USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=35 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: A 71 GLN : amide:sc= 1.65 K(o=4,f=1.4) USER MOD Set 1.2: A 75 THR OG1 : rot -58:sc= 0.433 USER MOD Set 1.3: B 75 THR OG1 : rot 79:sc= 1.87 USER MOD Set 2.1: B 32 LYS NZ :NH3+ 167:sc= 0 (180deg=0) USER MOD Set 2.2: B 35 LYS NZ :NH3+ -132:sc= 0.172 (180deg=-1.99!) USER MOD Set 2.3: B 57 MET CE :methyl -164:sc= -0.0358 (180deg=-0.323) USER MOD Set 3.1: B 17 HIS : no HE2:sc= 1.47 K(o=2.4,f=-9.7!) USER MOD Set 3.2: B 27 HIS : no HE2:sc= 0.966 K(o=2.4,f=-8.3!) USER MOD Set 4.1: A 28 THR OG1 : rot -86:sc= 1.12 USER MOD Set 4.2: A 63 ASN : amide:sc= 1.76 K(o=4.1,f=0.32) USER MOD Set 4.3: A 69 ASN : amide:sc= 1.25 K(o=4.1,f=0.32) USER MOD Set 5.1: A 17 HIS : no HE2:sc= 1.5 K(o=7.6,f=-9.2!) USER MOD Set 5.2: A 27 HIS : no HE2:sc= 2.41 K(o=7.6,f=-20!) USER MOD Set 5.3: B 85 ASN : amide:sc= 2.23 K(o=7.6,f=-7.9!) USER MOD Set 5.4: B 89 LYS NZ :NH3+ 165:sc= 1.46 (180deg=-0.0751) USER MOD Single : A 3 SER OG : rot 26:sc= 0.65 USER MOD Single : A 7 GLN : amide:sc= 0.698 K(o=0.7,f=0) USER MOD Single : A 18 LYS NZ :NH3+ -176:sc= 0.914 (180deg=0.903) USER MOD Single : A 19 TYR OH : rot 118:sc= 1.05 USER MOD Single : A 20 SER OG : rot 180:sc= -0.579 USER MOD Single : A 30 SER OG : rot -2:sc= 0.766 USER MOD Single : A 31 LYS NZ :NH3+ 165:sc= 0.831 (180deg=0.689) USER MOD Single : A 32 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0833) USER MOD Single : A 35 LYS NZ :NH3+ -153:sc= 0.888 (180deg=0.339) USER MOD Single : A 39 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.039) USER MOD Single : A 40 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.0751) USER MOD Single : A 55 LYS NZ :NH3+ 169:sc= 0.573 (180deg=0.505) USER MOD Single : A 57 MET CE :methyl 167:sc=-0.00209 (180deg=-0.185) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 GLN : amide:sc= 1.11 K(o=1.1,f=-0.097) USER MOD Single : A 73 TYR OH : rot 156:sc= 1.19 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.689 K(o=0.69,f=-0.19) USER MOD Single : B 3 SER OG : rot 13:sc= 0.755 USER MOD Single : B 7 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 18 LYS NZ :NH3+ -170:sc= 0.374 (180deg=0.339) USER MOD Single : B 19 TYR OH : rot 172:sc= 1.18 USER MOD Single : B 20 SER OG : rot -84:sc= 0.965 USER MOD Single : B 28 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0379) USER MOD Single : B 39 GLN : amide:sc= -0.0374 K(o=-0.037,f=-0.81) USER MOD Single : B 40 LYS NZ :NH3+ -169:sc= 0.82 (180deg=0.694) USER MOD Single : B 55 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.111) USER MOD Single : B 69 ASN : amide:sc= 0.388 K(o=0.39,f=-3!) USER MOD Single : B 71 GLN : amide:sc= 0.845 K(o=0.84,f=-0.5) USER MOD Single : B 73 TYR OH : rot 153:sc= 1.17 USER MOD Single : B 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -9.622 -3.263 -6.001 1.00 0.00 N ATOM 31 CA SER A 3 -8.369 -3.680 -6.612 1.00 0.00 C ATOM 32 C SER A 3 -7.202 -2.695 -6.436 1.00 0.00 C ATOM 33 O SER A 3 -6.098 -3.153 -6.133 1.00 0.00 O ATOM 34 CB SER A 3 -8.618 -4.070 -8.073 1.00 0.00 C ATOM 35 OG SER A 3 -9.892 -4.681 -8.166 1.00 0.00 O ATOM 0 HA SER A 3 -8.024 -4.558 -6.066 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.573 -3.189 -8.713 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.844 -4.755 -8.419 1.00 0.00 H new ATOM 0 HG SER A 3 -10.464 -4.356 -7.440 1.00 0.00 H new ATOM 41 N PRO A 4 -7.390 -1.376 -6.629 1.00 0.00 N ATOM 42 CA PRO A 4 -6.363 -0.379 -6.364 1.00 0.00 C ATOM 43 C PRO A 4 -5.802 -0.470 -4.945 1.00 0.00 C ATOM 44 O PRO A 4 -4.589 -0.426 -4.762 1.00 0.00 O ATOM 45 CB PRO A 4 -7.013 0.984 -6.627 1.00 0.00 C ATOM 46 CG PRO A 4 -8.108 0.650 -7.635 1.00 0.00 C ATOM 47 CD PRO A 4 -8.580 -0.714 -7.140 1.00 0.00 C ATOM 0 HA PRO A 4 -5.502 -0.542 -7.013 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.422 1.419 -5.715 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -6.298 1.702 -7.030 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -8.910 1.388 -7.627 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -7.726 0.605 -8.655 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.335 -0.609 -6.361 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -9.033 -1.289 -7.948 1.00 0.00 H new ATOM 55 N LEU A 5 -6.657 -0.606 -3.927 1.00 0.00 N ATOM 56 CA LEU A 5 -6.149 -0.742 -2.571 1.00 0.00 C ATOM 57 C LEU A 5 -5.538 -2.128 -2.400 1.00 0.00 C ATOM 58 O LEU A 5 -4.432 -2.256 -1.876 1.00 0.00 O ATOM 59 CB LEU A 5 -7.243 -0.480 -1.529 1.00 0.00 C ATOM 60 CG LEU A 5 -6.698 -0.629 -0.096 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.516 0.299 0.199 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.788 -0.303 0.919 1.00 0.00 C ATOM 0 H LEU A 5 -7.673 -0.624 -4.016 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.377 0.010 -2.407 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.645 0.524 -1.665 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.067 -1.177 -1.681 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.363 -1.663 -0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.179 0.145 1.224 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.699 0.078 -0.488 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.827 1.336 0.071 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.390 -0.412 1.928 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.127 0.722 0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.627 -0.986 0.784 1.00 0.00 H new ATOM 74 N ASP A 6 -6.262 -3.162 -2.840 1.00 0.00 N ATOM 75 CA ASP A 6 -5.856 -4.551 -2.653 1.00 0.00 C ATOM 76 C ASP A 6 -4.426 -4.763 -3.140 1.00 0.00 C ATOM 77 O ASP A 6 -3.612 -5.336 -2.420 1.00 0.00 O ATOM 78 CB ASP A 6 -6.798 -5.518 -3.383 1.00 0.00 C ATOM 79 CG ASP A 6 -8.262 -5.405 -2.970 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.515 -5.002 -1.815 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.108 -5.731 -3.831 1.00 0.00 O ATOM 0 H ASP A 6 -7.147 -3.055 -3.336 1.00 0.00 H new ATOM 0 HA ASP A 6 -5.909 -4.763 -1.585 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -6.721 -5.340 -4.456 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.461 -6.539 -3.204 1.00 0.00 H new ATOM 86 N GLN A 7 -4.106 -4.298 -4.351 1.00 0.00 N ATOM 87 CA GLN A 7 -2.753 -4.442 -4.875 1.00 0.00 C ATOM 88 C GLN A 7 -1.740 -3.680 -4.016 1.00 0.00 C ATOM 89 O GLN A 7 -0.637 -4.169 -3.791 1.00 0.00 O ATOM 90 CB GLN A 7 -2.693 -4.046 -6.355 1.00 0.00 C ATOM 91 CG GLN A 7 -2.923 -2.549 -6.590 1.00 0.00 C ATOM 92 CD GLN A 7 -3.278 -2.270 -8.042 1.00 0.00 C ATOM 93 OE1 GLN A 7 -2.482 -1.732 -8.803 1.00 0.00 O ATOM 94 NE2 GLN A 7 -4.492 -2.644 -8.432 1.00 0.00 N ATOM 0 H GLN A 7 -4.758 -3.825 -4.977 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.473 -5.494 -4.820 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.720 -4.325 -6.760 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.443 -4.613 -6.907 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -3.725 -2.195 -5.942 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -2.025 -1.993 -6.319 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -5.126 -3.089 -7.769 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -4.790 -2.486 -9.395 1.00 0.00 H new ATOM 103 N ALA A 8 -2.101 -2.492 -3.523 1.00 0.00 N ATOM 104 CA ALA A 8 -1.200 -1.698 -2.703 1.00 0.00 C ATOM 105 C ALA A 8 -0.896 -2.400 -1.382 1.00 0.00 C ATOM 106 O ALA A 8 0.274 -2.591 -1.056 1.00 0.00 O ATOM 107 CB ALA A 8 -1.761 -0.300 -2.485 1.00 0.00 C ATOM 0 H ALA A 8 -3.013 -2.064 -3.681 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.255 -1.593 -3.236 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.071 0.277 -1.869 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -1.889 0.195 -3.448 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.725 -0.369 -1.982 1.00 0.00 H new ATOM 113 N ILE A 9 -1.919 -2.817 -0.626 1.00 0.00 N ATOM 114 CA ILE A 9 -1.657 -3.603 0.578 1.00 0.00 C ATOM 115 C ILE A 9 -0.869 -4.861 0.181 1.00 0.00 C ATOM 116 O ILE A 9 0.182 -5.148 0.755 1.00 0.00 O ATOM 117 CB ILE A 9 -2.925 -3.843 1.434 1.00 0.00 C ATOM 118 CG1 ILE A 9 -4.042 -4.634 0.740 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.425 -2.499 1.981 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.264 -4.867 1.640 1.00 0.00 C ATOM 0 H ILE A 9 -2.903 -2.630 -0.820 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.027 -3.037 1.265 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.628 -4.495 2.255 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.355 -4.099 -0.156 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.649 -5.597 0.415 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.318 -2.661 2.585 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.648 -2.045 2.597 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.664 -1.835 1.151 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.018 -5.431 1.091 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -4.963 -5.428 2.524 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.680 -3.907 1.944 1.00 0.00 H new ATOM 132 N GLY A 10 -1.315 -5.546 -0.876 1.00 0.00 N ATOM 133 CA GLY A 10 -0.615 -6.654 -1.509 1.00 0.00 C ATOM 134 C GLY A 10 0.885 -6.395 -1.655 1.00 0.00 C ATOM 135 O GLY A 10 1.687 -7.267 -1.340 1.00 0.00 O ATOM 0 H GLY A 10 -2.205 -5.332 -1.326 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.768 -7.559 -0.921 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.046 -6.836 -2.493 1.00 0.00 H new ATOM 139 N LEU A 11 1.272 -5.201 -2.113 1.00 0.00 N ATOM 140 CA LEU A 11 2.662 -4.801 -2.281 1.00 0.00 C ATOM 141 C LEU A 11 3.418 -4.941 -0.954 1.00 0.00 C ATOM 142 O LEU A 11 4.367 -5.717 -0.862 1.00 0.00 O ATOM 143 CB LEU A 11 2.709 -3.366 -2.840 1.00 0.00 C ATOM 144 CG LEU A 11 3.990 -2.951 -3.582 1.00 0.00 C ATOM 145 CD1 LEU A 11 5.255 -3.163 -2.757 1.00 0.00 C ATOM 146 CD2 LEU A 11 4.099 -3.618 -4.955 1.00 0.00 C ATOM 0 H LEU A 11 0.609 -4.474 -2.382 1.00 0.00 H new ATOM 0 HA LEU A 11 3.161 -5.455 -2.996 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.867 -3.239 -3.520 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.557 -2.674 -2.012 1.00 0.00 H new ATOM 0 HG LEU A 11 3.904 -1.876 -3.743 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.124 -2.851 -3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.197 -2.571 -1.843 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.350 -4.218 -2.501 1.00 0.00 H new ATOM 0 HD21 LEU A 11 5.019 -3.296 -5.444 1.00 0.00 H new ATOM 0 HD22 LEU A 11 4.112 -4.701 -4.833 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.244 -3.332 -5.567 1.00 0.00 H new ATOM 158 N LEU A 12 2.991 -4.210 0.082 1.00 0.00 N ATOM 159 CA LEU A 12 3.588 -4.273 1.416 1.00 0.00 C ATOM 160 C LEU A 12 3.654 -5.721 1.901 1.00 0.00 C ATOM 161 O LEU A 12 4.681 -6.163 2.426 1.00 0.00 O ATOM 162 CB LEU A 12 2.754 -3.449 2.416 1.00 0.00 C ATOM 163 CG LEU A 12 2.988 -1.933 2.371 1.00 0.00 C ATOM 164 CD1 LEU A 12 2.503 -1.282 1.072 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.258 -1.268 3.544 1.00 0.00 C ATOM 0 H LEU A 12 2.214 -3.553 0.015 1.00 0.00 H new ATOM 0 HA LEU A 12 4.596 -3.862 1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.698 -3.643 2.230 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.970 -3.804 3.424 1.00 0.00 H new ATOM 0 HG LEU A 12 4.066 -1.786 2.432 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.699 -0.210 1.107 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.032 -1.720 0.226 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.432 -1.452 0.958 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.424 -0.191 3.512 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.190 -1.473 3.471 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.640 -1.667 4.484 1.00 0.00 H new ATOM 177 N ILE A 13 2.543 -6.444 1.758 1.00 0.00 N ATOM 178 CA ILE A 13 2.415 -7.800 2.262 1.00 0.00 C ATOM 179 C ILE A 13 3.436 -8.704 1.567 1.00 0.00 C ATOM 180 O ILE A 13 4.151 -9.455 2.234 1.00 0.00 O ATOM 181 CB ILE A 13 0.951 -8.280 2.122 1.00 0.00 C ATOM 182 CG1 ILE A 13 0.110 -7.843 3.336 1.00 0.00 C ATOM 183 CG2 ILE A 13 0.863 -9.807 2.031 1.00 0.00 C ATOM 184 CD1 ILE A 13 -0.217 -6.349 3.400 1.00 0.00 C ATOM 0 H ILE A 13 1.707 -6.099 1.287 1.00 0.00 H new ATOM 0 HA ILE A 13 2.643 -7.839 3.327 1.00 0.00 H new ATOM 0 HB ILE A 13 0.568 -7.830 1.206 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.825 -8.403 3.330 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.643 -8.121 4.245 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.181 -10.106 1.934 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.422 -10.153 1.162 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.285 -10.250 2.933 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.812 -6.144 4.290 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.709 -5.775 3.442 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.782 -6.062 2.513 1.00 0.00 H new ATOM 196 N GLY A 14 3.508 -8.608 0.239 1.00 0.00 N ATOM 197 CA GLY A 14 4.431 -9.349 -0.596 1.00 0.00 C ATOM 198 C GLY A 14 5.865 -9.026 -0.207 1.00 0.00 C ATOM 199 O GLY A 14 6.639 -9.933 0.084 1.00 0.00 O ATOM 0 H GLY A 14 2.900 -7.988 -0.296 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.250 -10.419 -0.491 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.266 -9.099 -1.644 1.00 0.00 H new ATOM 203 N ILE A 15 6.215 -7.736 -0.174 1.00 0.00 N ATOM 204 CA ILE A 15 7.535 -7.278 0.239 1.00 0.00 C ATOM 205 C ILE A 15 7.928 -7.927 1.569 1.00 0.00 C ATOM 206 O ILE A 15 9.027 -8.464 1.693 1.00 0.00 O ATOM 207 CB ILE A 15 7.583 -5.734 0.247 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.943 -5.262 -1.173 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.577 -5.182 1.274 1.00 0.00 C ATOM 210 CD1 ILE A 15 8.075 -3.742 -1.299 1.00 0.00 C ATOM 0 H ILE A 15 5.583 -6.980 -0.436 1.00 0.00 H new ATOM 0 HA ILE A 15 8.289 -7.597 -0.481 1.00 0.00 H new ATOM 0 HB ILE A 15 6.606 -5.352 0.543 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.882 -5.726 -1.474 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.179 -5.611 -1.867 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.571 -4.093 1.237 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.291 -5.513 2.272 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.578 -5.547 1.044 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.330 -3.483 -2.327 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.129 -3.271 -1.030 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.860 -3.388 -0.630 1.00 0.00 H new ATOM 222 N PHE A 16 7.028 -7.904 2.555 1.00 0.00 N ATOM 223 CA PHE A 16 7.304 -8.536 3.835 1.00 0.00 C ATOM 224 C PHE A 16 7.544 -10.036 3.659 1.00 0.00 C ATOM 225 O PHE A 16 8.613 -10.547 3.992 1.00 0.00 O ATOM 226 CB PHE A 16 6.156 -8.264 4.815 1.00 0.00 C ATOM 227 CG PHE A 16 6.437 -8.691 6.243 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.243 -10.027 6.641 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.931 -7.757 7.171 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.455 -10.401 7.977 1.00 0.00 C ATOM 231 CE2 PHE A 16 7.115 -8.124 8.515 1.00 0.00 C ATOM 232 CZ PHE A 16 6.838 -9.438 8.926 1.00 0.00 C ATOM 0 H PHE A 16 6.113 -7.458 2.488 1.00 0.00 H new ATOM 0 HA PHE A 16 8.215 -8.106 4.251 1.00 0.00 H new ATOM 0 HB2 PHE A 16 5.931 -7.198 4.805 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.264 -8.781 4.463 1.00 0.00 H new ATOM 0 HD1 PHE A 16 5.931 -10.765 5.917 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.170 -6.754 6.850 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.324 -11.430 8.276 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.469 -7.397 9.231 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.919 -9.708 9.969 1.00 0.00 H new ATOM 242 N HIS A 17 6.539 -10.750 3.149 1.00 0.00 N ATOM 243 CA HIS A 17 6.552 -12.206 3.155 1.00 0.00 C ATOM 244 C HIS A 17 7.627 -12.802 2.254 1.00 0.00 C ATOM 245 O HIS A 17 8.151 -13.873 2.552 1.00 0.00 O ATOM 246 CB HIS A 17 5.147 -12.765 2.926 1.00 0.00 C ATOM 247 CG HIS A 17 4.272 -12.468 4.117 1.00 0.00 C ATOM 248 ND1 HIS A 17 3.654 -11.266 4.366 1.00 0.00 N ATOM 249 CD2 HIS A 17 4.218 -13.209 5.269 1.00 0.00 C ATOM 250 CE1 HIS A 17 3.230 -11.288 5.642 1.00 0.00 C ATOM 251 NE2 HIS A 17 3.552 -12.450 6.238 1.00 0.00 N ATOM 0 H HIS A 17 5.706 -10.339 2.727 1.00 0.00 H new ATOM 0 HA HIS A 17 6.849 -12.532 4.152 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.714 -12.325 2.028 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.198 -13.841 2.761 1.00 0.00 H new ATOM 0 HD1 HIS A 17 3.538 -10.498 3.705 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.619 -14.203 5.405 1.00 0.00 H new ATOM 0 HE1 HIS A 17 2.701 -10.480 6.124 1.00 0.00 H new ATOM 259 N LYS A 18 8.009 -12.086 1.196 1.00 0.00 N ATOM 260 CA LYS A 18 9.164 -12.433 0.382 1.00 0.00 C ATOM 261 C LYS A 18 10.390 -12.600 1.283 1.00 0.00 C ATOM 262 O LYS A 18 11.146 -13.560 1.141 1.00 0.00 O ATOM 263 CB LYS A 18 9.383 -11.330 -0.664 1.00 0.00 C ATOM 264 CG LYS A 18 10.481 -11.674 -1.679 1.00 0.00 C ATOM 265 CD LYS A 18 10.893 -10.450 -2.509 1.00 0.00 C ATOM 266 CE LYS A 18 9.712 -9.792 -3.232 1.00 0.00 C ATOM 267 NZ LYS A 18 10.167 -8.702 -4.114 1.00 0.00 N ATOM 0 H LYS A 18 7.521 -11.247 0.882 1.00 0.00 H new ATOM 0 HA LYS A 18 8.997 -13.376 -0.138 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.448 -11.150 -1.195 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.644 -10.402 -0.156 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.352 -12.067 -1.154 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.128 -12.462 -2.344 1.00 0.00 H new ATOM 0 HD2 LYS A 18 11.366 -9.717 -1.855 1.00 0.00 H new ATOM 0 HD3 LYS A 18 11.640 -10.751 -3.244 1.00 0.00 H new ATOM 0 HE2 LYS A 18 9.179 -10.540 -3.819 1.00 0.00 H new ATOM 0 HE3 LYS A 18 9.006 -9.400 -2.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 9.342 -8.231 -4.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.713 -8.012 -3.