USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 760 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 35 ASN :FLIP amide:sc= -3.57! F(o=-4,f=-2.9!) USER MOD Set 1.2: A 65 SER OG : rot 131:sc= 0.626 USER MOD Set 2.1: A 59 GLN : amide:sc= -0.547 X(o=-0.39,f=-0.74!) USER MOD Set 2.2: A 61 TYR OH : rot 180:sc= 0.158 USER MOD Set 3.1: A 43 LYS NZ :NH3+ 149:sc= 0.853 (180deg=-1.31) USER MOD Set 3.2: A 45 THR OG1 : rot -170:sc= 0.723 USER MOD Single : A 1 GLY N :NH3+ 142:sc= 0.0104 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 72:sc= 1.34 USER MOD Single : A 13 GLN : amide:sc= -0.0862 K(o=-0.086,f=-1.5!) USER MOD Single : A 14 ASN : amide:sc= -0.0402 X(o=-0.04,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -1.24 K(o=-1.2,f=-1.9) USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= 0.769 (180deg=0.642) USER MOD Single : A 28 GLN : amide:sc= -0.665 K(o=-0.67,f=-4.4!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -63:sc= -0.926! USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -116:sc= 1.17 (180deg=-0.19) USER MOD Single : A 41 CYS SG : rot 137:sc= -1.66! USER MOD Single : A 42 MET CE :methyl -154:sc= -0.324 (180deg=-1.46!) USER MOD Single : A 44 LYS NZ :NH3+ 168:sc= 0.00244 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -1.03 X(o=-1,f=-0.85) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot -46:sc= 0.23 USER MOD Single : A 58 TYR OH : rot 47:sc= 1.99 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -121:sc= -1.06 (180deg=-2.83!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -1.95! C(o=-1.9!,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 152.570 -5.291 14.795 1.00 0.00 N ATOM 2 CA GLY A 1 151.506 -5.666 13.823 1.00 0.00 C ATOM 3 C GLY A 1 150.137 -5.759 14.468 1.00 0.00 C ATOM 4 O GLY A 1 149.834 -6.730 15.163 1.00 0.00 O ATOM 0 H1 GLY A 1 153.440 -5.817 14.577 1.00 0.00 H new ATOM 0 H2 GLY A 1 152.756 -4.270 14.729 1.00 0.00 H new ATOM 0 H3 GLY A 1 152.257 -5.524 15.759 1.00 0.00 H new ATOM 0 HA2 GLY A 1 151.476 -4.930 13.020 1.00 0.00 H new ATOM 0 HA3 GLY A 1 151.756 -6.624 13.368 1.00 0.00 H new ATOM 10 N GLU A 2 149.307 -4.745 14.240 1.00 0.00 N ATOM 11 CA GLU A 2 147.962 -4.717 14.807 1.00 0.00 C ATOM 12 C GLU A 2 146.922 -4.425 13.730 1.00 0.00 C ATOM 13 O GLU A 2 147.257 -3.967 12.638 1.00 0.00 O ATOM 14 CB GLU A 2 147.875 -3.665 15.913 1.00 0.00 C ATOM 15 CG GLU A 2 146.984 -4.075 17.074 1.00 0.00 C ATOM 16 CD GLU A 2 146.195 -2.912 17.643 1.00 0.00 C ATOM 17 OE1 GLU A 2 145.629 -2.133 16.846 1.00 0.00 O ATOM 18 OE2 GLU A 2 146.140 -2.781 18.882 1.00 0.00 O ATOM 0 H GLU A 2 149.541 -3.934 13.668 1.00 0.00 H new ATOM 0 HA GLU A 2 147.753 -5.699 15.231 1.00 0.00 H new ATOM 0 HB2 GLU A 2 148.878 -3.462 16.289 1.00 0.00 H new ATOM 0 HB3 GLU A 2 147.499 -2.734 15.489 1.00 0.00 H new ATOM 0 HG2 GLU A 2 146.293 -4.850 16.741 1.00 0.00 H new ATOM 0 HG3 GLU A 2 147.598 -4.513 17.861 1.00 0.00 H new ATOM 25 N TRP A 3 145.656 -4.690 14.047 1.00 0.00 N ATOM 26 CA TRP A 3 144.556 -4.456 13.112 1.00 0.00 C ATOM 27 C TRP A 3 144.523 -5.526 12.020 1.00 0.00 C ATOM 28 O TRP A 3 143.526 -6.231 11.866 1.00 0.00 O ATOM 29 CB TRP A 3 144.672 -3.064 12.480 1.00 0.00 C ATOM 30 CG TRP A 3 143.459 -2.213 12.697 1.00 0.00 C ATOM 31 CD1 TRP A 3 142.155 -2.615 12.651 1.00 0.00 C ATOM 32 CD2 TRP A 3 143.436 -0.812 12.997 1.00 0.00 C ATOM 33 NE1 TRP A 3 141.324 -1.551 12.902 1.00 0.00 N ATOM 34 CE2 TRP A 3 142.086 -0.433 13.117 1.00 0.00 C ATOM 35 CE3 TRP A 3 144.428 0.158 13.175 1.00 0.00 C ATOM 36 CZ2 TRP A 3 141.702 0.874 13.408 1.00 0.00 C ATOM 37 CZ3 TRP A 3 144.044 1.454 13.463 1.00 0.00 C ATOM 38 CH2 TRP A 3 142.694 1.803 13.577 1.00 0.00 C ATOM 0 H TRP A 3 145.365 -5.069 14.948 1.00 0.00 H new ATOM 0 HA TRP A 3 143.624 -4.512 13.675 1.00 0.00 H new ATOM 0 HB2 TRP A 3 145.543 -2.556 12.894 1.00 0.00 H new ATOM 0 HB3 TRP A 3 144.845 -3.172 11.409 1.00 0.00 H new ATOM 0 HD1 TRP A 3 141.825 -3.623 12.447 1.00 0.00 H new ATOM 0 HE1 TRP A 3 140.305 -1.587 12.925 1.00 0.00 H new ATOM 0 HE3 TRP A 3 145.473 -0.101 13.089 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 140.660 1.145 13.497 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 144.801 2.212 13.603 1.00 0.00 H new ATOM 0 HH2 TRP A 3 142.429 2.825 13.803 1.00 0.00 H new ATOM 49 N GLU A 4 145.614 -5.634 11.265 1.00 0.00 N ATOM 50 CA GLU A 4 145.717 -6.613 10.182 1.00 0.00 C ATOM 51 C GLU A 4 144.495 -6.566 9.268 1.00 0.00 C ATOM 52 O GLU A 4 143.598 -5.743 9.452 1.00 0.00 O ATOM 53 CB GLU A 4 145.906 -8.025 10.749 1.00 0.00 C ATOM 54 CG GLU A 4 144.667 -8.596 11.423 1.00 0.00 C ATOM 55 CD GLU A 4 144.740 -10.100 11.600 1.00 0.00 C ATOM 56 OE1 GLU A 4 145.484 -10.558 12.492 1.00 0.00 O ATOM 57 OE2 GLU A 4 144.053 -10.819 10.844 1.00 0.00 O ATOM 0 H GLU A 4 146.444 -5.053 11.383 1.00 0.00 H new ATOM 0 HA GLU A 4 146.591 -6.354 9.584 1.00 0.00 H new ATOM 0 HB2 GLU A 4 146.207 -8.692 9.941 1.00 0.00 H new ATOM 0 HB3 GLU A 4 146.724 -8.009 11.470 1.00 0.00 H new ATOM 0 HG2 GLU A 4 144.539 -8.125 12.398 1.00 0.00 H new ATOM 0 HG3 GLU A 4 143.787 -8.346 10.830 1.00 0.00 H new ATOM 64 N ILE A 5 144.472 -7.451 8.274 1.00 0.00 N ATOM 65 CA ILE A 5 143.371 -7.512 7.324 1.00 0.00 C ATOM 66 C ILE A 5 142.024 -7.635 8.035 1.00 0.00 C ATOM 67 O ILE A 5 141.864 -8.443 8.948 1.00 0.00 O ATOM 68 CB ILE A 5 143.539 -8.696 6.349 1.00 0.00 C ATOM 69 CG1 ILE A 5 142.457 -8.659 5.266 1.00 0.00 C ATOM 70 CG2 ILE A 5 143.498 -10.018 7.102 1.00 0.00 C ATOM 71 CD1 ILE A 5 142.889 -7.942 4.005 1.00 0.00 C ATOM 0 H ILE A 5 145.208 -8.137 8.108 1.00 0.00 H new ATOM 0 HA ILE A 5 143.390 -6.579 6.761 1.00 0.00 H new ATOM 0 HB ILE A 5 144.511 -8.607 5.865 1.00 0.00 H new ATOM 0 HG12 ILE A 5 142.171 -9.680 5.014 1.00 0.00 H new ATOM 0 HG13 ILE A 5 141.569 -8.169 5.667 1.00 0.00 H new ATOM 0 HG21 ILE A 5 143.618 -10.842 6.398 1.00 0.00 H new ATOM 0 HG22 ILE A 5 144.306 -10.045 7.834 1.00 0.00 H new ATOM 0 HG23 ILE A 5 142.541 -10.115 7.614 1.00 0.00 H new ATOM 0 HD11 ILE A 5 142.074 -7.954 3.282 1.00 0.00 H new ATOM 0 HD12 ILE A 5 143.147 -6.910 4.243 1.00 0.00 H new ATOM 0 HD13 ILE A 5 143.758 -8.444 3.580 1.00 0.00 H new ATOM 83 N ILE A 6 141.059 -6.825 7.607 1.00 0.00 N ATOM 84 CA ILE A 6 139.727 -6.842 8.200 1.00 0.00 C ATOM 85 C ILE A 6 138.649 -6.948 7.126 1.00 0.00 C ATOM 86 O ILE A 6 137.976 -7.974 7.007 1.00 0.00 O ATOM 87 CB ILE A 6 139.470 -5.579 9.049 1.00 0.00 C ATOM 88 CG1 ILE A 6 140.601 -5.373 10.060 1.00 0.00 C ATOM 89 CG2 ILE A 6 138.127 -5.678 9.760 1.00 0.00 C ATOM 90 CD1 ILE A 6 141.146 -3.962 10.077 1.00 0.00 C ATOM 0 H ILE A 6 141.176 -6.149 6.852 1.00 0.00 H new ATOM 0 HA ILE A 6 139.681 -7.719 8.846 1.00 0.00 H new ATOM 0 HB ILE A 6 139.443 -4.716 8.384 1.00 0.00 H new ATOM 0 HG12 ILE A 6 140.238 -5.626 11.056 1.00 0.00 H new ATOM 0 HG13 ILE A 6 141.412 -6.065 9.832 1.00 0.00 H new ATOM 0 HG21 ILE A 6 137.963 -4.779 10.354 1.00 0.00 H new ATOM 0 HG22 ILE A 6 137.331 -5.776 9.022 1.00 0.00 H new ATOM 0 HG23 ILE A 6 138.125 -6.550 10.414 1.00 0.00 H new ATOM 0 HD11 ILE A 6 141.944 -3.889 10.816 1.00 0.00 H new ATOM 0 HD12 ILE A 6 141.540 -3.712 9.092 1.00 0.00 H new ATOM 0 HD13 ILE A 6 140.347 -3.267 10.335 1.00 0.00 H new ATOM 102 N GLU A 7 138.488 -5.885 6.346 1.00 0.00 N ATOM 103 CA GLU A 7 137.489 -5.858 5.282 1.00 0.00 C ATOM 104 C GLU A 7 138.119 -6.203 3.936 1.00 0.00 C ATOM 105 O GLU A 7 139.340 -6.292 3.816 1.00 0.00 O ATOM 106 CB GLU A 7 136.826 -4.482 5.209 1.00 0.00 C ATOM 107 CG GLU A 7 136.448 -3.912 6.567 1.00 0.00 C ATOM 108 CD GLU A 7 136.218 -2.414 6.528 1.00 0.00 C ATOM 109 OE1 GLU A 7 136.881 -1.733 5.718 1.00 0.00 O ATOM 110 OE2 GLU A 7 135.376 -1.921 7.308 1.00 0.00 O ATOM 0 H GLU A 7 139.037 -5.029 6.430 1.00 0.00 H new ATOM 0 HA GLU A 7 136.731 -6.607 5.512 1.00 0.00 H new ATOM 0 HB2 GLU A 7 137.503 -3.789 4.710 1.00 0.00 H new ATOM 0 HB3 GLU A 7 135.930 -4.553 4.592 1.00 0.00 H new ATOM 0 HG2 GLU A 7 135.544 -4.405 6.925 1.00 0.00 H new ATOM 0 HG3 GLU A 7 137.238 -4.136 7.283 1.00 0.00 H new ATOM 117 N ILE A 8 137.276 -6.396 2.926 1.00 0.00 N ATOM 118 CA ILE A 8 137.751 -6.730 1.589 1.00 0.00 C ATOM 119 C ILE A 8 137.060 -5.886 0.518 1.00 0.00 C ATOM 120 O ILE A 8 137.218 -6.139 -0.677 1.00 0.00 O ATOM 121 CB ILE A 8 137.528 -8.221 1.270 1.00 0.00 C ATOM 122 CG1 ILE A 8 138.020 -9.093 2.426 1.00 0.00 C ATOM 123 CG2 ILE A 8 138.233 -8.600 -0.023 1.00 0.00 C ATOM 124 CD1 ILE A 8 137.518 -10.519 2.365 1.00 0.00 C ATOM 0 H ILE A 8 136.262 -6.327 3.009 1.00 0.00 H new ATOM 0 HA ILE A 8 138.819 -6.514 1.578 1.00 0.00 H new ATOM 0 HB ILE A 8 136.459 -8.391 1.141 1.00 0.00 H new ATOM 0 HG12 ILE A 8 139.110 -9.100 2.426 1.00 0.00 H new ATOM 0 HG13 ILE A 8 137.704 -8.645 3.368 1.00 0.00 H new ATOM 0 HG21 ILE A 8 138.065 -9.656 -0.233 1.00 0.00 H new ATOM 0 HG22 ILE A 8 137.838 -8.000 -0.842 1.00 0.00 H new ATOM 0 HG23 ILE A 8 139.303 -8.416 0.078 1.00 0.00 H new ATOM 0 HD11 ILE A 8 137.907 -11.078 3.216 1.00 0.00 H new ATOM 0 HD12 ILE A 8 136.428 -10.523 2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 8 137.857 -10.985 1.439 1.00 0.00 H new ATOM 136 N GLY A 9 136.297 -4.883 0.946 1.00 0.00 N ATOM 137 CA GLY A 9 135.602 -4.027 0.002 1.00 0.00 C ATOM 138 C GLY A 9 136.294 -2.688 -0.181 1.00 0.00 C ATOM 139 O GLY A 9 137.234 -2.577 -0.968 1.00 0.00 O ATOM 0 H GLY A 9 136.148 -4.649 1.928 1.00 0.00 H new ATOM 0 HA2 GLY A 9 135.534 -4.533 -0.961 1.00 0.00 H new ATOM 0 HA3 GLY A 9 134.582 -3.862 0.348 1.00 0.00 H new ATOM 143 N PRO A 10 135.853 -1.644 0.544 1.00 0.00 N ATOM 144 CA PRO A 10 136.454 -0.309 0.449 1.00 0.00 C ATOM 145 C PRO A 10 137.899 -0.301 0.932 1.00 0.00 C ATOM 146 O PRO A 10 138.735 0.435 0.411 1.00 0.00 O ATOM 147 CB PRO A 10 135.576 0.552 1.363 1.00 0.00 C ATOM 148 CG PRO A 10 134.928 -0.414 2.295 1.00 0.00 C ATOM 149 CD PRO A 10 134.744 -1.683 1.512 1.00 0.00 C ATOM 0 HA PRO A 10 136.490 0.051 -0.579 1.00 0.00 H new ATOM 0 HB2 PRO A 10 136.172 1.286 1.906 1.00 0.00 H new ATOM 0 HB3 PRO A 10 134.833 1.106 0.789 1.00 0.00 H new ATOM 0 HG2 PRO A 10 135.549 -0.584 3.174 1.00 0.00 H new ATOM 0 HG3 PRO A 10 133.971 -0.032 