USER MOD reduce.3.24.130724 H: found=0, std=0, add=952, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 62 THR OG1 : rot 180:sc= -0.335 USER MOD Set 1.2: B 64 GLN : amide:sc= 0.0586 K(o=-4.2,f=-6.6!) USER MOD Set 1.3: B 78 ASN : amide:sc= -3.9 K(o=-4.2,f=-6.6!) USER MOD Set 2.1: A 62 THR OG1 : rot 180:sc= -0.344 USER MOD Set 2.2: A 64 GLN : amide:sc= 0.0479 K(o=-4.3,f=-6.5!) USER MOD Set 2.3: A 78 ASN : amide:sc= -4 K(o=-4.3,f=-6.5!) USER MOD Single : A 32 SER OG : rot 180:sc= 0.0218 USER MOD Single : A 37 HIS : no HD1:sc= -0.0981 X(o=-0.098,f=-0.019) USER MOD Single : A 38 TYR OH : rot 180:sc= -0.0133 USER MOD Single : A 41 GLN : amide:sc= -1.16 X(o=-1.2,f=-1.2) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0.02) USER MOD Single : A 60 MET CE :methyl 147:sc= -1.89 (180deg=-4.65!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0416) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 95:sc= 0.749 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0.0234 USER MOD Single : B 37 HIS : no HD1:sc= -0.103 X(o=-0.1,f=-0.022) USER MOD Single : B 38 TYR OH : rot 180:sc= -0.0083 USER MOD Single : B 41 GLN : amide:sc= -1.26 X(o=-1.3,f=-1.3) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=0.018) USER MOD Single : B 60 MET CE :methyl 145:sc= -1.83 (180deg=-4.73!) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 68 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0436) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 94:sc= 0.735 USER MOD Single : B 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 31 4.320 0.415 2.703 1.00 0.00 N ATOM 2 CA ARG A 31 4.729 0.889 1.350 1.00 0.00 C ATOM 3 C ARG A 31 6.191 0.505 1.096 1.00 0.00 C ATOM 4 O ARG A 31 7.075 1.341 1.112 1.00 0.00 O ATOM 5 CB ARG A 31 4.572 2.410 1.274 1.00 0.00 C ATOM 6 CG ARG A 31 4.181 2.813 -0.149 1.00 0.00 C ATOM 7 CD ARG A 31 3.250 4.027 -0.098 1.00 0.00 C ATOM 8 NE ARG A 31 4.057 5.279 -0.228 1.00 0.00 N ATOM 9 CZ ARG A 31 3.563 6.453 0.114 1.00 0.00 C ATOM 10 NH1 ARG A 31 2.342 6.578 0.582 1.00 0.00 N ATOM 11 NH2 ARG A 31 4.307 7.518 -0.015 1.00 0.00 N ATOM 0 HA ARG A 31 4.098 0.424 0.593 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.811 2.743 1.980 1.00 0.00 H new ATOM 0 HB3 ARG A 31 5.505 2.897 1.558 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.073 3.049 -0.729 1.00 0.00 H new ATOM 0 HG3 ARG A 31 3.685 1.982 -0.651 1.00 0.00 H new ATOM 0 HD2 ARG A 31 2.516 3.970 -0.902 1.00 0.00 H new ATOM 0 HD3 ARG A 31 2.696 4.035 0.840 1.00 0.00 H new ATOM 0 HE ARG A 31 5.009 5.224 -0.589 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.750 5.754 0.689 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.986 7.499 0.839 1.00 0.00 H new ATOM 0 HH21 ARG A 31 5.257 7.436 -0.376 1.00 0.00 H new ATOM 0 HH22 ARG A 31 3.938 8.433 0.246 1.00 0.00 H new ATOM 27 N SER A 32 6.447 -0.757 0.864 1.00 0.00 N ATOM 28 CA SER A 32 7.845 -1.210 0.609 1.00 0.00 C ATOM 29 C SER A 32 8.400 -0.525 -0.643 1.00 0.00 C ATOM 30 O SER A 32 9.601 -0.429 -0.818 1.00 0.00 O ATOM 31 CB SER A 32 7.862 -2.724 0.404 1.00 0.00 C ATOM 32 OG SER A 32 6.965 -3.333 1.323 1.00 0.00 O ATOM 0 H SER A 32 5.744 -1.495 0.840 1.00 0.00 H new ATOM 0 HA SER A 32 8.464 -0.947 1.467 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.574 -2.967 -0.619 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.870 -3.111 0.552 1.00 0.00 H new ATOM 0 HG SER A 32 6.973 -4.304 1.193 1.00 0.00 H new ATOM 38 N ASP A 33 7.541 -0.049 -1.516 1.00 0.00 N ATOM 39 CA ASP A 33 8.028 0.625 -2.751 1.00 0.00 C ATOM 40 C ASP A 33 8.263 2.119 -2.494 1.00 0.00 C ATOM 41 O ASP A 33 8.429 2.886 -3.422 1.00 0.00 O ATOM 42 CB ASP A 33 6.998 0.464 -3.870 1.00 0.00 C ATOM 43 CG ASP A 33 6.628 -1.013 -4.024 1.00 0.00 C ATOM 44 OD1 ASP A 33 6.077 -1.567 -3.086 1.00 0.00 O ATOM 45 OD2 ASP A 33 6.902 -1.565 -5.077 1.00 0.00 O ATOM 0 H ASP A 33 6.527 -0.101 -1.422 1.00 0.00 H new ATOM 0 HA ASP A 33 8.970 0.163 -3.046 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.107 1.050 -3.644 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.402 0.847 -4.807 1.00 0.00 H new ATOM 50 N ALA A 34 8.290 2.540 -1.252 1.00 0.00 N ATOM 51 CA ALA A 34 8.532 3.976 -0.946 1.00 0.00 C ATOM 52 C ALA A 34 10.037 4.212 -0.738 1.00 0.00 C ATOM 53 O ALA A 34 10.506 5.334 -0.778 1.00 0.00 O ATOM 54 CB ALA A 34 7.774 4.356 0.328 1.00 0.00 C ATOM 0 H ALA A 34 8.153 1.943 -0.436 1.00 0.00 H new ATOM 0 HA ALA A 34 8.182 4.590 -1.776 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.949 5.408 0.555 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.707 4.189 0.180 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.125 3.742 1.157 1.00 0.00 H new ATOM 60 N GLU A 35 10.792 3.162 -0.514 1.00 0.00 N ATOM 61 CA GLU A 35 12.262 3.308 -0.299 1.00 0.00 C ATOM 62 C GLU A 35 12.940 4.036 -1.483 1.00 0.00 C ATOM 63 O GLU A 35 13.787 4.876 -1.255 1.00 0.00 O ATOM 64 CB GLU A 35 12.895 1.920 -0.125 1.00 0.00 C ATOM 65 CG GLU A 35 12.147 1.133 0.962 1.00 0.00 C ATOM 66 CD GLU A 35 12.998 1.063 2.233 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.045 2.052 2.945 1.00 0.00 O ATOM 68 OE2 GLU A 35 13.588 0.022 2.471 1.00 0.00 O ATOM 0 H GLU A 35 10.447 2.203 -0.471 1.00 0.00 H new ATOM 0 HA GLU A 35 12.413 3.907 0.599 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.861 1.375 -1.068 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.946 2.022 0.146 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.193 1.613 1.179 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.925 0.127 0.607 1.00 0.00 H new ATOM 75 N PRO A 36 12.580 3.707 -2.715 1.00 0.00 N ATOM 76 CA PRO A 36 13.184 4.339 -3.935 1.00 0.00 C ATOM 77 C PRO A 36 12.471 5.649 -4.289 1.00 0.00 C ATOM 78 O PRO A 36 13.099 6.627 -4.641 1.00 0.00 O ATOM 79 CB PRO A 36 12.965 3.291 -5.018 1.00 0.00 C ATOM 80 CG PRO A 36 11.785 2.437 -4.592 1.00 0.00 C ATOM 81 CD PRO A 36 11.539 2.689 -3.104 1.00 0.00 C ATOM 0 HA PRO A 36 14.233 4.603 -3.801 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.767 3.767 -5.978 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.857 2.677 -5.144 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.899 2.692 -5.174 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.992 1.382 -4.772 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.531 3.065 -2.927 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.644 1.772 -2.524 1.00 0.00 H new ATOM 89 N HIS A 37 11.159 5.667 -4.209 1.00 0.00 N ATOM 90 CA HIS A 37 10.369 6.900 -4.547 1.00 0.00 C ATOM 91 C HIS A 37 10.313 7.121 -6.069 1.00 0.00 C ATOM 92 O HIS A 37 9.696 8.062 -6.533 1.00 0.00 O ATOM 93 CB HIS A 37 10.976 8.138 -3.870 1.00 0.00 C ATOM 94 CG HIS A 37 9.923 9.204 -3.735 1.00 0.00 C ATOM 95 ND1 HIS A 37 10.105 10.488 -4.222 1.00 0.00 N ATOM 96 CD2 HIS A 37 8.672 9.190 -3.172 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.990 11.189 -3.945 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.084 10.445 -3.305 1.00 0.00 N ATOM 0 H HIS A 37 10.594 4.869 -3.920 1.00 0.00 H new ATOM 0 HA HIS A 37 9.355 6.752 -4.176 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.368 7.873 -2.888 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.814 8.512 -4.458 1.00 0.00 H new ATOM 0 HD2 HIS A 37 8.213 8.335 -2.698 1.00 0.00 H new ATOM 0 HE1 HIS A 37 8.845 12.226 -4.208 1.00 0.00 H new ATOM 0 HE2 HIS A 37 7.160 10.734 -2.983 1.00 0.00 H new ATOM 106 N TYR A 38 10.929 6.263 -6.852 1.00 0.00 N ATOM 107 CA TYR A 38 10.883 6.429 -8.338 1.00 0.00 C ATOM 108 C TYR A 38 10.228 5.188 -8.953 1.00 0.00 C ATOM 109 O TYR A 38 9.502 5.276 -9.923 1.00 0.00 O ATOM 110 CB TYR A 38 12.300 6.603 -8.900 1.00 0.00 C ATOM 111 CG TYR A 38 13.229 5.561 -8.321 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.314 4.293 -8.908 1.00 0.00 C ATOM 113 CD2 TYR A 38 14.010 5.866 -7.199 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.180 3.331 -8.374 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.876 4.905 -6.665 1.00 0.00 C ATOM 116 CZ TYR A 38 14.960 3.637 -7.252 1.00 0.00 C ATOM 117 OH TYR A 38 15.814 2.689 -6.725 1.00 0.00 O ATOM 0 H TYR A 38 11.460 5.457 -6.524 1.00 0.00 H new ATOM 0 HA TYR A 38 10.303 7.318 -8.586 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.280 6.518 -9.986 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.671 7.601 -8.665 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.712 4.057 -9.773 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.944 6.844 -6.745 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.246 2.353 -8.827 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.479 5.142 -5.801 1.00 0.00 H new ATOM 0 HH TYR A 38 16.281 3.065 -5.950 1.00 0.00 H new ATOM 127 N LEU A 39 10.470 4.034 -8.382 1.00 0.00 N ATOM 128 CA LEU A 39 9.861 2.772 -8.901 1.00 0.00 C ATOM 129 C LEU A 39 8.328 2.924 -9.052 1.00 0.00 C ATOM 130 O LEU A 39 7.793 2.612 -10.101 1.00 0.00 O ATOM 131 CB LEU A 39 10.174 1.628 -7.922 1.00 0.00 C ATOM 132 CG LEU A 39 10.871 0.469 -8.657 1.00 0.00 C ATOM 133 CD1 LEU A 39 10.003 -0.023 -9.821 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.221 0.947 -9.197 1.00 0.00 C ATOM 0 H LEU A 39 11.072 3.912 -7.568 1.00 0.00 H new ATOM 0 HA LEU A 39 10.281 2.552 -9.882 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.813 1.993 -7.118 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.252 1.273 -7.461 1.00 0.00 H new ATOM 0 HG LEU A 39 11.022 -0.352 -7.957 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.509 -0.843 -10.331 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.044 -0.371 -9.438 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.838 0.795 -10.523 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.716 0.127 -9.718 1.00 0.00 H new ATOM 0 HD22 LEU A 39 12.064 1.774 -9.889 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.846 1.281 -8.369 1.00 0.00 H new ATOM 146 N PRO A 40 7.653 3.397 -8.015 1.00 0.00 N ATOM 147 CA PRO A 40 6.164 3.589 -8.041 1.00 0.00 C ATOM 148 C PRO A 40 5.790 4.800 -8.905 1.00 0.00 C ATOM 149 O PRO A 40 4.671 4.921 -9.369 1.00 0.00 O ATOM 150 CB PRO A 40 5.792 3.792 -6.579 1.00 0.00 C ATOM 151 CG PRO A 40 7.036 4.278 -5.866 1.00 0.00 C ATOM 152 CD PRO A 40 8.240 3.817 -6.687 1.00 0.00 C ATOM 0 HA PRO A 40 5.630 2.746 -8.480 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.985 4.519 -6.484 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.435 2.861 -6.139 1.00 0.00 H new ATOM 0 HG2 PRO A 40 7.027 5.364 -5.774 1.00 0.00 H new ATOM 0 HG3 PRO A 40 7.082 3.873 -4.855 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.967 4.620 -6.810 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.758 2.989 -6.202 1.00 0.00 H new ATOM 160 N GLN A 41 6.727 5.684 -9.148 1.00 0.00 N ATOM 161 CA GLN A 41 6.437 6.863 -10.009 1.00 0.00 C ATOM 162 C GLN A 41 6.345 6.375 -11.457 1.00 0.00 C ATOM 163 O GLN A 41 5.569 6.874 -12.255 1.00 0.00 O ATOM 164 CB GLN A 41 7.577 7.882 -9.868 1.00 0.00 C ATOM 165 CG GLN A 41 7.315 9.096 -10.766 1.00 0.00 C ATOM 166 CD GLN A 41 6.053 9.820 -10.295 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.830 9.970 -9.110 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.209 10.277 -11.180 1.00 0.00 N ATOM 0 H GLN A 41 7.679 5.636 -8.785 1.00 0.00 H new ATOM 0 HA GLN A 41 5.502 7.340 -9.715 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.663 8.201 -8.829 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.525 7.418 -10.139 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.168 9.774 -10.736 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.198 8.777 -11.802 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.395 10.152 -12.175 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.363 10.760 -10.876 1.00 0.00 H new ATOM 177 N LEU A 42 7.139 5.395 -11.798 1.00 0.00 N ATOM 178 CA LEU A 42 7.119 4.861 -13.176 1.00 0.00 C ATOM 179 C LEU A 42 5.846 4.044 -13.382 1.00 0.00 C ATOM 180 O LEU A 42 5.082 4.307 -14.281 1.00 0.00 O ATOM 181 CB LEU A 42 8.346 3.958 -13.403 1.00 0.00 C ATOM 182 CG LEU A 42 9.709 4.723 -13.348 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.574 6.205 -12.947 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.632 4.030 -12.341 1.00 0.00 C ATOM 0 H LEU A 42 7.804 4.943 -11.170 1.00 0.00 H new ATOM 0 HA LEU A 42 7.145 5.689 -13.884 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.351 3.171 -12.649 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.252 3.470 -14.373 1.00 0.00 H new ATOM 0 HG LEU A 42 10.117 4.700 -14.358 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.560 6.669 -12.931 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.942 6.721 -13.670 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.124 6.274 -11.957 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.585 4.558 -12.297 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.167 4.039 -11.355 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.802 3.000 -12.653 1.00 0.00 H new ATOM 196 N ARG A 43 5.609 3.050 -12.555 1.00 0.00 N ATOM 197 CA ARG A 43 4.381 2.201 -12.710 1.00 0.00 C ATOM 198 C ARG A 43 3.133 3.077 -12.884 1.00 0.00 C ATOM 199 O ARG A 43 2.307 2.827 -13.749 1.00 0.00 O ATOM 200 CB ARG A 43 4.226 1.284 -11.486 1.00 0.00 C ATOM 201 CG ARG A 43 3.885 2.092 -10.231 1.00 0.00 C ATOM 202 CD ARG A 43 3.835 1.157 -9.021 1.00 0.00 C ATOM 203 NE ARG A 43 3.328 1.908 -7.832 1.00 0.00 N ATOM 204 CZ ARG A 43 3.462 1.432 -6.609 1.00 0.00 C ATOM 205 NH1 ARG A 43 4.045 0.277 -6.381 1.00 0.00 N ATOM 206 NH2 ARG A 43 3.003 2.124 -5.603 1.00 0.00 N ATOM 0 H ARG A 43 6.215 2.790 -11.777 1.00 0.00 H new ATOM 0 HA ARG A 43 4.490 1.587 -13.604 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.442 0.551 -11.674 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.150 0.729 -11.325 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.632 2.870 -10.072 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.925 2.593 -10.357 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.186 0.307 -9.231 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.828 0.757 -8.816 1.00 0.00 H new ATOM 0 HE ARG A 43 2.868 2.808 -7.969 1.00 0.00 H new ATOM 0 HH11 ARG A 43 4.407 -0.274 -7.159 1.00 0.00 H new ATOM 0 HH12 ARG A 43 4.136 -0.069 -5.426 1.00 0.00 H new ATOM 0 HH21 ARG A 43 2.547 3.022 -5.767 1.00 0.00 H new ATOM 0 HH22 ARG A 43 3.100 1.768 -4.652 1.00 0.00 H new ATOM 220 N LYS A 44 2.995 4.110 -12.088 1.00 0.00 N ATOM 221 CA LYS A 44 1.814 4.984 -12.238 1.00 0.00 C ATOM 222 C LYS A 44 1.896 5.687 -13.597 1.00 0.00 C ATOM 223 O LYS A 44 0.888 5.993 -14.199 1.00 0.00 O ATOM 224 CB LYS A 44 1.752 6.006 -11.093 1.00 0.00 C ATOM 225 CG LYS A 44 2.938 6.967 -11.163 1.00 0.00 C ATOM 226 CD LYS A 44 2.796 8.042 -10.083 1.00 0.00 C ATOM 227 CE LYS A 44 3.039 7.424 -8.703 1.00 0.00 C ATOM 228 NZ LYS A 44 2.081 8.009 -7.722 1.00 0.00 N ATOM 0 H LYS A 44 3.648 4.375 -11.351 1.00 0.00 H new ATOM 0 HA LYS A 44 0.903 4.387 -12.193 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.819 6.567 -11.149 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.754 5.487 -10.135 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.870 6.420 -11.024 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.984 7.431 -12.148 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.509 8.847 -10.262 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.800 8.483 -10.124 1.00 0.00 H new ATOM 0 HE2 LYS A 44 2.913 6.342 -8.750 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.064 7.612 -8.