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 10.767 -9.093 -4.868 1.00 0.00 H new ATOM 281 N TYR A 19 10.594 -11.650 2.198 1.00 0.00 N ATOM 282 CA TYR A 19 11.736 -11.656 3.092 1.00 0.00 C ATOM 283 C TYR A 19 11.525 -12.586 4.280 1.00 0.00 C ATOM 284 O TYR A 19 12.414 -13.390 4.551 1.00 0.00 O ATOM 285 CB TYR A 19 12.116 -10.228 3.478 1.00 0.00 C ATOM 286 CG TYR A 19 13.060 -9.617 2.465 1.00 0.00 C ATOM 287 CD1 TYR A 19 12.553 -9.048 1.284 1.00 0.00 C ATOM 288 CD2 TYR A 19 14.450 -9.763 2.630 1.00 0.00 C ATOM 289 CE1 TYR A 19 13.433 -8.569 0.300 1.00 0.00 C ATOM 290 CE2 TYR A 19 15.328 -9.307 1.634 1.00 0.00 C ATOM 291 CZ TYR A 19 14.823 -8.697 0.476 1.00 0.00 C ATOM 292 OH TYR A 19 15.672 -8.010 -0.336 1.00 0.00 O ATOM 0 H TYR A 19 9.967 -10.857 2.334 1.00 0.00 H new ATOM 0 HA TYR A 19 12.594 -12.073 2.565 1.00 0.00 H new ATOM 0 HB2 TYR A 19 11.216 -9.618 3.554 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.585 -10.228 4.462 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.486 -8.979 1.133 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.842 -10.226 3.524 1.00 0.00 H new ATOM 0 HE1 TYR A 19 13.043 -8.102 -0.592 1.00 0.00 H new ATOM 0 HE2 TYR A 19 16.394 -9.426 1.759 1.00 0.00 H new ATOM 0 HH TYR A 19 16.201 -7.383 0.200 1.00 0.00 H new ATOM 302 N SER A 20 10.384 -12.530 4.980 1.00 0.00 N ATOM 303 CA SER A 20 10.175 -13.463 6.085 1.00 0.00 C ATOM 304 C SER A 20 10.332 -14.901 5.595 1.00 0.00 C ATOM 305 O SER A 20 11.020 -15.684 6.241 1.00 0.00 O ATOM 306 CB SER A 20 8.865 -13.241 6.843 1.00 0.00 C ATOM 307 OG SER A 20 7.731 -13.509 6.053 1.00 0.00 O ATOM 0 H SER A 20 9.621 -11.875 4.808 1.00 0.00 H new ATOM 0 HA SER A 20 10.951 -13.262 6.824 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.848 -13.880 7.726 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.823 -12.210 7.195 1.00 0.00 H new ATOM 0 HG SER A 20 6.920 -13.354 6.581 1.00 0.00 H new ATOM 313 N GLY A 21 9.793 -15.213 4.411 1.00 0.00 N ATOM 314 CA GLY A 21 9.981 -16.474 3.703 1.00 0.00 C ATOM 315 C GLY A 21 11.397 -17.050 3.813 1.00 0.00 C ATOM 316 O GLY A 21 11.555 -18.265 3.903 1.00 0.00 O ATOM 0 H GLY A 21 9.191 -14.565 3.904 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.272 -17.205 4.091 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.742 -16.326 2.650 1.00 0.00 H new ATOM 398 N HIS A 27 4.788 -14.340 9.985 1.00 0.00 N ATOM 399 CA HIS A 27 4.367 -12.943 10.004 1.00 0.00 C ATOM 400 C HIS A 27 5.310 -12.137 10.911 1.00 0.00 C ATOM 401 O HIS A 27 4.892 -11.220 11.619 1.00 0.00 O ATOM 402 CB HIS A 27 2.891 -12.883 10.417 1.00 0.00 C ATOM 403 CG HIS A 27 2.025 -13.782 9.566 1.00 0.00 C ATOM 404 ND1 HIS A 27 2.181 -14.012 8.216 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.066 -14.647 10.020 1.00 0.00 C ATOM 406 CE1 HIS A 27 1.332 -14.994 7.871 1.00 0.00 C ATOM 407 NE2 HIS A 27 0.616 -15.404 8.933 1.00 0.00 N ATOM 0 HA HIS A 27 4.437 -12.484 9.018 1.00 0.00 H new ATOM 0 HB2 HIS A 27 2.796 -13.173 11.463 1.00 0.00 H new ATOM 0 HB3 HIS A 27 2.534 -11.856 10.338 1.00 0.00 H new ATOM 0 HD1 HIS A 27 2.824 -13.525 7.592 1.00 0.00 H new ATOM 0 HD2 HIS A 27 0.718 -14.730 11.039 1.00 0.00 H new ATOM 0 HE1 HIS A 27 1.237 -15.400 6.875 1.00 0.00 H new ATOM 415 N THR A 28 6.599 -12.480 10.852 1.00 0.00 N ATOM 416 CA THR A 28 7.685 -11.968 11.667 1.00 0.00 C ATOM 417 C THR A 28 8.921 -12.009 10.765 1.00 0.00 C ATOM 418 O THR A 28 8.999 -12.883 9.903 1.00 0.00 O ATOM 419 CB THR A 28 7.835 -12.848 12.916 1.00 0.00 C ATOM 420 OG1 THR A 28 6.602 -12.958 13.601 1.00 0.00 O ATOM 421 CG2 THR A 28 8.897 -12.320 13.883 1.00 0.00 C ATOM 0 H THR A 28 6.927 -13.175 10.181 1.00 0.00 H new ATOM 0 HA THR A 28 7.518 -10.953 12.026 1.00 0.00 H new ATOM 0 HB THR A 28 8.156 -13.828 12.563 1.00 0.00 H new ATOM 0 HG1 THR A 28 6.502 -12.204 14.218 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.962 -12.980 14.748 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.863 -12.286 13.379 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.624 -11.317 14.211 1.00 0.00 H new ATOM 429 N LEU A 29 9.836 -11.047 10.904 1.00 0.00 N ATOM 430 CA LEU A 29 10.921 -10.822 9.955 1.00 0.00 C ATOM 431 C LEU A 29 12.122 -10.276 10.733 1.00 0.00 C ATOM 432 O LEU A 29 11.971 -9.312 11.479 1.00 0.00 O ATOM 433 CB LEU A 29 10.365 -9.833 8.912 1.00 0.00 C ATOM 434 CG LEU A 29 11.048 -9.773 7.540 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.107 -9.050 6.570 1.00 0.00 C ATOM 436 CD2 LEU A 29 12.368 -9.008 7.575 1.00 0.00 C ATOM 0 H LEU A 29 9.842 -10.396 11.689 1.00 0.00 H new ATOM 0 HA LEU A 29 11.262 -11.721 9.442 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.314 -10.073 8.751 1.00 0.00 H new ATOM 0 HB3 LEU A 29 10.401 -8.834 9.347 1.00 0.00 H new ATOM 0 HG LEU A 29 11.261 -10.796 7.228 1.00 0.00 H new ATOM 0 HD11 LEU A 29 10.572 -8.995 5.586 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.168 -9.598 6.498 1.00 0.00 H new ATOM 0 HD13 LEU A 29 9.912 -8.042 6.936 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.808 -8.996 6.578 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.187 -7.985 7.904 1.00 0.00 H new ATOM 0 HD23 LEU A 29 13.053 -9.496 8.269 1.00 0.00 H new ATOM 448 N SER A 30 13.310 -10.876 10.602 1.00 0.00 N ATOM 449 CA SER A 30 14.428 -10.541 11.486 1.00 0.00 C ATOM 450 C SER A 30 15.056 -9.195 11.111 1.00 0.00 C ATOM 451 O SER A 30 14.906 -8.724 9.992 1.00 0.00 O ATOM 452 CB SER A 30 15.477 -11.657 11.440 1.00 0.00 C ATOM 453 OG SER A 30 14.948 -12.852 11.972 1.00 0.00 O ATOM 0 H SER A 30 13.520 -11.587 9.901 1.00 0.00 H new ATOM 0 HA SER A 30 14.045 -10.450 12.502 1.00 0.00 H new ATOM 0 HB2 SER A 30 15.798 -11.820 10.411 1.00 0.00 H new ATOM 0 HB3 SER A 30 16.359 -11.359 12.006 1.00 0.00 H new ATOM 0 HG SER A 30 14.036 -12.692 12.292 1.00 0.00 H new ATOM 459 N LYS A 31 15.761 -8.550 12.044 1.00 0.00 N ATOM 460 CA LYS A 31 16.207 -7.171 11.868 1.00 0.00 C ATOM 461 C LYS A 31 17.188 -6.980 10.703 1.00 0.00 C ATOM 462 O LYS A 31 16.980 -6.133 9.835 1.00 0.00 O ATOM 463 CB LYS A 31 16.703 -6.608 13.204 1.00 0.00 C ATOM 464 CG LYS A 31 17.786 -7.412 13.940 1.00 0.00 C ATOM 465 CD LYS A 31 17.901 -6.833 15.356 1.00 0.00 C ATOM 466 CE LYS A 31 18.695 -7.743 16.296 1.00 0.00 C ATOM 467 NZ LYS A 31 18.618 -7.245 17.681 1.00 0.00 N ATOM 0 H LYS A 31 16.035 -8.967 12.934 1.00 0.00 H new ATOM 0 HA LYS A 31 15.345 -6.578 11.562 1.00 0.00 H new ATOM 0 HB2 LYS A 31 17.088 -5.604 13.027 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.845 -6.507 13.869 1.00 0.00 H new ATOM 0 HG2 LYS A 31 17.521 -8.469 13.977 1.00 0.00 H new ATOM 0 HG3 LYS A 31 18.740 -7.341 13.417 1.00 0.00 H new ATOM 0 HD2 LYS A 31 18.382 -5.856 15.308 1.00 0.00 H new ATOM 0 HD3 LYS A 31 16.902 -6.677 15.764 1.00 0.00 H new ATOM 0 HE2 LYS A 31 18.303 -8.759 16.246 1.00 0.00 H new ATOM 0 HE3 LYS A 31 19.736 -7.787 15.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 18.935 -7.989 18.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 19.229 -6.410 17.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 17.636 -6.985 17.902 1.00 0.00 H new ATOM 481 N LYS A 32 18.248 -7.785 10.633 1.00 0.00 N ATOM 482 CA LYS A 32 19.161 -7.688 9.496 1.00 0.00 C ATOM 483 C LYS A 32 18.435 -8.067 8.197 1.00 0.00 C ATOM 484 O LYS A 32 18.699 -7.497 7.143 1.00 0.00 O ATOM 485 CB LYS A 32 20.428 -8.516 9.742 1.00 0.00 C ATOM 486 CG LYS A 32 21.409 -8.401 8.565 1.00 0.00 C ATOM 487 CD LYS A 32 22.699 -9.181 8.844 1.00 0.00 C ATOM 488 CE LYS A 32 23.722 -8.997 7.714 1.00 0.00 C ATOM 489 NZ LYS A 32 23.223 -9.496 6.419 1.00 0.00 N ATOM 0 H LYS A 32 18.491 -8.491 11.328 1.00 0.00 H new ATOM 0 HA LYS A 32 19.490 -6.655 9.384 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.914 -8.178 10.657 1.00 0.00 H new ATOM 0 HB3 LYS A 32 20.158 -9.561 9.892 1.00 0.00 H new ATOM 0 HG2 LYS A 32 20.939 -8.781 7.658 1.00 0.00 H new ATOM 0 HG3 LYS A 32 21.646 -7.352 8.386 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.132 -8.846 9.786 1.00 0.00 H new ATOM 0 HD3 LYS A 32 22.468 -10.240 8.958 1.00 0.00 H new ATOM 0 HE2 LYS A 32 23.971 -7.940 7.622 1.00 0.00 H new ATOM 0 HE3 LYS A 32 24.643 -9.520 7.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.992 -9.476 5.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 22.883 -10.472 6.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 22.442 -8.892 6.092 1.00 0.00 H new ATOM 503 N GLU A 33 17.501 -9.017 8.270 1.00 0.00 N ATOM 504 CA GLU A 33 16.682 -9.416 7.135 1.00 0.00 C ATOM 505 C GLU A 33 15.810 -8.238 6.671 1.00 0.00 C ATOM 506 O GLU A 33 15.684 -7.998 5.472 1.00 0.00 O ATOM 507 CB GLU A 33 15.892 -10.664 7.540 1.00 0.00 C ATOM 508 CG GLU A 33 15.091 -11.312 6.412 1.00 0.00 C ATOM 509 CD GLU A 33 14.341 -12.509 6.984 1.00 0.00 C ATOM 510 OE1 GLU A 33 13.200 -12.289 7.441 1.00 0.00 O ATOM 511 OE2 GLU A 33 14.955 -13.597 7.027 1.00 0.00 O ATOM 0 H GLU A 33 17.294 -9.532 9.126 1.00 0.00 H new ATOM 0 HA GLU A 33 17.289 -9.679 6.269 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.587 -11.401 7.943 1.00 0.00 H new ATOM 0 HB3 GLU A 33 15.208 -10.398 8.345 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.391 -10.595 5.983 1.00 0.00 H new ATOM 0 HG3 GLU A 33 15.755 -11.629 5.608 1.00 0.00 H new ATOM 518 N LEU A 34 15.254 -7.463 7.608 1.00 0.00 N ATOM 519 CA LEU A 34 14.582 -6.204 7.319 1.00 0.00 C ATOM 520 C LEU A 34 15.560 -5.278 6.606 1.00 0.00 C ATOM 521 O LEU A 34 15.230 -4.711 5.569 1.00 0.00 O ATOM 522 CB LEU A 34 14.001 -5.583 8.603 1.00 0.00 C ATOM 523 CG LEU A 34 13.426 -4.160 8.477 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.500 -3.068 8.343 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.374 -4.067 7.364 1.00 0.00 C ATOM 0 H LEU A 34 15.261 -7.701 8.600 1.00 0.00 H new ATOM 0 HA LEU A 34 13.732 -6.375 6.658 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.212 -6.238 8.973 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.785 -5.569 9.360 1.00 0.00 H new ATOM 0 HG LEU A 34 12.925 -3.961 9.425 1.00 0.00 H new ATOM 0 HD11 LEU A 34 14.019 -2.093 8.259 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.143 -3.081 9.223 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.100 -3.255 7.452 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.993 -3.047 7.308 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.828 -4.338 6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.553 -4.750 7.582 1.00 0.00 H new ATOM 537 N LYS A 35 16.777 -5.111 7.125 1.00 0.00 N ATOM 538 CA LYS A 35 17.743 -4.281 6.418 1.00 0.00 C ATOM 539 C LYS A 35 17.937 -4.791 4.981 1.00 0.00 C ATOM 540 O LYS A 35 17.946 -4.002 4.041 1.00 0.00 O ATOM 541 CB LYS A 35 19.054 -4.178 7.200 1.00 0.00 C ATOM 542 CG LYS A 35 19.890 -3.031 6.625 1.00 0.00 C ATOM 543 CD LYS A 35 21.128 -2.770 7.484 1.00 0.00 C ATOM 544 CE LYS A 35 21.778 -1.442 7.084 1.00 0.00 C ATOM 545 NZ LYS A 35 22.173 -1.421 5.665 1.00 0.00 N ATOM 0 H LYS A 35 17.106 -5.523 7.998 1.00 0.00 H new ATOM 0 HA LYS A 35 17.354 -3.266 6.343 1.00 0.00 H new ATOM 0 HB2 LYS A 35 18.849 -4.002 8.256 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.606 -5.116 7.134 1.00 0.00 H new ATOM 0 HG2 LYS A 35 20.194 -3.273 5.607 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.284 -2.127 6.570 1.00 0.00 H new ATOM 0 HD2 LYS A 35 20.850 -2.745 8.538 1.00 0.00 H new ATOM 0 HD3 LYS A 35 21.842 -3.584 7.362 1.00 0.00 H new ATOM 0 HE2 LYS A 35 21.082 -0.626 7.278 1.00 0.00 H new ATOM 0 HE3 LYS A 35 22.656 -1.267 7.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 22.971 -0.766 5.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 22.458 -2.377 5.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 21.369 -1.105 5.086 1.00 0.00 H new ATOM 559 N GLU A 36 18.041 -6.109 4.802 1.00 0.00 N ATOM 560 CA GLU A 36 18.162 -6.747 3.496 1.00 0.00 C ATOM 561 C GLU A 36 16.939 -6.459 2.602 1.00 0.00 C ATOM 562 O GLU A 36 17.074 -6.294 1.388 1.00 0.00 O ATOM 563 CB GLU A 36 18.406 -8.254 3.700 1.00 0.00 C ATOM 564 CG GLU A 36 19.284 -8.855 2.596 1.00 0.00 C ATOM 565 CD GLU A 36 20.734 -8.389 2.720 1.00 0.00 C ATOM 566 OE1 GLU A 36 21.388 -8.827 3.693 1.00 0.00 O ATOM 567 OE2 GLU A 36 21.156 -7.596 1.852 1.00 0.00 O ATOM 0 H GLU A 36 18.043 -6.772 5.577 1.00 0.00 H new ATOM 0 HA GLU A 36 19.015 -6.326 2.963 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.881 -8.415 4.668 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.449 -8.775 3.724 1.00 0.00 H new ATOM 0 HG2 GLU A 36 19.244 -9.943 2.649 1.00 0.00 H new ATOM 0 HG3 GLU A 36 18.891 -8.569 1.620 1.00 0.00 H new ATOM 574 N LEU A 37 15.741 -6.405 3.193 1.00 0.00 N ATOM 575 CA LEU A 37 14.526 -5.938 2.530 1.00 0.00 C ATOM 576 C LEU A 37 14.730 -4.512 2.052 1.00 0.00 C ATOM 577 O LEU A 37 14.597 -4.231 0.863 1.00 0.00 O ATOM 578 CB LEU A 37 13.311 -6.134 3.464 1.00 0.00 C ATOM 579 CG LEU A 37 11.937 -5.601 3.017 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.871 -6.262 3.904 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.776 -4.082 3.194 1.00 0.00 C ATOM 0 H LEU A 37 15.589 -6.690 4.161 1.00 0.00 H new ATOM 0 HA LEU A 37 14.311 -6.529 1.639 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.206 -7.203 3.649 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.551 -5.668 4.420 1.00 0.00 H new ATOM 0 HG LEU A 37 11.836 -5.829 1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.883 -5.905 3.613 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.916 -7.344 3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.056 -6.006 4.947 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.784 -3.780 2.858 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.898 -3.823 4.246 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.532 -3.565 2.603 1.00 0.00 H new ATOM 593 N ILE A 38 15.067 -3.613 2.971 1.00 0.00 N ATOM 594 CA ILE A 38 15.203 -2.203 2.664 1.00 0.00 C ATOM 595 C ILE A 38 16.224 -1.993 1.555 1.00 0.00 C ATOM 596 O ILE A 38 15.899 -1.376 0.548 1.00 0.00 O ATOM 597 CB ILE A 38 15.487 -1.421 3.955 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.187 -1.467 4.773 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.935 0.026 3.704 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.235 -0.601 6.020 1.00 0.00 C ATOM 0 H ILE A 38 15.252 -3.846 3.947 1.00 0.00 H new ATOM 0 HA ILE A 38 14.269 -1.804 2.267 1.00 0.00 H new ATOM 0 HB ILE A 38 16.322 -1.876 4.488 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.358 -1.142 4.144 1.00 0.00 H new ATOM 0 HG13 ILE A 38 13.983 -2.498 5.062 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.119 0.521 4.658 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.851 0.026 3.113 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.154 0.560 3.163 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.287 -0.678 6.553 1.00 0.00 H new ATOM 0 HD12 ILE A 38 15.044 -0.940 6.667 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.409 0.437 5.736 1.00 0.00 H new ATOM 612 N GLN A 39 17.437 -2.522 1.708 1.00 0.00 N ATOM 613 CA GLN A 39 18.491 -2.318 0.728 1.00 0.00 C ATOM 614 C GLN A 39 18.046 -2.683 -0.690 1.00 0.00 C ATOM 615 O GLN A 39 18.414 -1.979 -1.630 1.00 0.00 O ATOM 616 CB GLN A 39 19.755 -3.090 1.132 1.00 0.00 C ATOM 617 CG GLN A 39 20.408 -2.571 2.422 1.00 0.00 C ATOM 618 CD GLN A 39 21.056 -1.202 2.248 1.00 0.00 C ATOM 619 OE1 GLN A 39 22.238 -1.107 1.937 1.00 0.00 O ATOM 620 NE2 GLN A 39 20.300 -0.129 2.465 1.00 0.00 N ATOM 0 H GLN A 39 17.710 -3.096 2.506 1.00 0.00 H new ATOM 0 HA GLN A 39 18.724 -1.253 0.715 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.502 -4.142 1.261 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.480 -3.034 0.320 1.00 0.00 H new ATOM 0 HG2 GLN A 39 19.654 -2.514 3.207 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.162 -3.285 2.755 1.00 0.00 H new ATOM 0 HE21 GLN A 39 19.319 -0.240 2.723 1.00 0.00 H new ATOM 0 HE22 GLN A 39 20.701 0.804 2.374 1.00 0.00 H new ATOM 629 N LYS A 40 17.275 -3.763 -0.863 1.00 0.00 N ATOM 630 CA LYS A 40 16.817 -4.127 -2.195 1.00 0.00 C ATOM 631 C LYS A 40 15.604 -3.288 -2.604 1.00 0.00 C ATOM 632 O LYS A 40 15.612 -2.651 -3.655 1.00 0.00 O ATOM 633 CB LYS A 40 16.512 -5.627 -2.244 1.00 0.00 C ATOM 634 CG LYS A 40 16.391 -6.120 -3.694 1.00 0.00 C ATOM 635 CD LYS A 40 16.044 -7.612 -3.755 1.00 0.00 C ATOM 636 CE LYS A 40 14.558 -7.849 -3.468 1.00 0.00 C ATOM 637 NZ LYS A 40 14.249 -9.286 -3.396 1.00 0.00 N ATOM 0 H LYS A 40 16.965 -4.382 -0.114 1.00 0.00 H new ATOM 0 HA LYS A 40 17.608 -3.916 -2.915 1.00 0.00 H new ATOM 0 HB2 LYS A 40 17.302 -6.179 -1.734 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.584 -5.830 -1.709 1.00 0.00 H new ATOM 0 HG2 LYS A 40 15.623 -5.546 -4.211 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.330 -5.942 -4.219 1.00 0.00 H new ATOM 0 HD2 LYS A 40 16.294 -8.006 -4.740 1.00 0.00 H new ATOM 0 HD3 LYS A 40 16.648 -8.158 -3.031 1.00 0.00 H new ATOM 0 HE2 LYS A 40 14.286 -7.369 -2.528 1.00 0.00 H new ATOM 0 HE3 LYS A 40 13.956 -7.384 -4.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.339 -9.421 -2.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 14.191 -9.677 -4.