2.650 1.00 0.00 H new ATOM 0 HD2 PRO A 10 134.799 -2.563 2.153 1.00 0.00 H new ATOM 0 HD3 PRO A 10 133.775 -1.712 1.014 1.00 0.00 H new ATOM 157 N PHE A 11 138.184 -1.131 1.932 1.00 0.00 N ATOM 158 CA PHE A 11 139.526 -1.234 2.492 1.00 0.00 C ATOM 159 C PHE A 11 140.566 -1.420 1.389 1.00 0.00 C ATOM 160 O PHE A 11 141.712 -0.995 1.525 1.00 0.00 O ATOM 161 CB PHE A 11 139.591 -2.402 3.481 1.00 0.00 C ATOM 162 CG PHE A 11 140.946 -2.612 4.098 1.00 0.00 C ATOM 163 CD1 PHE A 11 141.997 -3.106 3.343 1.00 0.00 C ATOM 164 CD2 PHE A 11 141.166 -2.323 5.437 1.00 0.00 C ATOM 165 CE1 PHE A 11 143.243 -3.305 3.908 1.00 0.00 C ATOM 166 CE2 PHE A 11 142.409 -2.523 6.006 1.00 0.00 C ATOM 167 CZ PHE A 11 143.449 -3.015 5.241 1.00 0.00 C ATOM 0 H PHE A 11 137.498 -1.745 2.372 1.00 0.00 H new ATOM 0 HA PHE A 11 139.751 -0.306 3.018 1.00 0.00 H new ATOM 0 HB2 PHE A 11 138.865 -2.231 4.276 1.00 0.00 H new ATOM 0 HB3 PHE A 11 139.293 -3.316 2.967 1.00 0.00 H new ATOM 0 HD1 PHE A 11 141.841 -3.339 2.300 1.00 0.00 H new ATOM 0 HD2 PHE A 11 140.357 -1.938 6.041 1.00 0.00 H new ATOM 0 HE1 PHE A 11 144.054 -3.687 3.306 1.00 0.00 H new ATOM 0 HE2 PHE A 11 142.568 -2.295 7.050 1.00 0.00 H new ATOM 0 HZ PHE A 11 144.421 -3.172 5.685 1.00 0.00 H new ATOM 177 N THR A 12 140.153 -2.057 0.297 1.00 0.00 N ATOM 178 CA THR A 12 141.045 -2.299 -0.831 1.00 0.00 C ATOM 179 C THR A 12 141.039 -1.113 -1.792 1.00 0.00 C ATOM 180 O THR A 12 142.064 -0.458 -1.999 1.00 0.00 O ATOM 181 CB THR A 12 140.634 -3.578 -1.570 1.00 0.00 C ATOM 182 OG1 THR A 12 139.402 -4.073 -1.073 1.00 0.00 O ATOM 183 CG2 THR A 12 141.654 -4.692 -1.457 1.00 0.00 C ATOM 0 H THR A 12 139.206 -2.415 0.170 1.00 0.00 H new ATOM 0 HA THR A 12 142.056 -2.423 -0.444 1.00 0.00 H new ATOM 0 HB THR A 12 140.550 -3.289 -2.618 1.00 0.00 H new ATOM 0 HG1 THR A 12 138.672 -3.492 -1.371 1.00 0.00 H new ATOM 0 HG21 THR A 12 141.300 -5.567 -2.003 1.00 0.00 H new ATOM 0 HG22 THR A 12 142.603 -4.361 -1.879 1.00 0.00 H new ATOM 0 HG23 THR A 12 141.795 -4.951 -0.408 1.00 0.00 H new ATOM 191 N GLN A 13 139.877 -0.838 -2.375 1.00 0.00 N ATOM 192 CA GLN A 13 139.734 0.272 -3.312 1.00 0.00 C ATOM 193 C GLN A 13 140.383 1.539 -2.758 1.00 0.00 C ATOM 194 O GLN A 13 140.851 2.391 -3.515 1.00 0.00 O ATOM 195 CB GLN A 13 138.255 0.522 -3.609 1.00 0.00 C ATOM 196 CG GLN A 13 138.018 1.376 -4.844 1.00 0.00 C ATOM 197 CD GLN A 13 138.003 0.561 -6.121 1.00 0.00 C ATOM 198 OE1 GLN A 13 137.626 -0.611 -6.119 1.00 0.00 O ATOM 199 NE2 GLN A 13 138.416 1.179 -7.222 1.00 0.00 N ATOM 0 H GLN A 13 139.020 -1.368 -2.216 1.00 0.00 H new ATOM 0 HA GLN A 13 140.242 0.006 -4.239 1.00 0.00 H new ATOM 0 HB2 GLN A 13 137.752 -0.436 -3.738 1.00 0.00 H new ATOM 0 HB3 GLN A 13 137.797 1.009 -2.748 1.00 0.00 H new ATOM 0 HG2 GLN A 13 137.068 1.901 -4.741 1.00 0.00 H new ATOM 0 HG3 GLN A 13 138.797 2.136 -4.911 1.00 0.00 H new ATOM 0 HE21 GLN A 13 138.720 2.152 -7.177 1.00 0.00 H new ATOM 0 HE22 GLN A 13 138.429 0.681 -8.112 1.00 0.00 H new ATOM 208 N ASN A 14 140.411 1.651 -1.432 1.00 0.00 N ATOM 209 CA ASN A 14 141.008 2.803 -0.771 1.00 0.00 C ATOM 210 C ASN A 14 142.444 3.005 -1.230 1.00 0.00 C ATOM 211 O ASN A 14 142.767 4.019 -1.850 1.00 0.00 O ATOM 212 CB ASN A 14 140.963 2.623 0.747 1.00 0.00 C ATOM 213 CG ASN A 14 140.201 3.735 1.440 1.00 0.00 C ATOM 214 OD1 ASN A 14 140.746 4.441 2.287 1.00 0.00 O ATOM 215 ND2 ASN A 14 138.933 3.895 1.082 1.00 0.00 N ATOM 0 H ASN A 14 140.025 0.954 -0.795 1.00 0.00 H new ATOM 0 HA ASN A 14 140.432 3.688 -1.041 1.00 0.00 H new ATOM 0 HB2 ASN A 14 140.497 1.666 0.983 1.00 0.00 H new ATOM 0 HB3 ASN A 14 141.981 2.587 1.136 1.00 0.00 H new ATOM 0 HD21 ASN A 14 138.370 4.627 1.514 1.00 0.00 H new ATOM 0 HD22 ASN A 14 138.522 3.286 0.375 1.00 0.00 H new ATOM 222 N LEU A 15 143.303 2.032 -0.937 1.00 0.00 N ATOM 223 CA LEU A 15 144.700 2.116 -1.343 1.00 0.00 C ATOM 224 C LEU A 15 144.784 2.500 -2.813 1.00 0.00 C ATOM 225 O LEU A 15 145.726 3.165 -3.244 1.00 0.00 O ATOM 226 CB LEU A 15 145.420 0.790 -1.098 1.00 0.00 C ATOM 227 CG LEU A 15 146.876 0.924 -0.643 1.00 0.00 C ATOM 228 CD1 LEU A 15 147.103 0.173 0.661 1.00 0.00 C ATOM 229 CD2 LEU A 15 147.826 0.423 -1.722 1.00 0.00 C ATOM 0 H LEU A 15 143.058 1.185 -0.425 1.00 0.00 H new ATOM 0 HA LEU A 15 145.192 2.882 -0.743 1.00 0.00 H new ATOM 0 HB2 LEU A 15 144.869 0.227 -0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 15 145.394 0.203 -2.016 1.00 0.00 H new ATOM 0 HG LEU A 15 147.082 1.980 -0.470 1.00 0.00 H new ATOM 0 HD11 LEU A 15 148.144 0.281 0.967 1.00 0.00 H new ATOM 0 HD12 LEU A 15 146.453 0.582 1.435 1.00 0.00 H new ATOM 0 HD13 LEU A 15 146.875 -0.883 0.517 1.00 0.00 H new ATOM 0 HD21 LEU A 15 148.855 0.527 -1.378 1.00 0.00 H new ATOM 0 HD22 LEU A 15 147.618 -0.626 -1.931 1.00 0.00 H new ATOM 0 HD23 LEU A 15 147.686 1.009 -2.631 1.00 0.00 H new ATOM 241 N GLY A 16 143.768 2.095 -3.575 1.00 0.00 N ATOM 242 CA GLY A 16 143.725 2.428 -4.983 1.00 0.00 C ATOM 243 C GLY A 16 143.765 3.925 -5.202 1.00 0.00 C ATOM 244 O GLY A 16 144.454 4.411 -6.099 1.00 0.00 O ATOM 0 H GLY A 16 142.978 1.544 -3.239 1.00 0.00 H new ATOM 0 HA2 GLY A 16 144.568 1.962 -5.494 1.00 0.00 H new ATOM 0 HA3 GLY A 16 142.818 2.019 -5.427 1.00 0.00 H new ATOM 248 N LYS A 17 143.036 4.663 -4.366 1.00 0.00 N ATOM 249 CA LYS A 17 143.014 6.116 -4.469 1.00 0.00 C ATOM 250 C LYS A 17 144.413 6.674 -4.234 1.00 0.00 C ATOM 251 O LYS A 17 144.880 7.553 -4.962 1.00 0.00 O ATOM 252 CB LYS A 17 142.033 6.711 -3.457 1.00 0.00 C ATOM 253 CG LYS A 17 141.239 7.889 -4.001 1.00 0.00 C ATOM 254 CD LYS A 17 141.246 9.065 -3.037 1.00 0.00 C ATOM 255 CE LYS A 17 141.489 10.379 -3.762 1.00 0.00 C ATOM 256 NZ LYS A 17 142.918 10.796 -3.694 1.00 0.00 N ATOM 0 H LYS A 17 142.459 4.280 -3.617 1.00 0.00 H new ATOM 0 HA LYS A 17 142.684 6.390 -5.471 1.00 0.00 H new ATOM 0 HB2 LYS A 17 141.340 5.934 -3.135 1.00 0.00 H new ATOM 0 HB3 LYS A 17 142.585 7.032 -2.574 1.00 0.00 H new ATOM 0 HG2 LYS A 17 141.659 8.200 -4.958 1.00 0.00 H new ATOM 0 HG3 LYS A 17 140.211 7.579 -4.190 1.00 0.00 H new ATOM 0 HD2 LYS A 17 140.293 9.110 -2.510 1.00 0.00 H new ATOM 0 HD3 LYS A 17 142.020 8.915 -2.284 1.00 0.00 H new ATOM 0 HE2 LYS A 17 141.190 10.279 -4.805 1.00 0.00 H new ATOM 0 HE3 LYS A 17 140.863 11.156 -3.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 143.041 11.696 -4.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 143.197 10.917 -2.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 143.514 10.066 -4.135 1.00 0.00 H new ATOM 270 N PHE A 18 145.084 6.142 -3.217 1.00 0.00 N ATOM 271 CA PHE A 18 146.436 6.569 -2.884 1.00 0.00 C ATOM 272 C PHE A 18 147.451 5.969 -3.853 1.00 0.00 C ATOM 273 O PHE A 18 148.593 6.419 -3.930 1.00 0.00 O ATOM 274 CB PHE A 18 146.784 6.177 -1.448 1.00 0.00 C ATOM 275 CG PHE A 18 145.871 6.784 -0.422 1.00 0.00 C ATOM 276 CD1 PHE A 18 144.625 6.232 -0.169 1.00 0.00 C ATOM 277 CD2 PHE A 18 146.259 7.909 0.290 1.00 0.00 C ATOM 278 CE1 PHE A 18 143.784 6.789 0.775 1.00 0.00 C ATOM 279 CE2 PHE A 18 145.422 8.471 1.235 1.00 0.00 C ATOM 280 CZ PHE A 18 144.182 7.911 1.478 1.00 0.00 C ATOM 0 H PHE A 18 144.711 5.413 -2.609 1.00 0.00 H new ATOM 0 HA PHE A 18 146.477 7.655 -2.971 1.00 0.00 H new ATOM 0 HB2 PHE A 18 146.748 5.091 -1.358 1.00 0.00 H new ATOM 0 HB3 PHE A 18 147.809 6.481 -1.235 1.00 0.00 H new ATOM 0 HD1 PHE A 18 144.308 5.356 -0.716 1.00 0.00 H new ATOM 0 HD2 PHE A 18 147.227 8.351 0.104 1.00 0.00 H new ATOM 0 HE1 PHE A 18 142.816 6.348 0.964 1.00 0.00 H new ATOM 0 HE2 PHE A 18 145.736 9.347 1.783 1.00 0.00 H new ATOM 0 HZ PHE A 18 143.525 8.349 2.215 1.00 0.00 H new ATOM 290 N ALA A 19 147.023 4.955 -4.595 1.00 0.00 N ATOM 291 CA ALA A 19 147.890 4.299 -5.565 1.00 0.00 C ATOM 292 C ALA A 19 148.286 5.274 -6.665 1.00 0.00 C ATOM 293 O ALA A 19 149.464 5.405 -6.999 1.00 0.00 O ATOM 294 CB ALA A 19 147.200 3.078 -6.156 1.00 0.00 C ATOM 0 H ALA A 19 146.080 4.569 -4.543 1.00 0.00 H new ATOM 0 HA ALA A 19 148.794 3.968 -5.054 1.00 0.00 H new ATOM 0 HB1 ALA A 19 147.862 2.600 -6.878 1.00 0.00 H new ATOM 0 HB2 ALA A 19 146.963 2.373 -5.359 1.00 0.00 H new ATOM 0 HB3 ALA A 19 146.280 3.385 -6.654 1.00 0.00 H new ATOM 300 N VAL A 20 147.294 5.966 -7.216 1.00 0.00 N ATOM 301 CA VAL A 20 147.538 6.941 -8.269 1.00 0.00 C ATOM 302 C VAL A 20 148.237 8.171 -7.705 1.00 0.00 C ATOM 303 O VAL A 20 149.144 8.723 -8.326 1.00 0.00 O ATOM 304 CB VAL A 20 146.228 7.370 -8.957 1.00 0.00 C ATOM 305 CG1 VAL A 20 146.518 8.280 -10.140 1.00 0.00 C ATOM 306 CG2 VAL A 20 145.430 6.151 -9.393 1.00 0.00 C ATOM 0 H VAL A 20 146.314 5.869 -6.950 1.00 0.00 H new ATOM 0 HA VAL A 20 148.179 6.464 -9.011 1.00 0.00 H new ATOM 0 HB VAL A 20 145.628 7.929 -8.239 1.00 0.00 H new ATOM 0 HG11 VAL A 20 145.580 8.572 -10.613 1.00 0.00 H new ATOM 0 HG12 VAL A 20 147.043 9.170 -9.794 1.00 0.00 H new ATOM 0 HG13 VAL A 20 147.139 7.751 -10.863 1.00 0.00 H new ATOM 0 HG21 VAL A 20 144.508 6.474 -9.877 1.00 0.00 H new ATOM 0 HG22 VAL A 20 146.021 5.561 -10.094 1.00 0.00 H new ATOM 0 HG23 VAL A 20 145.189 5.543 -8.521 1.00 0.00 H new ATOM 316 N ASP A 21 147.810 8.590 -6.518 1.00 0.00 N ATOM 317 CA ASP A 21 148.400 9.751 -5.862 1.00 0.00 C ATOM 318 C ASP A 21 149.849 9.471 -5.471 1.00 0.00 C ATOM 319 O ASP A 21 150.659 10.390 -5.354 1.00 0.00 O ATOM 320 CB ASP A 21 147.589 10.131 -4.623 1.00 0.00 C ATOM 321 CG ASP A 21 146.293 10.837 -4.974 1.00 0.00 C ATOM 322 OD1 ASP A 21 145.646 10.431 -5.961 1.00 0.00 O ATOM 323 OD2 ASP A 21 145.927 11.794 -4.260 1.00 0.00 O ATOM 0 H ASP A 21 147.059 8.144 -5.992 1.00 0.00 H new ATOM 0 HA ASP A 21 148.384 10.584 -6.565 1.00 0.00 H new ATOM 0 HB2 ASP A 21 147.366 9.232 -4.049 1.00 0.00 H new ATOM 0 HB3 ASP A 21 148.190 10.777 -3.983 1.00 0.00 H new ATOM 328 N GLU A 22 150.168 8.194 -5.272 1.00 0.00 N ATOM 329 CA GLU A 22 151.518 7.790 -4.893 1.00 0.00 C ATOM 330 C GLU A 22 152.284 7.229 -6.088 1.00 0.00 C ATOM 331 O GLU A 22 153.509 7.105 -6.046 1.00 0.00 O ATOM 332 CB GLU A 22 151.467 6.746 -3.780 1.00 0.00 C ATOM 333 CG GLU A 22 150.891 7.275 -2.478 1.00 0.00 C ATOM 334 CD GLU A 22 151.739 8.374 -1.870 1.00 0.00 