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 2.245 7.590 -6.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 2.222 9.038 -7.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.107 7.807 -8.026 1.00 0.00 H new ATOM 242 N ASP A 45 3.095 5.926 -14.095 1.00 0.00 N ATOM 243 CA ASP A 45 3.225 6.587 -15.420 1.00 0.00 C ATOM 244 C ASP A 45 2.615 5.683 -16.496 1.00 0.00 C ATOM 245 O ASP A 45 1.831 6.134 -17.304 1.00 0.00 O ATOM 246 CB ASP A 45 4.696 6.856 -15.744 1.00 0.00 C ATOM 247 CG ASP A 45 5.259 7.888 -14.766 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.516 8.776 -14.382 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.422 7.772 -14.418 1.00 0.00 O ATOM 0 H ASP A 45 3.975 5.690 -13.637 1.00 0.00 H new ATOM 0 HA ASP A 45 2.697 7.540 -15.395 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.268 5.930 -15.680 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.792 7.220 -16.767 1.00 0.00 H new ATOM 254 N ILE A 46 2.955 4.407 -16.511 1.00 0.00 N ATOM 255 CA ILE A 46 2.373 3.490 -17.544 1.00 0.00 C ATOM 256 C ILE A 46 0.839 3.528 -17.455 1.00 0.00 C ATOM 257 O ILE A 46 0.152 3.451 -18.456 1.00 0.00 O ATOM 258 CB ILE A 46 2.927 2.055 -17.364 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.879 1.349 -18.719 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.134 1.236 -16.333 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.864 2.012 -19.681 1.00 0.00 C ATOM 0 H ILE A 46 3.604 3.969 -15.857 1.00 0.00 H new ATOM 0 HA ILE A 46 2.664 3.825 -18.540 1.00 0.00 H new ATOM 0 HB ILE A 46 3.948 2.132 -16.990 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.127 0.294 -18.599 1.00 0.00 H new ATOM 0 HG13 ILE A 46 1.870 1.395 -19.128 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.567 0.239 -16.249 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.176 1.733 -15.364 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.096 1.154 -16.654 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.827 1.506 -20.646 1.00 0.00 H new ATOM 0 HD12 ILE A 46 3.596 3.061 -19.811 1.00 0.00 H new ATOM 0 HD13 ILE A 46 4.873 1.943 -19.274 1.00 0.00 H new ATOM 273 N LEU A 47 0.300 3.672 -16.263 1.00 0.00 N ATOM 274 CA LEU A 47 -1.181 3.744 -16.116 1.00 0.00 C ATOM 275 C LEU A 47 -1.695 4.953 -16.903 1.00 0.00 C ATOM 276 O LEU A 47 -2.622 4.855 -17.688 1.00 0.00 O ATOM 277 CB LEU A 47 -1.541 3.905 -14.638 1.00 0.00 C ATOM 278 CG LEU A 47 -1.491 2.544 -13.942 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.486 2.745 -12.425 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.719 1.725 -14.343 1.00 0.00 C ATOM 0 H LEU A 47 0.826 3.742 -15.392 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.637 2.831 -16.498 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.847 4.595 -14.158 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.537 4.337 -14.542 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.586 2.016 -14.240 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.450 1.775 -11.930 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.613 3.331 -12.139 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.391 3.273 -12.125 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.686 0.754 -13.848 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.623 2.255 -14.043 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.724 1.582 -15.424 1.00 0.00 H new ATOM 292 N GLU A 48 -1.072 6.090 -16.714 1.00 0.00 N ATOM 293 CA GLU A 48 -1.489 7.308 -17.459 1.00 0.00 C ATOM 294 C GLU A 48 -1.124 7.114 -18.919 1.00 0.00 C ATOM 295 O GLU A 48 -1.840 7.528 -19.812 1.00 0.00 O ATOM 296 CB GLU A 48 -0.756 8.552 -16.942 1.00 0.00 C ATOM 297 CG GLU A 48 -0.717 8.573 -15.414 1.00 0.00 C ATOM 298 CD GLU A 48 -2.141 8.560 -14.847 1.00 0.00 C ATOM 299 OE1 GLU A 48 -2.691 9.632 -14.658 1.00 0.00 O ATOM 300 OE2 GLU A 48 -2.654 7.478 -14.613 1.00 0.00 O ATOM 0 H GLU A 48 -0.290 6.223 -16.072 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.561 7.454 -17.326 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.261 8.568 -17.335 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.254 9.450 -17.308 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.163 7.710 -15.045 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.189 9.462 -15.069 1.00 0.00 H new ATOM 307 N VAL A 49 -0.004 6.480 -19.167 1.00 0.00 N ATOM 308 CA VAL A 49 0.429 6.246 -20.569 1.00 0.00 C ATOM 309 C VAL A 49 -0.647 5.421 -21.276 1.00 0.00 C ATOM 310 O VAL A 49 -1.206 5.842 -22.265 1.00 0.00 O ATOM 311 CB VAL A 49 1.770 5.498 -20.588 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.220 5.279 -22.037 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.830 6.324 -19.846 1.00 0.00 C ATOM 0 H VAL A 49 0.627 6.116 -18.453 1.00 0.00 H new ATOM 0 HA VAL A 49 0.562 7.198 -21.083 1.00 0.00 H new ATOM 0 HB VAL A 49 1.649 4.533 -20.096 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.172 4.748 -22.046 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.471 4.690 -22.566 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.338 6.243 -22.531 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.781 5.792 -19.860 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.947 7.290 -20.336 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.515 6.477 -18.814 1.00 0.00 H new ATOM 323 N ILE A 50 -0.977 4.263 -20.747 1.00 0.00 N ATOM 324 CA ILE A 50 -2.056 3.430 -21.371 1.00 0.00 C ATOM 325 C ILE A 50 -3.327 4.282 -21.496 1.00 0.00 C ATOM 326 O ILE A 50 -4.158 4.051 -22.352 1.00 0.00 O ATOM 327 CB ILE A 50 -2.331 2.199 -20.499 1.00 0.00 C ATOM 328 CG1 ILE A 50 -1.041 1.391 -20.337 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.393 1.321 -21.166 1.00 0.00 C ATOM 330 CD1 ILE A 50 -1.059 0.668 -18.989 1.00 0.00 C ATOM 0 H ILE A 50 -0.547 3.861 -19.914 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.742 3.093 -22.359 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.688 2.524 -19.522 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.947 0.669 -21.148 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.176 2.051 -20.396 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.586 0.447 -20.544 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.314 1.892 -21.286 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.036 0.998 -22.144 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.141 0.092 -18.873 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.133 1.400 -18.185 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.916 -0.004 -18.948 1.00 0.00 H new ATOM 342 N CYS A 51 -3.466 5.280 -20.653 1.00 0.00 N ATOM 343 CA CYS A 51 -4.655 6.167 -20.723 1.00 0.00 C ATOM 344 C CYS A 51 -4.525 7.091 -21.942 1.00 0.00 C ATOM 345 O CYS A 51 -5.451 7.259 -22.707 1.00 0.00 O ATOM 346 CB CYS A 51 -4.736 7.010 -19.446 1.00 0.00 C ATOM 347 SG CYS A 51 -6.417 7.653 -19.254 1.00 0.00 S ATOM 0 H CYS A 51 -2.798 5.513 -19.918 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.559 5.565 -20.817 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.465 6.405 -18.580 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.023 7.833 -19.495 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.487 8.367 -18.170 1.00 0.00 H new ATOM 353 N LYS A 52 -3.376 7.691 -22.124 1.00 0.00 N ATOM 354 CA LYS A 52 -3.175 8.615 -23.289 1.00 0.00 C ATOM 355 C LYS A 52 -3.477 7.890 -24.603 1.00 0.00 C ATOM 356 O LYS A 52 -3.928 8.486 -25.563 1.00 0.00 O ATOM 357 CB LYS A 52 -1.720 9.094 -23.332 1.00 0.00 C ATOM 358 CG LYS A 52 -1.351 9.804 -22.031 1.00 0.00 C ATOM 359 CD LYS A 52 0.172 9.798 -21.874 1.00 0.00 C ATOM 360 CE LYS A 52 0.747 11.107 -22.417 1.00 0.00 C ATOM 361 NZ LYS A 52 0.606 12.176 -21.388 1.00 0.00 N ATOM 0 H LYS A 52 -2.564 7.582 -21.516 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.850 9.463 -23.169 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.056 8.244 -23.490 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.579 9.770 -24.175 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.724 10.828 -22.042 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.819 9.303 -21.183 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.439 9.679 -20.824 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.600 8.951 -22.410 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.797 10.975 -22.678 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.225 11.395 -23.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.997 13.066 -21.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.400 12.308 -21.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.123 11.901 -20.528 1.00 0.00 H new ATOM 375 N TYR A 53 -3.207 6.613 -24.655 1.00 0.00 N ATOM 376 CA TYR A 53 -3.441 5.839 -25.899 1.00 0.00 C ATOM 377 C TYR A 53 -4.727 5.003 -25.773 1.00 0.00 C ATOM 378 O TYR A 53 -5.251 4.518 -26.758 1.00 0.00 O ATOM 379 CB TYR A 53 -2.254 4.896 -26.116 1.00 0.00 C ATOM 380 CG TYR A 53 -0.968 5.677 -26.308 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.429 6.422 -25.249 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.299 5.637 -27.537 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.766 7.125 -25.416 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.902 6.340 -27.704 1.00 0.00 C ATOM 385 CZ TYR A 53 1.434 7.084 -26.641 1.00 0.00 C ATOM 386 OH TYR A 53 2.616 7.775 -26.806 1.00 0.00 O ATOM 0 H TYR A 53 -2.830 6.071 -23.877 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.546 6.526 -26.739 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.154 4.228 -25.260 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.437 4.270 -26.989 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.941 6.452 -24.299 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.708 5.065 -28.356 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.173 7.700 -24.598 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.418 6.309 -28.652 1.00 0.00 H new ATOM 0 HH TYR A 53 2.950 7.639 -27.717 1.00 0.00 H new ATOM 396 N VAL A 54 -5.232 4.815 -24.573 1.00 0.00 N ATOM 397 CA VAL A 54 -6.473 3.991 -24.389 1.00 0.00 C ATOM 398 C VAL A 54 -7.203 4.494 -23.121 1.00 0.00 C ATOM 399 O VAL A 54 -7.285 5.686 -22.903 1.00 0.00 O ATOM 400 CB VAL A 54 -6.112 2.489 -24.257 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.319 1.644 -24.669 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.928 2.120 -25.162 1.00 0.00 C ATOM 0 H VAL A 54 -4.838 5.197 -23.713 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.125 4.096 -25.256 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.837 2.296 -23.220 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.071 0.587 -24.578 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.164 1.876 -24.020 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.584 1.867 -25.703 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.699 1.061 -25.047 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.186 2.325 -26.201 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.057 2.712 -24.881 1.00 0.00 H new ATOM 412 N GLN A 55 -7.735 3.624 -22.282 1.00 0.00 N ATOM 413 CA GLN A 55 -8.434 4.102 -21.052 1.00 0.00 C ATOM 414 C GLN A 55 -8.698 2.916 -20.125 1.00 0.00 C ATOM 415 O GLN A 55 -9.491 2.043 -20.421 1.00 0.00 O ATOM 416 CB GLN A 55 -9.759 4.767 -21.438 1.00 0.00 C ATOM 417 CG GLN A 55 -9.652 6.281 -21.244 1.00 0.00 C ATOM 418 CD GLN A 55 -10.505 6.993 -22.296 1.00 0.00 C ATOM 419 OE1 GLN A 55 -10.082 7.168 -23.421 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.699 7.415 -21.975 1.00 0.00 N ATOM 0 H GLN A 55 -7.712 2.611 -22.402 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.808 4.830 -20.536 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -10.002 4.540 -22.476 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.569 4.369 -20.827 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.987 6.554 -20.243 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.612 6.597 -21.330 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -12.055 7.268 -21.030 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.275 7.891 -22.669 1.00 0.00 H new ATOM 429 N ILE A 56 -8.031 2.887 -19.005 1.00 0.00 N ATOM 430 CA ILE A 56 -8.219 1.768 -18.033 1.00 0.00 C ATOM 431 C ILE A 56 -8.209 2.331 -16.613 1.00 0.00 C ATOM 432 O ILE A 56 -7.859 3.476 -16.394 1.00 0.00 O ATOM 433 CB ILE A 56 -7.082 0.745 -18.172 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.745 1.467 -18.400 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.371 -0.186 -19.352 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.639 0.756 -17.618 1.00 0.00 C ATOM 0 H ILE A 56 -7.357 3.596 -18.717 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.170 1.276 -18.238 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.017 0.161 -17.254 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.503 1.479 -19.463 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.821 2.506 -18.079 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.563 -0.911 -19.449 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.311 -0.710 -19.180 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.445 0.400 -20.268 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.691 1.269 -17.780 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.880 0.767 -16.555 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.557 -0.276 -17.961 1.00 0.00 H new ATOM 448 N ASP A 57 -8.580 1.532 -15.649 1.00 0.00 N ATOM 449 CA ASP A 57 -8.583 2.008 -14.237 1.00 0.00 C ATOM 450 C ASP A 57 -7.369 1.412 -13.513 1.00 0.00 C ATOM 451 O ASP A 57 -6.786 0.459 -13.992 1.00 0.00 O ATOM 452 CB ASP A 57 -9.869 1.549 -13.546 1.00 0.00 C ATOM 453 CG ASP A 57 -10.986 2.557 -13.824 1.00 0.00 C ATOM 454 OD1 ASP A 57 -10.693 3.741 -13.860 1.00 0.00 O ATOM 455 OD2 ASP A 57 -12.115 2.128 -13.996 1.00 0.00 O ATOM 0 H ASP A 57 -8.882 0.567 -15.780 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.532 3.097 -14.211 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.157 0.562 -13.909 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.705 1.459 -12.472 1.00 0.00 H new ATOM 460 N PRO A 58 -7.013 1.972 -12.375 1.00 0.00 N ATOM 461 CA PRO A 58 -5.848 1.486 -11.566 1.00 0.00 C ATOM 462 C PRO A 58 -6.215 0.173 -10.883 1.00 0.00 C ATOM 463 O PRO A 58 -5.381 -0.693 -10.696 1.00 0.00 O ATOM 464 CB PRO A 58 -5.604 2.603 -10.563 1.00 0.00 C ATOM 465 CG PRO A 58 -6.910 3.360 -10.421 1.00 0.00 C ATOM 466 CD PRO A 58 -7.699 3.144 -11.714 1.00 0.00 C ATOM 0 HA PRO A 58 -4.956 1.280 -12.157 