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 14.999 -9.776 -2.867 1.00 0.00 H new ATOM 651 N GLU A 41 14.545 -3.327 -1.794 1.00 0.00 N ATOM 652 CA GLU A 41 13.241 -2.784 -2.147 1.00 0.00 C ATOM 653 C GLU A 41 13.247 -1.257 -2.101 1.00 0.00 C ATOM 654 O GLU A 41 12.772 -0.594 -3.021 1.00 0.00 O ATOM 655 CB GLU A 41 12.176 -3.345 -1.192 1.00 0.00 C ATOM 656 CG GLU A 41 12.064 -4.880 -1.219 1.00 0.00 C ATOM 657 CD GLU A 41 11.522 -5.446 -2.529 1.00 0.00 C ATOM 658 OE1 GLU A 41 10.897 -4.674 -3.288 1.00 0.00 O ATOM 659 OE2 GLU A 41 11.718 -6.664 -2.737 1.00 0.00 O ATOM 0 H GLU A 41 14.574 -3.743 -0.863 1.00 0.00 H new ATOM 0 HA GLU A 41 13.005 -3.083 -3.168 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.407 -3.025 -0.176 1.00 0.00 H new ATOM 0 HB3 GLU A 41 11.208 -2.915 -1.449 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.049 -5.308 -1.031 1.00 0.00 H new ATOM 0 HG3 GLU A 41 11.416 -5.200 -0.403 1.00 0.00 H new ATOM 666 N LEU A 42 13.767 -0.700 -1.008 1.00 0.00 N ATOM 667 CA LEU A 42 13.908 0.732 -0.821 1.00 0.00 C ATOM 668 C LEU A 42 15.333 1.065 -1.253 1.00 0.00 C ATOM 669 O LEU A 42 16.187 1.348 -0.418 1.00 0.00 O ATOM 670 CB LEU A 42 13.654 1.115 0.647 1.00 0.00 C ATOM 671 CG LEU A 42 12.193 1.036 1.129 1.00 0.00 C ATOM 672 CD1 LEU A 42 11.609 -0.380 1.083 1.00 0.00 C ATOM 673 CD2 LEU A 42 12.110 1.573 2.563 1.00 0.00 C ATOM 0 H LEU A 42 14.106 -1.247 -0.217 1.00 0.00 H new ATOM 0 HA LEU A 42 13.181 1.294 -1.408 1.00 0.00 H new ATOM 0 HB2 LEU A 42 14.259 0.465 1.280 1.00 0.00 H new ATOM 0 HB3 LEU A 42 14.011 2.133 0.802 1.00 0.00 H new ATOM 0 HG LEU A 42 11.599 1.641 0.444 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.578 -0.360 1.436 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.634 -0.751 0.058 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.199 -1.038 1.722 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.079 1.521 2.912 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.744 0.972 3.214 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.448 2.609 2.584 1.00 0.00 H new ATOM 794 N ASP A 50 23.114 4.763 5.665 1.00 0.00 N ATOM 795 CA ASP A 50 23.144 3.485 6.372 1.00 0.00 C ATOM 796 C ASP A 50 22.854 3.638 7.866 1.00 0.00 C ATOM 797 O ASP A 50 22.042 2.899 8.417 1.00 0.00 O ATOM 798 CB ASP A 50 24.503 2.809 6.158 1.00 0.00 C ATOM 799 CG ASP A 50 24.575 1.471 6.883 1.00 0.00 C ATOM 800 OD1 ASP A 50 24.988 1.481 8.063 1.00 0.00 O ATOM 801 OD2 ASP A 50 24.208 0.463 6.242 1.00 0.00 O ATOM 0 HA ASP A 50 22.352 2.860 5.959 1.00 0.00 H new ATOM 0 HB2 ASP A 50 24.672 2.657 5.092 1.00 0.00 H new ATOM 0 HB3 ASP A 50 25.298 3.463 6.517 1.00 0.00 H new ATOM 806 N ALA A 51 23.493 4.618 8.509 1.00 0.00 N ATOM 807 CA ALA A 51 23.258 4.937 9.915 1.00 0.00 C ATOM 808 C ALA A 51 21.764 5.151 10.191 1.00 0.00 C ATOM 809 O ALA A 51 21.205 4.616 11.150 1.00 0.00 O ATOM 810 CB ALA A 51 24.064 6.183 10.292 1.00 0.00 C ATOM 0 H ALA A 51 24.191 5.214 8.065 1.00 0.00 H new ATOM 0 HA ALA A 51 23.585 4.097 10.528 1.00 0.00 H new ATOM 0 HB1 ALA A 51 23.891 6.424 11.341 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.125 5.991 10.134 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.750 7.021 9.670 1.00 0.00 H new ATOM 816 N GLU A 52 21.110 5.926 9.324 1.00 0.00 N ATOM 817 CA GLU A 52 19.689 6.200 9.426 1.00 0.00 C ATOM 818 C GLU A 52 18.922 4.895 9.238 1.00 0.00 C ATOM 819 O GLU A 52 17.989 4.617 9.986 1.00 0.00 O ATOM 820 CB GLU A 52 19.256 7.248 8.390 1.00 0.00 C ATOM 821 CG GLU A 52 20.121 8.519 8.437 1.00 0.00 C ATOM 822 CD GLU A 52 19.733 9.538 7.368 1.00 0.00 C ATOM 823 OE1 GLU A 52 18.833 9.223 6.559 1.00 0.00 O ATOM 824 OE2 GLU A 52 20.366 10.615 7.363 1.00 0.00 O ATOM 0 H GLU A 52 21.560 6.380 8.530 1.00 0.00 H new ATOM 0 HA GLU A 52 19.468 6.611 10.411 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.311 6.812 7.393 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.214 7.516 8.563 1.00 0.00 H new ATOM 0 HG2 GLU A 52 20.030 8.979 9.421 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.168 8.245 8.309 1.00 0.00 H new ATOM 831 N ILE A 53 19.329 4.081 8.257 1.00 0.00 N ATOM 832 CA ILE A 53 18.711 2.780 8.047 1.00 0.00 C ATOM 833 C ILE A 53 18.805 1.920 9.306 1.00 0.00 C ATOM 834 O ILE A 53 17.803 1.322 9.680 1.00 0.00 O ATOM 835 CB ILE A 53 19.249 2.052 6.802 1.00 0.00 C ATOM 836 CG1 ILE A 53 19.145 2.904 5.523 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.501 0.720 6.618 1.00 0.00 C ATOM 838 CD1 ILE A 53 17.743 3.462 5.247 1.00 0.00 C ATOM 0 H ILE A 53 20.079 4.304 7.603 1.00 0.00 H new ATOM 0 HA ILE A 53 17.655 2.960 7.845 1.00 0.00 H new ATOM 0 HB ILE A 53 20.310 1.864 6.968 1.00 0.00 H new ATOM 0 HG12 ILE A 53 19.846 3.735 5.597 1.00 0.00 H new ATOM 0 HG13 ILE A 53 19.456 2.299 4.671 1.00 0.00 H new ATOM 0 HG21 ILE A 53 18.884 0.207 5.736 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.652 0.093 7.497 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.436 0.915 6.491 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.759 4.049 4.329 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.038 2.638 5.138 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.434 4.096 6.078 1.00 0.00 H new ATOM 850 N VAL A 54 19.959 1.832 9.977 1.00 0.00 N ATOM 851 CA VAL A 54 20.034 1.006 11.182 1.00 0.00 C ATOM 852 C VAL A 54 19.256 1.612 12.355 1.00 0.00 C ATOM 853 O VAL A 54 18.683 0.865 13.144 1.00 0.00 O ATOM 854 CB VAL A 54 21.455 0.547 11.549 1.00 0.00 C ATOM 855 CG1 VAL A 54 21.931 -0.498 10.532 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.467 1.685 11.673 1.00 0.00 C ATOM 0 H VAL A 54 20.824 2.305 9.717 1.00 0.00 H new ATOM 0 HA VAL A 54 19.522 0.078 10.929 1.00 0.00 H new ATOM 0 HB VAL A 54 21.396 0.108 12.545 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.938 -0.825 10.790 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.257 -1.354 10.547 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.937 -0.059 9.534 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.443 1.277 11.934 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.537 2.215 10.723 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.143 2.377 12.451 1.00 0.00 H new ATOM 866 N LYS A 55 19.171 2.942 12.473 1.00 0.00 N ATOM 867 CA LYS A 55 18.255 3.534 13.447 1.00 0.00 C ATOM 868 C LYS A 55 16.810 3.125 13.122 1.00 0.00 C ATOM 869 O LYS A 55 16.068 2.666 13.985 1.00 0.00 O ATOM 870 CB LYS A 55 18.450 5.056 13.510 1.00 0.00 C ATOM 871 CG LYS A 55 17.448 5.784 14.425 1.00 0.00 C ATOM 872 CD LYS A 55 17.279 5.193 15.835 1.00 0.00 C ATOM 873 CE LYS A 55 18.584 5.128 16.636 1.00 0.00 C ATOM 874 NZ LYS A 55 18.349 4.542 17.968 1.00 0.00 N ATOM 0 H LYS A 55 19.710 3.610 11.922 1.00 0.00 H new ATOM 0 HA LYS A 55 18.478 3.153 14.444 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.461 5.267 13.857 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.367 5.464 12.502 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.762 6.823 14.522 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.475 5.790 13.935 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.554 5.792 16.386 1.00 0.00 H new ATOM 0 HD3 LYS A 55 16.864 4.189 15.751 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.319 4.532 16.095 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.002 6.129 16.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 19.261 4.334 18.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.816 5.215 18.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.804 3.662 17.869 1.00 0.00 H new ATOM 888 N LEU A 56 16.407 3.255 11.862 1.00 0.00 N ATOM 889 CA LEU A 56 15.099 2.821 11.395 1.00 0.00 C ATOM 890 C LEU A 56 14.876 1.326 11.687 1.00 0.00 C ATOM 891 O LEU A 56 13.813 0.938 12.170 1.00 0.00 O ATOM 892 CB LEU A 56 14.974 3.220 9.918 1.00 0.00 C ATOM 893 CG LEU A 56 13.817 2.552 9.170 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.259 3.510 8.111 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.314 1.302 8.445 1.00 0.00 C ATOM 0 H LEU A 56 16.986 3.669 11.131 1.00 0.00 H new ATOM 0 HA LEU A 56 14.293 3.316 11.936 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.852 4.301 9.857 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.907 2.975 9.410 1.00 0.00 H new ATOM 0 HG LEU A 56 13.047 2.291 9.896 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.436 3.029 7.582 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.898 4.417 8.595 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.046 3.766 7.401 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.484 0.834 7.916 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.089 1.580 7.731 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.724 0.599 9.171 1.00 0.00 H new ATOM 907 N MET A 57 15.883 0.488 11.427 1.00 0.00 N ATOM 908 CA MET A 57 15.858 -0.940 11.703 1.00 0.00 C ATOM 909 C MET A 57 15.586 -1.148 13.189 1.00 0.00 C ATOM 910 O MET A 57 14.669 -1.881 13.545 1.00 0.00 O ATOM 911 CB MET A 57 17.197 -1.569 11.290 1.00 0.00 C ATOM 912 CG MET A 57 17.241 -3.090 11.473 1.00 0.00 C ATOM 913 SD MET A 57 18.875 -3.856 11.294 1.00 0.00 S ATOM 914 CE MET A 57 19.714 -3.227 12.767 1.00 0.00 C ATOM 0 H MET A 57 16.759 0.798 11.007 1.00 0.00 H new ATOM 0 HA MET A 57 15.068 -1.425 11.129 1.00 0.00 H new ATOM 0 HB2 MET A 57 17.394 -1.331 10.245 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.997 -1.117 11.876 1.00 0.00 H new ATOM 0 HG2 MET A 57 16.854 -3.330 12.463 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.566 -3.544 10.748 1.00 0.00 H new ATOM 0 HE1 MET A 57 20.639 -3.782 12.924 1.00 0.00 H new ATOM 0 HE2 MET A 57 19.944 -2.170 12.631 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.066 -3.349 13.635 1.00 0.00 H new ATOM 924 N ASP A 58 16.368 -0.481 14.044 1.00 0.00 N ATOM 925 CA ASP A 58 16.149 -0.466 15.481 1.00 0.00 C ATOM 926 C ASP A 58 14.693 -0.110 15.779 1.00 0.00 C ATOM 927 O ASP A 58 14.016 -0.865 16.461 1.00 0.00 O ATOM 928 CB ASP A 58 17.156 0.466 16.171 1.00 0.00 C ATOM 929 CG ASP A 58 16.789 0.760 17.622 1.00 0.00 C ATOM 930 OD1 ASP A 58 16.537 -0.217 18.360 1.00 0.00 O ATOM 931 OD2 ASP A 58 16.780 1.962 17.969 1.00 0.00 O ATOM 0 H ASP A 58 17.176 0.066 13.748 1.00 0.00 H new ATOM 0 HA ASP A 58 16.324 -1.460 15.893 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.147 0.013 16.136 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.214 1.404 15.618 1.00 0.00 H new ATOM 936 N ASP A 59 14.178 1.001 15.248 1.00 0.00 N ATOM 937 CA ASP A 59 12.792 1.398 15.484 1.00 0.00 C ATOM 938 C ASP A 59 11.779 0.323 15.066 1.00 0.00 C ATOM 939 O ASP A 59 10.789 0.116 15.768 1.00 0.00 O ATOM 940 CB ASP A 59 12.474 2.735 14.802 1.00 0.00 C ATOM 941 CG ASP A 59 12.921 3.925 15.641 1.00 0.00 C ATOM 942 OD1 ASP A 59 12.172 4.248 16.591 1.00 0.00 O ATOM 943 OD2 ASP A 59 13.985 4.497 15.318 1.00 0.00 O ATOM 0 H ASP A 59 14.702 1.641 14.651 1.00 0.00 H new ATOM 0 HA ASP A 59 12.692 1.521 16.562 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.966 2.772 13.830 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.402 2.803 14.620 1.00 0.00 H new ATOM 948 N LEU A 60 11.996 -0.343 13.929 1.00 0.00 N ATOM 949 CA LEU A 60 11.157 -1.456 13.491 1.00 0.00 C ATOM 950 C LEU A 60 11.256 -2.622 14.491 1.00 0.00 C ATOM 951 O LEU A 60 10.252 -3.067 15.053 1.00 0.00 O ATOM 952 CB LEU A 60 11.557 -1.876 12.058 1.00 0.00 C ATOM 953 CG LEU A 60 10.889 -1.026 10.960 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.748 -0.942 9.695 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.551 -1.637 10.524 1.00 0.00 C ATOM 0 H LEU A 60 12.759 -0.124 13.288 1.00 0.00 H new ATOM 0 HA LEU A 60 10.113 -1.145 13.465 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.640 -1.803 11.955 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.293 -2.923 11.907 1.00 0.00 H new ATOM 0 HG LEU A 60 10.754 -0.038 11.399 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.238 -0.333 8.948 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.709 -0.489 9.937 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.909 -1.944 9.297 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.103 -1.016 9.749 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.719 -2.640 10.133 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.879 -1.690 11.380 1.00 0.00 H new ATOM 967 N ASP A 61 12.464 -3.143 14.715 1.00 0.00 N ATOM 968 CA ASP A 61 12.669 -4.337 15.530 1.00 0.00 C ATOM 969 C ASP A 61 12.354 -4.107 17.009 1.00 0.00 C ATOM 970 O ASP A 61 11.956 -5.042 17.695 1.00 0.00 O ATOM 971 CB ASP A 61 14.056 -4.953 15.295 1.00 0.00 C ATOM 972 CG ASP A 61 15.240 -4.143 15.826 1.00 0.00 C ATOM 973 OD1 ASP A 61 15.211 -3.770 17.017 1.00 0.00 O ATOM 974 OD2 ASP A 61 16.186 -3.945 15.032 1.00 0.00 O ATOM 0 H ASP A 61 13.325 -2.748 14.336 1.00 0.00 H new ATOM 0 HA ASP A 61 11.942 -5.077 15.196 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.078 -5.940 15.757 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.191 -5.100 14.223 1.00 0.00 H new ATOM 979 N ARG A 62 12.489 -2.870 17.494 1.00 0.00 N ATOM 980 CA ARG A 62 12.294 -2.466 18.884 1.00 0.00 C ATOM 981 C ARG A 62 10.973 -2.974 19.458 1.00 0.00 C ATOM 982 O ARG A 62 10.902 -3.213 20.660 1.00 0.00 O ATOM 983 CB ARG A 62 12.473 -0.943 18.998 1.00 0.00 C ATOM 984 CG ARG A 62 11.992 -0.279 20.303 1.00 0.00 C ATOM 985 CD ARG A 62 10.496 0.089 20.321 1.00 0.00 C ATOM 986 NE ARG A 62 10.081 0.735 19.068 1.00 0.00 N ATOM 987 CZ ARG A 62 10.456 1.956 18.661 1.00 0.00 C ATOM 988 NH1 ARG A 62 11.025 2.822 19.505 1.00 0.00 N ATOM 989 NH2 ARG A 62 10.288 2.291 17.381 1.00 0.00 N ATOM 0 H ARG A 62 12.750 -2.086 16.896 1.00 0.00 H new ATOM 0 HA ARG A 62 13.055 -2.938 19.505 1.00 0.00 H new ATOM 0 HB2 ARG A 62 13.532 -0.716 18.872 1.00 0.00 H new ATOM 0 HB3 ARG A 62 11.946 -0.476 18.166 1.00 0.00 H new ATOM 0 HG2 ARG A 62 12.197 -0.953 21.135 1.00 0.00 H new ATOM 0 HG3 ARG A 62 12.577 0.625 20.473 1.00 0.00 H new ATOM 0 HD2 ARG A 62 9.902 -0.811 20.481 1.00 0.00 H new ATOM 0 HD3 ARG A 62 10.295 0.757 21.159 1.00 0.00 H new ATOM 0 HE ARG A 62 9.455 0.210 18.457 1.00 0.00 H new ATOM 0 HH11 ARG A 62 11.181 2.558 20.478 1.00 0.00 H new ATOM 0 HH12 ARG A 62 11.303 3.747 19.176 1.00 0.00 H new ATOM 0 HH21 ARG A 62 9.880 1.622 16.728 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.568 3.216 17.055 1.00 0.00 H new ATOM 1003 N ASN A 63 9.956 -3.202 18.616 1.00 0.00 N ATOM 1004 CA ASN A 63 8.731 -3.887 19.031 1.00 0.00 C ATOM 1005 C ASN A 63 9.004 -5.121 19.912 1.00 0.00 C ATOM 1006 O ASN A 63 8.259 -5.365 20.857 1.00 0.00 O ATOM 1007 CB ASN A 63 7.828 -4.214 17.833 1.00 0.00 C ATOM 1008 CG ASN A 63 8.264 -5.490 17.124 1.00 0.00 C ATOM 1009 OD1 ASN A 63 7.684 -6.552 17.324 1.00 0.00 O ATOM 1010 ND2 ASN A 63 9.304 -5.414 16.307 1.00 0.00 N ATOM 0 H ASN A 63 9.961 -2.918 17.636 1.00 0.00 H new ATOM 0 HA ASN A 63 8.184 -3.186 19.662 1.00 0.00 H new ATOM 0 HB2 ASN A 63 6.798 -4.322 18.173 1.00 0.00 H new ATOM 0 HB3 ASN A 63 7.845 -3.383 17.128 1.00 0.00 H new ATOM 0 HD21 ASN A 63 9.639 -6.250 15.828 1.00 0.00 H new ATOM 0 HD22 ASN A 63 9.770 -4.519 16.157 1.00 0.00 H new ATOM 1017 N LYS A 64 10.071 -5.880 19.625 1.00 0.00 N ATOM 1018 CA LYS A 64 10.577 -6.919 20.528 1.00 0.00 C ATOM 1019 C LYS A 64 12.102 -7.113 20.440 1.00 0.00 C ATOM 1020 O LYS A 64 12.608 -8.178 20.787 1.00 0.00 O ATOM 1021 CB LYS A 64 9.807 -8.236 20.344 1.00 0.00 C ATOM 1022 CG LYS A 64 9.962 -8.843 18.944 1.00 0.00 C ATOM 1023 CD LYS A 64 9.491 -10.304 18.913 1.00 0.00 C ATOM 1024 CE LYS A 64 8.058 -10.460 19.444 1.00 0.00 C ATOM 1025 NZ LYS A 64 7.484 -11.767 19.080 1.00 0.00 N ATOM 0 H LYS A 64 10.606 -5.790 18.761 1.00 0.00 H new ATOM 0 HA LYS A 64 10.392 -6.567 21.543 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.153 -8.957 21.085 1.00 0.00 H new ATOM 0 HB3 LYS A 64 8.749 -8.060 20.540 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.387 -8.258 18.226 1.00 0.00 H new ATOM 0 HG3 LYS A 64 11.006 -8.789 18.636 1.00 0.00 H new ATOM 0 HD2 LYS A 64 9.541 -10.679 17.891 1.00 0.00 H new ATOM 0 HD3 LYS A 64 10.167 -10.915 19.511 1.00 0.00 H new ATOM 0 HE2 LYS A 64 8.057 -10.351 20.529 1.00 0.00 H new ATOM 0 HE3 LYS A 64 7.432 -9.663 19.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.516 -11.838 19.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 7.462 -11.860 18.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 8.068 -12.527 19.484 1.00 0.00 H new ATOM 1039 N ASP A 65 12.833 -6.101 19.962 1.00 0.00 N ATOM 1040 CA ASP A 65 14.284 -6.010 19.789 1.00 0.00 C ATOM 1041 C ASP A 65 14.910 -7.001 18.796 1.00 0.00 C ATOM 1042 O ASP A 65 15.776 -6.618 18.015 1.00 0.00 O ATOM 1043 CB ASP A 65 15.032 -5.889 21.126 1.00 0.00 C ATOM 1044 CG ASP A 65 15.271 -7.216 21.839 1.00 0.00 C ATOM 1045 OD1 ASP A 65 16.151 -7.964 21.359 1.00 0.00 O ATOM 1046 OD2 ASP A 65 14.601 -7.443 22.868 1.00 0.00 O ATOM 0 H ASP A 65 12.377 -5.241 19.657 1.00 0.00 H new ATOM 0 HA ASP A 65 14.430 -5.061 19.273 1.00 0.00 H new ATOM 0 HB2 ASP A 65 15.994 -5.408 20.948 1.00 0.00 H new ATOM 0 HB3 ASP A 65 14.466 -5.233 21.787 1.00 0.00 H new ATOM 1051 N GLN A 66 14.506 -8.270 18.814 1.00 0.00 N ATOM 1052 CA GLN A 66 15.064 -9.304 17.954 1.00 0.00 C ATOM 1053 C GLN A 66 14.576 -9.155 16.510 1.00 0.00 C ATOM 1054 O GLN A 66 15.379 -9.168 15.575 1.00 0.00 O ATOM 1055 CB GLN A 66 14.689 -10.690 18.500 1.00 0.00 C ATOM 1056 CG GLN A 66 15.313 -10.995 19.868 1.00 0.00 C ATOM 1057 CD GLN A 66 16.835 -11.094 19.790 1.00 0.00 C ATOM 1058 OE1 GLN A 66 17.372 -12.100 19.341 1.00 0.00 O ATOM 1059 NE2 GLN A 66 17.548 -10.057 20.215 1.00 0.00 N ATOM 0 H GLN A 66 13.772 -8.610 19.436 1.00 0.00 H new ATOM 0 HA GLN A 66 16.149 -9.195 17.950 1.00 0.00 H new ATOM 0 HB2 GLN A 66 13.604 -10.759 18.580 1.00 0.00 H new ATOM 0 HB3 GLN A 66 15.005 -11.451 17.787 1.00 0.00 H new ATOM 0 HG2 GLN A 66 15.036 -10.214 20.576 1.00 0.00 H new ATOM 0 HG3 GLN A 66 14.907 -11.931 20.252 1.00 0.00 H new ATOM 0 HE21 GLN A 66 17.077 -9.231 20.584 1.00 0.00 H new ATOM 0 HE22 GLN A 66 18.567 -10.086 20.172 1.00 0.00 H new ATOM 1068 N GLU A 67 13.255 -9.071 16.327 1.00 0.00 N ATOM 1069 CA GLU A 67 12.620 -9.144 15.020 1.00 0.00 C ATOM 1070 C GLU A 67 11.501 -8.117 14.886 1.00 0.00 C ATOM 1071 O GLU A 67 10.906 -7.685 15.873 1.00 0.00 O ATOM 1072 CB GLU A 67 12.035 -10.545 14.791 1.00 0.00 C ATOM 1073 CG GLU A 67 13.051 -11.680 14.980 1.00 0.00 C ATOM 1074 CD GLU A 67 12.533 -12.980 14.371 1.00 0.00 C ATOM 1075 OE1 GLU A 67 12.340 -12.987 13.135 1.00 0.00 O ATOM 1076 OE2 GLU A 67 12.311 -13.928 15.154 1.00 0.00 O ATOM 0 H GLU A 67 12.594 -8.949 17.095 1.00 0.00 H new ATOM 0 HA GLU A 67 13.386 -8.931 14.274 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.202 -10.697 15.478 1.00 0.00 H new ATOM 0 HB3 GLU A 67 11.629 -10.598 13.781 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.998 -11.407 14.514 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.248 -11.824 16.042 1.00 0.00 H new ATOM 1083 N VAL A 68 11.197 -7.768 13.639 1.00 0.00 N ATOM 1084 CA VAL A 68 10.038 -6.994 13.247 1.00 0.00 C ATOM 1085 C VAL A 68 8.853 -7.958 13.189 1.00 0.00 C ATOM 1086 O VAL A 68 9.022 -9.099 12.761 1.00 0.00 O ATOM 1087 CB VAL A 68 10.293 -6.358 11.873 1.00 0.00 C ATOM 1088 CG1 VAL A 68 9.226 -5.299 11.573 1.00 0.00 C ATOM 1089 CG2 VAL A 68 11.682 -5.713 11.804 1.00 0.00 C ATOM 0 H VAL A 68 11.781 -8.031 12.845 1.00 0.00 H new ATOM 0 HA VAL A 68 9.833 -6.191 13.955 1.00 0.00 H new ATOM 0 HB VAL A 68 10.243 -7.152 11.128 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.418 -4.856 10.596 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.241 -5.765 11.573 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.259 -4.522 12.337 1.00 0.00 H new ATOM 0 HG21 VAL A 68 11.830 -5.272 10.818 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.760 -4.936 12.564 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.445 -6.472 11.980 1.00 0.00 H new ATOM 1099 N ASN A 69 7.659 -7.517 13.595 1.00 0.00 N ATOM 1100 CA ASN A 69 6.434 -8.296 13.447 1.00 0.00 C ATOM 1101 C ASN A 69 5.513 -7.599 12.460 1.00 0.00 C ATOM 1102 O ASN A 69 5.460 -6.372 12.433 1.00 0.00 O ATOM 1103 CB ASN A 69 5.753 -8.517 14.798 1.00 0.00 C ATOM 1104 CG ASN A 69 6.490 -9.602 15.569 1.00 0.00 C ATOM 1105 OD1 ASN A 69 6.286 -10.788 15.326 1.00 0.00 O ATOM 1106 ND2 ASN A 69 7.378 -9.216 16.475 1.00 0.00 N ATOM 0 H ASN A 69 7.518 -6.608 14.036 1.00 0.00 H new ATOM 0 HA ASN A 69 6.681 -9.283 13.057 1.00 0.00 H new ATOM 0 HB2 ASN A 69 5.748 -7.589 15.370 1.00 0.00 H new ATOM 0 HB3 ASN A 69 4.712 -8.805 14.649 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.914 -9.912 16.993 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.525 -8.223 16.654 1.00 0.00 H new ATOM 1113 N PHE A 70 4.810 -8.381 11.640 1.00 0.00 N ATOM 1114 CA PHE A 70 4.036 -7.898 10.503 1.00 0.00 C ATOM 1115 C PHE A 70 3.182 -6.658 10.816 1.00 0.00 C ATOM 1116 O PHE A 70 3.317 -5.621 10.167 1.00 0.00 O ATOM 1117 CB PHE A 70 3.199 -9.056 9.952 1.00 