USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1197 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 85 ASN : amide:sc= 1.72 K(o=1.8,f=-1.1) USER MOD Set 1.2: B 89 LYS NZ :NH3+ 145:sc= 0.113 (180deg=-0.0797) USER MOD Set 2.1: A 71 GLN : amide:sc= 1.14 K(o=1.1,f=-0.014) USER MOD Set 2.2: B 82 MET CE :methyl 177:sc= 0 (180deg=-0.0143) USER MOD Set 3.1: A 75 THR OG1 : rot -66:sc= -0.0899 USER MOD Set 3.2: B 75 THR OG1 : rot 79:sc= 1.9 USER MOD Set 4.1: B 17 HIS : no HD1:sc= 1.17 K(o=2.1,f=-9.3!) USER MOD Set 4.2: B 27 HIS : no HD1:sc= 0.982 K(o=2.1,f=-8.5!) USER MOD Set 5.1: A 17 HIS : no HE2:sc= 0.98 K(o=2.2,f=-6.6!) USER MOD Set 5.2: A 27 HIS : no HE2:sc= 1.24 K(o=2.2,f=-7.5!) USER MOD Single : A 3 SER OG : rot -21:sc= 0.829 USER MOD Single : A 7 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 150:sc=-0.00935 USER MOD Single : A 20 SER OG : rot -88:sc= 1.09 USER MOD Single : A 28 THR OG1 : rot 153:sc= 1.21 USER MOD Single : A 30 SER OG : rot 39:sc= 1.13 USER MOD Single : A 31 LYS NZ :NH3+ -173:sc= 0.688 (180deg=0.587) USER MOD Single : A 32 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0182) USER MOD Single : A 35 LYS NZ :NH3+ -131:sc= -0.0837 (180deg=-1.99!) USER MOD Single : A 39 GLN : amide:sc= -0.166 X(o=-0.17,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0203) USER MOD Single : A 57 MET CE :methyl -165:sc= -0.0061 (180deg=-0.199) USER MOD Single : A 63 ASN : amide:sc= -0.809 K(o=-0.81,f=-7.6!) USER MOD Single : A 64 LYS NZ :NH3+ 169:sc=-0.00477 (180deg=-0.127) USER MOD Single : A 66 GLN : amide:sc= 1.19 K(o=1.2,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.369 K(o=0.37,f=-3!) USER MOD Single : A 73 TYR OH : rot 156:sc= 1.17 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot -171:sc= 1.21 USER MOD Single : A 85 ASN : amide:sc= 1.19 K(o=1.2,f=-0.018) USER MOD Single : B 3 SER OG : rot 25:sc= 0.62 USER MOD Single : B 7 GLN : amide:sc= 0.0599 X(o=0.06,f=-0.39) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 180:sc= 1.15 USER MOD Single : B 20 SER OG : rot -70:sc= 0.593 USER MOD Single : B 28 THR OG1 : rot 36:sc= 0.051 USER MOD Single : B 30 SER OG : rot 180:sc= -0.0826 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ -147:sc= 0.29 (180deg=-1.84!) USER MOD Single : B 39 GLN : amide:sc= 0.526 K(o=0.53,f=-1.2) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0265) USER MOD Single : B 57 MET CE :methyl -166:sc= -0.0092 (180deg=-0.219) USER MOD Single : B 69 ASN : amide:sc= 1.17 K(o=1.2,f=-1.2) USER MOD Single : B 71 GLN : amide:sc= 1.18 K(o=1.2,f=-0.45) USER MOD Single : B 73 TYR OH : rot 156:sc= 1.12 USER MOD Single : B 84 TYR OH : rot -176:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -9.770 -3.323 -5.952 1.00 0.00 N ATOM 31 CA SER A 3 -8.526 -3.791 -6.533 1.00 0.00 C ATOM 32 C SER A 3 -7.362 -2.841 -6.229 1.00 0.00 C ATOM 33 O SER A 3 -6.411 -3.293 -5.602 1.00 0.00 O ATOM 34 CB SER A 3 -8.736 -4.092 -8.026 1.00 0.00 C ATOM 35 OG SER A 3 -9.959 -3.522 -8.475 1.00 0.00 O ATOM 0 HA SER A 3 -8.231 -4.730 -6.065 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.905 -3.690 -8.606 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.747 -5.170 -8.189 1.00 0.00 H new ATOM 0 HG SER A 3 -10.549 -3.368 -7.708 1.00 0.00 H new ATOM 41 N PRO A 4 -7.433 -1.547 -6.592 1.00 0.00 N ATOM 42 CA PRO A 4 -6.470 -0.530 -6.194 1.00 0.00 C ATOM 43 C PRO A 4 -5.965 -0.629 -4.751 1.00 0.00 C ATOM 44 O PRO A 4 -4.755 -0.633 -4.533 1.00 0.00 O ATOM 45 CB PRO A 4 -7.162 0.804 -6.470 1.00 0.00 C ATOM 46 CG PRO A 4 -7.963 0.488 -7.729 1.00 0.00 C ATOM 47 CD PRO A 4 -8.401 -0.962 -7.510 1.00 0.00 C ATOM 0 HA PRO A 4 -5.551 -0.659 -6.766 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.804 1.110 -5.644 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -6.446 1.610 -6.633 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -8.818 1.155 -7.840 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -7.357 0.594 -8.629 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.407 -1.006 -7.094 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -8.422 -1.508 -8.453 1.00 0.00 H new ATOM 55 N LEU A 5 -6.849 -0.710 -3.751 1.00 0.00 N ATOM 56 CA LEU A 5 -6.355 -0.830 -2.386 1.00 0.00 C ATOM 57 C LEU A 5 -5.770 -2.223 -2.167 1.00 0.00 C ATOM 58 O LEU A 5 -4.665 -2.353 -1.640 1.00 0.00 O ATOM 59 CB LEU A 5 -7.432 -0.500 -1.348 1.00 0.00 C ATOM 60 CG LEU A 5 -6.870 -0.624 0.083 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.659 0.279 0.345 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.932 -0.244 1.109 1.00 0.00 C ATOM 0 H LEU A 5 -7.863 -0.695 -3.856 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.564 -0.093 -2.247 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.803 0.512 -1.511 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.280 -1.174 -1.470 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.563 -1.665 0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.316 0.140 1.370 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.856 0.019 -0.344 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.943 1.321 0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.518 -0.337 2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.248 0.786 0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.790 -0.908 1.007 1.00 0.00 H new ATOM 74 N ASP A 6 -6.514 -3.261 -2.562 1.00 0.00 N ATOM 75 CA ASP A 6 -6.120 -4.647 -2.339 1.00 0.00 C ATOM 76 C ASP A 6 -4.704 -4.907 -2.856 1.00 0.00 C ATOM 77 O ASP A 6 -3.894 -5.506 -2.153 1.00 0.00 O ATOM 78 CB ASP A 6 -7.128 -5.619 -2.966 1.00 0.00 C ATOM 79 CG ASP A 6 -8.489 -5.598 -2.272 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.503 -5.712 -1.025 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.498 -5.493 -3.002 1.00 0.00 O ATOM 0 H ASP A 6 -7.406 -3.159 -3.045 1.00 0.00 H new ATOM 0 HA ASP A 6 -6.118 -4.823 -1.263 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -7.259 -5.369 -4.019 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.722 -6.630 -2.927 1.00 0.00 H new ATOM 86 N GLN A 7 -4.385 -4.444 -4.068 1.00 0.00 N ATOM 87 CA GLN A 7 -3.052 -4.607 -4.628 1.00 0.00 C ATOM 88 C GLN A 7 -2.014 -3.833 -3.814 1.00 0.00 C ATOM 89 O GLN A 7 -0.902 -4.317 -3.622 1.00 0.00 O ATOM 90 CB GLN A 7 -3.029 -4.247 -6.123 1.00 0.00 C ATOM 91 CG GLN A 7 -3.305 -2.768 -6.421 1.00 0.00 C ATOM 92 CD GLN A 7 -3.537 -2.548 -7.910 1.00 0.00 C ATOM 93 OE1 GLN A 7 -4.673 -2.505 -8.372 1.00 0.00 O ATOM 94 NE2 GLN A 7 -2.462 -2.420 -8.684 1.00 0.00 N ATOM 0 H GLN A 7 -5.039 -3.952 -4.678 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.777 -5.660 -4.560 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -2.055 -4.512 -6.534 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.770 -4.855 -6.642 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -4.179 -2.437 -5.860 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -2.463 -2.162 -6.087 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -1.530 -2.460 -8.272 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -2.571 -2.282 -9.689 1.00 0.00 H new ATOM 103 N ALA A 8 -2.360 -2.641 -3.318 1.00 0.00 N ATOM 104 CA ALA A 8 -1.435 -1.854 -2.518 1.00 0.00 C ATOM 105 C ALA A 8 -1.111 -2.560 -1.202 1.00 0.00 C ATOM 106 O ALA A 8 0.062 -2.794 -0.913 1.00 0.00 O ATOM 107 CB ALA A 8 -1.976 -0.450 -2.291 1.00 0.00 C ATOM 0 H ALA A 8 -3.272 -2.207 -3.459 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.500 -1.757 -3.070 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.267 0.120 -1.690 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.118 0.045 -3.252 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.931 -0.508 -1.768 1.00 0.00 H new ATOM 113 N ILE A 9 -2.124 -2.930 -0.408 1.00 0.00 N ATOM 114 CA ILE A 9 -1.864 -3.702 0.809 1.00 0.00 C ATOM 115 C ILE A 9 -1.116 -4.994 0.431 1.00 0.00 C ATOM 116 O ILE A 9 -0.107 -5.341 1.047 1.00 0.00 O ATOM 117 CB ILE A 9 -3.135 -3.909 1.666 1.00 0.00 C ATOM 118 CG1 ILE A 9 -4.246 -4.691 0.955 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.638 -2.550 2.168 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.486 -4.910 1.830 1.00 0.00 C ATOM 0 H ILE A 9 -3.106 -2.713 -0.581 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.211 -3.136 1.473 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.852 -4.534 2.513 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.537 -4.156 0.051 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.856 -5.659 0.640 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.534 -2.694 2.772 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.865 -2.077 2.773 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.874 -1.912 1.316 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.234 -5.469 1.268 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.208 -5.472 2.722 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.899 -3.945 2.123 1.00 0.00 H new ATOM 132 N GLY A 10 -1.559 -5.645 -0.650 1.00 0.00 N ATOM 133 CA GLY A 10 -0.888 -6.765 -1.291 1.00 0.00 C ATOM 134 C GLY A 10 0.612 -6.530 -1.464 1.00 0.00 C ATOM 135 O GLY A 10 1.404 -7.409 -1.146 1.00 0.00 O ATOM 0 H GLY A 10 -2.430 -5.391 -1.116 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.045 -7.666 -0.698 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.339 -6.944 -2.267 1.00 0.00 H new ATOM 139 N LEU A 11 1.012 -5.358 -1.961 1.00 0.00 N ATOM 140 CA LEU A 11 2.407 -4.998 -2.181 1.00 0.00 C ATOM 141 C LEU A 11 3.189 -5.124 -0.872 1.00 0.00 C ATOM 142 O LEU A 11 4.135 -5.906 -0.781 1.00 0.00 O ATOM 143 CB LEU A 11 2.471 -3.573 -2.767 1.00 0.00 C ATOM 144 CG LEU A 11 3.756 -3.180 -3.512 1.00 0.00 C ATOM 145 CD1 LEU A 11 5.028 -3.416 -2.699 1.00 0.00 C ATOM 146 CD2 LEU A 11 3.835 -3.843 -4.889 1.00 0.00 C ATOM 0 H LEU A 11 0.359 -4.620 -2.226 1.00 0.00 H new ATOM 0 HA LEU A 11 2.869 -5.678 -2.897 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.632 -3.451 -3.452 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.323 -2.865 -1.952 1.00 0.00 H new ATOM 0 HG LEU A 11 3.695 -2.102 -3.662 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.896 -3.117 -3.286 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.989 -2.827 -1.783 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.108 -4.473 -2.447 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.757 -3.541 -5.386 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.823 -4.927 -4.772 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.981 -3.534 -5.491 1.00 0.00 H new ATOM 158 N LEU A 12 2.781 -4.366 0.152 1.00 0.00 N ATOM 159 CA LEU A 12 3.419 -4.379 1.464 1.00 0.00 C ATOM 160 C LEU A 12 3.523 -5.811 1.987 1.00 0.00 C ATOM 161 O LEU A 12 4.577 -6.216 2.486 1.00 0.00 O ATOM 162 CB LEU A 12 2.614 -3.531 2.465 1.00 0.00 C ATOM 163 CG LEU A 12 2.833 -2.013 2.366 1.00 0.00 C ATOM 164 CD1 LEU A 12 2.291 -1.404 1.070 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.144 -1.325 3.549 1.00 0.00 C ATOM 0 H LEU A 12 1.992 -3.723 0.088 1.00 0.00 H new ATOM 0 HA LEU A 12 4.418 -3.956 1.359 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.554 -3.738 2.321 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.868 -3.853 3.475 1.00 0.00 H new ATOM 0 HG LEU A 12 3.911 -1.852 2.377 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.479 -0.330 1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.789 -1.863 0.216 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.218 -1.585 1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.297 -0.248 3.483 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.076 -1.542 3.525 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.568 -1.695 4.482 1.00 0.00 H new ATOM 177 N ILE A 13 2.422 -6.560 1.897 1.00 0.00 N ATOM 178 CA ILE A 13 2.351 -7.920 2.407 1.00 0.00 C ATOM 179 C ILE A 13 3.344 -8.813 1.663 1.00 0.00 C ATOM 180 O ILE A 13 4.139 -9.513 2.286 1.00 0.00 O ATOM 181 CB ILE A 13 0.909 -8.441 2.284 1.00 0.00 C ATOM 182 CG1 ILE A 13 -0.055 -7.640 3.177 1.00 0.00 C ATOM 183 CG2 ILE A 13 0.837 -9.920 2.669 1.00 0.00 C ATOM 184 CD1 ILE A 13 -1.506 -7.765 2.702 1.00 0.00 C ATOM 0 H ILE A 13 1.556 -6.235 1.467 1.00 0.00 H new ATOM 0 HA ILE A 13 2.626 -7.934 3.462 1.00 0.00 H new ATOM 0 HB ILE A 13 0.608 -8.318 1.244 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.023 -7.994 4.205 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.238 -6.590 3.178 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.191 -10.271 2.576 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.480 -10.500 2.007 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.171 -10.044 3.699 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.155 -7.185 3.358 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.589 -7.387 1.683 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.808 -8.812 2.726 1.00 0.00 H new ATOM 196 N GLY A 14 3.296 -8.779 0.332 1.00 0.00 N ATOM 197 CA GLY A 14 4.157 -9.559 -0.535 1.00 0.00 C ATOM 198 C GLY A 14 5.616 -9.275 -0.214 1.00 0.00 C ATOM 199 O GLY A 14 6.381 -10.203 0.046 1.00 0.00 O ATOM 0 H GLY A 14 2.638 -8.191 -0.179 1.00 0.00 H new ATOM 0 HA2 GLY A 14 3.949 -10.621 -0.408 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.952 -9.317 -1.578 1.00 0.00 H new ATOM 203 N ILE A 15 5.993 -7.989 -0.196 1.00 0.00 N ATOM 204 CA ILE A 15 7.345 -7.591 0.162 1.00 0.00 C ATOM 205 C ILE A 15 7.706 -8.214 1.510 1.00 0.00 C ATOM 206 O ILE A 15 8.712 -8.917 1.622 1.00 0.00 O ATOM 207 CB ILE A 15 7.472 -6.052 0.121 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.813 -5.648 -1.324 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.525 -5.524 1.101 1.00 0.00 C ATOM 210 CD1 ILE A 15 8.002 -4.140 -1.508 1.00 0.00 C ATOM 0 H ILE A 15 5.374 -7.212 -0.427 1.00 0.00 H new ATOM 0 HA ILE A 15 8.070 -7.965 -0.561 1.00 0.00 H new ATOM 0 HB ILE A 15 6.527 -5.607 0.433 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.725 -6.161 -1.631 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.017 -5.990 -1.986 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.574 -4.437 1.032 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.253 -5.811 2.117 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.498 -5.948 0.852 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.240 -3.928 -2.550 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.083 -3.622 -1.233 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.817 -3.795 -0.872 1.00 0.00 H new ATOM 222 N PHE A 16 6.867 -7.978 2.522 1.00 0.00 N ATOM 223 CA PHE A 16 7.127 -8.465 3.861 1.00 0.00 C ATOM 224 C PHE A 16 7.391 -9.967 3.853 1.00 0.00 C ATOM 225 O PHE A 16 8.488 -10.411 4.188 1.00 0.00 O ATOM 226 CB PHE A 16 5.950 -8.124 4.779 1.00 0.00 C ATOM 227 CG PHE A 16 6.188 -8.484 6.228 1.00 0.00 C ATOM 228 CD1 PHE A 16 5.837 -9.757 6.710 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.843 -7.574 7.073 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.124 -10.105 8.039 1.00 0.00 C ATOM 231 CE2 PHE A 16 7.065 -7.895 8.422 1.00 0.00 C ATOM 232 CZ PHE A 16 6.704 -9.162 8.903 1.00 0.00 C ATOM 0 H PHE A 16 6.000 -7.449 2.429 1.00 0.00 H new ATOM 0 HA PHE A 16 8.022 -7.973 4.242 1.00 0.00 H new ATOM 0 HB2 PHE A 16 5.742 -7.056 4.708 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.061 -8.646 4.425 1.00 0.00 H new ATOM 0 HD1 PHE A 16 5.347 -10.466 6.059 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.177 -6.624 6.684 1.00 0.00 H new ATOM 0 HE1 PHE A 16 5.899 -11.099 8.397 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.512 -7.170 9.086 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.872 -9.413 9.940 1.00 0.00 H new ATOM 242 N HIS A 17 6.386 -10.757 3.465 1.00 0.00 N ATOM 243 CA HIS A 17 6.471 -12.192 3.652 1.00 0.00 C ATOM 244 C HIS A 17 7.465 -12.847 2.700 1.00 0.00 C ATOM 245 O HIS A 17 7.967 -13.921 3.016 1.00 0.00 O ATOM 246 CB HIS A 17 5.095 -12.866 3.646 1.00 0.00 C ATOM 247 CG HIS A 17 5.079 -14.113 4.501 1.00 0.00 C ATOM 248 ND1 HIS A 17 4.658 -15.369 4.122 1.00 0.00 N ATOM 249 CD2 HIS A 17 5.340 -14.159 5.845 1.00 0.00 C ATOM 250 CE1 HIS A 17 4.670 -16.144 5.221 1.00 0.00 C ATOM 251 NE2 HIS A 17 5.076 -15.454 6.301 1.00 0.00 N ATOM 0 H HIS A 17 5.524 -10.428 3.029 1.00 0.00 H new ATOM 0 HA HIS A 17 6.873 -12.351 4.653 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.345 -12.165 4.011 1.00 0.00 H new ATOM 0 HB3 HIS A 17 4.820 -13.123 2.623 1.00 0.00 H new ATOM 0 HD1 HIS A 17 4.387 -15.658 3.182 1.00 0.00 H new ATOM 0 HD2 HIS A 17 5.690 -13.335 6.449 1.00 0.00 H new ATOM 0 HE1 HIS A 17 4.389 -17.187 5.234 1.00 0.00 H new ATOM 259 N LYS A 18 7.793 -12.218 1.566 1.00 0.00 N ATOM 260 CA LYS A 18 8.901 -12.688 0.746 1.00 0.00 C ATOM 261 C LYS A 18 10.182 -12.645 1.586 1.00 0.00 C ATOM 262 O LYS A 18 10.875 -13.652 1.746 1.00 0.00 O ATOM 263 CB LYS A 18 9.024 -11.820 -0.516 1.00 0.00 C ATOM 264 CG LYS A 18 10.129 -12.324 -1.456 1.00 0.00 C ATOM 265 CD LYS A 18 10.318 -11.403 -2.669 1.00 0.00 C ATOM 266 CE LYS A 18 10.992 -10.079 -2.279 1.00 0.00 C ATOM 267 NZ LYS A 18 11.293 -9.260 -3.464 1.00 0.00 N ATOM 0 H LYS A 18 7.312 -11.395 1.204 1.00 0.00 H new ATOM 0 HA LYS A 18 8.727 -13.714 0.421 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.072 -11.814 -1.046 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.235 -10.790 -0.228 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.067 -12.396 -0.906 1.00 0.00 H new ATOM 0 HG3 LYS A 18 9.882 -13.329 -1.799 1.00 0.00 H new ATOM 0 HD2 LYS A 18 10.922 -11.911 -3.421 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.349 -11.198 -3.124 1.00 0.00 H new ATOM 0 HE2 LYS A 18 10.340 -9.522 -1.606 1.00 0.00 H new ATOM 0 HE3 LYS A 18 11.913 -10.285 -1.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 11.747 -8.373 -3.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 11.934 -9.783 -4.