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.287 2.197 -9.603 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.809 3.265 -10.908 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.473 2.998 -9.561 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.724 4.421 -10.256 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.748 2.928 -11.509 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.674 4.030 -12.349 1.00 0.00 H new ATOM 474 N GLU A 59 -7.468 0.007 -10.550 1.00 0.00 N ATOM 475 CA GLU A 59 -7.910 -1.266 -9.919 1.00 0.00 C ATOM 476 C GLU A 59 -7.800 -2.404 -10.949 1.00 0.00 C ATOM 477 O GLU A 59 -7.870 -3.567 -10.601 1.00 0.00 O ATOM 478 CB GLU A 59 -9.364 -1.130 -9.460 1.00 0.00 C ATOM 479 CG GLU A 59 -9.415 -0.340 -8.150 1.00 0.00 C ATOM 480 CD GLU A 59 -10.743 -0.611 -7.442 1.00 0.00 C ATOM 481 OE1 GLU A 59 -11.051 -1.772 -7.229 1.00 0.00 O ATOM 482 OE2 GLU A 59 -11.428 0.347 -7.124 1.00 0.00 O ATOM 0 H GLU A 59 -8.203 0.700 -10.689 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.279 -1.488 -9.058 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.952 -0.624 -10.225 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.806 -2.117 -9.319 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.583 -0.627 -7.507 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.309 0.726 -8.351 1.00 0.00 H new ATOM 489 N MET A 60 -7.624 -2.079 -12.216 1.00 0.00 N ATOM 490 CA MET A 60 -7.505 -3.134 -13.257 1.00 0.00 C ATOM 491 C MET A 60 -6.033 -3.526 -13.422 1.00 0.00 C ATOM 492 O MET A 60 -5.722 -4.622 -13.848 1.00 0.00 O ATOM 493 CB MET A 60 -8.038 -2.588 -14.585 1.00 0.00 C ATOM 494 CG MET A 60 -9.575 -2.571 -14.564 1.00 0.00 C ATOM 495 SD MET A 60 -10.227 -3.898 -15.615 1.00 0.00 S ATOM 496 CE MET A 60 -9.936 -3.086 -17.205 1.00 0.00 C ATOM 0 H MET A 60 -7.559 -1.122 -12.564 1.00 0.00 H new ATOM 0 HA MET A 60 -8.081 -4.010 -12.960 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.657 -1.581 -14.753 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.684 -3.205 -15.411 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.934 -2.696 -13.542 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.941 -1.606 -14.915 1.00 0.00 H new ATOM 0 HE1 MET A 60 -9.698 -3.837 -17.959 1.00 0.00 H new ATOM 0 HE2 MET A 60 -10.832 -2.542 -17.505 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.103 -2.389 -17.111 1.00 0.00 H new ATOM 506 N VAL A 61 -5.127 -2.636 -13.091 1.00 0.00 N ATOM 507 CA VAL A 61 -3.676 -2.949 -13.231 1.00 0.00 C ATOM 508 C VAL A 61 -3.119 -3.410 -11.882 1.00 0.00 C ATOM 509 O VAL A 61 -3.212 -2.708 -10.893 1.00 0.00 O ATOM 510 CB VAL A 61 -2.927 -1.696 -13.688 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.472 -2.050 -13.995 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.591 -1.136 -14.949 1.00 0.00 C ATOM 0 H VAL A 61 -5.334 -1.705 -12.729 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.546 -3.742 -13.968 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.958 -0.948 -12.896 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.941 -1.156 -14.320 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.997 -2.448 -13.098 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.439 -2.799 -14.786 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.058 -0.243 -15.275 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.561 -1.886 -15.740 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.628 -0.880 -14.731 1.00 0.00 H new ATOM 522 N THR A 62 -2.543 -4.587 -11.835 1.00 0.00 N ATOM 523 CA THR A 62 -1.981 -5.099 -10.556 1.00 0.00 C ATOM 524 C THR A 62 -0.497 -4.745 -10.468 1.00 0.00 C ATOM 525 O THR A 62 0.150 -4.487 -11.466 1.00 0.00 O ATOM 526 CB THR A 62 -2.137 -6.621 -10.492 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.398 -6.989 -11.033 1.00 0.00 O ATOM 528 CG2 THR A 62 -2.052 -7.081 -9.037 1.00 0.00 C ATOM 0 H THR A 62 -2.440 -5.214 -12.633 1.00 0.00 H new ATOM 0 HA THR A 62 -2.518 -4.642 -9.725 1.00 0.00 H new ATOM 0 HB THR A 62 -1.342 -7.094 -11.069 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.499 -7.963 -10.994 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.163 -8.164 -8.991 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.085 -6.797 -8.622 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.847 -6.610 -8.459 1.00 0.00 H new ATOM 536 N VAL A 63 0.046 -4.739 -9.279 1.00 0.00 N ATOM 537 CA VAL A 63 1.490 -4.415 -9.107 1.00 0.00 C ATOM 538 C VAL A 63 2.076 -5.328 -8.032 1.00 0.00 C ATOM 539 O VAL A 63 1.537 -5.443 -6.946 1.00 0.00 O ATOM 540 CB VAL A 63 1.635 -2.957 -8.678 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.117 -2.580 -8.626 1.00 0.00 C ATOM 542 CG2 VAL A 63 0.919 -2.060 -9.686 1.00 0.00 C ATOM 0 H VAL A 63 -0.454 -4.946 -8.414 1.00 0.00 H new ATOM 0 HA VAL A 63 2.020 -4.566 -10.047 1.00 0.00 H new ATOM 0 HB VAL A 63 1.194 -2.825 -7.690 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.217 -1.539 -8.320 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.630 -3.220 -7.909 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.561 -2.712 -9.613 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.021 -1.018 -9.382 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.362 -2.195 -10.673 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.137 -2.326 -9.723 1.00 0.00 H new ATOM 552 N GLN A 64 3.165 -5.985 -8.329 1.00 0.00 N ATOM 553 CA GLN A 64 3.783 -6.903 -7.332 1.00 0.00 C ATOM 554 C GLN A 64 5.306 -6.837 -7.446 1.00 0.00 C ATOM 555 O GLN A 64 5.853 -6.843 -8.530 1.00 0.00 O ATOM 556 CB GLN A 64 3.297 -8.332 -7.598 1.00 0.00 C ATOM 557 CG GLN A 64 3.537 -8.703 -9.069 1.00 0.00 C ATOM 558 CD GLN A 64 2.212 -8.660 -9.837 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.750 -7.602 -10.216 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.577 -9.774 -10.082 1.00 0.00 N ATOM 0 H GLN A 64 3.654 -5.924 -9.222 1.00 0.00 H new ATOM 0 HA GLN A 64 3.493 -6.603 -6.325 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.823 -9.031 -6.948 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.236 -8.414 -7.362 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.250 -8.011 -9.517 1.00 0.00 H new ATOM 0 HG3 GLN A 64 3.975 -9.699 -9.136 1.00 0.00 H new ATOM 0 HE21 GLN A 64 1.964 -10.662 -9.764 1.00 0.00 H new ATOM 0 HE22 GLN A 64 0.693 -9.756 -10.591 1.00 0.00 H new ATOM 569 N LEU A 65 5.994 -6.758 -6.333 1.00 0.00 N ATOM 570 CA LEU A 65 7.475 -6.675 -6.372 1.00 0.00 C ATOM 571 C LEU A 65 8.095 -7.982 -5.882 1.00 0.00 C ATOM 572 O LEU A 65 7.563 -8.652 -5.017 1.00 0.00 O ATOM 573 CB LEU A 65 7.935 -5.529 -5.476 1.00 0.00 C ATOM 574 CG LEU A 65 7.346 -5.698 -4.070 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.410 -5.353 -3.025 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.146 -4.761 -3.902 1.00 0.00 C ATOM 0 H LEU A 65 5.585 -6.748 -5.398 1.00 0.00 H new ATOM 0 HA LEU A 65 7.794 -6.499 -7.399 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.024 -5.511 -5.424 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.620 -4.575 -5.900 1.00 0.00 H new ATOM 0 HG LEU A 65 7.024 -6.730 -3.934 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.991 -5.473 -2.026 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.265 -6.019 -3.143 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.733 -4.321 -3.161 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.728 -4.881 -2.903 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.468 -3.729 -4.039 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.387 -5.005 -4.645 1.00 0.00 H new ATOM 588 N GLU A 66 9.228 -8.335 -6.428 1.00 0.00 N ATOM 589 CA GLU A 66 9.919 -9.587 -6.009 1.00 0.00 C ATOM 590 C GLU A 66 11.420 -9.308 -5.915 1.00 0.00 C ATOM 591 O GLU A 66 11.873 -8.226 -6.235 1.00 0.00 O ATOM 592 CB GLU A 66 9.659 -10.692 -7.044 1.00 0.00 C ATOM 593 CG GLU A 66 8.235 -11.237 -6.898 1.00 0.00 C ATOM 594 CD GLU A 66 8.027 -11.811 -5.491 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.669 -12.799 -5.175 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.229 -11.252 -4.756 1.00 0.00 O ATOM 0 H GLU A 66 9.708 -7.803 -7.154 1.00 0.00 H new ATOM 0 HA GLU A 66 9.541 -9.916 -5.041 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.803 -10.298 -8.050 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.379 -11.499 -6.912 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.513 -10.442 -7.084 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.056 -12.011 -7.644 1.00 0.00 H new ATOM 603 N GLN A 67 12.192 -10.267 -5.473 1.00 0.00 N ATOM 604 CA GLN A 67 13.666 -10.049 -5.353 1.00 0.00 C ATOM 605 C GLN A 67 14.404 -11.361 -5.625 1.00 0.00 C ATOM 606 O GLN A 67 13.850 -12.435 -5.483 1.00 0.00 O ATOM 607 CB GLN A 67 13.995 -9.570 -3.936 1.00 0.00 C ATOM 608 CG GLN A 67 13.916 -8.042 -3.876 1.00 0.00 C ATOM 609 CD GLN A 67 13.833 -7.592 -2.417 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.826 -7.574 -1.717 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.681 -7.228 -1.923 1.00 0.00 N ATOM 0 H GLN A 67 11.866 -11.191 -5.190 1.00 0.00 H new ATOM 0 HA GLN A 67 13.980 -9.298 -6.078 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.297 -10.008 -3.223 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.993 -9.904 -3.652 1.00 0.00 H new ATOM 0 HG2 GLN A 67 14.792 -7.603 -4.354 1.00 0.00 H new ATOM 0 HG3 GLN A 67 13.043 -7.691 -4.426 1.00 0.00 H new ATOM 0 HE21 GLN A 67 11.847 -7.243 -2.510 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.615 -6.929 -0.950 1.00 0.00 H new ATOM 620 N LYS A 68 15.654 -11.280 -6.012 1.00 0.00 N ATOM 621 CA LYS A 68 16.438 -12.519 -6.289 1.00 0.00 C ATOM 622 C LYS A 68 17.511 -12.693 -5.212 1.00 0.00 C ATOM 623 O LYS A 68 17.691 -11.840 -4.362 1.00 0.00 O ATOM 624 CB LYS A 68 17.111 -12.413 -7.658 1.00 0.00 C ATOM 625 CG LYS A 68 16.110 -12.783 -8.761 1.00 0.00 C ATOM 626 CD LYS A 68 16.214 -11.782 -9.916 1.00 0.00 C ATOM 627 CE LYS A 68 17.600 -11.874 -10.557 1.00 0.00 C ATOM 628 NZ LYS A 68 17.668 -13.085 -11.424 1.00 0.00 N ATOM 0 H LYS A 68 16.164 -10.407 -6.147 1.00 0.00 H new ATOM 0 HA LYS A 68 15.766 -13.377 -6.283 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.480 -11.399 -7.814 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.975 -13.077 -7.701 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.311 -13.791 -9.123 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.097 -12.784 -8.359 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.445 -11.989 -10.660 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.039 -10.770 -9.550 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.799 -10.980 -11.147 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.367 -11.924 -9.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.557 -13.076 -11.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.631 -13.939 -10.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.863 -13.086 -12.083 1.00 0.00 H new ATOM 642 N ASP A 69 18.223 -13.790 -5.243 1.00 0.00 N ATOM 643 CA ASP A 69 19.284 -14.032 -4.227 1.00 0.00 C ATOM 644 C ASP A 69 20.564 -13.260 -4.589 1.00 0.00 C ATOM 645 O ASP A 69 21.499 -13.215 -3.812 1.00 0.00 O ATOM 646 CB ASP A 69 19.596 -15.528 -4.166 1.00 0.00 C ATOM 647 CG ASP A 69 18.314 -16.305 -3.859 1.00 0.00 C ATOM 648 OD1 ASP A 69 17.562 -16.557 -4.786 1.00 0.00 O ATOM 649 OD2 ASP A 69 18.107 -16.635 -2.703 1.00 0.00 O ATOM 0 H ASP A 69 18.112 -14.532 -5.934 1.00 0.00 H new ATOM 0 HA ASP A 69 18.927 -13.686 -3.257 1.00 0.00 H new ATOM 0 HB2 ASP A 69 20.018 -15.861 -5.114 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.345 -15.723 -3.398 1.00 0.00 H new ATOM 654 N GLY A 70 20.622 -12.659 -5.757 1.00 0.00 N ATOM 655 CA GLY A 70 21.849 -11.904 -6.155 1.00 0.00 C ATOM 656 C GLY A 70 21.662 -10.412 -5.866 1.00 0.00 C ATOM 657 O GLY A 70 22.192 -9.569 -6.565 1.00 0.00 O ATOM 0 H GLY A 70 19.872 -12.661 -6.448 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.713 -12.283 -5.609 1.00 0.00 H new ATOM 0 HA3 GLY A 70 22.051 -12.055 -7.215 1.00 0.00 H new ATOM 661 N ASP A 71 20.907 -10.082 -4.847 1.00 0.00 N ATOM 662 CA ASP A 71 20.674 -8.645 -4.501 1.00 0.00 C ATOM 663 C ASP A 71 20.019 -7.935 -5.687 1.00 0.00 C ATOM 664 O ASP A 71 20.460 -6.887 -6.124 1.00 0.00 O ATOM 665 CB ASP A 71 22.006 -7.969 -4.159 1.00 0.00 C ATOM 666 CG ASP A 71 22.395 -8.312 -2.720 1.00 0.00 C ATOM 667 OD1 ASP A 71 21.820 -7.726 -1.816 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.262 -9.151 -2.544 1.00 0.00 O ATOM 0 H ASP A 71 20.439 -10.751 -4.236 1.00 0.00 H new ATOM 0 HA ASP A 71 20.015 -8.584 -3.635 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.783 -8.303 -4.847 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.919 -6.889 -4.276 1.00 0.00 H new ATOM 673 N ILE A 72 18.975 -8.513 -6.214 1.00 0.00 N ATOM 674 CA ILE A 72 18.280 -7.903 -7.381 1.00 0.00 C ATOM 675 C ILE A 72 16.784 -7.794 -7.077 1.00 0.00 C ATOM 676 O ILE A 72 16.275 -8.459 -6.193 1.00 0.00 O ATOM 677 CB ILE A 72 18.500 -8.784 -8.615 1.00 0.00 C ATOM 678 CG1 ILE A 72 19.996 -9.154 -8.710 1.00 0.00 C ATOM 679 CG2 ILE A 72 18.050 -8.019 -9.862 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.305 -9.879 -10.029 1.00 0.00 C ATOM 0 H ILE A 72 18.571 -9.389 -5.883 1.00 0.00 H new ATOM 0 HA ILE A 72 18.680 -6.908 -7.574 1.00 0.00 H new ATOM 0 HB ILE A 72 17.916 -9.701 -8.537 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.602 -8.251 -8.637 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.270 -9.791 -7.869 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.204 -8.640 -10.745 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.993 -7.769 -9.774 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.633 -7.103 -9.957 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.366 -10.127 -10.068 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.716 -10.794 -10.088 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.053 -9.231 -10.868 1.00 0.00 H new ATOM 692 N SER A 73 16.079 -6.960 -7.799 1.00 0.00 N ATOM 693 CA SER A 73 14.616 -6.802 -7.554 1.00 0.00 C ATOM 694 C SER A 73 13.841 -7.220 -8.802 1.00 0.00 C ATOM 695 O SER A 73 14.398 -7.360 -9.874 1.00 0.00 O ATOM 696 CB SER A 73 14.309 -5.342 -7.225 1.00 0.00 C ATOM 697 OG SER A 73 14.643 -5.086 -5.867 1.00 0.00 O ATOM 0 H SER A 73 16.456 -6.381 -8.549 1.00 0.00 H new ATOM 0 HA SER A 73 14.318 -7.432 -6.716 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.876 -4.682 -7.882 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.253 -5.133 -7.398 1.00 0.00 H new ATOM 0 HG SER A 73 14.449 -4.150 -5.653 1.00 0.00 H new ATOM 703 N ILE A 74 12.561 -7.428 -8.661 1.00 0.00 N ATOM 704 CA ILE A 74 11.726 -7.852 -9.819 1.00 0.00 C ATOM 705 C ILE A 74 10.314 -7.273 -9.648 1.00 0.00 C ATOM 706 O ILE A 74 9.443 -7.902 -9.077 1.00 0.00 O ATOM 707 CB ILE A 74 11.679 -9.390 -9.851 1.00 0.00 C ATOM 708 CG1 ILE A 74 13.092 -9.936 -10.122 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.711 -9.875 -10.944 1.00 0.00 C ATOM 