0.00 C ATOM 1118 CG PHE A 70 2.273 -8.633 8.840 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.822 -8.122 7.651 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.892 -8.530 9.083 1.00 0.00 C ATOM 1121 CE1 PHE A 70 1.993 -7.486 6.715 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.064 -7.893 8.147 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.619 -7.351 6.978 1.00 0.00 C ATOM 0 H PHE A 70 4.764 -9.394 11.754 1.00 0.00 H new ATOM 0 HA PHE A 70 4.734 -7.554 9.740 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.865 -9.837 9.586 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.612 -9.491 10.761 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.880 -8.219 7.458 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.470 -8.940 9.988 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.409 -7.101 5.796 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.999 -7.820 8.326 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.013 -6.827 6.276 1.00 0.00 H new ATOM 1133 N GLN A 71 2.316 -6.742 11.829 1.00 0.00 N ATOM 1134 CA GLN A 71 1.473 -5.616 12.217 1.00 0.00 C ATOM 1135 C GLN A 71 2.320 -4.369 12.498 1.00 0.00 C ATOM 1136 O GLN A 71 1.962 -3.264 12.087 1.00 0.00 O ATOM 1137 CB GLN A 71 0.633 -6.005 13.442 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.234 -4.859 13.987 1.00 0.00 C ATOM 1139 CD GLN A 71 -1.256 -4.352 12.974 1.00 0.00 C ATOM 1140 OE1 GLN A 71 -2.393 -4.809 12.959 1.00 0.00 O ATOM 1141 NE2 GLN A 71 -0.875 -3.400 12.128 1.00 0.00 N ATOM 0 H GLN A 71 2.183 -7.581 12.394 1.00 0.00 H new ATOM 0 HA GLN A 71 0.802 -5.372 11.394 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.012 -6.843 13.178 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.299 -6.352 14.232 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.755 -5.199 14.882 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.411 -4.034 14.288 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.078 -3.038 12.163 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.536 -3.031 11.444 1.00 0.00 H new ATOM 1150 N GLU A 72 3.436 -4.557 13.205 1.00 0.00 N ATOM 1151 CA GLU A 72 4.320 -3.483 13.619 1.00 0.00 C ATOM 1152 C GLU A 72 5.035 -2.900 12.402 1.00 0.00 C ATOM 1153 O GLU A 72 5.205 -1.689 12.312 1.00 0.00 O ATOM 1154 CB GLU A 72 5.307 -3.988 14.681 1.00 0.00 C ATOM 1155 CG GLU A 72 4.589 -4.699 15.839 1.00 0.00 C ATOM 1156 CD GLU A 72 3.568 -3.797 16.525 1.00 0.00 C ATOM 1157 OE1 GLU A 72 4.020 -2.860 17.218 1.00 0.00 O ATOM 1158 OE2 GLU A 72 2.360 -4.054 16.330 1.00 0.00 O ATOM 0 H GLU A 72 3.750 -5.479 13.508 1.00 0.00 H new ATOM 0 HA GLU A 72 3.736 -2.683 14.074 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.018 -4.673 14.219 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.882 -3.148 15.071 1.00 0.00 H new ATOM 0 HG2 GLU A 72 4.088 -5.590 15.461 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.325 -5.033 16.570 1.00 0.00 H new ATOM 1165 N TYR A 73 5.426 -3.753 11.452 1.00 0.00 N ATOM 1166 CA TYR A 73 5.922 -3.327 10.152 1.00 0.00 C ATOM 1167 C TYR A 73 4.908 -2.392 9.486 1.00 0.00 C ATOM 1168 O TYR A 73 5.273 -1.284 9.098 1.00 0.00 O ATOM 1169 CB TYR A 73 6.278 -4.556 9.302 1.00 0.00 C ATOM 1170 CG TYR A 73 6.269 -4.356 7.801 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.442 -3.945 7.142 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.149 -4.764 7.050 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.506 -3.978 5.738 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.200 -4.752 5.647 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.381 -4.366 4.991 1.00 0.00 C ATOM 1176 OH TYR A 73 6.457 -4.419 3.634 1.00 0.00 O ATOM 0 H TYR A 73 5.405 -4.766 11.570 1.00 0.00 H new ATOM 0 HA TYR A 73 6.841 -2.752 10.265 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.270 -4.900 9.596 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.578 -5.355 9.545 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.292 -3.604 7.714 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.250 -5.086 7.554 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.421 -3.705 5.233 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.332 -5.039 5.072 1.00 0.00 H new ATOM 0 HH TYR A 73 5.778 -5.037 3.292 1.00 0.00 H new ATOM 1186 N ILE A 74 3.639 -2.803 9.376 1.00 0.00 N ATOM 1187 CA ILE A 74 2.621 -1.946 8.767 1.00 0.00 C ATOM 1188 C ILE A 74 2.508 -0.621 9.543 1.00 0.00 C ATOM 1189 O ILE A 74 2.629 0.455 8.957 1.00 0.00 O ATOM 1190 CB ILE A 74 1.263 -2.665 8.635 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.324 -3.984 7.838 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.241 -1.712 7.997 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.474 -3.817 6.322 1.00 0.00 C ATOM 0 H ILE A 74 3.298 -3.710 9.696 1.00 0.00 H new ATOM 0 HA ILE A 74 2.936 -1.713 7.750 1.00 0.00 H new ATOM 0 HB ILE A 74 0.959 -2.941 9.645 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.161 -4.576 8.208 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.417 -4.554 8.038 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.720 -2.219 7.903 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.125 -0.829 8.625 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.591 -1.411 7.009 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.508 -4.799 5.849 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.625 -3.255 5.932 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.396 -3.278 6.105 1.00 0.00 H new ATOM 1205 N THR A 75 2.300 -0.679 10.861 1.00 0.00 N ATOM 1206 CA THR A 75 2.223 0.504 11.718 1.00 0.00 C ATOM 1207 C THR A 75 3.427 1.433 11.523 1.00 0.00 C ATOM 1208 O THR A 75 3.275 2.656 11.436 1.00 0.00 O ATOM 1209 CB THR A 75 2.097 0.033 13.173 1.00 0.00 C ATOM 1210 OG1 THR A 75 0.895 -0.692 13.290 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.089 1.170 14.198 1.00 0.00 C ATOM 0 H THR A 75 2.179 -1.557 11.366 1.00 0.00 H new ATOM 0 HA THR A 75 1.348 1.094 11.446 1.00 0.00 H new ATOM 0 HB THR A 75 2.976 -0.573 13.394 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.142 -0.121 13.031 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.997 0.755 15.202 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.018 1.734 14.123 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.246 1.832 14.001 1.00 0.00 H new ATOM 1219 N PHE A 76 4.629 0.859 11.458 1.00 0.00 N ATOM 1220 CA PHE A 76 5.851 1.610 11.240 1.00 0.00 C ATOM 1221 C PHE A 76 5.836 2.248 9.856 1.00 0.00 C ATOM 1222 O PHE A 76 6.157 3.422 9.729 1.00 0.00 O ATOM 1223 CB PHE A 76 7.085 0.726 11.421 1.00 0.00 C ATOM 1224 CG PHE A 76 8.370 1.504 11.214 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.896 2.278 12.266 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.907 1.633 9.919 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.953 3.172 12.021 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.005 2.476 9.692 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.511 3.268 10.735 1.00 0.00 C ATOM 0 H PHE A 76 4.775 -0.146 11.556 1.00 0.00 H new ATOM 0 HA PHE A 76 5.904 2.402 11.987 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.079 0.294 12.422 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.045 -0.104 10.715 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.487 2.185 13.261 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.473 1.082 9.098 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.337 3.786 12.822 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.462 2.516 8.714 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.328 3.950 10.549 1.00 0.00 H new ATOM 1239 N LEU A 77 5.448 1.513 8.812 1.00 0.00 N ATOM 1240 CA LEU A 77 5.265 2.117 7.497 1.00 0.00 C ATOM 1241 C LEU A 77 4.263 3.270 7.577 1.00 0.00 C ATOM 1242 O LEU A 77 4.442 4.283 6.907 1.00 0.00 O ATOM 1243 CB LEU A 77 4.884 1.066 6.447 1.00 0.00 C ATOM 1244 CG LEU A 77 6.074 0.168 6.066 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.589 -0.976 5.175 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.150 0.947 5.298 1.00 0.00 C ATOM 0 H LEU A 77 5.257 0.512 8.853 1.00 0.00 H new ATOM 0 HA LEU A 77 6.215 2.539 7.168 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.073 0.448 6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.508 1.566 5.555 1.00 0.00 H new ATOM 0 HG LEU A 77 6.505 -0.212 6.992 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.433 -1.611 4.906 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.847 -1.567 5.713 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.140 -0.567 4.270 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.974 0.279 5.047 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.721 1.354 4.382 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.521 1.763 5.918 1.00 0.00 H new ATOM 1258 N GLY A 78 3.249 3.160 8.436 1.00 0.00 N ATOM 1259 CA GLY A 78 2.379 4.279 8.764 1.00 0.00 C ATOM 1260 C GLY A 78 3.179 5.475 9.287 1.00 0.00 C ATOM 1261 O GLY A 78 3.017 6.591 8.795 1.00 0.00 O ATOM 0 H GLY A 78 3.012 2.294 8.920 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.816 4.575 7.879 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.653 3.969 9.515 1.00 0.00 H new ATOM 1265 N ALA A 79 4.065 5.254 10.262 1.00 0.00 N ATOM 1266 CA ALA A 79 4.957 6.306 10.746 1.00 0.00 C ATOM 1267 C ALA A 79 5.810 6.878 9.610 1.00 0.00 C ATOM 1268 O ALA A 79 5.938 8.091 9.478 1.00 0.00 O ATOM 1269 CB ALA A 79 5.848 5.804 11.888 1.00 0.00 C ATOM 0 H ALA A 79 4.182 4.355 10.730 1.00 0.00 H new ATOM 0 HA ALA A 79 4.329 7.107 11.136 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.499 6.612 12.224 1.00 0.00 H new ATOM 0 HB2 ALA A 79 5.224 5.472 12.718 1.00 0.00 H new ATOM 0 HB3 ALA A 79 6.456 4.971 11.536 1.00 0.00 H new ATOM 1275 N LEU A 80 6.395 6.014 8.781 1.00 0.00 N ATOM 1276 CA LEU A 80 7.231 6.412 7.657 1.00 0.00 C ATOM 1277 C LEU A 80 6.436 7.317 6.711 1.00 0.00 C ATOM 1278 O LEU A 80 6.902 8.379 6.303 1.00 0.00 O ATOM 1279 CB LEU A 80 7.754 5.155 6.942 1.00 0.00 C ATOM 1280 CG LEU A 80 9.069 5.399 6.187 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.258 5.507 7.151 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.332 4.228 5.234 1.00 0.00 C ATOM 0 H LEU A 80 6.298 5.003 8.876 1.00 0.00 H new ATOM 0 HA LEU A 80 8.090 6.982 8.011 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.904 4.362 7.675 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.998 4.802 6.240 1.00 0.00 H new ATOM 0 HG LEU A 80 8.970 6.336 5.640 1.00 0.00 H new ATOM 0 HD11 LEU A 80 11.172 5.680 6.583 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.095 6.338 7.838 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.352 4.581 7.718 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.265 4.399 4.697 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.407 3.303 5.806 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.512 4.148 4.521 1.00 0.00 H new ATOM 1294 N ALA A 81 5.208 6.907 6.394 1.00 0.00 N ATOM 1295 CA ALA A 81 4.285 7.686 5.592 1.00 0.00 C ATOM 1296 C ALA A 81 4.010 9.037 6.254 1.00 0.00 C ATOM 1297 O ALA A 81 4.097 10.068 5.595 1.00 0.00 O ATOM 1298 CB ALA A 81 3.008 6.883 5.353 1.00 0.00 C ATOM 0 H ALA A 81 4.828 6.010 6.695 1.00 0.00 H new ATOM 0 HA ALA A 81 4.730 7.897 4.619 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.316 7.471 4.750 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.252 5.959 4.828 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.543 6.645 6.310 1.00 0.00 H new ATOM 1304 N MET A 82 3.705 9.046 7.554 1.00 0.00 N ATOM 1305 CA MET A 82 3.507 10.282 8.302 1.00 0.00 C ATOM 1306 C MET A 82 4.734 11.196 8.178 1.00 0.00 C ATOM 1307 O MET A 82 4.593 12.386 7.903 1.00 0.00 O ATOM 1308 CB MET A 82 3.125 9.949 9.753 1.00 0.00 C ATOM 1309 CG MET A 82 2.826 11.193 10.601 1.00 0.00 C ATOM 1310 SD MET A 82 4.276 12.034 11.290 1.00 0.00 S ATOM 1311 CE MET A 82 3.467 13.412 12.130 1.00 0.00 C ATOM 0 H MET A 82 3.590 8.200 8.112 1.00 0.00 H new ATOM 0 HA MET A 82 2.677 10.848 7.879 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.250 9.300 9.751 1.00 0.00 H new ATOM 0 HB3 MET A 82 3.937 9.388 10.216 1.00 0.00 H new ATOM 0 HG2 MET A 82 2.272 11.904 9.988 1.00 0.00 H new ATOM 0 HG3 MET A 82 2.172 10.902 11.423 1.00 0.00 H new ATOM 0 HE1 MET A 82 4.219 14.036 12.612 1.00 0.00 H new ATOM 0 HE2 MET A 82 2.913 14.007 11.403 1.00 0.00 H new ATOM 0 HE3 MET A 82 2.779 13.026 12.882 1.00 0.00 H new ATOM 1321 N ILE A 83 5.939 10.643 8.346 1.00 0.00 N ATOM 1322 CA ILE A 83 7.185 11.378 8.148 1.00 0.00 C ATOM 1323 C ILE A 83 7.208 11.953 6.728 1.00 0.00 C ATOM 1324 O ILE A 83 7.453 13.149 6.554 1.00 0.00 O ATOM 1325 CB ILE A 83 8.404 10.498 8.493 1.00 0.00 C ATOM 1326 CG1 ILE A 83 8.437 10.255 10.015 1.00 0.00 C ATOM 1327 CG2 ILE A 83 9.713 11.163 8.037 1.00 0.00 C ATOM 1328 CD1 ILE A 83 9.373 9.112 10.420 1.00 0.00 C ATOM 0 H ILE A 83 6.075 9.671 8.624 1.00 0.00 H new ATOM 0 HA ILE A 83 7.243 12.223 8.834 1.00 0.00 H new ATOM 0 HB ILE A 83 8.311 9.547 7.968 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.752 11.170 10.516 1.00 0.00 H new ATOM 0 HG13 ILE A 83 7.429 10.032 10.363 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.556 10.521 8.293 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.687 11.315 6.958 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.825 12.125 8.536 1.00 0.00 H new ATOM 0 HD11 ILE A 83 9.352 8.991 11.503 1.00 0.00 H new ATOM 0 HD12 ILE A 83 9.045 8.187 9.945 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.389 9.343 10.100 1.00 0.00 H new ATOM 1340 N TYR A 84 6.834 11.160 5.716 1.00 0.00 N ATOM 1341 CA TYR A 84 6.615 11.638 4.349 1.00 0.00 C ATOM 1342 C TYR A 84 5.347 12.505 4.214 1.00 0.00 C ATOM 1343 O TYR A 84 4.667 12.446 3.191 1.00 0.00 O ATOM 1344 CB TYR A 84 6.546 10.455 3.367 1.00 0.00 C ATOM 1345 CG TYR A 84 7.650 9.415 3.418 1.00 0.00 C ATOM 1346 CD1 TYR A 84 8.964 9.756 3.794 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.375 8.116 2.950 1.00 0.00 C ATOM 1348 CE1 TYR A 84 9.992 8.801 3.706 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.406 7.165 2.853 1.00 0.00 C ATOM 1350 CZ TYR A 84 9.717 7.514 3.219 1.00 0.00 C ATOM 1351 OH TYR A 84 10.726 6.607 3.099 1.00 0.00 O ATOM 0 H TYR A 84 6.674 10.159 5.826 1.00 0.00 H new ATOM 0 HA TYR A 84 7.467 12.271 4.102 1.00 0.00 H new ATOM 0 HB2 TYR A 84 5.598 9.942 3.530 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.519 10.862 2.356 1.00 0.00 H new ATOM 0 HD1 TYR A 84 9.182 10.752 4.150 1.00 0.00 H new ATOM 0 HD2 TYR A 84 6.368 7.849 2.664 1.00 0.00 H new ATOM 0 HE1 TYR A 84 10.995 9.058 4.014 1.00 0.00 H new ATOM 0 HE2 TYR A 84 8.191 6.168 2.498 1.00 0.00 H new ATOM 0 HH TYR A 84 10.369 5.765 2.748 1.00 0.00 H new ATOM 1361 N ASN A 85 5.059 13.351 5.209 1.00 0.00 N ATOM 1362 CA ASN A 85 3.967 14.310 5.298 1.00 0.00 C ATOM 1363 C ASN A 85 3.596 14.949 3.959 1.00 0.00 C ATOM 1364 O ASN A 85 2.412 15.084 3.666 1.00 0.00 O ATOM 1365 CB ASN A 85 4.308 15.382 6.344 1.00 0.00 C ATOM 1366 CG ASN A 85 5.432 16.311 5.890 1.00 0.00 C ATOM 1367 OD1 ASN A 85 5.179 17.450 5.514 1.00 0.00 O ATOM 1368 ND2 ASN A 85 6.678 15.840 5.894 1.00 0.00 N ATOM 0 H ASN A 85 5.641 13.379 6.046 1.00 0.00 H new ATOM 0 HA ASN A 85 3.082 13.755 5.608 1.00 0.00 H new ATOM 0 HB2 ASN A 85 3.417 15.973 6.557 1.00 0.00 H new ATOM 0 HB3 ASN A 85 4.598 14.896 7.276 1.00 0.00 H new ATOM 0 HD21 ASN A 85 7.448 16.431 5.579 1.00 0.00 H new ATOM 0 HD22 ASN A 85 6.863 14.888 6.212 1.00 0.00 H new ATOM 1375 N GLU A 86 4.582 15.319 3.136 1.00 0.00 N ATOM 1376 CA GLU A 86 4.360 15.849 1.795 1.00 0.00 C ATOM 1377 C GLU A 86 3.301 15.031 1.041 1.00 0.00 C ATOM 1378 O GLU A 86 2.355 15.592 0.496 1.00 0.00 O ATOM 1379 CB GLU A 86 5.697 15.878 1.041 1.00 0.00 C ATOM 1380 CG GLU A 86 5.568 16.546 -0.334 1.00 0.00 C ATOM 1381 CD GLU A 86 6.917 16.613 -1.044 1.00 0.00 C ATOM 1382 OE1 GLU A 86 7.427 15.527 -1.393 1.00 0.00 O ATOM 1383 OE2 GLU A 86 7.417 17.746 -1.215 1.00 0.00 O ATOM 0 H GLU A 86 5.568 15.256 3.389 1.00 0.00 H new ATOM 0 HA GLU A 86 3.973 16.866 1.868 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.437 16.413 1.636 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.065 14.860 0.916 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.859 15.989 -0.947 1.00 0.00 H new ATOM 0 HG3 GLU A 86 5.166 17.552 -0.216 1.00 0.00 H new ATOM 1390 N ALA A 87 3.443 13.703 1.046 1.00 0.00 N ATOM 1391 CA ALA A 87 2.513 12.786 0.400 1.00 0.00 C ATOM 1392 C ALA A 87 1.091 12.963 0.937 1.00 0.00 C ATOM 1393 O ALA A 87 0.122 12.882 0.188 1.00 0.00 O ATOM 1394 CB ALA A 87 2.989 11.349 0.631 1.00 0.00 C ATOM 0 H ALA A 87 4.221 13.232 1.507 1.00 0.00 H new ATOM 0 HA ALA A 87 2.491 13.004 -0.668 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.299 10.655 0.151 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.985 11.223 0.206 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.023 11.145 1.701 1.00 0.00 H new ATOM 1400 N LEU A 88 0.967 13.179 2.247 1.00 0.00 N ATOM 1401 CA LEU A 88 -0.312 13.312 2.922 1.00 0.00 C ATOM 1402 C LEU A 88 -0.922 14.676 2.591 1.00 0.00 C ATOM 1403 O LEU A 88 -2.128 14.782 2.389 1.00 0.00 O ATOM 1404 CB LEU A 88 -0.136 13.131 4.436 1.00 0.00 C ATOM 1405 CG LEU A 88 0.172 11.696 4.898 1.00 0.00 C ATOM 1406 CD1 LEU A 88 1.459 11.097 4.330 1.00 0.00 C ATOM 1407 CD2 LEU A 88 0.280 11.696 6.423 1.00 0.00 C ATOM 0 H LEU A 88 1.768 13.267 2.873 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.992 12.535 2.574 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.670 13.783 4.771 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.046 13.467 4.933 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.644 11.077 4.525 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.589 10.085 4.713 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.398 11.068 3.242 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.309 11.710 4.629 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.498 10.687 6.772 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.081 12.368 6.731 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.662 12.033 6.854 1.00 0.00 H new ATOM 1479 N SER B 3 10.423 3.325 -5.280 1.00 0.00 N ATOM 1480 CA SER B 3 9.264 3.489 -6.142 1.00 0.00 C ATOM 1481 C SER B 3 8.163 2.434 -5.949 1.00 0.00 C ATOM 1482 O SER B 3 7.014 2.823 -5.733 1.00 0.00 O ATOM 1483 CB SER B 3 9.724 3.652 -7.596 1.00 0.00 C ATOM 1484 OG SER B 3 11.014 4.246 -7.602 1.00 0.00 O ATOM 0 HA SER B 3 8.760 4.406 -5.838 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.752 2.683 -8.094 1.00 0.00 H new ATOM 0 HB3 SER B 3 9.019 4.274 -8.148 1.00 0.00 H new ATOM 0 HG SER B 3 11.390 4.222 -6.697 1.00 0.00 H new ATOM 1490 N PRO B 4 8.479 