C ATOM 335 OE1 GLU A 22 152.980 8.304 -1.994 1.00 0.00 O ATOM 336 OE2 GLU A 22 151.163 9.304 -1.268 1.00 0.00 O ATOM 0 H GLU A 22 149.509 7.422 -5.367 1.00 0.00 H new ATOM 0 HA GLU A 22 152.041 8.676 -4.534 1.00 0.00 H new ATOM 0 HB2 GLU A 22 150.869 5.899 -4.115 1.00 0.00 H new ATOM 0 HB3 GLU A 22 152.474 6.372 -3.597 1.00 0.00 H new ATOM 0 HG2 GLU A 22 149.885 7.655 -2.658 1.00 0.00 H new ATOM 0 HG3 GLU A 22 150.800 6.455 -1.766 1.00 0.00 H new ATOM 343 N GLU A 23 151.564 6.888 -7.154 1.00 0.00 N ATOM 344 CA GLU A 23 152.187 6.339 -8.355 1.00 0.00 C ATOM 345 C GLU A 23 153.339 7.226 -8.824 1.00 0.00 C ATOM 346 O GLU A 23 154.279 6.751 -9.462 1.00 0.00 O ATOM 347 CB GLU A 23 151.150 6.189 -9.470 1.00 0.00 C ATOM 348 CG GLU A 23 151.111 4.795 -10.078 1.00 0.00 C ATOM 349 CD GLU A 23 152.186 4.587 -11.125 1.00 0.00 C ATOM 350 OE1 GLU A 23 153.382 4.641 -10.767 1.00 0.00 O ATOM 351 OE2 GLU A 23 151.835 4.370 -12.304 1.00 0.00 O ATOM 0 H GLU A 23 150.550 6.982 -7.210 1.00 0.00 H new ATOM 0 HA GLU A 23 152.588 5.355 -8.111 1.00 0.00 H new ATOM 0 HB2 GLU A 23 150.164 6.432 -9.074 1.00 0.00 H new ATOM 0 HB3 GLU A 23 151.365 6.914 -10.255 1.00 0.00 H new ATOM 0 HG2 GLU A 23 151.230 4.054 -9.287 1.00 0.00 H new ATOM 0 HG3 GLU A 23 150.133 4.626 -10.528 1.00 0.00 H new ATOM 358 N ASN A 24 153.258 8.512 -8.498 1.00 0.00 N ATOM 359 CA ASN A 24 154.295 9.462 -8.883 1.00 0.00 C ATOM 360 C ASN A 24 155.306 9.664 -7.754 1.00 0.00 C ATOM 361 O ASN A 24 156.023 10.663 -7.725 1.00 0.00 O ATOM 362 CB ASN A 24 153.670 10.805 -9.266 1.00 0.00 C ATOM 363 CG ASN A 24 153.349 10.891 -10.745 1.00 0.00 C ATOM 364 OD1 ASN A 24 154.147 11.391 -11.537 1.00 0.00 O ATOM 365 ND2 ASN A 24 152.173 10.402 -11.125 1.00 0.00 N ATOM 0 H ASN A 24 152.487 8.919 -7.969 1.00 0.00 H new ATOM 0 HA ASN A 24 154.820 9.051 -9.745 1.00 0.00 H new ATOM 0 HB2 ASN A 24 152.757 10.956 -8.689 1.00 0.00 H new ATOM 0 HB3 ASN A 24 154.353 11.611 -8.998 1.00 0.00 H new ATOM 0 HD21 ASN A 24 151.902 10.432 -12.108 1.00 0.00 H new ATOM 0 HD22 ASN A 24 151.542 9.996 -10.434 1.00 0.00 H new ATOM 372 N LYS A 25 155.360 8.708 -6.829 1.00 0.00 N ATOM 373 CA LYS A 25 156.288 8.789 -5.705 1.00 0.00 C ATOM 374 C LYS A 25 157.472 7.849 -5.918 1.00 0.00 C ATOM 375 O LYS A 25 158.568 8.291 -6.264 1.00 0.00 O ATOM 376 CB LYS A 25 155.574 8.454 -4.392 1.00 0.00 C ATOM 377 CG LYS A 25 155.854 9.451 -3.279 1.00 0.00 C ATOM 378 CD LYS A 25 157.344 9.557 -2.984 1.00 0.00 C ATOM 379 CE LYS A 25 157.679 9.018 -1.604 1.00 0.00 C ATOM 380 NZ LYS A 25 157.533 7.538 -1.533 1.00 0.00 N ATOM 0 H LYS A 25 154.775 7.872 -6.836 1.00 0.00 H new ATOM 0 HA LYS A 25 156.663 9.811 -5.645 1.00 0.00 H new ATOM 0 HB2 LYS A 25 154.500 8.414 -4.572 1.00 0.00 H new ATOM 0 HB3 LYS A 25 155.880 7.460 -4.064 1.00 0.00 H new ATOM 0 HG2 LYS A 25 155.468 10.430 -3.561 1.00 0.00 H new ATOM 0 HG3 LYS A 25 155.324 9.148 -2.376 1.00 0.00 H new ATOM 0 HD2 LYS A 25 157.905 9.004 -3.737 1.00 0.00 H new ATOM 0 HD3 LYS A 25 157.656 10.599 -3.054 1.00 0.00 H new ATOM 0 HE2 LYS A 25 158.701 9.294 -1.345 1.00 0.00 H new ATOM 0 HE3 LYS A 25 157.026 9.483 -0.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 157.945 7.191 -0.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 156.525 7.287 -1.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 158.028 7.101 -2.337 1.00 0.00 H new ATOM 394 N ILE A 26 157.251 6.552 -5.715 1.00 0.00 N ATOM 395 CA ILE A 26 158.306 5.563 -5.891 1.00 0.00 C ATOM 396 C ILE A 26 158.947 5.669 -7.273 1.00 0.00 C ATOM 397 O ILE A 26 160.168 5.597 -7.409 1.00 0.00 O ATOM 398 CB ILE A 26 157.766 4.136 -5.690 1.00 0.00 C ATOM 399 CG1 ILE A 26 158.918 3.127 -5.670 1.00 0.00 C ATOM 400 CG2 ILE A 26 156.750 3.786 -6.766 1.00 0.00 C ATOM 401 CD1 ILE A 26 158.465 1.684 -5.599 1.00 0.00 C ATOM 0 H ILE A 26 156.352 6.164 -5.429 1.00 0.00 H new ATOM 0 HA ILE A 26 159.064 5.770 -5.135 1.00 0.00 H new ATOM 0 HB ILE A 26 157.258 4.091 -4.727 1.00 0.00 H new ATOM 0 HG12 ILE A 26 159.524 3.264 -6.565 1.00 0.00 H new ATOM 0 HG13 ILE A 26 159.560 3.339 -4.815 1.00 0.00 H new ATOM 0 HG21 ILE A 26 156.382 2.773 -6.603 1.00 0.00 H new ATOM 0 HG22 ILE A 26 155.916 4.486 -6.721 1.00 0.00 H new ATOM 0 HG23 ILE A 26 157.222 3.848 -7.746 1.00 0.00 H new ATOM 0 HD11 ILE A 26 159.336 1.029 -5.589 1.00 0.00 H new ATOM 0 HD12 ILE A 26 157.884 1.529 -4.690 1.00 0.00 H new ATOM 0 HD13 ILE A 26 157.848 1.453 -6.467 1.00 0.00 H new ATOM 413 N GLY A 27 158.116 5.841 -8.295 1.00 0.00 N ATOM 414 CA GLY A 27 158.621 5.954 -9.651 1.00 0.00 C ATOM 415 C GLY A 27 158.691 7.390 -10.128 1.00 0.00 C ATOM 416 O GLY A 27 158.203 8.299 -9.457 1.00 0.00 O ATOM 0 H GLY A 27 157.102 5.904 -8.209 1.00 0.00 H new ATOM 0 HA2 GLY A 27 159.615 5.509 -9.703 1.00 0.00 H new ATOM 0 HA3 GLY A 27 157.980 5.383 -10.322 1.00 0.00 H new ATOM 420 N GLN A 28 159.297 7.595 -11.293 1.00 0.00 N ATOM 421 CA GLN A 28 159.430 8.931 -11.861 1.00 0.00 C ATOM 422 C GLN A 28 158.061 9.526 -12.170 1.00 0.00 C ATOM 423 O GLN A 28 157.687 10.565 -11.627 1.00 0.00 O ATOM 424 CB GLN A 28 160.276 8.882 -13.135 1.00 0.00 C ATOM 425 CG GLN A 28 161.769 8.797 -12.870 1.00 0.00 C ATOM 426 CD GLN A 28 162.360 10.121 -12.425 1.00 0.00 C ATOM 427 OE1 GLN A 28 161.725 10.882 -11.695 1.00 0.00 O ATOM 428 NE2 GLN A 28 163.580 10.403 -12.864 1.00 0.00 N ATOM 0 H GLN A 28 159.704 6.853 -11.862 1.00 0.00 H new ATOM 0 HA GLN A 28 159.926 9.566 -11.127 1.00 0.00 H new ATOM 0 HB2 GLN A 28 159.972 8.021 -13.731 1.00 0.00 H new ATOM 0 HB3 GLN A 28 160.071 9.771 -13.732 1.00 0.00 H new ATOM 0 HG2 GLN A 28 161.956 8.044 -12.104 1.00 0.00 H new ATOM 0 HG3 GLN A 28 162.276 8.463 -13.775 1.00 0.00 H new ATOM 0 HE21 GLN A 28 164.070 9.743 -13.468 1.00 0.00 H new ATOM 0 HE22 GLN A 28 164.028 11.280 -12.598 1.00 0.00 H new ATOM 437 N TYR A 29 157.316 8.859 -13.047 1.00 0.00 N ATOM 438 CA TYR A 29 155.986 9.319 -13.429 1.00 0.00 C ATOM 439 C TYR A 29 155.026 8.144 -13.574 1.00 0.00 C ATOM 440 O TYR A 29 155.250 7.241 -14.380 1.00 0.00 O ATOM 441 CB TYR A 29 156.054 10.103 -14.742 1.00 0.00 C ATOM 442 CG TYR A 29 156.808 9.385 -15.839 1.00 0.00 C ATOM 443 CD1 TYR A 29 156.169 8.462 -16.659 1.00 0.00 C ATOM 444 CD2 TYR A 29 158.159 9.629 -16.054 1.00 0.00 C ATOM 445 CE1 TYR A 29 156.854 7.804 -17.661 1.00 0.00 C ATOM 446 CE2 TYR A 29 158.851 8.974 -17.057 1.00 0.00 C ATOM 447 CZ TYR A 29 158.195 8.064 -17.857 1.00 0.00 C ATOM 448 OH TYR A 29 158.882 7.410 -18.854 1.00 0.00 O ATOM 0 H TYR A 29 157.612 7.998 -13.506 1.00 0.00 H new ATOM 0 HA TYR A 29 155.614 9.974 -12.641 1.00 0.00 H new ATOM 0 HB2 TYR A 29 155.040 10.309 -15.085 1.00 0.00 H new ATOM 0 HB3 TYR A 29 156.530 11.066 -14.556 1.00 0.00 H new ATOM 0 HD1 TYR A 29 155.119 8.256 -16.510 1.00 0.00 H new ATOM 0 HD2 TYR A 29 158.677 10.341 -15.428 1.00 0.00 H new ATOM 0 HE1 TYR A 29 156.343 7.089 -18.289 1.00 0.00 H new ATOM 0 HE2 TYR A 29 159.901 9.175 -17.212 1.00 0.00 H new ATOM 0 HH TYR A 29 159.815 7.709 -18.858 1.00 0.00 H new ATOM 458 N GLY A 30 153.956 8.161 -12.785 1.00 0.00 N ATOM 459 CA GLY A 30 152.979 7.090 -12.841 1.00 0.00 C ATOM 460 C GLY A 30 151.844 7.387 -13.802 1.00 0.00 C ATOM 461 O GLY A 30 151.826 8.436 -14.447 1.00 0.00 O ATOM 0 H GLY A 30 153.749 8.896 -12.109 1.00 0.00 H new ATOM 0 HA2 GLY A 30 153.474 6.167 -13.143 1.00 0.00 H new ATOM 0 HA3 GLY A 30 152.572 6.922 -11.844 1.00 0.00 H new ATOM 465 N ARG A 31 150.897 6.461 -13.898 1.00 0.00 N ATOM 466 CA ARG A 31 149.753 6.626 -14.788 1.00 0.00 C ATOM 467 C ARG A 31 148.460 6.213 -14.091 1.00 0.00 C ATOM 468 O ARG A 31 148.442 5.982 -12.881 1.00 0.00 O ATOM 469 CB ARG A 31 149.950 5.807 -16.065 1.00 0.00 C ATOM 470 CG ARG A 31 149.965 4.304 -15.832 1.00 0.00 C ATOM 471 CD ARG A 31 149.630 3.540 -17.105 1.00 0.00 C ATOM 472 NE ARG A 31 150.536 2.414 -17.319 1.00 0.00 N ATOM 473 CZ ARG A 31 150.587 1.342 -16.531 1.00 0.00 C ATOM 474 NH1 ARG A 31 149.786 1.249 -15.477 1.00 0.00 N ATOM 475 NH2 ARG A 31 151.441 0.364 -16.797 1.00 0.00 N ATOM 0 H ARG A 31 150.898 5.588 -13.371 1.00 0.00 H new ATOM 0 HA ARG A 31 149.678 7.680 -15.054 1.00 0.00 H new ATOM 0 HB2 ARG A 31 149.152 6.049 -16.768 1.00 0.00 H new ATOM 0 HB3 ARG A 31 150.889 6.102 -16.534 1.00 0.00 H new ATOM 0 HG2 ARG A 31 150.948 4.000 -15.472 1.00 0.00 H new ATOM 0 HG3 ARG A 31 149.247 4.048 -15.053 1.00 0.00 H new ATOM 0 HD2 ARG A 31 148.604 3.175 -17.050 1.00 0.00 H new ATOM 0 HD3 ARG A 31 149.683 4.216 -17.959 1.00 0.00 H new ATOM 0 HE ARG A 31 151.167 2.451 -18.120 1.00 0.00 H new ATOM 0 HH11 ARG A 31 149.128 2.000 -15.268 1.00 0.00 H new ATOM 0 HH12 ARG A 31 149.828 0.426 -14.876 1.00 0.00 H new ATOM 0 HH21 ARG A 31 152.059 0.433 -17.605 1.00 0.00 H new ATOM 0 HH22 ARG A 31 151.480 -0.457 -16.193 1.00 0.00 H new ATOM 489 N LEU A 32 147.379 6.122 -14.859 1.00 0.00 N ATOM 490 CA LEU A 32 146.083 5.739 -14.311 1.00 0.00 C ATOM 491 C LEU A 32 146.076 4.270 -13.901 1.00 0.00 C ATOM 492 O LEU A 32 146.298 3.384 -14.727 1.00 0.00 O ATOM 493 CB LEU A 32 144.976 6.000 -15.335 1.00 0.00 C ATOM 494 CG LEU A 32 143.553 5.782 -14.820 1.00 0.00 C ATOM 495 CD1 LEU A 32 142.584 6.723 -15.519 1.00 0.00 C ATOM 496 CD2 LEU A 32 143.132 4.333 -15.020 1.00 0.00 C ATOM 0 H LEU A 32 147.375 6.308 -15.862 1.00 0.00 H new ATOM 0 HA LEU A 32 145.899 6.345 -13.424 1.00 0.00 H new ATOM 0 HB2 LEU A 32 145.064 7.027 -15.689 1.00 0.00 H new ATOM 0 HB3 LEU A 32 145.138 5.351 -16.196 1.00 0.00 H new ATOM 0 HG LEU A 32 143.533 6.001 -13.752 1.00 0.00 H new ATOM 0 HD11 LEU A 32 141.576 6.554 -15.140 1.00 0.00 H new ATOM 0 HD12 LEU A 32 142.876 7.755 -15.326 1.00 0.00 H new ATOM 0 HD13 LEU A 32 142.605 6.535 -16.592 1.00 0.00 H new ATOM 0 HD21 LEU A 32 142.117 4.194 -14.648 1.00 0.00 H new ATOM 0 HD22 LEU A 32 143.166 4.087 -16.081 1.00 0.00 H new ATOM 0 HD23 LEU A 32 143.811 3.678 -14.474 1.00 0.00 H new ATOM 508 N THR A 33 145.820 4.020 -12.622 1.00 0.00 N ATOM 509 CA THR A 33 145.783 2.658 -12.101 1.00 0.00 C ATOM 510 C THR A 33 144.681 2.506 -11.057 1.00 0.00 C ATOM 511 O THR A 33 144.816 1.735 -10.107 1.00 0.00 O ATOM 512 CB THR A 33 147.137 2.286 -11.489 1.00 0.00 C ATOM 513 OG1 