710 CD1 ILE A 74 13.070 -11.470 -10.189 1.00 0.00 C ATOM 0 H ILE A 74 12.053 -7.321 -7.783 1.00 0.00 H new ATOM 0 HA ILE A 74 12.146 -7.488 -10.756 1.00 0.00 H new ATOM 0 HB ILE A 74 11.324 -9.756 -8.888 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.472 -9.530 -11.060 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.772 -9.610 -9.335 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.689 -10.965 -10.953 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.711 -9.494 -10.739 1.00 0.00 H new ATOM 0 HG23 ILE A 74 11.046 -9.510 -11.915 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.077 -11.840 -10.381 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.711 -11.870 -9.241 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.406 -11.790 -10.992 1.00 0.00 H new ATOM 722 N LEU A 75 10.089 -6.077 -10.133 1.00 0.00 N ATOM 723 CA LEU A 75 8.747 -5.448 -9.997 1.00 0.00 C ATOM 724 C LEU A 75 7.861 -5.828 -11.182 1.00 0.00 C ATOM 725 O LEU A 75 8.033 -5.344 -12.284 1.00 0.00 O ATOM 726 CB LEU A 75 8.900 -3.927 -9.936 1.00 0.00 C ATOM 727 CG LEU A 75 7.584 -3.292 -9.463 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.879 -2.191 -8.438 1.00 0.00 C ATOM 729 CD2 LEU A 75 6.846 -2.689 -10.663 1.00 0.00 C ATOM 0 H LEU A 75 10.783 -5.510 -10.619 1.00 0.00 H new ATOM 0 HA LEU A 75 8.279 -5.806 -9.080 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.709 -3.660 -9.255 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.169 -3.539 -10.919 1.00 0.00 H new ATOM 0 HG LEU A 75 6.962 -4.058 -9.000 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.943 -1.743 -8.105 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.400 -2.621 -7.582 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.504 -1.425 -8.897 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.912 -2.238 -10.327 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.470 -1.926 -11.128 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.630 -3.473 -11.389 1.00 0.00 H new ATOM 741 N GLU A 76 6.903 -6.687 -10.950 1.00 0.00 N ATOM 742 CA GLU A 76 5.979 -7.109 -12.042 1.00 0.00 C ATOM 743 C GLU A 76 4.646 -6.384 -11.864 1.00 0.00 C ATOM 744 O GLU A 76 4.220 -6.130 -10.755 1.00 0.00 O ATOM 745 CB GLU A 76 5.738 -8.621 -11.960 1.00 0.00 C ATOM 746 CG GLU A 76 7.078 -9.361 -11.873 1.00 0.00 C ATOM 747 CD GLU A 76 7.335 -9.794 -10.427 1.00 0.00 C ATOM 748 OE1 GLU A 76 7.035 -9.017 -9.535 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.825 -10.894 -10.236 1.00 0.00 O ATOM 0 H GLU A 76 6.721 -7.117 -10.043 1.00 0.00 H new ATOM 0 HA GLU A 76 6.419 -6.864 -13.009 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.127 -8.854 -11.088 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.183 -8.957 -12.836 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.066 -10.233 -12.527 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.885 -8.714 -12.218 1.00 0.00 H new ATOM 756 N LEU A 77 3.982 -6.057 -12.941 1.00 0.00 N ATOM 757 CA LEU A 77 2.670 -5.357 -12.826 1.00 0.00 C ATOM 758 C LEU A 77 1.696 -5.937 -13.853 1.00 0.00 C ATOM 759 O LEU A 77 2.008 -6.057 -15.022 1.00 0.00 O ATOM 760 CB LEU A 77 2.851 -3.853 -13.070 1.00 0.00 C ATOM 761 CG LEU A 77 3.645 -3.614 -14.356 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.280 -2.245 -14.933 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.143 -3.647 -14.043 1.00 0.00 C ATOM 0 H LEU A 77 4.292 -6.244 -13.895 1.00 0.00 H new ATOM 0 HA LEU A 77 2.271 -5.503 -11.822 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.877 -3.370 -13.141 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.370 -3.401 -12.225 1.00 0.00 H new ATOM 0 HG LEU A 77 3.405 -4.392 -15.081 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.845 -2.074 -15.849 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.213 -2.216 -15.154 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.521 -1.468 -14.207 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.710 -3.477 -14.958 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.381 -2.868 -13.319 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.407 -4.620 -13.629 1.00 0.00 H new ATOM 775 N ASN A 78 0.518 -6.300 -13.422 1.00 0.00 N ATOM 776 CA ASN A 78 -0.483 -6.870 -14.359 1.00 0.00 C ATOM 777 C ASN A 78 -1.305 -5.729 -14.945 1.00 0.00 C ATOM 778 O ASN A 78 -1.612 -4.771 -14.263 1.00 0.00 O ATOM 779 CB ASN A 78 -1.417 -7.807 -13.597 1.00 0.00 C ATOM 780 CG ASN A 78 -0.617 -8.789 -12.726 1.00 0.00 C ATOM 781 OD1 ASN A 78 -1.089 -9.219 -11.693 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.577 -9.168 -13.099 1.00 0.00 N ATOM 0 H ASN A 78 0.207 -6.224 -12.453 1.00 0.00 H new ATOM 0 HA ASN A 78 0.024 -7.421 -15.151 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.091 -7.224 -12.970 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -2.037 -8.361 -14.302 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.108 -9.822 -12.523 1.00 0.00 H new ATOM 0 HD22 ASN A 78 0.978 -8.810 -13.966 1.00 0.00 H new ATOM 789 N VAL A 79 -1.660 -5.818 -16.197 1.00 0.00 N ATOM 790 CA VAL A 79 -2.463 -4.729 -16.822 1.00 0.00 C ATOM 791 C VAL A 79 -3.737 -5.322 -17.426 1.00 0.00 C ATOM 792 O VAL A 79 -3.746 -5.785 -18.551 1.00 0.00 O ATOM 793 CB VAL A 79 -1.641 -4.043 -17.914 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.360 -2.768 -18.352 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.256 -3.680 -17.366 1.00 0.00 C ATOM 0 H VAL A 79 -1.429 -6.597 -16.814 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.730 -3.993 -16.064 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.528 -4.717 -18.763 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.780 -2.273 -19.131 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.347 -3.022 -18.740 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.467 -2.099 -17.498 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.327 -3.191 -18.146 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.366 -3.004 -16.518 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.257 -4.586 -17.043 1.00 0.00 H new ATOM 805 N THR A 80 -4.810 -5.313 -16.678 1.00 0.00 N ATOM 806 CA THR A 80 -6.094 -5.879 -17.189 1.00 0.00 C ATOM 807 C THR A 80 -6.776 -4.865 -18.109 1.00 0.00 C ATOM 808 O THR A 80 -7.361 -3.901 -17.657 1.00 0.00 O ATOM 809 CB THR A 80 -7.015 -6.194 -16.008 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.325 -7.019 -15.080 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.263 -6.920 -16.510 1.00 0.00 C ATOM 0 H THR A 80 -4.852 -4.936 -15.731 1.00 0.00 H new ATOM 0 HA THR A 80 -5.889 -6.792 -17.748 1.00 0.00 H new ATOM 0 HB THR A 80 -7.311 -5.265 -15.520 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.927 -6.461 -14.379 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.918 -7.143 -15.668 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.791 -6.286 -17.222 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.971 -7.849 -16.999 1.00 0.00 H new ATOM 819 N LEU A 81 -6.709 -5.084 -19.396 1.00 0.00 N ATOM 820 CA LEU A 81 -7.357 -4.149 -20.359 1.00 0.00 C ATOM 821 C LEU A 81 -8.800 -4.625 -20.612 1.00 0.00 C ATOM 822 O LEU A 81 -9.019 -5.808 -20.780 1.00 0.00 O ATOM 823 CB LEU A 81 -6.578 -4.173 -21.680 1.00 0.00 C ATOM 824 CG LEU A 81 -5.311 -3.310 -21.583 1.00 0.00 C ATOM 825 CD1 LEU A 81 -5.688 -1.856 -21.274 1.00 0.00 C ATOM 826 CD2 LEU A 81 -4.397 -3.851 -20.477 1.00 0.00 C ATOM 0 H LEU A 81 -6.229 -5.877 -19.823 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.363 -3.136 -19.955 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.306 -5.199 -21.928 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.212 -3.807 -22.488 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.784 -3.347 -22.537 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.783 -1.252 -21.207 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.325 -1.468 -22.069 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.224 -1.813 -20.326 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.500 -3.235 -20.413 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.925 -3.824 -19.524 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.116 -4.879 -20.708 1.00 0.00 H new ATOM 838 N PRO A 82 -9.752 -3.710 -20.635 1.00 0.00 N ATOM 839 CA PRO A 82 -11.195 -4.040 -20.869 1.00 0.00 C ATOM 840 C PRO A 82 -11.480 -4.186 -22.367 1.00 0.00 C ATOM 841 O PRO A 82 -10.592 -4.079 -23.191 1.00 0.00 O ATOM 842 CB PRO A 82 -11.934 -2.842 -20.290 1.00 0.00 C ATOM 843 CG PRO A 82 -10.974 -1.667 -20.313 1.00 0.00 C ATOM 844 CD PRO A 82 -9.556 -2.228 -20.437 1.00 0.00 C ATOM 0 HA PRO A 82 -11.496 -4.983 -20.413 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.826 -2.621 -20.876 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.264 -3.049 -19.272 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.198 -1.006 -21.150 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.073 -1.074 -19.404 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.025 -1.782 -21.278 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -8.968 -2.021 -19.543 1.00 0.00 H new ATOM 852 N GLU A 83 -12.716 -4.437 -22.718 1.00 0.00 N ATOM 853 CA GLU A 83 -13.080 -4.600 -24.154 1.00 0.00 C ATOM 854 C GLU A 83 -12.763 -3.311 -24.919 1.00 0.00 C ATOM 855 O GLU A 83 -12.175 -2.390 -24.386 1.00 0.00 O ATOM 856 CB GLU A 83 -14.579 -4.907 -24.263 1.00 0.00 C ATOM 857 CG GLU A 83 -14.782 -6.396 -24.551 1.00 0.00 C ATOM 858 CD GLU A 83 -16.280 -6.703 -24.620 1.00 0.00 C ATOM 859 OE1 GLU A 83 -16.898 -6.317 -25.598 1.00 0.00 O ATOM 860 OE2 GLU A 83 -16.781 -7.319 -23.695 1.00 0.00 O ATOM 0 H GLU A 83 -13.493 -4.536 -22.064 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.505 -5.420 -24.584 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.084 -4.634 -23.336 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.025 -4.309 -25.058 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -14.301 -6.664 -25.492 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -14.313 -6.995 -23.771 1.00 0.00 H new ATOM 867 N ALA A 84 -13.158 -3.245 -26.165 1.00 0.00 N ATOM 868 CA ALA A 84 -12.895 -2.025 -26.980 1.00 0.00 C ATOM 869 C ALA A 84 -13.502 -2.205 -28.373 1.00 0.00 C ATOM 870 O ALA A 84 -13.560 -3.303 -28.894 1.00 0.00 O ATOM 871 CB ALA A 84 -11.386 -1.804 -27.105 1.00 0.00 C ATOM 0 H ALA A 84 -13.654 -3.990 -26.654 1.00 0.00 H new ATOM 0 HA ALA A 84 -13.346 -1.160 -26.494 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.197 -0.911 -27.701 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.954 -1.676 -26.113 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.931 -2.667 -27.590 1.00 0.00 H new ATOM 877 N GLU A 85 -13.954 -1.135 -28.977 1.00 0.00 N ATOM 878 CA GLU A 85 -14.559 -1.235 -30.337 1.00 0.00 C ATOM 879 C GLU A 85 -14.937 0.166 -30.832 1.00 0.00 C ATOM 880 O GLU A 85 -16.051 0.408 -31.259 1.00 0.00 O ATOM 881 CB GLU A 85 -15.811 -2.117 -30.274 1.00 0.00 C ATOM 882 CG GLU A 85 -16.041 -2.777 -31.636 1.00 0.00 C ATOM 883 CD GLU A 85 -17.519 -3.140 -31.784 1.00 0.00 C ATOM 884 OE1 GLU A 85 -18.341 -2.242 -31.708 1.00 0.00 O ATOM 885 OE2 GLU A 85 -17.805 -4.311 -31.971 1.00 0.00 O ATOM 0 H GLU A 85 -13.929 -0.194 -28.584 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.840 -1.678 -31.026 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.693 -2.879 -29.504 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -16.678 -1.517 -29.998 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -15.740 -2.100 -32.435 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -15.425 -3.672 -31.727 1.00 0.00 H new ATOM 892 N GLU A 86 -14.010 1.090 -30.780 1.00 0.00 N ATOM 893 CA GLU A 86 -14.298 2.477 -31.247 1.00 0.00 C ATOM 894 C GLU A 86 -13.031 3.327 -31.126 1.00 0.00 C ATOM 895 O GLU A 86 -13.082 4.485 -30.752 1.00 0.00 O ATOM 896 CB GLU A 86 -15.409 3.087 -30.388 1.00 0.00 C ATOM 897 CG GLU A 86 -15.026 2.990 -28.910 1.00 0.00 C ATOM 898 CD GLU A 86 -16.261 3.240 -28.043 1.00 0.00 C ATOM 899 OE1 GLU A 86 -16.542 4.394 -27.766 1.00 0.00 O ATOM 900 OE2 GLU A 86 -16.905 2.274 -27.672 1.00 0.00 O ATOM 0 H GLU A 86 -13.063 0.941 -30.432 1.00 0.00 H new ATOM 0 HA GLU A 86 -14.620 2.451 -32.288 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.567 4.129 -30.666 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -16.349 2.564 -30.566 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -14.612 2.005 -28.695 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -14.251 3.720 -28.676 1.00 0.00 H new ATOM 907 N LEU A 87 -11.895 2.759 -31.442 1.00 0.00 N ATOM 908 CA LEU A 87 -10.618 3.526 -31.349 1.00 0.00 C ATOM 909 C LEU A 87 -10.224 4.029 -32.741 1.00 0.00 C ATOM 910 O LEU A 87 -9.761 3.273 -33.575 1.00 0.00 O ATOM 911 CB LEU A 87 -9.512 2.612 -30.793 1.00 0.00 C ATOM 912 CG LEU A 87 -8.768 3.307 -29.641 1.00 0.00 C ATOM 913 CD1 LEU A 87 -8.130 4.607 -30.140 1.00 0.00 C ATOM 914 CD2 LEU A 87 -9.749 3.623 -28.507 1.00 0.00 C ATOM 0 H LEU A 87 -11.798 1.795 -31.761 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.750 4.378 -30.682 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.948 1.677 -30.441 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.809 2.357 -31.586 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.987 2.642 -29.271 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.605 5.093 -29.318 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.424 4.382 -30.939 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.907 5.272 -30.518 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.217 4.115 -27.693 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.534 4.281 -28.878 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.194 2.697 -28.142 1.00 0.00 H new ATOM 926 N LYS A 88 -10.407 5.300 -32.995 1.00 0.00 N ATOM 927 CA LYS A 88 -10.047 5.862 -34.330 1.00 0.00 C ATOM 928 C LYS A 88 -8.881 6.842 -34.173 1.00 0.00 C ATOM 929 O LYS A 88 -8.063 6.906 -35.075 1.00 0.00 O ATOM 930 CB LYS A 88 -11.255 6.597 -34.916 1.00 0.00 C ATOM 931 CG LYS A 88 -12.229 5.579 -35.512 1.00 0.00 C ATOM 932 CD LYS A 88 -13.279 5.202 -34.464 1.00 0.00 C ATOM 933 CE LYS A 88 -14.594 4.851 -35.162 1.00 0.00 C ATOM 934 NZ LYS A 88 -15.739 5.256 -34.297 1.00 0.00 N ATOM 935 OXT LYS A 88 -8.830 7.512 -33.155 1.00 0.00 O ATOM 0 H LYS A 88 -10.791 5.974 -32.333 1.00 0.00 H new ATOM 0 HA LYS A 88 -9.754 5.052 -34.999 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -11.751 7.180 -34.140 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -10.930 7.299 -35.684 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -12.714 5.997 -36.394 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -11.689 4.690 -35.837 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -12.931 4.354 -33.874 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -13.432 6.031 -33.773 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -14.654 5.359 -36.125 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -14.637 3.781 -35.