1.124 -5.991 1.00 0.00 N ATOM 1491 CA PRO B 4 7.483 0.072 -5.850 1.00 0.00 C ATOM 1492 C PRO B 4 6.692 0.183 -4.548 1.00 0.00 C ATOM 1493 O PRO B 4 5.483 -0.031 -4.537 1.00 0.00 O ATOM 1494 CB PRO B 4 8.250 -1.255 -5.920 1.00 0.00 C ATOM 1495 CG PRO B 4 9.522 -0.888 -6.681 1.00 0.00 C ATOM 1496 CD PRO B 4 9.796 0.527 -6.177 1.00 0.00 C ATOM 0 HA PRO B 4 6.739 0.150 -6.643 1.00 0.00 H new ATOM 0 HB2 PRO B 4 8.474 -1.643 -4.926 1.00 0.00 H new ATOM 0 HB3 PRO B 4 7.678 -2.023 -6.440 1.00 0.00 H new ATOM 0 HG2 PRO B 4 10.343 -1.568 -6.455 1.00 0.00 H new ATOM 0 HG3 PRO B 4 9.374 -0.915 -7.761 1.00 0.00 H new ATOM 0 HD2 PRO B 4 10.357 0.511 -5.243 1.00 0.00 H new ATOM 0 HD3 PRO B 4 10.388 1.094 -6.895 1.00 0.00 H new ATOM 1504 N LEU B 5 7.365 0.513 -3.442 1.00 0.00 N ATOM 1505 CA LEU B 5 6.684 0.668 -2.169 1.00 0.00 C ATOM 1506 C LEU B 5 6.010 2.037 -2.119 1.00 0.00 C ATOM 1507 O LEU B 5 4.857 2.138 -1.703 1.00 0.00 O ATOM 1508 CB LEU B 5 7.661 0.455 -1.009 1.00 0.00 C ATOM 1509 CG LEU B 5 6.966 0.563 0.359 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.827 -0.446 0.531 1.00 0.00 C ATOM 1511 CD2 LEU B 5 7.977 0.295 1.469 1.00 0.00 C ATOM 0 H LEU B 5 8.371 0.675 -3.409 1.00 0.00 H new ATOM 0 HA LEU B 5 5.908 -0.091 -2.068 1.00 0.00 H new ATOM 0 HB2 LEU B 5 8.126 -0.526 -1.103 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.460 1.194 -1.068 1.00 0.00 H new ATOM 0 HG LEU B 5 6.553 1.570 0.414 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.376 -0.321 1.515 1.00 0.00 H new ATOM 0 HD12 LEU B 5 5.073 -0.278 -0.238 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.221 -1.458 0.438 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.483 0.372 2.438 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.390 -0.707 1.351 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.782 1.028 1.413 1.00 0.00 H new ATOM 1523 N ASP B 6 6.722 3.082 -2.556 1.00 0.00 N ATOM 1524 CA ASP B 6 6.228 4.454 -2.567 1.00 0.00 C ATOM 1525 C ASP B 6 4.849 4.523 -3.210 1.00 0.00 C ATOM 1526 O ASP B 6 3.942 5.112 -2.630 1.00 0.00 O ATOM 1527 CB ASP B 6 7.185 5.407 -3.296 1.00 0.00 C ATOM 1528 CG ASP B 6 8.535 5.583 -2.608 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.560 5.520 -1.359 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.521 5.793 -3.348 1.00 0.00 O ATOM 0 H ASP B 6 7.672 2.991 -2.917 1.00 0.00 H new ATOM 0 HA ASP B 6 6.161 4.775 -1.527 1.00 0.00 H new ATOM 0 HB2 ASP B 6 7.351 5.035 -4.307 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.707 6.382 -3.390 1.00 0.00 H new ATOM 1535 N GLN B 7 4.670 3.919 -4.391 1.00 0.00 N ATOM 1536 CA GLN B 7 3.361 3.931 -5.033 1.00 0.00 C ATOM 1537 C GLN B 7 2.297 3.264 -4.150 1.00 0.00 C ATOM 1538 O GLN B 7 1.170 3.747 -4.070 1.00 0.00 O ATOM 1539 CB GLN B 7 3.421 3.339 -6.450 1.00 0.00 C ATOM 1540 CG GLN B 7 3.838 1.865 -6.496 1.00 0.00 C ATOM 1541 CD GLN B 7 3.989 1.372 -7.930 1.00 0.00 C ATOM 1542 OE1 GLN B 7 5.098 1.182 -8.418 1.00 0.00 O ATOM 1543 NE2 GLN B 7 2.874 1.164 -8.624 1.00 0.00 N ATOM 0 H GLN B 7 5.400 3.428 -4.907 1.00 0.00 H new ATOM 0 HA GLN B 7 3.055 4.971 -5.150 1.00 0.00 H new ATOM 0 HB2 GLN B 7 2.442 3.443 -6.917 1.00 0.00 H new ATOM 0 HB3 GLN B 7 4.122 3.923 -7.046 1.00 0.00 H new ATOM 0 HG2 GLN B 7 4.781 1.736 -5.965 1.00 0.00 H new ATOM 0 HG3 GLN B 7 3.094 1.259 -5.978 1.00 0.00 H new ATOM 0 HE21 GLN B 7 1.965 1.331 -8.191 1.00 0.00 H new ATOM 0 HE22 GLN B 7 2.927 0.838 -9.589 1.00 0.00 H new ATOM 1552 N ALA B 8 2.642 2.166 -3.473 1.00 0.00 N ATOM 1553 CA ALA B 8 1.694 1.439 -2.645 1.00 0.00 C ATOM 1554 C ALA B 8 1.300 2.250 -1.412 1.00 0.00 C ATOM 1555 O ALA B 8 0.113 2.478 -1.186 1.00 0.00 O ATOM 1556 CB ALA B 8 2.253 0.074 -2.265 1.00 0.00 C ATOM 0 H ALA B 8 3.579 1.764 -3.487 1.00 0.00 H new ATOM 0 HA ALA B 8 0.786 1.278 -3.226 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.530 -0.456 -1.645 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.449 -0.503 -3.169 1.00 0.00 H new ATOM 0 HB3 ALA B 8 3.182 0.203 -1.709 1.00 0.00 H new ATOM 1562 N ILE B 9 2.272 2.713 -0.616 1.00 0.00 N ATOM 1563 CA ILE B 9 1.943 3.568 0.525 1.00 0.00 C ATOM 1564 C ILE B 9 1.196 4.811 0.016 1.00 0.00 C ATOM 1565 O ILE B 9 0.164 5.193 0.565 1.00 0.00 O ATOM 1566 CB ILE B 9 3.167 3.872 1.416 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.273 4.664 0.705 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.707 2.557 1.996 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.461 4.989 1.618 1.00 0.00 C ATOM 0 H ILE B 9 3.265 2.516 -0.737 1.00 0.00 H new ATOM 0 HA ILE B 9 1.272 3.036 1.199 1.00 0.00 H new ATOM 0 HB ILE B 9 2.827 4.525 2.220 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.627 4.092 -0.153 1.00 0.00 H new ATOM 0 HG13 ILE B 9 3.855 5.593 0.318 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.572 2.765 2.626 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.931 2.076 2.592 1.00 0.00 H new ATOM 0 HG23 ILE B 9 4.002 1.895 1.182 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.209 5.550 1.057 1.00 0.00 H new ATOM 0 HD12 ILE B 9 5.118 5.587 2.463 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.902 4.062 1.985 1.00 0.00 H new ATOM 1581 N GLY B 10 1.678 5.379 -1.094 1.00 0.00 N ATOM 1582 CA GLY B 10 1.033 6.439 -1.851 1.00 0.00 C ATOM 1583 C GLY B 10 -0.445 6.149 -2.095 1.00 0.00 C ATOM 1584 O GLY B 10 -1.276 7.031 -1.916 1.00 0.00 O ATOM 0 H GLY B 10 2.569 5.095 -1.502 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.134 7.382 -1.313 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.541 6.562 -2.807 1.00 0.00 H new ATOM 1588 N LEU B 11 -0.785 4.923 -2.494 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.161 4.508 -2.726 1.00 0.00 C ATOM 1590 C LEU B 11 -2.995 4.699 -1.456 1.00 0.00 C ATOM 1591 O LEU B 11 -3.958 5.464 -1.459 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.172 3.051 -3.217 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.417 2.610 -3.996 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -4.723 2.858 -3.246 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.447 3.202 -5.407 1.00 0.00 C ATOM 0 H LEU B 11 -0.102 4.185 -2.666 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.615 5.129 -3.498 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.299 2.896 -3.850 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.059 2.397 -2.352 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.335 1.528 -4.096 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.562 2.522 -3.856 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.713 2.306 -2.306 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -4.828 3.923 -3.040 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.345 2.864 -5.924 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.451 4.290 -5.345 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.566 2.874 -5.958 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.628 4.020 -0.363 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.314 4.130 0.924 1.00 0.00 C ATOM 1609 C LEU B 12 -3.459 5.601 1.322 1.00 0.00 C ATOM 1610 O LEU B 12 -4.538 6.033 1.735 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.531 3.374 2.014 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.743 1.851 2.022 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.140 1.146 0.803 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.114 1.252 3.284 1.00 0.00 C ATOM 0 H LEU B 12 -1.839 3.374 -0.350 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.305 3.687 0.826 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.468 3.578 1.885 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.816 3.771 2.988 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.821 1.692 1.996 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.326 0.074 0.873 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.599 1.535 -0.106 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.065 1.326 0.773 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.265 0.173 3.289 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.046 1.469 3.296 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.583 1.688 4.166 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.368 6.360 1.208 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.329 7.773 1.556 1.00 0.00 C ATOM 1628 C ILE B 13 -3.327 8.552 0.699 1.00 0.00 C ATOM 1629 O ILE B 13 -4.098 9.352 1.228 1.00 0.00 O ATOM 1630 CB ILE B 13 -0.887 8.296 1.395 1.00 0.00 C ATOM 1631 CG1 ILE B 13 0.036 7.677 2.460 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -0.800 9.824 1.486 1.00 0.00 C ATOM 1633 CD1 ILE B 13 1.515 7.760 2.066 1.00 0.00 C ATOM 0 H ILE B 13 -1.476 6.001 0.866 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.623 7.913 2.596 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.562 7.998 0.398 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -0.114 8.190 3.410 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.239 6.634 2.614 1.00 0.00 H new ATOM 0 HG21 ILE B 13 0.237 10.137 1.366 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.407 10.271 0.699 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.168 10.152 2.458 1.00 0.00 H new ATOM 0 HD11 ILE B 13 2.126 7.310 2.849 1.00 0.00 H new ATOM 0 HD12 ILE B 13 1.673 7.224 1.130 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.800 8.804 1.939 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.308 8.318 -0.611 1.00 0.00 N ATOM 1646 CA GLY B 14 -4.166 8.967 -1.581 1.00 0.00 C ATOM 1647 C GLY B 14 -5.626 8.679 -1.264 1.00 0.00 C ATOM 1648 O GLY B 14 -6.410 9.608 -1.097 1.00 0.00 O ATOM 0 H GLY B 14 -2.669 7.645 -1.035 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -3.989 10.043 -1.572 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -3.927 8.613 -2.584 1.00 0.00 H new ATOM 1652 N ILE B 15 -5.986 7.396 -1.146 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.326 6.976 -0.762 1.00 0.00 C ATOM 1654 C ILE B 15 -7.745 7.722 0.508 1.00 0.00 C ATOM 1655 O ILE B 15 -8.821 8.317 0.561 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.374 5.435 -0.639 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.684 4.841 -2.026 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.399 4.966 0.398 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.694 3.308 -2.059 1.00 0.00 C ATOM 0 H ILE B 15 -5.347 6.620 -1.317 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.057 7.238 -1.527 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.404 5.083 -0.289 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.655 5.208 -2.358 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -6.945 5.205 -2.739 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.395 3.877 0.447 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.141 5.374 1.375 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.392 5.312 0.111 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -7.920 2.967 -3.069 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.716 2.931 -1.759 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.453 2.934 -1.372 1.00 0.00 H new ATOM 1671 N PHE B 16 -6.879 7.714 1.523 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.179 8.373 2.779 1.00 0.00 C ATOM 1673 C PHE B 16 -7.472 9.857 2.566 1.00 0.00 C ATOM 1674 O PHE B 16 -8.546 10.334 2.914 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.027 8.159 3.763 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.308 8.643 5.167 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -6.161 10.001 5.494 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.750 7.741 6.148 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.335 10.426 6.817 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -6.882 8.156 7.482 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.627 9.492 7.824 1.00 0.00 C ATOM 0 H PHE B 16 -5.968 7.257 1.492 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.080 7.931 3.204 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.789 7.096 3.799 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.142 8.672 3.385 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -5.914 10.718 4.725 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -6.989 6.724 5.875 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -6.244 11.474 7.063 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -7.179 7.449 8.243 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.655 9.801 8.858 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.517 10.599 2.006 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.612 12.050 1.936 1.00 0.00 C ATOM 1693 C HIS B 17 -7.700 12.498 0.963 1.00 0.00 C ATOM 1694 O HIS B 17 -8.356 13.511 1.209 1.00 0.00 O ATOM 1695 CB HIS B 17 -5.239 12.663 1.653 1.00 0.00 C ATOM 1696 CG HIS B 17 -4.337 12.489 2.847 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -3.702 11.320 3.195 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -4.322 13.305 3.946 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -3.307 11.435 4.474 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -3.658 12.630 4.977 1.00 0.00 N ATOM 0 H HIS B 17 -5.667 10.214 1.594 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.926 12.430 2.908 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.793 12.188 0.779 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -5.346 13.722 1.420 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -3.557 10.511 2.591 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -4.748 14.296 4.007 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -2.779 10.670 5.023 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.933 11.718 -0.099 1.00 0.00 N ATOM 1709 CA LYS B 18 -9.081 11.901 -0.977 1.00 0.00 C ATOM 1710 C LYS B 18 -10.329 11.955 -0.100 1.00 0.00 C ATOM 1711 O LYS B 18 -11.140 12.874 -0.212 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.164 10.734 -1.977 1.00 0.00 C ATOM 1713 CG LYS B 18 -10.332 10.851 -2.971 1.00 0.00 C ATOM 1714 CD LYS B 18 -10.807 9.471 -3.449 1.00 0.00 C ATOM 1715 CE LYS B 18 -9.703 8.669 -4.148 1.00 0.00 C ATOM 1716 NZ LYS B 18 -10.204 7.361 -4.609 1.00 0.00 N ATOM 0 H LYS B 18 -7.327 10.943 -0.369 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.990 12.823 -1.551 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -8.229 10.678 -2.534 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -9.262 9.800 -1.424 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.161 11.379 -2.499 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -10.022 11.447 -3.829 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -11.176 8.903 -2.595 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -11.646 9.598 -4.134 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -9.321 9.235 -4.998 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -8.868 8.521 -3.463 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -9.405 6.774 -4.923 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -10.698 6.884 -3.828 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -10.863 7.501 -5.401 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.466 10.970 0.790 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.575 10.939 1.717 1.00 0.00 C ATOM 1732 C TYR B 19 -11.534 12.090 2.709 1.00 0.00 C ATOM 1733 O TYR B 19 -12.535 12.785 2.806 1.00 0.00 O ATOM 1734 CB TYR B 19 -11.716 9.566 2.370 1.00 0.00 C ATOM 1735 CG TYR B 19 -12.721 8.741 1.610 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -12.334 8.099 0.420 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.082 8.990 1.857 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -13.299 7.763 -0.542 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -15.035 8.704 0.873 1.00 0.00 C ATOM 1740 CZ TYR B 19 -14.641 8.131 -0.344 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.558 7.961 -1.334 1.00 0.00 O ATOM 0 H TYR B 19 -9.817 10.188 0.880 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.489 11.096 1.145 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -10.751 9.059 2.384 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.033 9.677 3.407 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -11.294 7.865 0.246 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -14.392 9.402 2.806 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -13.011 7.223 -1.432 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -16.077 8.925 1.052 1.00 0.00 H new ATOM 0 HH TYR B 19 -16.454 8.152 -0.986 1.00 0.00 H new ATOM 1751 N SER B 20 -10.425 12.339 3.415 1.00 0.00 N ATOM 1752 CA SER B 20 -10.325 13.473 4.333 1.00 0.00 C ATOM 1753 C SER B 20 -10.867 14.751 3.683 1.00 0.00 C ATOM 1754 O SER B 20 -11.634 15.483 4.308 1.00 0.00 O ATOM 1755 CB SER B 20 -8.882 13.653 4.814 1.00 0.00 C ATOM 1756 OG SER B 20 -8.410 12.457 5.407 1.00 0.00 O ATOM 0 H SER B 20 -9.582 11.766 3.366 1.00 0.00 H new ATOM 0 HA SER B 20 -10.941 13.265 5.207 1.00 0.00 H new ATOM 0 HB2 SER B 20 -8.243 13.928 3.975 1.00 0.00 H new ATOM 0 HB3 SER B 20 -8.831 14.469 5.534 1.00 0.00 H new ATOM 0 HG SER B 20 -8.690 12.425 6.346 1.00 0.00 H new ATOM 1762 N GLY B 21 -10.507 14.978 2.414 1.00 0.00 N ATOM 1763 CA GLY B 21 -11.065 16.009 1.547 1.00 0.00 C ATOM 1764 C GLY B 21 -12.545 16.291 1.784 1.00 0.00 C ATOM 1765 O GLY B 21 -12.929 17.447 1.959 1.00 0.00 O ATOM 0 H GLY B 21 -9.789 14.422 1.949 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -10.503 16.932 1.691 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -10.925 15.709 0.508 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.390 14.886 8.629 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.754 13.572 8.513 1.00 0.00 C ATOM 1849 C HIS B 27 -5.526 12.567 9.373 1.00 0.00 C ATOM 1850 O HIS B 27 -4.962 11.695 10.041 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.271 13.682 8.890 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.522 14.635 7.991 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -2.662 14.722 6.625 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.661 15.625 8.380 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.900 15.742 6.201 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -1.263 16.322 7.233 1.00 0.00 N ATOM 0 HA HIS B 27 -4.787 13.209 7.486 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.185 14.017 9.924 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -2.810 12.696 8.835 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -3.241 14.120 6.040 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.345 15.832 9.392 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -1.811 16.054 5.171 1.00 0.00 H new ATOM 1864 N THR B 28 -6.847 12.711 9.329 1.00 0.00 N ATOM 1865 CA THR B 28 -7.823 12.008 10.130 1.00 0.00 C ATOM 1866 C THR B 28 -9.005 