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 10.410 -9.044 -3.970 1.00 0.00 H new ATOM 281 N TYR A 19 10.492 -11.465 2.131 1.00 0.00 N ATOM 282 CA TYR A 19 11.686 -11.289 2.941 1.00 0.00 C ATOM 283 C TYR A 19 11.636 -12.149 4.205 1.00 0.00 C ATOM 284 O TYR A 19 12.664 -12.691 4.598 1.00 0.00 O ATOM 285 CB TYR A 19 11.940 -9.804 3.216 1.00 0.00 C ATOM 286 CG TYR A 19 12.699 -9.132 2.088 1.00 0.00 C ATOM 287 CD1 TYR A 19 14.092 -9.305 1.998 1.00 0.00 C ATOM 288 CD2 TYR A 19 12.014 -8.461 1.059 1.00 0.00 C ATOM 289 CE1 TYR A 19 14.781 -8.895 0.845 1.00 0.00 C ATOM 290 CE2 TYR A 19 12.704 -8.047 -0.092 1.00 0.00 C ATOM 291 CZ TYR A 19 14.077 -8.311 -0.219 1.00 0.00 C ATOM 292 OH TYR A 19 14.717 -8.019 -1.383 1.00 0.00 O ATOM 0 H TYR A 19 9.929 -10.622 2.022 1.00 0.00 H new ATOM 0 HA TYR A 19 12.548 -11.648 2.379 1.00 0.00 H new ATOM 0 HB2 TYR A 19 10.987 -9.296 3.363 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.504 -9.700 4.143 1.00 0.00 H new ATOM 0 HD1 TYR A 19 14.633 -9.754 2.818 1.00 0.00 H new ATOM 0 HD2 TYR A 19 10.956 -8.264 1.154 1.00 0.00 H new ATOM 0 HE1 TYR A 19 15.851 -9.029 0.777 1.00 0.00 H new ATOM 0 HE2 TYR A 19 12.179 -7.526 -0.879 1.00 0.00 H new ATOM 0 HH TYR A 19 14.085 -8.084 -2.129 1.00 0.00 H new ATOM 302 N SER A 20 10.467 -12.329 4.827 1.00 0.00 N ATOM 303 CA SER A 20 10.344 -13.302 5.903 1.00 0.00 C ATOM 304 C SER A 20 10.737 -14.688 5.399 1.00 0.00 C ATOM 305 O SER A 20 11.674 -15.282 5.920 1.00 0.00 O ATOM 306 CB SER A 20 8.928 -13.331 6.470 1.00 0.00 C ATOM 307 OG SER A 20 8.518 -12.037 6.856 1.00 0.00 O ATOM 0 H SER A 20 9.610 -11.822 4.606 1.00 0.00 H new ATOM 0 HA SER A 20 11.019 -13.004 6.706 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.240 -13.728 5.723 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.888 -14.001 7.328 1.00 0.00 H new ATOM 0 HG SER A 20 8.790 -11.870 7.783 1.00 0.00 H new ATOM 313 N GLY A 21 10.036 -15.182 4.375 1.00 0.00 N ATOM 314 CA GLY A 21 10.217 -16.497 3.778 1.00 0.00 C ATOM 315 C GLY A 21 11.688 -16.819 3.546 1.00 0.00 C ATOM 316 O GLY A 21 12.128 -17.931 3.830 1.00 0.00 O ATOM 0 H GLY A 21 9.294 -14.647 3.923 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.778 -17.254 4.428 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.682 -16.542 2.830 1.00 0.00 H new ATOM 398 N HIS A 27 5.472 -14.918 10.114 1.00 0.00 N ATOM 399 CA HIS A 27 5.016 -13.546 9.908 1.00 0.00 C ATOM 400 C HIS A 27 5.852 -12.556 10.736 1.00 0.00 C ATOM 401 O HIS A 27 5.306 -11.724 11.464 1.00 0.00 O ATOM 402 CB HIS A 27 3.513 -13.442 10.207 1.00 0.00 C ATOM 403 CG HIS A 27 2.637 -14.330 9.353 1.00 0.00 C ATOM 404 ND1 HIS A 27 3.004 -15.019 8.215 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.312 -14.594 9.580 1.00 0.00 C ATOM 406 CE1 HIS A 27 1.923 -15.688 7.783 1.00 0.00 C ATOM 407 NE2 HIS A 27 0.866 -15.463 8.580 1.00 0.00 N ATOM 0 HA HIS A 27 5.163 -13.273 8.863 1.00 0.00 H new ATOM 0 HB2 HIS A 27 3.347 -13.690 11.255 1.00 0.00 H new ATOM 0 HB3 HIS A 27 3.200 -12.407 10.071 1.00 0.00 H new ATOM 0 HD1 HIS A 27 3.927 -15.020 7.781 1.00 0.00 H new ATOM 0 HD2 HIS A 27 0.716 -14.200 10.390 1.00 0.00 H new ATOM 0 HE1 HIS A 27 1.906 -16.323 6.910 1.00 0.00 H new ATOM 415 N THR A 28 7.181 -12.621 10.607 1.00 0.00 N ATOM 416 CA THR A 28 8.114 -11.703 11.243 1.00 0.00 C ATOM 417 C THR A 28 9.287 -11.440 10.297 1.00 0.00 C ATOM 418 O THR A 28 9.549 -12.235 9.394 1.00 0.00 O ATOM 419 CB THR A 28 8.598 -12.227 12.606 1.00 0.00 C ATOM 420 OG1 THR A 28 9.302 -13.440 12.463 1.00 0.00 O ATOM 421 CG2 THR A 28 7.464 -12.448 13.610 1.00 0.00 C ATOM 0 H THR A 28 7.643 -13.334 10.042 1.00 0.00 H new ATOM 0 HA THR A 28 7.597 -10.764 11.442 1.00 0.00 H new ATOM 0 HB THR A 28 9.252 -11.446 12.996 1.00 0.00 H new ATOM 0 HG1 THR A 28 9.946 -13.533 13.196 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.876 -12.818 14.549 1.00 0.00 H new ATOM 0 HG22 THR A 28 6.946 -11.505 13.787 1.00 0.00 H new ATOM 0 HG23 THR A 28 6.761 -13.179 13.210 1.00 0.00 H new ATOM 429 N LEU A 29 9.982 -10.321 10.503 1.00 0.00 N ATOM 430 CA LEU A 29 11.252 -10.007 9.855 1.00 0.00 C ATOM 431 C LEU A 29 12.289 -9.751 10.940 1.00 0.00 C ATOM 432 O LEU A 29 12.019 -8.966 11.849 1.00 0.00 O ATOM 433 CB LEU A 29 11.134 -8.727 9.016 1.00 0.00 C ATOM 434 CG LEU A 29 10.366 -8.883 7.700 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.189 -7.493 7.082 1.00 0.00 C ATOM 436 CD2 LEU A 29 11.138 -9.748 6.703 1.00 0.00 C ATOM 0 H LEU A 29 9.668 -9.590 11.142 1.00 0.00 H new ATOM 0 HA LEU A 29 11.533 -10.839 9.210 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.644 -7.961 9.617 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.137 -8.363 8.793 1.00 0.00 H new ATOM 0 HG LEU A 29 9.409 -9.360 7.911 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.644 -7.579 6.142 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.630 -6.858 7.769 1.00 0.00 H new ATOM 0 HD13 LEU A 29 11.168 -7.051 6.894 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.565 -9.839 5.780 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.101 -9.285 6.488 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.299 -10.738 7.129 1.00 0.00 H new ATOM 448 N SER A 30 13.469 -10.377 10.851 1.00 0.00 N ATOM 449 CA SER A 30 14.582 -10.001 11.712 1.00 0.00 C ATOM 450 C SER A 30 15.307 -8.775 11.151 1.00 0.00 C ATOM 451 O SER A 30 15.063 -8.345 10.026 1.00 0.00 O ATOM 452 CB SER A 30 15.531 -11.173 11.979 1.00 0.00 C ATOM 453 OG SER A 30 16.413 -10.820 13.037 1.00 0.00 O ATOM 0 H SER A 30 13.670 -11.135 10.199 1.00 0.00 H new ATOM 0 HA SER A 30 14.174 -9.725 12.684 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.963 -12.065 12.243 1.00 0.00 H new ATOM 0 HB3 SER A 30 16.098 -11.411 11.079 1.00 0.00 H new ATOM 0 HG SER A 30 15.922 -10.313 13.717 1.00 0.00 H new ATOM 459 N LYS A 31 16.212 -8.220 11.956 1.00 0.00 N ATOM 460 CA LYS A 31 16.859 -6.936 11.732 1.00 0.00 C ATOM 461 C LYS A 31 17.571 -6.848 10.384 1.00 0.00 C ATOM 462 O LYS A 31 17.289 -5.965 9.575 1.00 0.00 O ATOM 463 CB LYS A 31 17.795 -6.597 12.904 1.00 0.00 C ATOM 464 CG LYS A 31 18.649 -7.738 13.492 1.00 0.00 C ATOM 465 CD LYS A 31 19.423 -7.255 14.729 1.00 0.00 C ATOM 466 CE LYS A 31 18.676 -7.507 16.047 1.00 0.00 C ATOM 467 NZ LYS A 31 17.331 -6.904 16.060 1.00 0.00 N ATOM 0 H LYS A 31 16.524 -8.673 12.815 1.00 0.00 H new ATOM 0 HA LYS A 31 16.073 -6.182 11.690 1.00 0.00 H new ATOM 0 HB2 LYS A 31 18.471 -5.807 12.576 1.00 0.00 H new ATOM 0 HB3 LYS A 31 17.188 -6.183 13.709 1.00 0.00 H new ATOM 0 HG2 LYS A 31 18.008 -8.577 13.763 1.00 0.00 H new ATOM 0 HG3 LYS A 31 19.348 -8.101 12.739 1.00 0.00 H new ATOM 0 HD2 LYS A 31 20.389 -7.759 14.764 1.00 0.00 H new ATOM 0 HD3 LYS A 31 19.623 -6.188 14.631 1.00 0.00 H new ATOM 0 HE2 LYS A 31 18.590 -8.581 16.212 1.00 0.00 H new ATOM 0 HE3 LYS A 31 19.259 -7.103 16.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 16.917 -7.000 17.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 17.400 -5.896 15.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 16.726 -7.390 15.368 1.00 0.00 H new ATOM 481 N LYS A 32 18.519 -7.749 10.138 1.00 0.00 N ATOM 482 CA LYS A 32 19.307 -7.685 8.914 1.00 0.00 C ATOM 483 C LYS A 32 18.450 -8.083 7.709 1.00 0.00 C ATOM 484 O LYS A 32 18.662 -7.576 6.610 1.00 0.00 O ATOM 485 CB LYS A 32 20.614 -8.472 9.081 1.00 0.00 C ATOM 486 CG LYS A 32 21.453 -8.551 7.795 1.00 0.00 C ATOM 487 CD LYS A 32 21.128 -9.801 6.957 1.00 0.00 C ATOM 488 CE LYS A 32 21.700 -9.692 5.539 1.00 0.00 C ATOM 489 NZ LYS A 32 23.167 -9.558 5.542 1.00 0.00 N ATOM 0 H LYS A 32 18.757 -8.521 10.761 1.00 0.00 H new ATOM 0 HA LYS A 32 19.619 -6.661 8.711 1.00 0.00 H new ATOM 0 HB2 LYS A 32 21.210 -8.007 9.866 1.00 0.00 H new ATOM 0 HB3 LYS A 32 20.380 -9.483 9.415 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.277 -7.659 7.194 1.00 0.00 H new ATOM 0 HG3 LYS A 32 22.512 -8.557 8.055 1.00 0.00 H new ATOM 0 HD2 LYS A 32 21.535 -10.685 7.448 1.00 0.00 H new ATOM 0 HD3 LYS A 32 20.047 -9.935 6.905 1.00 0.00 H new ATOM 0 HE2 LYS A 32 21.418 -10.575 4.966 1.00 0.00 H new ATOM 0 HE3 LYS A 32 21.259 -8.832 5.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.522 -9.607 4.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 23.431 -8.644 5.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 23.585 -10.329 6.101 1.00 0.00 H new ATOM 503 N GLU A 33 17.459 -8.959 7.900 1.00 0.00 N ATOM 504 CA GLU A 33 16.527 -9.298 6.836 1.00 0.00 C ATOM 505 C GLU A 33 15.734 -8.049 6.433 1.00 0.00 C ATOM 506 O GLU A 33 15.609 -7.732 5.252 1.00 0.00 O ATOM 507 CB GLU A 33 15.611 -10.441 7.290 1.00 0.00 C ATOM 508 CG GLU A 33 14.824 -11.030 6.113 1.00 0.00 C ATOM 509 CD GLU A 33 15.720 -11.817 5.160 1.00 0.00 C ATOM 510 OE1 GLU A 33 15.975 -13.001 5.463 1.00 0.00 O ATOM 511 OE2 GLU A 33 16.164 -11.208 4.162 1.00 0.00 O ATOM 0 H GLU A 33 17.287 -9.442 8.782 1.00 0.00 H new ATOM 0 HA GLU A 33 17.071 -9.645 5.958 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.208 -11.224 7.758 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.917 -10.074 8.046 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.038 -11.683 6.493 1.00 0.00 H new ATOM 0 HG3 GLU A 33 14.333 -10.225 5.567 1.00 0.00 H new ATOM 518 N LEU A 34 15.230 -7.315 7.427 1.00 0.00 N ATOM 519 CA LEU A 34 14.600 -6.025 7.215 1.00 0.00 C ATOM 520 C LEU A 34 15.572 -5.099 6.482 1.00 0.00 C ATOM 521 O LEU A 34 15.205 -4.488 5.480 1.00 0.00 O ATOM 522 CB LEU A 34 14.099 -5.470 8.559 1.00 0.00 C ATOM 523 CG LEU A 34 13.518 -4.044 8.536 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.606 -2.963 8.451 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.460 -3.877 7.435 1.00 0.00 C ATOM 0 H LEU A 34 15.251 -7.607 8.404 1.00 0.00 H new ATOM 0 HA LEU A 34 13.721 -6.116 6.576 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.334 -6.145 8.944 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.927 -5.490 9.267 1.00 0.00 H new ATOM 0 HG LEU A 34 13.016 -3.901 9.493 1.00 0.00 H new ATOM 0 HD11 LEU A 34 14.140 -1.978 8.438 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.265 -3.041 9.316 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.186 -3.102 7.539 1.00 0.00 H new ATOM 0 HD21 LEU A 34 12.075 -2.857 7.452 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.911 -4.078 6.463 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.642 -4.577 7.607 1.00 0.00 H new ATOM 537 N LYS A 35 16.826 -4.993 6.938 1.00 0.00 N ATOM 538 CA LYS A 35 17.792 -4.193 6.198 1.00 0.00 C ATOM 539 C LYS A 35 17.842 -4.643 4.735 1.00 0.00 C ATOM 540 O LYS A 35 17.797 -3.799 3.850 1.00 0.00 O ATOM 541 CB LYS A 35 19.182 -4.193 6.849 1.00 0.00 C ATOM 542 CG LYS A 35 20.113 -3.279 6.035 1.00 0.00 C ATOM 543 CD LYS A 35 21.528 -3.179 6.601 1.00 0.00 C ATOM 544 CE LYS A 35 21.582 -2.355 7.887 1.00 0.00 C ATOM 545 NZ LYS A 35 22.990 -2.115 8.256 1.00 0.00 N ATOM 0 H LYS A 35 17.181 -5.436 7.785 1.00 0.00 H new ATOM 0 HA LYS A 35 17.454 -3.157 6.226 1.00 0.00 H new ATOM 0 HB2 LYS A 35 19.116 -3.843 7.879 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.583 -5.206 6.882 1.00 0.00 H new ATOM 0 HG2 LYS A 35 20.167 -3.650 5.011 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.678 -2.280 5.990 1.00 0.00 H new ATOM 0 HD2 LYS A 35 21.910 -4.181 6.798 1.00 0.00 H new ATOM 0 HD3 LYS A 35 22.184 -2.729 5.856 1.00 0.00 H new ATOM 0 HE2 LYS A 35 21.065 -1.406 7.746 1.00 0.00 H new ATOM 0 HE3 LYS A 35 21.068 -2.882 8.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 23.131 -2.351 9.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 23.609 -2.711 7.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 23.224 -1.114 8.100 1.00 0.00 H new ATOM 559 N GLU A 36 17.919 -5.947 4.466 1.00 0.00 N ATOM 560 CA GLU A 36 17.943 -6.468 3.106 1.00 0.00 C ATOM 561 C GLU A 36 16.711 -5.999 2.317 1.00 0.00 C ATOM 562 O GLU A 36 16.837 -5.537 1.181 1.00 0.00 O ATOM 563 CB GLU A 36 18.063 -7.999 3.133 1.00 0.00 C ATOM 564 CG GLU A 36 18.666 -8.520 1.823 1.00 0.00 C ATOM 565 CD GLU A 36 18.713 -10.044 1.790 1.00 0.00 C ATOM 566 OE1 GLU A 36 19.329 -10.615 2.716 1.00 0.00 O ATOM 567 OE2 GLU A 36 18.141 -10.607 0.831 1.00 0.00 O ATOM 0 H GLU A 36 17.966 -6.668 5.186 1.00 0.00 H new ATOM 0 HA GLU A 36 18.818 -6.074 2.589 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.687 -8.305 3.973 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.080 -8.443 3.288 1.00 0.00 H new ATOM 0 HG2 GLU A 36 18.077 -8.156 0.981 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.674 -8.122 1.703 1.00 0.00 H new ATOM 574 N LEU A 37 15.525 -6.097 2.929 1.00 0.00 N ATOM 575 CA LEU A 37 14.277 -5.603 2.356 1.00 0.00 C ATOM 576 C LEU A 37 14.451 -4.156 1.917 1.00 0.00 C ATOM 577 O LEU A 37 14.182 -3.814 0.767 1.00 0.00 O ATOM 578 CB LEU A 37 13.132 -5.799 3.370 1.00 0.00 C ATOM 579 CG LEU A 37 11.736 -5.278 2.978 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.712 -5.969 3.887 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.551 -3.769 3.202 1.00 0.00 C ATOM 0 H LEU A 37 15.408 -6.527 3.846 1.00 0.00 H new ATOM 0 HA LEU A 37 14.011 -6.171 1.464 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.046 -6.865 3.578 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.422 -5.314 4.302 1.00 0.00 H new ATOM 0 HG LEU A 37 11.610 -5.485 1.915 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.710 -5.622 3.636 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.769 -7.048 3.744 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.929 -5.729 4.928 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.544 -3.478 2.903 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.698 -3.537 4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.280 -3.221 2.605 1.00 0.00 H new ATOM 593 N ILE A 38 14.914 -3.308 2.832 1.00 0.00 N ATOM 594 CA ILE A 38 15.089 -1.893 2.553 1.00 0.00 C ATOM 595 C ILE A 38 16.124 -1.692 1.452 1.00 0.00 C ATOM 596 O ILE A 38 15.841 -1.015 0.472 1.00 0.00 O ATOM 597 CB ILE A 38 15.424 -1.151 3.854 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.179 -1.248 4.750 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.808 0.316 3.607 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.330 -0.467 6.045 1.00 0.00 C ATOM 0 H ILE A 38 15.175 -3.583 3.779 1.00 0.00 H new ATOM 0 HA ILE A 38 14.161 -1.465 2.174 1.00 0.00 H new ATOM 0 HB ILE A 38 16.293 -1.607 4.329 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.313 -0.875 4.204 1.00 0.00 H new ATOM 0 HG13 ILE A 38 13.983 -2.295 4.982 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.036 0.798 4.558 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.684 0.359 2.960 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.977 0.834 3.128 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.422 -0.570 6.640 1.00 0.00 H new ATOM 0 HD12 ILE A 38 15.179 -0.856 6.608 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.498 0.586 5.818 1.00 0.00 H new ATOM 612 N GLN A 39 17.313 -2.276 1.590 1.00 0.00 N ATOM 613 CA GLN A 39 18.384 -2.157 0.614 1.00 0.00 C ATOM 614 C GLN A 39 17.897 -2.528 -0.784 1.00 0.00 C ATOM 615 O GLN A 39 18.288 -1.878 -1.752 1.00 0.00 O ATOM 616 CB GLN A 39 19.579 -3.024 1.032 1.00 0.00 C ATOM 617 CG GLN A 39 20.277 -2.527 2.307 1.00 0.00 C ATOM 618 CD GLN A 39 21.150 -1.302 2.062 1.00 0.00 C ATOM 619 OE1 GLN A 39 22.353 -1.422 1.863 1.00 0.00 O ATOM 620 NE2 GLN A 39 20.563 -0.111 2.083 1.00 0.00 N ATOM 0 H GLN A 39 17.558 -2.852 2.395 1.00 0.00 H new ATOM 0 HA GLN A 39 18.708 -1.117 0.582 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.239 -4.048 1.188 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.302 -3.050 0.217 1.00 0.00 H new ATOM 0 HG2 GLN A 39 19.524 -2.287 3.058 1.00 0.00 H new ATOM 0 HG3 GLN A 39 20.891 -3.329 2.716 1.00 0.00 H new ATOM 0 HE21 GLN A 39 19.559 -0.040 2.251 1.00 0.00 H new ATOM 0 HE22 GLN A 39 21.116 0.733 1.931 1.00 0.00 H new ATOM 629 N LYS A 40 17.051 -3.556 -0.909 1.00 0.00 N ATOM 630 CA LYS A 40 16.488 -3.884 -2.206 1.00 0.00 C ATOM 631 C LYS A 40 15.444 -2.848 -2.622 1.00 0.00 C ATOM 632 O LYS A 40 15.580 -2.216 -3.668 1.00 0.00 O ATOM 633 CB LYS A 40 15.925 -5.313 -2.182 1.00 0.00 C ATOM 634 CG LYS A 40 15.545 -5.833 -3.580 1.00 0.00 C ATOM 635 CD LYS A 40 16.627 -6.716 -4.221 1.00 0.00 C ATOM 636 CE LYS A 40 17.953 -5.978 -4.441 1.00 0.00 C ATOM 637 NZ LYS A 40 18.910 -6.810 -5.190 1.00 0.00 N ATOM 0 H LYS A 40 16.751 -4.158 -0.142 1.00 0.00 H new ATOM 0 HA LYS A 40 17.273 -3.853 -2.962 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.664 -5.981 -1.740 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.046 -5.340 -1.539 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.618 -6.403 -3.508 1.00 0.00 H new ATOM 0 HG3 LYS A 40 15.347 -4.983 -4.233 1.00 0.00 H new ATOM 0 HD2 LYS A 40 16.802 -7.584 -3.586 1.00 0.00 H new ATOM 0 HD3 LYS A 40 16.263 -7.090 -5.178 1.00 0.00 H new ATOM 0 HE2 LYS A 40 17.770 -5.051 -4.985 1.00 0.00 H new ATOM 0 HE3 LYS A 40 18.383 -5.703 -3.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 19.797 -6.284 -5.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 19.102 -7.683 -4.