USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1045 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 120 CYS SG : rot -132:sc= -5.75! USER MOD Set 1.2: A 127 CYS SG : rot -46:sc= -6.47! USER MOD Set 2.1: A 83 THR OG1 : rot -35:sc= 0.808 USER MOD Set 2.2: A 98 GLN : amide:sc= -0.0176 X(o=0.79,f=0.79) USER MOD Set 3.1: A 76 THR OG1 : rot 47:sc= 2.06 USER MOD Set 3.2: A 82 LYS NZ :NH3+ 174:sc= 2.25 (180deg=1.14) USER MOD Set 4.1: A 61 LYS NZ :NH3+ 171:sc= 1.26 (180deg=0.466) USER MOD Set 4.2: A 63 THR OG1 : rot 180:sc= 0.521 USER MOD Set 5.1: A 43 CYS SG : rot 101:sc= -0.774 USER MOD Set 5.2: A 56 THR OG1 : rot 180:sc= 0.347 USER MOD Set 6.1: A 22 TYR OH : rot -17:sc= 1.07 USER MOD Set 6.2: A 105 SER OG : rot 15:sc= 2.31 USER MOD Single : A 5 GLN : amide:sc= 0.398 X(o=0.4,f=0) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 16 SER OG : rot 51:sc= 0.788 USER MOD Single : A 17 LYS NZ :NH3+ -159:sc= 1.08 (180deg=0.511) USER MOD Single : A 23 MET CE :methyl -170:sc= 0 (180deg=-0.223) USER MOD Single : A 24 LYS NZ :NH3+ -130:sc= 1.14 (180deg=-0.456) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 179:sc= 1.1 (180deg=1.1) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 CYS SG : rot 38:sc= -0.38 USER MOD Single : A 50 LYS NZ :NH3+ -133:sc= 1.29 (180deg=-0.158) USER MOD Single : A 51 ASN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot -160:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -162:sc= 1.01 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot 21:sc= 0.595 USER MOD Single : A 67 CYS SG : rot -128:sc= -0.255 USER MOD Single : A 68 THR OG1 : rot 73:sc= 0.772 USER MOD Single : A 72 LYS NZ :NH3+ -173:sc= 1.11 (180deg=1) USER MOD Single : A 77 THR OG1 : rot -73:sc= -0.0763 USER MOD Single : A 84 GLN : amide:sc= -0.0705 X(o=-0.07,f=-0.07) USER MOD Single : A 85 THR OG1 : rot -145:sc= 0.91 USER MOD Single : A 87 CYS SG : rot 74:sc= -0.499 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 90 THR OG1 : rot -94:sc= 1.02 USER MOD Single : A 96 GLN : amide:sc= 0.603 K(o=0.6,f=-4.8!) USER MOD Single : A 97 HIS : +bothHN:sc= 1.15 K(o=1.1,f=-7.9!) USER MOD Single : A 103 LYS NZ :NH3+ -97:sc= 0.376 (180deg=-0.0448) USER MOD Single : A 106 THR OG1 : rot 20:sc= 0.428! USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 165:sc= 1.18 (180deg=0.805) USER MOD Single : A 112 LYS NZ :NH3+ 150:sc= 1.28 (180deg=1.07) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl -170:sc= 0 (180deg=-0.155) USER MOD Single : A 123 ASN : amide:sc= 1.64 K(o=1.6,f=-5.1!) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 178:sc= 2.04 (180deg=1.92) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 -0.344 -1.571 -2.373 1.00 0.00 N ATOM 15 CA VAL A 4 0.984 -1.586 -3.067 1.00 0.00 C ATOM 16 C VAL A 4 2.022 -2.705 -2.689 1.00 0.00 C ATOM 17 O VAL A 4 2.533 -3.380 -3.589 1.00 0.00 O ATOM 18 CB VAL A 4 1.538 -0.150 -3.374 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.212 0.559 -2.179 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.511 -0.133 -4.574 1.00 0.00 C ATOM 0 HA VAL A 4 0.739 -1.997 -4.046 1.00 0.00 H new ATOM 0 HB VAL A 4 0.637 0.412 -3.618 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.562 1.543 -2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.492 0.669 -1.368 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.059 -0.035 -1.834 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.864 0.885 -4.742 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.361 -0.781 -4.362 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.996 -0.490 -5.465 1.00 0.00 H new ATOM 30 N GLN A 5 2.307 -2.950 -1.396 1.00 0.00 N ATOM 31 CA GLN A 5 3.217 -4.050 -0.943 1.00 0.00 C ATOM 32 C GLN A 5 2.547 -5.479 -0.922 1.00 0.00 C ATOM 33 O GLN A 5 2.498 -6.181 0.092 1.00 0.00 O ATOM 34 CB GLN A 5 3.824 -3.597 0.414 1.00 0.00 C ATOM 35 CG GLN A 5 5.035 -4.443 0.911 1.00 0.00 C ATOM 36 CD GLN A 5 4.907 -5.001 2.333 1.00 0.00 C ATOM 37 OE1 GLN A 5 5.459 -4.482 3.296 1.00 0.00 O ATOM 38 NE2 GLN A 5 4.177 -6.077 2.505 1.00 0.00 N ATOM 0 H GLN A 5 1.921 -2.400 -0.629 1.00 0.00 H new ATOM 0 HA GLN A 5 4.015 -4.200 -1.670 1.00 0.00 H new ATOM 0 HB2 GLN A 5 4.139 -2.557 0.325 1.00 0.00 H new ATOM 0 HB3 GLN A 5 3.042 -3.629 1.173 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.181 -5.276 0.224 1.00 0.00 H new ATOM 0 HG3 GLN A 5 5.933 -3.827 0.860 1.00 0.00 H new ATOM 0 HE21 GLN A 5 3.715 -6.513 1.707 1.00 0.00 H new ATOM 0 HE22 GLN A 5 4.071 -6.478 3.437 1.00 0.00 H new ATOM 47 N GLN A 6 2.058 -5.887 -2.098 1.00 0.00 N ATOM 48 CA GLN A 6 1.525 -7.249 -2.399 1.00 0.00 C ATOM 49 C GLN A 6 1.778 -7.640 -3.900 1.00 0.00 C ATOM 50 O GLN A 6 2.122 -8.789 -4.183 1.00 0.00 O ATOM 51 CB GLN A 6 0.010 -7.364 -2.064 1.00 0.00 C ATOM 52 CG GLN A 6 -0.357 -7.435 -0.561 1.00 0.00 C ATOM 53 CD GLN A 6 -1.835 -7.722 -0.260 1.00 0.00 C ATOM 54 OE1 GLN A 6 -2.708 -7.800 -1.120 1.00 0.00 O ATOM 55 NE2 GLN A 6 -2.170 -7.871 0.998 1.00 0.00 N ATOM 0 H GLN A 6 2.014 -5.266 -2.906 1.00 0.00 H new ATOM 0 HA GLN A 6 2.066 -7.948 -1.761 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.503 -6.507 -2.501 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.382 -8.255 -2.554 1.00 0.00 H new ATOM 0 HG2 GLN A 6 0.249 -8.210 -0.092 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -0.085 -6.489 -0.092 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -1.458 -7.809 1.726 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -3.143 -8.049 1.249 1.00 0.00 H new ATOM 64 N LEU A 7 1.612 -6.702 -4.863 1.00 0.00 N ATOM 65 CA LEU A 7 2.032 -6.880 -6.287 1.00 0.00 C ATOM 66 C LEU A 7 3.580 -7.000 -6.580 1.00 0.00 C ATOM 67 O LEU A 7 3.956 -7.242 -7.728 1.00 0.00 O ATOM 68 CB LEU A 7 1.458 -5.701 -7.140 1.00 0.00 C ATOM 69 CG LEU A 7 0.004 -5.184 -6.941 1.00 0.00 C ATOM 70 CD1 LEU A 7 -0.267 -4.005 -7.886 1.00 0.00 C ATOM 71 CD2 LEU A 7 -1.073 -6.254 -7.160 1.00 0.00 C ATOM 0 H LEU A 7 1.182 -5.795 -4.680 1.00 0.00 H new ATOM 0 HA LEU A 7 1.626 -7.855 -6.558 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.120 -4.849 -6.988 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.549 -5.993 -8.186 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.062 -4.876 -5.898 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.287 -3.649 -7.740 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.433 -3.198 -7.671 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.140 -4.330 -8.919 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.059 -5.816 -7.003 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -1.004 -6.637 -8.178 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.923 -7.071 -6.455 1.00 0.00 H new ATOM 83 N GLU A 8 4.464 -6.815 -5.583 1.00 0.00 N ATOM 84 CA GLU A 8 5.926 -7.045 -5.697 1.00 0.00 C ATOM 85 C GLU A 8 6.382 -8.538 -5.876 1.00 0.00 C ATOM 86 O GLU A 8 5.602 -9.475 -5.680 1.00 0.00 O ATOM 87 CB GLU A 8 6.601 -6.356 -4.471 1.00 0.00 C ATOM 88 CG GLU A 8 6.171 -6.633 -3.000 1.00 0.00 C ATOM 89 CD GLU A 8 5.819 -8.056 -2.582 1.00 0.00 C ATOM 90 OE1 GLU A 8 6.696 -8.938 -2.671 1.00 0.00 O ATOM 91 OE2 GLU A 8 4.677 -8.296 -2.142 1.00 0.00 O ATOM 0 H GLU A 8 4.183 -6.496 -4.656 1.00 0.00 H new ATOM 0 HA GLU A 8 6.255 -6.601 -6.637 1.00 0.00 H new ATOM 0 HB2 GLU A 8 7.664 -6.589 -4.532 1.00 0.00 H new ATOM 0 HB3 GLU A 8 6.501 -5.282 -4.626 1.00 0.00 H new ATOM 0 HG2 GLU A 8 6.979 -6.292 -2.353 1.00 0.00 H new ATOM 0 HG3 GLU A 8 5.305 -6.005 -2.788 1.00 0.00 H new ATOM 98 N GLY A 9 7.654 -8.758 -6.259 1.00 0.00 N ATOM 99 CA GLY A 9 8.232 -10.125 -6.393 1.00 0.00 C ATOM 100 C GLY A 9 8.622 -10.535 -7.826 1.00 0.00 C ATOM 101 O GLY A 9 8.453 -9.790 -8.793 1.00 0.00 O ATOM 0 H GLY A 9 8.309 -8.009 -6.484 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.117 -10.192 -5.760 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.510 -10.846 -6.010 1.00 0.00 H new ATOM 105 N ARG A 10 9.147 -11.759 -7.950 1.00 0.00 N ATOM 106 CA ARG A 10 9.457 -12.384 -9.266 1.00 0.00 C ATOM 107 C ARG A 10 8.257 -13.269 -9.723 1.00 0.00 C ATOM 108 O ARG A 10 7.860 -14.210 -9.037 1.00 0.00 O ATOM 109 CB ARG A 10 10.781 -13.156 -9.069 1.00 0.00 C ATOM 110 CG ARG A 10 11.460 -13.758 -10.323 1.00 0.00 C ATOM 111 CD ARG A 10 12.543 -14.828 -10.025 1.00 0.00 C ATOM 112 NE ARG A 10 13.553 -14.410 -8.992 1.00 0.00 N ATOM 113 CZ ARG A 10 13.467 -14.675 -7.682 1.00 0.00 C ATOM 114 NH1 ARG A 10 12.657 -15.553 -7.171 1.00 0.00 N ATOM 115 NH2 ARG A 10 14.208 -14.025 -6.835 1.00 0.00 N ATOM 0 H ARG A 10 9.373 -12.352 -7.152 1.00 0.00 H new ATOM 0 HA ARG A 10 9.592 -11.660 -10.069 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.494 -12.482 -8.593 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.593 -13.969 -8.367 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.693 -14.204 -10.956 1.00 0.00 H new ATOM 0 HG3 ARG A 10 11.915 -12.950 -10.896 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.053 -15.742 -9.689 1.00 0.00 H new ATOM 0 HD3 ARG A 10 13.065 -15.069 -10.951 1.00 0.00 H new ATOM 0 HE ARG A 10 14.366 -13.884 -9.314 1.00 0.00 H new ATOM 0 HH11 ARG A 10 12.037 -16.089 -7.778 1.00 0.00 H new ATOM 0 HH12 ARG A 10 12.641 -15.707 -6.163 1.00 0.00 H new ATOM 0 HH21 ARG A 10 14.857 -13.311 -7.168 1.00 0.00 H new ATOM 0 HH22 ARG A 10 14.141 -14.228 -5.838 1.00 0.00 H new ATOM 129 N TRP A 11 7.643 -12.934 -10.860 1.00 0.00 N ATOM 130 CA TRP A 11 6.305 -13.464 -11.235 1.00 0.00 C ATOM 131 C TRP A 11 6.388 -14.271 -12.555 1.00 0.00 C ATOM 132 O TRP A 11 6.560 -13.688 -13.629 1.00 0.00 O ATOM 133 CB TRP A 11 5.343 -12.260 -11.392 1.00 0.00 C ATOM 134 CG TRP A 11 4.932 -11.564 -10.102 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.410 -10.311 -9.693 1.00 0.00 C ATOM 136 CD2 TRP A 11 4.027 -11.960 -9.136 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.771 -9.879 -8.527 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.938 -10.918 -8.183 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.281 -13.153 -8.963 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.101 -11.051 -7.056 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.464 -13.265 -7.839 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.375 -12.232 -6.898 1.00 0.00 C ATOM 0 H TRP A 11 8.043 -12.296 -11.548 1.00 0.00 H new ATOM 0 HA TRP A 11 5.939 -14.140 -10.462 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.815 -11.525 -12.044 1.00 0.00 H new ATOM 0 HB3 TRP A 11 4.442 -12.604 -11.900 1.00 0.00 H new ATOM 0 HD1 TRP A 11 6.174 -9.751 -10.212 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.895 -8.991 -8.040 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.344 -13.955 -9.684 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 3.023 -10.255 -6.330 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.888 -14.167 -7.691 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.735 -12.351 -6.037 1.00 0.00 H new ATOM 153 N ARG A 12 6.226 -15.599 -12.498 1.00 0.00 N ATOM 154 CA ARG A 12 6.336 -16.464 -13.701 1.00 0.00 C ATOM 155 C ARG A 12 4.943 -16.840 -14.289 1.00 0.00 C ATOM 156 O ARG A 12 4.068 -17.341 -13.578 1.00 0.00 O ATOM 157 CB ARG A 12 7.176 -17.684 -13.286 1.00 0.00 C ATOM 158 CG ARG A 12 7.545 -18.635 -14.449 1.00 0.00 C ATOM 159 CD ARG A 12 8.321 -19.874 -13.982 1.00 0.00 C ATOM 160 NE ARG A 12 9.660 -19.475 -13.474 1.00 0.00 N ATOM 161 CZ ARG A 12 10.138 -19.695 -12.256 1.00 0.00 C ATOM 162 NH1 ARG A 12 9.518 -20.356 -11.305 1.00 0.00 N ATOM 163 NH2 ARG A 12 11.300 -19.175 -12.002 1.00 0.00 N ATOM 0 H ARG A 12 6.018 -16.106 -11.638 1.00 0.00 H new ATOM 0 HA ARG A 12 6.828 -15.937 -14.519 1.00 0.00 H new ATOM 0 HB2 ARG A 12 8.094 -17.334 -12.815 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.626 -18.248 -12.533 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.634 -18.953 -14.955 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.143 -18.092 -15.180 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.764 -20.388 -13.198 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.431 -20.577 -14.808 1.00 0.00 H new ATOM 0 HE ARG A 12 10.271 -18.984 -14.126 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.592 -20.748 -11.477 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.963 -20.477 -10.395 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.786 -18.637 -12.719 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.727 -19.305 -11.085 1.00 0.00 H new ATOM 177 N LEU A 13 4.756 -16.647 -15.607 1.00 0.00 N ATOM 178 CA LEU A 13 3.482 -16.999 -16.302 1.00 0.00 C ATOM 179 C LEU A 13 3.211 -18.541 -16.358 1.00 0.00 C ATOM 180 O LEU A 13 4.044 -19.314 -16.841 1.00 0.00 O ATOM 181 CB LEU A 13 3.529 -16.359 -17.718 1.00 0.00 C ATOM 182 CG LEU A 13 2.285 -16.524 -18.634 1.00 0.00 C ATOM 183 CD1 LEU A 13 1.005 -15.938 -18.014 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.548 -15.865 -20.000 1.00 0.00 C ATOM 0 H LEU A 13 5.466 -16.249 -16.222 1.00 0.00 H new ATOM 0 HA LEU A 13 2.642 -16.601 -15.733 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.715 -15.292 -17.596 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.389 -16.774 -18.244 1.00 0.00 H new ATOM 0 HG LEU A 13 2.122 -17.595 -18.757 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.170 -16.083 -18.699 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.793 -16.443 -17.072 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.144 -14.872 -17.831 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.671 -15.985 -20.637 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.751 -14.804 -19.859 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.408 -16.339 -20.473 1.00 0.00 H new ATOM 196 N VAL A 14 2.028 -18.964 -15.886 1.00 0.00 N ATOM 197 CA VAL A 14 1.607 -20.403 -15.882 1.00 0.00 C ATOM 198 C VAL A 14 0.367 -20.681 -16.797 1.00 0.00 C ATOM 199 O VAL A 14 0.439 -21.569 -17.651 1.00 0.00 O ATOM 200 CB VAL A 14 1.489 -20.997 -14.431 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.873 -21.249 -13.793 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.629 -20.189 -13.428 1.00 0.00 C ATOM 0 H VAL A 14 1.328 -18.334 -15.495 1.00 0.00 H new ATOM 0 HA VAL A 14 2.418 -20.963 -16.347 1.00 0.00 H new ATOM 0 HB VAL A 14 0.960 -21.934 -14.606 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.743 -21.659 -12.792 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.432 -21.957 -14.405 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.422 -20.309 -13.732 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.622 -20.696 -12.463 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.050 -19.190 -13.310 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.391 -20.111 -13.804 1.00 0.00 H new ATOM 212 N ASP A 15 -0.751 -19.948 -16.635 1.00 0.00 N ATOM 213 CA ASP A 15 -1.971 -20.100 -17.476 1.00 0.00 C ATOM 214 C ASP A 15 -2.221 -18.765 -18.252 1.00 0.00 C ATOM 215 O ASP A 15 -2.454 -17.718 -17.638 1.00 0.00 O ATOM 216 CB ASP A 15 -3.114 -20.507 -16.508 1.00 0.00 C ATOM 217 CG ASP A 15 -4.500 -20.717 -17.109 1.00 0.00 C ATOM 218 OD1 ASP A 15 -5.083 -19.760 -17.668 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.085 -21.806 -16.939 1.00 0.00 O ATOM 0 H ASP A 15 -0.842 -19.229 -15.917 1.00 0.00 H new ATOM 0 HA ASP A 15 -1.885 -20.869 -18.244 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -2.820 -21.430 -16.008 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.193 -19.739 -15.738 1.00 0.00 H new ATOM 224 N SER A 16 -2.185 -18.802 -19.597 1.00 0.00 N ATOM 225 CA SER A 16 -2.501 -17.615 -20.447 1.00 0.00 C ATOM 226 C SER A 16 -3.812 -17.788 -21.281 1.00 0.00 C ATOM 227 O SER A 16 -3.771 -17.864 -22.517 1.00 0.00 O ATOM 228 CB SER A 16 -1.256 -17.278 -21.309 1.00 0.00 C ATOM 229 OG SER A 16 -1.098 -18.186 -22.400 1.00 0.00 O ATOM 0 H SER A 16 -1.941 -19.637 -20.129 1.00 0.00 H new ATOM 0 HA SER A 16 -2.718 -16.763 -19.803 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.346 -16.262 -21.693 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.364 -17.305 -20.683 1.00 0.00 H new ATOM 0 HG SER A 16 -1.941 -18.251 -22.896 1.00 0.00 H new ATOM 235 N LYS A 17 -4.980 -17.823 -20.613 1.00 0.00 N ATOM 236 CA LYS A 17 -6.290 -18.026 -21.295 1.00 0.00 C ATOM 237 C LYS A 17 -6.835 -16.720 -21.968 1.00 0.00 C ATOM 238 O LYS A 17 -6.957 -15.672 -21.325 1.00 0.00 O ATOM 239 CB LYS A 17 -7.291 -18.718 -20.332 1.00 0.00 C ATOM 240 CG LYS A 17 -7.704 -17.967 -19.039 1.00 0.00 C ATOM 241 CD LYS A 17 -8.858 -18.617 -18.244 1.00 0.00 C ATOM 242 CE LYS A 17 -8.680 -20.088 -17.816 1.00 0.00 C ATOM 243 NZ LYS A 17 -7.554 -20.267 -16.862 1.00 0.00 N ATOM 0 H LYS A 17 -5.052 -17.714 -19.601 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.142 -18.704 -22.135 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.199 -18.935 -20.895 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.862 -19.676 -20.038 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -6.833 -17.890 -18.388 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -7.994 -16.950 -19.305 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.026 -18.022 -17.346 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.764 -18.548 -18.846 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.602 -20.444 -17.357 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.506 -20.702 -18.