THR A 33 147.157 0.923 -11.106 1.00 0.00 O ATOM 514 CG2 THR A 33 147.495 3.111 -10.271 1.00 0.00 C ATOM 0 H THR A 33 145.635 4.743 -11.926 1.00 0.00 H new ATOM 0 HA THR A 33 145.570 1.983 -12.930 1.00 0.00 H new ATOM 0 HB THR A 33 147.870 2.488 -12.270 1.00 0.00 H new ATOM 0 HG1 THR A 33 146.485 0.769 -10.409 1.00 0.00 H new ATOM 0 HG21 THR A 33 148.466 2.794 -9.889 1.00 0.00 H new ATOM 0 HG22 THR A 33 147.539 4.165 -10.546 1.00 0.00 H new ATOM 0 HG23 THR A 33 146.738 2.969 -9.500 1.00 0.00 H new ATOM 522 N PHE A 34 143.595 3.252 -11.237 1.00 0.00 N ATOM 523 CA PHE A 34 142.474 3.203 -10.306 1.00 0.00 C ATOM 524 C PHE A 34 141.293 2.431 -10.891 1.00 0.00 C ATOM 525 O PHE A 34 140.147 2.657 -10.506 1.00 0.00 O ATOM 526 CB PHE A 34 142.033 4.621 -9.937 1.00 0.00 C ATOM 527 CG PHE A 34 141.055 4.669 -8.797 1.00 0.00 C ATOM 528 CD1 PHE A 34 141.458 4.358 -7.508 1.00 0.00 C ATOM 529 CD2 PHE A 34 139.734 5.025 -9.015 1.00 0.00 C ATOM 530 CE1 PHE A 34 140.562 4.402 -6.457 1.00 0.00 C ATOM 531 CE2 PHE A 34 138.832 5.069 -7.969 1.00 0.00 C ATOM 532 CZ PHE A 34 139.246 4.759 -6.688 1.00 0.00 C ATOM 0 H PHE A 34 143.468 3.896 -12.018 1.00 0.00 H new ATOM 0 HA PHE A 34 142.810 2.681 -9.410 1.00 0.00 H new ATOM 0 HB2 PHE A 34 142.912 5.210 -9.675 1.00 0.00 H new ATOM 0 HB3 PHE A 34 141.583 5.092 -10.811 1.00 0.00 H new ATOM 0 HD1 PHE A 34 142.484 4.078 -7.323 1.00 0.00 H new ATOM 0 HD2 PHE A 34 139.405 5.271 -10.014 1.00 0.00 H new ATOM 0 HE1 PHE A 34 140.889 4.158 -5.457 1.00 0.00 H new ATOM 0 HE2 PHE A 34 137.804 5.345 -8.153 1.00 0.00 H new ATOM 0 HZ PHE A 34 138.543 4.795 -5.869 1.00 0.00 H new ATOM 542 N ASN A 35 141.575 1.518 -11.818 1.00 0.00 N ATOM 543 CA ASN A 35 140.521 0.724 -12.439 1.00 0.00 C ATOM 544 C ASN A 35 139.900 -0.234 -11.427 1.00 0.00 C ATOM 545 O ASN A 35 138.742 -0.076 -11.041 1.00 0.00 O ATOM 546 CB ASN A 35 141.072 -0.055 -13.633 1.00 0.00 C ATOM 547 CG ASN A 35 139.975 -0.554 -14.553 1.00 0.00 C ATOM 548 OD1 ASN A 35 139.561 0.289 -15.492 1.00 0.00 O flip ATOM 549 ND2 ASN A 35 139.504 -1.685 -14.422 1.00 0.00 N flip ATOM 0 H ASN A 35 142.516 1.312 -12.152 1.00 0.00 H new ATOM 0 HA ASN A 35 139.746 1.404 -12.792 1.00 0.00 H new ATOM 0 HB2 ASN A 35 141.753 0.583 -14.197 1.00 0.00 H new ATOM 0 HB3 ASN A 35 141.654 -0.903 -13.273 1.00 0.00 H new ATOM 0 HD21 ASN A 35 139.852 -2.300 -13.687 1.00 0.00 H new ATOM 0 HD22 ASN A 35 138.766 -2.006 -15.049 1.00 0.00 H new ATOM 556 N LYS A 36 140.674 -1.227 -10.997 1.00 0.00 N ATOM 557 CA LYS A 36 140.194 -2.204 -10.027 1.00 0.00 C ATOM 558 C LYS A 36 141.272 -2.523 -8.994 1.00 0.00 C ATOM 559 O LYS A 36 141.923 -3.563 -9.061 1.00 0.00 O ATOM 560 CB LYS A 36 139.751 -3.489 -10.732 1.00 0.00 C ATOM 561 CG LYS A 36 138.670 -3.274 -11.780 1.00 0.00 C ATOM 562 CD LYS A 36 138.774 -4.292 -12.907 1.00 0.00 C ATOM 563 CE LYS A 36 137.498 -5.108 -13.043 1.00 0.00 C ATOM 564 NZ LYS A 36 137.449 -6.227 -12.061 1.00 0.00 N ATOM 0 H LYS A 36 141.635 -1.375 -11.305 1.00 0.00 H new ATOM 0 HA LYS A 36 139.337 -1.770 -9.511 1.00 0.00 H new ATOM 0 HB2 LYS A 36 140.618 -3.949 -11.207 1.00 0.00 H new ATOM 0 HB3 LYS A 36 139.385 -4.194 -9.986 1.00 0.00 H new ATOM 0 HG2 LYS A 36 137.688 -3.347 -11.312 1.00 0.00 H new ATOM 0 HG3 LYS A 36 138.754 -2.267 -12.189 1.00 0.00 H new ATOM 0 HD2 LYS A 36 138.979 -3.777 -13.846 1.00 0.00 H new ATOM 0 HD3 LYS A 36 139.615 -4.959 -12.719 1.00 0.00 H new ATOM 0 HE2 LYS A 36 136.634 -4.459 -12.898 1.00 0.00 H new ATOM 0 HE3 LYS A 36 137.429 -5.509 -14.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 136.564 -6.760 -12.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 138.259 -6.860 -12.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 137.489 -5.843 -11.095 1.00 0.00 H new ATOM 578 N VAL A 37 141.456 -1.620 -8.038 1.00 0.00 N ATOM 579 CA VAL A 37 142.454 -1.810 -6.994 1.00 0.00 C ATOM 580 C VAL A 37 141.903 -2.665 -5.859 1.00 0.00 C ATOM 581 O VAL A 37 141.052 -2.213 -5.094 1.00 0.00 O ATOM 582 CB VAL A 37 142.933 -0.459 -6.425 1.00 0.00 C ATOM 583 CG1 VAL A 37 143.859 -0.667 -5.234 1.00 0.00 C ATOM 584 CG2 VAL A 37 143.617 0.360 -7.510 1.00 0.00 C ATOM 0 H VAL A 37 140.928 -0.751 -7.965 1.00 0.00 H new ATOM 0 HA VAL A 37 143.301 -2.322 -7.451 1.00 0.00 H new ATOM 0 HB VAL A 37 142.062 0.094 -6.075 1.00 0.00 H new ATOM 0 HG11 VAL A 37 144.183 0.301 -4.851 1.00 0.00 H new ATOM 0 HG12 VAL A 37 143.328 -1.208 -4.451 1.00 0.00 H new ATOM 0 HG13 VAL A 37 144.730 -1.243 -5.547 1.00 0.00 H new ATOM 0 HG21 VAL A 37 143.949 1.311 -7.093 1.00 0.00 H new ATOM 0 HG22 VAL A 37 144.477 -0.189 -7.893 1.00 0.00 H new ATOM 0 HG23 VAL A 37 142.915 0.546 -8.323 1.00 0.00 H new ATOM 594 N ILE A 38 142.389 -3.899 -5.750 1.00 0.00 N ATOM 595 CA ILE A 38 141.929 -4.797 -4.701 1.00 0.00 C ATOM 596 C ILE A 38 142.982 -5.871 -4.363 1.00 0.00 C ATOM 597 O ILE A 38 144.144 -5.541 -4.093 1.00 0.00 O ATOM 598 CB ILE A 38 140.585 -5.452 -5.094 1.00 0.00 C ATOM 599 CG1 ILE A 38 140.713 -6.168 -6.439 1.00 0.00 C ATOM 600 CG2 ILE A 38 139.481 -4.407 -5.153 1.00 0.00 C ATOM 601 CD1 ILE A 38 139.701 -7.279 -6.630 1.00 0.00 C ATOM 0 H ILE A 38 143.095 -4.295 -6.371 1.00 0.00 H new ATOM 0 HA ILE A 38 141.775 -4.199 -3.803 1.00 0.00 H new ATOM 0 HB ILE A 38 140.325 -6.188 -4.333 1.00 0.00 H new ATOM 0 HG12 ILE A 38 140.597 -5.440 -7.242 1.00 0.00 H new ATOM 0 HG13 ILE A 38 141.717 -6.583 -6.527 1.00 0.00 H new ATOM 0 HG21 ILE A 38 138.542 -4.885 -5.431 1.00 0.00 H new ATOM 0 HG22 ILE A 38 139.373 -3.936 -4.176 1.00 0.00 H new ATOM 0 HG23 ILE A 38 139.736 -3.650 -5.894 1.00 0.00 H new ATOM 0 HD11 ILE A 38 139.850 -7.743 -7.605 1.00 0.00 H new ATOM 0 HD12 ILE A 38 139.831 -8.027 -5.848 1.00 0.00 H new ATOM 0 HD13 ILE A 38 138.693 -6.867 -6.574 1.00 0.00 H new ATOM 613 N LYS A 39 142.575 -7.153 -4.369 1.00 0.00 N ATOM 614 CA LYS A 39 143.471 -8.271 -4.063 1.00 0.00 C ATOM 615 C LYS A 39 143.684 -8.422 -2.559 1.00 0.00 C ATOM 616 O LYS A 39 143.550 -7.460 -1.804 1.00 0.00 O ATOM 617 CB LYS A 39 144.816 -8.102 -4.769 1.00 0.00 C ATOM 618 CG LYS A 39 144.694 -7.961 -6.279 1.00 0.00 C ATOM 619 CD LYS A 39 144.229 -9.257 -6.921 1.00 0.00 C ATOM 620 CE LYS A 39 143.308 -8.994 -8.103 1.00 0.00 C ATOM 621 NZ LYS A 39 143.491 -10.004 -9.183 1.00 0.00 N ATOM 0 H LYS A 39 141.620 -7.437 -4.586 1.00 0.00 H new ATOM 0 HA LYS A 39 142.993 -9.179 -4.431 1.00 0.00 H new ATOM 0 HB2 LYS A 39 145.319 -7.222 -4.369 1.00 0.00 H new ATOM 0 HB3 LYS A 39 145.447 -8.961 -4.542 1.00 0.00 H new ATOM 0 HG2 LYS A 39 143.990 -7.163 -6.516 1.00 0.00 H new ATOM 0 HG3 LYS A 39 145.658 -7.671 -6.698 1.00 0.00 H new ATOM 0 HD2 LYS A 39 145.094 -9.831 -7.253 1.00 0.00 H new ATOM 0 HD3 LYS A 39 143.708 -9.865 -6.181 1.00 0.00 H new ATOM 0 HE2 LYS A 39 142.272 -9.006 -7.766 1.00 0.00 H new ATOM 0 HE3 LYS A 39 143.502 -7.998 -8.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 143.851 -9.536 -10.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 144.171 -10.726 -8.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 142.578 -10.456 -9.394 1.00 0.00 H new ATOM 635 N PRO A 40 144.017 -9.646 -2.107 1.00 0.00 N ATOM 636 CA PRO A 40 144.249 -9.942 -0.690 1.00 0.00 C ATOM 637 C PRO A 40 145.252 -8.990 -0.051 1.00 0.00 C ATOM 638 O PRO A 40 146.444 -9.285 0.028 1.00 0.00 O ATOM 639 CB PRO A 40 144.795 -11.379 -0.692 1.00 0.00 C ATOM 640 CG PRO A 40 145.120 -11.683 -2.118 1.00 0.00 C ATOM 641 CD PRO A 40 144.190 -10.844 -2.941 1.00 0.00 C ATOM 0 HA PRO A 40 143.337 -9.827 -0.105 1.00 0.00 H new ATOM 0 HB2 PRO A 40 145.680 -11.463 -0.062 1.00 0.00 H new ATOM 0 HB3 PRO A 40 144.057 -12.079 -0.300 1.00 0.00 H new ATOM 0 HG2 PRO A 40 146.160 -11.445 -2.340 1.00 0.00 H new ATOM 0 HG3 PRO A 40 144.982 -12.743 -2.332 1.00 0.00 H new ATOM 0 HD2 PRO A 40 144.616 -10.602 -3.915 1.00 0.00 H new ATOM 0 HD3 PRO A 40 143.242 -11.350 -3.125 1.00 0.00 H new ATOM 649 N CYS A 41 144.754 -7.848 0.405 1.00 0.00 N ATOM 650 CA CYS A 41 145.596 -6.840 1.042 1.00 0.00 C ATOM 651 C CYS A 41 145.845 -7.184 2.509 1.00 0.00 C ATOM 652 O CYS A 41 145.476 -8.265 2.971 1.00 0.00 O ATOM 653 CB CYS A 41 144.937 -5.466 0.934 1.00 0.00 C ATOM 654 SG CYS A 41 143.228 -5.423 1.520 1.00 0.00 S ATOM 0 H CYS A 41 143.768 -7.595 0.346 1.00 0.00 H new ATOM 0 HA CYS A 41 146.556 -6.821 0.527 1.00 0.00 H new ATOM 0 HB2 CYS A 41 145.524 -4.747 1.505 1.00 0.00 H new ATOM 0 HB3 CYS A 41 144.962 -5.143 -0.107 1.00 0.00 H new ATOM 0 HG CYS A 41 143.042 -4.355 2.238 1.00 0.00 H new ATOM 660 N MET A 42 146.472 -6.262 3.236 1.00 0.00 N ATOM 661 CA MET A 42 146.767 -6.477 4.649 1.00 0.00 C ATOM 662 C MET A 42 147.460 -5.261 5.260 1.00 0.00 C ATOM 663 O MET A 42 148.545 -4.870 4.830 1.00 0.00 O ATOM 664 CB MET A 42 147.649 -7.716 4.826 1.00 0.00 C ATOM 665 CG MET A 42 147.955 -8.043 6.277 1.00 0.00 C ATOM 666 SD MET A 42 148.579 -9.722 6.493 1.00 0.00 S ATOM 667 CE MET A 42 147.203 -10.676 5.859 1.00 0.00 C ATOM 0 H MET A 42 146.784 -5.362 2.871 1.00 0.00 H new ATOM 0 HA MET A 42 145.820 -6.631 5.167 1.00 0.00 H new ATOM 0 HB2 MET A 42 147.155 -8.572 4.366 1.00 0.00 H new ATOM 0 HB3 MET A 42 148.586 -7.564 4.291 1.00 0.00 H new ATOM 0 HG2 MET A 42 148.690 -7.334 6.658 1.00 0.00 H new ATOM 0 HG3 MET A 42 147.051 -7.916 6.873 1.00 0.00 H new ATOM 0 HE1 MET A 42 147.204 -11.665 6.318 1.00 0.00 H new ATOM 0 HE2 MET A 42 146.268 -10.167 6.095 1.00 0.00 H new ATOM 0 HE3 MET A 42 147.298 -10.778 4.778 1.00 0.00 H new ATOM 677 N LYS A 43 146.828 -4.673 6.271 1.00 0.00 N ATOM 678 CA LYS A 43 147.383 -3.509 6.954 1.00 0.00 C ATOM 679 C LYS A 43 147.645 -3.831 8.423 1.00 0.00 C ATOM 680 O LYS A 43 146.723 -4.171 9.165 1.00 0.00 O ATOM 681 CB LYS A 43 146.430 -2.318 6.842 1.00 0.00 C ATOM 682 CG LYS A 43 146.954 -1.051 7.500 1.00 0.00 C ATOM 683 CD LYS A 43 146.312 -0.814 8.858 1.00 0.00 C ATOM 684 CE LYS A 43 147.334 -0.891 9.983 1.00 0.00 C ATOM 685 NZ LYS A 43 146.923 -0.085 11.166 1.00 0.00 N ATOM 0 H LYS A 43 145.928 -4.985 6.636 1.00 0.00 H new ATOM 0 HA LYS A 43 148.327 -3.248 6.476 1.00 0.00 H new ATOM 0 HB2 LYS A 43 146.237 -2.116 5.788 1.00 0.00 H new ATOM 0 HB3 LYS A 43 145.475 -2.584 7.296 1.00 0.00 H new ATOM 0 HG2 LYS A 43 148.035 -1.122 7.616 1.00 0.00 H new ATOM 0 HG3 LYS A 43 146.759 -0.197 6.851 1.00 0.00 H new ATOM 0 HD2 LYS A 43 145.832 0.165 8.868 1.00 0.00 H new ATOM 0 HD3 LYS A 43 145.530 -1.554 9.025 1.00 0.00 H new ATOM 0 HE2 LYS A 43 147.467 -1.931 10.281 1.00 0.00 H new ATOM 0 HE3 LYS A 43 148.299 -0.537 9.