11.656 9.210 1.00 0.00 C ATOM 1867 O THR B 28 -9.157 12.236 8.132 1.00 0.00 O ATOM 1868 CB THR B 28 -8.196 12.912 11.326 1.00 0.00 C ATOM 1869 OG1 THR B 28 -8.081 14.283 10.994 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.219 12.727 12.490 1.00 0.00 C ATOM 0 H THR B 28 -7.286 13.369 8.686 1.00 0.00 H new ATOM 0 HA THR B 28 -7.452 11.073 10.549 1.00 0.00 H new ATOM 0 HB THR B 28 -9.216 12.633 11.590 1.00 0.00 H new ATOM 0 HG1 THR B 28 -8.325 14.829 11.770 1.00 0.00 H new ATOM 0 HG21 THR B 28 -7.509 13.377 13.315 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.240 11.689 12.821 1.00 0.00 H new ATOM 0 HG23 THR B 28 -6.211 12.983 12.163 1.00 0.00 H new ATOM 1878 N LEU B 29 -9.821 10.678 9.602 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.086 10.365 8.941 1.00 0.00 C ATOM 1880 C LEU B 29 -12.153 10.198 10.009 1.00 0.00 C ATOM 1881 O LEU B 29 -11.942 9.453 10.956 1.00 0.00 O ATOM 1882 CB LEU B 29 -10.997 9.053 8.150 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.174 9.132 6.861 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.077 7.726 6.258 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -10.816 10.059 5.831 1.00 0.00 C ATOM 0 H LEU B 29 -9.619 10.073 10.398 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.325 11.174 8.251 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -10.565 8.286 8.793 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.007 8.727 7.900 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.190 9.530 7.110 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.493 7.764 5.338 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.591 7.058 6.969 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.078 7.355 6.038 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -10.200 10.086 4.932 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -11.810 9.690 5.579 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -10.897 11.064 6.246 1.00 0.00 H new ATOM 1897 N SER B 30 -13.311 10.832 9.868 1.00 0.00 N ATOM 1898 CA SER B 30 -14.371 10.683 10.852 1.00 0.00 C ATOM 1899 C SER B 30 -15.085 9.342 10.638 1.00 0.00 C ATOM 1900 O SER B 30 -15.073 8.794 9.538 1.00 0.00 O ATOM 1901 CB SER B 30 -15.303 11.892 10.753 1.00 0.00 C ATOM 1902 OG SER B 30 -14.560 13.071 11.001 1.00 0.00 O ATOM 0 H SER B 30 -13.537 11.449 9.088 1.00 0.00 H new ATOM 0 HA SER B 30 -13.973 10.661 11.867 1.00 0.00 H new ATOM 0 HB2 SER B 30 -15.758 11.936 9.764 1.00 0.00 H new ATOM 0 HB3 SER B 30 -16.115 11.801 11.474 1.00 0.00 H new ATOM 0 HG SER B 30 -15.151 13.850 10.937 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.700 8.788 11.685 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.194 7.416 11.679 1.00 0.00 C ATOM 1910 C LYS B 31 -17.106 7.079 10.488 1.00 0.00 C ATOM 1911 O LYS B 31 -16.953 6.037 9.852 1.00 0.00 O ATOM 1912 CB LYS B 31 -16.808 7.096 13.049 1.00 0.00 C ATOM 1913 CG LYS B 31 -17.947 8.020 13.495 1.00 0.00 C ATOM 1914 CD LYS B 31 -18.458 7.562 14.868 1.00 0.00 C ATOM 1915 CE LYS B 31 -19.530 8.505 15.428 1.00 0.00 C ATOM 1916 NZ LYS B 31 -20.722 8.573 14.565 1.00 0.00 N ATOM 0 H LYS B 31 -15.868 9.282 12.561 1.00 0.00 H new ATOM 0 HA LYS B 31 -15.345 6.750 11.521 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -17.181 6.072 13.030 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -16.018 7.134 13.799 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -17.596 9.050 13.549 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -18.757 7.997 12.766 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.869 6.556 14.784 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.622 7.508 15.566 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -19.823 8.168 16.422 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -19.109 9.504 15.541 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -21.445 9.168 15.017 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -20.462 8.983 13.645 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -21.102 7.616 14.422 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.050 7.960 10.155 1.00 0.00 N ATOM 1931 CA LYS B 32 -18.945 7.703 9.022 1.00 0.00 C ATOM 1932 C LYS B 32 -18.278 8.044 7.679 1.00 0.00 C ATOM 1933 O LYS B 32 -18.568 7.423 6.657 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.298 8.406 9.185 1.00 0.00 C ATOM 1935 CG LYS B 32 -20.937 8.266 10.575 1.00 0.00 C ATOM 1936 CD LYS B 32 -21.148 6.814 11.033 1.00 0.00 C ATOM 1937 CE LYS B 32 -22.098 6.052 10.099 1.00 0.00 C ATOM 1938 NZ LYS B 32 -22.481 4.748 10.668 1.00 0.00 N ATOM 0 H LYS B 32 -18.215 8.841 10.641 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.147 6.632 9.015 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -20.169 9.466 8.966 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.989 8.009 8.442 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -20.308 8.776 11.304 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.900 8.777 10.572 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -20.187 6.302 11.070 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -21.552 6.808 12.045 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -22.992 6.649 9.921 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -21.617 5.902 9.132 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -23.282 4.357 10.132 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -21.674 4.094 10.611 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -22.757 4.871 11.663 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.360 9.015 7.672 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.552 9.345 6.503 1.00 0.00 C ATOM 1954 C GLU B 33 -15.745 8.107 6.097 1.00 0.00 C ATOM 1955 O GLU B 33 -15.679 7.758 4.918 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.673 10.552 6.857 1.00 0.00 C ATOM 1957 CG GLU B 33 -14.759 11.081 5.744 1.00 0.00 C ATOM 1958 CD GLU B 33 -13.884 12.226 6.264 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -13.617 12.238 7.484 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -13.499 13.082 5.443 1.00 0.00 O ATOM 0 H GLU B 33 -17.158 9.596 8.486 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.163 9.622 5.644 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.323 11.365 7.180 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.051 10.283 7.711 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -14.128 10.275 5.370 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -15.362 11.429 4.905 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.181 7.408 7.087 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.564 6.106 6.893 1.00 0.00 C ATOM 1969 C LEU B 34 -15.558 5.141 6.242 1.00 0.00 C ATOM 1970 O LEU B 34 -15.219 4.508 5.243 1.00 0.00 O ATOM 1971 CB LEU B 34 -13.989 5.587 8.221 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.437 4.149 8.201 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.541 3.077 8.184 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.407 3.967 7.076 1.00 0.00 C ATOM 0 H LEU B 34 -15.143 7.739 8.051 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.723 6.193 6.205 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.189 6.258 8.535 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -14.770 5.645 8.980 1.00 0.00 H new ATOM 0 HG LEU B 34 -12.913 3.996 9.145 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -14.086 2.087 8.170 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.161 3.179 9.075 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.159 3.205 7.295 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.034 2.943 7.086 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.878 4.173 6.115 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.577 4.657 7.228 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.784 5.004 6.763 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.755 4.152 6.077 1.00 0.00 C ATOM 1988 C LYS B 35 -17.862 4.562 4.605 1.00 0.00 C ATOM 1989 O LYS B 35 -17.818 3.696 3.737 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.134 4.131 6.755 1.00 0.00 C ATOM 1991 CG LYS B 35 -20.067 3.199 5.958 1.00 0.00 C ATOM 1992 CD LYS B 35 -21.501 3.155 6.480 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.612 2.392 7.797 1.00 0.00 C ATOM 1994 NZ LYS B 35 -23.034 2.240 8.156 1.00 0.00 N ATOM 0 H LYS B 35 -17.115 5.451 7.618 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.384 3.129 6.139 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.043 3.783 7.784 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.550 5.138 6.794 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -20.081 3.521 4.917 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.655 2.190 5.974 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -21.866 4.172 6.620 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -22.143 2.685 5.735 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -21.142 1.413 7.704 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -21.081 2.926 8.585 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -23.172 2.509 9.151 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -23.613 2.854 7.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -23.322 1.250 8.023 1.00 0.00 H new ATOM 2008 N GLU B 36 -17.996 5.859 4.312 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.082 6.322 2.931 1.00 0.00 C ATOM 2010 C GLU B 36 -16.852 5.860 2.125 1.00 0.00 C ATOM 2011 O GLU B 36 -17.004 5.339 1.020 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.328 7.843 2.873 1.00 0.00 C ATOM 2013 CG GLU B 36 -19.313 8.234 1.756 1.00 0.00 C ATOM 2014 CD GLU B 36 -18.930 7.712 0.371 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -18.041 8.335 -0.252 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -19.542 6.706 -0.047 1.00 0.00 O ATOM 0 H GLU B 36 -18.047 6.600 5.011 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.947 5.864 2.452 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -18.717 8.183 3.833 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.380 8.356 2.714 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -20.303 7.858 2.012 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -19.385 9.321 1.715 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.645 6.000 2.690 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.422 5.452 2.099 1.00 0.00 C ATOM 2025 C LEU B 37 -14.628 3.993 1.725 1.00 0.00 C ATOM 2026 O LEU B 37 -14.420 3.607 0.577 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.210 5.641 3.035 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.860 5.147 2.475 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.723 5.885 3.186 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.617 3.647 2.710 1.00 0.00 C ATOM 0 H LEU B 37 -15.492 6.496 3.568 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.201 6.005 1.186 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.119 6.700 3.275 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.409 5.118 3.970 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.888 5.337 1.402 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.765 5.541 2.795 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.821 6.957 3.014 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.772 5.684 4.256 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.651 3.365 2.292 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.624 3.441 3.780 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.404 3.070 2.225 1.00 0.00 H new ATOM 2042 N ILE B 38 -15.025 3.174 2.694 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.151 1.746 2.467 1.00 0.00 C ATOM 2044 C ILE B 38 -16.202 1.471 1.397 1.00 0.00 C ATOM 2045 O ILE B 38 -15.913 0.761 0.444 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.399 1.014 3.791 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -14.140 1.212 4.649 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.663 -0.483 3.568 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -14.222 0.462 5.965 1.00 0.00 C ATOM 0 H ILE B 38 -15.263 3.477 3.638 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.215 1.347 2.077 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.284 1.416 4.283 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -13.266 0.873 4.093 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -14.000 2.275 4.846 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -15.834 -0.969 4.528 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -16.543 -0.607 2.936 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.800 -0.936 3.081 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -13.310 0.631 6.538 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.080 0.819 6.535 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -14.335 -0.604 5.770 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.400 2.040 1.522 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.458 1.854 0.539 1.00 0.00 C ATOM 2063 C GLN B 39 -17.963 2.207 -0.869 1.00 0.00 C ATOM 2064 O GLN B 39 -18.270 1.490 -1.820 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.691 2.682 0.929 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.352 2.188 2.228 1.00 0.00 C ATOM 2067 CD GLN B 39 -21.024 0.823 2.099 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -21.358 0.379 1.005 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -21.248 0.143 3.221 1.00 0.00 N ATOM 0 H GLN B 39 -17.661 2.640 2.305 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.747 0.803 0.526 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.400 3.726 1.049 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.419 2.645 0.119 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -19.597 2.138 3.012 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -21.095 2.919 2.547 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -20.961 0.532 4.119 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -21.706 -0.767 3.183 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.201 3.299 -1.012 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.701 3.708 -2.316 1.00 0.00 C ATOM 2080 C LYS B 40 -15.611 2.773 -2.830 1.00 0.00 C ATOM 2081 O LYS B 40 -15.680 2.317 -3.970 1.00 0.00 O ATOM 2082 CB LYS B 40 -16.219 5.164 -2.261 1.00 0.00 C ATOM 2083 CG LYS B 40 -15.626 5.709 -3.576 1.00 0.00 C ATOM 2084 CD LYS B 40 -16.648 6.327 -4.543 1.00 0.00 C ATOM 2085 CE LYS B 40 -17.664 5.351 -5.151 1.00 0.00 C ATOM 2086 NZ LYS B 40 -17.016 4.177 -5.766 1.00 0.00 N ATOM 0 H LYS B 40 -16.923 3.907 -0.242 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.523 3.642 -3.029 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -17.057 5.797 -1.969 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -15.466 5.251 -1.478 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -14.876 6.462 -3.334 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -15.109 4.897 -4.088 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -17.194 7.108 -4.015 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -16.106 6.811 -5.355 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -18.353 5.018 -4.375 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -18.258 5.870 -5.903 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -17.716 3.645 -6.321 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -16.247 4.493 -6.390 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -16.628 3.565 -5.021 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.566 2.549 -2.035 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.432 1.754 -2.469 1.00 0.00 C ATOM 2102 C GLU B 41 -13.845 0.280 -2.495 1.00 0.00 C ATOM 2103 O GLU B 41 -13.890 -0.360 -3.541 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.228 2.012 -1.548 1.00 0.00 C ATOM 2105 CG GLU B 41 -11.800 3.491 -1.499 1.00 0.00 C ATOM 2106 CD GLU B 41 -11.372 4.058 -2.851 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -10.690 3.321 -3.595 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -11.714 5.234 -3.109 1.00 0.00 O ATOM 0 H GLU B 41 -14.487 2.911 -1.085 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.126 2.037 -3.476 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.474 1.679 -0.540 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.386 1.409 -1.886 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.628 4.086 -1.113 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -10.975 3.597 -0.794 1.00 0.00 H new ATOM 2115 N LEU B 42 -14.191 -0.262 -1.333 1.00 0.00 N ATOM 2116 CA LEU B 42 -14.600 -1.648 -1.193 1.00 0.00 C ATOM 2117 C LEU B 42 -16.076 -1.724 -1.579 1.00 0.00 C ATOM 2118 O LEU B 42 -16.952 -1.803 -0.719 1.00 0.00 O ATOM 2119 CB LEU B 42 -14.357 -2.162 0.238 1.00 0.00 C ATOM 2120 CG LEU B 42 -12.891 -2.334 0.687 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -12.129 -3.335 -0.188 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -12.108 -1.020 0.767 1.00 0.00 C ATOM 0 H LEU B 42 -14.194 0.257 -0.455 1.00 0.00 H new ATOM 0 HA LEU B 42 -14.008 -2.290 -1.845 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -14.844 -1.475 0.931 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -14.857 -3.125 0.340 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.964 -2.730 1.700 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -11.102 -3.421 0.168 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -12.615 -4.309 -0.134 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.127 -2.987 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -11.087 -1.224 1.089 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -12.091 -0.546 -0.215 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -12.588 -0.353 1.483 1.00 0.00 H new ATOM 2243 N ASP B 50 -23.203 -4.573 5.748 1.00 0.00 N ATOM 2244 CA ASP B 50 -22.970 -3.291 6.403 1.00 0.00 C ATOM 2245 C ASP B 50 -22.834 -3.433 7.921 1.00 0.00 C ATOM 2246 O ASP B 50 -22.069 -2.693 8.526 1.00 0.00 O ATOM 2247 CB ASP B 50 -24.042 -2.261 6.036 1.00 0.00 C ATOM 2248 CG ASP B 50 -23.682 -0.888 6.600 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -22.751 -0.269 6.038 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -24.337 -0.478 7.582 1.00 0.00 O ATOM 0 HA ASP B 50 -22.016 -2.921 6.028 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -24.140 -2.201 4.952 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -25.009 -2.579 6.427 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.525 -4.400 8.534 1.00 0.00 N ATOM 2256 CA ALA B 51 -23.330 -4.749 9.940 1.00 0.00 C ATOM 2257 C ALA B 51 -21.847 -4.999 10.254 1.00 0.00 C ATOM 2258 O ALA B 51 -21.289 -4.435 11.197 1.00 0.00 O ATOM 2259 CB ALA B 51 -24.173 -5.982 10.275 1.00 0.00 C ATOM 0 H ALA B 51 -24.236 -4.962 8.066 1.00 0.00 H new ATOM 0 