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.242 -21.259 -16.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -6.763 -19.652 -17.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.868 -20.016 -15.903 1.00 0.00 H new ATOM 257 N GLY A 18 -7.114 -16.786 -23.284 1.00 0.00 N ATOM 258 CA GLY A 18 -7.420 -15.574 -24.101 1.00 0.00 C ATOM 259 C GLY A 18 -6.247 -14.796 -24.758 1.00 0.00 C ATOM 260 O GLY A 18 -6.502 -13.822 -25.468 1.00 0.00 O ATOM 0 H GLY A 18 -7.136 -17.659 -23.812 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.101 -15.876 -24.896 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.963 -14.876 -23.464 1.00 0.00 H new ATOM 264 N PHE A 19 -4.971 -15.178 -24.556 1.00 0.00 N ATOM 265 CA PHE A 19 -3.817 -14.380 -25.061 1.00 0.00 C ATOM 266 C PHE A 19 -3.628 -14.338 -26.614 1.00 0.00 C ATOM 267 O PHE A 19 -3.316 -13.260 -27.125 1.00 0.00 O ATOM 268 CB PHE A 19 -2.549 -14.741 -24.236 1.00 0.00 C ATOM 269 CG PHE A 19 -1.339 -13.791 -24.391 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.475 -12.404 -24.229 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.079 -14.320 -24.690 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.382 -11.562 -24.415 1.00 0.00 C ATOM 273 CE2 PHE A 19 1.015 -13.476 -24.863 1.00 0.00 C ATOM 274 CZ PHE A 19 0.862 -12.099 -24.736 1.00 0.00 C ATOM 0 H PHE A 19 -4.706 -16.025 -24.053 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.047 -13.329 -24.886 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.825 -14.775 -23.182 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.233 -15.746 -24.516 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.434 -11.987 -23.958 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.046 -15.388 -24.787 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.499 -10.493 -24.310 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.984 -13.891 -25.096 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.709 -11.446 -24.887 1.00 0.00 H new ATOM 284 N ASP A 20 -3.868 -15.428 -27.375 1.00 0.00 N ATOM 285 CA ASP A 20 -3.860 -15.369 -28.866 1.00 0.00 C ATOM 286 C ASP A 20 -4.948 -14.433 -29.499 1.00 0.00 C ATOM 287 O ASP A 20 -4.581 -13.615 -30.345 1.00 0.00 O ATOM 288 CB ASP A 20 -3.820 -16.803 -29.456 1.00 0.00 C ATOM 289 CG ASP A 20 -3.421 -16.842 -30.933 1.00 0.00 C ATOM 290 OD1 ASP A 20 -2.287 -16.454 -31.271 1.00 0.00 O ATOM 291 OD2 ASP A 20 -4.248 -17.221 -31.791 1.00 0.00 O ATOM 0 H ASP A 20 -4.068 -16.353 -26.994 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.939 -14.866 -29.161 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.116 -17.405 -28.881 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -4.801 -17.263 -29.340 1.00 0.00 H new ATOM 296 N GLU A 21 -6.247 -14.484 -29.107 1.00 0.00 N ATOM 297 CA GLU A 21 -7.235 -13.413 -29.478 1.00 0.00 C ATOM 298 C GLU A 21 -6.778 -11.935 -29.216 1.00 0.00 C ATOM 299 O GLU A 21 -6.825 -11.111 -30.134 1.00 0.00 O ATOM 300 CB GLU A 21 -8.672 -13.711 -28.951 1.00 0.00 C ATOM 301 CG GLU A 21 -8.924 -13.663 -27.417 1.00 0.00 C ATOM 302 CD GLU A 21 -10.380 -13.571 -26.979 1.00 0.00 C ATOM 303 OE1 GLU A 21 -11.122 -14.555 -27.170 1.00 0.00 O ATOM 304 OE2 GLU A 21 -10.773 -12.528 -26.404 1.00 0.00 O ATOM 0 H GLU A 21 -6.639 -15.238 -28.543 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.274 -13.469 -30.566 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.352 -13.000 -29.421 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.955 -14.703 -29.303 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.487 -14.556 -26.970 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.388 -12.806 -27.008 1.00 0.00 H new ATOM 311 N TYR A 22 -6.263 -11.635 -28.009 1.00 0.00 N ATOM 312 CA TYR A 22 -5.609 -10.335 -27.694 1.00 0.00 C ATOM 313 C TYR A 22 -4.371 -9.964 -28.585 1.00 0.00 C ATOM 314 O TYR A 22 -4.299 -8.832 -29.069 1.00 0.00 O ATOM 315 CB TYR A 22 -5.333 -10.362 -26.163 1.00 0.00 C ATOM 316 CG TYR A 22 -4.875 -9.025 -25.569 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.778 -7.962 -25.454 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.542 -8.841 -25.186 1.00 0.00 C ATOM 319 CE1 TYR A 22 -5.339 -6.719 -25.007 1.00 0.00 C ATOM 320 CE2 TYR A 22 -3.114 -7.600 -24.720 1.00 0.00 C ATOM 321 CZ TYR A 22 -4.003 -6.532 -24.663 1.00 0.00 C ATOM 322 OH TYR A 22 -3.541 -5.288 -24.326 1.00 0.00 O ATOM 0 H TYR A 22 -6.285 -12.281 -27.220 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.273 -9.510 -27.952 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.241 -10.680 -25.650 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.571 -11.114 -25.958 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.817 -8.106 -25.712 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.844 -9.662 -25.252 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -6.036 -5.898 -24.927 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -2.090 -7.467 -24.403 1.00 0.00 H new ATOM 0 HH TYR A 22 -4.178 -4.609 -24.631 1.00 0.00 H new ATOM 332 N MET A 23 -3.443 -10.902 -28.854 1.00 0.00 N ATOM 333 CA MET A 23 -2.374 -10.717 -29.876 1.00 0.00 C ATOM 334 C MET A 23 -2.874 -10.499 -31.352 1.00 0.00 C ATOM 335 O MET A 23 -2.384 -9.579 -32.013 1.00 0.00 O ATOM 336 CB MET A 23 -1.344 -11.872 -29.757 1.00 0.00 C ATOM 337 CG MET A 23 -0.498 -11.905 -28.464 1.00 0.00 C ATOM 338 SD MET A 23 0.867 -13.078 -28.612 1.00 0.00 S ATOM 339 CE MET A 23 0.001 -14.648 -28.445 1.00 0.00 C ATOM 0 H MET A 23 -3.405 -11.804 -28.379 1.00 0.00 H new ATOM 0 HA MET A 23 -1.891 -9.767 -29.647 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.880 -12.818 -29.840 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.666 -11.814 -30.608 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.106 -10.909 -28.257 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.129 -12.181 -27.619 1.00 0.00 H new ATOM 0 HE1 MET A 23 0.727 -15.454 -28.338 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.641 -14.618 -27.564 1.00 0.00 H new ATOM 0 HE3 MET A 23 -0.608 -14.824 -29.332 1.00 0.00 H new ATOM 349 N LYS A 24 -3.869 -11.252 -31.872 1.00 0.00 N ATOM 350 CA LYS A 24 -4.601 -10.860 -33.123 1.00 0.00 C ATOM 351 C LYS A 24 -5.207 -9.408 -33.115 1.00 0.00 C ATOM 352 O LYS A 24 -4.930 -8.647 -34.045 1.00 0.00 O ATOM 353 CB LYS A 24 -5.690 -11.915 -33.489 1.00 0.00 C ATOM 354 CG LYS A 24 -5.220 -13.184 -34.256 1.00 0.00 C ATOM 355 CD LYS A 24 -5.265 -14.499 -33.457 1.00 0.00 C ATOM 356 CE LYS A 24 -6.676 -15.028 -33.139 1.00 0.00 C ATOM 357 NZ LYS A 24 -6.592 -16.036 -32.048 1.00 0.00 N ATOM 0 H LYS A 24 -4.190 -12.128 -31.459 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.835 -10.841 -33.899 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.172 -12.237 -32.566 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.452 -11.419 -34.091 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.839 -13.299 -35.146 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.198 -13.022 -34.598 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.726 -15.263 -34.016 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.729 -14.353 -32.519 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.326 -14.206 -32.840 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.118 -15.476 -34.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.108 -16.895 -32.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.595 -16.273 -31.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.014 -15.646 -31.181 1.00 0.00 H new ATOM 371 N GLU A 25 -5.985 -9.019 -32.083 1.00 0.00 N ATOM 372 CA GLU A 25 -6.587 -7.654 -31.977 1.00 0.00 C ATOM 373 C GLU A 25 -5.576 -6.462 -31.773 1.00 0.00 C ATOM 374 O GLU A 25 -5.757 -5.399 -32.372 1.00 0.00 O ATOM 375 CB GLU A 25 -7.685 -7.724 -30.881 1.00 0.00 C ATOM 376 CG GLU A 25 -8.779 -6.624 -30.957 1.00 0.00 C ATOM 377 CD GLU A 25 -9.925 -6.818 -31.947 1.00 0.00 C ATOM 378 OE1 GLU A 25 -9.899 -7.741 -32.787 1.00 0.00 O ATOM 379 OE2 GLU A 25 -10.877 -6.014 -31.865 1.00 0.00 O ATOM 0 H GLU A 25 -6.218 -9.630 -31.300 1.00 0.00 H new ATOM 0 HA GLU A 25 -7.014 -7.398 -32.947 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -8.170 -8.698 -30.939 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.203 -7.666 -29.905 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.212 -6.515 -29.963 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.288 -5.681 -31.196 1.00 0.00 H new ATOM 386 N LEU A 26 -4.487 -6.636 -30.992 1.00 0.00 N ATOM 387 CA LEU A 26 -3.285 -5.742 -31.047 1.00 0.00 C ATOM 388 C LEU A 26 -2.578 -5.569 -32.442 1.00 0.00 C ATOM 389 O LEU A 26 -2.062 -4.485 -32.736 1.00 0.00 O ATOM 390 CB LEU A 26 -2.227 -6.266 -30.024 1.00 0.00 C ATOM 391 CG LEU A 26 -2.470 -6.022 -28.513 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.382 -6.737 -27.694 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.473 -4.528 -28.152 1.00 0.00 C ATOM 0 H LEU A 26 -4.406 -7.389 -30.309 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.676 -4.752 -30.812 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -2.127 -7.341 -30.173 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.268 -5.817 -30.281 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.456 -6.422 -28.276 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.554 -6.565 -26.632 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.417 -7.807 -27.898 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.403 -6.347 -27.971 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.647 -4.413 -27.082 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.510 -4.089 -28.412 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.264 -4.022 -28.705 1.00 0.00 H new ATOM 405 N GLY A 27 -2.492 -6.643 -33.243 1.00 0.00 N ATOM 406 CA GLY A 27 -1.715 -6.675 -34.510 1.00 0.00 C ATOM 407 C GLY A 27 -0.337 -7.358 -34.389 1.00 0.00 C ATOM 408 O GLY A 27 0.694 -6.726 -34.630 1.00 0.00 O ATOM 0 H GLY A 27 -2.961 -7.525 -33.035 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.300 -7.194 -35.269 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.572 -5.653 -34.861 1.00 0.00 H new ATOM 412 N VAL A 28 -0.344 -8.648 -34.028 1.00 0.00 N ATOM 413 CA VAL A 28 0.888 -9.455 -33.786 1.00 0.00 C ATOM 414 C VAL A 28 0.998 -10.514 -34.935 1.00 0.00 C ATOM 415 O VAL A 28 0.087 -11.328 -35.139 1.00 0.00 O ATOM 416 CB VAL A 28 0.822 -10.135 -32.370 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.064 -10.981 -32.011 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.632 -9.179 -31.169 1.00 0.00 C ATOM 0 H VAL A 28 -1.205 -9.177 -33.891 1.00 0.00 H new ATOM 0 HA VAL A 28 1.776 -8.823 -33.792 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.066 -10.753 -32.503 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.935 -11.413 -31.019 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.184 -11.780 -32.742 1.00 0.00 H new ATOM 0 HG13 VAL A 28 2.951 -10.347 -32.018 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.601 -9.757 -30.245 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.464 -8.475 -31.129 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.302 -8.630 -31.285 1.00 0.00 H new ATOM 428 N GLY A 29 2.139 -10.547 -35.649 1.00 0.00 N ATOM 429 CA GLY A 29 2.405 -11.593 -36.679 1.00 0.00 C ATOM 430 C GLY A 29 2.619 -13.037 -36.154 1.00 0.00 C ATOM 431 O GLY A 29 2.908 -13.257 -34.977 1.00 0.00 O ATOM 0 H GLY A 29 2.893 -9.869 -35.539 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.570 -11.604 -37.379 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.290 -11.300 -37.244 1.00 0.00 H new ATOM 435 N ILE A 30 2.495 -14.034 -37.044 1.00 0.00 N ATOM 436 CA ILE A 30 2.479 -15.488 -36.670 1.00 0.00 C ATOM 437 C ILE A 30 3.739 -16.012 -35.883 1.00 0.00 C ATOM 438 O ILE A 30 3.579 -16.712 -34.878 1.00 0.00 O ATOM 439 CB ILE A 30 2.122 -16.391 -37.912 1.00 0.00 C ATOM 440 CG1 ILE A 30 1.030 -15.841 -38.890 1.00 0.00 C ATOM 441 CG2 ILE A 30 1.693 -17.814 -37.466 1.00 0.00 C ATOM 442 CD1 ILE A 30 1.585 -15.043 -40.086 1.00 0.00 C ATOM 0 H ILE A 30 2.402 -13.872 -38.047 1.00 0.00 H new ATOM 0 HA ILE A 30 1.679 -15.574 -35.934 1.00 0.00 H new ATOM 0 HB ILE A 30 3.055 -16.400 -38.475 1.00 0.00 H new ATOM 0 HG12 ILE A 30 0.445 -16.679 -39.269 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.347 -15.203 -38.329 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.453 -18.414 -38.344 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.509 -18.285 -36.917 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.816 -17.745 -36.823 1.00 0.00 H new ATOM 0 HD11 ILE A 30 0.759 -14.701 -40.710 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.145 -14.182 -39.721 1.00 0.00 H new ATOM 0 HD13 ILE A 30 2.244 -15.681 -40.675 1.00 0.00 H new ATOM 454 N ALA A 31 4.969 -15.654 -36.302 1.00 0.00 N ATOM 455 CA ALA A 31 6.200 -15.876 -35.489 1.00 0.00 C ATOM 456 C ALA A 31 6.240 -15.205 -34.070 1.00 0.00 C ATOM 457 O ALA A 31 6.614 -15.860 -33.095 1.00 0.00 O ATOM 458 CB ALA A 31 7.391 -15.450 -36.368 1.00 0.00 C ATOM 0 H ALA A 31 5.145 -15.207 -37.202 1.00 0.00 H new ATOM 0 HA ALA A 31 6.233 -16.933 -35.226 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.320 -15.594 -35.816 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.410 -16.056 -37.274 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.287 -14.399 -36.636 1.00 0.00 H new ATOM 464 N LEU A 32 5.818 -13.934 -33.954 1.00 0.00 N ATOM 465 CA LEU A 32 5.618 -13.241 -32.645 1.00 0.00 C ATOM 466 C LEU A 32 4.438 -13.793 -31.763 1.00 0.00 C ATOM 467 O LEU A 32 4.602 -13.902 -30.546 1.00 0.00 O ATOM 468 CB LEU A 32 5.495 -11.714 -32.921 1.00 0.00 C ATOM 469 CG LEU A 32 6.749 -11.001 -33.505 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.368 -9.647 -34.122 1.00 0.00 C ATOM 471 CD2 LEU A 32 7.846 -10.795 -32.445 1.00 0.00 C ATOM 0 H LEU A 32 5.602 -13.347 -34.760 1.00 0.00 H new ATOM 0 HA LEU A 32 6.491 -13.450 -32.027 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.665 -11.560 -33.611 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.229 -11.221 -31.986 1.00 0.00 H new ATOM 0 HG LEU A 32 7.149 -11.654 -34.281 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.260 -9.166 -34.524 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.647 -9.803 -34.924 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.926 -9.010 -33.356 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.701 -10.294 -32.899 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.456 -10.182 -31.632 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.159 -11.763 -32.052 1.00 0.00 H new ATOM 483 N ARG A 33 3.290 -14.196 -32.351 1.00 0.00 N ATOM 484 CA ARG A 33 2.241 -15.014 -31.664 1.00 0.00 C ATOM 485 C ARG A 33 2.745 -16.385 -31.101 1.00 0.00 C ATOM 486 O ARG A 33 2.533 -16.671 -29.921 1.00 0.00 O ATOM 487 CB ARG A 33 1.032 -15.213 -32.624 1.00 0.00 C ATOM 488 CG ARG A 33 0.072 -14.003 -32.753 1.00 0.00 C ATOM 489 CD ARG A 33 -1.048 -14.088 -33.809 1.00 0.00 C ATOM 490 NE ARG A 33 -1.865 -15.322 -33.635 1.00 0.00 N ATOM 491 CZ ARG A 33 -2.086 -16.260 -34.548 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.753 -16.145 -35.808 1.00 0.00 N ATOM 493 NH2 ARG A 33 -2.683 -17.348 -34.157 1.00 0.00 N ATOM 0 H ARG A 33 3.055 -13.968 -33.317 1.00 0.00 H new ATOM 0 HA ARG A 33 1.938 -14.450 -30.782 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.415 -15.457 -33.615 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.458 -16.074 -32.282 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -0.394 -13.840 -31.781 1.00 0.00 H new ATOM 0 HG3 ARG A 33 0.673 -13.120 -32.971 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.690 -13.211 -33.732 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.611 -14.077 -34.807 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.298 -15.460 -32.722 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.295 -15.296 -36.139 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.952 -16.904 -36.459 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.962 -17.454 -33.182 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.872 -18.094 -34.826 1.00 0.00 H new ATOM 507 N LYS A 34 3.455 -17.194 -31.913 1.00 0.00 N ATOM 508 CA LYS A 34 4.254 -18.352 -31.426 1.00 0.00 C ATOM 509 C LYS A 34 5.261 -18.029 -30.265 1.00 0.00 C ATOM 510 O LYS A 34 5.190 -18.688 -29.227 1.00 0.00 O ATOM 511 CB LYS A 34 4.898 -18.977 -32.687 1.00 0.00 C ATOM 512 CG LYS A 34 5.663 -20.295 -32.435 1.00 0.00 C ATOM 513 CD LYS A 34 6.188 -20.969 -33.718 1.00 0.00 C ATOM 514 CE LYS A 34 7.332 -20.201 -34.413 1.00 0.00 C ATOM 515 NZ LYS A 34 7.821 -20.981 -35.583 1.00 0.00 N ATOM 0 H LYS A 34 3.495 -17.069 -32.924 1.00 0.00 H new ATOM 0 HA LYS A 34 3.607 -19.072 -30.926 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.116 -19.162 -33.424 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.584 -18.252 -33.125 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.504 -20.094 -31.772 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.006 -20.991 -31.914 1.00 0.00 H new ATOM 0 HD2 LYS A 34 6.536 -21.972 -33.472 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.362 -21.082 -34.420 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.981 -19.222 -34.738 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.148 -20.030 -33.