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -16.633 5.018 -34.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -15.683 4.752 -33.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -15.700 6.281 -34.127 1.00 0.00 H new TER 949 LYS A 88 ATOM 950 N ARG B 31 3.824 -11.435 -33.424 1.00 0.00 N ATOM 951 CA ARG B 31 3.620 -10.185 -32.639 1.00 0.00 C ATOM 952 C ARG B 31 2.132 -10.025 -32.311 1.00 0.00 C ATOM 953 O ARG B 31 1.445 -9.194 -32.877 1.00 0.00 O ATOM 954 CB ARG B 31 4.102 -8.986 -33.461 1.00 0.00 C ATOM 955 CG ARG B 31 4.667 -7.917 -32.522 1.00 0.00 C ATOM 956 CD ARG B 31 5.829 -7.197 -33.210 1.00 0.00 C ATOM 957 NE ARG B 31 5.316 -5.971 -33.898 1.00 0.00 N ATOM 958 CZ ARG B 31 6.022 -5.359 -34.829 1.00 0.00 C ATOM 959 NH1 ARG B 31 7.206 -5.795 -35.193 1.00 0.00 N ATOM 960 NH2 ARG B 31 5.532 -4.294 -35.402 1.00 0.00 N ATOM 0 HA ARG B 31 4.188 -10.238 -31.710 1.00 0.00 H new ATOM 0 HB2 ARG B 31 4.866 -9.302 -34.171 1.00 0.00 H new ATOM 0 HB3 ARG B 31 3.277 -8.575 -34.043 1.00 0.00 H new ATOM 0 HG2 ARG B 31 3.888 -7.202 -32.257 1.00 0.00 H new ATOM 0 HG3 ARG B 31 5.008 -8.376 -31.594 1.00 0.00 H new ATOM 0 HD2 ARG B 31 6.588 -6.925 -32.477 1.00 0.00 H new ATOM 0 HD3 ARG B 31 6.306 -7.860 -33.932 1.00 0.00 H new ATOM 0 HE ARG B 31 4.401 -5.601 -33.641 1.00 0.00 H new ATOM 0 HH11 ARG B 31 7.601 -6.626 -34.753 1.00 0.00 H new ATOM 0 HH12 ARG B 31 7.731 -5.303 -35.916 1.00 0.00 H new ATOM 0 HH21 ARG B 31 4.614 -3.944 -35.128 1.00 0.00 H new ATOM 0 HH22 ARG B 31 6.067 -3.811 -36.123 1.00 0.00 H new ATOM 976 N SER B 32 1.631 -10.821 -31.400 1.00 0.00 N ATOM 977 CA SER B 32 0.190 -10.729 -31.026 1.00 0.00 C ATOM 978 C SER B 32 -0.119 -9.340 -30.458 1.00 0.00 C ATOM 979 O SER B 32 -1.257 -8.908 -30.456 1.00 0.00 O ATOM 980 CB SER B 32 -0.133 -11.788 -29.974 1.00 0.00 C ATOM 981 OG SER B 32 0.547 -12.993 -30.294 1.00 0.00 O ATOM 0 H SER B 32 2.162 -11.533 -30.898 1.00 0.00 H new ATOM 0 HA SER B 32 -0.418 -10.896 -31.915 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.168 -11.439 -28.986 1.00 0.00 H new ATOM 0 HB3 SER B 32 -1.208 -11.963 -29.936 1.00 0.00 H new ATOM 0 HG SER B 32 0.342 -13.673 -29.619 1.00 0.00 H new ATOM 987 N ASP B 33 0.880 -8.638 -29.974 1.00 0.00 N ATOM 988 CA ASP B 33 0.636 -7.283 -29.407 1.00 0.00 C ATOM 989 C ASP B 33 0.704 -6.217 -30.509 1.00 0.00 C ATOM 990 O ASP B 33 0.772 -5.039 -30.222 1.00 0.00 O ATOM 991 CB ASP B 33 1.684 -6.970 -28.338 1.00 0.00 C ATOM 992 CG ASP B 33 1.742 -8.112 -27.320 1.00 0.00 C ATOM 993 OD1 ASP B 33 2.095 -9.211 -27.713 1.00 0.00 O ATOM 994 OD2 ASP B 33 1.431 -7.867 -26.167 1.00 0.00 O ATOM 0 H ASP B 33 1.851 -8.949 -29.950 1.00 0.00 H new ATOM 0 HA ASP B 33 -0.359 -7.271 -28.962 1.00 0.00 H new ATOM 0 HB2 ASP B 33 2.661 -6.834 -28.802 1.00 0.00 H new ATOM 0 HB3 ASP B 33 1.437 -6.035 -27.836 1.00 0.00 H new ATOM 999 N ALA B 34 0.681 -6.612 -31.759 1.00 0.00 N ATOM 1000 CA ALA B 34 0.728 -5.619 -32.866 1.00 0.00 C ATOM 1001 C ALA B 34 -0.703 -5.237 -33.278 1.00 0.00 C ATOM 1002 O ALA B 34 -0.921 -4.238 -33.936 1.00 0.00 O ATOM 1003 CB ALA B 34 1.458 -6.231 -34.064 1.00 0.00 C ATOM 0 H ALA B 34 0.631 -7.586 -32.057 1.00 0.00 H new ATOM 0 HA ALA B 34 1.257 -4.727 -32.532 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.494 -5.506 -34.877 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.473 -6.501 -33.773 1.00 0.00 H new ATOM 0 HB3 ALA B 34 0.927 -7.123 -34.397 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.678 -6.029 -32.894 1.00 0.00 N ATOM 1010 CA GLU B 35 -3.095 -5.730 -33.256 1.00 0.00 C ATOM 1011 C GLU B 35 -3.518 -4.322 -32.776 1.00 0.00 C ATOM 1012 O GLU B 35 -4.183 -3.621 -33.513 1.00 0.00 O ATOM 1013 CB GLU B 35 -4.018 -6.784 -32.625 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.532 -8.194 -32.987 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.465 -8.815 -34.031 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -4.351 -8.450 -35.190 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -5.277 -9.643 -33.654 1.00 0.00 O ATOM 0 H GLU B 35 -1.548 -6.876 -32.341 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.180 -5.757 -34.342 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -4.034 -6.663 -31.542 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -5.040 -6.641 -32.977 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.515 -8.149 -33.377 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.504 -8.819 -32.094 1.00 0.00 H new ATOM 1024 N PRO B 36 -3.151 -3.932 -31.563 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.521 -2.596 -30.994 1.00 0.00 C ATOM 1026 C PRO B 36 -2.524 -1.514 -31.428 1.00 0.00 C ATOM 1027 O PRO B 36 -2.903 -0.410 -31.762 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.454 -2.824 -29.490 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.514 -3.991 -29.249 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.324 -4.720 -30.580 1.00 0.00 C ATOM 0 HA PRO B 36 -4.497 -2.247 -31.331 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -3.093 -1.930 -28.982 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.445 -3.040 -29.090 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.556 -3.638 -28.867 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.927 -4.666 -28.499 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.274 -4.744 -30.873 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.661 -5.755 -30.517 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.247 -1.825 -31.411 1.00 0.00 N ATOM 1039 CA HIS B 37 -0.191 -0.831 -31.808 1.00 0.00 C ATOM 1040 C HIS B 37 0.016 0.225 -30.706 1.00 0.00 C ATOM 1041 O HIS B 37 0.849 1.102 -30.840 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.568 -0.132 -33.123 1.00 0.00 C ATOM 1043 CG HIS B 37 0.675 0.398 -33.784 1.00 0.00 C ATOM 1044 ND1 HIS B 37 0.803 1.726 -34.158 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.852 -0.209 -34.143 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.019 1.874 -34.715 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.700 0.726 -34.731 1.00 0.00 N ATOM 0 H HIS B 37 -0.886 -2.738 -31.135 1.00 0.00 H new ATOM 0 HA HIS B 37 0.740 -1.380 -31.949 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.075 -0.832 -33.787 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.264 0.683 -32.927 1.00 0.00 H new ATOM 0 HD2 HIS B 37 2.085 -1.253 -33.992 1.00 0.00 H new ATOM 0 HE1 HIS B 37 2.398 2.808 -35.102 1.00 0.00 H new ATOM 0 HE2 HIS B 37 3.639 0.568 -35.096 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.711 0.145 -29.614 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.528 1.136 -28.509 1.00 0.00 C ATOM 1057 C TYR B 38 -0.110 0.390 -27.238 1.00 0.00 C ATOM 1058 O TYR B 38 0.685 0.873 -26.457 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.833 1.903 -28.258 1.00 0.00 C ATOM 1060 CG TYR B 38 -3.000 0.945 -28.177 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.310 0.317 -26.965 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.774 0.692 -29.316 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.396 -0.565 -26.892 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.859 -0.191 -29.243 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.169 -0.818 -28.031 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.239 -1.687 -27.958 1.00 0.00 O ATOM 0 H TYR B 38 -1.423 -0.565 -29.443 1.00 0.00 H new ATOM 0 HA TYR B 38 0.244 1.853 -28.790 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.756 2.471 -27.331 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -2.000 2.622 -29.060 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.712 0.512 -26.087 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.535 1.177 -30.251 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.637 -1.049 -25.957 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.456 -0.388 -30.121 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.670 -1.750 -28.836 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.630 -0.796 -27.040 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.266 -1.606 -25.837 1.00 0.00 C ATOM 1078 C LEU B 39 1.270 -1.724 -25.697 1.00 0.00 C ATOM 1079 O LEU B 39 1.799 -1.464 -24.632 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.883 -3.008 -25.976 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.756 -3.335 -24.752 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.934 -3.219 -23.463 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.934 -2.358 -24.691 1.00 0.00 C ATOM 0 H LEU B 39 -1.299 -1.242 -27.668 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.652 -1.112 -24.946 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.485 -3.059 -26.883 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -0.092 -3.752 -26.076 1.00 0.00 H new ATOM 0 HG LEU B 39 -2.125 -4.356 -24.846 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.566 -3.453 -22.606 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -0.099 -3.918 -23.500 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.552 -2.203 -23.365 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.553 -2.589 -23.824 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.557 -1.339 -24.607 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.531 -2.451 -25.598 1.00 0.00 H new ATOM 1095 N PRO B 40 1.957 -2.106 -26.763 1.00 0.00 N ATOM 1096 CA PRO B 40 3.450 -2.256 -26.752 1.00 0.00 C ATOM 1097 C PRO B 40 4.131 -0.882 -26.740 1.00 0.00 C ATOM 1098 O PRO B 40 5.281 -0.753 -26.358 1.00 0.00 O ATOM 1099 CB PRO B 40 3.753 -3.035 -28.025 1.00 0.00 C ATOM 1100 CG PRO B 40 2.594 -2.810 -28.970 1.00 0.00 C ATOM 1101 CD PRO B 40 1.380 -2.434 -28.123 1.00 0.00 C ATOM 0 HA PRO B 40 3.823 -2.770 -25.866 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.687 -2.694 -28.472 1.00 0.00 H new ATOM 0 HB3 PRO B 40 3.873 -4.096 -27.808 1.00 0.00 H new ATOM 0 HG2 PRO B 40 2.827 -2.017 -29.681 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.393 -3.710 -29.551 1.00 0.00 H new ATOM 0 HD2 PRO B 40 0.849 -1.581 -28.546 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.667 -3.256 -28.064 1.00 0.00 H new ATOM 1109 N GLN B 41 3.423 0.150 -27.128 1.00 0.00 N ATOM 1110 CA GLN B 41 4.015 1.515 -27.106 1.00 0.00 C ATOM 1111 C GLN B 41 4.102 1.965 -25.645 1.00 0.00 C ATOM 1112 O GLN B 41 5.021 2.658 -25.241 1.00 0.00 O ATOM 1113 CB GLN B 41 3.110 2.470 -27.897 1.00 0.00 C ATOM 1114 CG GLN B 41 3.686 3.889 -27.868 1.00 0.00 C ATOM 1115 CD GLN B 41 5.037 3.911 -28.586 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.202 3.286 -29.614 1.00 0.00 O ATOM 1117 NE2 GLN B 41 6.018 4.609 -28.082 1.00 0.00 N ATOM 0 H GLN B 41 2.459 0.102 -27.459 1.00 0.00 H new ATOM 0 HA GLN B 41 5.007 1.516 -27.558 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.020 2.127 -28.928 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.107 2.468 -27.471 1.00 0.00 H new ATOM 0 HG2 GLN B 41 2.996 4.582 -28.349 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.805 4.223 -26.837 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.879 5.134 -27.219 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.923 4.630 -28.552 1.00 0.00 H new ATOM 1126 N LEU B 42 3.145 1.566 -24.851 1.00 0.00 N ATOM 1127 CA LEU B 42 3.147 1.955 -23.424 1.00 0.00 C ATOM 1128 C LEU B 42 4.229 1.168 -22.689 1.00 0.00 C ATOM 1129 O LEU B 42 5.093 1.739 -22.065 1.00 0.00 O ATOM 1130 CB LEU B 42 1.775 1.643 -22.798 1.00 0.00 C ATOM 1131 CG LEU B 42 0.605 2.497 -23.386 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.023 3.390 -24.569 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.511 1.559 -23.856 1.00 0.00 C ATOM 0 H LEU B 42 2.359 0.983 -25.138 1.00 0.00 H new ATOM 0 HA LEU B 42 3.347 3.023 -23.340 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.551 0.586 -22.945 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.830 1.811 -21.722 1.00 0.00 H new ATOM 0 HG LEU B 42 0.272 3.159 -22.587 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.159 3.952 -24.924 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.799 4.083 -24.245 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.407 2.767 -25.377 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.331 2.147 -24.268 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -0.124 0.889 -24.624 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.873 0.973 -23.012 1.00 0.00 H new ATOM 1145 N ARG B 43 4.192 -0.145 -22.756 1.00 0.00 N ATOM 1146 CA ARG B 43 5.219 -0.978 -22.047 1.00 0.00 C ATOM 1147 C ARG B 43 6.634 -0.455 -22.333 1.00 0.00 C ATOM 1148 O ARG B 43 7.448 -0.317 -21.432 1.00 0.00 O ATOM 1149 CB ARG B 43 5.091 -2.445 -22.485 1.00 0.00 C ATOM 1150 CG ARG B 43 5.506 -2.623 -23.947 1.00 0.00 C ATOM 1151 CD ARG B 43 5.272 -4.075 -24.370 1.00 0.00 C ATOM 1152 NE ARG B 43 5.843 -4.294 -25.735 1.00 0.00 N ATOM 1153 CZ ARG B 43 5.527 -5.355 -26.450 1.00 0.00 C ATOM 1154 NH1 ARG B 43 4.697 -6.267 -25.998 1.00 0.00 N ATOM 1155 NH2 ARG B 43 6.050 -5.502 -27.637 1.00 0.00 N ATOM 0 H ARG B 43 3.492 -0.676 -23.273 1.00 0.00 H new ATOM 0 HA ARG B 43 5.044 -0.911 -20.973 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.714 -3.073 -21.848 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.062 -2.778 -22.353 1.00 0.00 H new ATOM 0 HG2 ARG B 43 4.932 -1.950 -24.584 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.557 -2.361 -24.073 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.739 -4.753 -23.656 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.205 -4.298 -24.370 1.00 0.00 H new ATOM 0 HE ARG B 43 6.491 -3.607 -26.121 1.00 0.00 H new ATOM 0 HH11 ARG B 43 4.280 -6.163 -25.073 1.00 0.00 H new ATOM 0 HH12 ARG B 43 4.469 -7.079 -26.572 1.00 0.00 H new ATOM 0 HH21 ARG B 43 6.695 -4.800 -28.001 1.00 0.00 H new ATOM 0 HH22 ARG B 43 5.814 -6.319 -28.201 1.00 0.00 H new ATOM 1169 N LYS B 44 6.932 -0.145 -23.574 1.00 0.00 N ATOM 1170 CA LYS B 44 8.279 0.376 -23.883 1.00 0.00 C ATOM 1171 C LYS B 44 8.442 1.740 -23.204 1.00 0.00 C ATOM 1172 O LYS B 44 9.532 2.120 -22.829 1.00 0.00 O ATOM 1173 CB LYS B 44 8.476 0.488 -25.401 1.00 0.00 C ATOM 1174 CG LYS B 44 7.528 1.532 -25.992 1.00 0.00 C ATOM 1175 CD LYS B 44 7.819 1.707 -27.484 1.00 0.00 C ATOM 1176 CE LYS B 44 7.355 0.466 -28.252 1.00 0.00 C ATOM 1177 NZ LYS B 44 8.344 0.144 -29.319 1.00 0.00 N ATOM 0 H LYS B 44 6.300 -0.233 -24.370 1.00 0.00 H new ATOM 0 HA LYS B 44 9.039 -0.308 -23.505 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.508 0.761 -25.620 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.296 -0.480 -25.869 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.493 1.221 -25.847 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.650 2.483 -25.474 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.308 2.592 -27.862 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.886 1.864 -27.640 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.251 -0.379 -27.571 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.374 0.643 -28.692 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 