HA ALA B 51 -23.653 -3.911 10.558 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -24.031 -6.246 11.323 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.226 -5.763 10.096 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -23.864 -6.816 9.645 1.00 0.00 H new ATOM 2265 N GLU B 52 -21.192 -5.834 9.443 1.00 0.00 N ATOM 2266 CA GLU B 52 -19.771 -6.100 9.588 1.00 0.00 C ATOM 2267 C GLU B 52 -18.994 -4.807 9.359 1.00 0.00 C ATOM 2268 O GLU B 52 -18.076 -4.495 10.115 1.00 0.00 O ATOM 2269 CB GLU B 52 -19.316 -7.192 8.612 1.00 0.00 C ATOM 2270 CG GLU B 52 -20.106 -8.494 8.800 1.00 0.00 C ATOM 2271 CD GLU B 52 -19.551 -9.607 7.917 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -19.537 -9.395 6.684 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -19.157 -10.647 8.485 1.00 0.00 O ATOM 0 H GLU B 52 -21.634 -6.338 8.675 1.00 0.00 H new ATOM 0 HA GLU B 52 -19.575 -6.463 10.597 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -19.438 -6.838 7.588 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -18.254 -7.388 8.756 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -20.064 -8.800 9.845 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -21.155 -8.324 8.559 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.376 -4.045 8.328 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.737 -2.766 8.046 1.00 0.00 C ATOM 2282 C ILE B 53 -18.796 -1.846 9.270 1.00 0.00 C ATOM 2283 O ILE B 53 -17.786 -1.230 9.590 1.00 0.00 O ATOM 2284 CB ILE B 53 -19.290 -2.094 6.773 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -19.264 -3.025 5.544 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.522 -0.798 6.467 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -17.893 -3.631 5.234 1.00 0.00 C ATOM 0 H ILE B 53 -20.123 -4.296 7.680 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.686 -2.965 7.836 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.335 -1.859 6.977 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -19.977 -3.834 5.702 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -19.605 -2.465 4.673 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -18.927 -0.339 5.565 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.626 -0.107 7.304 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.467 -1.027 6.315 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -17.969 -4.271 4.355 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -17.177 -2.832 5.040 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.555 -4.222 6.085 1.00 0.00 H new ATOM 2299 N VAL B 54 -19.929 -1.743 9.976 1.00 0.00 N ATOM 2300 CA VAL B 54 -19.989 -0.885 11.156 1.00 0.00 C ATOM 2301 C VAL B 54 -19.154 -1.427 12.316 1.00 0.00 C ATOM 2302 O VAL B 54 -18.522 -0.638 13.014 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.400 -0.446 11.575 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -21.934 0.567 10.558 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.392 -1.586 11.789 1.00 0.00 C ATOM 0 H VAL B 54 -20.796 -2.233 9.754 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.519 0.046 10.839 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.301 0.013 12.559 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -22.936 0.882 10.850 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.275 1.434 10.528 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -21.972 0.106 9.571 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.359 -1.177 12.082 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.503 -2.151 10.863 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -22.024 -2.246 12.575 1.00 0.00 H new ATOM 2315 N LYS B 55 -19.103 -2.747 12.525 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.186 -3.301 13.521 1.00 0.00 C ATOM 2317 C LYS B 55 -16.743 -2.908 13.174 1.00 0.00 C ATOM 2318 O LYS B 55 -16.013 -2.358 13.997 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.372 -4.823 13.623 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.357 -5.517 14.547 1.00 0.00 C ATOM 2321 CD LYS B 55 -17.344 -4.935 15.969 1.00 0.00 C ATOM 2322 CE LYS B 55 -16.357 -5.678 16.878 1.00 0.00 C ATOM 2323 NZ LYS B 55 -16.760 -7.075 17.115 1.00 0.00 N ATOM 0 H LYS B 55 -19.671 -3.435 12.031 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.410 -2.885 14.503 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.379 -5.032 13.984 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -18.295 -5.256 12.626 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -17.589 -6.581 14.598 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.360 -5.428 14.115 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -17.076 -3.879 15.927 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -18.346 -4.993 16.395 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -15.365 -5.660 16.426 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -16.282 -5.157 17.832 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -16.165 -7.486 17.862 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -17.756 -7.103 17.411 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -16.644 -7.623 16.239 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.342 -3.168 11.932 1.00 0.00 N ATOM 2338 CA LEU B 56 -15.039 -2.793 11.408 1.00 0.00 C ATOM 2339 C LEU B 56 -14.782 -1.288 11.592 1.00 0.00 C ATOM 2340 O LEU B 56 -13.710 -0.885 12.040 1.00 0.00 O ATOM 2341 CB LEU B 56 -14.969 -3.284 9.954 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.827 -2.679 9.134 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -13.282 -3.698 8.126 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.333 -1.474 8.340 1.00 0.00 C ATOM 0 H LEU B 56 -16.927 -3.654 11.252 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.229 -3.268 11.961 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.864 -4.369 9.955 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -15.914 -3.056 9.461 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.042 -2.383 9.831 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.471 -3.246 7.554 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.907 -4.572 8.659 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -14.080 -4.001 7.448 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.513 -1.050 7.760 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.129 -1.791 7.666 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.718 -0.721 9.028 1.00 0.00 H new ATOM 2356 N MET B 57 -15.767 -0.450 11.267 1.00 0.00 N ATOM 2357 CA MET B 57 -15.679 0.997 11.386 1.00 0.00 C ATOM 2358 C MET B 57 -15.467 1.384 12.845 1.00 0.00 C ATOM 2359 O MET B 57 -14.603 2.210 13.134 1.00 0.00 O ATOM 2360 CB MET B 57 -16.931 1.630 10.770 1.00 0.00 C ATOM 2361 CG MET B 57 -17.110 3.124 11.059 1.00 0.00 C ATOM 2362 SD MET B 57 -17.888 3.546 12.643 1.00 0.00 S ATOM 2363 CE MET B 57 -19.547 2.869 12.456 1.00 0.00 C ATOM 0 H MET B 57 -16.666 -0.770 10.906 1.00 0.00 H new ATOM 0 HA MET B 57 -14.819 1.379 10.835 1.00 0.00 H new ATOM 0 HB2 MET B 57 -16.899 1.485 9.690 1.00 0.00 H new ATOM 0 HB3 MET B 57 -17.808 1.097 11.137 1.00 0.00 H new ATOM 0 HG2 MET B 57 -16.130 3.600 11.021 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.707 3.559 10.257 1.00 0.00 H new ATOM 0 HE1 MET B 57 -20.202 3.296 13.215 1.00 0.00 H new ATOM 0 HE2 MET B 57 -19.931 3.115 11.466 1.00 0.00 H new ATOM 0 HE3 MET B 57 -19.513 1.786 12.574 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.218 0.767 13.762 1.00 0.00 N ATOM 2374 CA ASP B 58 -15.998 0.944 15.187 1.00 0.00 C ATOM 2375 C ASP B 58 -14.542 0.622 15.509 1.00 0.00 C ATOM 2376 O ASP B 58 -13.847 1.449 16.087 1.00 0.00 O ATOM 2377 CB ASP B 58 -16.969 0.094 16.015 1.00 0.00 C ATOM 2378 CG ASP B 58 -16.678 0.247 17.503 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -17.189 1.230 18.082 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -15.940 -0.610 18.034 1.00 0.00 O ATOM 0 H ASP B 58 -16.987 0.138 13.533 1.00 0.00 H new ATOM 0 HA ASP B 58 -16.196 1.982 15.456 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -17.995 0.397 15.806 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.881 -0.954 15.727 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.067 -0.556 15.100 1.00 0.00 N ATOM 2386 CA ASP B 59 -12.696 -0.977 15.371 1.00 0.00 C ATOM 2387 C ASP B 59 -11.672 0.026 14.825 1.00 0.00 C ATOM 2388 O ASP B 59 -10.661 0.286 15.475 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.429 -2.383 14.810 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.381 -3.452 15.342 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -13.720 -3.382 16.544 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -13.738 -4.341 14.538 1.00 0.00 O ATOM 0 H ASP B 59 -14.617 -1.237 14.577 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.579 -1.010 16.454 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.506 -2.351 13.723 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.405 -2.671 15.049 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.923 0.589 13.640 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.101 1.649 13.068 1.00 0.00 C ATOM 2399 C LEU B 60 -11.144 2.914 13.936 1.00 0.00 C ATOM 2400 O LEU B 60 -10.095 3.418 14.339 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.540 1.939 11.618 1.00 0.00 C ATOM 2402 CG LEU B 60 -10.854 1.028 10.586 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.723 0.810 9.347 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.551 1.660 10.084 1.00 0.00 C ATOM 0 H LEU B 60 -12.709 0.317 13.049 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.065 1.312 13.047 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.620 1.817 11.540 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.319 2.979 11.379 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.674 0.083 11.098 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.199 0.161 8.645 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.664 0.344 9.640 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -11.926 1.770 8.872 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.083 0.998 9.355 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.769 2.620 9.615 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.873 1.812 10.924 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.330 3.463 14.209 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.438 4.764 14.866 1.00 0.00 C ATOM 2418 C ASP B 61 -12.114 4.704 16.359 1.00 0.00 C ATOM 2419 O ASP B 61 -11.685 5.705 16.928 1.00 0.00 O ATOM 2420 CB ASP B 61 -13.784 5.443 14.571 1.00 0.00 C ATOM 2421 CG ASP B 61 -14.935 5.007 15.474 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -14.898 5.359 16.673 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -15.871 4.382 14.937 1.00 0.00 O ATOM 0 H ASP B 61 -13.225 3.027 13.986 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.668 5.400 14.429 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.658 6.522 14.663 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -14.057 5.241 13.535 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.304 3.544 16.997 1.00 0.00 N ATOM 2429 CA ARG B 62 -12.134 3.386 18.437 1.00 0.00 C ATOM 2430 C ARG B 62 -10.769 3.909 18.876 1.00 0.00 C ATOM 2431 O ARG B 62 -10.658 4.597 19.893 1.00 0.00 O ATOM 2432 CB ARG B 62 -12.340 1.910 18.821 1.00 0.00 C ATOM 2433 CG ARG B 62 -12.301 1.616 20.329 1.00 0.00 C ATOM 2434 CD ARG B 62 -13.287 2.468 21.141 1.00 0.00 C ATOM 2435 NE ARG B 62 -14.613 2.518 20.497 1.00 0.00 N ATOM 2436 CZ ARG B 62 -15.237 3.641 20.111 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -14.881 4.825 20.615 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -16.200 3.586 19.189 1.00 0.00 N ATOM 0 H ARG B 62 -12.582 2.686 16.521 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.884 3.978 18.961 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -13.301 1.579 18.427 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -11.572 1.313 18.330 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -12.523 0.561 20.492 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -11.291 1.790 20.700 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -13.384 2.056 22.146 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -12.894 3.479 21.247 1.00 0.00 H new ATOM 0 HE ARG B 62 -15.091 1.632 20.333 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -14.128 4.882 21.301 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -15.362 5.673 20.314 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -16.462 2.690 18.778 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -16.674 4.440 18.896 1.00 0.00 H new ATOM 2517 N GLU B 67 -12.959 9.058 15.460 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.287 9.247 14.188 1.00 0.00 C ATOM 2519 C GLU B 67 -11.082 8.313 14.102 1.00 0.00 C ATOM 2520 O GLU B 67 -10.530 7.898 15.117 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.964 10.740 13.987 1.00 0.00 C ATOM 2522 CG GLU B 67 -11.053 11.371 15.056 1.00 0.00 C ATOM 2523 CD GLU B 67 -9.559 11.222 14.776 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -9.212 10.516 13.806 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -8.781 11.852 15.523 1.00 0.00 O ATOM 0 HA GLU B 67 -12.934 8.973 13.355 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.491 10.863 13.013 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -12.901 11.296 13.959 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -11.291 12.431 15.140 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -11.277 10.917 16.021 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.710 7.958 12.877 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.547 7.161 12.543 1.00 0.00 C ATOM 2534 C VAL B 68 -8.412 8.125 12.207 1.00 0.00 C ATOM 2535 O VAL B 68 -8.508 8.863 11.226 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.841 6.274 11.318 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -8.837 5.118 11.286 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.273 5.731 11.271 1.00 0.00 C ATOM 0 H VAL B 68 -11.242 8.235 12.052 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.280 6.515 13.380 1.00 0.00 H new ATOM 0 HB VAL B 68 -9.736 6.907 10.436 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.038 4.485 10.422 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -7.825 5.517 11.216 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.932 4.528 12.198 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.400 5.117 10.380 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.462 5.127 12.158 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -11.977 6.563 11.242 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.322 8.115 12.974 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.137 8.864 12.579 1.00 0.00 C ATOM 2550 C ASN B 69 -5.383 8.074 11.513 1.00 0.00 C ATOM 2551 O ASN B 69 -5.395 6.844 11.540 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.235 9.131 13.790 1.00 0.00 C ATOM 2553 CG ASN B 69 -3.878 9.674 13.347 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -2.954 8.909 13.074 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -3.758 10.990 13.216 1.00 0.00 N ATOM 0 H ASN B 69 -7.238 7.607 13.854 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.439 9.829 12.171 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.717 9.845 14.458 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.096 8.210 14.356 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -2.882 11.391 12.881 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -4.542 11.599 13.450 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.710 8.777 10.599 1.00 0.00 N ATOM 2563 CA PHE B 70 -3.918 8.179 9.534 1.00 0.00 C ATOM 2564 C PHE B 70 -3.118 6.941 9.970 1.00 0.00 C ATOM 2565 O PHE B 70 -3.256 5.875 9.368 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.027 9.260 8.914 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.113 8.717 7.843 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.666 8.222 6.648 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.753 8.505 8.130 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.859 7.515 5.742 1.00 0.00 C ATOM 2571 CE2 PHE B 70 0.055 7.810 7.219 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.499 7.304 6.032 1.00 0.00 C ATOM 0 H PHE B 70 -4.703 9.797 10.583 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.606 7.795 8.781 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.655 10.042 8.488 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.427 9.724 9.697 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.711 8.386 6.427 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.331 8.877 9.052 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.282 7.134 4.824 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.104 7.664 7.430 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.120 6.752 5.341 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.296 7.033 11.021 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.478 5.886 11.403 1.00 0.00 C ATOM 2584 C GLN B 71 -2.346 4.723 11.896 1.00 0.00 C ATOM 2585 O GLN B 71 -2.000 3.558 11.687 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.405 6.277 12.427 1.00 0.00 C ATOM 2587 CG GLN B 71 0.575 5.106 12.621 1.00 0.00 C ATOM 2588 CD GLN B 71 1.769 5.450 13.502 1.00 0.00 C ATOM 2589 OE1 GLN B 71 1.745 6.415 14.258 1.00 0.00 O ATOM 2590 NE2 GLN B 71 2.829 4.654 13.416 1.00 0.00 N ATOM 0 H GLN B 71 -2.183 7.863 11.603 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.955 5.541 10.511 1.00 0.00 H new ATOM 0 HB2 GLN B 71 0.133 7.162 12.086 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -0.872 6.535 13.378 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.040 4.264 13.061 1.00 0.00 H new ATOM 0 HG3 GLN B 71 0.936 4.780 11.646 1.00 0.00 H new ATOM 0 HE21 GLN B 71 2.819 3.859 12.778 1.00 0.00 H new ATOM 0 HE22 GLN B 71 3.653 4.838 13.988 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.477 5.022 12.540 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.402 4.003 13.009 1.00 0.00 C ATOM 2601 C GLU B 72 -5.084 3.334 11.817 1.00 0.00 C ATOM 2602 O GLU B 72 -5.241 2.117 11.800 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.412 4.599 13.997 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.714 5.293 15.179 1.00 0.00 C ATOM 2605 CD GLU B 72 -3.745 4.367 15.911 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -4.180 3.248 16.258 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -2.582 4.789 16.092 1.00 0.00 O ATOM 0 H GLU B 72 -3.771 5.976 12.748 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.849 3.235 13.550 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -6.048 5.316 13.478 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.063 