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.592 -20.461 -36.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.172 -21.906 -35.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.041 -21.122 -36.257 1.00 0.00 H new ATOM 529 N MET A 35 6.135 -17.009 -30.412 1.00 0.00 N ATOM 530 CA MET A 35 6.988 -16.477 -29.306 1.00 0.00 C ATOM 531 C MET A 35 6.219 -16.091 -27.993 1.00 0.00 C ATOM 532 O MET A 35 6.534 -16.648 -26.941 1.00 0.00 O ATOM 533 CB MET A 35 7.824 -15.303 -29.888 1.00 0.00 C ATOM 534 CG MET A 35 8.986 -14.825 -28.996 1.00 0.00 C ATOM 535 SD MET A 35 9.753 -13.338 -29.678 1.00 0.00 S ATOM 536 CE MET A 35 8.673 -12.054 -29.011 1.00 0.00 C ATOM 0 H MET A 35 6.275 -16.525 -31.299 1.00 0.00 H new ATOM 0 HA MET A 35 7.639 -17.280 -28.960 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.229 -15.609 -30.853 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.158 -14.460 -30.074 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.618 -14.621 -27.991 1.00 0.00 H new ATOM 0 HG3 MET A 35 9.731 -15.616 -28.908 1.00 0.00 H new ATOM 0 HE1 MET A 35 9.020 -11.077 -29.346 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.654 -12.217 -29.362 1.00 0.00 H new ATOM 0 HE3 MET A 35 8.692 -12.092 -27.922 1.00 0.00 H new ATOM 546 N GLY A 36 5.204 -15.204 -28.050 1.00 0.00 N ATOM 547 CA GLY A 36 4.312 -14.908 -26.891 1.00 0.00 C ATOM 548 C GLY A 36 3.545 -16.077 -26.222 1.00 0.00 C ATOM 549 O GLY A 36 3.482 -16.131 -24.993 1.00 0.00 O ATOM 0 H GLY A 36 4.974 -14.673 -28.890 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.918 -14.428 -26.122 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.575 -14.175 -27.220 1.00 0.00 H new ATOM 553 N ALA A 37 2.974 -17.002 -27.010 1.00 0.00 N ATOM 554 CA ALA A 37 2.400 -18.270 -26.488 1.00 0.00 C ATOM 555 C ALA A 37 3.410 -19.278 -25.839 1.00 0.00 C ATOM 556 O ALA A 37 3.114 -19.801 -24.761 1.00 0.00 O ATOM 557 CB ALA A 37 1.607 -18.898 -27.650 1.00 0.00 C ATOM 0 H ALA A 37 2.893 -16.901 -28.022 1.00 0.00 H new ATOM 0 HA ALA A 37 1.765 -18.027 -25.636 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.161 -19.837 -27.321 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.820 -18.213 -27.965 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.278 -19.089 -28.487 1.00 0.00 H new ATOM 563 N MET A 38 4.580 -19.563 -26.454 1.00 0.00 N ATOM 564 CA MET A 38 5.620 -20.443 -25.834 1.00 0.00 C ATOM 565 C MET A 38 6.509 -19.817 -24.698 1.00 0.00 C ATOM 566 O MET A 38 6.946 -20.562 -23.812 1.00 0.00 O ATOM 567 CB MET A 38 6.419 -21.179 -26.947 1.00 0.00 C ATOM 568 CG MET A 38 7.547 -20.397 -27.650 1.00 0.00 C ATOM 569 SD MET A 38 8.199 -21.337 -29.046 1.00 0.00 S ATOM 570 CE MET A 38 9.495 -22.302 -28.246 1.00 0.00 C ATOM 0 H MET A 38 4.835 -19.203 -27.374 1.00 0.00 H new ATOM 0 HA MET A 38 5.068 -21.179 -25.249 1.00 0.00 H new ATOM 0 HB2 MET A 38 6.855 -22.078 -26.510 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.711 -21.506 -27.709 1.00 0.00 H new ATOM 0 HG2 MET A 38 7.168 -19.436 -27.997 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.348 -20.187 -26.941 1.00 0.00 H new ATOM 0 HE1 MET A 38 9.988 -22.933 -28.986 1.00 0.00 H new ATOM 0 HE2 MET A 38 10.226 -21.629 -27.798 1.00 0.00 H new ATOM 0 HE3 MET A 38 9.056 -22.929 -27.470 1.00 0.00 H new ATOM 580 N ALA A 39 6.772 -18.494 -24.710 1.00 0.00 N ATOM 581 CA ALA A 39 7.522 -17.783 -23.644 1.00 0.00 C ATOM 582 C ALA A 39 6.712 -17.598 -22.320 1.00 0.00 C ATOM 583 O ALA A 39 5.647 -16.971 -22.300 1.00 0.00 O ATOM 584 CB ALA A 39 7.912 -16.397 -24.199 1.00 0.00 C ATOM 0 H ALA A 39 6.468 -17.880 -25.466 1.00 0.00 H new ATOM 0 HA ALA A 39 8.390 -18.389 -23.384 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.466 -15.844 -23.441 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.535 -16.522 -25.085 1.00 0.00 H new ATOM 0 HB3 ALA A 39 7.011 -15.844 -24.464 1.00 0.00 H new ATOM 590 N LYS A 40 7.260 -18.097 -21.204 1.00 0.00 N ATOM 591 CA LYS A 40 6.720 -17.834 -19.839 1.00 0.00 C ATOM 592 C LYS A 40 7.720 -16.888 -19.088 1.00 0.00 C ATOM 593 O LYS A 40 8.666 -17.412 -18.489 1.00 0.00 O ATOM 594 CB LYS A 40 6.332 -19.126 -19.040 1.00 0.00 C ATOM 595 CG LYS A 40 7.104 -20.453 -19.270 1.00 0.00 C ATOM 596 CD LYS A 40 6.510 -21.258 -20.448 1.00 0.00 C ATOM 597 CE LYS A 40 7.399 -22.418 -20.926 1.00 0.00 C ATOM 598 NZ LYS A 40 6.838 -22.907 -22.213 1.00 0.00 N ATOM 0 H LYS A 40 8.087 -18.694 -21.208 1.00 0.00 H new ATOM 0 HA LYS A 40 5.760 -17.327 -19.932 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.413 -18.886 -17.980 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.280 -19.326 -19.242 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.153 -20.235 -19.470 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.071 -21.056 -18.363 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.540 -21.656 -20.150 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.333 -20.581 -21.284 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.428 -22.084 -21.058 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.416 -23.218 -20.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 7.427 -23.684 -22.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 5.868 -23.250 -22.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 6.826 -22.130 -22.904 1.00 0.00 H new ATOM 612 N PRO A 41 7.590 -15.523 -19.095 1.00 0.00 N ATOM 613 CA PRO A 41 8.606 -14.624 -18.482 1.00 0.00 C ATOM 614 C PRO A 41 8.573 -14.556 -16.922 1.00 0.00 C ATOM 615 O PRO A 41 7.499 -14.525 -16.314 1.00 0.00 O ATOM 616 CB PRO A 41 8.272 -13.268 -19.138 1.00 0.00 C ATOM 617 CG PRO A 41 6.776 -13.330 -19.449 1.00 0.00 C ATOM 618 CD PRO A 41 6.563 -14.785 -19.865 1.00 0.00 C ATOM 0 HA PRO A 41 9.622 -14.976 -18.661 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.501 -12.439 -18.468 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.857 -13.115 -20.045 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.173 -13.068 -18.579 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.502 -12.639 -20.247 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.557 -15.128 -19.622 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.695 -14.918 -20.939 1.00 0.00 H new ATOM 626 N ASP A 42 9.765 -14.469 -16.309 1.00 0.00 N ATOM 627 CA ASP A 42 9.918 -14.196 -14.852 1.00 0.00 C ATOM 628 C ASP A 42 9.965 -12.650 -14.618 1.00 0.00 C ATOM 629 O ASP A 42 10.982 -11.984 -14.842 1.00 0.00 O ATOM 630 CB ASP A 42 11.186 -14.920 -14.309 1.00 0.00 C ATOM 631 CG ASP A 42 10.919 -16.254 -13.614 1.00 0.00 C ATOM 632 OD1 ASP A 42 10.445 -16.246 -12.460 1.00 0.00 O ATOM 633 OD2 ASP A 42 11.222 -17.331 -14.179 1.00 0.00 O ATOM 0 H ASP A 42 10.652 -14.584 -16.798 1.00 0.00 H new ATOM 0 HA ASP A 42 9.064 -14.588 -14.300 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.872 -15.090 -15.139 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.692 -14.257 -13.608 1.00 0.00 H new ATOM 638 N CYS A 43 8.832 -12.074 -14.191 1.00 0.00 N ATOM 639 CA CYS A 43 8.666 -10.611 -14.065 1.00 0.00 C ATOM 640 C CYS A 43 8.976 -10.092 -12.639 1.00 0.00 C ATOM 641 O CYS A 43 8.177 -10.237 -11.712 1.00 0.00 O ATOM 642 CB CYS A 43 7.263 -10.257 -14.595 1.00 0.00 C ATOM 643 SG CYS A 43 6.924 -8.477 -14.384 1.00 0.00 S ATOM 0 H CYS A 43 8.003 -12.605 -13.923 1.00 0.00 H new ATOM 0 HA CYS A 43 9.404 -10.086 -14.672 1.00 0.00 H new ATOM 0 HB2 CYS A 43 7.189 -10.524 -15.649 1.00 0.00 H new ATOM 0 HB3 CYS A 43 6.511 -10.841 -14.065 1.00 0.00 H new ATOM 0 HG CYS A 43 7.106 -7.864 -15.516 1.00 0.00 H new ATOM 649 N ILE A 44 10.148 -9.456 -12.491 1.00 0.00 N ATOM 650 CA ILE A 44 10.605 -8.852 -11.211 1.00 0.00 C ATOM 651 C ILE A 44 9.918 -7.454 -11.060 1.00 0.00 C ATOM 652 O ILE A 44 10.276 -6.484 -11.740 1.00 0.00 O ATOM 653 CB ILE A 44 12.176 -8.790 -11.150 1.00 0.00 C ATOM 654 CG1 ILE A 44 12.906 -10.155 -11.353 1.00 0.00 C ATOM 655 CG2 ILE A 44 12.661 -8.147 -9.822 1.00 0.00 C ATOM 656 CD1 ILE A 44 14.351 -10.025 -11.870 1.00 0.00 C ATOM 0 H ILE A 44 10.815 -9.341 -13.254 1.00 0.00 H new ATOM 0 HA ILE A 44 10.310 -9.468 -10.362 1.00 0.00 H new ATOM 0 HB ILE A 44 12.448 -8.169 -12.003 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.918 -10.693 -10.405 1.00 0.00 H new ATOM 0 HG13 ILE A 44 12.333 -10.760 -12.056 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.751 -8.118 -9.809 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.270 -7.133 -9.745 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.304 -8.739 -8.979 1.00 0.00 H new ATOM 0 HD11 ILE A 44 14.787 -11.017 -11.984 1.00 0.00 H new ATOM 0 HD12 ILE A 44 14.348 -9.517 -12.834 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.942 -9.449 -11.158 1.00 0.00 H new ATOM 668 N ILE A 45 8.932 -7.373 -10.157 1.00 0.00 N ATOM 669 CA ILE A 45 8.194 -6.115 -9.862 1.00 0.00 C ATOM 670 C ILE A 45 8.743 -5.585 -8.499 1.00 0.00 C ATOM 671 O ILE A 45 8.605 -6.241 -7.460 1.00 0.00 O ATOM 672 CB ILE A 45 6.636 -6.322 -9.899 1.00 0.00 C ATOM 673 CG1 ILE A 45 6.144 -6.915 -11.258 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.886 -4.998 -9.579 1.00 0.00 C ATOM 675 CD1 ILE A 45 4.635 -7.176 -11.400 1.00 0.00 C ATOM 0 H ILE A 45 8.616 -8.171 -9.605 1.00 0.00 H new ATOM 0 HA ILE A 45 8.364 -5.361 -10.631 1.00 0.00 H new ATOM 0 HB ILE A 45 6.402 -7.052 -9.124 1.00 0.00 H new ATOM 0 HG12 ILE A 45 6.447 -6.235 -12.054 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.668 -7.856 -11.427 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.810 -5.172 -9.612 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.167 -4.652 -8.584 1.00 0.00 H new ATOM 0 HG23 ILE A 45 6.154 -4.241 -10.316 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.428 -7.587 -12.388 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.315 -7.886 -10.638 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.091 -6.240 -11.275 1.00 0.00 H new ATOM 687 N THR A 46 9.352 -4.390 -8.508 1.00 0.00 N ATOM 688 CA THR A 46 9.805 -3.702 -7.262 1.00 0.00 C ATOM 689 C THR A 46 9.074 -2.331 -7.123 1.00 0.00 C ATOM 690 O THR A 46 9.113 -1.500 -8.041 1.00 0.00 O ATOM 691 CB THR A 46 11.359 -3.644 -7.183 1.00 0.00 C ATOM 692 OG1 THR A 46 11.748 -3.103 -5.928 1.00 0.00 O ATOM 693 CG2 THR A 46 12.113 -2.839 -8.252 1.00 0.00 C ATOM 0 H THR A 46 9.549 -3.868 -9.362 1.00 0.00 H new ATOM 0 HA THR A 46 9.519 -4.279 -6.383 1.00 0.00 H new ATOM 0 HB THR A 46 11.639 -4.685 -7.347 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.726 -3.067 -5.876 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.185 -2.895 -8.061 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.898 -3.252 -9.237 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.792 -1.798 -8.217 1.00 0.00 H new ATOM 701 N CYS A 47 8.389 -2.110 -5.983 1.00 0.00 N ATOM 702 CA CYS A 47 7.548 -0.901 -5.786 1.00 0.00 C ATOM 703 C CYS A 47 8.006 -0.039 -4.568 1.00 0.00 C ATOM 704 O CYS A 47 7.701 -0.341 -3.410 1.00 0.00 O ATOM 705 CB CYS A 47 6.094 -1.408 -5.704 1.00 0.00 C ATOM 706 SG CYS A 47 5.882 -2.600 -4.334 1.00 0.00 S ATOM 0 H CYS A 47 8.398 -2.746 -5.186 1.00 0.00 H new ATOM 0 HA CYS A 47 7.647 -0.202 -6.616 1.00 0.00 H new ATOM 0 HB2 CYS A 47 5.420 -0.564 -5.562 1.00 0.00 H new ATOM 0 HB3 CYS A 47 5.818 -1.881 -6.646 1.00 0.00 H new ATOM 0 HG CYS A 47 6.593 -2.220 -3.314 1.00 0.00 H new ATOM 712 N ASP A 48 8.703 1.079 -4.842 1.00 0.00 N ATOM 713 CA ASP A 48 9.048 2.108 -3.818 1.00 0.00 C ATOM 714 C ASP A 48 7.873 3.140 -3.631 1.00 0.00 C ATOM 715 O ASP A 48 7.965 4.310 -4.018 1.00 0.00 O ATOM 716 CB ASP A 48 10.428 2.668 -4.272 1.00 0.00 C ATOM 717 CG ASP A 48 10.968 3.879 -3.510 1.00 0.00 C ATOM 718 OD1 ASP A 48 11.266 3.752 -2.304 1.00 0.00 O ATOM 719 OD2 ASP A 48 11.086 4.965 -4.125 1.00 0.00 O ATOM 0 H ASP A 48 9.047 1.303 -5.776 1.00 0.00 H new ATOM 0 HA ASP A 48 9.155 1.724 -2.804 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.161 1.865 -4.196 1.00 0.00 H new ATOM 0 HB3 ASP A 48 10.355 2.935 -5.326 1.00 0.00 H new ATOM 724 N GLY A 49 6.743 2.682 -3.045 1.00 0.00 N ATOM 725 CA GLY A 49 5.541 3.526 -2.781 1.00 0.00 C ATOM 726 C GLY A 49 4.834 4.157 -4.007 1.00 0.00 C ATOM 727 O GLY A 49 3.868 3.612 -4.541 1.00 0.00 O ATOM 0 H GLY A 49 6.633 1.715 -2.739 1.00 0.00 H new ATOM 0 HA2 GLY A 49 4.812 2.917 -2.247 1.00 0.00 H new ATOM 0 HA3 GLY A 49 5.836 4.332 -2.109 1.00 0.00 H new ATOM 731 N LYS A 50 5.351 5.317 -4.428 1.00 0.00 N ATOM 732 CA LYS A 50 5.023 5.936 -5.747 1.00 0.00 C ATOM 733 C LYS A 50 5.877 5.457 -6.975 1.00 0.00 C ATOM 734 O LYS A 50 5.408 5.623 -8.103 1.00 0.00 O ATOM 735 CB LYS A 50 5.149 7.481 -5.592 1.00 0.00 C ATOM 736 CG LYS A 50 4.058 8.195 -4.751 1.00 0.00 C ATOM 737 CD LYS A 50 2.642 8.280 -5.367 1.00 0.00 C ATOM 738 CE LYS A 50 2.573 9.093 -6.675 1.00 0.00 C ATOM 739 NZ LYS A 50 1.163 9.269 -7.110 1.00 0.00 N ATOM 0 H LYS A 50 6.010 5.864 -3.874 1.00 0.00 H new ATOM 0 HA LYS A 50 4.011 5.610 -5.988 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.119 7.699 -5.144 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.152 7.923 -6.589 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.980 7.683 -3.792 1.00 0.00 H new ATOM 0 HG3 LYS A 50 4.399 9.209 -4.544 1.00 0.00 H new ATOM 0 HD2 LYS A 50 2.280 7.270 -5.560 1.00 0.00 H new ATOM 0 HD3 LYS A 50 1.966 8.727 -4.638 1.00 0.00 H new ATOM 0 HE2 LYS A 50 3.038 10.068 -6.528 1.00 0.00 H new ATOM 0 HE3 LYS A 50 3.139 8.584 -7.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 1.082 9.050 -8.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.550 8.628 -6.