8.029 -0.699 -29.841 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 8.422 0.948 -29.974 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.272 -0.042 -28.888 1.00 0.00 H new ATOM 1191 N ASP B 45 7.360 2.473 -23.027 1.00 0.00 N ATOM 1192 CA ASP B 45 7.466 3.796 -22.357 1.00 0.00 C ATOM 1193 C ASP B 45 7.944 3.593 -20.916 1.00 0.00 C ATOM 1194 O ASP B 45 8.860 4.254 -20.473 1.00 0.00 O ATOM 1195 CB ASP B 45 6.111 4.508 -22.356 1.00 0.00 C ATOM 1196 CG ASP B 45 5.713 4.859 -23.789 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.598 5.170 -24.569 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.530 4.810 -24.083 1.00 0.00 O ATOM 0 H ASP B 45 6.420 2.206 -23.319 1.00 0.00 H new ATOM 0 HA ASP B 45 8.180 4.414 -22.901 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.353 3.868 -21.904 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.165 5.413 -21.751 1.00 0.00 H new ATOM 1203 N ILE B 46 7.343 2.677 -20.178 1.00 0.00 N ATOM 1204 CA ILE B 46 7.788 2.443 -18.765 1.00 0.00 C ATOM 1205 C ILE B 46 9.286 2.096 -18.752 1.00 0.00 C ATOM 1206 O ILE B 46 10.007 2.478 -17.852 1.00 0.00 O ATOM 1207 CB ILE B 46 6.931 1.334 -18.107 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.923 1.568 -16.596 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.459 -0.079 -18.402 1.00 0.00 C ATOM 1210 CD1 ILE B 46 6.171 2.859 -16.278 1.00 0.00 C ATOM 0 H ILE B 46 6.572 2.089 -20.494 1.00 0.00 H new ATOM 0 HA ILE B 46 7.645 3.350 -18.178 1.00 0.00 H new ATOM 0 HB ILE B 46 5.926 1.390 -18.525 1.00 0.00 H new ATOM 0 HG12 ILE B 46 6.450 0.726 -16.091 1.00 0.00 H new ATOM 0 HG13 ILE B 46 7.945 1.630 -16.223 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.819 -0.815 -17.916 1.00 0.00 H new ATOM 0 HG22 ILE B 46 7.457 -0.251 -19.478 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.476 -0.174 -18.022 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.168 3.022 -15.200 1.00 0.00 H new ATOM 0 HD12 ILE B 46 6.663 3.698 -16.770 1.00 0.00 H new ATOM 0 HD13 ILE B 46 5.145 2.780 -16.636 1.00 0.00 H new ATOM 1222 N LEU B 47 9.758 1.393 -19.759 1.00 0.00 N ATOM 1223 CA LEU B 47 11.207 1.049 -19.818 1.00 0.00 C ATOM 1224 C LEU B 47 12.019 2.348 -19.858 1.00 0.00 C ATOM 1225 O LEU B 47 12.957 2.535 -19.101 1.00 0.00 O ATOM 1226 CB LEU B 47 11.487 0.231 -21.080 1.00 0.00 C ATOM 1227 CG LEU B 47 11.102 -1.230 -20.845 1.00 0.00 C ATOM 1228 CD1 LEU B 47 11.035 -1.962 -22.187 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.154 -1.895 -19.954 1.00 0.00 C ATOM 0 H LEU B 47 9.198 1.046 -20.538 1.00 0.00 H new ATOM 0 HA LEU B 47 11.487 0.463 -18.943 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.922 0.635 -21.920 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.542 0.301 -21.343 1.00 0.00 H new ATOM 0 HG LEU B 47 10.128 -1.276 -20.357 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.761 -3.004 -22.020 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.288 -1.487 -22.823 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.009 -1.917 -22.675 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.882 -2.937 -19.785 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.127 -1.849 -20.443 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.204 -1.373 -18.998 1.00 0.00 H new ATOM 1241 N GLU B 48 11.639 3.256 -20.720 1.00 0.00 N ATOM 1242 CA GLU B 48 12.356 4.558 -20.805 1.00 0.00 C ATOM 1243 C GLU B 48 12.061 5.341 -19.540 1.00 0.00 C ATOM 1244 O GLU B 48 12.908 6.036 -19.013 1.00 0.00 O ATOM 1245 CB GLU B 48 11.870 5.382 -22.005 1.00 0.00 C ATOM 1246 CG GLU B 48 11.729 4.508 -23.252 1.00 0.00 C ATOM 1247 CD GLU B 48 13.074 3.864 -23.602 1.00 0.00 C ATOM 1248 OE1 GLU B 48 13.824 4.473 -24.346 1.00 0.00 O ATOM 1249 OE2 GLU B 48 13.329 2.772 -23.120 1.00 0.00 O ATOM 0 H GLU B 48 10.860 3.149 -21.370 1.00 0.00 H new ATOM 0 HA GLU B 48 13.423 4.366 -20.922 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.910 5.842 -21.769 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.572 6.192 -22.202 1.00 0.00 H new ATOM 0 HG2 GLU B 48 10.981 3.734 -23.080 1.00 0.00 H new ATOM 0 HG3 GLU B 48 11.377 5.111 -24.089 1.00 0.00 H new ATOM 1256 N VAL B 49 10.852 5.228 -19.047 1.00 0.00 N ATOM 1257 CA VAL B 49 10.478 5.960 -17.808 1.00 0.00 C ATOM 1258 C VAL B 49 11.403 5.502 -16.678 1.00 0.00 C ATOM 1259 O VAL B 49 12.106 6.293 -16.089 1.00 0.00 O ATOM 1260 CB VAL B 49 9.014 5.671 -17.448 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.630 6.447 -16.183 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.103 6.105 -18.606 1.00 0.00 C ATOM 0 H VAL B 49 10.110 4.658 -19.454 1.00 0.00 H new ATOM 0 HA VAL B 49 10.585 7.034 -17.961 1.00 0.00 H new ATOM 0 HB VAL B 49 8.894 4.602 -17.270 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.590 6.239 -15.930 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.272 6.139 -15.358 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.754 7.515 -16.360 1.00 0.00 H new ATOM 0 HG21 VAL B 49 7.064 5.899 -18.348 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.227 7.173 -18.786 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.370 5.552 -19.506 1.00 0.00 H new ATOM 1272 N ILE B 50 11.441 4.218 -16.402 1.00 0.00 N ATOM 1273 CA ILE B 50 12.359 3.706 -15.335 1.00 0.00 C ATOM 1274 C ILE B 50 13.789 4.175 -15.645 1.00 0.00 C ATOM 1275 O ILE B 50 14.609 4.321 -14.760 1.00 0.00 O ATOM 1276 CB ILE B 50 12.306 2.173 -15.296 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.866 1.720 -15.041 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.203 1.653 -14.168 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.636 0.360 -15.702 1.00 0.00 C ATOM 0 H ILE B 50 10.878 3.506 -16.868 1.00 0.00 H new ATOM 0 HA ILE B 50 12.049 4.091 -14.363 1.00 0.00 H new ATOM 0 HB ILE B 50 12.655 1.777 -16.250 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.679 1.652 -13.969 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.166 2.454 -15.441 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.163 0.564 -14.144 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.230 1.974 -14.342 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.856 2.050 -13.214 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.611 0.036 -15.521 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.806 0.444 -16.775 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.327 -0.371 -15.281 1.00 0.00 H new ATOM 1291 N CYS B 51 14.077 4.430 -16.901 1.00 0.00 N ATOM 1292 CA CYS B 51 15.428 4.913 -17.282 1.00 0.00 C ATOM 1293 C CYS B 51 15.582 6.377 -16.852 1.00 0.00 C ATOM 1294 O CYS B 51 16.574 6.761 -16.268 1.00 0.00 O ATOM 1295 CB CYS B 51 15.597 4.803 -18.802 1.00 0.00 C ATOM 1296 SG CYS B 51 17.358 4.838 -19.216 1.00 0.00 S ATOM 0 H CYS B 51 13.424 4.321 -17.677 1.00 0.00 H new ATOM 0 HA CYS B 51 16.188 4.307 -16.788 1.00 0.00 H new ATOM 0 HB2 CYS B 51 15.146 3.879 -19.163 1.00 0.00 H new ATOM 0 HB3 CYS B 51 15.080 5.625 -19.297 1.00 0.00 H new ATOM 0 HG CYS B 51 17.503 4.743 -20.504 1.00 0.00 H new ATOM 1302 N LYS B 52 14.603 7.196 -17.137 1.00 0.00 N ATOM 1303 CA LYS B 52 14.683 8.644 -16.754 1.00 0.00 C ATOM 1304 C LYS B 52 14.915 8.785 -15.247 1.00 0.00 C ATOM 1305 O LYS B 52 15.548 9.720 -14.793 1.00 0.00 O ATOM 1306 CB LYS B 52 13.371 9.352 -17.102 1.00 0.00 C ATOM 1307 CG LYS B 52 13.070 9.221 -18.595 1.00 0.00 C ATOM 1308 CD LYS B 52 11.572 9.447 -18.823 1.00 0.00 C ATOM 1309 CE LYS B 52 11.328 10.910 -19.195 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.620 11.112 -20.642 1.00 0.00 N ATOM 0 H LYS B 52 13.746 6.926 -17.621 1.00 0.00 H new ATOM 0 HA LYS B 52 15.512 9.093 -17.302 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.554 8.923 -16.522 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.436 10.405 -16.829 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.651 9.949 -19.162 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.361 8.233 -18.952 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.212 8.794 -19.618 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.014 9.192 -17.922 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.295 11.183 -18.980 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.961 11.560 -18.591 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.454 12.107 -20.894 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.613 10.868 -20.833 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 10.998 10.502 -21.210 1.00 0.00 H new ATOM 1324 N TYR B 53 14.386 7.877 -14.475 1.00 0.00 N ATOM 1325 CA TYR B 53 14.537 7.951 -13.001 1.00 0.00 C ATOM 1326 C TYR B 53 15.605 6.953 -12.522 1.00 0.00 C ATOM 1327 O TYR B 53 16.081 7.042 -11.406 1.00 0.00 O ATOM 1328 CB TYR B 53 13.195 7.594 -12.354 1.00 0.00 C ATOM 1329 CG TYR B 53 12.120 8.590 -12.749 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.680 8.664 -14.077 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.547 9.422 -11.781 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.675 9.566 -14.439 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.535 10.324 -12.143 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.101 10.393 -13.475 1.00 0.00 C ATOM 1335 OH TYR B 53 9.107 11.282 -13.830 1.00 0.00 O ATOM 0 H TYR B 53 13.849 7.077 -14.811 1.00 0.00 H new ATOM 0 HA TYR B 53 14.844 8.959 -12.720 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.896 6.591 -12.658 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.302 7.580 -11.269 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.119 8.021 -14.825 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.883 9.370 -10.756 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.344 9.622 -15.465 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.090 10.965 -11.396 1.00 0.00 H new ATOM 0 HH TYR B 53 8.816 11.781 -13.038 1.00 0.00 H new ATOM 1345 N VAL B 54 15.972 5.994 -13.344 1.00 0.00 N ATOM 1346 CA VAL B 54 16.996 4.979 -12.922 1.00 0.00 C ATOM 1347 C VAL B 54 17.725 4.473 -14.189 1.00 0.00 C ATOM 1348 O VAL B 54 18.043 5.259 -15.058 1.00 0.00 O ATOM 1349 CB VAL B 54 16.316 3.806 -12.171 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.342 3.132 -11.258 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.146 4.299 -11.308 1.00 0.00 C ATOM 0 H VAL B 54 15.607 5.870 -14.288 1.00 0.00 H new ATOM 0 HA VAL B 54 17.716 5.432 -12.240 1.00 0.00 H new ATOM 0 HB VAL B 54 15.934 3.105 -12.913 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.869 2.306 -10.727 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.169 2.752 -11.858 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.720 3.857 -10.538 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.691 3.452 -10.795 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.513 5.015 -10.572 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.403 4.780 -11.943 1.00 0.00 H new ATOM 1361 N GLN B 55 18.001 3.188 -14.317 1.00 0.00 N ATOM 1362 CA GLN B 55 18.697 2.692 -15.540 1.00 0.00 C ATOM 1363 C GLN B 55 18.638 1.164 -15.573 1.00 0.00 C ATOM 1364 O GLN B 55 19.247 0.488 -14.766 1.00 0.00 O ATOM 1365 CB GLN B 55 20.156 3.156 -15.527 1.00 0.00 C ATOM 1366 CG GLN B 55 20.361 4.248 -16.580 1.00 0.00 C ATOM 1367 CD GLN B 55 21.416 5.241 -16.091 1.00 0.00 C ATOM 1368 OE1 GLN B 55 21.119 6.129 -15.315 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.645 5.129 -16.514 1.00 0.00 N ATOM 0 H GLN B 55 17.772 2.472 -13.627 1.00 0.00 H new ATOM 0 HA GLN B 55 18.205 3.092 -16.427 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.418 3.536 -14.540 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.817 2.313 -15.730 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.676 3.803 -17.524 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.421 4.765 -16.770 1.00 0.00 H new ATOM 0 HE21 GLN B 55 22.894 4.384 -17.165 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.356 5.786 -16.194 1.00 0.00 H new ATOM 1378 N ILE B 56 17.904 0.624 -16.506 1.00 0.00 N ATOM 1379 CA ILE B 56 17.781 -0.860 -16.620 1.00 0.00 C ATOM 1380 C ILE B 56 17.793 -1.252 -18.096 1.00 0.00 C ATOM 1381 O ILE B 56 17.679 -0.411 -18.969 1.00 0.00 O ATOM 1382 CB ILE B 56 16.467 -1.335 -15.986 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.332 -0.355 -16.321 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.634 -1.432 -14.468 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.049 -1.135 -16.610 1.00 0.00 C ATOM 0 H ILE B 56 17.378 1.152 -17.203 1.00 0.00 H new ATOM 0 HA ILE B 56 18.617 -1.327 -16.099 1.00 0.00 H new ATOM 0 HB ILE B 56 16.215 -2.317 -16.387 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.173 0.331 -15.489 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.604 0.250 -17.186 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.699 -1.770 -14.020 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.426 -2.143 -14.234 1.00 0.00 H new ATOM 0 HG23 ILE B 56 16.895 -0.453 -14.067 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.245 -0.438 -16.847 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.212 -1.803 -17.456 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.774 -1.721 -15.733 1.00 0.00 H new ATOM 1397 N ASP B 57 17.917 -2.521 -18.378 1.00 0.00 N ATOM 1398 CA ASP B 57 17.923 -2.978 -19.796 1.00 0.00 C ATOM 1399 C ASP B 57 16.562 -3.612 -20.116 1.00 0.00 C ATOM 1400 O ASP B 57 15.826 -3.951 -19.210 1.00 0.00 O ATOM 1401 CB ASP B 57 19.032 -4.015 -19.994 1.00 0.00 C ATOM 1402 CG ASP B 57 20.353 -3.301 -20.284 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.321 -2.294 -20.970 1.00 0.00 O ATOM 1404 OD2 ASP B 57 21.374 -3.775 -19.814 1.00 0.00 O ATOM 0 H ASP B 57 18.015 -3.263 -17.684 1.00 0.00 H new ATOM 0 HA ASP B 57 18.103 -2.132 -20.459 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.129 -4.634 -19.102 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.778 -4.682 -20.818 1.00 0.00 H new ATOM 1409 N PRO B 58 16.253 -3.767 -21.386 1.00 0.00 N ATOM 1410 CA PRO B 58 14.960 -4.375 -21.835 1.00 0.00 C ATOM 1411 C PRO B 58 14.991 -5.879 -21.589 1.00 0.00 C ATOM 1412 O PRO B 58 13.982 -6.490 -21.290 1.00 0.00 O ATOM 1413 CB PRO B 58 14.889 -4.040 -23.317 1.00 0.00 C ATOM 1414 CG PRO B 58 16.311 -3.808 -23.784 1.00 0.00 C ATOM 1415 CD PRO B 58 17.126 -3.385 -22.560 1.00 0.00 C ATOM 0 HA PRO B 58 14.088 -3.999 -21.300 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.427 -4.854 -23.875 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.278 -3.153 -23.484 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.723 -4.715 -24.226 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.342 -3.036 -24.553 1.00 0.00 H new ATOM 0 HD2 PRO B 58 18.088 -3.897 -22.525 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.335 -2.315 -22.570 1.00 0.00 H new ATOM 1423 N GLU B 59 16.154 -6.471 -21.673 1.00 0.00 N ATOM 1424 CA GLU B 59 16.271 -7.928 -21.403 1.00 0.00 C ATOM 1425 C GLU B 59 15.995 -8.190 -19.912 1.00 0.00 C ATOM 1426 O GLU B 59 15.792 -9.318 -19.505 1.00 0.00 O ATOM 1427 CB GLU B 59 17.685 -8.400 -21.751 