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 147.290 -0.528 12.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 147.307 0.878 11.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 145.885 -0.041 11.212 1.00 0.00 H new ATOM 699 N LYS A 44 148.905 -3.733 8.836 1.00 0.00 N ATOM 700 CA LYS A 44 149.276 -4.028 10.217 1.00 0.00 C ATOM 701 C LYS A 44 149.925 -2.822 10.886 1.00 0.00 C ATOM 702 O LYS A 44 150.933 -2.302 10.411 1.00 0.00 O ATOM 703 CB LYS A 44 150.231 -5.222 10.263 1.00 0.00 C ATOM 704 CG LYS A 44 149.545 -6.560 10.039 1.00 0.00 C ATOM 705 CD LYS A 44 150.326 -7.699 10.676 1.00 0.00 C ATOM 706 CE LYS A 44 151.570 -8.039 9.871 1.00 0.00 C ATOM 707 NZ LYS A 44 151.338 -9.179 8.942 1.00 0.00 N ATOM 0 H LYS A 44 149.683 -3.453 8.238 1.00 0.00 H new ATOM 0 HA LYS A 44 148.365 -4.272 10.763 1.00 0.00 H new ATOM 0 HB2 LYS A 44 151.003 -5.088 9.506 1.00 0.00 H new ATOM 0 HB3 LYS A 44 150.733 -5.238 11.231 1.00 0.00 H new ATOM 0 HG2 LYS A 44 148.539 -6.529 10.457 1.00 0.00 H new ATOM 0 HG3 LYS A 44 149.441 -6.742 8.969 1.00 0.00 H new ATOM 0 HD2 LYS A 44 150.612 -7.423 11.691 1.00 0.00 H new ATOM 0 HD3 LYS A 44 149.689 -8.580 10.753 1.00 0.00 H new ATOM 0 HE2 LYS A 44 151.883 -7.164 9.301 1.00 0.00 H new ATOM 0 HE3 LYS A 44 152.386 -8.285 10.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 152.132 -9.249 8.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 151.265 -10.062 9.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 150.455 -9.023 8.415 1.00 0.00 H new ATOM 721 N THR A 45 149.338 -2.384 11.998 1.00 0.00 N ATOM 722 CA THR A 45 149.857 -1.246 12.735 1.00 0.00 C ATOM 723 C THR A 45 151.215 -1.569 13.351 1.00 0.00 C ATOM 724 O THR A 45 151.640 -2.724 13.359 1.00 0.00 O ATOM 725 CB THR A 45 148.871 -0.826 13.829 1.00 0.00 C ATOM 726 OG1 THR A 45 147.579 -1.345 13.564 1.00 0.00 O ATOM 727 CG2 THR A 45 148.743 0.674 13.973 1.00 0.00 C ATOM 0 H THR A 45 148.502 -2.804 12.404 1.00 0.00 H new ATOM 0 HA THR A 45 149.984 -0.420 12.036 1.00 0.00 H new ATOM 0 HB THR A 45 149.276 -1.230 14.756 1.00 0.00 H new ATOM 0 HG1 THR A 45 146.932 -0.941 14.179 1.00 0.00 H new ATOM 0 HG21 THR A 45 148.030 0.904 14.764 1.00 0.00 H new ATOM 0 HG22 THR A 45 149.714 1.100 14.225 1.00 0.00 H new ATOM 0 HG23 THR A 45 148.393 1.101 13.033 1.00 0.00 H new ATOM 735 N ILE A 46 151.891 -0.546 13.866 1.00 0.00 N ATOM 736 CA ILE A 46 153.204 -0.730 14.481 1.00 0.00 C ATOM 737 C ILE A 46 153.347 0.125 15.736 1.00 0.00 C ATOM 738 O ILE A 46 154.042 1.140 15.727 1.00 0.00 O ATOM 739 CB ILE A 46 154.347 -0.373 13.506 1.00 0.00 C ATOM 740 CG1 ILE A 46 153.972 -0.742 12.068 1.00 0.00 C ATOM 741 CG2 ILE A 46 155.632 -1.071 13.920 1.00 0.00 C ATOM 742 CD1 ILE A 46 153.859 -2.233 11.834 1.00 0.00 C ATOM 0 H ILE A 46 151.554 0.417 13.870 1.00 0.00 H new ATOM 0 HA ILE A 46 153.278 -1.785 14.745 1.00 0.00 H new ATOM 0 HB ILE A 46 154.508 0.704 13.547 1.00 0.00 H new ATOM 0 HG12 ILE A 46 153.022 -0.270 11.817 1.00 0.00 H new ATOM 0 HG13 ILE A 46 154.720 -0.332 11.390 1.00 0.00 H new ATOM 0 HG21 ILE A 46 156.429 -0.810 13.223 1.00 0.00 H new ATOM 0 HG22 ILE A 46 155.911 -0.754 14.925 1.00 0.00 H new ATOM 0 HG23 ILE A 46 155.480 -2.150 13.909 1.00 0.00 H new ATOM 0 HD11 ILE A 46 153.591 -2.419 10.794 1.00 0.00 H new ATOM 0 HD12 ILE A 46 154.815 -2.709 12.053 1.00 0.00 H new ATOM 0 HD13 ILE A 46 153.090 -2.646 12.486 1.00 0.00 H new ATOM 754 N TYR A 47 152.690 -0.287 16.814 1.00 0.00 N ATOM 755 CA TYR A 47 152.756 0.455 18.068 1.00 0.00 C ATOM 756 C TYR A 47 153.683 -0.234 19.063 1.00 0.00 C ATOM 757 O TYR A 47 153.709 -1.461 19.160 1.00 0.00 O ATOM 758 CB TYR A 47 151.357 0.617 18.669 1.00 0.00 C ATOM 759 CG TYR A 47 150.776 -0.664 19.227 1.00 0.00 C ATOM 760 CD1 TYR A 47 150.258 -1.639 18.385 1.00 0.00 C ATOM 761 CD2 TYR A 47 150.748 -0.898 20.597 1.00 0.00 C ATOM 762 CE1 TYR A 47 149.726 -2.810 18.892 1.00 0.00 C ATOM 763 CE2 TYR A 47 150.220 -2.066 21.110 1.00 0.00 C ATOM 764 CZ TYR A 47 149.710 -3.019 20.255 1.00 0.00 C ATOM 765 OH TYR A 47 149.182 -4.183 20.763 1.00 0.00 O ATOM 0 H TYR A 47 152.109 -1.125 16.846 1.00 0.00 H new ATOM 0 HA TYR A 47 153.162 1.444 17.854 1.00 0.00 H new ATOM 0 HB2 TYR A 47 151.398 1.362 19.464 1.00 0.00 H new ATOM 0 HB3 TYR A 47 150.686 1.005 17.903 1.00 0.00 H new ATOM 0 HD1 TYR A 47 150.271 -1.480 17.317 1.00 0.00 H new ATOM 0 HD2 TYR A 47 151.146 -0.154 21.271 1.00 0.00 H new ATOM 0 HE1 TYR A 47 149.325 -3.558 18.224 1.00 0.00 H new ATOM 0 HE2 TYR A 47 150.207 -2.232 22.177 1.00 0.00 H new ATOM 0 HH TYR A 47 149.249 -4.173 21.741 1.00 0.00 H new ATOM 775 N GLU A 48 154.446 0.568 19.798 1.00 0.00 N ATOM 776 CA GLU A 48 155.378 0.038 20.784 1.00 0.00 C ATOM 777 C GLU A 48 154.646 -0.422 22.038 1.00 0.00 C ATOM 778 O GLU A 48 154.342 -1.603 22.200 1.00 0.00 O ATOM 779 CB GLU A 48 156.439 1.090 21.130 1.00 0.00 C ATOM 780 CG GLU A 48 157.423 0.642 22.199 1.00 0.00 C ATOM 781 CD GLU A 48 158.763 0.227 21.623 1.00 0.00 C ATOM 782 OE1 GLU A 48 158.813 -0.112 20.421 1.00 0.00 O ATOM 783 OE2 GLU A 48 159.762 0.242 22.372 1.00 0.00 O ATOM 0 H GLU A 48 154.437 1.586 19.729 1.00 0.00 H new ATOM 0 HA GLU A 48 155.876 -0.830 20.352 1.00 0.00 H new ATOM 0 HB2 GLU A 48 156.991 1.346 20.226 1.00 0.00 H new ATOM 0 HB3 GLU A 48 155.940 1.999 21.467 1.00 0.00 H new ATOM 0 HG2 GLU A 48 157.574 1.453 22.911 1.00 0.00 H new ATOM 0 HG3 GLU A 48 156.996 -0.194 22.753 1.00 0.00 H new ATOM 790 N ASN A 49 154.368 0.522 22.914 1.00 0.00 N ATOM 791 CA ASN A 49 153.670 0.243 24.163 1.00 0.00 C ATOM 792 C ASN A 49 153.230 1.540 24.830 1.00 0.00 C ATOM 793 O ASN A 49 152.043 1.750 25.083 1.00 0.00 O ATOM 794 CB ASN A 49 154.570 -0.554 25.109 1.00 0.00 C ATOM 795 CG ASN A 49 154.344 -2.049 25.000 1.00 0.00 C ATOM 796 OD1 ASN A 49 155.287 -2.820 24.825 1.00 0.00 O ATOM 797 ND2 ASN A 49 153.088 -2.466 25.104 1.00 0.00 N ATOM 0 H ASN A 49 154.617 1.503 22.786 1.00 0.00 H new ATOM 0 HA ASN A 49 152.784 -0.351 23.936 1.00 0.00 H new ATOM 0 HB2 ASN A 49 155.614 -0.330 24.888 1.00 0.00 H new ATOM 0 HB3 ASN A 49 154.386 -0.235 26.135 1.00 0.00 H new ATOM 0 HD21 ASN A 49 152.874 -3.461 25.039 1.00 0.00 H new ATOM 0 HD22 ASN A 49 152.337 -1.791 25.249 1.00 0.00 H new ATOM 804 N GLU A 50 154.194 2.410 25.104 1.00 0.00 N ATOM 805 CA GLU A 50 153.913 3.694 25.732 1.00 0.00 C ATOM 806 C GLU A 50 153.929 4.811 24.693 1.00 0.00 C ATOM 807 O GLU A 50 154.350 5.932 24.977 1.00 0.00 O ATOM 808 CB GLU A 50 154.938 3.986 26.830 1.00 0.00 C ATOM 809 CG GLU A 50 154.404 4.881 27.937 1.00 0.00 C ATOM 810 CD GLU A 50 154.659 6.352 27.669 1.00 0.00 C ATOM 811 OE1 GLU A 50 155.677 6.670 27.020 1.00 0.00 O ATOM 812 OE2 GLU A 50 153.839 7.186 28.109 1.00 0.00 O ATOM 0 H GLU A 50 155.180 2.249 24.900 1.00 0.00 H new ATOM 0 HA GLU A 50 152.921 3.647 26.180 1.00 0.00 H new ATOM 0 HB2 GLU A 50 155.271 3.044 27.265 1.00 0.00 H new ATOM 0 HB3 GLU A 50 155.813 4.458 26.383 1.00 0.00 H new ATOM 0 HG2 GLU A 50 153.332 4.716 28.048 1.00 0.00 H new ATOM 0 HG3 GLU A 50 154.869 4.601 28.882 1.00 0.00 H new ATOM 819 N ARG A 51 153.472 4.488 23.486 1.00 0.00 N ATOM 820 CA ARG A 51 153.434 5.455 22.394 1.00 0.00 C ATOM 821 C ARG A 51 154.845 5.810 21.935 1.00 0.00 C ATOM 822 O ARG A 51 155.201 6.985 21.833 1.00 0.00 O ATOM 823 CB ARG A 51 152.688 6.722 22.825 1.00 0.00 C ATOM 824 CG ARG A 51 151.838 7.333 21.723 1.00 0.00 C ATOM 825 CD ARG A 51 152.526 8.528 21.085 1.00 0.00 C ATOM 826 NE ARG A 51 152.283 8.598 19.646 1.00 0.00 N ATOM 827 CZ ARG A 51 151.162 9.070 19.106 1.00 0.00 C ATOM 828 NH1 ARG A 51 150.176 9.510 19.881 1.00 0.00 N ATOM 829 NH2 ARG A 51 151.023 9.102 17.788 1.00 0.00 N ATOM 0 H ARG A 51 153.122 3.562 23.240 1.00 0.00 H new ATOM 0 HA ARG A 51 152.902 5.000 21.558 1.00 0.00 H new ATOM 0 HB2 ARG A 51 152.049 6.486 23.676 1.00 0.00 H new ATOM 0 HB3 ARG A 51 153.412 7.462 23.166 1.00 0.00 H new ATOM 0 HG2 ARG A 51 151.633 6.581 20.961 1.00 0.00 H new ATOM 0 HG3 ARG A 51 150.876 7.642 22.133 1.00 0.00 H new ATOM 0 HD2 ARG A 51 152.172 9.444 21.557 1.00 0.00 H new ATOM 0 HD3 ARG A 51 153.599 8.469 21.269 1.00 0.00 H new ATOM 0 HE ARG A 51 153.015 8.266 19.019 1.00 0.00 H new ATOM 0 HH11 ARG A 51 150.276 9.487 20.896 1.00 0.00 H new ATOM 0 HH12 ARG A 51 149.319 9.871 19.461 1.00 0.00 H new ATOM 0 HH21 ARG A 51 151.775 8.765 17.187 1.00 0.00 H new ATOM 0 HH22 ARG A 51 150.164 9.464 17.374 1.00 0.00 H new ATOM 843 N GLU A 52 155.648 4.785 21.661 1.00 0.00 N ATOM 844 CA GLU A 52 157.022 4.992 21.213 1.00 0.00 C ATOM 845 C GLU A 52 157.108 5.037 19.692 1.00 0.00 C ATOM 846 O GLU A 52 158.080 5.543 19.131 1.00 0.00 O ATOM 847 CB GLU A 52 157.934 3.891 21.756 1.00 0.00 C ATOM 848 CG GLU A 52 159.375 4.337 21.950 1.00 0.00 C ATOM 849 CD GLU A 52 159.572 5.135 23.225 1.00 0.00 C ATOM 850 OE1 GLU A 52 158.941 6.204 23.360 1.00 0.00 O ATOM 851 OE2 GLU A 52 160.357 4.689 24.088 1.00 0.00 O ATOM 0 H GLU A 52 155.372 3.806 21.741 1.00 0.00 H new ATOM 0 HA GLU A 52 157.355 5.954 21.602 1.00 0.00 H new ATOM 0 HB2 GLU A 52 157.539 3.541 22.710 1.00 0.00 H new ATOM 0 HB3 GLU A 52 157.914 3.043 21.072 1.00 0.00 H new ATOM 0 HG2 GLU A 52 160.023 3.461 21.970 1.00 0.00 H new ATOM 0 HG3 GLU A 52 159.683 4.941 21.096 1.00 0.00 H new ATOM 858 N ILE A 53 156.088 4.512 19.032 1.00 0.00 N ATOM 859 CA ILE A 53 156.047 4.500 17.577 1.00 0.00 C ATOM 860 C ILE A 53 154.619 4.672 17.072 1.00 0.00 C ATOM 861 O ILE A 53 154.198 5.775 16.720 1.00 0.00 O ATOM 862 CB ILE A 53 156.694 3.212 16.997 1.00 0.00 C ATOM 863 CG1 ILE A 53 156.336 3.033 15.516 1.00 0.00 C ATOM 864 CG2 ILE A 53 156.301 1.984 17.805 1.00 0.00 C ATOM 865 CD1 ILE A 53 156.944 1.795 14.891 1.00 0.00 C ATOM 0 H ILE A 53 155.276 4.088 19.481 1.00 0.00 H new ATOM 0 HA ILE A 53 156.636 5.347 17.224 1.00 0.00 H new ATOM 0 HB ILE A 53 157.776 