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 0.869 10.253 -6.944 1.00 0.00 H new ATOM 753 N ASN A 51 7.104 4.932 -6.792 1.00 0.00 N ATOM 754 CA ASN A 51 8.069 4.669 -7.899 1.00 0.00 C ATOM 755 C ASN A 51 8.095 3.142 -8.233 1.00 0.00 C ATOM 756 O ASN A 51 8.610 2.340 -7.446 1.00 0.00 O ATOM 757 CB ASN A 51 9.480 5.166 -7.466 1.00 0.00 C ATOM 758 CG ASN A 51 9.620 6.650 -7.100 1.00 0.00 C ATOM 759 OD1 ASN A 51 9.246 7.542 -7.852 1.00 0.00 O ATOM 760 ND2 ASN A 51 10.151 6.964 -5.940 1.00 0.00 N ATOM 0 H ASN A 51 7.463 4.675 -5.873 1.00 0.00 H new ATOM 0 HA ASN A 51 7.762 5.205 -8.797 1.00 0.00 H new ATOM 0 HB2 ASN A 51 9.797 4.575 -6.607 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.177 4.951 -8.276 1.00 0.00 H new ATOM 0 HD21 ASN A 51 10.249 7.943 -5.672 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.465 6.228 -5.307 1.00 0.00 H new ATOM 767 N LEU A 52 7.530 2.718 -9.379 1.00 0.00 N ATOM 768 CA LEU A 52 7.312 1.272 -9.677 1.00 0.00 C ATOM 769 C LEU A 52 8.126 0.812 -10.928 1.00 0.00 C ATOM 770 O LEU A 52 8.011 1.384 -12.018 1.00 0.00 O ATOM 771 CB LEU A 52 5.774 1.059 -9.753 1.00 0.00 C ATOM 772 CG LEU A 52 5.289 -0.415 -9.853 1.00 0.00 C ATOM 773 CD1 LEU A 52 3.956 -0.619 -9.112 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.116 -0.844 -11.316 1.00 0.00 C ATOM 0 H LEU A 52 7.214 3.346 -10.118 1.00 0.00 H new ATOM 0 HA LEU A 52 7.701 0.623 -8.892 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.322 1.509 -8.869 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.395 1.604 -10.618 1.00 0.00 H new ATOM 0 HG LEU A 52 6.056 -1.031 -9.384 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.645 -1.660 -9.202 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.083 -0.368 -8.059 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.194 0.026 -9.550 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.776 -1.879 -11.354 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.379 -0.202 -11.799 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.070 -0.756 -11.836 1.00 0.00 H new ATOM 786 N THR A 53 8.943 -0.248 -10.762 1.00 0.00 N ATOM 787 CA THR A 53 9.749 -0.847 -11.869 1.00 0.00 C ATOM 788 C THR A 53 9.247 -2.289 -12.195 1.00 0.00 C ATOM 789 O THR A 53 9.193 -3.156 -11.317 1.00 0.00 O ATOM 790 CB THR A 53 11.262 -0.793 -11.502 1.00 0.00 C ATOM 791 OG1 THR A 53 11.651 0.553 -11.249 1.00 0.00 O ATOM 792 CG2 THR A 53 12.215 -1.307 -12.594 1.00 0.00 C ATOM 0 H THR A 53 9.069 -0.718 -9.865 1.00 0.00 H new ATOM 0 HA THR A 53 9.618 -0.266 -12.782 1.00 0.00 H new ATOM 0 HB THR A 53 11.351 -1.445 -10.633 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.603 0.580 -11.017 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.245 -1.229 -12.245 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.985 -2.349 -12.816 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.092 -0.708 -13.496 1.00 0.00 H new ATOM 800 N ILE A 54 8.917 -2.537 -13.476 1.00 0.00 N ATOM 801 CA ILE A 54 8.521 -3.884 -13.988 1.00 0.00 C ATOM 802 C ILE A 54 9.682 -4.386 -14.913 1.00 0.00 C ATOM 803 O ILE A 54 9.883 -3.890 -16.028 1.00 0.00 O ATOM 804 CB ILE A 54 7.101 -3.799 -14.663 1.00 0.00 C ATOM 805 CG1 ILE A 54 5.961 -3.617 -13.612 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.753 -5.008 -15.570 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.627 -3.062 -14.140 1.00 0.00 C ATOM 0 H ILE A 54 8.914 -1.814 -14.196 1.00 0.00 H new ATOM 0 HA ILE A 54 8.400 -4.625 -13.198 1.00 0.00 H new ATOM 0 HB ILE A 54 7.166 -2.917 -15.299 1.00 0.00 H new ATOM 0 HG12 ILE A 54 5.769 -4.583 -13.146 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.322 -2.951 -12.828 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.759 -4.870 -15.995 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.485 -5.082 -16.375 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.771 -5.923 -14.979 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.916 -2.981 -13.318 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.790 -2.077 -14.577 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.228 -3.734 -14.900 1.00 0.00 H new ATOM 819 N LYS A 55 10.427 -5.396 -14.438 1.00 0.00 N ATOM 820 CA LYS A 55 11.526 -6.053 -15.202 1.00 0.00 C ATOM 821 C LYS A 55 11.060 -7.477 -15.657 1.00 0.00 C ATOM 822 O LYS A 55 11.239 -8.473 -14.951 1.00 0.00 O ATOM 823 CB LYS A 55 12.775 -5.980 -14.281 1.00 0.00 C ATOM 824 CG LYS A 55 14.061 -6.669 -14.791 1.00 0.00 C ATOM 825 CD LYS A 55 15.259 -6.462 -13.838 1.00 0.00 C ATOM 826 CE LYS A 55 16.507 -7.225 -14.321 1.00 0.00 C ATOM 827 NZ LYS A 55 17.648 -7.006 -13.394 1.00 0.00 N ATOM 0 H LYS A 55 10.291 -5.791 -13.507 1.00 0.00 H new ATOM 0 HA LYS A 55 11.792 -5.567 -16.141 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.002 -4.929 -14.100 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.513 -6.420 -13.319 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.875 -7.736 -14.910 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.313 -6.278 -15.777 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.487 -5.399 -13.766 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.991 -6.799 -12.837 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.285 -8.290 -14.387 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.777 -6.893 -15.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.479 -7.528 -13.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.871 -5.991 -13.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.394 -7.345 -12.444 1.00 0.00 H new ATOM 841 N THR A 56 10.434 -7.545 -16.845 1.00 0.00 N ATOM 842 CA THR A 56 9.864 -8.804 -17.421 1.00 0.00 C ATOM 843 C THR A 56 10.963 -9.613 -18.178 1.00 0.00 C ATOM 844 O THR A 56 11.320 -9.230 -19.295 1.00 0.00 O ATOM 845 CB THR A 56 8.620 -8.434 -18.293 1.00 0.00 C ATOM 846 OG1 THR A 56 7.637 -7.757 -17.510 1.00 0.00 O ATOM 847 CG2 THR A 56 7.885 -9.628 -18.917 1.00 0.00 C ATOM 0 H THR A 56 10.302 -6.731 -17.446 1.00 0.00 H new ATOM 0 HA THR A 56 9.518 -9.473 -16.633 1.00 0.00 H new ATOM 0 HB THR A 56 9.043 -7.820 -19.088 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.867 -7.533 -18.074 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.038 -9.269 -19.502 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.568 -10.177 -19.566 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.526 -10.288 -18.127 1.00 0.00 H new ATOM 855 N GLU A 57 11.496 -10.705 -17.587 1.00 0.00 N ATOM 856 CA GLU A 57 12.680 -11.421 -18.147 1.00 0.00 C ATOM 857 C GLU A 57 12.313 -12.739 -18.896 1.00 0.00 C ATOM 858 O GLU A 57 11.713 -13.659 -18.328 1.00 0.00 O ATOM 859 CB GLU A 57 13.696 -11.718 -17.006 1.00 0.00 C ATOM 860 CG GLU A 57 14.436 -10.486 -16.420 1.00 0.00 C ATOM 861 CD GLU A 57 15.411 -9.746 -17.333 1.00 0.00 C ATOM 862 OE1 GLU A 57 15.728 -10.217 -18.451 1.00 0.00 O ATOM 863 OE2 GLU A 57 15.858 -8.657 -16.919 1.00 0.00 O ATOM 0 H GLU A 57 11.132 -11.114 -16.726 1.00 0.00 H new ATOM 0 HA GLU A 57 13.126 -10.761 -18.892 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.167 -12.219 -16.196 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.440 -12.420 -17.382 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.685 -9.772 -16.082 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.985 -10.813 -15.537 1.00 0.00 H new ATOM 870 N SER A 58 12.741 -12.852 -20.164 1.00 0.00 N ATOM 871 CA SER A 58 12.707 -14.130 -20.927 1.00 0.00 C ATOM 872 C SER A 58 13.907 -14.203 -21.919 1.00 0.00 C ATOM 873 O SER A 58 14.228 -13.236 -22.617 1.00 0.00 O ATOM 874 CB SER A 58 11.352 -14.267 -21.669 1.00 0.00 C ATOM 875 OG SER A 58 11.271 -15.475 -22.430 1.00 0.00 O ATOM 0 H SER A 58 13.121 -12.069 -20.696 1.00 0.00 H new ATOM 0 HA SER A 58 12.800 -14.964 -20.232 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.539 -14.242 -20.944 1.00 0.00 H new ATOM 0 HB3 SER A 58 11.215 -13.413 -22.332 1.00 0.00 H new ATOM 0 HG SER A 58 10.574 -15.385 -23.113 1.00 0.00 H new ATOM 881 N THR A 59 14.501 -15.402 -22.063 1.00 0.00 N ATOM 882 CA THR A 59 15.425 -15.730 -23.202 1.00 0.00 C ATOM 883 C THR A 59 14.858 -15.517 -24.654 1.00 0.00 C ATOM 884 O THR A 59 15.625 -15.192 -25.563 1.00 0.00 O ATOM 885 CB THR A 59 16.003 -17.173 -23.044 1.00 0.00 C ATOM 886 OG1 THR A 59 14.961 -18.143 -23.000 1.00 0.00 O ATOM 887 CG2 THR A 59 16.881 -17.404 -21.802 1.00 0.00 C ATOM 0 H THR A 59 14.366 -16.173 -21.409 1.00 0.00 H new ATOM 0 HA THR A 59 16.216 -14.985 -23.118 1.00 0.00 H new ATOM 0 HB THR A 59 16.637 -17.283 -23.924 1.00 0.00 H new ATOM 0 HG1 THR A 59 15.350 -19.037 -22.903 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.230 -18.437 -21.790 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.739 -16.732 -21.833 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.298 -17.207 -20.902 1.00 0.00 H new ATOM 895 N LEU A 60 13.535 -15.654 -24.864 1.00 0.00 N ATOM 896 CA LEU A 60 12.849 -15.185 -26.099 1.00 0.00 C ATOM 897 C LEU A 60 12.664 -13.626 -26.189 1.00 0.00 C ATOM 898 O LEU A 60 12.980 -13.062 -27.240 1.00 0.00 O ATOM 899 CB LEU A 60 11.518 -15.984 -26.242 1.00 0.00 C ATOM 900 CG LEU A 60 11.645 -17.499 -26.580 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.314 -18.234 -26.385 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.133 -17.752 -28.020 1.00 0.00 C ATOM 0 H LEU A 60 12.907 -16.090 -24.189 1.00 0.00 H new ATOM 0 HA LEU A 60 13.491 -15.391 -26.955 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.962 -15.889 -25.309 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.919 -15.511 -27.020 1.00 0.00 H new ATOM 0 HG LEU A 60 12.390 -17.886 -25.885 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.441 -19.288 -26.630 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.994 -18.139 -25.347 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.558 -17.798 -27.039 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.202 -18.825 -28.197 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.428 -17.312 -28.726 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.114 -17.298 -28.157 1.00 0.00 H new ATOM 914 N LYS A 61 12.167 -12.920 -25.144 1.00 0.00 N ATOM 915 CA LYS A 61 12.097 -11.426 -25.136 1.00 0.00 C ATOM 916 C LYS A 61 12.039 -10.835 -23.685 1.00 0.00 C ATOM 917 O LYS A 61 10.988 -10.853 -23.035 1.00 0.00 O ATOM 918 CB LYS A 61 10.899 -10.956 -26.019 1.00 0.00 C ATOM 919 CG LYS A 61 10.588 -9.441 -26.115 1.00 0.00 C ATOM 920 CD LYS A 61 11.740 -8.570 -26.670 1.00 0.00 C ATOM 921 CE LYS A 61 11.397 -7.081 -26.894 1.00 0.00 C ATOM 922 NZ LYS A 61 11.216 -6.340 -25.612 1.00 0.00 N ATOM 0 H LYS A 61 11.808 -13.354 -24.294 1.00 0.00 H new ATOM 0 HA LYS A 61 13.019 -11.036 -25.567 1.00 0.00 H new ATOM 0 HB2 LYS A 61 11.072 -11.321 -27.031 1.00 0.00 H new ATOM 0 HB3 LYS A 61 10.002 -11.454 -25.650 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.712 -9.305 -26.749 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.323 -9.076 -25.123 1.00 0.00 H new ATOM 0 HD2 LYS A 61 12.583 -8.631 -25.982 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.070 -8.996 -27.618 1.00 0.00 H new ATOM 0 HE2 LYS A 61 12.192 -6.611 -27.473 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.485 -7.006 -27.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.139 -5.321 -25.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 10.349 -6.668 -25.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.033 -6.513 -24.993 1.00 0.00 H new ATOM 936 N THR A 62 13.138 -10.200 -23.234 1.00 0.00 N ATOM 937 CA THR A 62 13.134 -9.302 -22.035 1.00 0.00 C ATOM 938 C THR A 62 12.515 -7.895 -22.381 1.00 0.00 C ATOM 939 O THR A 62 12.845 -7.281 -23.404 1.00 0.00 O ATOM 940 CB THR A 62 14.571 -9.219 -21.413 1.00 0.00 C ATOM 941 OG1 THR A 62 14.882 -10.445 -20.745 1.00 0.00 O ATOM 942 CG2 THR A 62 14.798 -8.118 -20.361 1.00 0.00 C ATOM 0 H THR A 62 14.052 -10.286 -23.678 1.00 0.00 H new ATOM 0 HA THR A 62 12.487 -9.728 -21.268 1.00 0.00 H new ATOM 0 HB THR A 62 15.201 -8.996 -22.274 1.00 0.00 H new ATOM 0 HG1 THR A 62 15.629 -10.301 -20.128 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.827 -8.161 -20.005 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.609 -7.142 -20.809 1.00 0.00 H new ATOM 0 HG23 THR A 62 14.118 -8.270 -19.523 1.00 0.00 H new ATOM 950 N THR A 63 11.633 -7.371 -21.505 1.00 0.00 N ATOM 951 CA THR A 63 11.119 -5.965 -21.600 1.00 0.00 C ATOM 952 C THR A 63 11.167 -5.320 -20.174 1.00 0.00 C ATOM 953 O THR A 63 10.551 -5.820 -19.226 1.00 0.00 O ATOM 954 CB THR A 63 9.687 -5.902 -22.224 1.00 0.00 C ATOM 955 OG1 THR A 63 9.555 -6.798 -23.328 1.00 0.00 O ATOM 956 CG2 THR A 63 9.261 -4.513 -22.734 1.00 0.00 C ATOM 0 H THR A 63 11.253 -7.894 -20.716 1.00 0.00 H new ATOM 0 HA THR A 63 11.757 -5.395 -22.276 1.00 0.00 H new ATOM 0 HB THR A 63 9.041 -6.179 -21.391 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.648 -6.735 -23.694 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.255 -4.571 -23.149 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.273 -3.803 -21.907 1.00 0.00 H new ATOM 0 HG23 THR A 63 9.954 -4.181 -23.508 1.00 0.00 H new ATOM 964 N GLN A 64 11.913 -4.216 -20.019 1.00 0.00 N ATOM 965 CA GLN A 64 12.165 -3.571 -18.696 1.00 0.00 C ATOM 966 C GLN A 64 11.745 -2.071 -18.721 1.00 0.00 C ATOM 967 O GLN A 64 12.179 -1.312 -19.593 1.00 0.00 O ATOM 968 CB GLN A 64 13.664 -3.789 -18.337 1.00 0.00 C ATOM 969 CG GLN A 64 14.105 -3.353 -16.911 1.00 0.00 C ATOM 970 CD GLN A 64 14.647 -1.924 -16.773 1.00 0.00 C ATOM 971 OE1 GLN A 64 15.767 -1.617 -17.166 1.00 0.00 O ATOM 972 NE2 GLN A 64 13.910 -1.016 -16.178 1.00 0.00 N ATOM 0 H GLN A 64 12.364 -3.736 -20.798 1.00 0.00 H new ATOM 0 HA GLN A 64 11.555 -4.025 -17.915 1.00 0.00 H new ATOM 0 HB2 GLN A 64 13.893 -4.848 -18.456 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.271 -3.248 -19.063 1.00 0.00 H new ATOM 0 HG2 GLN A 64 13.252 -3.461 -16.241 1.00 0.00 H new ATOM 0 HG3 GLN A 64 14.873 -4.045 -16.564 1.00 0.00 H new ATOM 0 HE21 GLN A 64 12.976 -1.255 -15.845 1.00 0.00 H new ATOM 0 HE22 GLN A 64 14.271 -0.071 -16.048 1.00 0.00 H new ATOM 981 N PHE A 65 10.934 -1.635 -17.738 1.00 0.00 N ATOM 982 CA PHE A 65 10.469 -0.220 -17.645 1.00 0.00 C ATOM 983 C PHE A 65 10.280 0.273 -16.171 1.00 0.00 C ATOM 984 O PHE A 65 10.003 -0.509 -15.256 1.00 0.00 O ATOM 985 CB PHE A 65 9.217 0.000 -18.541 1.00 0.00 C ATOM 986 CG PHE A 65 7.964 -0.858 -18.272 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.071 -0.504 -17.255 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.665 -1.945 -19.101 1.00 0.00 C ATOM 989 CE1 PHE A 65 5.878 -1.202 -17.097 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.484 -2.661 -18.921 1.00 0.00 C ATOM 991 CZ PHE A 65 5.591 -2.287 -17.920 1.00 0.00 C ATOM 0 H PHE A 65 10.582 -2.236 -16.992 1.00 0.00 H new ATOM 0 HA PHE A 65 11.263 0.416 -18.037 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.927 1.047 -18.455 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.516 -0.164 -19.576 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.308 0.314 -16.591 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.353 -2.230 -19.883 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.174 -0.902 -16.335 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.261 -3.505 -19.557 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.674 -2.840 -17.782 1.00 0.00 H new ATOM 1001 N SER A 66 10.429 1.594 -15.960 1.00 0.00 N ATOM 1002 CA SER A 66 10.342 2.236 -14.616 1.00 0.00 C ATOM 1003 C SER A 66 9.505 3.549 -14.670 1.00 0.00 C ATOM 1004 O SER A 66 9.908 4.491 -15.363 1.00 0.00 O ATOM 1005 CB SER A 66 11.775 2.511 -14.093 1.00 0.00 C ATOM 1006 OG SER A 66 12.449 3.498 -14.880 1.00 0.00 O ATOM 0 H SER A 66 10.614 2.256 -16.713 1.00 0.00 H new ATOM 0 HA SER A 66 9.831 1.560 -13.930 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.726 2.845 -13.056 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.349 1.585 -14.103 1.00 0.00 H new ATOM 0 HG SER A 66 11.789 4.032 -15.370 1.00 0.00 H new ATOM 1012 N CYS A 67 8.371 3.624 -13.944 1.00 0.00 N ATOM 1013 CA CYS A 67 7.457 4.801 -14.001 1.00 0.00 C ATOM 1014 C CYS A 67 6.775 5.120 -12.634 1.00 0.00 C ATOM 1015 O CYS A 67 6.559 4.252 -11.778 1.00 0.00 O ATOM 1016 CB CYS A 67 6.421 4.526 -15.114 1.00 0.00 C ATOM 1017 SG CYS A 67 5.420 6.011 -15.474 1.00 0.00 S ATOM 0 H CYS A 67 8.060 2.888 -13.310 1.00 0.00 H new ATOM 0 HA CYS A 67 8.037 5.695 -14.228 1.00 0.00 H new ATOM 0 HB2 CYS A 67 6.935 4.203 -16.020 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.767 3.709 -14.810 1.00 0.00 H new ATOM 0 HG CYS A 67 4.157 5.706 -15.424 1.00 0.00 H new ATOM 1023 N THR A 68 6.405 6.397 -12.448 1.00 0.00 N ATOM 1024 CA THR A 68 5.721 6.888 -11.223 1.00 0.00 C ATOM 1025 C THR A 68 4.172 6.663 -11.321 1.00 0.00 C ATOM 1026 O THR A 68 3.559 6.730 -12.392 1.00 0.00 O ATOM 1027 CB THR A 68 6.071 8.397 -10.969 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.400 8.741 -11.368 1.00 0.00 O ATOM 1029 CG2 THR A 68 5.956 8.810 -9.494 1.00 0.00 C ATOM 0 H THR A 68 6.569 7.127 -13.141 1.00 0.00 H new ATOM 0 HA THR A 68 6.080 6.314 -10.369 1.00 0.00 H new ATOM 0 HB THR A 68 5.334 8.924 -11.575 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.452 8.767 -12.346 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.212 9.865 -9.390 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.934 8.649 -9.150 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.640 8.210 -8.894 1.00 0.00 H new ATOM 1037 N LEU A 69 3.516 6.440 -10.177 1.00 0.00 N ATOM 1038 CA LEU A 69 2.030 6.281 -10.106 1.00 0.00 C ATOM 1039 C LEU A 69 1.263 7.609 -10.455 1.00 0.00 C ATOM 1040 O LEU A 69 1.392 8.622 -9.758 1.00 0.00 O ATOM 1041 CB LEU A 69 1.666 5.733 -8.696 1.00 0.00 C ATOM 1042 CG LEU A 69 1.606 4.191 -8.512 1.00 0.00 C ATOM 1043 CD1 LEU A 69 2.851 3.417 -8.985 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.364 3.878 -7.025 1.00 0.00 C ATOM 0 H LEU A 69 3.981 6.362 -9.272 1.00 0.00 H new ATOM 0 HA LEU A 69 1.707 5.568 -10.865 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.393 6.127 -7.985 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.694 6.142 -8.418 1.00 0.00 H new ATOM 0 HG LEU A 69 0.791 3.852 -9.151 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.704 2.351 -8.811 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.006 3.593 -10.049 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.724 3.758 -8.430 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.320 2.798 -6.883 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.179 4.289 -6.429 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.422 4.324 -6.708 1.00 0.00 H new ATOM 1056 N GLY A 70 0.491 7.602 -11.553 1.00 0.00 N ATOM 1057 CA GLY A 70 0.024 8.852 -12.227 1.00 0.00 C ATOM 1058 C GLY A 70 0.776 9.314 -13.506 1.00 0.00 C ATOM 1059 O GLY A 70 0.172 9.966 -14.358 1.00 0.00 O ATOM 0 H GLY A 70 0.169 6.746 -12.005 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.026 8.719 -12.486 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.073 9.662 -11.500 1.00 0.00 H new ATOM 1063 N GLU A 71 2.080 9.019 -13.628 1.00 0.00 N ATOM 1064 CA GLU A 71 2.930 9.407 -14.783 1.00 0.00 C ATOM 1065 C GLU A 71 2.791 8.415 -15.988 1.00 0.00 C ATOM 1066 O GLU A 71 2.521 7.214 -15.829 1.00 0.00 O ATOM 1067 CB GLU A 71 4.365 9.467 -14.188 1.00 0.00 C ATOM 1068 CG GLU A 71 5.545 9.884 -15.102 1.00 0.00 C ATOM 1069 CD GLU A 71 6.886 9.901 -14.372 1.00 0.00 C ATOM 1070 OE1 GLU A 71 7.272 8.870 -13.772 1.00 0.00 O ATOM 1071 OE2 GLU A 71 7.556 10.951 -14.387 1.00 0.00 O ATOM 0 H GLU A 71 2.590 8.494 -12.917 1.00 0.00 H new ATOM 0 HA GLU A 71 2.637 10.362 -15.220 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.342 10.158 -13.345 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.595 8.481 -13.785 1.00 0.00 H new ATOM 0 HG2 GLU A 71 5.605 9.196 -15.945 1.00 0.00 H new ATOM 0 HG3 GLU A 71 5.348 10.875 -15.512 1.00 0.00 H new ATOM 1078 N LYS A 72 2.979 8.954 -17.208 1.00 0.00 N ATOM 1079 CA LYS A 72 3.099 8.133 -18.446 1.00 0.00 C ATOM 1080 C LYS A 72 4.531 8.115 -19.061 1.00 0.00 C ATOM 1081 O LYS A 72 5.313 9.064 -18.950 1.00 0.00 O ATOM 1082 CB LYS A 72 2.002 8.462 -19.494 1.00 0.00 C ATOM 1083 CG LYS A 72 1.969 9.854 -20.166 1.00 0.00 C ATOM 1084 CD LYS A 72 1.151 9.935 -21.484 1.00 0.00 C ATOM 1085 CE LYS A 72 -0.243 9.261 -21.481 1.00 0.00 C ATOM 1086 NZ LYS A 72 -1.019 9.573 -22.712 1.00 0.00 N ATOM 0 H LYS A 72 3.052 9.958 -17.371 1.00 0.00 H new ATOM 0 HA LYS A 72 2.920 7.108 -18.120 1.00 0.00 H new ATOM 0 HB2 LYS A 72 2.080 7.720 -20.289 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.036 8.312 -19.011 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.557 10.572 -19.457 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.993 10.163 -20.374 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.020 10.987 -21.739 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.744 9.486 -22.281 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.123 8.181 -21.393 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.803 9.592 -20.