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 18.508 -7.051 -6.118 1.00 0.00 H new ATOM 651 N GLU A 41 14.385 -2.703 -1.828 1.00 0.00 N ATOM 652 CA GLU A 41 13.220 -1.922 -2.209 1.00 0.00 C ATOM 653 C GLU A 41 13.561 -0.433 -2.266 1.00 0.00 C ATOM 654 O GLU A 41 13.402 0.206 -3.303 1.00 0.00 O ATOM 655 CB GLU A 41 12.074 -2.235 -1.236 1.00 0.00 C ATOM 656 CG GLU A 41 10.823 -1.374 -1.462 1.00 0.00 C ATOM 657 CD GLU A 41 10.312 -1.418 -2.898 1.00 0.00 C ATOM 658 OE1 GLU A 41 10.219 -2.540 -3.440 1.00 0.00 O ATOM 659 OE2 GLU A 41 10.021 -0.324 -3.428 1.00 0.00 O ATOM 0 H GLU A 41 14.315 -3.126 -0.902 1.00 0.00 H new ATOM 0 HA GLU A 41 12.894 -2.194 -3.213 1.00 0.00 H new ATOM 0 HB2 GLU A 41 11.803 -3.286 -1.333 1.00 0.00 H new ATOM 0 HB3 GLU A 41 12.426 -2.089 -0.215 1.00 0.00 H new ATOM 0 HG2 GLU A 41 10.032 -1.711 -0.792 1.00 0.00 H new ATOM 0 HG3 GLU A 41 11.048 -0.341 -1.195 1.00 0.00 H new ATOM 666 N LEU A 42 14.021 0.119 -1.147 1.00 0.00 N ATOM 667 CA LEU A 42 14.440 1.507 -1.036 1.00 0.00 C ATOM 668 C LEU A 42 15.928 1.543 -1.376 1.00 0.00 C ATOM 669 O LEU A 42 16.775 1.640 -0.488 1.00 0.00 O ATOM 670 CB LEU A 42 14.181 2.072 0.375 1.00 0.00 C ATOM 671 CG LEU A 42 12.717 2.177 0.848 1.00 0.00 C ATOM 672 CD1 LEU A 42 11.769 2.679 -0.244 1.00 0.00 C ATOM 673 CD2 LEU A 42 12.195 0.872 1.457 1.00 0.00 C ATOM 0 H LEU A 42 14.114 -0.401 -0.274 1.00 0.00 H new ATOM 0 HA LEU A 42 13.865 2.133 -1.719 1.00 0.00 H new ATOM 0 HB2 LEU A 42 14.720 1.450 1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 42 14.621 3.068 0.423 1.00 0.00 H new ATOM 0 HG LEU A 42 12.731 2.928 1.638 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.754 2.731 0.151 1.00 0.00 H new ATOM 0 HD12 LEU A 42 12.083 3.671 -0.570 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.794 1.993 -1.091 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.160 1.006 1.772 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.248 0.077 0.714 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.805 0.604 2.320 1.00 0.00 H new ATOM 794 N ASP A 50 22.490 4.309 5.115 1.00 0.00 N ATOM 795 CA ASP A 50 22.483 3.090 5.914 1.00 0.00 C ATOM 796 C ASP A 50 22.486 3.399 7.417 1.00 0.00 C ATOM 797 O ASP A 50 21.818 2.710 8.182 1.00 0.00 O ATOM 798 CB ASP A 50 23.667 2.191 5.546 1.00 0.00 C ATOM 799 CG ASP A 50 23.619 0.887 6.337 1.00 0.00 C ATOM 800 OD1 ASP A 50 22.814 0.014 5.946 1.00 0.00 O ATOM 801 OD2 ASP A 50 24.378 0.786 7.324 1.00 0.00 O ATOM 0 HA ASP A 50 21.560 2.556 5.688 1.00 0.00 H new ATOM 0 HB2 ASP A 50 23.648 1.975 4.478 1.00 0.00 H new ATOM 0 HB3 ASP A 50 24.603 2.712 5.750 1.00 0.00 H new ATOM 806 N ALA A 51 23.195 4.453 7.841 1.00 0.00 N ATOM 807 CA ALA A 51 23.164 4.913 9.228 1.00 0.00 C ATOM 808 C ALA A 51 21.732 5.224 9.684 1.00 0.00 C ATOM 809 O ALA A 51 21.312 4.821 10.768 1.00 0.00 O ATOM 810 CB ALA A 51 24.062 6.144 9.371 1.00 0.00 C ATOM 0 H ALA A 51 23.801 5.005 7.234 1.00 0.00 H new ATOM 0 HA ALA A 51 23.538 4.116 9.871 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.042 6.491 10.404 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.084 5.883 9.095 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.701 6.936 8.715 1.00 0.00 H new ATOM 816 N GLU A 52 20.965 5.928 8.848 1.00 0.00 N ATOM 817 CA GLU A 52 19.559 6.186 9.116 1.00 0.00 C ATOM 818 C GLU A 52 18.810 4.855 9.126 1.00 0.00 C ATOM 819 O GLU A 52 18.007 4.600 10.023 1.00 0.00 O ATOM 820 CB GLU A 52 18.966 7.140 8.070 1.00 0.00 C ATOM 821 CG GLU A 52 19.764 8.444 7.940 1.00 0.00 C ATOM 822 CD GLU A 52 19.120 9.393 6.934 1.00 0.00 C ATOM 823 OE1 GLU A 52 18.960 8.962 5.769 1.00 0.00 O ATOM 824 OE2 GLU A 52 18.799 10.528 7.342 1.00 0.00 O ATOM 0 H GLU A 52 21.303 6.330 7.974 1.00 0.00 H new ATOM 0 HA GLU A 52 19.457 6.669 10.088 1.00 0.00 H new ATOM 0 HB2 GLU A 52 18.936 6.639 7.102 1.00 0.00 H new ATOM 0 HB3 GLU A 52 17.936 7.374 8.340 1.00 0.00 H new ATOM 0 HG2 GLU A 52 19.828 8.932 8.913 1.00 0.00 H new ATOM 0 HG3 GLU A 52 20.784 8.219 7.628 1.00 0.00 H new ATOM 831 N ILE A 53 19.085 4.002 8.133 1.00 0.00 N ATOM 832 CA ILE A 53 18.439 2.702 8.035 1.00 0.00 C ATOM 833 C ILE A 53 18.624 1.892 9.318 1.00 0.00 C ATOM 834 O ILE A 53 17.659 1.286 9.763 1.00 0.00 O ATOM 835 CB ILE A 53 18.854 1.916 6.778 1.00 0.00 C ATOM 836 CG1 ILE A 53 18.596 2.697 5.475 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.124 0.566 6.717 1.00 0.00 C ATOM 838 CD1 ILE A 53 17.236 3.401 5.396 1.00 0.00 C ATOM 0 H ILE A 53 19.753 4.196 7.387 1.00 0.00 H new ATOM 0 HA ILE A 53 17.372 2.890 7.920 1.00 0.00 H new ATOM 0 HB ILE A 53 19.929 1.753 6.859 1.00 0.00 H new ATOM 0 HG12 ILE A 53 19.381 3.443 5.356 1.00 0.00 H new ATOM 0 HG13 ILE A 53 18.680 2.008 4.634 1.00 0.00 H new ATOM 0 HG21 ILE A 53 18.431 0.026 5.821 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.374 -0.023 7.599 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.048 0.735 6.687 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.151 3.922 4.442 1.00 0.00 H new ATOM 0 HD12 ILE A 53 16.439 2.662 5.478 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.150 4.120 6.211 1.00 0.00 H new ATOM 850 N VAL A 54 19.810 1.862 9.937 1.00 0.00 N ATOM 851 CA VAL A 54 19.962 1.103 11.178 1.00 0.00 C ATOM 852 C VAL A 54 19.138 1.690 12.329 1.00 0.00 C ATOM 853 O VAL A 54 18.529 0.936 13.086 1.00 0.00 O ATOM 854 CB VAL A 54 21.419 0.800 11.558 1.00 0.00 C ATOM 855 CG1 VAL A 54 21.965 -0.284 10.622 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.338 2.018 11.579 1.00 0.00 C ATOM 0 H VAL A 54 20.651 2.338 9.611 1.00 0.00 H new ATOM 0 HA VAL A 54 19.535 0.122 10.969 1.00 0.00 H new ATOM 0 HB VAL A 54 21.407 0.448 12.589 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.999 -0.505 10.885 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.364 -1.188 10.722 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.920 0.069 9.592 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.346 1.709 11.857 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.359 2.475 10.590 1.00 0.00 H new ATOM 0 HG23 VAL A 54 21.967 2.741 12.305 1.00 0.00 H new ATOM 866 N LYS A 55 19.068 3.019 12.460 1.00 0.00 N ATOM 867 CA LYS A 55 18.192 3.628 13.459 1.00 0.00 C ATOM 868 C LYS A 55 16.740 3.211 13.196 1.00 0.00 C ATOM 869 O LYS A 55 16.050 2.702 14.077 1.00 0.00 O ATOM 870 CB LYS A 55 18.375 5.154 13.457 1.00 0.00 C ATOM 871 CG LYS A 55 17.420 5.898 14.405 1.00 0.00 C ATOM 872 CD LYS A 55 17.447 5.409 15.863 1.00 0.00 C ATOM 873 CE LYS A 55 18.841 5.453 16.505 1.00 0.00 C ATOM 874 NZ LYS A 55 19.422 6.807 16.468 1.00 0.00 N ATOM 0 H LYS A 55 19.599 3.682 11.896 1.00 0.00 H new ATOM 0 HA LYS A 55 18.458 3.274 14.455 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.403 5.387 13.736 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.228 5.526 12.443 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.668 6.959 14.388 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.404 5.802 14.023 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.765 6.020 16.454 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.072 4.386 15.901 1.00 0.00 H new ATOM 0 HE2 LYS A 55 18.775 5.115 17.539 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.502 4.760 15.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.332 6.808 16.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 19.572 7.094 15.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 18.772 7.476 16.928 1.00 0.00 H new ATOM 888 N LEU A 56 16.287 3.400 11.958 1.00 0.00 N ATOM 889 CA LEU A 56 14.967 2.988 11.503 1.00 0.00 C ATOM 890 C LEU A 56 14.718 1.498 11.788 1.00 0.00 C ATOM 891 O LEU A 56 13.650 1.119 12.264 1.00 0.00 O ATOM 892 CB LEU A 56 14.859 3.379 10.023 1.00 0.00 C ATOM 893 CG LEU A 56 13.734 2.689 9.245 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.171 3.660 8.201 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.272 1.460 8.508 1.00 0.00 C ATOM 0 H LEU A 56 16.841 3.853 11.231 1.00 0.00 H new ATOM 0 HA LEU A 56 14.174 3.496 12.052 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.715 4.457 9.959 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.807 3.154 9.535 1.00 0.00 H new ATOM 0 HG LEU A 56 12.960 2.386 9.950 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.370 3.172 7.645 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.779 4.545 8.702 1.00 0.00 H new ATOM 0 HD13 LEU A 56 13.963 3.954 7.513 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.461 0.980 7.960 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.051 1.767 7.809 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.688 0.757 9.229 1.00 0.00 H new ATOM 907 N MET A 57 15.706 0.649 11.517 1.00 0.00 N ATOM 908 CA MET A 57 15.639 -0.785 11.733 1.00 0.00 C ATOM 909 C MET A 57 15.470 -1.066 13.222 1.00 0.00 C ATOM 910 O MET A 57 14.647 -1.901 13.586 1.00 0.00 O ATOM 911 CB MET A 57 16.880 -1.451 11.122 1.00 0.00 C ATOM 912 CG MET A 57 17.064 -2.921 11.510 1.00 0.00 C ATOM 913 SD MET A 57 17.825 -3.211 13.131 1.00 0.00 S ATOM 914 CE MET A 57 19.509 -2.612 12.876 1.00 0.00 C ATOM 0 H MET A 57 16.599 0.953 11.130 1.00 0.00 H new ATOM 0 HA MET A 57 14.772 -1.216 11.232 1.00 0.00 H new ATOM 0 HB2 MET A 57 16.818 -1.379 10.036 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.765 -0.893 11.429 1.00 0.00 H new ATOM 0 HG2 MET A 57 16.089 -3.408 11.493 1.00 0.00 H new ATOM 0 HG3 MET A 57 17.675 -3.406 10.749 1.00 0.00 H new ATOM 0 HE1 MET A 57 20.148 -2.968 13.684 1.00 0.00 H new ATOM 0 HE2 MET A 57 19.887 -2.984 11.924 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.510 -1.522 12.866 1.00 0.00 H new ATOM 924 N ASP A 58 16.205 -0.359 14.084 1.00 0.00 N ATOM 925 CA ASP A 58 15.988 -0.450 15.519 1.00 0.00 C ATOM 926 C ASP A 58 14.544 -0.063 15.846 1.00 0.00 C ATOM 927 O ASP A 58 13.851 -0.783 16.559 1.00 0.00 O ATOM 928 CB ASP A 58 17.002 0.410 16.280 1.00 0.00 C ATOM 929 CG ASP A 58 16.785 0.299 17.785 1.00 0.00 C ATOM 930 OD1 ASP A 58 17.373 -0.632 18.377 1.00 0.00 O ATOM 931 OD2 ASP A 58 16.040 1.151 18.316 1.00 0.00 O ATOM 0 H ASP A 58 16.952 0.279 13.809 1.00 0.00 H new ATOM 0 HA ASP A 58 16.143 -1.479 15.843 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.015 0.093 16.030 1.00 0.00 H new ATOM 0 HB3 ASP A 58 16.908 1.451 15.970 1.00 0.00 H new ATOM 936 N ASP A 59 14.070 1.058 15.299 1.00 0.00 N ATOM 937 CA ASP A 59 12.712 1.540 15.547 1.00 0.00 C ATOM 938 C ASP A 59 11.653 0.522 15.104 1.00 0.00 C ATOM 939 O ASP A 59 10.622 0.387 15.761 1.00 0.00 O ATOM 940 CB ASP A 59 12.473 2.901 14.878 1.00 0.00 C ATOM 941 CG ASP A 59 13.462 3.984 15.308 1.00 0.00 C ATOM 942 OD1 ASP A 59 13.822 3.998 16.505 1.00 0.00 O ATOM 943 OD2 ASP A 59 13.826 4.797 14.430 1.00 0.00 O ATOM 0 H ASP A 59 14.614 1.654 14.675 1.00 0.00 H new ATOM 0 HA ASP A 59 12.612 1.669 16.625 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.531 2.778 13.796 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.461 3.235 15.107 1.00 0.00 H new ATOM 948 N LEU A 60 11.895 -0.193 14.001 1.00 0.00 N ATOM 949 CA LEU A 60 11.074 -1.323 13.576 1.00 0.00 C ATOM 950 C LEU A 60 11.189 -2.470 14.598 1.00 0.00 C ATOM 951 O LEU A 60 10.193 -2.861 15.211 1.00 0.00 O ATOM 952 CB LEU A 60 11.485 -1.761 12.153 1.00 0.00 C ATOM 953 CG LEU A 60 10.808 -0.932 11.042 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.670 -0.854 9.779 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.471 -1.553 10.612 1.00 0.00 C ATOM 0 H LEU A 60 12.676 0.001 13.374 1.00 0.00 H new ATOM 0 HA LEU A 60 10.025 -1.028 13.537 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.567 -1.676 12.052 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.234 -2.813 12.017 1.00 0.00 H new ATOM 0 HG LEU A 60 10.662 0.060 11.470 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.155 -0.261 9.023 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.625 -0.386 10.019 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.845 -1.859 9.395 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.022 -0.943 9.828 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.643 -2.561 10.234 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.798 -1.597 11.468 1.00 0.00 H new ATOM 967 N ASP A 61 12.397 -3.022 14.779 1.00 0.00 N ATOM 968 CA ASP A 61 12.633 -4.217 15.590 1.00 0.00 C ATOM 969 C ASP A 61 12.234 -4.040 17.054 1.00 0.00 C ATOM 970 O ASP A 61 11.911 -5.028 17.708 1.00 0.00 O ATOM 971 CB ASP A 61 14.042 -4.807 15.390 1.00 0.00 C ATOM 972 CG ASP A 61 15.196 -4.115 16.121 1.00 0.00 C ATOM 973 OD1 ASP A 61 14.967 -3.508 17.187 1.00 0.00 O ATOM 974 OD2 ASP A 61 16.327 -4.245 15.607 1.00 0.00 O ATOM 0 H ASP A 61 13.246 -2.644 14.359 1.00 0.00 H new ATOM 0 HA ASP A 61 11.951 -4.978 15.210 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.020 -5.851 15.704 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.264 -4.799 14.323 1.00 0.00 H new ATOM 979 N ARG A 62 12.210 -2.793 17.541 1.00 0.00 N ATOM 980 CA ARG A 62 11.650 -2.348 18.813 1.00 0.00 C ATOM 981 C ARG A 62 10.518 -3.269 19.274 1.00 0.00 C ATOM 982 O ARG A 62 10.523 -3.747 20.406 1.00 0.00 O ATOM 983 CB ARG A 62 11.107 -0.937 18.567 1.00 0.00 C ATOM 984 CG ARG A 62 10.407 -0.264 19.754 1.00 0.00 C ATOM 985 CD ARG A 62 9.226 0.571 19.240 1.00 0.00 C ATOM 986 NE ARG A 62 8.042 -0.267 18.982 1.00 0.00 N ATOM 987 CZ ARG A 62 7.523 -0.622 17.794 1.00 0.00 C ATOM 988 NH1 ARG A 62 8.144 -0.364 16.636 1.00 0.00 N ATOM 989 NH2 ARG A 62 6.342 -1.253 17.777 1.00 0.00 N ATOM 0 H ARG A 62 12.611 -2.017 17.015 1.00 0.00 H new ATOM 0 HA ARG A 62 12.410 -2.363 19.595 1.00 0.00 H new ATOM 0 HB2 ARG A 62 11.935 -0.301 18.252 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.404 -0.981 17.735 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.055 -1.018 20.458 1.00 0.00 H new ATOM 0 HG3 ARG A 62 11.110 0.372 20.292 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.977 1.339 19.972 1.00 0.00 H new ATOM 0 HD3 ARG A 62 9.515 1.086 18.324 1.00 0.00 H new ATOM 0 HE ARG A 62 7.557 -0.621 19.806 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.043 0.118 16.636 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.718 -0.649 15.754 1.00 0.00 H new ATOM 0 HH21 ARG A 62 5.858 -1.453 18.652 1.00 0.00 H new ATOM 0 HH22 ARG A 62 5.926 -1.533 16.889 1.00 0.00 H new ATOM 1003 N ASN A 63 9.566 -3.517 18.367 1.00 0.00 N ATOM 1004 CA ASN A 63 8.438 -4.417 18.549 1.00 0.00 C ATOM 1005 C ASN A 63 8.784 -5.682 19.328 1.00 0.00 C ATOM 1006 O ASN A 63 8.062 -6.026 20.262 1.00 0.00 O ATOM 1007 CB ASN A 63 7.878 -4.770 17.168 1.00 0.00 C ATOM 1008 CG ASN A 63 6.813 -5.869 17.147 1.00 0.00 C ATOM 1009 OD1 ASN A 63 6.545 -6.415 16.085 1.00 0.00 O ATOM 1010 ND2 ASN A 63 6.161 -6.207 18.258 1.00 0.00 N ATOM 0 H ASN A 63 9.567 -3.073 17.449 1.00 0.00 H new ATOM 0 HA ASN A 63 7.692 -3.901 19.153 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.453 -3.868 16.727 1.00 0.00 H new ATOM 0 HB3 ASN A 63 8.705 -5.078 16.528 1.00 0.00 H new ATOM 0 HD21 ASN A 63 5.435 -6.923 18.226 1.00 0.00 H new ATOM 0 HD22 ASN A 63 6.387 -5.750 19.141 1.00 0.00 H new ATOM 1017 N LYS A 64 9.808 -6.409 18.887 1.00 0.00 N ATOM 1018 CA LYS A 64 10.172 -7.700 19.451 1.00 0.00 C ATOM 1019 C LYS A 64 11.682 -7.906 19.320 1.00 0.00 C ATOM 1020 O LYS A 64 12.141 -8.970 18.903 1.00 0.00 O ATOM 1021 CB LYS A 64 9.325 -8.812 18.797 1.00 0.00 C ATOM 1022 CG LYS A 64 8.942 -9.943 19.765 1.00 0.00 C ATOM 1023 CD LYS A 64 10.155 -10.721 20.294 1.00 0.00 C ATOM 1024 CE LYS A 64 9.744 -11.885 21.205 1.00 0.00 C ATOM 1025 NZ LYS A 64 8.994 -12.922 20.475 1.00 0.00 N ATOM 0 H LYS A 64 10.412 -6.113 18.121 1.00 0.00 H new ATOM 0 HA LYS A 64 9.948 -7.738 20.517 1.00 0.00 H new ATOM 0 HB2 LYS A 64 8.416 -8.372 18.388 1.00 0.00 H new ATOM 0 HB3 LYS A 64 9.880 -9.234 17.959 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.393 -9.522 20.607 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.268 -10.634 19.258 1.00 0.00 H new ATOM 0 HD2 LYS A 64 10.732 -11.106 19.453 1.00 0.00 H new ATOM 0 HD3 LYS A 64 10.807 -10.043 20.845 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.635 -12.328 21.650 1.00 0.00 H new ATOM 0 HE3 LYS A 64 9.133 -11.505 22.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 8.898 -13.767 21.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 8.049 -12.561 20.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 9.504 -13.171 19.604 1.00 0.00 H new ATOM 1039 N ASP A 65 12.450 -6.891 19.734 1.00 0.00 N ATOM 1040 CA ASP A 65 13.906 -6.874 19.879 1.00 0.00 C ATOM 1041 C ASP A 65 14.673 -7.448 18.680 1.00 0.00 C ATOM 1042 O ASP A 65 15.232 -6.708 17.878 1.00 0.00 O ATOM 1043 CB ASP A 65 14.337 -7.465 21.237 1.00 0.00 C ATOM 1044 CG ASP A 65 13.702 -8.814 21.579 1.00 0.00 C ATOM 1045 OD1 ASP A 65 14.209 -9.840 21.071 1.00 0.00 O ATOM 1046 OD2 ASP A 65 12.708 -8.801 22.336 1.00 0.00 O ATOM 0 H ASP A 65 12.037 -5.996 19.995 1.00 0.00 H new ATOM 0 HA ASP A 65 14.201 -5.825 19.879 1.00 0.00 H new ATOM 0 HB2 ASP A 65 15.421 -7.578 21.241 1.00 0.00 H new ATOM 0 HB3 ASP A 65 14.088 -6.752 22.023 1.00 0.00 H new ATOM 1051 N GLN A 66 14.736 -8.771 18.578 1.00 0.00 N ATOM 1052 CA GLN A 66 15.356 -9.506 17.489 1.00 0.00 C ATOM 1053 C GLN A 66 14.601 -9.297 16.173 1.00 0.00 C ATOM 1054 O GLN A 66 15.220 -9.364 15.106 1.00 0.00 O ATOM 1055 CB GLN A 66 15.381 -10.992 17.864 1.00 0.00 C ATOM 1056 CG GLN A 66 16.387 -11.262 18.993 1.00 0.00 C ATOM 1057 CD GLN A 66 16.044 -12.544 19.740 1.00 0.00 C ATOM 1058 OE1 GLN A 66 16.617 -13.597 19.486 1.00 0.00 O ATOM 1059 NE2 GLN A 66 15.100 -12.464 20.673 1.00 0.00 N ATOM 0 H GLN A 66 14.337 -9.386 19.287 1.00 0.00 H new ATOM 0 HA GLN A 66 16.371 -9.139 17.337 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.386 -11.308 18.177 1.00 0.00 H new ATOM 0 HB3 GLN A 66 15.644 -11.586 16.989 1.00 0.00 H new ATOM 0 HG2 GLN A 66 17.392 -11.337 18.578 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.391 -10.423 19.688 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.642 -11.572 20.860 1.00 0.00 H new ATOM 0 HE22 GLN A 66 14.834 -13.295 21.202 1.00 0.00 H new ATOM 1068 N GLU A 67 13.275 -9.104 16.238 1.00 0.00 N ATOM 1069 CA GLU A 67 12.419 -9.054 15.059 1.00 0.00 C ATOM 1070 C GLU A 67 11.311 -8.007 15.167 1.00 0.00 C ATOM 1071 O GLU A 67 10.992 -7.529 16.253 1.00 0.00 O ATOM 1072 CB GLU A 67 11.779 -10.431 14.813 1.00 0.00 C ATOM 1073 CG GLU A 67 12.778 -11.596 14.806 1.00 0.00 C ATOM 1074 CD GLU A 67 12.182 -12.838 14.153 1.00 0.00 C ATOM 1075 OE1 GLU A 67 11.046 -13.201 14.532 1.00 0.00 O ATOM 1076 OE2 GLU A 67 12.864 -13.394 13.265 1.00 0.00 O ATOM 0 H GLU A 67 12.771 -8.979 17.116 1.00 0.00 H new ATOM 0 HA GLU A 67 13.061 -8.771 14.225 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.030 -10.614 15.583 1.00 0.00 H new ATOM 0 HB3 GLU A 67 11.255 -10.410 13.857 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.680 -11.300 14.271 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.075 -11.828 15.829 1.00 0.00 H new ATOM 1083 N VAL A 68 10.704 -7.702 14.015 1.00 0.00 N ATOM 1084 CA VAL A 68 9.475 -6.930 13.884 1.00 0.00 C ATOM 1085 C VAL A 68 8.418 -7.849 13.267 1.00 0.00 C ATOM 1086 O VAL A 68 8.730 -8.643 12.379 1.00 0.00 O ATOM 1087 CB VAL A 68 9.713 -5.652 13.053 1.00 0.00 C ATOM 1088 CG1 VAL A 68 10.150 -5.925 11.609 1.00 0.00 C ATOM 1089 CG2 VAL A 68 8.470 -4.754 13.048 1.00 0.00 C ATOM 0 H VAL A 68 11.076 -8.002 13.114 1.00 0.00 H new ATOM 0 HA VAL A 68 9.124 -6.585 14.857 1.00 0.00 H new ATOM 0 HB VAL A 68 10.539 -5.141 13.547 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.298 -4.979 11.088 1.00 0.00 H new ATOM 0 HG12 VAL A 68 11.084 -6.487 11.612 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.380 -6.503 11.099 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.668 -3.861 12.455 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.630 -5.298 12.616 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.227 -4.463 14.070 1.00 0.00 H new ATOM 1099 N ASN A 69 7.174 -7.770 13.746 1.00 0.00 N ATOM 1100 CA ASN A 69 6.043 -8.504 13.200 1.00 0.00 C ATOM 1101 C ASN A 69 5.321 -7.651 12.162 1.00 0.00 C ATOM 1102 O ASN A 69 5.315 -6.423 12.237 1.00 0.00 O ATOM 1103 CB ASN A 69 5.067 -8.903 14.321 1.00 0.00 C ATOM 1104 CG ASN A 69 3.689 -9.295 13.781 1.00 0.00 C ATOM 1105 OD1 ASN A 69 2.743 -8.518 13.864 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.561 -10.458 13.150 1.00 0.00 N ATOM 0 H ASN A 69 6.926 -7.180 14.540 1.00 0.00 H new ATOM 0 HA ASN A 69 6.415 -9.411 12.723 1.00 0.00 H new ATOM 0 HB2 ASN A 69 5.485 -9.738 14.883 1.00 0.00 H new ATOM 0 HB3 ASN A 69 4.958 -8.072 15.018 1.00 0.00 H new ATOM 0 HD21 ASN A 69 2.668 -10.714 12.728 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.355 -11.095 13.088 1.00 0.00 H new ATOM 1113 N PHE A 70 4.663 -8.338 11.229 1.00 0.00 N ATOM 1114 CA PHE A 70 3.851 -7.771 10.171 1.00 0.00 C ATOM 1115 C PHE A 70 3.010 -6.567 10.618 1.00 0.00 C ATOM 1116 O PHE A 70 3.086 -5.505 10.000 1.00 0.00 O ATOM 1117 CB PHE A 70 2.976 -8.887 9.595 1.00 0.00 C ATOM 1118 CG PHE A 70 2.022 -8.383 8.544 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.530 -7.928 7.315 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.689 -8.113 8.899 1.00 0.00 C ATOM 1121 CE1 PHE A 70 1.697 -7.228 6.428 1.00 0.00 C ATOM 1122 CE2 PHE A 70 -0.137 -7.404 8.018 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.362 -6.970 6.779 1.00 0.00 C ATOM 0 H PHE A 70 4.688 -9.357 11.195 1.00 0.00 H new ATOM 0 HA PHE A 70 4.515 -7.372 9.405 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.613 -9.659 9.163 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.411 -9.355 10.401 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.561 -8.117 7.053 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.303 -8.452 9.849 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.082 -6.889 5.478 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.160 -7.191 8.292 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.282 -6.437 6.095 1.00 0.00 H new ATOM 1133 N GLN A 71 2.211 -6.701 11.681 1.00 0.00 N ATOM 1134 CA GLN A 71 1.325 -5.615 12.091 1.00 0.00 C ATOM 1135 C GLN A 71 2.138 -4.352 12.388 1.00 0.00 C ATOM 1136 O GLN A 71 1.802 -3.256 11.941 1.00 0.00 O ATOM 1137 CB GLN A 71 0.502 -6.044 13.310 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.585 -5.010 13.635 1.00 0.00 C ATOM 1139 CD GLN A 71 -1.332 -5.380 14.909 1.00 0.00 C ATOM 1140 OE1 GLN A 71 -2.429 -5.926 14.858 1.00 0.00 O ATOM 1141 NE2 GLN A 71 -0.743 -5.088 16.065 1.00 0.00 N ATOM 0 H GLN A 71 2.161 -7.537 12.263 1.00 0.00 H new ATOM 0 HA GLN A 71 0.636 -5.387 11.278 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.041 -7.013 13.119 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.159 -6.168 14.171 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.132 -4.025 13.749 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.288 -4.943 12.804 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.170 -4.634 16.072 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.204 -5.319 16.945 1.00 0.00 H new ATOM 1150 N GLU A 72 3.224 -4.516 13.144 1.00 0.00 N ATOM 1151 CA GLU A 72 4.043 -3.394 13.564 1.00 0.00 C ATOM 1152 C GLU A 72 4.841 -2.846 12.384 1.00 0.00 C ATOM 1153 O GLU A 72 5.077 -1.644 12.312 1.00 0.00 O ATOM 1154 CB GLU A 72 4.911 -3.788 14.761 1.00 0.00 C ATOM 1155 CG GLU A 72 4.051 -4.307 15.927 1.00 0.00 C ATOM 1156 CD GLU A 72 2.912 -3.362 16.297 1.00 0.00 C ATOM 1157 OE1 GLU A 72 3.240 -2.234 16.726 1.00 0.00 O ATOM 1158 OE2 GLU A 72 1.745 -3.784 16.136 1.00 0.00 O ATOM 0 H GLU A 72 3.553 -5.423 13.476 1.00 0.00 H new ATOM 0 HA GLU A 72 3.405 -2.579 13.904 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.622 -4.557 14.460 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.493 -2.927 15.090 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.636 -5.279 15.660 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.686 -4.460 16.799 1.00 0.00 H new ATOM 1165 N TYR A 73 5.224 -3.710 11.442 1.00 0.00 N ATOM 1166 CA TYR A 73 5.770 -3.280 10.163 1.00 0.00 C ATOM 1167 C TYR A 73 4.770 -2.345 9.469 1.00 0.00 C ATOM 1168 O TYR A 73 5.150 -1.245 9.072 1.00 0.00 O ATOM 1169 CB TYR A 73 6.153 -4.507 9.325 1.00 0.00 C ATOM 1170 CG TYR A 73 6.154 -4.313 7.820 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.331 -3.902 7.167 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.032 -4.706 7.061 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.408 -3.950 5.764 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.098 -4.708 5.658 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.296 -4.361 5.010 1.00 0.00 C ATOM 1176 OH TYR A 73 6.409 -4.491 3.658 1.00 0.00 O ATOM 0 H TYR A 73 5.163 -4.723 11.548 1.00 0.00 H new ATOM 0 HA TYR A 73 6.686 -2.707 10.304 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.147 -4.834 9.630 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.464 -5.316 9.566 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.174 -3.550 7.743 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.122 -5.006 7.559 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.324 -3.670 5.265 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.228 -4.976 5.077 1.00 0.00 H new ATOM 0 HH TYR A 73 5.728 -5.116 3.331 1.00 0.00 H new ATOM 1186 N ILE A 74 3.498 -2.743 9.350 1.00 0.00 N ATOM 1187 CA ILE A 74 2.477 -1.882 8.755 1.00 0.00 C ATOM 1188 C ILE A 74 2.385 -0.556 9.526 1.00 0.00 C ATOM 1189 O ILE A 74 2.514 0.510 8.923 1.00 0.00 O ATOM 1190 CB ILE A 74 1.110 -2.588 8.645 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.128 -3.856 7.770 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.056 -1.603 8.117 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.207 -3.602 6.261 1.00 0.00 C ATOM 0 H ILE A 74 3.155 -3.653 9.658 1.00 0.00 H new ATOM 0 HA ILE A 74 2.780 -1.658 7.732 1.00 0.00 H new ATOM 0 HB ILE A 74 0.856 -2.919 9.652 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.979 -4.470 8.065 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.229 -4.436 7.979 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.907 -2.107 8.041 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -0.029 -0.759 8.802 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.355 -1.243 7.133 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.214 -4.555 5.732 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.343 -3.018 5.945 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.120 -3.053 6.032 1.00 0.00 H new ATOM 1205 N THR A 75 2.181 -0.597 10.849 1.00 0.00 N ATOM 1206 CA THR A 75 2.138 0.612 11.675 1.00 0.00 C ATOM 1207 C THR A 75 3.344 1.512 11.401 1.00 0.00 C ATOM 1208 O THR A 75 3.197 2.714 11.184 1.00 0.00 O ATOM 1209 CB THR A 75 2.078 0.226 13.158 1.00 0.00 C ATOM 1210 OG1 THR A 75 0.912 -0.531 13.375 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.055 1.441 14.092 1.00 0.00 C ATOM 0 H THR A 75 2.042 -1.462 11.371 1.00 0.00 H new ATOM 0 HA THR A 75 1.241 1.175 11.417 1.00 0.00 H new ATOM 0 HB THR A 75 2.980 -0.342 13.386 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.124 0.032 13.226 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.012 1.103 15.127 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.957 2.034 13.940 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.179 2.052 13.873 1.00 0.00 H new ATOM 1219 N PHE A 76 4.543 0.929 11.412 1.00 0.00 N ATOM 1220 CA PHE A 76 5.769 1.663 11.175 1.00 0.00 C ATOM 1221 C PHE A 76 5.756 2.287 9.782 1.00 0.00 C ATOM 1222 O PHE A 76 6.091 3.456 9.640 1.00 0.00 O ATOM 1223 CB PHE A 76 6.989 0.765 11.370 1.00 0.00 C ATOM 1224 CG PHE A 76 8.283 1.534 11.210 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.813 2.253 12.298 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.844 1.694 9.929 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.891 3.133 12.102 1.00 0.00 C ATOM 1228 CE2 PHE A 76 9.954 2.530 9.746 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.455 3.279 10.823 1.00 0.00 C ATOM 0 H PHE A 76 4.683 -0.066 11.586 1.00 0.00 H new ATOM 0 HA PHE A 76 5.835 2.469 11.905 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.954 0.314 12.362 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.959 -0.051 10.648 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.391 2.128 13.284 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.418 1.171 9.085 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.286 3.697 12.934 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.424 2.598 8.776 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.273 3.967 10.669 1.00 0.00 H new ATOM 1239 N LEU A 77 5.358 1.543 8.749 1.00 0.00 N ATOM 1240 CA LEU A 77 5.200 2.123 7.420 1.00 0.00 C ATOM 1241 C LEU A 77 4.188 3.274 7.453 1.00 0.00 C ATOM 1242 O LEU A 77 4.380 4.271 6.764 1.00 0.00 O ATOM 1243 CB LEU A 77 4.835 1.051 6.385 1.00 0.00 C ATOM 1244 CG LEU A 77 6.021 0.128 6.047 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.539 -1.036 5.183 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.120 0.853 5.263 1.00 0.00 C ATOM 0 H LEU A 77 5.142 0.548 8.808 1.00 0.00 H new ATOM 0 HA LEU A 77 6.157 2.542 7.107 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.008 0.451 6.765 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.485 1.535 5.474 1.00 0.00 H new ATOM 0 HG LEU A 77 6.429 -0.216 6.997 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.381 -1.686 4.946 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.783 -1.604 5.726 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.108 -0.650 4.259 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.933 0.159 5.050 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.710 1.231 4.326 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.500 1.686 5.855 1.00 0.00 H new ATOM 1258 N GLY A 78 3.148 3.182 8.283 1.00 0.00 N ATOM 1259 CA GLY A 78 2.256 4.303 8.552 1.00 0.00 C ATOM 1260 C GLY A 78 3.020 5.503 9.114 1.00 0.00 C ATOM 1261 O GLY A 78 2.912 6.615 8.597 1.00 0.00 O ATOM 0 H GLY A 78 2.903 2.329 8.785 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.746 4.593 7.633 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.487 3.996 9.260 1.00 0.00 H new ATOM 1265 N ALA A 79 3.816 5.288 10.163 1.00 0.00 N ATOM 1266 CA ALA A 79 4.669 6.337 10.708 1.00 0.00 C ATOM 1267 C ALA A 79 5.557 6.929 9.607 1.00 0.00 C ATOM 1268 O ALA A 79 5.649 8.144 9.463 1.00 0.00 O ATOM 1269 CB ALA A 79 5.499 5.804 11.879 1.00 0.00 C ATOM 0 H ALA A 79 3.885 4.395 10.650 1.00 0.00 H new ATOM 0 HA ALA A 79 4.039 7.139 11.093 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.129 6.602 12.272 1.00 0.00 H new ATOM 0 HB2 ALA A 79 4.833 5.448 12.665 1.00 0.00 H new ATOM 0 HB3 ALA A 79 6.127 4.982 11.535 1.00 0.00 H new ATOM 1275 N LEU A 80 6.184 6.080 8.795 1.00 0.00 N ATOM 1276 CA LEU A 80 7.046 6.499 7.702 1.00 0.00 C ATOM 1277 C LEU A 80 6.262 7.339 6.686 1.00 0.00 C ATOM 1278 O LEU A 80 6.736 8.369 6.210 1.00 0.00 O ATOM 1279 CB LEU A 80 7.682 5.266 7.047 1.00 0.00 C ATOM 1280 CG LEU A 80 9.020 5.610 6.379 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.151 5.659 7.411 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.363 4.531 5.347 1.00 0.00 C ATOM 0 H LEU A 80 6.103 5.067 8.883 1.00 0.00 H new ATOM 0 HA LEU A 80 7.845 7.129 8.093 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.838 4.493 7.799 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.999 4.854 6.304 1.00 0.00 H new ATOM 0 HG LEU A 80 8.922 6.587 5.905 1.00 0.00 H new ATOM 0 HD11 LEU A 80 11.088 5.905 6.912 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.928 6.420 8.159 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.242 4.688 7.897 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.313 4.772 4.870 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.442 3.564 5.844 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.579 4.488 4.591 1.00 0.00 H new ATOM 1294 N ALA A 81 5.040 6.918 6.364 1.00 0.00 N ATOM 1295 CA ALA A 81 4.144 7.669 5.504 1.00 0.00 C ATOM 1296 C ALA A 81 3.853 9.049 6.095 1.00 0.00 C ATOM 1297 O ALA A 81 3.817 10.036 5.362 1.00 0.00 O ATOM 1298 CB ALA A 81 2.867 6.869 5.263 1.00 0.00 C ATOM 0 H ALA A 81 4.646 6.038 6.698 1.00 0.00 H new ATOM 0 HA ALA A 81 4.625 7.833 4.540 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.198 7.437 4.617 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.116 5.922 4.784 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.374 6.675 6.216 1.00 0.00 H new ATOM 1304 N MET A 82 3.678 9.140 7.416 1.00 0.00 N ATOM 1305 CA MET A 82 3.594 10.438 8.069 1.00 0.00 C ATOM 1306 C MET A 82 4.902 11.215 7.862 1.00 0.00 C ATOM 1307 O MET A 82 4.866 12.354 7.402 1.00 0.00 O ATOM 1308 CB MET A 82 3.174 10.277 9.540 1.00 0.00 C ATOM 1309 CG MET A 82 2.889 11.620 10.226 1.00 0.00 C ATOM 1310 SD MET A 82 4.346 12.541 10.785 1.00 0.00 S ATOM 1311 CE MET A 82 3.550 14.032 11.417 1.00 0.00 C ATOM 0 H MET A 82 3.593 8.339 8.042 1.00 0.00 H new ATOM 0 HA MET A 82 2.811 11.041 7.610 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.283 9.651 9.593 1.00 0.00 H new ATOM 0 HB3 MET A 82 3.962 9.756 10.084 1.00 0.00 H new ATOM 0 HG2 MET A 82 2.328 12.248 9.534 1.00 0.00 H new ATOM 0 HG3 MET A 82 2.245 11.438 11.086 1.00 0.00 H new ATOM 0 HE1 MET A 82 4.308 14.713 11.803 1.00 0.00 H new ATOM 0 HE2 MET A 82 3.000 14.520 10.612 1.00 0.00 H new ATOM 0 HE3 MET A 82 2.861 13.765 12.218 1.00 0.00 H new ATOM 1321 N ILE A 83 6.051 10.590 8.145 1.00 0.00 N ATOM 1322 CA ILE A 83 7.377 11.200 8.002 1.00 0.00 C ATOM 1323 C ILE A 83 7.561 11.791 6.600 1.00 0.00 C ATOM 1324 O ILE A 83 8.108 12.884 6.470 1.00 0.00 O ATOM 1325 CB ILE A 83 8.494 10.189 8.343 1.00 0.00 C ATOM 1326 CG1 ILE A 83 8.486 9.779 9.827 1.00 0.00 C ATOM 1327 CG2 ILE A 83 9.888 10.683 7.925 1.00 0.00 C ATOM 1328 CD1 ILE A 83 9.166 10.788 10.754 1.00 0.00 C ATOM 0 H ILE A 83 6.085 9.629 8.486 1.00 0.00 H new ATOM 0 HA ILE A 83 7.450 12.020 8.716 1.00 0.00 H new ATOM 0 HB ILE A 83 8.270 9.300 7.753 1.00 0.00 H new ATOM 0 HG12 ILE A 83 7.454 9.642 10.150 1.00 0.00 H new ATOM 0 HG13 ILE A 83 8.983 8.814 9.930 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.634 9.933 8.189 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.907 10.851 6.848 1.00 0.00 H new ATOM 0 HG23 ILE A 83 10.113 11.616 8.441 1.00 0.00 H new ATOM 0 HD11 ILE A 83 9.119 10.427 11.782 1.00 0.00 H new ATOM 0 HD12 ILE A 83 10.208 10.908 10.459 1.00 0.00 H new ATOM 0 HD13 ILE A 83 8.656 11.749 10.683 1.00 0.00 H new ATOM 1340 N TYR A 84 7.109 11.085 5.555 1.00 0.00 N ATOM 1341 CA TYR A 84 7.167 11.588 4.184 1.00 0.00 C ATOM 1342 C TYR A 84 6.563 12.996 4.088 1.00 0.00 C ATOM 1343 O TYR A 84 7.067 13.816 3.325 1.00 0.00 O ATOM 1344 CB TYR A 84 6.452 10.642 3.205 1.00 0.00 C ATOM 1345 CG TYR A 84 7.152 9.355 2.792 1.00 0.00 C ATOM 1346 CD1 TYR A 84 8.244 8.824 3.510 1.00 0.00 C ATOM 1347 CD2 TYR A 84 6.718 8.708 1.619 1.00 0.00 C ATOM 1348 CE1 TYR A 84 8.891 7.661 3.051 1.00 0.00 C ATOM 1349 CE2 TYR A 84 7.386 7.566 1.147 1.00 0.00 C ATOM 1350 CZ TYR A 84 8.467 7.034 1.869 1.00 0.00 C ATOM 1351 OH TYR A 84 9.111 5.916 1.428 1.00 0.00 O ATOM 0 H TYR A 84 6.696 10.156 5.639 1.00 0.00 H new ATOM 0 HA TYR A 84 8.219 11.637 3.904 1.00 0.00 H new ATOM 0 HB2 TYR A 84 5.494 10.370 3.648 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.235 11.206 2.298 1.00 0.00 H new ATOM 0 HD1 TYR A 84 8.584 9.310 4.413 1.00 0.00 H new ATOM 0 HD2 TYR A 84 5.866 9.092 1.079 1.00 0.00 H new ATOM 0 HE1 TYR A 84 9.718 7.249 3.611 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.068 7.096 0.228 1.00 0.00 H new ATOM 0 HH TYR A 84 8.794 5.689 0.529 1.00 0.00 H new ATOM 1361 N ASN A 85 5.492 13.268 4.846 1.00 0.00 N ATOM 1362 CA ASN A 85 4.843 14.565 5.028 1.00 0.00 C ATOM 1363 C ASN A 85 4.136 15.045 3.764 1.00 0.00 C ATOM 1364 O ASN A 85 2.910 15.152 3.736 1.00 0.00 O ATOM 1365 CB ASN A 85 5.822 15.612 5.578 1.00 0.00 C ATOM 1366 CG ASN A 85 5.114 16.944 5.805 1.00 0.00 C ATOM 1367 OD1 ASN A 85 4.292 17.073 6.705 1.00 0.00 O ATOM 1368 ND2 ASN A 85 5.410 17.955 4.994 1.00 0.00 N ATOM 0 H ASN A 85 5.028 12.535 5.383 1.00 0.00 H new ATOM 0 HA ASN A 85 4.064 14.427 5.778 1.00 0.00 H new ATOM 0 HB2 ASN A 85 6.252 15.258 6.515 1.00 0.00 H new ATOM 0 HB3 ASN A 85 6.648 15.748 4.880 1.00 0.00 H new ATOM 0 HD21 ASN A 85 4.950 18.857 5.115 1.00 0.00 H new ATOM 0 HD22 ASN A 85 6.097 17.828 4.251 1.00 0.00 H new ATOM 1375 N GLU A 86 4.908 15.304 2.709 1.00 0.00 N ATOM 1376 CA GLU A 86 4.427 15.752 1.409 1.00 0.00 C ATOM 1377 C GLU A 86 3.279 14.862 0.930 1.00 0.00 C ATOM 1378 O GLU A 86 2.286 15.351 0.402 1.00 0.00 O ATOM 1379 CB GLU A 86 5.569 15.742 0.378 1.00 0.00 C ATOM 1380 CG GLU A 86 6.869 16.408 0.857 1.00 0.00 C ATOM 1381 CD GLU A 86 6.636 17.781 1.476 1.00 0.00 C ATOM 1382 OE1 GLU A 86 6.169 18.670 0.732 1.00 0.00 O ATOM 1383 OE2 GLU A 86 6.918 17.910 2.686 1.00 0.00 O ATOM 0 H GLU A 86 5.922 15.203 2.741 1.00 0.00 H new ATOM 0 HA GLU A 86 4.060 16.773 1.513 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.785 14.709 0.104 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.229 16.247 -0.526 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.354 15.762 1.589 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.554 16.506 0.014 1.00 0.00 H new ATOM 1390 N ALA A 87 3.420 13.551 1.142 1.00 0.00 N ATOM 1391 CA ALA A 87 2.421 12.559 0.780 1.00 0.00 C ATOM 1392 C ALA A 87 1.045 12.872 1.384 1.00 0.00 C ATOM 1393 O ALA A 87 0.028 12.639 0.734 1.00 0.00 O ATOM 1394 CB ALA A 87 2.916 11.174 1.203 1.00 0.00 C ATOM 0 H ALA A 87 4.249 13.148 1.578 1.00 0.00 H new ATOM 0 HA ALA A 87 2.287 12.581 -0.301 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.172 10.424 0.935 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.854 10.952 0.695 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.075 11.158 2.281 1.00 0.00 H new ATOM 1400 N LEU A 88 1.004 13.389 2.618 1.00 0.00 N ATOM 1401 CA LEU A 88 -0.239 13.805 3.255 1.00 0.00 C ATOM 1402 C LEU A 88 -0.595 15.220 2.802 1.00 0.00 C ATOM 1403 O LEU A 88 -1.705 15.472 2.344 1.00 0.00 O ATOM 1404 CB LEU A 88 -0.100 13.769 4.786 1.00 0.00 C ATOM 1405 CG LEU A 88 0.066 12.363 5.383 1.00 0.00 C ATOM 1406 CD1 LEU A 88 0.503 12.493 6.846 1.00 0.00 C ATOM 1407 CD2 LEU A 88 -1.245 11.569 5.348 1.00 0.00 C ATOM 0 H LEU A 88 1.832 13.528 3.197 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.032 13.116 2.963 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.759 14.375 5.073 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.981 14.235 5.228 1.00 0.00 H new ATOM 0 HG LEU A 88 0.810 11.834 4.787 1.00 0.00 H new ATOM 0 HD11 LEU A 88 0.624 11.500 7.279 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.451 13.029 6.896 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.254 13.043 7.404 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -1.084 10.581 5.779 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.005 12.097 5.924 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.579 11.464 4.316 1.00 0.00 H new ATOM 1479 N SER B 3 9.941 3.471 -5.807 1.00 0.00 N ATOM 1480 CA SER B 3 8.677 3.503 -6.514 1.00 0.00 C ATOM 1481 C SER B 3 7.774 2.304 -6.191 1.00 0.00 C ATOM 1482 O SER B 3 6.603 2.521 -5.884 1.00 0.00 O ATOM 1483 CB SER B 3 8.930 3.670 -8.023 1.00 0.00 C ATOM 1484 OG SER B 3 10.134 4.386 -8.256 1.00 0.00 O ATOM 0 HA SER B 3 8.117 4.369 -6.162 1.00 0.00 H new ATOM 0 HB2 SER B 3 8.987 2.690 -8.497 1.00 0.00 H new ATOM 0 HB3 SER B 3 8.093 4.198 -8.480 1.00 0.00 H new ATOM 0 HG SER B 3 10.732 4.279 -7.487 1.00 0.00 H new ATOM 1490 N PRO B 4 8.259 1.049 -6.260 1.00 0.00 N ATOM 1491 CA PRO B 4 7.393 -0.110 -6.130 1.00 0.00 C ATOM 1492 C