1.00 0.00 C ATOM 1428 CG GLU B 59 17.811 -8.563 -23.267 1.00 0.00 C ATOM 1429 CD GLU B 59 18.999 -9.472 -23.587 1.00 0.00 C ATOM 1430 OE1 GLU B 59 19.039 -10.571 -23.056 1.00 0.00 O ATOM 1431 OE2 GLU B 59 19.848 -9.056 -24.358 1.00 0.00 O ATOM 0 H GLU B 59 17.027 -6.004 -21.918 1.00 0.00 H new ATOM 0 HA GLU B 59 15.548 -8.473 -22.011 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.419 -7.680 -21.390 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.896 -9.347 -21.254 1.00 0.00 H new ATOM 0 HG2 GLU B 59 16.894 -8.988 -23.675 1.00 0.00 H new ATOM 0 HG3 GLU B 59 17.948 -7.589 -23.738 1.00 0.00 H new ATOM 1438 N MET B 60 15.981 -7.154 -19.093 1.00 0.00 N ATOM 1439 CA MET B 60 15.714 -7.343 -17.642 1.00 0.00 C ATOM 1440 C MET B 60 14.208 -7.240 -17.382 1.00 0.00 C ATOM 1441 O MET B 60 13.701 -7.780 -16.416 1.00 0.00 O ATOM 1442 CB MET B 60 16.442 -6.248 -16.855 1.00 0.00 C ATOM 1443 CG MET B 60 17.942 -6.574 -16.773 1.00 0.00 C ATOM 1444 SD MET B 60 18.370 -7.131 -15.102 1.00 0.00 S ATOM 1445 CE MET B 60 18.369 -5.501 -14.317 1.00 0.00 C ATOM 0 H MET B 60 16.145 -6.189 -19.379 1.00 0.00 H new ATOM 0 HA MET B 60 16.069 -8.324 -17.327 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.297 -5.282 -17.339 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.023 -6.169 -15.852 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.194 -7.348 -17.498 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.528 -5.692 -17.032 1.00 0.00 H new ATOM 0 HE1 MET B 60 17.997 -5.589 -13.296 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.384 -5.105 -14.300 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.725 -4.826 -14.881 1.00 0.00 H new ATOM 1455 N VAL B 61 13.490 -6.547 -18.235 1.00 0.00 N ATOM 1456 CA VAL B 61 12.019 -6.402 -18.039 1.00 0.00 C ATOM 1457 C VAL B 61 11.284 -7.436 -18.896 1.00 0.00 C ATOM 1458 O VAL B 61 11.453 -7.488 -20.099 1.00 0.00 O ATOM 1459 CB VAL B 61 11.587 -4.995 -18.459 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.114 -4.783 -18.105 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.441 -3.958 -17.724 1.00 0.00 C ATOM 0 H VAL B 61 13.864 -6.076 -19.059 1.00 0.00 H new ATOM 0 HA VAL B 61 11.775 -6.561 -16.989 1.00 0.00 H new ATOM 0 HB VAL B 61 11.721 -4.882 -19.535 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.808 -3.781 -18.405 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.504 -5.520 -18.628 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.978 -4.897 -17.030 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.134 -2.956 -18.023 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.307 -4.073 -16.648 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.491 -4.106 -17.977 1.00 0.00 H new ATOM 1471 N THR B 62 10.470 -8.261 -18.283 1.00 0.00 N ATOM 1472 CA THR B 62 9.724 -9.294 -19.053 1.00 0.00 C ATOM 1473 C THR B 62 8.345 -8.753 -19.435 1.00 0.00 C ATOM 1474 O THR B 62 7.840 -7.829 -18.826 1.00 0.00 O ATOM 1475 CB THR B 62 9.550 -10.551 -18.199 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.739 -10.789 -17.458 1.00 0.00 O ATOM 1477 CG2 THR B 62 9.267 -11.749 -19.108 1.00 0.00 C ATOM 0 H THR B 62 10.292 -8.260 -17.279 1.00 0.00 H new ATOM 0 HA THR B 62 10.285 -9.540 -19.954 1.00 0.00 H new ATOM 0 HB THR B 62 8.716 -10.411 -17.512 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.627 -11.593 -16.909 1.00 0.00 H new ATOM 0 HG21 THR B 62 9.143 -12.645 -18.500 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.355 -11.567 -19.677 1.00 0.00 H new ATOM 0 HG23 THR B 62 10.101 -11.889 -19.795 1.00 0.00 H new ATOM 1485 N VAL B 63 7.736 -9.332 -20.435 1.00 0.00 N ATOM 1486 CA VAL B 63 6.384 -8.873 -20.865 1.00 0.00 C ATOM 1487 C VAL B 63 5.545 -10.094 -21.238 1.00 0.00 C ATOM 1488 O VAL B 63 5.969 -10.936 -22.008 1.00 0.00 O ATOM 1489 CB VAL B 63 6.522 -7.956 -22.077 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.153 -7.379 -22.444 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.481 -6.815 -21.742 1.00 0.00 C ATOM 0 H VAL B 63 8.119 -10.108 -20.975 1.00 0.00 H new ATOM 0 HA VAL B 63 5.900 -8.327 -20.055 1.00 0.00 H new ATOM 0 HB VAL B 63 6.911 -8.526 -22.920 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.254 -6.725 -23.310 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.467 -8.192 -22.682 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.761 -6.809 -21.602 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.581 -6.158 -22.606 1.00 0.00 H new ATOM 0 HG22 VAL B 63 7.090 -6.247 -20.898 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.457 -7.225 -21.482 1.00 0.00 H new ATOM 1501 N GLN B 64 4.364 -10.202 -20.688 1.00 0.00 N ATOM 1502 CA GLN B 64 3.498 -11.374 -20.996 1.00 0.00 C ATOM 1503 C GLN B 64 2.035 -10.932 -21.049 1.00 0.00 C ATOM 1504 O GLN B 64 1.576 -10.185 -20.210 1.00 0.00 O ATOM 1505 CB GLN B 64 3.688 -12.437 -19.908 1.00 0.00 C ATOM 1506 CG GLN B 64 3.477 -11.811 -18.520 1.00 0.00 C ATOM 1507 CD GLN B 64 4.832 -11.608 -17.835 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.533 -10.657 -18.117 1.00 0.00 O ATOM 1509 NE2 GLN B 64 5.231 -12.469 -16.939 1.00 0.00 N ATOM 0 H GLN B 64 3.963 -9.527 -20.038 1.00 0.00 H new ATOM 0 HA GLN B 64 3.774 -11.794 -21.963 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.982 -13.254 -20.059 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.689 -12.864 -19.975 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.960 -10.856 -18.616 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.844 -12.457 -17.911 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.643 -13.268 -16.702 1.00 0.00 H new ATOM 0 HE22 GLN B 64 6.131 -12.343 -16.476 1.00 0.00 H new ATOM 1518 N LEU B 65 1.304 -11.379 -22.041 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.119 -10.977 -22.162 1.00 0.00 C ATOM 1520 C LEU B 65 -1.036 -12.155 -21.833 1.00 0.00 C ATOM 1521 O LEU B 65 -0.719 -13.299 -22.099 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.388 -10.511 -23.589 1.00 0.00 C ATOM 1523 CG LEU B 65 0.053 -11.593 -24.583 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -0.985 -11.712 -25.702 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.409 -11.213 -25.185 1.00 0.00 C ATOM 0 H LEU B 65 1.639 -12.007 -22.771 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.320 -10.168 -21.460 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.449 -10.298 -23.717 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.150 -9.583 -23.785 1.00 0.00 H new ATOM 0 HG LEU B 65 0.140 -12.548 -24.064 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.672 -12.481 -26.408 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -1.951 -11.983 -25.275 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.073 -10.757 -26.220 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.722 -11.982 -25.891 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.322 -10.258 -25.703 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.149 -11.128 -24.389 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.177 -11.869 -21.264 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.146 -12.946 -20.915 1.00 0.00 C ATOM 1539 C GLU B 66 -4.556 -12.465 -21.260 1.00 0.00 C ATOM 1540 O GLU B 66 -4.745 -11.336 -21.669 1.00 0.00 O ATOM 1541 CB GLU B 66 -3.054 -13.259 -19.414 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.790 -14.071 -19.112 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.808 -15.389 -19.895 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.665 -16.211 -19.614 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -0.963 -15.553 -20.759 1.00 0.00 O ATOM 0 H GLU B 66 -2.481 -10.925 -21.024 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.916 -13.851 -21.477 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -3.042 -12.331 -18.843 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.936 -13.816 -19.098 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.905 -13.493 -19.379 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.727 -14.275 -18.043 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.542 -13.310 -21.108 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.940 -12.899 -21.435 1.00 0.00 C ATOM 1554 C GLN B 67 -7.919 -13.608 -20.496 1.00 0.00 C ATOM 1555 O GLN B 67 -7.618 -14.648 -19.942 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.259 -13.287 -22.882 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.862 -12.146 -23.822 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.788 -12.670 -25.257 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.802 -12.855 -25.902 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.623 -12.918 -25.788 1.00 0.00 N ATOM 0 H GLN B 67 -5.440 -14.267 -20.771 1.00 0.00 H new ATOM 0 HA GLN B 67 -7.036 -11.820 -21.313 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -6.722 -14.196 -23.152 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.323 -13.502 -22.985 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -7.589 -11.337 -23.756 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -5.898 -11.734 -23.524 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -4.772 -12.763 -25.247 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.562 -13.267 -26.744 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.094 -13.052 -20.320 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.102 -13.692 -19.423 1.00 0.00 C ATOM 1571 C LYS B 68 -11.260 -14.232 -20.266 1.00 0.00 C ATOM 1572 O LYS B 68 -11.314 -14.028 -21.463 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.638 -12.662 -18.429 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.665 -12.516 -17.252 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.473 -11.033 -16.916 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.799 -10.435 -16.440 1.00 0.00 C ATOM 1577 NZ LYS B 68 -11.061 -10.858 -15.036 1.00 0.00 N ATOM 0 H LYS B 68 -9.396 -12.183 -20.760 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.631 -14.509 -18.877 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -10.770 -11.700 -18.924 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.618 -12.970 -18.066 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -10.050 -13.048 -16.382 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.706 -12.968 -17.503 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.714 -10.921 -16.142 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.115 -10.495 -17.794 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.762 -9.347 -16.502 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.612 -10.764 -17.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.898 -10.358 -14.673 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.231 -11.884 -15.008 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.237 -10.628 -14.445 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.183 -14.922 -19.645 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.341 -15.481 -20.397 1.00 0.00 C ATOM 1593 C ASP B 69 -14.399 -14.394 -20.648 1.00 0.00 C ATOM 1594 O ASP B 69 -15.355 -14.617 -21.366 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.966 -16.620 -19.589 1.00 0.00 C ATOM 1596 CG ASP B 69 -12.902 -17.678 -19.290 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -12.158 -17.491 -18.343 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -12.851 -18.659 -20.015 1.00 0.00 O ATOM 0 H ASP B 69 -12.182 -15.122 -18.645 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.988 -15.854 -21.358 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -14.382 -16.234 -18.658 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -14.790 -17.065 -20.146 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.247 -13.227 -20.062 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.255 -12.144 -20.271 1.00 0.00 C ATOM 1605 C GLY B 70 -14.777 -11.186 -21.366 1.00 0.00 C ATOM 1606 O GLY B 70 -15.066 -10.005 -21.335 1.00 0.00 O ATOM 0 H GLY B 70 -13.469 -12.982 -19.450 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.215 -12.579 -20.550 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.411 -11.597 -19.341 1.00 0.00 H new ATOM 1610 N ASP B 71 -14.043 -11.687 -22.329 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.534 -10.818 -23.435 1.00 0.00 C ATOM 1612 C ASP B 71 -12.663 -9.705 -22.851 1.00 0.00 C ATOM 1613 O ASP B 71 -12.839 -8.536 -23.144 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.713 -10.208 -24.202 1.00 0.00 C ATOM 1615 CG ASP B 71 -15.266 -11.238 -25.190 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -14.644 -11.434 -26.221 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.301 -11.814 -24.897 1.00 0.00 O ATOM 0 H ASP B 71 -13.773 -12.668 -22.397 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.938 -11.420 -24.121 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.493 -9.900 -23.506 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.390 -9.314 -24.735 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.731 -10.069 -22.013 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.842 -9.054 -21.382 1.00 0.00 C ATOM 1624 C ILE B 72 -9.381 -9.465 -21.586 1.00 0.00 C ATOM 1625 O ILE B 72 -9.088 -10.610 -21.873 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.158 -8.971 -19.885 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.688 -8.887 -19.695 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.469 -7.737 -19.297 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.050 -8.613 -18.229 1.00 0.00 C ATOM 0 H ILE B 72 -11.547 -11.033 -21.737 1.00 0.00 H new ATOM 0 HA ILE B 72 -11.006 -8.078 -21.840 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.790 -9.858 -19.368 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.093 -8.096 -20.326 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.149 -9.820 -20.018 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.689 -7.671 -18.231 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.392 -7.819 -19.441 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.835 -6.842 -19.800 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.134 -8.559 -18.126 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.665 -9.418 -17.603 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.608 -7.667 -17.916 1.00 0.00 H new ATOM 1641 N SER B 73 -8.467 -8.540 -21.444 1.00 0.00 N ATOM 1642 CA SER B 73 -7.025 -8.870 -21.634 1.00 0.00 C ATOM 1643 C SER B 73 -6.271 -8.626 -20.328 1.00 0.00 C ATOM 1644 O SER B 73 -6.770 -7.989 -19.419 1.00 0.00 O ATOM 1645 CB SER B 73 -6.439 -7.986 -22.734 1.00 0.00 C ATOM 1646 OG SER B 73 -6.806 -8.513 -24.003 1.00 0.00 O ATOM 0 H SER B 73 -8.659 -7.567 -21.204 1.00 0.00 H new ATOM 0 HA SER B 73 -6.927 -9.917 -21.920 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.806 -6.965 -22.631 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.353 -7.945 -22.644 1.00 0.00 H new ATOM 0 HG SER B 73 -6.434 -7.948 -24.712 1.00 0.00 H new ATOM 1652 N ILE B 74 -5.077 -9.144 -20.229 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.272 -8.972 -18.987 1.00 0.00 C ATOM 1654 C ILE B 74 -2.785 -8.919 -19.367 1.00 0.00 C ATOM 1655 O ILE B 74 -2.109 -9.931 -19.397 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.550 -10.164 -18.056 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -6.024 -10.131 -17.616 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.633 -10.106 -16.822 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.324 -11.295 -16.659 1.00 0.00 C ATOM 0 H ILE B 74 -4.621 -9.685 -20.964 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.539 -8.048 -18.474 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.349 -11.091 -18.592 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.242 -9.183 -17.125 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.672 -10.194 -18.490 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.842 -10.956 -16.173 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.591 -10.140 -17.141 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.815 -9.180 -16.277 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.371 -11.257 -16.357 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -6.126 -12.241 -17.163 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.689 -11.214 -15.777 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.278 -7.748 -19.663 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.845 -7.620 -20.048 1.00 0.00 C ATOM 1673 C LEU B 75 0.020 -7.410 -18.807 1.00 0.00 C ATOM 1674 O LEU B 75 0.031 -6.348 -18.216 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.678 -6.435 -21.001 1.00 0.00 C ATOM 1676 CG LEU B 75 0.707 -6.497 -21.664 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.581 -6.175 -23.157 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.638 -5.478 -20.998 1.00 0.00 C ATOM 0 H LEU B 75 -2.801 -6.872 -19.653 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.527 -8.536 -20.545 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.458 -6.455 -21.762 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.789 -5.498 -20.455 1.00 0.00 H new ATOM 0 HG LEU B 75 1.119 -7.499 -21.546 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.565 -6.220 -23.623 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -0.079 -6.901 -23.631 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.167 -5.174 -23.280 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.621 -5.521 -21.468 1.00 0.00 H new ATOM 0 HD22 LEU B 75 1.224 -4.476 -21.115 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.732 -5.710 -19.937 1.00 0.00 H new ATOM 1690 N GLU B 76 0.755 -8.419 -18.422 1.00 0.00 N ATOM 1691 CA GLU B 76 1.642 -8.304 -17.231 1.00 0.00 C ATOM 1692 C GLU B 76 3.083 -8.125 -17.706 1.00 0.00 C ATOM 1693 O GLU B 76 3.475 -8.667 -18.719 1.00 0.00 O ATOM 1694 CB GLU B 76 1.551 -9.583 -16.392 1.00 0.00 C ATOM 1695 CG GLU B 76 0.082 -9.929 -16.121 1.00 0.00 C ATOM 1696 CD GLU B 76 -0.360 -11.063 -17.051 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.034 -11.041 -18.206 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -1.086 -11.930 -16.593 1.00 0.00 O ATOM 0 H GLU B 76 0.778 -9.326 -18.887 1.00 0.00 H new ATOM 0 HA GLU B 76 1.333 -7.451 -16.627 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.037 -10.407 -16.916 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.081 -9.448 -15.449 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.045 -10.228 -15.081 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.544 -9.051 -16.279 1.00 0.00 H new ATOM 1705 N LEU B 77 3.874 -7.377 -16.983 1.00 0.00 N ATOM 1706 CA LEU B 77 5.294 -7.176 -17.396 1.00 0.00 C ATOM 1707 C LEU B 77 6.193 -7.232 -16.159 1.00 0.00 C ATOM 1708 O LEU B 77 5.944 -6.574 -15.167 1.00 0.00 O ATOM 1709 CB LEU B 77 5.454 -5.819 -18.095 1.00 0.00 C ATOM 1710 CG LEU B 77 4.819 -4.709 -17.253 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.506 -3.378 -17.567 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.329 -4.602 -17.591 1.00 0.00 C ATOM 0 H LEU B 77 3.599 -6.897 -16.126 1.00 0.00 H new ATOM 0 HA LEU B 77 5.581 -7.964 -18.092 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.511 -5.606 -18.252 1.00 0.00 H new ATOM 0 HB3 LEU B 77 4.986 -5.852 -19.079 1.00 0.00 H new ATOM 0 HG LEU B 77 4.937 -4.942 -16.195 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.056 -2.586 -16.969 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.568 -3.452 -17.331 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.385 -3.147 -18.625 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.876 -3.812 -16.992 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.212 -4.368 -18.649 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.837 -5.550 -17.373 1.00 0.00 H new ATOM 1724 N ASN B 78 7.234 -8.018 -16.211 1.00 0.00 N ATOM 1725 CA ASN B 78 8.154 -8.126 -15.050 1.00 0.00 C ATOM 1726 C ASN B 78 9.238 -7.064 -15.191 1.00 0.00 C ATOM 1727 O ASN B 78 9.692 -6.781 -16.282 1.00 0.00 O ATOM 1728 CB ASN B 78 8.813 -9.502 -15.050 1.00 0.00 C ATOM 1729 CG ASN B 78 7.764 -10.612 -15.232 1.00 0.00 C ATOM 1730 OD1 ASN B 78 8.060 -11.655 -15.779 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.546 -10.437 -14.791 1.00 0.00 N ATOM 0 H ASN B 78 7.486 -8.593 -17.015 1.00 0.00 H new ATOM 0 HA ASN B 78 7.598 -7.986 -14.123 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.550 -9.557 -15.852 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.349 -9.653 -14.113 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.851 -11.174 -14.907 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.291 -9.563 -14.331 1.00 0.00 H new ATOM 1738 N VAL B 79 9.652 -6.474 -14.103 1.00 0.00 N ATOM 1739 CA VAL B 79 10.710 -5.426 -14.183 1.00 0.00 C ATOM 1740 C VAL B 79 11.868 -5.805 -13.259 1.00 0.00 C ATOM 1741 O VAL B 79 11.857 -5.508 -12.079 1.00 0.00 O ATOM 1742 CB VAL B 79 10.131 -4.075 -13.763 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.132 -2.975 -14.108 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.819 -3.820 -14.515 1.00 0.00 C ATOM 0 H VAL B 79 9.305 -6.671 -13.164 1.00 0.00 H new ATOM 0 HA VAL B 79 11.074 -5.353 -15.208 1.00 0.00 H new ATOM 0 HB VAL B 79 9.937 -4.078 -12.690 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.726 -2.008 -13.811 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.067 -3.154 -13.577 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.318 -2.976 -15.182 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.408 -2.856 -14.214 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.010 -3.814 -15.588 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.105 -4.609 -14.278 1.00 0.00 H new ATOM 1754 N THR B 80 12.865 -6.464 -13.792 1.00 0.00 N ATOM 1755 CA THR B 80 14.031 -6.878 -12.959 1.00 0.00 C ATOM 1756 C THR B 80 14.976 -5.691 -12.765 1.00 0.00 C ATOM 1757 O THR B 80 15.719 -5.328 -13.655 1.00 0.00 O ATOM 1758 CB THR B 80 14.780 -8.014 -13.661 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.867 -9.057 -13.973 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.878 -8.551 -12.742 1.00 0.00 C ATOM 0 H THR B 80 12.920 -6.734 -14.774 1.00 0.00 H new ATOM 0 HA THR B 80 13.676 -7.218 -11.986 1.00 0.00 H new ATOM 0 HB THR B 80 15.232 -7.639 -14.579 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.536 -8.939 -14.888 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.410 -9.359 -13.244 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.577 -7.750 -12.504 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.431 -8.927 -11.822 1.00 0.00 H new ATOM 1768 N LEU B 81 14.954 -5.092 -11.602 1.00 0.00 N ATOM 1769 CA LEU B 81 15.850 -3.934 -11.331 1.00 0.00 C ATOM 1770 C LEU B 81 17.174 -4.463 -10.745 1.00 0.00 C ATOM 1771 O LEU B 81 17.149 -5.335 -9.901 1.00 0.00 O ATOM 1772 CB LEU B 81 15.179 -3.011 -10.304 1.00 0.00 C ATOM 1773 CG LEU B 81 14.119 -2.125 -10.979 1.00 0.00 C ATOM 1774 CD1 LEU B 81 14.773 -1.251 -12.055 1.00 0.00 C ATOM 1775 CD2 LEU B 81 13.036 -3.003 -11.616 1.00 0.00 C ATOM 0 H LEU B 81 14.349 -5.359 -10.825 1.00 0.00 H new ATOM 0 HA LEU B 81 16.041 -3.382 -12.252 1.00 0.00 H new ATOM 0 HB2 LEU B 81 14.714 -3.609 -9.520 1.00 0.00 H new ATOM 0 HB3 LEU B 81 15.931 -2.385 -9.824 1.00 0.00 H new ATOM 0 HG LEU B 81 13.664 -1.482 -10.225 1.00 0.00 H new ATOM 0 HD11 LEU B 81 14.014 -0.627 -12.528 1.00 0.00 H new ATOM 0 HD12 LEU B 81 15.531 -0.616 -11.597 1.00 0.00 H new ATOM 0 HD13 LEU B 81 15.239 -1.888 -12.807 1.00 0.00 H new ATOM 0 HD21 LEU B 81 12.288 -2.370 -12.093 1.00 0.00 H new ATOM 0 HD22 LEU B 81 13.489 -3.655 -12.363 1.00 0.00 H new ATOM 0 HD23 LEU B 81 12.560 -3.610 -10.846 1.00 0.00 H new ATOM 1787 N PRO B 82 18.297 -3.936 -11.198 1.00 0.00 N ATOM 1788 CA PRO B 82 19.651 -4.362 -10.714 1.00 0.00 C ATOM 1789 C PRO B 82 20.002 -3.658 -9.401 1.00 0.00 C ATOM 1790 O PRO B 82 19.217 -2.901 -8.862 1.00 0.00 O ATOM 1791 CB PRO B 82 20.584 -3.922 -11.833 1.00 0.00 C ATOM 1792 CG PRO B 82 19.898 -2.788 -12.571 1.00 0.00 C ATOM 1793 CD PRO B 82 18.406 -2.853 -12.241 1.00 0.00 C ATOM 0 HA PRO B 82 19.714 -5.430 -10.507 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.542 -3.594 -11.429 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.791 -4.751 -12.509 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.315 -1.827 -12.268 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.056 -2.880 -13.646 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.041 -1.898 -11.862 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.814 -3.092 -13.125 1.00 0.00 H new ATOM 1801 N GLU B 83 21.177 -3.909 -8.885 1.00 0.00 N ATOM 1802 CA GLU B 83 21.599 -3.270 -7.604 1.00 0.00 C ATOM 1803 C GLU B 83 21.618 -1.747 -7.766 1.00 0.00 C ATOM 1804 O GLU B 83 21.201 -1.216 -8.779 1.00 0.00 O ATOM 1805 CB GLU B 83 23.003 -3.763 -7.232 1.00 0.00 C ATOM 1806 CG GLU B 83 22.905 -4.800 -6.111 1.00 0.00 C ATOM 1807 CD GLU B 83 24.305 -5.318 -5.770 1.00 0.00 C ATOM 1808 OE1 GLU B 83 25.059 -4.573 -5.164 1.00 0.00 O ATOM 1809 OE2 GLU B 83 24.599 -6.448 -6.121 1.00 0.00 O ATOM 0 H GLU B 83 21.868 -4.535 -9.300 1.00 0.00 H new ATOM 0 HA GLU B 83 20.895 -3.537 -6.816 1.00 0.00 H new ATOM 0 HB2 GLU B 83 23.488 -4.201 -8.104 1.00 0.00 H new ATOM 0 HB3 GLU B 83 23.621 -2.924 -6.911 1.00 0.00 H new ATOM 0 HG2 GLU B 83 22.446 -4.355 -5.229 1.00 0.00 H new ATOM 0 HG3 GLU B 83 22.265 -5.626 -6.421 1.00 0.00 H new ATOM 1816 N ALA B 84 22.102 -1.047 -6.773 1.00 0.00 N ATOM 1817 CA ALA B 84 22.162 0.440 -6.851 1.00 0.00 C ATOM 1818 C ALA B 84 22.812 0.989 -5.579 1.00 0.00 C ATOM 1819 O ALA B 84 22.673 0.425 -4.511 1.00 0.00 O ATOM 1820 CB ALA B 84 20.745 1.006 -6.985 1.00 0.00 C ATOM 0 H ALA B 84 22.461 -1.446 -5.906 1.00 0.00 H new ATOM 0 HA ALA B 84 22.752 0.734 -7.719 1.00 0.00 H new ATOM 0 HB1 ALA B 84 20.791 2.094 -7.042 1.00 0.00 H new ATOM 0 HB2 ALA B 84 20.281 0.615 -7.890 1.00 0.00 H new ATOM 0 HB3 ALA B 84 20.153 0.713 -6.118 1.00 0.00 H new ATOM 1826 N GLU B 85 23.522 2.084 -5.690 1.00 0.00 N ATOM 1827 CA GLU B 85 24.186 2.676 -4.492 1.00 0.00 C ATOM 1828 C GLU B 85 24.885 3.981 -4.889 1.00 0.00 C ATOM 1829 O GLU B 85 26.053 4.185 -4.608 1.00 0.00 O ATOM 1830 CB GLU B 85 25.214 1.685 -3.936 1.00 0.00 C ATOM 1831 CG GLU B 85 25.393 1.921 -2.435 1.00 0.00 C ATOM 1832 CD GLU B 85 26.768 1.410 -1.999 1.00 0.00 C ATOM 1833 OE1 GLU B 85 27.754 1.894 -2.531 1.00 0.00 O ATOM 1834 OE2 GLU B 85 26.812 0.545 -1.140 1.00 0.00 O ATOM 0 H GLU B 85 23.670 2.593 -6.561 1.00 0.00 H new ATOM 0 HA GLU B 85 23.439 2.886 -3.726 1.00 0.00 H new ATOM 0 HB2 GLU B 85 24.883 0.662 -4.117 1.00 0.00 H new ATOM 0 HB3 GLU B 85 26.167 1.807 -4.450 1.00 0.00 H new ATOM 0 HG2 GLU B 85 25.300 2.983 -2.209 1.00 0.00 H new ATOM 0 HG3 GLU B 85 24.609 1.407 -1.879 1.00 0.00 H new ATOM 1841 N GLU B 86 24.174 4.869 -5.538 1.00 0.00 N ATOM 1842 CA GLU B 86 24.781 6.165 -5.956 1.00 0.00 C ATOM 1843 C GLU B 86 23.718 7.028 -6.641 1.00 0.00 C ATOM 1844 O GLU B 86 23.988 7.701 -7.619 1.00 0.00 O ATOM 1845 CB GLU B 86 25.933 5.903 -6.929 1.00 0.00 C ATOM 1846 CG GLU B 86 25.436 5.040 -8.090 1.00 0.00 C ATOM 1847 CD GLU B 86 26.633 4.465 -8.850 1.00 0.00 C ATOM 1848 OE1 GLU B 86 27.132 5.144 -9.732 1.00 0.00 O ATOM 1849 OE2 GLU B 86 27.030 3.354 -8.536 1.00 0.00 O ATOM 0 H GLU B 86 23.195 4.749 -5.796 1.00 0.00 H new ATOM 0 HA GLU B 86 25.162 6.686 -5.078 1.00 0.00 H new ATOM 0 HB2 GLU B 86 26.326 6.847 -7.306 1.00 0.00 H new ATOM 0 HB3 GLU B 86 26.751 5.401 -6.413 1.00 0.00 H new ATOM 0 HG2 GLU B 86 24.809 4.232 -7.713 1.00 0.00 H new ATOM 0 HG3 GLU B 86 24.818 5.636 -8.761 1.00 0.00 H new ATOM 1856 N LEU B 87 22.512 7.010 -6.133 1.00 0.00 N ATOM 1857 CA LEU B 87 21.423 7.825 -6.747 1.00 0.00 C ATOM 1858 C LEU B 87 21.244 9.119 -5.946 1.00 0.00 C ATOM 1859 O LEU B 87 20.690 9.116 -4.863 1.00 0.00 O ATOM 1860 CB LEU B 87 20.113 7.018 -6.736 1.00 0.00 C ATOM 1861 CG LEU B 87 19.454 7.042 -8.124 1.00 0.00 C ATOM 1862 CD1 LEU B 87 19.143 8.487 -8.529 1.00 0.00 C ATOM 1863 CD2 LEU B 87 20.399 6.416 -9.156 1.00 0.00 C ATOM 0 H LEU B 87 22.235 6.464 -5.317 1.00 0.00 H new ATOM 0 HA LEU B 87 21.684 8.072 -7.776 1.00 0.00 H new ATOM 0 HB2 LEU B 87 20.316 5.988 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU B 87 19.430 7.433 -5.995 1.00 0.00 H new ATOM 0 HG LEU B 87 18.526 6.471 -8.086 1.00 0.00 H new ATOM 0 HD11 LEU B 87 18.676 8.496 -9.514 1.00 0.00 H new ATOM 0 HD12 LEU B 87 18.464 8.931 -7.801 1.00 0.00 H new ATOM 0 HD13 LEU B 87 20.068 9.063 -8.560 1.00 0.00 H new ATOM 0 HD21 LEU B 87 19.928 6.435 -10.139 1.00 0.00 H new ATOM 0 HD22 LEU B 87 21.329 6.983 -9.188 1.00 0.00 H new ATOM 0 HD23 LEU B 87 20.612 5.385 -8.876 1.00 0.00 H new ATOM 1875 N LYS B 88 21.708 10.222 -6.476 1.00 0.00 N ATOM 1876 CA LYS B 88 21.571 11.522 -5.754 1.00 0.00 C ATOM 1877 C LYS B 88 20.631 12.442 -6.537 1.00 0.00 C ATOM 1878 O LYS B 88 19.908 13.195 -5.905 1.00 0.00 O ATOM 1879 CB LYS B 88 22.944 12.183 -5.628 1.00 0.00 C ATOM 1880 CG LYS B 88 23.721 11.532 -4.483 1.00 0.00 C ATOM 1881 CD LYS B 88 24.590 10.399 -5.033 1.00 0.00 C ATOM 1882 CE LYS B 88 25.846 10.255 -4.171 1.00 0.00 C ATOM 1883 NZ LYS B 88 26.987 9.823 -5.026 1.00 0.00 N ATOM 1884 OXT LYS B 88 20.651 12.378 -7.756 1.00 0.00 O ATOM 0 H LYS B 88 22.177 10.278 -7.380 1.00 0.00 H new ATOM 0 HA LYS B 88 21.162 11.345 -4.759 1.00 0.00 H new ATOM 0 HB2 LYS B 88 23.496 12.079 -6.562 1.00 0.00 H new ATOM 0 HB3 LYS B 88 22.830 13.251 -5.443 1.00 0.00 H new ATOM 0 HG2 LYS B 88 24.345 12.274 -3.985 1.00 0.00 H new ATOM 0 HG3 LYS B 88 23.030 11.144 -3.735 1.00 0.00 H new ATOM 0 HD2 LYS B 88 24.029 9.465 -5.036 1.00 0.00 H new ATOM 0 HD3 LYS B 88 24.867 10.608 -6.066 1.00 0.00 H new ATOM 0 HE2 LYS B 88 26.079 11.204 -3.687 1.00 0.00 H new ATOM 0 HE3 LYS B 88 25.675 9.526 -3.379 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 27.841 9.725 -4.441 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 26.763 8.909 -5.468 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 27.154 10.534 -5.767 1.00 0.00 H new TER 1898 LYS B 88