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.986 9.202 -22.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.056 10.603 -22.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.559 9.132 -23.534 1.00 0.00 H new ATOM 1100 N PHE A 73 4.833 7.002 -19.741 1.00 0.00 N ATOM 1101 CA PHE A 73 6.166 6.718 -20.343 1.00 0.00 C ATOM 1102 C PHE A 73 6.019 6.085 -21.774 1.00 0.00 C ATOM 1103 O PHE A 73 4.945 5.612 -22.165 1.00 0.00 O ATOM 1104 CB PHE A 73 6.987 5.848 -19.335 1.00 0.00 C ATOM 1105 CG PHE A 73 6.555 4.374 -19.182 1.00 0.00 C ATOM 1106 CD1 PHE A 73 5.435 4.038 -18.415 1.00 0.00 C ATOM 1107 CD2 PHE A 73 7.210 3.376 -19.910 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.961 2.731 -18.399 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.728 2.072 -19.899 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.594 1.754 -19.157 1.00 0.00 C ATOM 0 H PHE A 73 4.156 6.255 -19.897 1.00 0.00 H new ATOM 0 HA PHE A 73 6.722 7.641 -20.509 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.033 5.866 -19.642 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.935 6.322 -18.355 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.936 4.798 -17.832 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.093 3.619 -20.483 1.00 0.00 H new ATOM 0 HE1 PHE A 73 4.101 2.475 -17.798 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.234 1.305 -20.467 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.206 0.746 -19.171 1.00 0.00 H new ATOM 1120 N GLU A 74 7.124 6.021 -22.541 1.00 0.00 N ATOM 1121 CA GLU A 74 7.160 5.267 -23.830 1.00 0.00 C ATOM 1122 C GLU A 74 7.419 3.741 -23.584 1.00 0.00 C ATOM 1123 O GLU A 74 8.541 3.309 -23.296 1.00 0.00 O ATOM 1124 CB GLU A 74 8.192 5.967 -24.760 1.00 0.00 C ATOM 1125 CG GLU A 74 8.145 5.557 -26.257 1.00 0.00 C ATOM 1126 CD GLU A 74 9.065 4.423 -26.688 1.00 0.00 C ATOM 1127 OE1 GLU A 74 8.704 3.237 -26.537 1.00 0.00 O ATOM 1128 OE2 GLU A 74 10.122 4.711 -27.289 1.00 0.00 O ATOM 0 H GLU A 74 8.005 6.476 -22.301 1.00 0.00 H new ATOM 0 HA GLU A 74 6.195 5.290 -24.336 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.039 7.044 -24.694 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.192 5.763 -24.379 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.121 5.274 -26.500 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.384 6.435 -26.857 1.00 0.00 H new ATOM 1135 N GLU A 75 6.350 2.930 -23.680 1.00 0.00 N ATOM 1136 CA GLU A 75 6.432 1.452 -23.637 1.00 0.00 C ATOM 1137 C GLU A 75 6.566 0.888 -25.088 1.00 0.00 C ATOM 1138 O GLU A 75 5.577 0.704 -25.814 1.00 0.00 O ATOM 1139 CB GLU A 75 5.190 0.916 -22.870 1.00 0.00 C ATOM 1140 CG GLU A 75 5.210 -0.613 -22.606 1.00 0.00 C ATOM 1141 CD GLU A 75 4.052 -1.223 -21.825 1.00 0.00 C ATOM 1142 OE1 GLU A 75 3.029 -0.553 -21.555 1.00 0.00 O ATOM 1143 OE2 GLU A 75 4.173 -2.413 -21.470 1.00 0.00 O ATOM 0 H GLU A 75 5.398 3.280 -23.790 1.00 0.00 H new ATOM 0 HA GLU A 75 7.319 1.114 -23.101 1.00 0.00 H new ATOM 0 HB2 GLU A 75 5.116 1.436 -21.915 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.293 1.163 -23.438 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.263 -1.117 -23.571 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.131 -0.847 -22.073 1.00 0.00 H new ATOM 1150 N THR A 76 7.811 0.557 -25.475 1.00 0.00 N ATOM 1151 CA THR A 76 8.091 -0.259 -26.689 1.00 0.00 C ATOM 1152 C THR A 76 7.825 -1.763 -26.340 1.00 0.00 C ATOM 1153 O THR A 76 8.601 -2.414 -25.631 1.00 0.00 O ATOM 1154 CB THR A 76 9.533 0.013 -27.217 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.693 1.363 -27.650 1.00 0.00 O ATOM 1156 CG2 THR A 76 9.911 -0.826 -28.452 1.00 0.00 C ATOM 0 H THR A 76 8.649 0.840 -24.967 1.00 0.00 H new ATOM 0 HA THR A 76 7.427 0.019 -27.508 1.00 0.00 H new ATOM 0 HB THR A 76 10.163 -0.239 -26.364 1.00 0.00 H new ATOM 0 HG1 THR A 76 9.325 1.969 -26.974 1.00 0.00 H new ATOM 0 HG21 THR A 76 10.927 -0.582 -28.761 1.00 0.00 H new ATOM 0 HG22 THR A 76 9.852 -1.886 -28.204 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.221 -0.605 -29.267 1.00 0.00 H new ATOM 1164 N THR A 77 6.696 -2.285 -26.839 1.00 0.00 N ATOM 1165 CA THR A 77 6.160 -3.627 -26.446 1.00 0.00 C ATOM 1166 C THR A 77 7.046 -4.859 -26.868 1.00 0.00 C ATOM 1167 O THR A 77 8.070 -4.724 -27.547 1.00 0.00 O ATOM 1168 CB THR A 77 4.682 -3.739 -26.964 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.616 -3.585 -28.378 1.00 0.00 O ATOM 1170 CG2 THR A 77 3.683 -2.749 -26.339 1.00 0.00 C ATOM 0 H THR A 77 6.118 -1.802 -27.527 1.00 0.00 H new ATOM 0 HA THR A 77 6.186 -3.681 -25.358 1.00 0.00 H new ATOM 0 HB THR A 77 4.383 -4.739 -26.651 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.763 -2.645 -28.612 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.694 -2.912 -26.766 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.643 -2.905 -25.261 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.004 -1.728 -26.547 1.00 0.00 H new ATOM 1178 N ALA A 78 6.645 -6.085 -26.467 1.00 0.00 N ATOM 1179 CA ALA A 78 7.292 -7.355 -26.916 1.00 0.00 C ATOM 1180 C ALA A 78 7.544 -7.559 -28.454 1.00 0.00 C ATOM 1181 O ALA A 78 8.631 -8.001 -28.835 1.00 0.00 O ATOM 1182 CB ALA A 78 6.477 -8.509 -26.301 1.00 0.00 C ATOM 0 H ALA A 78 5.866 -6.231 -25.825 1.00 0.00 H new ATOM 0 HA ALA A 78 8.321 -7.318 -26.558 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.912 -9.462 -26.601 1.00 0.00 H new ATOM 0 HB2 ALA A 78 6.495 -8.428 -25.214 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.447 -8.454 -26.652 1.00 0.00 H new ATOM 1188 N ASP A 79 6.590 -7.177 -29.318 1.00 0.00 N ATOM 1189 CA ASP A 79 6.810 -7.025 -30.784 1.00 0.00 C ATOM 1190 C ASP A 79 7.743 -5.838 -31.221 1.00 0.00 C ATOM 1191 O ASP A 79 8.542 -5.990 -32.148 1.00 0.00 O ATOM 1192 CB ASP A 79 5.439 -6.803 -31.481 1.00 0.00 C ATOM 1193 CG ASP A 79 4.302 -7.800 -31.311 1.00 0.00 C ATOM 1194 OD1 ASP A 79 3.888 -8.069 -30.163 1.00 0.00 O ATOM 1195 OD2 ASP A 79 3.642 -8.097 -32.325 1.00 0.00 O ATOM 0 H ASP A 79 5.636 -6.961 -29.028 1.00 0.00 H new ATOM 0 HA ASP A 79 7.314 -7.945 -31.081 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.066 -5.834 -31.150 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.634 -6.721 -32.550 1.00 0.00 H new ATOM 1200 N GLY A 80 7.551 -4.642 -30.634 1.00 0.00 N ATOM 1201 CA GLY A 80 8.036 -3.357 -31.211 1.00 0.00 C ATOM 1202 C GLY A 80 7.049 -2.159 -31.270 1.00 0.00 C ATOM 1203 O GLY A 80 7.515 -1.050 -31.543 1.00 0.00 O ATOM 0 H GLY A 80 7.057 -4.530 -29.748 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.907 -3.042 -30.637 1.00 0.00 H new ATOM 0 HA3 GLY A 80 8.378 -3.556 -32.226 1.00 0.00 H new ATOM 1207 N ARG A 81 5.726 -2.324 -31.031 1.00 0.00 N ATOM 1208 CA ARG A 81 4.745 -1.193 -31.059 1.00 0.00 C ATOM 1209 C ARG A 81 5.027 -0.115 -29.959 1.00 0.00 C ATOM 1210 O ARG A 81 5.192 -0.443 -28.777 1.00 0.00 O ATOM 1211 CB ARG A 81 3.277 -1.691 -30.889 1.00 0.00 C ATOM 1212 CG ARG A 81 2.644 -2.482 -32.063 1.00 0.00 C ATOM 1213 CD ARG A 81 1.234 -3.056 -31.744 1.00 0.00 C ATOM 1214 NE ARG A 81 1.273 -4.116 -30.694 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.780 -5.336 -30.862 1.00 0.00 C ATOM 1216 NH1 ARG A 81 1.961 -5.883 -32.038 1.00 0.00 N ATOM 1217 NH2 ARG A 81 2.132 -6.002 -29.800 1.00 0.00 N ATOM 0 H ARG A 81 5.305 -3.228 -30.816 1.00 0.00 H new ATOM 0 HA ARG A 81 4.870 -0.736 -32.041 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.237 -2.321 -30.000 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.649 -0.822 -30.692 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.572 -1.828 -32.932 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.307 -3.303 -32.335 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.582 -2.247 -31.415 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.798 -3.467 -32.655 1.00 0.00 H new ATOM 0 HE ARG A 81 0.882 -3.889 -29.780 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.709 -5.370 -32.883 1.00 0.00 H new ATOM 0 HH12 ARG A 81 2.354 -6.822 -32.109 1.00 0.00 H new ATOM 0 HH21 ARG A 81 2.016 -5.587 -28.876 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.524 -6.939 -29.892 1.00 0.00 H new ATOM 1231 N LYS A 82 5.030 1.163 -30.375 1.00 0.00 N ATOM 1232 CA LYS A 82 5.207 2.326 -29.464 1.00 0.00 C ATOM 1233 C LYS A 82 3.874 2.673 -28.729 1.00 0.00 C ATOM 1234 O LYS A 82 2.904 3.108 -29.359 1.00 0.00 O ATOM 1235 CB LYS A 82 5.700 3.545 -30.305 1.00 0.00 C ATOM 1236 CG LYS A 82 7.103 3.457 -30.960 1.00 0.00 C ATOM 1237 CD LYS A 82 8.237 3.472 -29.921 1.00 0.00 C ATOM 1238 CE LYS A 82 9.647 3.452 -30.530 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.627 3.310 -29.421 1.00 0.00 N ATOM 0 H LYS A 82 4.910 1.428 -31.353 1.00 0.00 H new ATOM 0 HA LYS A 82 5.944 2.077 -28.701 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.972 3.721 -31.097 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.687 4.423 -29.660 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.168 2.544 -31.552 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.233 4.293 -31.648 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.134 4.362 -29.300 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.125 2.610 -29.264 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.746 2.625 -31.234 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.834 4.370 -31.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.582 3.192 -29.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.601 4.161 -28.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.384 2.477 -28.847 1.00 0.00 H new ATOM 1253 N THR A 83 3.833 2.468 -27.404 1.00 0.00 N ATOM 1254 CA THR A 83 2.593 2.648 -26.592 1.00 0.00 C ATOM 1255 C THR A 83 2.843 3.663 -25.441 1.00 0.00 C ATOM 1256 O THR A 83 3.747 3.471 -24.628 1.00 0.00 O ATOM 1257 CB THR A 83 2.033 1.282 -26.079 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.970 0.556 -25.291 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.551 0.323 -27.177 1.00 0.00 C ATOM 0 H THR A 83 4.643 2.175 -26.858 1.00 0.00 H new ATOM 0 HA THR A 83 1.818 3.066 -27.234 1.00 0.00 H new ATOM 0 HB THR A 83 1.177 1.599 -25.483 1.00 0.00 H new ATOM 0 HG1 THR A 83 3.874 0.700 -25.642 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.181 -0.596 -26.721 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.749 0.794 -27.745 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.380 0.088 -27.845 1.00 0.00 H new ATOM 1267 N GLN A 84 2.045 4.745 -25.338 1.00 0.00 N ATOM 1268 CA GLN A 84 2.172 5.708 -24.208 1.00 0.00 C ATOM 1269 C GLN A 84 1.391 5.191 -22.965 1.00 0.00 C ATOM 1270 O GLN A 84 0.174 5.365 -22.853 1.00 0.00 O ATOM 1271 CB GLN A 84 1.727 7.135 -24.628 1.00 0.00 C ATOM 1272 CG GLN A 84 2.611 7.892 -25.656 1.00 0.00 C ATOM 1273 CD GLN A 84 4.130 7.898 -25.417 1.00 0.00 C ATOM 1274 OE1 GLN A 84 4.897 7.228 -26.100 1.00 0.00 O ATOM 1275 NE2 GLN A 84 4.615 8.633 -24.445 1.00 0.00 N ATOM 0 H GLN A 84 1.314 4.978 -26.009 1.00 0.00 H new ATOM 0 HA GLN A 84 3.224 5.779 -23.931 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.720 7.065 -25.039 1.00 0.00 H new ATOM 0 HB3 GLN A 84 1.662 7.745 -23.727 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.427 7.461 -26.640 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.272 8.927 -25.693 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.988 9.195 -23.869 1.00 0.00 H new ATOM 0 HE22 GLN A 84 5.619 8.642 -24.265 1.00 0.00 H new ATOM 1284 N THR A 85 2.102 4.527 -22.045 1.00 0.00 N ATOM 1285 CA THR A 85 1.465 3.769 -20.936 1.00 0.00 C ATOM 1286 C THR A 85 1.421 4.636 -19.641 1.00 0.00 C ATOM 1287 O THR A 85 2.472 4.947 -19.074 1.00 0.00 O ATOM 1288 CB THR A 85 2.197 2.405 -20.768 1.00 0.00 C ATOM 1289 OG1 THR A 85 2.032 1.595 -21.932 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.684 1.548 -19.604 1.00 0.00 C ATOM 0 H THR A 85 3.121 4.493 -22.038 1.00 0.00 H new ATOM 0 HA THR A 85 0.424 3.542 -21.166 1.00 0.00 H new ATOM 0 HB THR A 85 3.234 2.687 -20.583 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.963 0.654 -21.668 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.249 0.617 -19.561 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.810 2.093 -18.668 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.628 1.324 -19.755 1.00 0.00 H new ATOM 1298 N VAL A 86 0.215 4.989 -19.148 1.00 0.00 N ATOM 1299 CA VAL A 86 0.044 5.616 -17.796 1.00 0.00 C ATOM 1300 C VAL A 86 -0.157 4.521 -16.688 1.00 0.00 C ATOM 1301 O VAL A 86 -1.047 3.667 -16.797 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.019 6.773 -17.816 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -2.488 6.376 -18.010 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -0.917 7.688 -16.576 1.00 0.00 C ATOM 0 H VAL A 86 -0.660 4.856 -19.655 1.00 0.00 H new ATOM 0 HA VAL A 86 0.968 6.123 -17.517 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.735 7.304 -18.725 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.111 7.271 -18.004 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -2.603 5.861 -18.964 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -2.796 5.714 -17.201 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.673 8.471 -16.638 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.079 7.098 -15.674 1.00 0.00 H new ATOM 0 HG23 VAL A 86 0.073 8.142 -16.539 1.00 0.00 H new ATOM 1314 N CYS A 87 0.682 4.543 -15.631 1.00 0.00 N ATOM 1315 CA CYS A 87 0.607 3.549 -14.522 1.00 0.00 C ATOM 1316 C CYS A 87 -0.229 4.086 -13.320 1.00 0.00 C ATOM 1317 O CYS A 87 0.161 5.077 -12.696 1.00 0.00 O ATOM 1318 CB CYS A 87 2.048 3.209 -14.076 1.00 0.00 C ATOM 1319 SG CYS A 87 3.066 2.599 -15.462 1.00 0.00 S ATOM 0 H CYS A 87 1.422 5.236 -15.516 1.00 0.00 H new ATOM 0 HA CYS A 87 0.101 2.652 -14.880 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.514 4.096 -13.647 1.00 0.00 H new ATOM 0 HB3 CYS A 87 2.016 2.454 -13.290 1.00 0.00 H new ATOM 0 HG CYS A 87 3.386 3.593 -16.236 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.362 3.446 -12.976 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.258 3.937 -11.883 1.00 0.00 C ATOM 1327 C ASN A 88 -2.633 2.785 -10.904 1.00 0.00 C ATOM 1328 O ASN A 88 -3.322 1.833 -11.281 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.538 4.574 -12.495 1.00 0.00 C ATOM 1330 CG ASN A 88 -3.329 5.934 -13.169 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -2.958 6.920 -12.542 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -3.569 6.038 -14.452 1.00 0.00 N ATOM 0 H ASN A 88 -1.688 2.592 -13.429 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.722 4.695 -11.312 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.954 3.883 -13.228 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.281 4.687 -11.706 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -3.447 