PRO B 4 6.632 -0.186 -4.808 1.00 0.00 C ATOM 1493 O PRO B 4 5.456 -0.546 -4.816 1.00 0.00 O ATOM 1494 CB PRO B 4 8.272 -1.341 -6.368 1.00 0.00 C ATOM 1495 CG PRO B 4 9.423 -0.789 -7.206 1.00 0.00 C ATOM 1496 CD PRO B 4 9.598 0.620 -6.645 1.00 0.00 C ATOM 0 HA PRO B 4 6.594 -0.044 -6.868 1.00 0.00 H new ATOM 0 HB2 PRO B 4 8.626 -1.771 -5.431 1.00 0.00 H new ATOM 0 HB3 PRO B 4 7.731 -2.127 -6.895 1.00 0.00 H new ATOM 0 HG2 PRO B 4 10.328 -1.385 -7.094 1.00 0.00 H new ATOM 0 HG3 PRO B 4 9.180 -0.775 -8.269 1.00 0.00 H new ATOM 0 HD2 PRO B 4 10.273 0.622 -5.789 1.00 0.00 H new ATOM 0 HD3 PRO B 4 10.027 1.290 -7.390 1.00 0.00 H new ATOM 1504 N LEU B 5 7.282 0.141 -3.686 1.00 0.00 N ATOM 1505 CA LEU B 5 6.597 0.282 -2.409 1.00 0.00 C ATOM 1506 C LEU B 5 5.931 1.654 -2.314 1.00 0.00 C ATOM 1507 O LEU B 5 4.780 1.750 -1.888 1.00 0.00 O ATOM 1508 CB LEU B 5 7.566 0.043 -1.244 1.00 0.00 C ATOM 1509 CG LEU B 5 6.903 0.220 0.134 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.759 -0.772 0.361 1.00 0.00 C ATOM 1511 CD2 LEU B 5 7.929 0.007 1.246 1.00 0.00 C ATOM 0 H LEU B 5 8.287 0.312 -3.643 1.00 0.00 H new ATOM 0 HA LEU B 5 5.815 -0.475 -2.344 1.00 0.00 H new ATOM 0 HB2 LEU B 5 7.974 -0.965 -1.318 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.405 0.733 -1.329 1.00 0.00 H new ATOM 0 HG LEU B 5 6.504 1.234 0.155 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.324 -0.607 1.347 1.00 0.00 H new ATOM 0 HD12 LEU B 5 4.994 -0.626 -0.402 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.143 -1.790 0.300 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.447 0.135 2.215 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.339 -1.001 1.175 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.734 0.734 1.142 1.00 0.00 H new ATOM 1523 N ASP B 6 6.652 2.718 -2.693 1.00 0.00 N ATOM 1524 CA ASP B 6 6.166 4.086 -2.549 1.00 0.00 C ATOM 1525 C ASP B 6 4.785 4.258 -3.176 1.00 0.00 C ATOM 1526 O ASP B 6 3.927 4.894 -2.573 1.00 0.00 O ATOM 1527 CB ASP B 6 7.150 5.113 -3.122 1.00 0.00 C ATOM 1528 CG ASP B 6 8.417 5.293 -2.289 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.358 5.059 -1.060 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.427 5.702 -2.898 1.00 0.00 O ATOM 0 H ASP B 6 7.583 2.650 -3.105 1.00 0.00 H new ATOM 0 HA ASP B 6 6.081 4.274 -1.479 1.00 0.00 H new ATOM 0 HB2 ASP B 6 7.431 4.808 -4.130 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.645 6.075 -3.209 1.00 0.00 H new ATOM 1535 N GLN B 7 4.543 3.679 -4.356 1.00 0.00 N ATOM 1536 CA GLN B 7 3.224 3.725 -4.977 1.00 0.00 C ATOM 1537 C GLN B 7 2.164 3.111 -4.055 1.00 0.00 C ATOM 1538 O GLN B 7 1.055 3.624 -3.957 1.00 0.00 O ATOM 1539 CB GLN B 7 3.251 3.036 -6.353 1.00 0.00 C ATOM 1540 CG GLN B 7 3.400 1.517 -6.204 1.00 0.00 C ATOM 1541 CD GLN B 7 3.699 0.775 -7.497 1.00 0.00 C ATOM 1542 OE1 GLN B 7 3.466 1.272 -8.593 1.00 0.00 O ATOM 1543 NE2 GLN B 7 4.207 -0.446 -7.363 1.00 0.00 N ATOM 0 H GLN B 7 5.245 3.174 -4.897 1.00 0.00 H new ATOM 0 HA GLN B 7 2.951 4.768 -5.135 1.00 0.00 H new ATOM 0 HB2 GLN B 7 2.333 3.264 -6.896 1.00 0.00 H new ATOM 0 HB3 GLN B 7 4.077 3.430 -6.945 1.00 0.00 H new ATOM 0 HG2 GLN B 7 4.199 1.313 -5.491 1.00 0.00 H new ATOM 0 HG3 GLN B 7 2.481 1.116 -5.776 1.00 0.00 H new ATOM 0 HE21 GLN B 7 4.387 -0.824 -6.433 1.00 0.00 H new ATOM 0 HE22 GLN B 7 4.417 -1.005 -8.190 1.00 0.00 H new ATOM 1552 N ALA B 8 2.489 1.999 -3.388 1.00 0.00 N ATOM 1553 CA ALA B 8 1.528 1.261 -2.585 1.00 0.00 C ATOM 1554 C ALA B 8 1.174 2.042 -1.324 1.00 0.00 C ATOM 1555 O ALA B 8 -0.003 2.297 -1.073 1.00 0.00 O ATOM 1556 CB ALA B 8 2.055 -0.130 -2.260 1.00 0.00 C ATOM 0 H ALA B 8 3.424 1.592 -3.394 1.00 0.00 H new ATOM 0 HA ALA B 8 0.612 1.135 -3.162 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.321 -0.666 -1.658 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.234 -0.677 -3.186 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.988 -0.045 -1.703 1.00 0.00 H new ATOM 1562 N ILE B 9 2.176 2.461 -0.541 1.00 0.00 N ATOM 1563 CA ILE B 9 1.888 3.338 0.594 1.00 0.00 C ATOM 1564 C ILE B 9 1.186 4.607 0.084 1.00 0.00 C ATOM 1565 O ILE B 9 0.170 5.027 0.639 1.00 0.00 O ATOM 1566 CB ILE B 9 3.120 3.586 1.493 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.324 4.191 0.757 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.512 2.270 2.177 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.504 4.501 1.688 1.00 0.00 C ATOM 0 H ILE B 9 3.158 2.217 -0.667 1.00 0.00 H new ATOM 0 HA ILE B 9 1.195 2.840 1.272 1.00 0.00 H new ATOM 0 HB ILE B 9 2.830 4.334 2.230 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.653 3.500 -0.019 1.00 0.00 H new ATOM 0 HG13 ILE B 9 4.013 5.108 0.256 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.381 2.436 2.814 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.680 1.914 2.784 1.00 0.00 H new ATOM 0 HG23 ILE B 9 3.754 1.524 1.420 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.323 4.926 1.108 1.00 0.00 H new ATOM 0 HD12 ILE B 9 5.189 5.215 2.449 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.839 3.582 2.169 1.00 0.00 H new ATOM 1581 N GLY B 10 1.668 5.153 -1.037 1.00 0.00 N ATOM 1582 CA GLY B 10 1.035 6.222 -1.794 1.00 0.00 C ATOM 1583 C GLY B 10 -0.456 5.976 -2.015 1.00 0.00 C ATOM 1584 O GLY B 10 -1.252 6.895 -1.864 1.00 0.00 O ATOM 0 H GLY B 10 2.547 4.845 -1.454 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.170 7.166 -1.266 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.531 6.322 -2.760 1.00 0.00 H new ATOM 1588 N LEU B 11 -0.846 4.751 -2.368 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.232 4.372 -2.594 1.00 0.00 C ATOM 1590 C LEU B 11 -3.041 4.571 -1.310 1.00 0.00 C ATOM 1591 O LEU B 11 -3.999 5.343 -1.294 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.278 2.916 -3.096 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.535 2.500 -3.873 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -4.827 2.759 -3.106 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.565 3.109 -5.275 1.00 0.00 C ATOM 0 H LEU B 11 -0.190 3.982 -2.506 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.683 5.006 -3.358 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.411 2.747 -3.734 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.174 2.255 -2.236 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.473 1.418 -3.992 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.678 2.443 -3.710 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.815 2.196 -2.173 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -4.913 3.823 -2.886 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.470 2.790 -5.791 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.554 4.196 -5.200 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.691 2.776 -5.835 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.654 3.886 -0.227 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.323 3.994 1.067 1.00 0.00 C ATOM 1609 C LEU B 12 -3.451 5.461 1.480 1.00 0.00 C ATOM 1610 O LEU B 12 -4.522 5.896 1.918 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.541 3.234 2.155 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.777 1.717 2.191 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.203 0.990 0.973 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.139 1.135 3.457 1.00 0.00 C ATOM 0 H LEU B 12 -1.865 3.240 -0.228 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.315 3.553 0.965 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.476 3.417 2.009 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.805 3.650 3.127 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.856 1.565 2.183 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.403 -0.078 1.059 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.670 1.375 0.066 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.127 1.155 0.925 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.305 0.058 3.486 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.068 1.337 3.451 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.590 1.595 4.336 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.349 6.205 1.356 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.294 7.612 1.716 1.00 0.00 C ATOM 1628 C ILE B 13 -3.276 8.392 0.850 1.00 0.00 C ATOM 1629 O ILE B 13 -4.097 9.133 1.373 1.00 0.00 O ATOM 1630 CB ILE B 13 -0.859 8.149 1.568 1.00 0.00 C ATOM 1631 CG1 ILE B 13 0.094 7.461 2.559 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -0.825 9.664 1.815 1.00 0.00 C ATOM 1633 CD1 ILE B 13 1.551 7.544 2.095 1.00 0.00 C ATOM 0 H ILE B 13 -1.466 5.839 0.999 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.580 7.735 2.760 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.532 7.934 0.551 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -0.003 7.927 3.540 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.192 6.416 2.673 1.00 0.00 H new ATOM 0 HG21 ILE B 13 0.197 10.027 1.706 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.467 10.165 1.091 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.180 9.876 2.823 1.00 0.00 H new ATOM 0 HD11 ILE B 13 2.193 7.047 2.822 1.00 0.00 H new ATOM 0 HD12 ILE B 13 1.653 7.055 1.126 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.846 8.590 2.006 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.196 8.225 -0.468 1.00 0.00 N ATOM 1646 CA GLY B 14 -4.036 8.903 -1.435 1.00 0.00 C ATOM 1647 C GLY B 14 -5.506 8.680 -1.109 1.00 0.00 C ATOM 1648 O GLY B 14 -6.256 9.644 -0.966 1.00 0.00 O ATOM 0 H GLY B 14 -2.522 7.593 -0.899 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -3.814 9.970 -1.434 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -3.819 8.534 -2.437 1.00 0.00 H new ATOM 1652 N ILE B 15 -5.909 7.411 -0.961 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.261 7.057 -0.558 1.00 0.00 C ATOM 1654 C ILE B 15 -7.619 7.873 0.686 1.00 0.00 C ATOM 1655 O ILE B 15 -8.535 8.696 0.659 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.363 5.522 -0.384 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.641 4.896 -1.762 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.457 5.111 0.604 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.651 3.362 -1.763 1.00 0.00 C ATOM 0 H ILE B 15 -5.301 6.607 -1.119 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.000 7.309 -1.319 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.420 5.163 0.028 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.604 5.255 -2.125 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -6.885 5.244 -2.466 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.483 4.024 0.687 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.246 5.544 1.582 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.422 5.471 0.248 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -7.854 3.000 -2.771 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.680 2.992 -1.433 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.426 3.003 -1.086 1.00 0.00 H new ATOM 1671 N PHE B 16 -6.854 7.683 1.764 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.136 8.328 3.034 1.00 0.00 C ATOM 1673 C PHE B 16 -7.319 9.835 2.872 1.00 0.00 C ATOM 1674 O PHE B 16 -8.284 10.414 3.370 1.00 0.00 O ATOM 1675 CB PHE B 16 -5.985 8.051 4.000 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.210 8.613 5.383 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -5.802 9.925 5.681 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.891 7.854 6.350 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.054 10.462 6.950 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -7.081 8.368 7.642 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.665 9.674 7.940 1.00 0.00 C ATOM 0 H PHE B 16 -6.030 7.082 1.775 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.068 7.921 3.426 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.835 6.974 4.074 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.068 8.473 3.590 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -5.296 10.517 4.933 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -7.269 6.874 6.099 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -5.778 11.483 7.168 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -7.546 7.760 8.404 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.815 10.074 8.932 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.357 10.478 2.208 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.276 11.921 2.148 1.00 0.00 C ATOM 1693 C HIS B 17 -7.363 12.504 1.253 1.00 0.00 C ATOM 1694 O HIS B 17 -7.813 13.616 1.510 1.00 0.00 O ATOM 1695 CB HIS B 17 -4.863 12.406 1.799 1.00 0.00 C ATOM 1696 CG HIS B 17 -4.479 13.585 2.657 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -4.769 14.906 2.399 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -4.065 13.504 3.960 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -4.497 15.604 3.516 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -4.074 14.792 4.503 1.00 0.00 N ATOM 0 H HIS B 17 -5.613 10.002 1.698 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.472 12.308 3.148 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.148 11.596 1.944 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -4.818 12.686 0.746 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -3.781 12.600 4.479 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -4.604 16.675 3.609 1.00 0.00 H new ATOM 0 HE2 HIS B 17 -3.814 15.061 5.452 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.824 11.764 0.238 1.00 0.00 N ATOM 1709 CA LYS B 18 -9.011 12.177 -0.499 1.00 0.00 C ATOM 1710 C LYS B 18 -10.209 12.198 0.453 1.00 0.00 C ATOM 1711 O LYS B 18 -10.882 13.219 0.592 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.275 11.242 -1.687 1.00 0.00 C ATOM 1713 CG LYS B 18 -8.279 11.480 -2.830 1.00 0.00 C ATOM 1714 CD LYS B 18 -8.588 10.612 -4.059 1.00 0.00 C ATOM 1715 CE LYS B 18 -8.438 9.112 -3.770 1.00 0.00 C ATOM 1716 NZ LYS B 18 -8.600 8.309 -4.995 1.00 0.00 N ATOM 0 H LYS B 18 -7.399 10.894 -0.083 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.852 13.177 -0.902 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -9.208 10.206 -1.356 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -10.291 11.395 -2.052 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -8.301 12.532 -3.115 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -7.269 11.265 -2.480 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -9.605 10.814 -4.397 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -7.920 10.891 -4.874 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -7.457 8.920 -3.335 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -9.180 8.806 -3.032 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -8.493 7.300 -4.766 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -9.545 8.474 -5.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -7.876 8.585 -5.689 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.477 11.068 1.113 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.656 10.942 1.960 1.00 0.00 C ATOM 1732 C TYR B 19 -11.637 11.938 3.126 1.00 0.00 C ATOM 1733 O TYR B 19 -12.645 12.588 3.390 1.00 0.00 O ATOM 1734 CB TYR B 19 -11.850 9.485 2.391 1.00 0.00 C ATOM 1735 CG TYR B 19 -12.397 8.613 1.278 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -13.760 8.678 0.935 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -11.541 7.782 0.536 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -14.229 8.001 -0.203 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -11.985 7.186 -0.653 1.00 0.00 C ATOM 1740 CZ TYR B 19 -13.324 7.336 -1.047 1.00 0.00 C ATOM 1741 OH TYR B 19 -13.751 6.791 -2.219 1.00 0.00 O ATOM 0 H TYR B 19 -9.893 10.233 1.075 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.536 11.215 1.377 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -10.896 9.080 2.728 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.530 9.450 3.242 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -14.445 9.248 1.546 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -10.535 7.601 0.884 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -15.285 7.992 -0.429 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -11.301 6.615 -1.262 1.00 0.00 H new ATOM 0 HH TYR B 19 -12.995 6.371 -2.679 1.00 0.00 H new ATOM 1751 N SER B 20 -10.505 12.102 3.816 1.00 0.00 N ATOM 1752 CA SER B 20 -10.403 13.116 4.863 1.00 0.00 C ATOM 1753 C SER B 20 -10.460 14.513 4.237 1.00 0.00 C ATOM 1754 O SER B 20 -11.224 15.363 4.691 1.00 0.00 O ATOM 1755 CB SER B 20 -9.160 12.900 5.731 1.00 0.00 C ATOM 1756 OG SER B 20 -8.018 12.661 4.939 1.00 0.00 O ATOM 0 H SER B 20 -9.658 11.553 3.670 1.00 0.00 H new ATOM 0 HA SER B 20 -11.254 13.023 5.538 1.00 0.00 H new ATOM 0 HB2 SER B 20 -8.994 13.777 6.357 1.00 0.00 H new ATOM 0 HB3 SER B 20 -9.324 12.056 6.401 1.00 0.00 H new ATOM 0 HG SER B 20 -8.095 11.783 4.511 1.00 0.00 H new ATOM 1762 N GLY B 21 -9.700 14.741 3.164 1.00 0.00 N ATOM 1763 CA GLY B 21 -9.724 15.974 2.386 1.00 0.00 C ATOM 1764 C GLY B 21 -11.147 16.451 2.103 1.00 0.00 C ATOM 1765 O GLY B 21 -11.432 17.637 2.250 1.00 0.00 O ATOM 0 H GLY B 21 -9.036 14.055 2.806 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -9.182 16.752 2.924 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -9.201 15.816 1.443 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.510 15.136 9.208 1.00 0.00 N ATOM 1848 CA HIS B 27 -5.082 13.808 8.770 1.00 0.00 C ATOM 1849 C HIS B 27 -5.857 12.727 9.542 1.00 0.00 C ATOM 1850 O HIS B 27 -5.279 11.804 10.124 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.562 13.672 8.945 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.776 14.789 8.303 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -2.920 15.260 7.015 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.831 15.566 8.918 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -2.076 16.292 6.863 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -1.390 16.519 7.995 1.00 0.00 N ATOM 0 HA HIS B 27 -5.305 13.673 7.712 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.329 13.640 10.009 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -3.240 12.722 8.520 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.487 15.461 9.936 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -1.964 16.863 5.953 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -0.688 17.242 8.150 1.00 0.00 H new ATOM 1864 N THR B 28 -7.183 12.855 9.536 1.00 0.00 N ATOM 1865 CA THR B 28 -8.132 12.115 10.338 1.00 0.00 C ATOM 1866 C THR B 28 -9.369 11.902 9.472 1.00 0.00 C ATOM 1867 O THR B 28 -9.787 12.831 8.787 1.00 0.00 O