3.809 14.372 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -4.172 6.166 14.815 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -5.466 5.654 15.880 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.451 4.118 10.802 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.929 3.599 9.529 1.00 0.00 C ATOM 2616 C TYR B 73 -4.901 2.632 8.934 1.00 0.00 C ATOM 2617 O TYR B 73 -5.245 1.489 8.637 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.279 4.767 8.596 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.252 4.465 7.112 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.422 4.041 6.455 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.114 4.810 6.359 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.463 4.004 5.050 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.145 4.739 4.958 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.322 4.343 4.302 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.382 4.352 2.943 1.00 0.00 O ATOM 0 H TYR B 73 -5.423 5.137 10.845 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.843 3.023 9.673 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.275 5.127 8.855 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.584 5.583 8.793 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.287 3.744 7.029 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.213 5.131 6.862 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.373 3.715 4.545 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.265 4.989 4.385 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.716 4.978 2.590 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.642 3.061 8.782 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.592 2.191 8.252 1.00 0.00 C ATOM 2637 C ILE B 74 -2.491 0.909 9.095 1.00 0.00 C ATOM 2638 O ILE B 74 -2.585 -0.200 8.568 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.242 2.934 8.167 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.252 4.150 7.219 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.128 1.961 7.756 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.396 3.813 5.732 1.00 0.00 C ATOM 0 H ILE B 74 -3.329 4.003 9.018 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.857 1.903 7.235 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.054 3.328 9.166 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.071 4.809 7.507 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.327 4.709 7.361 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.820 2.496 7.699 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.051 1.163 8.495 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.361 1.532 6.782 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.392 4.734 5.148 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.564 3.182 5.420 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.334 3.283 5.568 1.00 0.00 H new ATOM 2654 N THR B 75 -2.318 1.058 10.412 1.00 0.00 N ATOM 2655 CA THR B 75 -2.243 -0.054 11.354 1.00 0.00 C ATOM 2656 C THR B 75 -3.399 -1.030 11.135 1.00 0.00 C ATOM 2657 O THR B 75 -3.182 -2.232 10.975 1.00 0.00 O ATOM 2658 CB THR B 75 -2.233 0.497 12.788 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.066 1.276 12.956 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.275 -0.593 13.864 1.00 0.00 C ATOM 0 H THR B 75 -2.225 1.971 10.857 1.00 0.00 H new ATOM 0 HA THR B 75 -1.320 -0.610 11.187 1.00 0.00 H new ATOM 0 HB THR B 75 -3.138 1.090 12.916 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.202 2.160 12.554 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.265 -0.131 14.851 1.00 0.00 H new ATOM 0 HG22 THR B 75 -3.184 -1.183 13.749 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.405 -1.242 13.759 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.626 -0.508 11.111 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.814 -1.314 10.926 1.00 0.00 C ATOM 2670 C PHE B 76 -5.799 -1.998 9.565 1.00 0.00 C ATOM 2671 O PHE B 76 -6.148 -3.166 9.481 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.081 -0.480 11.098 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.335 -1.329 11.003 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.891 -1.626 9.743 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.845 -1.961 12.153 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -9.979 -2.504 9.640 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.903 -2.880 12.042 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.468 -3.155 10.785 1.00 0.00 C ATOM 0 H PHE B 76 -4.815 0.488 11.220 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.815 -2.085 11.696 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.056 0.023 12.065 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.110 0.297 10.334 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.477 -1.175 8.853 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.423 -1.739 13.122 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.442 -2.680 8.680 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.282 -3.375 12.924 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.277 -3.866 10.699 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.397 -1.315 8.490 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.227 -1.988 7.206 1.00 0.00 C ATOM 2690 C LEU B 77 -4.226 -3.141 7.345 1.00 0.00 C ATOM 2691 O LEU B 77 -4.417 -4.197 6.746 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.860 -0.993 6.094 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.061 -0.126 5.673 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.603 1.010 4.757 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.114 -0.930 4.900 1.00 0.00 C ATOM 0 H LEU B 77 -5.188 -0.317 8.484 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.178 -2.426 6.903 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.051 -0.348 6.437 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.487 -1.539 5.228 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.498 0.257 6.595 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.463 1.614 4.468 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.882 1.635 5.285 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.137 0.592 3.865 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.941 -0.276 4.625 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.665 -1.346 3.998 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.485 -1.740 5.527 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.200 -2.983 8.183 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.332 -4.087 8.571 1.00 0.00 C ATOM 2709 C GLY B 78 -3.127 -5.222 9.217 1.00 0.00 C ATOM 2710 O GLY B 78 -3.021 -6.375 8.801 1.00 0.00 O ATOM 0 H GLY B 78 -2.951 -2.090 8.608 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.805 -4.463 7.694 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.575 -3.729 9.268 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.949 -4.912 10.221 1.00 0.00 N ATOM 2715 CA ALA B 79 -4.821 -5.907 10.839 1.00 0.00 C ATOM 2716 C ALA B 79 -5.704 -6.594 9.789 1.00 0.00 C ATOM 2717 O ALA B 79 -5.865 -7.811 9.802 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.667 -5.275 11.949 1.00 0.00 C ATOM 0 H ALA B 79 -4.028 -3.978 10.623 1.00 0.00 H new ATOM 0 HA ALA B 79 -4.192 -6.673 11.293 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -6.309 -6.035 12.395 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -5.011 -4.859 12.714 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -6.284 -4.480 11.529 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.260 -5.822 8.858 1.00 0.00 N ATOM 2725 CA LEU B 80 -7.101 -6.312 7.779 1.00 0.00 C ATOM 2726 C LEU B 80 -6.304 -7.276 6.900 1.00 0.00 C ATOM 2727 O LEU B 80 -6.780 -8.357 6.564 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.655 -5.120 6.982 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.958 -5.434 6.234 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -10.137 -5.651 7.192 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.300 -4.254 5.319 1.00 0.00 C ATOM 0 H LEU B 80 -6.132 -4.810 8.837 1.00 0.00 H new ATOM 0 HA LEU B 80 -7.950 -6.865 8.182 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.829 -4.287 7.663 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.903 -4.793 6.264 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.801 -6.352 5.668 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -11.037 -5.870 6.618 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.917 -6.487 7.856 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.295 -4.750 7.784 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.225 -4.466 4.782 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.427 -3.353 5.919 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.492 -4.102 4.604 1.00 0.00 H new ATOM 2743 N ALA B 81 -5.067 -6.905 6.563 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.147 -7.768 5.842 1.00 0.00 C ATOM 2745 C ALA B 81 -3.916 -9.075 6.607 1.00 0.00 C ATOM 2746 O ALA B 81 -3.955 -10.149 6.016 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.840 -7.032 5.570 1.00 0.00 C ATOM 0 H ALA B 81 -4.679 -5.989 6.787 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.588 -8.031 4.881 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.158 -7.689 5.029 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.040 -6.144 4.971 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.385 -6.736 6.516 1.00 0.00 H new ATOM 2753 N MET B 82 -3.693 -8.996 7.923 1.00 0.00 N ATOM 2754 CA MET B 82 -3.553 -10.182 8.760 1.00 0.00 C ATOM 2755 C MET B 82 -4.822 -11.039 8.727 1.00 0.00 C ATOM 2756 O MET B 82 -4.731 -12.261 8.631 1.00 0.00 O ATOM 2757 CB MET B 82 -3.136 -9.783 10.185 1.00 0.00 C ATOM 2758 CG MET B 82 -3.009 -10.989 11.127 1.00 0.00 C ATOM 2759 SD MET B 82 -1.803 -12.255 10.646 1.00 0.00 S ATOM 2760 CE MET B 82 -2.155 -13.498 11.906 1.00 0.00 C ATOM 0 H MET B 82 -3.606 -8.115 8.430 1.00 0.00 H new ATOM 0 HA MET B 82 -2.757 -10.807 8.356 1.00 0.00 H new ATOM 0 HB2 MET B 82 -2.182 -9.256 10.146 1.00 0.00 H new ATOM 0 HB3 MET B 82 -3.869 -9.086 10.591 1.00 0.00 H new ATOM 0 HG2 MET B 82 -2.745 -10.623 12.119 1.00 0.00 H new ATOM 0 HG3 MET B 82 -3.987 -11.462 11.212 1.00 0.00 H new ATOM 0 HE1 MET B 82 -1.499 -14.357 11.763 1.00 0.00 H new ATOM 0 HE2 MET B 82 -1.985 -13.072 12.895 1.00 0.00 H new ATOM 0 HE3 MET B 82 -3.194 -13.817 11.822 1.00 0.00 H new ATOM 2770 N ILE B 83 -5.999 -10.412 8.808 1.00 0.00 N ATOM 2771 CA ILE B 83 -7.276 -11.109 8.691 1.00 0.00 C ATOM 2772 C ILE B 83 -7.341 -11.815 7.333 1.00 0.00 C ATOM 2773 O ILE B 83 -7.703 -12.988 7.268 1.00 0.00 O ATOM 2774 CB ILE B 83 -8.453 -10.147 8.954 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -8.480 -9.781 10.451 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -9.793 -10.778 8.544 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -9.358 -8.564 10.760 1.00 0.00 C ATOM 0 H ILE B 83 -6.090 -9.407 8.957 1.00 0.00 H new ATOM 0 HA ILE B 83 -7.360 -11.880 9.457 1.00 0.00 H new ATOM 0 HB ILE B 83 -8.310 -9.249 8.352 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -8.843 -10.636 11.021 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -7.463 -9.582 10.788 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -10.602 -10.075 8.742 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -9.772 -11.017 7.481 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -9.956 -11.690 9.118 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -9.333 -8.360 11.830 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -8.982 -7.697 10.217 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -10.384 -8.768 10.453 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.931 -11.141 6.255 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.738 -11.759 4.947 1.00 0.00 C ATOM 2791 C TYR B 84 -5.470 -12.626 4.958 1.00 0.00 C ATOM 2792 O TYR B 84 -4.595 -12.466 4.110 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.632 -10.675 3.860 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.734 -9.633 3.788 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -9.058 -9.937 4.160 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.436 -8.367 3.247 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -10.074 -8.978 3.999 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.455 -7.415 3.074 1.00 0.00 C ATOM 2799 CZ TYR B 84 -9.773 -7.722 3.447 1.00 0.00 C ATOM 2800 OH TYR B 84 -10.755 -6.790 3.285 1.00 0.00 O ATOM 0 H TYR B 84 -6.723 -10.143 6.269 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.596 -12.393 4.725 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.686 -10.152 4.000 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.580 -11.175 2.893 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -9.293 -10.908 4.570 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.422 -8.127 2.964 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -11.086 -9.207 4.300 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -8.224 -6.447 2.654 1.00 0.00 H new ATOM 0 HH TYR B 84 -10.373 -5.978 2.891 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.362 -13.568 5.898 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.128 -14.300 6.152 1.00 0.00 C ATOM 2812 C ASN B 85 -3.598 -15.015 4.906 1.00 0.00 C ATOM 2813 O ASN B 85 -2.387 -15.118 4.712 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.317 -15.281 7.311 1.00 0.00 C ATOM 2815 CG ASN B 85 -2.962 -15.812 7.759 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -2.627 -16.961 7.494 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -2.174 -14.976 8.431 1.00 0.00 N ATOM 0 H ASN B 85 -6.134 -13.843 6.505 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.372 -13.566 6.431 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -4.817 -14.785 8.143 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -4.958 -16.107 7.001 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -1.254 -15.284 8.746 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -2.490 -14.027 8.631 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.504 -15.470 4.034 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.148 -16.035 2.742 1.00 0.00 C ATOM 2826 C GLU B 86 -3.224 -15.102 1.949 1.00 0.00 C ATOM 2827 O GLU B 86 -2.278 -15.574 1.328 1.00 0.00 O ATOM 2828 CB GLU B 86 -5.397 -16.443 1.939 1.00 0.00 C ATOM 2829 CG GLU B 86 -6.463 -15.349 1.735 1.00 0.00 C ATOM 2830 CD GLU B 86 -7.543 -15.361 2.814 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -7.215 -14.966 3.953 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -8.677 -15.770 2.483 1.00 0.00 O ATOM 0 H GLU B 86 -5.508 -15.454 4.212 1.00 0.00 H new ATOM 0 HA GLU B 86 -3.582 -16.948 2.929 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -5.074 -16.794 0.959 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.866 -17.289 2.442 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -5.977 -14.373 1.726 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -6.930 -15.482 0.759 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.462 -13.788 1.987 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.603 -12.804 1.340 1.00 0.00 C ATOM 2841 C ALA B 87 -1.206 -12.832 1.952 1.00 0.00 C ATOM 2842 O ALA B 87 -0.216 -12.708 1.236 1.00 0.00 O ATOM 2843 CB ALA B 87 -3.216 -11.405 1.458 1.00 0.00 C ATOM 0 H ALA B 87 -4.261 -13.379 2.471 1.00 0.00 H new ATOM 0 HA ALA B 87 -2.519 -13.056 0.283 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -2.564 -10.680 0.971 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.194 -11.395 0.977 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.326 -11.144 2.510 1.00 0.00 H new ATOM 2849 N LEU B 88 -1.119 -12.983 3.278 1.00 0.00 N ATOM 2850 CA LEU B 88 0.167 -13.051 3.950 1.00 0.00 C ATOM 2851 C LEU B 88 0.920 -14.303 3.508 1.00 0.00 C ATOM 2852 O LEU B 88 2.073 -14.223 3.096 1.00 0.00 O ATOM 2853 CB LEU B 88 0.023 -13.020 5.476 1.00 0.00 C ATOM 2854 CG LEU B 88 -0.679 -11.796 6.089 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -0.172 -11.636 7.528 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -0.442 -10.489 5.334 1.00 0.00 C ATOM 0 H LEU B 88 -1.925 -13.059 3.898 1.00 0.00 H new ATOM 0 HA LEU B 88 0.737 -12.167 3.665 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -0.523 -13.912 5.782 1.00 0.00 H new ATOM 0 HB3 LEU B 88 1.020 -13.092 5.911 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.752 -11.983 6.037 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -0.653 -10.774 7.990 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -0.410 -12.533 8.099 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.908 -11.487 7.519 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.973 -9.679 5.834 1.00 0.00 H new ATOM 0 HD22 LEU B 88 0.625 -10.267 5.316 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -0.809 -10.587 4.312 1.00 0.00 H new ATOM 2868 N LYS B 89 0.274 -15.465 3.615 1.00 0.00 N ATOM 2869 CA LYS B 89 0.931 -16.728 3.302 1.00 0.00 C ATOM 2870 C LYS B 89 1.235 -16.861 1.805 1.00 0.00 C ATOM 2871 O LYS B 89 2.275 -17.401 1.433 1.00 0.00 O ATOM 2872 CB LYS B 89 0.107 -17.901 3.844 1.00 0.00 C ATOM 2873 CG LYS B 89 0.137 -17.894 5.380 1.00 0.00 C ATOM 2874 CD LYS B 89 -0.488 -19.172 5.951 1.00 0.00 C ATOM 2875 CE LYS B 89 -0.025 -19.429 7.391 1.00 0.00 C ATOM 2876 NZ LYS B 89 -0.293 -18.281 8.275 1.00 0.00 N ATOM 0 H LYS B 89 -0.697 -15.555 3.914 1.00 0.00 H new ATOM 0 HA LYS B 89 1.899 -16.746 3.802 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -0.922 -17.828 3.491 1.00 0.00 H new ATOM 0 HB3 LYS B 89 0.507 -18.843 3.468 1.00 0.00 H new ATOM 0 HG2 LYS B 89 1.167 -17.803 5.726 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -0.403 -17.024 5.753 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -1.575 -19.089 5.926 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -0.219 -20.022 5.324 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -0.531 -20.312 7.781 1.00 0.00 H new ATOM 0 HE3 LYS B 89 1.043 -19.646 7.394 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 -0.205 -18.579 9.267 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 0.393 -17.524 8.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 -1.256 -17.928 8.103 1.00 0.00 H new ATOM 2890 N GLY B 90 0.340 -16.375 0.944 1.00 0.00 N ATOM 2891 CA GLY B 90 0.526 -16.392 -0.497 1.00 0.00 C ATOM 2892 C GLY B 90 -0.767 -15.996 -1.207 1.00 0.00 C ATOM 2893 O GLY B 90 -0.939 -14.782 -1.450 1.00 0.00 O ATOM 2894 OXT GLY B 90 -1.558 -16.918 -1.504 1.00 0.00 O ATOM 0 H GLY B 90 -0.542 -15.955 1.237 1.00 0.00 H new ATOM 0 HA2 GLY B 90 1.326 -15.705 -0.775 1.00 0.00 H new ATOM 0 HA3 GLY B 90 0.834 -17.387 -0.818 1.00 0.00 H new