6.935 -14.923 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.878 5.222 -14.981 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.217 2.884 -9.629 1.00 0.00 N ATOM 1340 CA PHE A 89 -2.660 1.938 -8.568 1.00 0.00 C ATOM 1341 C PHE A 89 -4.044 2.350 -7.956 1.00 0.00 C ATOM 1342 O PHE A 89 -4.245 3.502 -7.557 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.526 1.843 -7.505 1.00 0.00 C ATOM 1344 CG PHE A 89 -1.835 0.911 -6.324 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -1.728 -0.479 -6.446 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.378 1.461 -5.158 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.180 -1.306 -5.420 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.841 0.634 -4.145 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.748 -0.746 -4.277 1.00 0.00 C ATOM 0 H PHE A 89 -1.576 3.606 -9.300 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.829 0.949 -8.994 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.615 1.499 -7.994 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.323 2.842 -7.119 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.295 -0.911 -7.336 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.437 2.534 -5.046 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.090 -2.379 -5.510 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.274 1.063 -3.253 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.117 -1.387 -3.491 1.00 0.00 H new ATOM 1359 N THR A 90 -4.942 1.364 -7.789 1.00 0.00 N ATOM 1360 CA THR A 90 -6.133 1.491 -6.899 1.00 0.00 C ATOM 1361 C THR A 90 -6.306 0.191 -6.050 1.00 0.00 C ATOM 1362 O THR A 90 -6.338 -0.917 -6.597 1.00 0.00 O ATOM 1363 CB THR A 90 -7.407 1.902 -7.701 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.435 2.330 -6.807 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.002 0.854 -8.660 1.00 0.00 C ATOM 0 H THR A 90 -4.874 0.461 -8.258 1.00 0.00 H new ATOM 0 HA THR A 90 -5.972 2.306 -6.193 1.00 0.00 H new ATOM 0 HB THR A 90 -7.046 2.704 -8.345 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.027 1.576 -6.603 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.882 1.269 -9.152 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.259 0.585 -9.411 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.287 -0.035 -8.097 1.00 0.00 H new ATOM 1373 N ASP A 91 -6.460 0.332 -4.717 1.00 0.00 N ATOM 1374 CA ASP A 91 -7.056 -0.725 -3.834 1.00 0.00 C ATOM 1375 C ASP A 91 -6.119 -1.963 -3.592 1.00 0.00 C ATOM 1376 O ASP A 91 -5.396 -2.025 -2.592 1.00 0.00 O ATOM 1377 CB ASP A 91 -8.536 -1.073 -4.208 1.00 0.00 C ATOM 1378 CG ASP A 91 -9.478 0.109 -4.434 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -9.538 0.605 -5.583 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -10.134 0.556 -3.473 1.00 0.00 O ATOM 0 H ASP A 91 -6.180 1.173 -4.212 1.00 0.00 H new ATOM 0 HA ASP A 91 -7.127 -0.275 -2.844 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -8.526 -1.679 -5.114 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -8.952 -1.694 -3.414 1.00 0.00 H new ATOM 1385 N GLY A 92 -6.106 -2.916 -4.535 1.00 0.00 N ATOM 1386 CA GLY A 92 -4.999 -3.904 -4.691 1.00 0.00 C ATOM 1387 C GLY A 92 -4.704 -4.293 -6.163 1.00 0.00 C ATOM 1388 O GLY A 92 -4.605 -5.480 -6.485 1.00 0.00 O ATOM 0 H GLY A 92 -6.856 -3.034 -5.216 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.093 -3.492 -4.246 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.248 -4.805 -4.131 1.00 0.00 H new ATOM 1392 N ALA A 93 -4.571 -3.288 -7.048 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.581 -3.479 -8.517 1.00 0.00 C ATOM 1394 C ALA A 93 -3.804 -2.334 -9.232 1.00 0.00 C ATOM 1395 O ALA A 93 -4.107 -1.150 -9.038 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.055 -3.494 -8.985 1.00 0.00 C ATOM 0 H ALA A 93 -4.453 -2.315 -6.767 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.089 -4.418 -8.770 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.092 -3.634 -10.065 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.584 -4.311 -8.495 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.529 -2.548 -8.725 1.00 0.00 H new ATOM 1402 N LEU A 94 -2.835 -2.682 -10.096 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.154 -1.692 -10.976 1.00 0.00 C ATOM 1404 C LEU A 94 -2.805 -1.695 -12.393 1.00 0.00 C ATOM 1405 O LEU A 94 -2.677 -2.660 -13.153 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.636 -2.004 -11.025 1.00 0.00 C ATOM 1407 CG LEU A 94 0.250 -0.973 -11.777 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.450 0.325 -10.974 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.611 -1.602 -12.102 1.00 0.00 C ATOM 0 H LEU A 94 -2.500 -3.638 -10.210 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.275 -0.687 -10.571 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.270 -2.089 -10.002 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.501 -2.979 -11.494 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.268 -0.706 -12.698 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.076 1.012 -11.543 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.518 0.788 -10.785 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.934 0.095 -10.025 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.230 -0.877 -12.629 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.106 -1.897 -11.177 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.465 -2.480 -12.731 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.454 -0.581 -12.758 1.00 0.00 N ATOM 1422 CA VAL A 95 -3.988 -0.356 -14.130 1.00 0.00 C ATOM 1423 C VAL A 95 -2.838 0.256 -15.004 1.00 0.00 C ATOM 1424 O VAL A 95 -2.526 1.451 -14.932 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.293 0.514 -14.082 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -5.896 0.772 -15.484 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.429 -0.096 -13.222 1.00 0.00 C ATOM 0 H VAL A 95 -3.629 0.195 -12.120 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.295 -1.292 -14.596 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.947 1.443 -13.628 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.796 1.379 -15.387 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.169 1.299 -16.102 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.148 -0.179 -15.952 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.295 0.566 -13.241 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.708 -1.070 -13.625 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.084 -0.214 -12.195 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.219 -0.596 -15.833 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.192 -0.194 -16.829 1.00 0.00 C ATOM 1439 C GLN A 96 -1.923 0.138 -18.179 1.00 0.00 C ATOM 1440 O GLN A 96 -2.351 -0.751 -18.922 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.161 -1.363 -16.823 1.00 0.00 C ATOM 1442 CG GLN A 96 0.944 -1.346 -17.906 1.00 0.00 C ATOM 1443 CD GLN A 96 1.717 -2.664 -18.086 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.887 -3.483 -17.182 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.226 -2.913 -19.269 1.00 0.00 N ATOM 0 H GLN A 96 -2.413 -1.597 -15.838 1.00 0.00 H new ATOM 0 HA GLN A 96 -0.634 0.719 -16.620 1.00 0.00 H new ATOM 0 HB2 GLN A 96 0.325 -1.378 -15.847 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -0.712 -2.298 -16.920 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.489 -1.079 -18.860 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.656 -0.558 -17.661 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.096 -2.247 -20.031 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.752 -3.773 -19.427 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.136 1.441 -18.444 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.094 1.920 -19.481 1.00 0.00 C ATOM 1456 C HIS A 97 -2.362 2.361 -20.784 1.00 0.00 C ATOM 1457 O HIS A 97 -1.849 3.480 -20.865 1.00 0.00 O ATOM 1458 CB HIS A 97 -3.877 3.076 -18.804 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.014 3.698 -19.614 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -4.941 4.846 -20.391 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.288 3.136 -19.718 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.198 4.862 -20.933 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.088 3.897 -20.553 1.00 0.00 N ATOM 0 H HIS A 97 -1.656 2.195 -17.953 1.00 0.00 H new ATOM 0 HA HIS A 97 -3.771 1.132 -19.811 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.290 2.704 -17.866 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.169 3.864 -18.550 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.166 5.497 -20.522 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -6.605 2.233 -19.217 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.481 5.622 -21.646 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -8.067 3.772 -20.812 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.358 1.487 -21.798 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.649 1.728 -23.088 1.00 0.00 C ATOM 1474 C GLN A 98 -2.436 2.683 -24.044 1.00 0.00 C ATOM 1475 O GLN A 98 -3.629 2.463 -24.272 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.450 0.366 -23.811 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.611 -0.714 -23.082 1.00 0.00 C ATOM 1478 CD GLN A 98 -0.372 -1.968 -23.932 1.00 0.00 C ATOM 1479 OE1 GLN A 98 0.645 -2.141 -24.593 1.00 0.00 O ATOM 1480 NE2 GLN A 98 -1.311 -2.882 -23.964 1.00 0.00 N ATOM 0 H GLN A 98 -2.842 0.590 -21.760 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.698 2.205 -22.852 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.435 -0.054 -24.015 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.981 0.562 -24.775 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.351 -0.287 -22.797 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.119 -0.999 -22.160 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -2.165 -2.755 -23.420 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -1.188 -3.720 -24.533 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.770 3.698 -24.627 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.420 4.684 -25.550 1.00 0.00 C ATOM 1491 C GLU A 99 -1.571 4.830 -26.859 1.00 0.00 C ATOM 1492 O GLU A 99 -0.401 5.231 -26.810 1.00 0.00 O ATOM 1493 CB GLU A 99 -2.567 6.042 -24.803 1.00 0.00 C ATOM 1494 CG GLU A 99 -3.639 6.076 -23.676 1.00 0.00 C ATOM 1495 CD GLU A 99 -3.406 7.119 -22.594 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -3.276 8.321 -22.913 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -3.320 6.739 -21.406 1.00 0.00 O ATOM 0 H GLU A 99 -0.775 3.868 -24.482 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.411 4.338 -25.843 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -1.602 6.304 -24.370 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.809 6.814 -25.534 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.614 6.257 -24.129 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.682 5.093 -23.208 1.00 0.00 H new ATOM 1504 N TRP A 100 -2.134 4.487 -28.038 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.375 4.475 -29.331 1.00 0.00 C ATOM 1506 C TRP A 100 -2.317 4.558 -30.570 1.00 0.00 C ATOM 1507 O TRP A 100 -3.347 3.884 -30.591 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.410 3.247 -29.416 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.969 1.863 -29.801 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -0.754 1.221 -31.039 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.774 1.004 -29.073 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.424 -0.017 -31.113 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -2.055 -0.125 -29.884 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -2.296 1.089 -27.757 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.888 -1.156 -29.396 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -3.108 0.057 -27.295 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -3.408 -1.045 -28.103 1.00 0.00 C ATOM 0 H TRP A 100 -3.112 4.213 -28.132 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.761 5.375 -29.347 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.370 3.495 -30.136 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.073 3.144 -28.444 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.149 1.629 -31.835 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.440 -0.678 -31.889 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -2.068 1.936 -27.127 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.119 -2.014 -30.010 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -3.513 0.108 -26.295 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -4.052 -1.823 -27.721 1.00 0.00 H new ATOM 1528 N ASP A 101 -1.940 5.287 -31.646 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.558 5.117 -33.009 1.00 0.00 C ATOM 1530 C ASP A 101 -4.138 5.169 -33.113 1.00 0.00 C ATOM 1531 O ASP A 101 -4.774 4.351 -33.786 1.00 0.00 O ATOM 1532 CB ASP A 101 -1.885 3.840 -33.601 1.00 0.00 C ATOM 1533 CG ASP A 101 -1.932 3.646 -35.111 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -2.153 4.600 -35.879 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -1.749 2.483 -35.524 1.00 0.00 O ATOM 0 H ASP A 101 -1.213 6.001 -31.611 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.354 6.001 -33.613 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -0.838 3.841 -33.296 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.351 2.971 -33.137 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.772 6.111 -32.385 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.252 6.103 -32.167 1.00 0.00 C ATOM 1542 C GLY A 102 -6.901 4.946 -31.349 1.00 0.00 C ATOM 1543 O GLY A 102 -8.067 4.625 -31.583 1.00 0.00 O ATOM 0 H GLY A 102 -4.292 6.890 -31.934 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.515 7.039 -31.674 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.727 6.116 -33.148 1.00 0.00 H new ATOM 1547 N LYS A 103 -6.162 4.316 -30.422 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.565 3.052 -29.738 1.00 0.00 C ATOM 1549 C LYS A 103 -6.105 3.092 -28.240 1.00 0.00 C ATOM 1550 O LYS A 103 -5.060 3.670 -27.908 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.864 1.830 -30.417 1.00 0.00 C ATOM 1552 CG LYS A 103 -6.076 1.585 -31.935 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.820 0.987 -32.614 1.00 0.00 C ATOM 1554 CE LYS A 103 -4.944 0.995 -34.149 1.00 0.00 C ATOM 1555 NZ LYS A 103 -3.630 0.825 -34.823 1.00 0.00 N ATOM 0 H LYS A 103 -5.254 4.665 -30.114 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.649 2.955 -29.806 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.792 1.930 -30.247 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.188 0.932 -29.891 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.920 0.910 -32.078 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.335 2.526 -32.420 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.940 1.557 -32.317 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.670 -0.035 -32.266 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -5.616 0.195 -34.461 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.395 1.934 -34.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.255 1.757 -35.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.965 0.358 -34.