ATOM 1868 CB THR B 28 -8.494 12.948 11.579 1.00 0.00 C ATOM 1869 OG1 THR B 28 -8.771 14.281 11.205 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.364 12.982 12.609 1.00 0.00 C ATOM 0 H THR B 28 -7.646 13.528 8.925 1.00 0.00 H new ATOM 0 HA THR B 28 -7.724 11.160 10.668 1.00 0.00 H new ATOM 0 HB THR B 28 -9.367 12.472 12.026 1.00 0.00 H new ATOM 0 HG1 THR B 28 -9.228 14.289 10.338 1.00 0.00 H new ATOM 0 HG21 THR B 28 -7.670 13.583 13.465 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.142 11.967 12.939 1.00 0.00 H new ATOM 0 HG23 THR B 28 -6.474 13.420 12.158 1.00 0.00 H new ATOM 1878 N LEU B 29 -9.946 10.704 9.491 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.258 10.454 8.901 1.00 0.00 C ATOM 1880 C LEU B 29 -12.283 10.462 10.027 1.00 0.00 C ATOM 1881 O LEU B 29 -11.932 10.126 11.153 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.292 9.071 8.236 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.469 8.991 6.948 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.265 7.524 6.555 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -11.194 9.679 5.794 1.00 0.00 C ATOM 0 H LEU B 29 -9.519 9.881 9.915 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.472 11.217 8.153 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -10.920 8.328 8.942 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.326 8.809 8.013 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.515 9.484 7.133 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.679 7.471 5.638 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.737 7.003 7.354 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.234 7.052 6.394 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -10.589 9.608 4.890 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -12.155 9.192 5.626 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -11.357 10.728 6.041 1.00 0.00 H new ATOM 1897 N SER B 30 -13.538 10.817 9.753 1.00 0.00 N ATOM 1898 CA SER B 30 -14.618 10.577 10.699 1.00 0.00 C ATOM 1899 C SER B 30 -15.186 9.178 10.433 1.00 0.00 C ATOM 1900 O SER B 30 -15.002 8.631 9.346 1.00 0.00 O ATOM 1901 CB SER B 30 -15.689 11.663 10.557 1.00 0.00 C ATOM 1902 OG SER B 30 -16.245 11.635 9.257 1.00 0.00 O ATOM 0 H SER B 30 -13.827 11.270 8.886 1.00 0.00 H new ATOM 0 HA SER B 30 -14.251 10.620 11.725 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.473 11.510 11.299 1.00 0.00 H new ATOM 0 HB3 SER B 30 -15.252 12.642 10.752 1.00 0.00 H new ATOM 0 HG SER B 30 -16.929 12.332 9.179 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.882 8.589 11.406 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.456 7.252 11.312 1.00 0.00 C ATOM 1910 C LYS B 31 -17.247 7.024 10.016 1.00 0.00 C ATOM 1911 O LYS B 31 -17.084 6.015 9.328 1.00 0.00 O ATOM 1912 CB LYS B 31 -17.315 6.988 12.557 1.00 0.00 C ATOM 1913 CG LYS B 31 -18.378 8.051 12.882 1.00 0.00 C ATOM 1914 CD LYS B 31 -18.938 7.866 14.300 1.00 0.00 C ATOM 1915 CE LYS B 31 -19.659 6.527 14.487 1.00 0.00 C ATOM 1916 NZ LYS B 31 -20.216 6.411 15.846 1.00 0.00 N ATOM 0 H LYS B 31 -16.065 9.042 12.302 1.00 0.00 H new ATOM 0 HA LYS B 31 -15.637 6.534 11.274 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -17.816 6.028 12.431 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -16.652 6.891 13.417 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -17.941 9.045 12.788 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -19.190 7.990 12.157 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.122 7.937 15.019 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -19.630 8.679 14.521 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -20.460 6.436 13.753 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -18.964 5.707 14.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -20.699 5.495 15.946 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -19.447 6.475 16.543 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -20.896 7.181 16.009 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.125 7.966 9.679 1.00 0.00 N ATOM 1931 CA LYS B 32 -18.972 7.826 8.503 1.00 0.00 C ATOM 1932 C LYS B 32 -18.193 8.158 7.225 1.00 0.00 C ATOM 1933 O LYS B 32 -18.441 7.550 6.186 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.277 8.607 8.698 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.201 8.530 7.473 1.00 0.00 C ATOM 1936 CD LYS B 32 -22.506 9.314 7.672 1.00 0.00 C ATOM 1937 CE LYS B 32 -23.399 8.715 8.765 1.00 0.00 C ATOM 1938 NZ LYS B 32 -24.705 9.395 8.821 1.00 0.00 N ATOM 0 H LYS B 32 -18.266 8.830 10.203 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.274 6.786 8.375 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -20.802 8.217 9.570 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.043 9.651 8.907 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -20.676 8.920 6.601 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.436 7.486 7.264 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -22.269 10.346 7.929 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -23.057 9.338 6.732 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -23.548 7.652 8.574 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -22.901 8.799 9.731 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -25.287 8.968 9.570 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -24.562 10.404 9.027 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -25.189 9.293 7.906 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.216 9.072 7.283 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.324 9.283 6.149 1.00 0.00 C ATOM 1954 C GLU B 33 -15.559 7.990 5.850 1.00 0.00 C ATOM 1955 O GLU B 33 -15.410 7.597 4.696 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.365 10.441 6.438 1.00 0.00 C ATOM 1957 CG GLU B 33 -14.594 10.864 5.182 1.00 0.00 C ATOM 1958 CD GLU B 33 -15.500 11.547 4.164 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -16.108 12.567 4.552 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -15.592 11.022 3.033 1.00 0.00 O ATOM 0 H GLU B 33 -17.029 9.666 8.091 1.00 0.00 H new ATOM 0 HA GLU B 33 -16.910 9.548 5.269 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -15.927 11.291 6.824 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -14.661 10.145 7.215 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -13.787 11.541 5.462 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -14.132 9.988 4.727 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.094 7.309 6.897 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.500 5.992 6.769 1.00 0.00 C ATOM 1969 C LEU B 34 -15.499 5.048 6.099 1.00 0.00 C ATOM 1970 O LEU B 34 -15.144 4.378 5.131 1.00 0.00 O ATOM 1971 CB LEU B 34 -13.989 5.510 8.137 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.519 4.048 8.206 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.681 3.040 8.157 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.443 3.756 7.149 1.00 0.00 C ATOM 0 H LEU B 34 -15.122 7.660 7.854 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.624 6.019 6.122 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.161 6.151 8.439 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -14.784 5.650 8.869 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.058 3.912 9.184 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -14.285 2.026 8.209 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.349 3.213 9.001 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.233 3.166 7.226 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.132 2.714 7.224 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.849 3.942 6.155 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.583 4.404 7.317 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.748 4.978 6.570 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.728 4.143 5.882 1.00 0.00 C ATOM 1988 C LYS B 35 -17.794 4.497 4.390 1.00 0.00 C ATOM 1989 O LYS B 35 -17.803 3.597 3.553 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.110 4.215 6.541 1.00 0.00 C ATOM 1991 CG LYS B 35 -20.061 3.232 5.837 1.00 0.00 C ATOM 1992 CD LYS B 35 -21.475 3.266 6.411 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.536 2.656 7.811 1.00 0.00 C ATOM 1994 NZ LYS B 35 -22.941 2.565 8.248 1.00 0.00 N ATOM 0 H LYS B 35 -17.093 5.471 7.394 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.395 3.109 5.968 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.034 3.969 7.600 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.504 5.229 6.476 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -20.099 3.469 4.774 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.662 2.221 5.925 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -21.827 4.297 6.448 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -22.149 2.723 5.749 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -21.080 1.666 7.808 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -20.966 3.267 8.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -22.994 2.701 9.278 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -23.501 3.301 7.772 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -23.321 1.628 8.003 1.00 0.00 H new ATOM 2008 N GLU B 36 -17.827 5.792 4.055 1.00 0.00 N ATOM 2009 CA GLU B 36 -17.822 6.241 2.669 1.00 0.00 C ATOM 2010 C GLU B 36 -16.611 5.663 1.927 1.00 0.00 C ATOM 2011 O GLU B 36 -16.769 5.064 0.867 1.00 0.00 O ATOM 2012 CB GLU B 36 -17.866 7.778 2.605 1.00 0.00 C ATOM 2013 CG GLU B 36 -18.269 8.295 1.217 1.00 0.00 C ATOM 2014 CD GLU B 36 -19.700 7.916 0.846 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -20.616 8.417 1.536 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -19.853 7.129 -0.112 1.00 0.00 O ATOM 0 H GLU B 36 -17.858 6.550 4.737 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.716 5.871 2.167 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -18.572 8.150 3.347 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -16.887 8.178 2.868 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -18.166 9.380 1.193 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -17.585 7.893 0.470 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.413 5.814 2.498 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.181 5.227 1.981 1.00 0.00 C ATOM 2025 C LEU B 37 -14.376 3.747 1.694 1.00 0.00 C ATOM 2026 O LEU B 37 -14.112 3.295 0.584 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.024 5.513 2.960 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.630 4.972 2.591 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.589 5.738 3.417 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.430 3.487 2.934 1.00 0.00 C ATOM 0 H LEU B 37 -15.273 6.359 3.349 1.00 0.00 H new ATOM 0 HA LEU B 37 -13.916 5.686 1.029 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -12.944 6.593 3.080 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.297 5.103 3.932 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.526 5.096 1.513 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.591 5.373 3.174 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.652 6.801 3.186 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.783 5.585 4.479 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.425 3.179 2.645 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.560 3.341 4.006 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.163 2.887 2.394 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.843 2.979 2.674 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.007 1.549 2.489 1.00 0.00 C ATOM 2044 C ILE B 38 -16.010 1.268 1.377 1.00 0.00 C ATOM 2045 O ILE B 38 -15.682 0.561 0.434 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.378 0.871 3.812 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -14.167 1.027 4.744 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.722 -0.611 3.601 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -14.380 0.313 6.067 1.00 0.00 C ATOM 0 H ILE B 38 -15.111 3.323 3.596 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.057 1.117 2.174 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.265 1.334 4.245 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -13.278 0.629 4.255 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -13.983 2.086 4.927 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -15.981 -1.064 4.558 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -16.568 -0.695 2.919 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.861 -1.127 3.176 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -13.502 0.447 6.698 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.254 0.729 6.568 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -14.538 -0.750 5.885 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.225 1.804 1.464 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.244 1.523 0.466 1.00 0.00 C ATOM 2063 C GLN B 39 -17.767 1.928 -0.934 1.00 0.00 C ATOM 2064 O GLN B 39 -18.031 1.220 -1.905 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.562 2.211 0.853 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.195 1.619 2.128 1.00 0.00 C ATOM 2067 CD GLN B 39 -20.728 0.197 1.946 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -20.789 -0.322 0.836 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -21.136 -0.459 3.029 1.00 0.00 N ATOM 0 H GLN B 39 -17.523 2.431 2.211 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.427 0.449 0.436 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.380 3.275 1.004 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.268 2.122 0.028 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -19.452 1.620 2.926 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -21.011 2.265 2.451 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -21.079 -0.015 3.946 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -21.505 -1.406 2.943 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.074 3.064 -1.061 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.693 3.591 -2.361 1.00 0.00 C ATOM 2080 C LYS B 40 -15.444 2.919 -2.934 1.00 0.00 C ATOM 2081 O LYS B 40 -15.368 2.705 -4.142 1.00 0.00 O ATOM 2082 CB LYS B 40 -16.602 5.119 -2.280 1.00 0.00 C ATOM 2083 CG LYS B 40 -16.499 5.759 -3.672 1.00 0.00 C ATOM 2084 CD LYS B 40 -16.667 7.286 -3.638 1.00 0.00 C ATOM 2085 CE LYS B 40 -18.110 7.714 -3.344 1.00 0.00 C ATOM 2086 NZ LYS B 40 -18.256 9.178 -3.412 1.00 0.00 N ATOM 0 H LYS B 40 -16.768 3.633 -0.272 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.469 3.344 -3.085 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -17.480 5.509 -1.765 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -15.733 5.400 -1.685 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -15.531 5.514 -4.109 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -17.260 5.328 -4.322 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -16.006 7.704 -2.878 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -16.356 7.703 -4.596 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -18.784 7.245 -4.061 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -18.402 7.362 -2.354 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -19.242 9.438 -3.209 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -17.629 9.622 -2.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -18.000 9.509 -4.364 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.461 2.594 -2.092 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.307 1.815 -2.514 1.00 0.00 C ATOM 2102 C GLU B 41 -13.669 0.329 -2.527 1.00 0.00 C ATOM 2103 O GLU B 41 -13.754 -0.306 -3.573 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.096 2.103 -1.611 1.00 0.00 C ATOM 2105 CG GLU B 41 -11.716 3.591 -1.572 1.00 0.00 C ATOM 2106 CD GLU B 41 -11.317 4.137 -2.938 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -10.320 3.625 -3.489 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -12.005 5.077 -3.398 1.00 0.00 O ATOM 0 H GLU B 41 -14.446 2.863 -1.108 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.025 2.105 -3.526 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.316 1.763 -0.599 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.242 1.525 -1.963 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.559 4.166 -1.188 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -10.890 3.732 -0.875 1.00 0.00 H new ATOM 2115 N LEU B 42 -13.893 -0.235 -1.345 1.00 0.00 N ATOM 2116 CA LEU B 42 -14.120 -1.659 -1.132 1.00 0.00 C ATOM 2117 C LEU B 42 -15.603 -1.959 -1.351 1.00 0.00 C ATOM 2118 O LEU B 42 -16.308 -2.403 -0.445 1.00 0.00 O ATOM 2119 CB LEU B 42 -13.652 -2.066 0.277 1.00 0.00 C ATOM 2120 CG LEU B 42 -12.141 -1.885 0.516 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -11.854 -1.970 2.020 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -11.318 -2.960 -0.204 1.00 0.00 C ATOM 0 H LEU B 42 -13.922 0.305 -0.480 1.00 0.00 H new ATOM 0 HA LEU B 42 -13.540 -2.246 -1.844 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -14.198 -1.477 1.014 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -13.913 -3.111 0.447 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.855 -0.911 0.119 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -10.786 -1.842 2.194 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -12.403 -1.185 2.540 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.169 -2.943 2.396 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.258 -2.797 -0.010 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -11.607 -3.945 0.162 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -11.504 -2.903 -1.277 1.00 0.00 H new ATOM 2243 N ASP B 50 -23.002 -4.136 5.197 1.00 0.00 N ATOM 2244 CA ASP B 50 -22.763 -2.899 5.926 1.00 0.00 C ATOM 2245 C ASP B 50 -22.853 -3.115 7.441 1.00 0.00 C ATOM 2246 O ASP B 50 -22.154 -2.440 8.187 1.00 0.00 O ATOM 2247 CB ASP B 50 -23.677 -1.763 5.461 1.00 0.00 C ATOM 2248 CG ASP B 50 -23.208 -0.431 6.046 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -22.141 0.040 5.591 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -23.916 0.093 6.933 1.00 0.00 O ATOM 0 HA ASP B 50 -21.743 -2.590 5.698 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -23.677 -1.710 4.372 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -24.703 -1.963 5.770 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.657 -4.083 7.898 1.00 0.00 N ATOM 2256 CA ALA B 51 -23.655 -4.522 9.291 1.00 0.00 C ATOM 2257 C ALA B 51 -22.242 -4.913 9.756 1.00 0.00 C ATOM 2258 O ALA B 51 -21.773 -4.468 10.804 1.00 0.00 O ATOM 2259 CB ALA B 51 -24.623 -5.698 9.451 1.00 0.00 C ATOM 0 H ALA B 51 -24.325 -4.581 7.310 1.00 0.00 H new ATOM 0 HA ALA B 51 -23.983 -3.694 9.919 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -24.625 -6.029 10.489 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.628 -5.383 9.169 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -24.306 -6.520 8.809 1.00 0.00 H new ATOM 2265 N GLU B 52 -21.543 -5.733 8.967 1.00 0.00 N ATOM 2266 CA GLU B 52 -20.155 -6.078 9.237 1.00 0.00 C ATOM 2267 C GLU B 52 -19.309 -4.807 9.178 1.00 0.00 C ATOM 2268 O GLU B 52 -18.476 -4.568 10.052 1.00 0.00 O ATOM 2269 CB GLU B 52 -19.639 -7.117 8.230 1.00 0.00 C ATOM 2270 CG GLU B 52 -20.522 -8.370 8.162 1.00 0.00 C ATOM 2271 CD GLU B 52 -19.917 -9.420 7.235 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -19.833 -9.129 6.022 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -19.542 -10.493 7.754 1.00 0.00 O ATOM 0 H GLU B 52 -21.925 -6.171 8.129 1.00 0.00 H new ATOM 0 HA GLU B 52 -20.083 -6.521 10.230 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -19.585 -6.662 7.241 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -18.624 -7.408 8.503 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -20.642 -8.789 9.161 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -21.517 -8.099 7.809 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.532 -3.984 8.146 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.793 -2.741 7.989 1.00 0.00 C ATOM 2282 C ILE B 53 -18.926 -1.854 9.230 1.00 0.00 C ATOM 2283 O ILE B 53 -17.928 -1.268 9.626 1.00 0.00 O ATOM 2284 CB ILE B 53 -19.137 -1.995 6.687 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -18.971 -2.878 5.432 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.286 -0.725 6.542 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -17.629 -3.612 5.344 1.00 0.00 C ATOM 0 H ILE B 53 -20.218 -4.162 7.413 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.741 -3.010 7.896 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.190 -1.722 6.760 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -19.775 -3.614 5.412 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -19.088 -2.254 4.546 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -18.548 -0.216 5.614 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.475 -0.062 7.386 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.230 -0.995 6.522 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -17.599 -4.208 4.432 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -16.817 -2.885 5.329 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.515 -4.266 6.208 1.00 0.00 H new ATOM 2299 N VAL B 54 -20.098 -1.743 9.870 1.00 0.00 N ATOM 2300 CA VAL B 54 -20.200 -0.929 11.080 1.00 0.00 C ATOM 2301 C VAL B 54 -19.427 -1.532 12.256 1.00 0.00 C ATOM 2302 O VAL B 54 -18.802 -0.788 13.008 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.626 -0.492 11.449 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -22.095 0.596 10.478 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.643 -1.625 11.536 1.00 0.00 C ATOM 0 H VAL B 54 -20.965 -2.194 9.578 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.703 0.007 10.826 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.570 -0.098 12.464 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -23.107 0.906 10.740 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.425 1.453 10.541 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -22.088 0.204 9.461 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.619 -1.218 11.802 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.710 -2.129 10.572 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -22.328 -2.339 12.297 1.00 0.00 H new ATOM 2315 N LYS B 55 -19.419 -2.859 12.417 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.572 -3.479 13.435 1.00 0.00 C ATOM 2317 C LYS B 55 -17.104 -3.136 13.159 1.00 0.00 C ATOM 2318 O LYS B 55 -16.392 -2.623 14.022 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.823 -4.995 13.481 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.890 -5.751 14.444 1.00 0.00 C ATOM 2321 CD LYS B 55 -17.876 -5.215 15.885 1.00 0.00 C ATOM 2322 CE LYS B 55 -19.261 -5.179 16.546 1.00 0.00 C ATOM 2323 NZ LYS B 55 -19.897 -6.509 16.567 1.00 0.00 N ATOM 0 H LYS B 55 -19.978 -3.511 11.867 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.823 -3.085 14.420 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.857 -5.174 13.777 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -18.703 -5.404 12.478 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -18.186 -6.800 14.465 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.875 -5.714 14.048 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -17.212 -5.836 16.487 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -17.458 -4.208 15.884 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -19.167 -4.806 17.566 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -19.901 -4.479 16.009 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -20.799 -6.454 17.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -20.073 -6.825 15.592 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -19.268 -7.187 17.043 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.656 -3.389 11.930 1.00 0.00 N ATOM 2338 CA LEU B 56 -15.314 -3.043 11.485 1.00 0.00 C ATOM 2339 C LEU B 56 -15.022 -1.552 11.719 1.00 0.00 C ATOM 2340 O LEU B 56 -13.953 -1.194 12.209 1.00 0.00 O ATOM 2341 CB LEU B 56 -15.169 -3.498 10.027 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.993 -2.856 9.282 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -13.355 -3.860 8.316 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.487 -1.657 8.468 1.00 0.00 C ATOM 0 H LEU B 56 -17.221 -3.843 11.213 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.555 -3.562 12.071 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.050 -4.581 10.006 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -16.091 -3.269 9.493 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.257 -2.538 10.021 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.522 -3.386 7.796 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.991 -4.722 8.875 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -14.098 -4.187 7.588 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.647 -1.204 7.941 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.232 -1.990 7.746 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.934 -0.922 9.137 1.00 0.00 H new ATOM 2356 N MET B 57 -15.972 -0.677 11.395 1.00 0.00 N ATOM 2357 CA MET B 57 -15.852 0.760 11.569 1.00 0.00 C ATOM 2358 C MET B 57 -15.701 1.083 13.049 1.00 0.00 C ATOM 2359 O MET B 57 -14.887 1.933 13.392 1.00 0.00 O ATOM 2360 CB MET B 57 -17.044 1.472 10.919 1.00 0.00 C ATOM 2361 CG MET B 57 -17.149 2.965 11.253 1.00 0.00 C ATOM 2362 SD MET B 57 -17.859 3.368 12.876 1.00 0.00 S ATOM 2363 CE MET B 57 -19.565 2.805 12.701 1.00 0.00 C ATOM 0 H MET B 57 -16.867 -0.960 10.995 1.00 0.00 H new ATOM 0 HA MET B 57 -14.958 1.128 11.066 1.00 0.00 H new ATOM 0 HB2 MET B 57 -16.974 1.358 9.837 1.00 0.00 H new ATOM 0 HB3 MET B 57 -17.963 0.976 11.233 1.00 0.00 H new ATOM 0 HG2 MET B 57 -16.152 3.401 11.196 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.752 3.448 10.484 1.00 0.00 H new ATOM 0 HE1 MET B 57 -20.167 3.210 13.514 1.00 0.00 H new ATOM 0 HE2 MET B 57 -19.965 3.148 11.747 1.00 0.00 H new ATOM 0 HE3 MET B 57 -19.594 1.716 12.736 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.448 0.409 13.928 1.00 0.00 N ATOM 2374 CA ASP B 58 -16.250 0.558 15.361 1.00 0.00 C ATOM 2375 C ASP B 58 -14.808 0.183 15.709 1.00 0.00 C ATOM 2376 O ASP B 58 -14.103 0.927 16.386 1.00 0.00 O ATOM 2377 CB ASP B 58 -17.266 -0.273 16.149 1.00 0.00 C ATOM 2378 CG ASP B 58 -17.077 -0.077 17.649 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -17.716 0.854 18.186 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -16.302 -0.866 18.232 1.00 0.00 O ATOM 0 H ASP B 58 -17.190 -0.241 13.668 1.00 0.00 H new ATOM 0 HA ASP B 58 -16.416 1.597 15.645 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.278 0.016 15.864 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -17.153 -1.328 15.898 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.348 -0.968 15.211 1.00 0.00 N ATOM 2386 CA ASP B 59 -12.998 -1.443 15.490 1.00 0.00 C ATOM 2387 C ASP B 59 -11.926 -0.488 14.957 1.00 0.00 C ATOM 2388 O ASP B 59 -10.857 -0.379 15.557 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.790 -2.866 14.951 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.811 -3.874 15.472 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -14.110 -3.816 16.685 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -14.260 -4.703 14.651 1.00 0.00 O ATOM 0 H ASP B 59 -14.895 -1.586 14.612 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.888 -1.471 16.574 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.838 -2.843 13.862 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.789 -3.204 15.219 1.00 0.00 H new ATOM 2397 N LEU B 60 -12.191 0.196 13.842 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.359 1.297 13.373 1.00 0.00 C ATOM 2399 C LEU B 60 -11.472 2.454 14.377 1.00 0.00 C ATOM 2400 O LEU B 60 -10.525 2.745 15.111 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.786 1.728 11.952 1.00 0.00 C ATOM 2402 CG LEU B 60 -11.098 0.917 10.840 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.953 0.792 9.579 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.802 1.601 10.390 1.00 0.00 C ATOM 0 H LEU B 60 -12.991 -0.001 13.241 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.317 0.984 13.310 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.866 1.620 11.856 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.558 2.785 11.816 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.920 -0.066 11.276 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.415 0.210 8.831 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.890 0.292 9.823 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.164 1.785 9.183 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.333 1.010 9.603 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -10.029 2.597 10.009 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -9.121 1.683 11.237 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.633 3.119 14.408 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.865 4.373 15.118 1.00 0.00 C ATOM 2418 C ASP B 61 -12.522 4.317 16.605 1.00 0.00 C ATOM 2419 O ASP B 61 -12.140 5.342 17.162 1.00 0.00 O ATOM 2420 CB ASP B 61 -14.233 5.000 14.798 1.00 0.00 C ATOM 2421 CG ASP B 61 -15.436 4.477 15.584 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -15.260 3.569 16.420 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -16.536 5.015 15.327 1.00 0.00 O ATOM 0 H ASP B 61 -13.464 2.783 13.921 1.00 0.00 H new ATOM 0 HA ASP B 61 -12.136 5.077 14.715 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -14.161 6.075 14.964 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -14.433 4.855 13.736 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.566 3.128 17.219 1.00 0.00 N ATOM 2429 CA ARG B 62 -12.057 2.854 18.558 1.00 0.00 C ATOM 2430 C ARG B 62 -10.767 3.636 18.832 1.00 0.00 C ATOM 2431 O ARG B 62 -10.647 4.270 19.879 1.00 0.00 O ATOM 2432 CB ARG B 62 -11.821 1.342 18.649 1.00 0.00 C ATOM 2433 CG ARG B 62 -11.117 0.867 19.930 1.00 0.00 C ATOM 2434 CD ARG B 62 -10.874 -0.647 19.854 1.00 0.00 C ATOM 2435 NE ARG B 62 -10.190 -1.001 18.602 1.00 0.00 N ATOM 2436 CZ ARG B 62 -8.919 -0.705 18.300 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -8.034 -0.415 19.260 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -8.559 -0.678 17.014 1.00 0.00 N ATOM 0 H ARG B 62 -12.973 2.304 16.776 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.775 3.174 19.313 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -12.783 0.835 18.572 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -11.227 1.030 17.790 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -10.169 1.392 20.052 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -11.727 1.104 20.801 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -10.273 -0.967 20.705 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -11.825 -1.177 19.917 1.00 0.00 H new ATOM 0 HE ARG B 62 -10.728 -1.515 17.905 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -8.323 -0.417 20.238 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -7.070 -0.192 19.014 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -9.246 -0.880 16.288 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -7.597 -0.455 16.758 1.00 0.00 H new ATOM 2517 N GLU B 67 -13.350 9.028 15.285 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.470 9.379 14.183 1.00 0.00 C ATOM 2519 C GLU B 67 -11.457 8.253 13.981 1.00 0.00 C ATOM 2520 O GLU B 67 -11.214 7.469 14.894 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.745 10.700 14.487 1.00 0.00 C ATOM 2522 CG GLU B 67 -12.647 11.938 14.375 1.00 0.00 C ATOM 2523 CD GLU B 67 -13.761 11.980 15.417 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -13.425 11.892 16.617 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -14.932 12.099 14.992 1.00 0.00 O ATOM 0 HA GLU B 67 -13.055 9.511 13.273 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.330 10.653 15.494 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -10.905 10.810 13.801 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -12.034 12.834 14.475 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.091 11.965 13.380 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.854 8.191 12.795 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.743 7.310 12.464 1.00 0.00 C ATOM 2534 C VAL B 68 -8.539 8.167 12.089 1.00 0.00 C ATOM 2535 O VAL B 68 -8.543 8.796 11.031 1.00 0.00 O ATOM 2536 CB VAL B 68 -10.111 6.329 11.341 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -9.084 5.191 11.328 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.514 5.735 11.506 1.00 0.00 C ATOM 0 H VAL B 68 -11.139 8.777 12.010 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.496 6.698 13.332 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.104 6.884 10.403 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.332 4.486 10.535 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -8.089 5.600 11.151 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -9.099 4.677 12.289 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.718 5.050 10.683 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.572 5.195 12.451 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -12.252 6.537 11.501 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.516 8.215 12.947 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.319 8.991 12.645 1.00 0.00 C ATOM 2550 C ASN B 69 -5.408 8.215 11.693 1.00 0.00 C ATOM 2551 O ASN B 69 -5.314 6.993 11.798 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.584 9.357 13.937 1.00 0.00 C ATOM 2553 CG ASN B 69 -4.320 10.153 13.623 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -4.400 11.299 13.199 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -3.146 9.557 13.800 1.00 0.00 N ATOM 0 H ASN B 69 -7.495 7.731 13.844 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.614 9.916 12.150 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -6.239 9.942 14.582 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.324 8.451 14.484 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -2.283 10.055 13.581 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -3.107 8.601 14.155 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.740 8.916 10.772 1.00 0.00 N ATOM 2563 CA PHE B 70 -3.965 8.324 9.683 1.00 0.00 C ATOM 2564 C PHE B 70 -3.157 7.073 10.071 1.00 0.00 C ATOM 2565 O PHE B 70 -3.374 5.991 9.522 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.076 9.406 9.060 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.168 8.867 7.979 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.735 8.253 6.848 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.782 8.778 8.205 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.925 7.530 5.959 1.00 0.00 C ATOM 2571 CE2 PHE B 70 0.027 8.053 7.316 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.550 7.404 6.211 1.00 0.00 C ATOM 0 H PHE B 70 -4.724 9.936 10.765 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.680 7.953 8.948 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.706 10.191 8.641 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.470 9.866 9.841 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.796 8.338 6.663 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.341 9.267 9.061 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.359 7.071 5.083 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.093 7.994 7.481 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.066 6.807 5.554 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.227 7.194 11.021 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.369 6.076 11.412 1.00 0.00 C ATOM 2584 C GLN B 71 -2.200 4.877 11.892 1.00 0.00 C ATOM 2585 O GLN B 71 -1.840 3.718 11.673 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.393 6.552 12.495 1.00 0.00 C ATOM 2587 CG GLN B 71 0.619 5.467 12.892 1.00 0.00 C ATOM 2588 CD GLN B 71 1.481 5.925 14.061 1.00 0.00 C ATOM 2589 OE1 GLN B 71 2.655 6.238 13.893 1.00 0.00 O ATOM 2590 NE2 GLN B 71 0.904 5.972 15.258 1.00 0.00 N ATOM 0 H GLN B 71 -2.050 8.058 11.534 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.802 5.737 10.545 1.00 0.00 H new ATOM 0 HB2 GLN B 71 0.143 7.430 12.136 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -0.955 6.860 13.377 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.090 4.553 13.162 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.254 5.228 12.039 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.075 5.705 15.363 1.00 0.00 H new ATOM 0 HE22 GLN B 71 1.440 6.275 16.071 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.315 5.156 12.569 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.179 4.137 13.134 1.00 0.00 C ATOM 2601 C GLU B 72 -5.006 3.500 12.015 1.00 0.00 C ATOM 2602 O GLU B 72 -5.224 2.292 12.030 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.022 4.735 14.267 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.187 4.982 15.540 1.00 0.00 C ATOM 2605 CD GLU B 72 -2.964 5.867 15.316 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.174 7.034 14.921 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -1.837 5.360 15.512 1.00 0.00 O ATOM 0 H GLU B 72 -3.641 6.108 12.738 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.594 3.336 13.586 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -5.462 