3.325 17.070 1.00 0.00 H new ATOM 0 HG12 ILE A 53 155.252 2.985 15.416 1.00 0.00 H new ATOM 0 HG13 ILE A 53 156.669 3.911 14.962 1.00 0.00 H new ATOM 0 HG21 ILE A 53 156.770 1.099 17.374 1.00 0.00 H new ATOM 0 HG22 ILE A 53 156.634 2.105 18.836 1.00 0.00 H new ATOM 0 HG23 ILE A 53 155.218 1.867 17.785 1.00 0.00 H new ATOM 0 HD11 ILE A 53 156.648 1.733 13.844 1.00 0.00 H new ATOM 0 HD12 ILE A 53 158.031 1.849 14.959 1.00 0.00 H new ATOM 0 HD13 ILE A 53 156.591 0.910 15.420 1.00 0.00 H new ATOM 877 N LYS A 54 153.883 3.582 17.051 1.00 0.00 N ATOM 878 CA LYS A 54 152.493 3.588 16.605 1.00 0.00 C ATOM 879 C LYS A 54 152.386 3.877 15.107 1.00 0.00 C ATOM 880 O LYS A 54 151.688 4.799 14.687 1.00 0.00 O ATOM 881 CB LYS A 54 151.688 4.610 17.411 1.00 0.00 C ATOM 882 CG LYS A 54 150.702 3.976 18.379 1.00 0.00 C ATOM 883 CD LYS A 54 149.442 4.817 18.529 1.00 0.00 C ATOM 884 CE LYS A 54 149.305 5.377 19.936 1.00 0.00 C ATOM 885 NZ LYS A 54 147.914 5.245 20.454 1.00 0.00 N ATOM 0 H LYS A 54 154.224 2.665 17.340 1.00 0.00 H new ATOM 0 HA LYS A 54 152.078 2.595 16.777 1.00 0.00 H new ATOM 0 HB2 LYS A 54 152.376 5.245 17.969 1.00 0.00 H new ATOM 0 HB3 LYS A 54 151.145 5.257 16.723 1.00 0.00 H new ATOM 0 HG2 LYS A 54 150.435 2.980 18.026 1.00 0.00 H new ATOM 0 HG3 LYS A 54 151.176 3.853 19.353 1.00 0.00 H new ATOM 0 HD2 LYS A 54 149.464 5.637 17.811 1.00 0.00 H new ATOM 0 HD3 LYS A 54 148.568 4.210 18.292 1.00 0.00 H new ATOM 0 HE2 LYS A 54 149.992 4.855 20.603 1.00 0.00 H new ATOM 0 HE3 LYS A 54 149.595 6.428 19.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 147.863 5.638 21.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 147.261 5.764 19.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 147.646 4.240 20.476 1.00 0.00 H new ATOM 899 N GLY A 55 153.070 3.064 14.309 1.00 0.00 N ATOM 900 CA GLY A 55 153.031 3.225 12.866 1.00 0.00 C ATOM 901 C GLY A 55 151.971 2.347 12.239 1.00 0.00 C ATOM 902 O GLY A 55 151.159 1.749 12.945 1.00 0.00 O ATOM 0 H GLY A 55 153.653 2.294 14.637 1.00 0.00 H new ATOM 0 HA2 GLY A 55 152.833 4.268 12.620 1.00 0.00 H new ATOM 0 HA3 GLY A 55 154.005 2.978 12.445 1.00 0.00 H new ATOM 906 N TYR A 56 151.977 2.258 10.918 1.00 0.00 N ATOM 907 CA TYR A 56 151.004 1.433 10.217 1.00 0.00 C ATOM 908 C TYR A 56 151.413 1.214 8.769 1.00 0.00 C ATOM 909 O TYR A 56 151.630 2.165 8.020 1.00 0.00 O ATOM 910 CB TYR A 56 149.611 2.063 10.283 1.00 0.00 C ATOM 911 CG TYR A 56 149.600 3.564 10.086 1.00 0.00 C ATOM 912 CD1 TYR A 56 149.540 4.116 8.812 1.00 0.00 C ATOM 913 CD2 TYR A 56 149.640 4.427 11.175 1.00 0.00 C ATOM 914 CE1 TYR A 56 149.519 5.485 8.629 1.00 0.00 C ATOM 915 CE2 TYR A 56 149.617 5.798 10.999 1.00 0.00 C ATOM 916 CZ TYR A 56 149.557 6.321 9.724 1.00 0.00 C ATOM 917 OH TYR A 56 149.531 7.685 9.546 1.00 0.00 O ATOM 0 H TYR A 56 152.640 2.743 10.313 1.00 0.00 H new ATOM 0 HA TYR A 56 150.972 0.463 10.714 1.00 0.00 H new ATOM 0 HB2 TYR A 56 148.980 1.603 9.522 1.00 0.00 H new ATOM 0 HB3 TYR A 56 149.165 1.831 11.250 1.00 0.00 H new ATOM 0 HD1 TYR A 56 149.509 3.464 7.951 1.00 0.00 H new ATOM 0 HD2 TYR A 56 149.690 4.020 12.174 1.00 0.00 H new ATOM 0 HE1 TYR A 56 149.473 5.898 7.632 1.00 0.00 H new ATOM 0 HE2 TYR A 56 149.646 6.456 11.855 1.00 0.00 H new ATOM 0 HH TYR A 56 150.163 7.935 8.840 1.00 0.00 H new ATOM 927 N GLU A 57 151.511 -0.052 8.384 1.00 0.00 N ATOM 928 CA GLU A 57 151.889 -0.406 7.023 1.00 0.00 C ATOM 929 C GLU A 57 150.660 -0.823 6.223 1.00 0.00 C ATOM 930 O GLU A 57 149.925 -1.723 6.624 1.00 0.00 O ATOM 931 CB GLU A 57 152.919 -1.537 7.033 1.00 0.00 C ATOM 932 CG GLU A 57 152.381 -2.845 7.591 1.00 0.00 C ATOM 933 CD GLU A 57 153.441 -3.650 8.317 1.00 0.00 C ATOM 934 OE1 GLU A 57 154.279 -3.037 9.011 1.00 0.00 O ATOM 935 OE2 GLU A 57 153.435 -4.892 8.189 1.00 0.00 O ATOM 0 H GLU A 57 151.334 -0.850 8.995 1.00 0.00 H new ATOM 0 HA GLU A 57 152.335 0.469 6.550 1.00 0.00 H new ATOM 0 HB2 GLU A 57 153.273 -1.704 6.016 1.00 0.00 H new ATOM 0 HB3 GLU A 57 153.781 -1.227 7.624 1.00 0.00 H new ATOM 0 HG2 GLU A 57 151.559 -2.633 8.275 1.00 0.00 H new ATOM 0 HG3 GLU A 57 151.971 -3.442 6.776 1.00 0.00 H new ATOM 942 N TYR A 58 150.435 -0.156 5.096 1.00 0.00 N ATOM 943 CA TYR A 58 149.283 -0.457 4.254 1.00 0.00 C ATOM 944 C TYR A 58 149.711 -1.075 2.926 1.00 0.00 C ATOM 945 O TYR A 58 150.130 -0.373 2.008 1.00 0.00 O ATOM 946 CB TYR A 58 148.471 0.814 4.001 1.00 0.00 C ATOM 947 CG TYR A 58 146.982 0.633 4.185 1.00 0.00 C ATOM 948 CD1 TYR A 58 146.294 -0.357 3.497 1.00 0.00 C ATOM 949 CD2 TYR A 58 146.264 1.456 5.043 1.00 0.00 C ATOM 950 CE1 TYR A 58 144.933 -0.525 3.659 1.00 0.00 C ATOM 951 CE2 TYR A 58 144.901 1.294 5.212 1.00 0.00 C ATOM 952 CZ TYR A 58 144.240 0.304 4.518 1.00 0.00 C ATOM 953 OH TYR A 58 142.884 0.140 4.683 1.00 0.00 O ATOM 0 H TYR A 58 151.032 0.593 4.746 1.00 0.00 H new ATOM 0 HA TYR A 58 148.664 -1.183 4.780 1.00 0.00 H new ATOM 0 HB2 TYR A 58 148.819 1.596 4.676 1.00 0.00 H new ATOM 0 HB3 TYR A 58 148.663 1.160 2.985 1.00 0.00 H new ATOM 0 HD1 TYR A 58 146.832 -1.007 2.823 1.00 0.00 H new ATOM 0 HD2 TYR A 58 146.778 2.235 5.587 1.00 0.00 H new ATOM 0 HE1 TYR A 58 144.413 -1.301 3.116 1.00 0.00 H new ATOM 0 HE2 TYR A 58 144.357 1.940 5.885 1.00 0.00 H new ATOM 0 HH TYR A 58 142.683 -0.810 4.814 1.00 0.00 H new ATOM 963 N GLN A 59 149.589 -2.396 2.831 1.00 0.00 N ATOM 964 CA GLN A 59 149.950 -3.114 1.614 1.00 0.00 C ATOM 965 C GLN A 59 148.703 -3.407 0.784 1.00 0.00 C ATOM 966 O GLN A 59 147.619 -3.602 1.335 1.00 0.00 O ATOM 967 CB GLN A 59 150.669 -4.420 1.962 1.00 0.00 C ATOM 968 CG GLN A 59 151.237 -5.144 0.753 1.00 0.00 C ATOM 969 CD GLN A 59 150.961 -6.635 0.780 1.00 0.00 C ATOM 970 OE1 GLN A 59 150.056 -7.097 1.476 1.00 0.00 O ATOM 971 NE2 GLN A 59 151.741 -7.395 0.023 1.00 0.00 N ATOM 0 H GLN A 59 149.242 -2.991 3.584 1.00 0.00 H new ATOM 0 HA GLN A 59 150.623 -2.488 1.028 1.00 0.00 H new ATOM 0 HB2 GLN A 59 151.479 -4.204 2.659 1.00 0.00 H new ATOM 0 HB3 GLN A 59 149.973 -5.082 2.477 1.00 0.00 H new ATOM 0 HG2 GLN A 59 150.811 -4.716 -0.155 1.00 0.00 H new ATOM 0 HG3 GLN A 59 152.313 -4.979 0.708 1.00 0.00 H new ATOM 0 HE21 GLN A 59 152.479 -6.969 -0.538 1.00 0.00 H new ATOM 0 HE22 GLN A 59 151.603 -8.405 0.002 1.00 0.00 H new ATOM 980 N LEU A 60 148.854 -3.437 -0.536 1.00 0.00 N ATOM 981 CA LEU A 60 147.725 -3.703 -1.414 1.00 0.00 C ATOM 982 C LEU A 60 148.165 -3.886 -2.861 1.00 0.00 C ATOM 983 O LEU A 60 149.196 -3.355 -3.273 1.00 0.00 O ATOM 984 CB LEU A 60 146.711 -2.564 -1.329 1.00 0.00 C ATOM 985 CG LEU A 60 145.251 -2.996 -1.462 1.00 0.00 C ATOM 986 CD1 LEU A 60 144.493 -2.721 -0.173 1.00 0.00 C ATOM 987 CD2 LEU A 60 144.583 -2.295 -2.637 1.00 0.00 C ATOM 0 H LEU A 60 149.740 -3.282 -1.016 1.00 0.00 H new ATOM 0 HA LEU A 60 147.264 -4.632 -1.080 1.00 0.00 H new ATOM 0 HB2 LEU A 60 146.839 -2.053 -0.375 1.00 0.00 H new ATOM 0 HB3 LEU A 60 146.934 -1.839 -2.112 1.00 0.00 H new ATOM 0 HG LEU A 60 145.230 -4.069 -1.651 1.00 0.00 H new ATOM 0 HD11 LEU A 60 143.455 -3.035 -0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 60 144.952 -3.276 0.645 1.00 0.00 H new ATOM 0 HD13 LEU A 60 144.527 -1.654 0.049 1.00 0.00 H new ATOM 0 HD21 LEU A 60 143.545 -2.619 -2.711 1.00 0.00 H new ATOM 0 HD22 LEU A 60 144.617 -1.216 -2.484 1.00 0.00 H new ATOM 0 HD23 LEU A 60 145.109 -2.548 -3.558 1.00 0.00 H new ATOM 999 N TYR A 61 147.365 -4.621 -3.634 1.00 0.00 N ATOM 1000 CA TYR A 61 147.668 -4.850 -5.040 1.00 0.00 C ATOM 1001 C TYR A 61 146.631 -4.158 -5.914 1.00 0.00 C ATOM 1002 O TYR A 61 145.471 -4.568 -5.960 1.00 0.00 O ATOM 1003 CB TYR A 61 147.711 -6.345 -5.358 1.00 0.00 C ATOM 1004 CG TYR A 61 148.472 -7.168 -4.342 1.00 0.00 C ATOM 1005 CD1 TYR A 61 147.997 -7.321 -3.044 1.00 0.00 C ATOM 1006 CD2 TYR A 61 149.665 -7.793 -4.681 1.00 0.00 C ATOM 1007 CE1 TYR A 61 148.691 -8.074 -2.115 1.00 0.00 C ATOM 1008 CE2 TYR A 61 150.363 -8.548 -3.758 1.00 0.00 C ATOM 1009 CZ TYR A 61 149.872 -8.685 -2.476 1.00 0.00 C ATOM 1010 OH TYR A 61 150.565 -9.436 -1.554 1.00 0.00 O ATOM 0 H TYR A 61 146.506 -5.065 -3.308 1.00 0.00 H new ATOM 0 HA TYR A 61 148.652 -4.432 -5.250 1.00 0.00 H new ATOM 0 HB2 TYR A 61 146.690 -6.721 -5.424 1.00 0.00 H new ATOM 0 HB3 TYR A 61 148.167 -6.485 -6.338 1.00 0.00 H new ATOM 0 HD1 TYR A 61 147.071 -6.844 -2.757 1.00 0.00 H new ATOM 0 HD2 TYR A 61 150.054 -7.687 -5.683 1.00 0.00 H new ATOM 0 HE1 TYR A 61 148.309 -8.183 -1.111 1.00 0.00 H new ATOM 0 HE2 TYR A 61 151.289 -9.029 -4.039 1.00 0.00 H new ATOM 0 HH TYR A 61 151.375 -9.798 -1.970 1.00 0.00 H new ATOM 1020 N VAL A 62 147.050 -3.098 -6.592 1.00 0.00 N ATOM 1021 CA VAL A 62 146.151 -2.341 -7.448 1.00 0.00 C ATOM 1022 C VAL A 62 145.971 -3.010 -8.807 1.00 0.00 C ATOM 1023 O VAL A 62 146.785 -2.831 -9.713 1.00 0.00 O ATOM 1024 CB VAL A 62 146.654 -0.893 -7.645 1.00 0.00 C ATOM 1025 CG1 VAL A 62 146.785 -0.186 -6.305 1.00 0.00 C ATOM 1026 CG2 VAL A 62 147.982 -0.877 -8.390 1.00 0.00 C ATOM 0 H VAL A 62 148.006 -2.744 -6.565 1.00 0.00 H new ATOM 0 HA VAL A 62 145.184 -2.315 -6.945 1.00 0.00 H new ATOM 0 HB VAL A 62 145.920 -0.358 -8.247 1.00 0.00 H new ATOM 0 HG11 VAL A 62 147.140 0.832 -6.464 1.00 0.00 H new ATOM 0 HG12 VAL A 62 145.813 -0.158 -5.812 1.00 0.00 H new ATOM 0 HG13 VAL A 62 147.495 -0.724 -5.678 1.00 0.00 H new ATOM 0 HG21 VAL A 62 148.316 0.153 -8.517 1.00 0.00 H new ATOM 0 HG22 VAL A 62 148.726 -1.432 -7.819 1.00 0.00 H new ATOM 0 HG23 VAL A 62 147.856 -1.340 -9.368 1.00 0.00 H new ATOM 1036 N TYR A 63 144.891 -3.775 -8.952 1.00 0.00 N ATOM 1037 CA TYR A 63 144.615 -4.452 -10.212 1.00 0.00 C ATOM 1038 C TYR A 63 143.949 -3.487 -11.187 1.00 0.00 C ATOM 1039 O TYR A 63 142.738 -3.534 -11.397 1.00 0.00 O ATOM 1040 CB TYR A 63 143.726 -5.678 -9.986 1.00 0.00 C ATOM 1041 CG TYR A 63 143.726 -6.649 -11.146 1.00 0.00 C ATOM 1042 CD1 TYR A 63 142.887 -6.456 -12.237 1.00 0.00 C ATOM 1043 CD2 TYR A 63 144.562 -7.757 -11.149 1.00 0.00 C ATOM 1044 CE1 TYR A 63 142.883 -7.342 -13.299 1.00 0.00 C ATOM 1045 CE2 TYR A 63 144.564 -8.646 -12.208 1.00 0.00 C ATOM 1046 CZ TYR A 63 143.723 -8.435 -13.280 1.00 0.00 C ATOM 1047 OH TYR