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.750 0.241 -35.675 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.826 2.386 -27.346 1.00 0.00 N ATOM 1570 CA GLU A 104 -6.327 2.102 -25.968 1.00 0.00 C ATOM 1571 C GLU A 104 -6.522 0.617 -25.517 1.00 0.00 C ATOM 1572 O GLU A 104 -7.400 -0.103 -26.006 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.850 3.140 -24.933 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.364 3.135 -24.580 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.672 3.885 -23.294 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -8.498 5.119 -23.246 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -9.001 3.228 -22.281 1.00 0.00 O ATOM 0 H GLU A 104 -7.750 2.001 -27.543 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.245 2.227 -26.009 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.293 2.995 -24.007 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.599 4.134 -25.304 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.925 3.583 -25.400 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.707 2.105 -24.485 1.00 0.00 H new ATOM 1584 N SER A 105 -5.686 0.158 -24.562 1.00 0.00 N ATOM 1585 CA SER A 105 -5.849 -1.177 -23.921 1.00 0.00 C ATOM 1586 C SER A 105 -5.383 -1.165 -22.434 1.00 0.00 C ATOM 1587 O SER A 105 -4.291 -0.693 -22.096 1.00 0.00 O ATOM 1588 CB SER A 105 -5.120 -2.268 -24.736 1.00 0.00 C ATOM 1589 OG SER A 105 -5.369 -3.567 -24.194 1.00 0.00 O ATOM 0 H SER A 105 -4.888 0.689 -24.213 1.00 0.00 H new ATOM 0 HA SER A 105 -6.913 -1.416 -23.917 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.452 -2.234 -25.774 1.00 0.00 H new ATOM 0 HB3 SER A 105 -4.048 -2.070 -24.737 1.00 0.00 H new ATOM 0 HG SER A 105 -6.130 -3.524 -23.578 1.00 0.00 H new ATOM 1595 N THR A 106 -6.229 -1.705 -21.541 1.00 0.00 N ATOM 1596 CA THR A 106 -6.049 -1.562 -20.067 1.00 0.00 C ATOM 1597 C THR A 106 -5.527 -2.899 -19.464 1.00 0.00 C ATOM 1598 O THR A 106 -6.269 -3.891 -19.449 1.00 0.00 O ATOM 1599 CB THR A 106 -7.346 -1.062 -19.343 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.240 -2.134 -19.061 1.00 0.00 O ATOM 1601 CG2 THR A 106 -8.169 0.020 -20.067 1.00 0.00 C ATOM 0 H THR A 106 -7.051 -2.249 -21.805 1.00 0.00 H new ATOM 0 HA THR A 106 -5.302 -0.787 -19.898 1.00 0.00 H new ATOM 0 HB THR A 106 -6.935 -0.608 -18.441 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.751 -2.983 -19.086 1.00 0.00 H new ATOM 0 HG21 THR A 106 -9.039 0.280 -19.464 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.553 0.907 -20.216 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.498 -0.360 -21.034 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.291 -2.914 -18.942 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.672 -4.134 -18.348 1.00 0.00 C ATOM 1611 C ILE A 107 -3.834 -4.059 -16.789 1.00 0.00 C ATOM 1612 O ILE A 107 -3.079 -3.344 -16.119 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.172 -4.277 -18.808 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -1.832 -4.080 -20.315 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.539 -5.595 -18.305 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -2.526 -5.028 -21.299 1.00 0.00 C ATOM 0 H ILE A 107 -3.687 -2.093 -18.914 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.176 -5.034 -18.700 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.727 -3.406 -18.327 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -2.084 -3.056 -20.591 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.754 -4.187 -20.439 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.505 -5.654 -18.644 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.566 -5.619 -17.216 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.100 -6.442 -18.700 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -2.210 -4.793 -22.315 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -2.256 -6.058 -21.064 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.606 -4.909 -21.219 1.00 0.00 H new ATOM 1628 N THR A 108 -4.800 -4.791 -16.203 1.00 0.00 N ATOM 1629 CA THR A 108 -5.104 -4.701 -14.741 1.00 0.00 C ATOM 1630 C THR A 108 -4.355 -5.835 -13.965 1.00 0.00 C ATOM 1631 O THR A 108 -4.812 -6.981 -13.905 1.00 0.00 O ATOM 1632 CB THR A 108 -6.651 -4.681 -14.532 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.219 -3.570 -15.223 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.092 -4.517 -13.067 1.00 0.00 C ATOM 0 H THR A 108 -5.389 -5.453 -16.708 1.00 0.00 H new ATOM 0 HA THR A 108 -4.730 -3.767 -14.321 1.00 0.00 H new ATOM 0 HB THR A 108 -6.990 -5.648 -14.902 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.190 -3.564 -15.090 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.181 -4.513 -13.013 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.702 -5.345 -12.475 1.00 0.00 H new ATOM 0 HG23 THR A 108 -6.706 -3.576 -12.674 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.201 -5.498 -13.361 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.342 -6.467 -12.622 1.00 0.00 C ATOM 1644 C ARG A 109 -2.795 -6.528 -11.125 1.00 0.00 C ATOM 1645 O ARG A 109 -2.491 -5.598 -10.367 1.00 0.00 O ATOM 1646 CB ARG A 109 -0.839 -6.047 -12.747 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.254 -5.788 -14.165 1.00 0.00 C ATOM 1648 CD ARG A 109 1.253 -5.440 -14.187 1.00 0.00 C ATOM 1649 NE ARG A 109 2.107 -6.649 -14.394 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.928 -6.865 -15.426 1.00 0.00 C ATOM 1651 NH1 ARG A 109 3.070 -6.052 -16.448 1.00 0.00 N ATOM 1652 NH2 ARG A 109 3.637 -7.958 -15.423 1.00 0.00 N ATOM 0 H ARG A 109 -2.830 -4.548 -13.366 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.449 -7.462 -13.053 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -0.699 -5.139 -12.160 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.238 -6.826 -12.278 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.418 -6.674 -14.778 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -0.809 -4.972 -14.629 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.447 -4.720 -14.982 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.527 -4.960 -13.248 1.00 0.00 H new ATOM 0 HE ARG A 109 2.059 -7.377 -13.681 1.00 0.00 H new ATOM 0 HH11 ARG A 109 2.532 -5.186 -16.490 1.00 0.00 H new ATOM 0 HH12 ARG A 109 3.718 -6.286 -17.200 1.00 0.00 H new ATOM 0 HH21 ARG A 109 3.555 -8.617 -14.649 1.00 0.00 H new ATOM 0 HH22 ARG A 109 4.274 -8.155 -16.195 1.00 0.00 H new ATOM 1666 N LYS A 110 -3.540 -7.572 -10.692 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.120 -7.614 -9.313 1.00 0.00 C ATOM 1668 C LYS A 110 -3.918 -8.974 -8.576 1.00 0.00 C ATOM 1669 O LYS A 110 -3.892 -10.045 -9.188 1.00 0.00 O ATOM 1670 CB LYS A 110 -5.592 -7.120 -9.327 1.00 0.00 C ATOM 1671 CG LYS A 110 -6.659 -7.963 -10.063 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.075 -7.396 -9.798 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.195 -8.051 -10.624 1.00 0.00 C ATOM 1674 NZ LYS A 110 -9.231 -7.489 -12.000 1.00 0.00 N ATOM 0 H LYS A 110 -3.756 -8.390 -11.262 1.00 0.00 H new ATOM 0 HA LYS A 110 -3.547 -6.915 -8.704 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -5.913 -7.014 -8.291 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -5.600 -6.123 -9.766 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.456 -7.964 -11.134 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.607 -8.999 -9.728 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.306 -7.514 -8.739 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.068 -6.326 -10.005 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -9.037 -9.129 -10.670 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -10.156 -7.890 -10.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -9.806 -8.104 -12.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -9.649 -6.537 -11.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -8.264 -7.433 -12.378 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.778 -8.922 -7.239 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.453 -10.117 -6.412 1.00 0.00 C ATOM 1690 C LEU A 111 -4.728 -10.941 -6.042 1.00 0.00 C ATOM 1691 O LEU A 111 -5.611 -10.456 -5.328 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.637 -9.657 -5.157 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.295 -10.380 -4.884 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.459 -11.871 -4.557 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.287 -10.187 -6.025 1.00 0.00 C ATOM 0 H LEU A 111 -3.884 -8.064 -6.698 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.835 -10.802 -6.993 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.432 -8.591 -5.259 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.271 -9.778 -4.279 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.895 -9.901 -3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.479 -12.314 -4.377 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.077 -11.982 -3.666 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.937 -12.377 -5.396 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.638 -10.713 -5.786 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.703 -10.586 -6.950 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.078 -9.125 -6.150 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.821 -12.183 -6.543 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.977 -13.089 -6.289 1.00 0.00 C ATOM 1709 C LYS A 112 -5.424 -14.484 -5.855 1.00 0.00 C ATOM 1710 O LYS A 112 -4.810 -15.197 -6.655 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.871 -13.146 -7.567 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.881 -11.977 -7.715 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.467 -11.734 -9.127 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.224 -12.913 -9.770 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.905 -12.475 -11.026 1.00 0.00 N ATOM 0 H LYS A 112 -4.102 -12.597 -7.137 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.610 -12.723 -5.480 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.224 -13.160 -8.444 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.424 -14.085 -7.564 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.710 -12.155 -7.030 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.389 -11.060 -7.389 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.145 -10.882 -9.073 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.651 -11.450 -9.791 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -8.528 -13.723 -9.990 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.960 -13.306 -9.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -9.963 -13.276 -11.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -10.864 -12.140 -10.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.362 -11.704 -11.464 1.00 0.00 H new ATOM 1729 N ASP A 113 -5.628 -14.849 -4.570 1.00 0.00 N ATOM 1730 CA ASP A 113 -5.155 -16.137 -3.964 1.00 0.00 C ATOM 1731 C ASP A 113 -3.611 -16.420 -4.082 1.00 0.00 C ATOM 1732 O ASP A 113 -3.172 -17.400 -4.693 1.00 0.00 O ATOM 1733 CB ASP A 113 -6.102 -17.285 -4.419 1.00 0.00 C ATOM 1734 CG ASP A 113 -6.032 -18.548 -3.564 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -6.298 -18.461 -2.346 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -5.718 -19.628 -4.107 1.00 0.00 O ATOM 0 H ASP A 113 -6.130 -14.258 -3.907 1.00 0.00 H new ATOM 0 HA ASP A 113 -5.235 -16.054 -2.880 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -7.127 -16.915 -4.413 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.864 -17.547 -5.450 1.00 0.00 H new ATOM 1741 N GLY A 114 -2.770 -15.506 -3.554 1.00 0.00 N ATOM 1742 CA GLY A 114 -1.290 -15.552 -3.788 1.00 0.00 C ATOM 1743 C GLY A 114 -0.714 -15.260 -5.207 1.00 0.00 C ATOM 1744 O GLY A 114 0.507 -15.167 -5.354 1.00 0.00 O ATOM 0 H GLY A 114 -3.075 -14.730 -2.967 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.831 -14.842 -3.100 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.947 -16.545 -3.497 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.565 -15.143 -6.237 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.152 -15.088 -7.662 1.00 0.00 C ATOM 1750 C LYS A 115 -1.465 -13.692 -8.269 1.00 0.00 C ATOM 1751 O LYS A 115 -2.530 -13.109 -8.031 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.889 -16.216 -8.448 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.685 -17.675 -7.959 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.233 -18.191 -8.092 1.00 0.00 C ATOM 1755 CE LYS A 115 0.161 -19.371 -7.184 1.00 0.00 C ATOM 1756 NZ LYS A 115 -0.622 -20.593 -7.517 1.00 0.00 N ATOM 0 H LYS A 115 -2.575 -15.082 -6.110 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.076 -15.244 -7.736 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.957 -15.999 -8.427 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.574 -16.162 -9.490 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -1.988 -17.742 -6.914 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.345 -18.332 -8.525 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.070 -18.488 -9.128 1.00 0.00 H new ATOM 0 HD3 LYS A 115 0.444 -17.362 -7.887 1.00 0.00 H new ATOM 0 HE2 LYS A 115 1.226 -19.577 -7.293 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.006 -19.102 -6.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -0.335 -21.371 -6.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -1.636 -20.401 -7.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.442 -20.862 -8.506 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.554 -13.175 -9.110 1.00 0.00 N ATOM 1771 CA LEU A 116 -0.796 -11.917 -9.862 1.00 0.00 C ATOM 1772 C LEU A 116 -1.614 -12.254 -11.141 1.00 0.00 C ATOM 1773 O LEU A 116 -1.110 -12.827 -12.114 1.00 0.00 O ATOM 1774 CB LEU A 116 0.557 -11.223 -10.145 1.00 0.00 C ATOM 1775 CG LEU A 116 0.497 -9.817 -10.793 1.00 0.00 C ATOM 1776 CD1 LEU A 116 0.150 -8.743 -9.746 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.848 -9.502 -11.449 1.00 0.00 C ATOM 0 H LEU A 116 0.355 -13.601 -9.291 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.388 -11.206 -9.285 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.100 -11.141 -9.204 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.143 -11.872 -10.795 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.287 -9.812 -11.551 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.114 -7.765 -10.226 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.821 -8.966 -9.304 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.911 -8.736 -8.966 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.809 -8.513 -11.906 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.633 -9.522 -10.693 1.00 0.00 H new ATOM 0 HD23 LEU A 116 2.063 -10.247 -12.215 1.00 0.00 H new ATOM 1789 N VAL A 117 -2.906 -11.924 -11.094 1.00 0.00 N ATOM 1790 CA VAL A 117 -3.867 -12.237 -12.180 1.00 0.00 C ATOM 1791 C VAL A 117 -3.954 -10.956 -13.064 1.00 0.00 C ATOM 1792 O VAL A 117 -4.508 -9.921 -12.668 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.212 -12.746 -11.567 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.291 -13.009 -12.637 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -5.044 -14.065 -10.768 1.00 0.00 C ATOM 0 H VAL A 117 -3.326 -11.432 -10.306 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.556 -13.058 -12.826 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.524 -11.939 -10.904 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.203 -13.360 -12.155 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.499 -12.086 -13.178 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.934 -13.767 -13.335 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.009 -14.372 -10.365 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.662 -14.844 -11.428 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.342 -13.907 -9.949 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.333 -11.040 -14.248 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.163 -9.886 -15.169 1.00 0.00 C ATOM 1807 C VAL A 118 -4.327 -9.940 -16.208 1.00 0.00 C ATOM 1808 O VAL A 118 -4.283 -10.689 -17.191 1.00 0.00 O ATOM 1809 CB VAL A 118 -1.716 -9.893 -15.772 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.499 -8.776 -16.815 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.596 -9.752 -14.708 1.00 0.00 C ATOM 0 H VAL A 118 -2.930 -11.907 -14.603 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.237 -8.924 -14.661 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.644 -10.873 -16.244 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.480 -8.829 -17.198 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.203 -8.904 -17.637 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.660 -7.805 -16.347 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.377 -9.765 -15.200 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.719 -8.811 -14.172 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.657 -10.581 -14.003 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.365 -9.133 -15.947 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.602 -9.089 -16.767 1.00 0.00 C ATOM 1823 C GLU A 119 -6.480 -7.929 -17.801 1.00 0.00 C ATOM 1824 O GLU A 119 -6.645 -6.747 -17.473 1.00 0.00 O ATOM 1825 CB GLU A 119 -7.810 -8.952 -15.795 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.114 -10.240 -14.976 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.024 -10.121 -13.758 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -9.948 -9.281 -13.744 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -8.793 -10.841 -12.761 1.00 0.00 O ATOM 0 H GLU A 119 -5.378 -8.486 -15.159 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.755 -9.998 -17.349 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.616 -8.132 -15.104 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.696 -8.682 -16.369 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.559 -10.969 -15.654 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.163 -10.654 -14.642 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.147 -8.280 -19.054 1.00 0.00 N ATOM 1837 CA CYS A 120 -6.050 -7.302 -20.165 1.00 0.00 C ATOM 1838 C CYS A 120 -7.384 -7.174 -20.963 1.00 0.00 C ATOM 1839 O CYS