5.675 13.934 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.847 4.061 14.499 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -4.823 5.443 16.296 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.860 4.022 15.940 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.419 4.290 11.017 1.00 0.00 N ATOM 2615 CA TYR B 73 -6.000 3.770 9.784 1.00 0.00 C ATOM 2616 C TYR B 73 -5.022 2.778 9.144 1.00 0.00 C ATOM 2617 O TYR B 73 -5.402 1.640 8.868 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.388 4.929 8.847 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.365 4.619 7.362 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.528 4.166 6.711 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.219 4.929 6.607 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.555 4.073 5.308 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.226 4.767 5.212 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.405 4.373 4.558 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.457 4.356 3.197 1.00 0.00 O ATOM 0 H TYR B 73 -5.358 5.308 11.046 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.921 3.227 9.996 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.390 5.265 9.113 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.712 5.763 9.034 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.398 3.890 7.288 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.331 5.293 7.102 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.462 3.770 4.806 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.326 4.945 4.643 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.748 4.928 2.835 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.761 3.182 8.938 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.747 2.292 8.374 1.00 0.00 C ATOM 2637 C ILE B 74 -2.643 1.015 9.223 1.00 0.00 C ATOM 2638 O ILE B 74 -2.759 -0.094 8.703 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.383 3.000 8.240 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.393 4.219 7.297 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.311 1.997 7.790 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.547 3.881 5.811 1.00 0.00 C ATOM 0 H ILE B 74 -3.423 4.120 9.155 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.053 2.012 7.366 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.150 3.389 9.231 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.208 4.881 7.591 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.465 4.775 7.434 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.648 2.506 7.698 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.228 1.198 8.527 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.591 1.574 6.825 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.543 4.801 5.226 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.719 3.246 5.495 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.488 3.355 5.653 1.00 0.00 H new ATOM 2654 N THR B 75 -2.444 1.168 10.535 1.00 0.00 N ATOM 2655 CA THR B 75 -2.358 0.041 11.461 1.00 0.00 C ATOM 2656 C THR B 75 -3.552 -0.902 11.295 1.00 0.00 C ATOM 2657 O THR B 75 -3.383 -2.115 11.177 1.00 0.00 O ATOM 2658 CB THR B 75 -2.258 0.562 12.900 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.102 1.367 13.012 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.187 -0.581 13.920 1.00 0.00 C ATOM 0 H THR B 75 -2.338 2.078 10.983 1.00 0.00 H new ATOM 0 HA THR B 75 -1.460 -0.533 11.233 1.00 0.00 H new ATOM 0 HB THR B 75 -3.156 1.141 13.118 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.284 2.254 12.638 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.117 -0.167 14.926 1.00 0.00 H new ATOM 0 HG22 THR B 75 -3.084 -1.195 13.842 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.309 -1.195 13.718 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.765 -0.349 11.276 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.956 -1.156 11.099 1.00 0.00 C ATOM 2670 C PHE B 76 -5.936 -1.846 9.742 1.00 0.00 C ATOM 2671 O PHE B 76 -6.289 -3.012 9.666 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.233 -0.342 11.267 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.466 -1.226 11.195 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.967 -1.831 12.364 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -9.011 -1.580 9.944 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.006 -2.776 12.279 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -10.075 -2.490 9.866 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.558 -3.107 11.030 1.00 0.00 C ATOM 0 H PHE B 76 -4.941 0.650 11.381 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.952 -1.914 11.882 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.212 0.178 12.225 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.285 0.421 10.491 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.553 -1.569 13.327 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.607 -1.148 9.041 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.380 -3.248 13.176 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.523 -2.716 8.910 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.353 -3.835 10.966 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.531 -1.172 8.664 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.370 -1.856 7.386 1.00 0.00 C ATOM 2690 C LEU B 77 -4.379 -3.018 7.521 1.00 0.00 C ATOM 2691 O LEU B 77 -4.579 -4.072 6.920 1.00 0.00 O ATOM 2692 CB LEU B 77 -5.016 -0.873 6.262 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.236 -0.023 5.860 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.814 1.112 4.931 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.292 -0.850 5.117 1.00 0.00 C ATOM 0 H LEU B 77 -5.313 -0.176 8.651 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.325 -2.294 7.097 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.206 -0.220 6.588 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.652 -1.424 5.395 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.659 0.364 6.787 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.688 1.702 4.657 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -5.091 1.749 5.440 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.361 0.696 4.031 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -8.135 -0.211 4.853 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.855 -1.268 4.210 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.638 -1.660 5.759 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.355 -2.873 8.364 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.507 -3.990 8.753 1.00 0.00 C ATOM 2709 C GLY B 78 -3.334 -5.105 9.398 1.00 0.00 C ATOM 2710 O GLY B 78 -3.271 -6.259 8.979 1.00 0.00 O ATOM 0 H GLY B 78 -3.095 -1.984 8.791 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.986 -4.378 7.878 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.744 -3.647 9.452 1.00 0.00 H new ATOM 2714 N ALA B 79 -4.143 -4.774 10.405 1.00 0.00 N ATOM 2715 CA ALA B 79 -5.059 -5.747 10.992 1.00 0.00 C ATOM 2716 C ALA B 79 -5.958 -6.389 9.925 1.00 0.00 C ATOM 2717 O ALA B 79 -6.201 -7.590 9.957 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.877 -5.116 12.122 1.00 0.00 C ATOM 0 H ALA B 79 -4.182 -3.846 10.827 1.00 0.00 H new ATOM 0 HA ALA B 79 -4.462 -6.549 11.427 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -6.552 -5.861 12.543 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -5.205 -4.755 12.900 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -6.458 -4.282 11.729 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.430 -5.610 8.952 1.00 0.00 N ATOM 2725 CA LEU B 80 -7.292 -6.080 7.881 1.00 0.00 C ATOM 2726 C LEU B 80 -6.534 -7.069 6.995 1.00 0.00 C ATOM 2727 O LEU B 80 -7.062 -8.120 6.647 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.849 -4.884 7.094 1.00 0.00 C ATOM 2729 CG LEU B 80 -9.127 -5.207 6.301 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -10.302 -5.559 7.223 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.521 -3.973 5.483 1.00 0.00 C ATOM 0 H LEU B 80 -6.216 -4.615 8.890 1.00 0.00 H new ATOM 0 HA LEU B 80 -8.146 -6.615 8.298 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -8.058 -4.070 7.788 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -7.085 -4.526 6.404 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.917 -6.066 5.664 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -11.183 -5.780 6.621 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -10.045 -6.432 7.823 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.514 -4.716 7.881 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.426 -4.187 4.915 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.704 -3.134 6.155 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.713 -3.719 4.797 1.00 0.00 H new ATOM 2743 N ALA B 81 -5.273 -6.768 6.675 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.375 -7.704 6.011 1.00 0.00 C ATOM 2745 C ALA B 81 -4.260 -8.998 6.829 1.00 0.00 C ATOM 2746 O ALA B 81 -4.360 -10.101 6.292 1.00 0.00 O ATOM 2747 CB ALA B 81 -3.018 -7.039 5.776 1.00 0.00 C ATOM 0 H ALA B 81 -4.848 -5.862 6.872 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.779 -7.978 5.036 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.349 -7.742 5.279 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.149 -6.157 5.148 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.587 -6.743 6.733 1.00 0.00 H new ATOM 2753 N MET B 82 -4.085 -8.874 8.146 1.00 0.00 N ATOM 2754 CA MET B 82 -4.030 -10.025 9.039 1.00 0.00 C ATOM 2755 C MET B 82 -5.355 -10.800 9.074 1.00 0.00 C ATOM 2756 O MET B 82 -5.336 -12.022 9.217 1.00 0.00 O ATOM 2757 CB MET B 82 -3.538 -9.574 10.421 1.00 0.00 C ATOM 2758 CG MET B 82 -3.227 -10.755 11.348 1.00 0.00 C ATOM 2759 SD MET B 82 -2.196 -10.352 12.785 1.00 0.00 S ATOM 2760 CE MET B 82 -3.194 -9.074 13.582 1.00 0.00 C ATOM 0 H MET B 82 -3.978 -7.976 8.618 1.00 0.00 H new ATOM 0 HA MET B 82 -3.308 -10.745 8.652 1.00 0.00 H new ATOM 0 HB2 MET B 82 -2.643 -8.964 10.303 1.00 0.00 H new ATOM 0 HB3 MET B 82 -4.296 -8.942 10.884 1.00 0.00 H new ATOM 0 HG2 MET B 82 -4.168 -11.177 11.702 1.00 0.00 H new ATOM 0 HG3 MET B 82 -2.728 -11.531 10.768 1.00 0.00 H new ATOM 0 HE1 MET B 82 -2.715 -8.765 14.511 1.00 0.00 H new ATOM 0 HE2 MET B 82 -3.284 -8.215 12.917 1.00 0.00 H new ATOM 0 HE3 MET B 82 -4.186 -9.470 13.800 1.00 0.00 H new ATOM 2770 N ILE B 83 -6.492 -10.114 8.924 1.00 0.00 N ATOM 2771 CA ILE B 83 -7.813 -10.729 8.819 1.00 0.00 C ATOM 2772 C ILE B 83 -7.972 -11.441 7.469 1.00 0.00 C ATOM 2773 O ILE B 83 -8.501 -12.549 7.438 1.00 0.00 O ATOM 2774 CB ILE B 83 -8.921 -9.691 9.100 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -8.913 -9.332 10.599 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -10.308 -10.219 8.702 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -9.668 -8.037 10.915 1.00 0.00 C ATOM 0 H ILE B 83 -6.517 -9.096 8.871 1.00 0.00 H new ATOM 0 HA ILE B 83 -7.915 -11.498 9.584 1.00 0.00 H new ATOM 0 HB ILE B 83 -8.717 -8.805 8.499 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -9.358 -10.151 11.164 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -7.881 -9.235 10.937 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -11.061 -9.460 8.915 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -10.317 -10.451 7.637 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -10.531 -11.121 9.271 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -9.624 -7.842 11.987 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -9.209 -7.208 10.376 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -10.709 -8.138 10.607 1.00 0.00 H new ATOM 2789 N TYR B 84 -7.505 -10.846 6.360 1.00 0.00 N ATOM 2790 CA TYR B 84 -7.419 -11.552 5.078 1.00 0.00 C ATOM 2791 C TYR B 84 -6.633 -12.845 5.322 1.00 0.00 C ATOM 2792 O TYR B 84 -7.032 -13.924 4.885 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.728 -10.710 3.989 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.472 -9.539 3.364 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.613 -8.959 3.955 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -6.988 -9.020 2.148 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -9.265 -7.884 3.322 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -7.657 -7.968 1.501 1.00 0.00 C ATOM 2799 CZ TYR B 84 -8.791 -7.391 2.094 1.00 0.00 C ATOM 2800 OH TYR B 84 -9.435 -6.356 1.482 1.00 0.00 O ATOM 0 H TYR B 84 -7.182 -9.879 6.328 1.00 0.00 H new ATOM 0 HA TYR B 84 -8.426 -11.758 4.714 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.804 -10.320 4.415 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.447 -11.387 3.182 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -8.987 -9.340 4.894 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.093 -9.435 1.708 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -10.133 -7.436 3.782 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -7.300 -7.604 0.549 1.00 0.00 H new ATOM 0 HH TYR B 84 -9.017 -6.178 0.614 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.513 -12.714 6.040 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.731 -13.791 6.629 1.00 0.00 C ATOM 2812 C ASN B 85 -3.951 -14.602 5.603 1.00 0.00 C ATOM 2813 O ASN B 85 -2.724 -14.617 5.638 1.00 0.00 O ATOM 2814 CB ASN B 85 -5.603 -14.690 7.517 1.00 0.00 C ATOM 2815 CG ASN B 85 -4.739 -15.386 8.558 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -4.411 -16.562 8.430 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -4.358 -14.651 9.597 1.00 0.00 N ATOM 0 H ASN B 85 -5.110 -11.797 6.233 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.982 -13.313 7.261 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -6.371 -14.094 8.009 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -6.118 -15.431 6.905 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -3.772 -15.061 10.324 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -4.651 -13.677 9.667 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.653 -15.241 4.664 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.046 -15.990 3.572 1.00 0.00 C ATOM 2826 C GLU B 86 -3.000 -15.121 2.875 1.00 0.00 C ATOM 2827 O GLU B 86 -1.888 -15.571 2.614 1.00 0.00 O ATOM 2828 CB GLU B 86 -5.140 -16.471 2.606 1.00 0.00 C ATOM 2829 CG GLU B 86 -4.583 -17.338 1.466 1.00 0.00 C ATOM 2830 CD GLU B 86 -3.839 -18.573 1.974 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -4.432 -19.290 2.809 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -2.689 -18.771 1.528 1.00 0.00 O ATOM 0 H GLU B 86 -5.673 -15.250 4.645 1.00 0.00 H new ATOM 0 HA GLU B 86 -3.536 -16.873 3.957 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -5.884 -17.042 3.161 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.652 -15.606 2.183 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -5.403 -17.653 0.820 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -3.908 -16.738 0.855 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.345 -13.851 2.644 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.435 -12.845 2.123 1.00 0.00 C ATOM 2841 C ALA B 87 -1.079 -12.872 2.841 1.00 0.00 C ATOM 2842 O ALA B 87 -0.040 -12.837 2.188 1.00 0.00 O ATOM 2843 CB ALA B 87 -3.090 -11.465 2.234 1.00 0.00 C ATOM 0 H ALA B 87 -4.284 -13.494 2.820 1.00 0.00 H new ATOM 0 HA ALA B 87 -2.236 -13.068 1.075 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -2.410 -10.707 1.844 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.015 -11.454 1.658 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.311 -11.250 3.279 1.00 0.00 H new ATOM 2849 N LEU B 88 -1.079 -12.948 4.178 1.00 0.00 N ATOM 2850 CA LEU B 88 0.156 -12.966 4.953 1.00 0.00 C ATOM 2851 C LEU B 88 0.957 -14.239 4.708 1.00 0.00 C ATOM 2852 O LEU B 88 2.166 -14.231 4.904 1.00 0.00 O ATOM 2853 CB LEU B 88 -0.095 -12.824 6.460 1.00 0.00 C ATOM 2854 CG LEU B 88 -0.887 -11.586 6.904 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -0.620 -11.372 8.401 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -0.505 -10.316 6.143 1.00 0.00 C ATOM 0 H LEU B 88 -1.927 -12.998 4.742 1.00 0.00 H new ATOM 0 HA LEU B 88 0.728 -12.104 4.611 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -0.627 -13.711 6.803 1.00 0.00 H new ATOM 0 HB3 LEU B 88 0.869 -12.814 6.968 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.941 -11.769 6.693 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.170 -10.497 8.747 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -0.947 -12.250 8.958 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.447 -11.217 8.562 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -1.103 -9.480 6.507 1.00 0.00 H new ATOM 0 HD22 LEU B 88 0.552 -10.102 6.300 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -0.692 -10.459 5.079 1.00 0.00 H new ATOM 2868 N LYS B 89 0.305 -15.335 4.315 1.00 0.00 N ATOM 2869 CA LYS B 89 0.992 -16.559 3.938 1.00 0.00 C ATOM 2870 C LYS B 89 1.599 -16.341 2.551 1.00 0.00 C ATOM 2871 O LYS B 89 2.807 -16.490 2.363 1.00 0.00 O ATOM 2872 CB LYS B 89 0.028 -17.756 3.994 1.00 0.00 C ATOM 2873 CG LYS B 89 -0.784 -17.750 5.298 1.00 0.00 C ATOM 2874 CD LYS B 89 -1.654 -19.005 5.426 1.00 0.00 C ATOM 2875 CE LYS B 89 -2.764 -18.793 6.466 1.00 0.00 C ATOM 2876 NZ LYS B 89 -2.233 -18.363 7.772 1.00 0.00 N ATOM 0 H LYS B 89 -0.711 -15.393 4.251 1.00 0.00 H new ATOM 0 HA LYS B 89 1.795 -16.795 4.636 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -0.649 -17.722 3.140 1.00 0.00 H new ATOM 0 HB3 LYS B 89 0.592 -18.685 3.917 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -0.106 -17.688 6.149 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -1.417 -16.863 5.329 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -2.096 -19.247 4.459 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -1.035 -19.854 5.715 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -3.466 -18.045 6.098 1.00 0.00 H new ATOM 0 HE3 LYS B 89 -3.323 -19.720 6.591 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 -2.900 -17.701 8.217 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 -2.108 -19.193 8.386 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 -1.316 -17.892 7.636 1.00 0.00 H new ATOM 2890 N GLY B 90 0.760 -15.931 1.597 1.00 0.00 N ATOM 2891 CA GLY B 90 1.178 -15.537 0.263 1.00 0.00 C ATOM 2892 C GLY B 90 0.085 -14.706 -0.408 1.00 0.00 C ATOM 2893 O GLY B 90 0.449 -13.730 -1.098 1.00 0.00 O ATOM 2894 OXT GLY B 90 -1.099 -15.073 -0.232 1.00 0.00 O ATOM 0 H GLY B 90 -0.248 -15.865 1.740 1.00 0.00 H new ATOM 0 HA2 GLY B 90 2.101 -14.960 0.319 1.00 0.00 H new ATOM 0 HA3 GLY B 90 1.391 -16.423 -0.336 1.00 0.00 H new