A 63 143.722 -9.317 -14.334 1.00 0.00 O ATOM 0 H TYR A 63 144.201 -3.939 -8.219 1.00 0.00 H new ATOM 0 HA TYR A 63 145.560 -4.791 -10.638 1.00 0.00 H new ATOM 0 HB2 TYR A 63 144.060 -6.198 -9.088 1.00 0.00 H new ATOM 0 HB3 TYR A 63 142.704 -5.346 -9.801 1.00 0.00 H new ATOM 0 HD1 TYR A 63 142.228 -5.601 -12.256 1.00 0.00 H new ATOM 0 HD2 TYR A 63 145.221 -7.927 -10.311 1.00 0.00 H new ATOM 0 HE1 TYR A 63 142.225 -7.178 -14.139 1.00 0.00 H new ATOM 0 HE2 TYR A 63 145.222 -9.502 -12.196 1.00 0.00 H new ATOM 0 HH TYR A 63 144.372 -10.030 -14.164 1.00 0.00 H new ATOM 1057 N ALA A 64 144.751 -2.601 -11.768 1.00 0.00 N ATOM 1058 CA ALA A 64 144.242 -1.612 -12.709 1.00 0.00 C ATOM 1059 C ALA A 64 143.957 -2.230 -14.070 1.00 0.00 C ATOM 1060 O ALA A 64 144.205 -3.415 -14.292 1.00 0.00 O ATOM 1061 CB ALA A 64 145.227 -0.463 -12.847 1.00 0.00 C ATOM 0 H ALA A 64 145.756 -2.548 -11.603 1.00 0.00 H new ATOM 0 HA ALA A 64 143.300 -1.230 -12.315 1.00 0.00 H new ATOM 0 HB1 ALA A 64 144.835 0.269 -13.553 1.00 0.00 H new ATOM 0 HB2 ALA A 64 145.372 0.010 -11.876 1.00 0.00 H new ATOM 0 HB3 ALA A 64 146.181 -0.844 -13.211 1.00 0.00 H new ATOM 1067 N SER A 65 143.431 -1.416 -14.978 1.00 0.00 N ATOM 1068 CA SER A 65 143.108 -1.876 -16.323 1.00 0.00 C ATOM 1069 C SER A 65 144.370 -2.293 -17.070 1.00 0.00 C ATOM 1070 O SER A 65 144.396 -3.324 -17.742 1.00 0.00 O ATOM 1071 CB SER A 65 142.378 -0.779 -17.099 1.00 0.00 C ATOM 1072 OG SER A 65 140.994 -1.066 -17.207 1.00 0.00 O ATOM 0 H SER A 65 143.219 -0.433 -14.807 1.00 0.00 H new ATOM 0 HA SER A 65 142.454 -2.744 -16.238 1.00 0.00 H new ATOM 0 HB2 SER A 65 142.516 0.179 -16.598 1.00 0.00 H new ATOM 0 HB3 SER A 65 142.812 -0.683 -18.094 1.00 0.00 H new ATOM 0 HG SER A 65 140.475 -0.277 -16.946 1.00 0.00 H new ATOM 1078 N ASP A 66 145.419 -1.483 -16.950 1.00 0.00 N ATOM 1079 CA ASP A 66 146.683 -1.763 -17.614 1.00 0.00 C ATOM 1080 C ASP A 66 147.182 -3.156 -17.272 1.00 0.00 C ATOM 1081 O ASP A 66 147.626 -3.905 -18.141 1.00 0.00 O ATOM 1082 CB ASP A 66 147.734 -0.719 -17.229 1.00 0.00 C ATOM 1083 CG ASP A 66 147.859 0.383 -18.262 1.00 0.00 C ATOM 1084 OD1 ASP A 66 146.836 1.035 -18.563 1.00 0.00 O ATOM 1085 OD2 ASP A 66 148.979 0.596 -18.771 1.00 0.00 O ATOM 0 H ASP A 66 145.415 -0.626 -16.397 1.00 0.00 H new ATOM 0 HA ASP A 66 146.514 -1.714 -18.690 1.00 0.00 H new ATOM 0 HB2 ASP A 66 147.472 -0.282 -16.265 1.00 0.00 H new ATOM 0 HB3 ASP A 66 148.700 -1.208 -17.105 1.00 0.00 H new ATOM 1090 N LYS A 67 147.094 -3.485 -15.997 1.00 0.00 N ATOM 1091 CA LYS A 67 147.525 -4.786 -15.492 1.00 0.00 C ATOM 1092 C LYS A 67 147.442 -4.831 -13.968 1.00 0.00 C ATOM 1093 O LYS A 67 146.945 -3.898 -13.334 1.00 0.00 O ATOM 1094 CB LYS A 67 148.956 -5.088 -15.941 1.00 0.00 C ATOM 1095 CG LYS A 67 149.027 -5.957 -17.186 1.00 0.00 C ATOM 1096 CD LYS A 67 149.523 -7.357 -16.867 1.00 0.00 C ATOM 1097 CE LYS A 67 149.103 -8.353 -17.937 1.00 0.00 C ATOM 1098 NZ LYS A 67 150.211 -8.651 -18.888 1.00 0.00 N ATOM 0 H LYS A 67 146.723 -2.863 -15.279 1.00 0.00 H new ATOM 0 HA LYS A 67 146.857 -5.543 -15.901 1.00 0.00 H new ATOM 0 HB2 LYS A 67 149.475 -4.149 -16.132 1.00 0.00 H new ATOM 0 HB3 LYS A 67 149.486 -5.585 -15.129 1.00 0.00 H new ATOM 0 HG2 LYS A 67 148.040 -6.016 -17.645 1.00 0.00 H new ATOM 0 HG3 LYS A 67 149.691 -5.493 -17.916 1.00 0.00 H new ATOM 0 HD2 LYS A 67 150.610 -7.349 -16.782 1.00 0.00 H new ATOM 0 HD3 LYS A 67 149.130 -7.672 -15.900 1.00 0.00 H new ATOM 0 HE2 LYS A 67 148.774 -9.278 -17.463 1.00 0.00 H new ATOM 0 HE3 LYS A 67 148.250 -7.956 -18.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 149.916 -8.402 -19.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 151.050 -8.095 -18.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 150.441 -9.664 -18.846 1.00 0.00 H new ATOM 1112 N LEU A 68 147.934 -5.921 -13.385 1.00 0.00 N ATOM 1113 CA LEU A 68 147.920 -6.085 -11.937 1.00 0.00 C ATOM 1114 C LEU A 68 149.145 -5.429 -11.308 1.00 0.00 C ATOM 1115 O LEU A 68 150.267 -5.902 -11.473 1.00 0.00 O ATOM 1116 CB LEU A 68 147.871 -7.569 -11.568 1.00 0.00 C ATOM 1117 CG LEU A 68 149.010 -8.423 -12.136 1.00 0.00 C ATOM 1118 CD1 LEU A 68 150.054 -8.706 -11.065 1.00 0.00 C ATOM 1119 CD2 LEU A 68 148.466 -9.724 -12.709 1.00 0.00 C ATOM 0 H LEU A 68 148.347 -6.703 -13.894 1.00 0.00 H new ATOM 0 HA LEU A 68 147.027 -5.596 -11.548 1.00 0.00 H new ATOM 0 HB2 LEU A 68 147.880 -7.657 -10.482 1.00 0.00 H new ATOM 0 HB3 LEU A 68 146.923 -7.981 -11.913 1.00 0.00 H new ATOM 0 HG LEU A 68 149.488 -7.865 -12.941 1.00 0.00 H new ATOM 0 HD11 LEU A 68 150.854 -9.313 -11.488 1.00 0.00 H new ATOM 0 HD12 LEU A 68 150.467 -7.765 -10.701 1.00 0.00 H new ATOM 0 HD13 LEU A 68 149.590 -9.243 -10.237 1.00 0.00 H new ATOM 0 HD21 LEU A 68 149.288 -10.318 -13.108 1.00 0.00 H new ATOM 0 HD22 LEU A 68 147.961 -10.285 -11.922 1.00 0.00 H new ATOM 0 HD23 LEU A 68 147.758 -9.502 -13.508 1.00 0.00 H new ATOM 1131 N PHE A 69 148.921 -4.333 -10.589 1.00 0.00 N ATOM 1132 CA PHE A 69 150.008 -3.611 -9.939 1.00 0.00 C ATOM 1133 C PHE A 69 149.960 -3.797 -8.424 1.00 0.00 C ATOM 1134 O PHE A 69 149.142 -4.560 -7.909 1.00 0.00 O ATOM 1135 CB PHE A 69 149.938 -2.123 -10.291 1.00 0.00 C ATOM 1136 CG PHE A 69 150.758 -1.755 -11.495 1.00 0.00 C ATOM 1137 CD1 PHE A 69 150.229 -1.866 -12.769 1.00 0.00 C ATOM 1138 CD2 PHE A 69 152.060 -1.302 -11.349 1.00 0.00 C ATOM 1139 CE1 PHE A 69 150.982 -1.531 -13.878 1.00 0.00 C ATOM 1140 CE2 PHE A 69 152.817 -0.965 -12.455 1.00 0.00 C ATOM 1141 CZ PHE A 69 152.278 -1.079 -13.722 1.00 0.00 C ATOM 0 H PHE A 69 147.997 -3.926 -10.442 1.00 0.00 H new ATOM 0 HA PHE A 69 150.952 -4.018 -10.302 1.00 0.00 H new ATOM 0 HB2 PHE A 69 148.899 -1.848 -10.471 1.00 0.00 H new ATOM 0 HB3 PHE A 69 150.279 -1.539 -9.436 1.00 0.00 H new ATOM 0 HD1 PHE A 69 149.216 -2.218 -12.898 1.00 0.00 H new ATOM 0 HD2 PHE A 69 152.487 -1.212 -10.361 1.00 0.00 H new ATOM 0 HE1 PHE A 69 150.557 -1.623 -14.867 1.00 0.00 H new ATOM 0 HE2 PHE A 69 153.830 -0.612 -12.329 1.00 0.00 H new ATOM 0 HZ PHE A 69 152.868 -0.816 -14.587 1.00 0.00 H new ATOM 1151 N ARG A 70 150.840 -3.096 -7.715 1.00 0.00 N ATOM 1152 CA ARG A 70 150.900 -3.188 -6.271 1.00 0.00 C ATOM 1153 C ARG A 70 151.413 -1.893 -5.654 1.00 0.00 C ATOM 1154 O ARG A 70 152.058 -1.096 -6.326 1.00 0.00 O ATOM 1155 CB ARG A 70 151.793 -4.358 -5.853 1.00 0.00 C ATOM 1156 CG ARG A 70 151.376 -5.017 -4.547 1.00 0.00 C ATOM 1157 CD ARG A 70 152.256 -4.569 -3.390 1.00 0.00 C ATOM 1158 NE ARG A 70 153.285 -5.558 -3.076 1.00 0.00 N ATOM 1159 CZ ARG A 70 153.991 -5.559 -1.949 1.00 0.00 C ATOM 1160 NH1 ARG A 70 153.786 -4.626 -1.027 1.00 0.00 N ATOM 1161 NH2 ARG A 70 154.906 -6.495 -1.741 1.00 0.00 N ATOM 0 H ARG A 70 151.521 -2.457 -8.125 1.00 0.00 H new ATOM 0 HA ARG A 70 149.888 -3.359 -5.904 1.00 0.00 H new ATOM 0 HB2 ARG A 70 151.787 -5.107 -6.645 1.00 0.00 H new ATOM 0 HB3 ARG A 70 152.819 -4.003 -5.758 1.00 0.00 H new ATOM 0 HG2 ARG A 70 150.336 -4.772 -4.331 1.00 0.00 H new ATOM 0 HG3 ARG A 70 151.433 -6.101 -4.651 1.00 0.00 H new ATOM 0 HD2 ARG A 70 152.729 -3.619 -3.640 1.00 0.00 H new ATOM 0 HD3 ARG A 70 151.638 -4.395 -2.509 1.00 0.00 H new ATOM 0 HE ARG A 70 153.473 -6.290 -3.761 1.00 0.00 H new ATOM 0 HH11 ARG A 70 153.084 -3.903 -1.181 1.00 0.00 H new ATOM 0 HH12 ARG A 70 154.331 -4.633 -0.165 1.00 0.00 H new ATOM 0 HH21 ARG A 70 155.069 -7.215 -2.445 1.00 0.00 H new ATOM 0 HH22 ARG A 70 155.447 -6.496 -0.877 1.00 0.00 H new ATOM 1175 N ALA A 71 151.116 -1.694 -4.371 1.00 0.00 N ATOM 1176 CA ALA A 71 151.545 -0.496 -3.650 1.00 0.00 C ATOM 1177 C ALA A 71 151.665 -0.790 -2.158 1.00 0.00 C ATOM 1178 O ALA A 71 150.730 -1.320 -1.558 1.00 0.00 O ATOM 1179 CB ALA A 71 150.562 0.640 -3.891 1.00 0.00 C ATOM 0 H ALA A 71 150.577 -2.351 -3.807 1.00 0.00 H new ATOM 0 HA ALA A 71 152.524 -0.194 -4.022 1.00 0.00 H new ATOM 0 HB1 ALA A 71 150.891 1.527 -3.350 1.00 0.00 H new ATOM 0 HB2 ALA A 71 150.517 0.862 -4.957 1.00 0.00 H new ATOM 0 HB3 ALA A 71 149.573 0.346 -3.539 1.00 0.00 H new ATOM 1185 N ASP A 72 152.809 -0.459 -1.547 1.00 0.00 N ATOM 1186 CA ASP A 72 152.982 -0.725 -0.123 1.00 0.00 C ATOM 1187 C ASP A 72 153.217 0.561 0.656 1.00 0.00 C ATOM 1188 O ASP A 72 154.066 1.376 0.296 1.00 0.00 O ATOM 1189 CB ASP A 72 154.142 -1.694 0.111 1.00 0.00 C ATOM 1190 CG ASP A 72 153.874 -2.650 1.257 1.00 0.00 C ATOM 1191 OD1 ASP A 72 152.978 -2.359 2.075 1.00 0.00 O ATOM 1192 OD2 ASP A 72 154.563 -3.689 1.335 1.00 0.00 O ATOM 0 H ASP A 72 153.606 -0.018 -2.006 1.00 0.00 H new ATOM 0 HA ASP A 72 152.061 -1.182 0.238 1.00 0.00 H new ATOM 0 HB2 ASP A 72 154.325 -2.265 -0.800 1.00 0.00 H new ATOM 0 HB3 ASP A 72 155.049 -1.127 0.319 1.00 0.00 H new ATOM 1197 N ILE A 73 152.456 0.730 1.732 1.00 0.00 N ATOM 1198 CA ILE A 73 152.570 1.908 2.577 1.00 0.00 C ATOM 1199 C ILE A 73 153.139 1.539 3.941 1.00 0.00 C ATOM 1200 O ILE A 73 152.981 0.410 4.406 1.00 0.00 O ATOM 1201 CB ILE A 73 151.205 2.594 2.775 1.00 0.00 C ATOM 1202 CG1 ILE A 73 150.519 2.810 1.423 1.00 0.00 C ATOM 1203 CG2 ILE A 73 151.374 3.916 3.508 1.00 0.00 C ATOM 1204 CD1 ILE A 73 149.058 3.185 1.542 1.00 0.00 C ATOM 0 H ILE A 73 151.750 0.060 2.039 1.00 0.00 H new ATOM 0 HA ILE A 73 153.244 2.600 2.072 1.00 0.00 H new ATOM 0 HB ILE A 73 150.574 1.945 3.383 1.00 0.00 H new ATOM 0 HG12 ILE A 73 151.044 3.595 0.879 1.00 0.00 H new ATOM 0 HG13 ILE A 73 150.605 1.899 0.831 1.00 0.00 H new ATOM 0 HG21 ILE A 73 150.400 4.387 3.639 1.00 0.00 H new ATOM 0 HG22 ILE A 73 151.824 3.736 4.484 1.00 0.00 H new ATOM 0 HG23 ILE A 73 152.020 4.574 2.927 1.00 0.00 H new ATOM 0 HD11 ILE A 73 148.635 3.323 0.547 1.00 0.00 H new ATOM 0 HD12 ILE A 73 148.519 2.390 2.058 1.00 0.00 H new ATOM 0 HD13 ILE A 73 148.965 4.113 2.107 1.00 0.00 H new ATOM 1216 N SER A 74 153.798 2.496 4.579 1.00 0.00 N ATOM 1217 CA SER A 74 154.387 2.272 5.892 1.00 0.00 C ATOM 1218 C SER A 74 154.716 3.594 6.563 1.00 0.00 C ATOM 1219 O SER A 74 155.387 4.448 5.982 1.00 0.00 O ATOM 1220 CB SER A 74 155.649 1.414 5.770 1.00 0.00 C ATOM 1221 OG SER A 74 156.172 1.460 4.454 1.00 0.00 O ATOM 0 H SER A 74 153.938 3.436 4.208 1.00 