A 120 -8.071 -8.175 -21.205 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.885 -7.717 -21.088 1.00 0.00 C ATOM 1841 SG CYS A 120 -5.379 -8.958 -22.286 1.00 0.00 S ATOM 0 H CYS A 120 -5.938 -9.239 -19.330 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.857 -6.315 -19.744 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -4.508 -6.839 -21.612 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -4.065 -8.104 -20.483 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.508 -9.923 -22.295 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.707 -5.961 -21.437 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.826 -5.745 -22.408 1.00 0.00 C ATOM 1848 C VAL A 121 -8.387 -4.773 -23.553 1.00 0.00 C ATOM 1849 O VAL A 121 -7.752 -3.738 -23.317 1.00 0.00 O ATOM 1850 CB VAL A 121 -10.162 -5.353 -21.684 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -10.132 -4.025 -20.898 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.390 -5.340 -22.622 1.00 0.00 C ATOM 0 H VAL A 121 -7.218 -5.106 -21.172 1.00 0.00 H new ATOM 0 HA VAL A 121 -9.056 -6.690 -22.900 1.00 0.00 H new ATOM 0 HB VAL A 121 -10.261 -6.159 -20.956 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -11.105 -3.852 -20.438 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.368 -4.079 -20.122 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.901 -3.205 -21.578 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.278 -5.061 -22.055 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -11.229 -4.618 -23.422 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.531 -6.332 -23.051 1.00 0.00 H new ATOM 1862 N MET A 122 -8.741 -5.109 -24.805 1.00 0.00 N ATOM 1863 CA MET A 122 -8.721 -4.145 -25.947 1.00 0.00 C ATOM 1864 C MET A 122 -10.110 -3.449 -26.150 1.00 0.00 C ATOM 1865 O MET A 122 -10.200 -2.221 -26.094 1.00 0.00 O ATOM 1866 CB MET A 122 -8.170 -4.906 -27.186 1.00 0.00 C ATOM 1867 CG MET A 122 -7.946 -4.053 -28.449 1.00 0.00 C ATOM 1868 SD MET A 122 -6.714 -2.774 -28.150 1.00 0.00 S ATOM 1869 CE MET A 122 -6.606 -2.061 -29.800 1.00 0.00 C ATOM 0 H MET A 122 -9.049 -6.046 -25.065 1.00 0.00 H new ATOM 0 HA MET A 122 -8.056 -3.304 -25.749 1.00 0.00 H new ATOM 0 HB2 MET A 122 -7.223 -5.372 -26.912 1.00 0.00 H new ATOM 0 HB3 MET A 122 -8.862 -5.711 -27.432 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.621 -4.691 -29.271 1.00 0.00 H new ATOM 0 HG3 MET A 122 -8.886 -3.594 -28.754 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.762 -1.372 -29.844 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.464 -2.856 -30.531 1.00 0.00 H new ATOM 0 HE3 MET A 122 -7.526 -1.522 -30.024 1.00 0.00 H new ATOM 1879 N ASN A 123 -11.178 -4.229 -26.382 1.00 0.00 N ATOM 1880 CA ASN A 123 -12.567 -3.712 -26.556 1.00 0.00 C ATOM 1881 C ASN A 123 -13.562 -4.701 -25.861 1.00 0.00 C ATOM 1882 O ASN A 123 -13.797 -4.590 -24.655 1.00 0.00 O ATOM 1883 CB ASN A 123 -12.831 -3.303 -28.044 1.00 0.00 C ATOM 1884 CG ASN A 123 -12.497 -4.326 -29.150 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -13.058 -5.416 -29.202 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -11.574 -4.027 -30.033 1.00 0.00 N ATOM 0 H ASN A 123 -11.113 -5.244 -26.457 1.00 0.00 H new ATOM 0 HA ASN A 123 -12.734 -2.766 -26.041 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -13.886 -3.045 -28.136 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -12.262 -2.396 -28.246 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -11.326 -4.699 -30.759 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -11.105 -3.122 -29.994 1.00 0.00 H new ATOM 1893 N ASN A 124 -14.080 -5.706 -26.581 1.00 0.00 N ATOM 1894 CA ASN A 124 -14.543 -6.994 -25.975 1.00 0.00 C ATOM 1895 C ASN A 124 -13.449 -8.124 -25.895 1.00 0.00 C ATOM 1896 O ASN A 124 -13.650 -9.095 -25.162 1.00 0.00 O ATOM 1897 CB ASN A 124 -15.785 -7.493 -26.769 1.00 0.00 C ATOM 1898 CG ASN A 124 -17.066 -6.663 -26.607 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -17.440 -5.866 -27.460 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -17.785 -6.823 -25.521 1.00 0.00 N ATOM 0 H ASN A 124 -14.196 -5.665 -27.594 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.791 -6.780 -24.935 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -15.527 -7.523 -27.828 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -15.999 -8.517 -26.464 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -18.644 -6.287 -25.394 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -17.485 -7.483 -24.803 1.00 0.00 H new ATOM 1907 N VAL A 125 -12.319 -8.023 -26.625 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.259 -9.067 -26.692 1.00 0.00 C ATOM 1909 C VAL A 125 -10.342 -8.979 -25.423 1.00 0.00 C ATOM 1910 O VAL A 125 -9.854 -7.901 -25.052 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.475 -8.906 -28.040 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.353 -9.949 -28.188 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.346 -9.024 -29.318 1.00 0.00 C ATOM 0 H VAL A 125 -12.108 -7.204 -27.195 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.693 -10.067 -26.685 1.00 0.00 H new ATOM 0 HB VAL A 125 -10.081 -7.892 -27.969 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -8.838 -9.798 -29.137 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.643 -9.838 -27.368 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -9.782 -10.951 -28.164 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.717 -8.899 -30.200 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.820 -10.005 -29.346 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -12.114 -8.251 -29.308 1.00 0.00 H new ATOM 1923 N THR A 126 -10.138 -10.130 -24.761 1.00 0.00 N ATOM 1924 CA THR A 126 -9.546 -10.189 -23.384 1.00 0.00 C ATOM 1925 C THR A 126 -8.490 -11.329 -23.202 1.00 0.00 C ATOM 1926 O THR A 126 -8.569 -12.385 -23.834 1.00 0.00 O ATOM 1927 CB THR A 126 -10.661 -10.332 -22.293 1.00 0.00 C ATOM 1928 OG1 THR A 126 -11.473 -11.477 -22.529 1.00 0.00 O ATOM 1929 CG2 THR A 126 -11.596 -9.127 -22.135 1.00 0.00 C ATOM 0 H THR A 126 -10.371 -11.045 -25.147 1.00 0.00 H new ATOM 0 HA THR A 126 -9.022 -9.242 -23.256 1.00 0.00 H new ATOM 0 HB THR A 126 -10.091 -10.421 -21.368 1.00 0.00 H new ATOM 0 HG1 THR A 126 -12.159 -11.541 -21.832 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.328 -9.334 -21.354 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.013 -8.247 -21.862 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.113 -8.942 -23.077 1.00 0.00 H new ATOM 1937 N CYS A 127 -7.542 -11.143 -22.258 1.00 0.00 N ATOM 1938 CA CYS A 127 -6.706 -12.255 -21.721 1.00 0.00 C ATOM 1939 C CYS A 127 -6.642 -12.216 -20.164 1.00 0.00 C ATOM 1940 O CYS A 127 -6.335 -11.177 -19.569 1.00 0.00 O ATOM 1941 CB CYS A 127 -5.297 -12.266 -22.361 1.00 0.00 C ATOM 1942 SG CYS A 127 -4.124 -11.158 -21.552 1.00 0.00 S ATOM 0 H CYS A 127 -7.331 -10.234 -21.847 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.186 -13.193 -21.998 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -4.903 -13.282 -22.333 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -5.382 -11.986 -23.411 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.686 -10.003 -21.350 1.00 0.00 H new ATOM 1947 N THR A 128 -6.901 -13.360 -19.507 1.00 0.00 N ATOM 1948 CA THR A 128 -6.691 -13.517 -18.035 1.00 0.00 C ATOM 1949 C THR A 128 -5.392 -14.351 -17.816 1.00 0.00 C ATOM 1950 O THR A 128 -5.393 -15.578 -17.969 1.00 0.00 O ATOM 1951 CB THR A 128 -7.961 -14.155 -17.398 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.102 -13.344 -17.664 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.906 -14.308 -15.870 1.00 0.00 C ATOM 0 H THR A 128 -7.258 -14.199 -19.964 1.00 0.00 H new ATOM 0 HA THR A 128 -6.551 -12.557 -17.538 1.00 0.00 H new ATOM 0 HB THR A 128 -8.018 -15.146 -17.848 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.896 -13.754 -17.261 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.832 -14.760 -15.516 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.064 -14.945 -15.598 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.782 -13.327 -15.410 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.279 -13.675 -17.482 1.00 0.00 N ATOM 1962 CA ARG A 129 -2.947 -14.329 -17.369 1.00 0.00 C ATOM 1963 C ARG A 129 -2.552 -14.560 -15.877 1.00 0.00 C ATOM 1964 O ARG A 129 -2.379 -13.610 -15.108 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.899 -13.481 -18.133 1.00 0.00 C ATOM 1966 CG ARG A 129 -2.028 -13.488 -19.680 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.772 -13.006 -20.430 1.00 0.00 C ATOM 1968 NE ARG A 129 -0.566 -11.542 -20.255 1.00 0.00 N ATOM 1969 CZ ARG A 129 0.501 -10.860 -20.666 1.00 0.00 C ATOM 1970 NH1 ARG A 129 1.500 -11.400 -21.320 1.00 0.00 N ATOM 1971 NH2 ARG A 129 0.553 -9.585 -20.411 1.00 0.00 N ATOM 0 H ARG A 129 -4.267 -12.675 -17.284 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.988 -15.318 -17.825 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -1.969 -12.450 -17.785 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.905 -13.840 -17.868 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -2.264 -14.500 -20.007 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.870 -12.856 -19.964 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.102 -13.545 -20.064 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.868 -13.238 -21.491 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.302 -11.019 -19.782 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.486 -12.396 -21.540 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.291 -10.824 -21.609 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -0.211 -9.134 -19.908 1.00 0.00 H new ATOM 0 HH22 ARG A 129 1.358 -9.037 -20.714 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.396 -15.831 -15.476 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.112 -16.222 -14.063 1.00 0.00 C ATOM 1987 C ILE A 130 -0.561 -16.315 -13.871 1.00 0.00 C ATOM 1988 O ILE A 130 0.111 -17.118 -14.531 1.00 0.00 O ATOM 1989 CB ILE A 130 -2.832 -17.568 -13.671 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.318 -17.743 -14.121 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.706 -17.885 -12.156 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.331 -16.699 -13.626 1.00 0.00 C ATOM 0 H ILE A 130 -2.461 -16.625 -16.112 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.513 -15.462 -13.392 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.275 -18.294 -14.263 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.342 -17.747 -15.211 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.657 -18.725 -13.791 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.218 -18.822 -11.936 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.653 -17.976 -11.890 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.158 -17.080 -11.577 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.321 -16.941 -14.012 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.355 -16.704 -12.536 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.036 -15.710 -13.978 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.012 -15.511 -12.947 1.00 0.00 N ATOM 2005 CA TYR A 131 1.446 -15.495 -12.650 1.00 0.00 C ATOM 2006 C TYR A 131 1.726 -16.016 -11.197 1.00 0.00 C ATOM 2007 O TYR A 131 1.117 -15.557 -10.221 1.00 0.00 O ATOM 2008 CB TYR A 131 1.976 -14.047 -12.845 1.00 0.00 C ATOM 2009 CG TYR A 131 2.140 -13.509 -14.283 1.00 0.00 C ATOM 2010 CD1 TYR A 131 1.060 -12.972 -14.984 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.412 -13.479 -14.868 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.241 -12.420 -16.254 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.595 -12.922 -16.131 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.513 -12.397 -16.824 1.00 0.00 C ATOM 2015 OH TYR A 131 2.689 -11.869 -18.075 1.00 0.00 O ATOM 0 H TYR A 131 -0.553 -14.855 -12.384 1.00 0.00 H new ATOM 0 HA TYR A 131 1.969 -16.164 -13.333 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.303 -13.374 -12.314 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.947 -13.980 -12.354 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.075 -12.983 -14.541 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.257 -13.891 -14.336 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.398 -12.012 -16.793 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.581 -12.898 -16.572 1.00 0.00 H new ATOM 0 HH TYR A 131 3.635 -11.928 -18.325 1.00 0.00 H new ATOM 2025 N GLU A 132 2.681 -16.955 -11.057 1.00 0.00 N ATOM 2026 CA GLU A 132 3.084 -17.535 -9.741 1.00 0.00 C ATOM 2027 C GLU A 132 4.185 -16.710 -8.988 1.00 0.00 C ATOM 2028 O GLU A 132 5.184 -16.304 -9.591 1.00 0.00 O ATOM 2029 CB GLU A 132 3.350 -19.063 -9.907 1.00 0.00 C ATOM 2030 CG GLU A 132 4.503 -19.574 -10.826 1.00 0.00 C ATOM 2031 CD GLU A 132 5.856 -19.930 -10.212 1.00 0.00 C ATOM 2032 OE1 GLU A 132 6.015 -19.900 -8.976 1.00 0.00 O ATOM 2033 OE2 GLU A 132 6.773 -20.285 -10.989 1.00 0.00 O ATOM 0 H GLU A 132 3.200 -17.339 -11.846 1.00 0.00 H new ATOM 0 HA GLU A 132 2.253 -17.445 -9.041 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.530 -19.468 -8.911 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.426 -19.512 -10.271 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.138 -20.460 -11.346 1.00 0.00 H new ATOM 0 HG3 GLU A 132 4.679 -18.810 -11.583 1.00 0.00 H new ATOM 2040 N LYS A 133 3.975 -16.417 -7.676 1.00 0.00 N ATOM 2041 CA LYS A 133 4.944 -15.625 -6.853 1.00 0.00 C ATOM 2042 C LYS A 133 6.202 -16.468 -6.491 1.00 0.00 C ATOM 2043 O LYS A 133 6.172 -17.349 -5.625 1.00 0.00 O ATOM 2044 CB LYS A 133 4.309 -15.034 -5.554 1.00 0.00 C ATOM 2045 CG LYS A 133 5.042 -13.776 -5.003 1.00 0.00 C ATOM 2046 CD LYS A 133 4.404 -13.212 -3.706 1.00 0.00 C ATOM 2047 CE LYS A 133 4.624 -11.701 -3.462 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.041 -11.398 -3.150 1.00 0.00 N ATOM 0 H LYS A 133 3.146 -16.715 -7.162 1.00 0.00 H new ATOM 0 HA LYS A 133 5.242 -14.784 -7.479 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.269 -14.776 -5.756 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.303 -15.804 -4.783 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.084 -14.028 -4.807 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.041 -12.999 -5.768 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.332 -13.406 -3.735 1.00 0.00 H new ATOM 0 HD3 LYS A 133 4.805 -13.762 -2.855 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.318 -11.141 -4.346 1.00 0.00 H new ATOM 0 HE3 LYS A 133 3.991 -11.369 -2.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.157 -10.372 -3.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.316 -11.886 -2.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.646 -11.723 -3.931 1.00 0.00 H new ATOM 2062 N VAL A 134 7.309 -16.146 -7.157 1.00 0.00 N ATOM 2063 CA VAL A 134 8.639 -16.746 -6.897 1.00 0.00 C ATOM 2064 C VAL A 134 9.407 -15.717 -6.005 1.00 0.00 C ATOM 2065 O VAL A 134 9.502 -14.530 -6.341 1.00 0.00 O ATOM 2066 CB VAL A 134 9.430 -17.064 -8.220 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.506 -18.145 -7.976 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.622 -17.537 -9.449 1.00 0.00 C ATOM 0 H VAL A 134 7.320 -15.453 -7.905 1.00 0.00 H new ATOM 0 HA VAL A 134 8.531 -17.709 -6.399 1.00 0.00 H new ATOM 0 HB VAL A 134 9.832 -16.082 -8.468 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.038 -18.346 -8.906 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.212 -17.793 -7.224 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.029 -19.060 -7.626 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.300 -17.717 -10.283 1.00 0.00 H new ATOM 0 HG22 VAL A 134 8.095 -18.459 -9.205 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.900 -16.769 -9.727 1.00 0.00 H new ATOM 2078 N GLU A 135 9.975 -16.171 -4.884 1.00 0.00 N ATOM 2079 CA GLU A 135 10.657 -15.269 -3.917 1.00 0.00 C ATOM 2080 C GLU A 135 12.176 -15.582 -3.962 1.00 0.00 C ATOM 2081 O GLU A 135 12.614 -16.657 -3.496 1.00 0.00 O ATOM 2082 CB GLU A 135 9.997 -15.389 -2.518 1.00 0.00 C ATOM 2083 CG GLU A 135 8.484 -15.031 -2.425 1.00 0.00 C ATOM 2084 CD GLU A 135 8.114 -13.559 -2.578 1.00 0.00 C ATOM 2085 OE1 GLU A 135 8.249 -12.987 -3.685 1.00 0.00 O ATOM 2086 OE2 GLU A 135 7.578 -12.974 -1.610 1.00 0.00 O ATOM 2087 OXT GLU A 135 12.941 -14.775 -4.546 1.00 0.00 O ATOM 0 H GLU A 135 9.983 -17.154 -4.613 1.00 0.00 H new ATOM 0 HA GLU A 135 10.544 -14.218 -4.182 1.00 0.00 H new ATOM 0 HB2 GLU A 135 10.126 -16.413 -2.167 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.542 -14.745 -1.828 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.954 -15.596 -3.192 1.00 0.00 H new ATOM 0 HG3 GLU A 135 8.112 -15.376 -1.460 1.00 0.00 H new