0.00 H new ATOM 0 HA SER A 74 153.660 1.742 6.508 1.00 0.00 H new ATOM 0 HB2 SER A 74 156.401 1.766 6.476 1.00 0.00 H new ATOM 0 HB3 SER A 74 155.419 0.383 6.037 1.00 0.00 H new ATOM 0 HG SER A 74 156.978 0.905 4.403 1.00 0.00 H new ATOM 1227 N GLU A 75 154.237 3.764 7.790 1.00 0.00 N ATOM 1228 CA GLU A 75 154.482 4.990 8.533 1.00 0.00 C ATOM 1229 C GLU A 75 155.158 4.672 9.866 1.00 0.00 C ATOM 1230 O GLU A 75 154.561 4.042 10.736 1.00 0.00 O ATOM 1231 CB GLU A 75 153.156 5.742 8.744 1.00 0.00 C ATOM 1232 CG GLU A 75 152.969 6.341 10.132 1.00 0.00 C ATOM 1233 CD GLU A 75 152.197 7.648 10.110 1.00 0.00 C ATOM 1234 OE1 GLU A 75 151.904 8.146 9.004 1.00 0.00 O ATOM 1235 OE2 GLU A 75 151.885 8.171 11.200 1.00 0.00 O ATOM 0 H GLU A 75 153.679 3.070 8.288 1.00 0.00 H new ATOM 0 HA GLU A 75 155.153 5.633 7.963 1.00 0.00 H new ATOM 0 HB2 GLU A 75 153.089 6.542 8.007 1.00 0.00 H new ATOM 0 HB3 GLU A 75 152.332 5.057 8.546 1.00 0.00 H new ATOM 0 HG2 GLU A 75 152.444 5.625 10.764 1.00 0.00 H new ATOM 0 HG3 GLU A 75 153.946 6.509 10.585 1.00 0.00 H new ATOM 1242 N ASP A 76 156.404 5.109 10.019 1.00 0.00 N ATOM 1243 CA ASP A 76 157.151 4.870 11.237 1.00 0.00 C ATOM 1244 C ASP A 76 157.137 6.099 12.139 1.00 0.00 C ATOM 1245 O ASP A 76 156.854 7.207 11.686 1.00 0.00 O ATOM 1246 CB ASP A 76 158.592 4.474 10.911 1.00 0.00 C ATOM 1247 CG ASP A 76 158.674 3.204 10.088 1.00 0.00 C ATOM 1248 OD1 ASP A 76 157.926 3.093 9.094 1.00 0.00 O ATOM 1249 OD2 ASP A 76 159.485 2.319 10.437 1.00 0.00 O ATOM 0 H ASP A 76 156.915 5.632 9.308 1.00 0.00 H new ATOM 0 HA ASP A 76 156.670 4.049 11.770 1.00 0.00 H new ATOM 0 HB2 ASP A 76 159.074 5.287 10.368 1.00 0.00 H new ATOM 0 HB3 ASP A 76 159.147 4.338 11.839 1.00 0.00 H new ATOM 1254 N TYR A 77 157.444 5.897 13.415 1.00 0.00 N ATOM 1255 CA TYR A 77 157.465 6.999 14.372 1.00 0.00 C ATOM 1256 C TYR A 77 158.795 7.074 15.119 1.00 0.00 C ATOM 1257 O TYR A 77 159.122 8.104 15.707 1.00 0.00 O ATOM 1258 CB TYR A 77 156.308 6.878 15.360 1.00 0.00 C ATOM 1259 CG TYR A 77 155.254 7.947 15.178 1.00 0.00 C ATOM 1260 CD1 TYR A 77 154.727 8.220 13.923 1.00 0.00 C ATOM 1261 CD2 TYR A 77 154.794 8.682 16.261 1.00 0.00 C ATOM 1262 CE1 TYR A 77 153.764 9.198 13.753 1.00 0.00 C ATOM 1263 CE2 TYR A 77 153.832 9.662 16.100 1.00 0.00 C ATOM 1264 CZ TYR A 77 153.321 9.916 14.844 1.00 0.00 C ATOM 1265 OH TYR A 77 152.363 10.889 14.679 1.00 0.00 O ATOM 0 H TYR A 77 157.681 4.987 13.810 1.00 0.00 H new ATOM 0 HA TYR A 77 157.349 7.923 13.806 1.00 0.00 H new ATOM 0 HB2 TYR A 77 155.845 5.898 15.249 1.00 0.00 H new ATOM 0 HB3 TYR A 77 156.699 6.932 16.376 1.00 0.00 H new ATOM 0 HD1 TYR A 77 155.074 7.660 13.067 1.00 0.00 H new ATOM 0 HD2 TYR A 77 155.193 8.486 17.245 1.00 0.00 H new ATOM 0 HE1 TYR A 77 153.361 9.398 12.771 1.00 0.00 H new ATOM 0 HE2 TYR A 77 153.483 10.225 16.953 1.00 0.00 H new ATOM 0 HH TYR A 77 152.161 11.299 15.546 1.00 0.00 H new ATOM 1275 N LYS A 78 159.580 5.996 15.076 1.00 0.00 N ATOM 1276 CA LYS A 78 160.883 5.989 15.734 1.00 0.00 C ATOM 1277 C LYS A 78 161.712 7.144 15.187 1.00 0.00 C ATOM 1278 O LYS A 78 162.421 7.832 15.922 1.00 0.00 O ATOM 1279 CB LYS A 78 161.598 4.657 15.501 1.00 0.00 C ATOM 1280 CG LYS A 78 161.746 4.293 14.031 1.00 0.00 C ATOM 1281 CD LYS A 78 161.566 2.801 13.806 1.00 0.00 C ATOM 1282 CE LYS A 78 162.770 2.014 14.299 1.00 0.00 C ATOM 1283 NZ LYS A 78 163.690 1.646 13.187 1.00 0.00 N ATOM 0 H LYS A 78 159.338 5.128 14.598 1.00 0.00 H new ATOM 0 HA LYS A 78 160.750 6.109 16.809 1.00 0.00 H new ATOM 0 HB2 LYS A 78 162.587 4.701 15.957 1.00 0.00 H new ATOM 0 HB3 LYS A 78 161.047 3.865 16.009 1.00 0.00 H new ATOM 0 HG2 LYS A 78 161.010 4.842 13.443 1.00 0.00 H new ATOM 0 HG3 LYS A 78 162.730 4.599 13.676 1.00 0.00 H new ATOM 0 HD2 LYS A 78 160.670 2.459 14.324 1.00 0.00 H new ATOM 0 HD3 LYS A 78 161.414 2.608 12.744 1.00 0.00 H new ATOM 0 HE2 LYS A 78 163.312 2.605 15.037 1.00 0.00 H new ATOM 0 HE3 LYS A 78 162.430 1.109 14.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 164.497 1.111 13.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 163.181 1.060 12.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 164.035 2.510 12.722 1.00 0.00 H new ATOM 1297 N THR A 79 161.566 7.364 13.886 1.00 0.00 N ATOM 1298 CA THR A 79 162.238 8.452 13.192 1.00 0.00 C ATOM 1299 C THR A 79 161.198 9.298 12.453 1.00 0.00 C ATOM 1300 O THR A 79 161.539 10.198 11.685 1.00 0.00 O ATOM 1301 CB THR A 79 163.271 7.902 12.206 1.00 0.00 C ATOM 1302 OG1 THR A 79 162.910 6.602 11.774 1.00 0.00 O ATOM 1303 CG2 THR A 79 164.667 7.822 12.787 1.00 0.00 C ATOM 0 H THR A 79 160.977 6.791 13.282 1.00 0.00 H new ATOM 0 HA THR A 79 162.760 9.073 13.920 1.00 0.00 H new ATOM 0 HB THR A 79 163.280 8.606 11.374 1.00 0.00 H new ATOM 0 HG1 THR A 79 163.582 6.269 11.143 1.00 0.00 H new ATOM 0 HG21 THR A 79 165.351 7.424 12.037 1.00 0.00 H new ATOM 0 HG22 THR A 79 164.995 8.818 13.085 1.00 0.00 H new ATOM 0 HG23 THR A 79 164.662 7.166 13.658 1.00 0.00 H new ATOM 1311 N ARG A 80 159.923 8.984 12.699 1.00 0.00 N ATOM 1312 CA ARG A 80 158.803 9.681 12.079 1.00 0.00 C ATOM 1313 C ARG A 80 158.705 9.343 10.604 1.00 0.00 C ATOM 1314 O ARG A 80 158.482 10.217 9.764 1.00 0.00 O ATOM 1315 CB ARG A 80 158.910 11.196 12.269 1.00 0.00 C ATOM 1316 CG ARG A 80 159.454 11.616 13.627 1.00 0.00 C ATOM 1317 CD ARG A 80 160.345 12.844 13.513 1.00 0.00 C ATOM 1318 NE ARG A 80 161.435 12.823 14.485 1.00 0.00 N ATOM 1319 CZ ARG A 80 161.297 13.172 15.762 1.00 0.00 C ATOM 1320 NH1 ARG A 80 160.117 13.563 16.227 1.00 0.00 N ATOM 1321 NH2 ARG A 80 162.342 13.127 16.577 1.00 0.00 N ATOM 0 H ARG A 80 159.643 8.238 13.335 1.00 0.00 H new ATOM 0 HA ARG A 80 157.894 9.342 12.576 1.00 0.00 H new ATOM 0 HB2 ARG A 80 159.554 11.604 11.490 1.00 0.00 H new ATOM 0 HB3 ARG A 80 157.924 11.639 12.132 1.00 0.00 H new ATOM 0 HG2 ARG A 80 158.625 11.827 14.303 1.00 0.00 H new ATOM 0 HG3 ARG A 80 160.020 10.793 14.064 1.00 0.00 H new ATOM 0 HD2 ARG A 80 160.759 12.899 12.506 1.00 0.00 H new ATOM 0 HD3 ARG A 80 159.745 13.742 13.661 1.00 0.00 H new ATOM 0 HE ARG A 80 162.356 12.523 14.166 1.00 0.00 H new ATOM 0 HH11 ARG A 80 159.310 13.597 15.605 1.00 0.00 H new ATOM 0 HH12 ARG A 80 160.018 13.829 17.207 1.00 0.00 H new ATOM 0 HH21 ARG A 80 163.251 12.825 16.225 1.00 0.00 H new ATOM 0 HH22 ARG A 80 162.237 13.394 17.556 1.00 0.00 H new ATOM 1335 N GLY A 81 158.848 8.062 10.295 1.00 0.00 N ATOM 1336 CA GLY A 81 158.748 7.625 8.922 1.00 0.00 C ATOM 1337 C GLY A 81 157.345 7.808 8.390 1.00 0.00 C ATOM 1338 O GLY A 81 156.408 8.010 9.162 1.00 0.00 O ATOM 0 H GLY A 81 159.031 7.320 10.971 1.00 0.00 H new ATOM 0 HA2 GLY A 81 159.449 8.188 8.306 1.00 0.00 H new ATOM 0 HA3 GLY A 81 159.033 6.575 8.850 1.00 0.00 H new ATOM 1342 N ARG A 82 157.200 7.740 7.076 1.00 0.00 N ATOM 1343 CA ARG A 82 155.899 7.900 6.435 1.00 0.00 C ATOM 1344 C ARG A 82 156.072 7.981 4.928 1.00 0.00 C ATOM 1345 O ARG A 82 156.611 8.961 4.417 1.00 0.00 O ATOM 1346 CB ARG A 82 155.195 9.169 6.935 1.00 0.00 C ATOM 1347 CG ARG A 82 153.678 9.082 6.888 1.00 0.00 C ATOM 1348 CD ARG A 82 153.104 9.915 5.753 1.00 0.00 C ATOM 1349 NE ARG A 82 152.910 11.309 6.142 1.00 0.00 N ATOM 1350 CZ ARG A 82 152.036 11.708 7.064 1.00 0.00 C ATOM 1351 NH1 ARG A 82 151.273 10.821 7.692 1.00 0.00 N ATOM 1352 NH2 ARG A 82 151.923 12.995 7.358 1.00 0.00 N ATOM 0 H ARG A 82 157.970 7.574 6.428 1.00 0.00 H new ATOM 0 HA ARG A 82 155.286 7.036 6.690 1.00 0.00 H new ATOM 0 HB2 ARG A 82 155.508 9.368 7.960 1.00 0.00 H new ATOM 0 HB3 ARG A 82 155.521 10.017 6.332 1.00 0.00 H new ATOM 0 HG2 ARG A 82 153.376 8.042 6.765 1.00 0.00 H new ATOM 0 HG3 ARG A 82 153.264 9.424 7.836 1.00 0.00 H new ATOM 0 HD2 ARG A 82 153.774 9.868 4.894 1.00 0.00 H new ATOM 0 HD3 ARG A 82 152.151 9.490 5.438 1.00 0.00 H new ATOM 0 HE ARG A 82 153.478 12.019 5.680 1.00 0.00 H new ATOM 0 HH11 ARG A 82 151.355 9.829 7.469 1.00 0.00 H new ATOM 0 HH12 ARG A 82 150.605 11.132 8.398 1.00 0.00 H new ATOM 0 HH21 ARG A 82 152.506 13.681 6.878 1.00 0.00 H new ATOM 0 HH22 ARG A 82 151.253 13.300 8.064 1.00 0.00 H new ATOM 1366 N LYS A 83 155.623 6.955 4.208 1.00 0.00 N ATOM 1367 CA LYS A 83 155.762 6.967 2.758 1.00 0.00 C ATOM 1368 C LYS A 83 155.117 5.763 2.075 1.00 0.00 C ATOM 1369 O LYS A 83 155.132 4.644 2.590 1.00 0.00 O ATOM 1370 CB LYS A 83 157.241 7.034 2.376 1.00 0.00 C ATOM 1371 CG LYS A 83 158.123 6.093 3.184 1.00 0.00 C ATOM 1372 CD LYS A 83 159.121 5.361 2.302 1.00 0.00 C ATOM 1373 CE LYS A 83 160.459 5.184 3.002 1.00 0.00 C ATOM 1374 NZ LYS A 83 161.595 5.181 2.038 1.00 0.00 N ATOM 0 H LYS A 83 155.171 6.126 4.594 1.00 0.00 H new ATOM 0 HA LYS A 83 155.233 7.853 2.407 1.00 0.00 H new ATOM 0 HB2 LYS A 83 157.345 6.796 1.317 1.00 0.00 H new ATOM 0 HB3 LYS A 83 157.596 8.056 2.510 1.00 0.00 H new ATOM 0 HG2 LYS A 83 158.658 6.660 3.946 1.00 0.00 H new ATOM 0 HG3 LYS A 83 157.499 5.368 3.706 1.00 0.00 H new ATOM 0 HD2 LYS A 83 158.720 4.385 2.030 1.00 0.00 H new ATOM 0 HD3 LYS A 83 159.265 5.916 1.375 1.00 0.00 H new ATOM 0 HE2 LYS A 83 160.599 5.987 3.725 1.00 0.00 H new ATOM 0 HE3 LYS A 83 160.455 4.248 3.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 162.489 5.058 2.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 161.475 4.399 1.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 161.615 6.084 1.522 1.00 0.00 H new ATOM 1388 N LEU A 84 154.592 6.021 0.879 1.00 0.00 N ATOM 1389 CA LEU A 84 153.974 4.999 0.042 1.00 0.00 C ATOM 1390 C LEU A 84 154.801 4.877 -1.230 1.00 0.00 C ATOM 1391 O LEU A 84 155.324 5.882 -1.715 1.00 0.00 O ATOM 1392 CB LEU A 84 152.531 5.380 -0.296 1.00 0.00 C ATOM 1393 CG LEU A 84 151.756 6.059 0.836 1.00 0.00 C ATOM 1394 CD1 LEU A 84 152.176 7.517 0.979 1.00 0.00 C ATOM 1395 CD2 LEU A 84 150.257 5.954 0.594 1.00 0.00 C ATOM 0 H LEU A 84 154.584 6.952 0.462 1.00 0.00 H new ATOM 0 HA LEU A 84 153.948 4.046 0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 84 152.540 6.046 -1.159 1.00 0.00 H new ATOM 0 HB3 LEU A 84 151.994 4.479 -0.594 1.00 0.00 H new ATOM 0 HG LEU A 84 151.991 5.545 1.768 1.00 0.00 H new ATOM 0 HD11 LEU A 84 151.613 7.980 1.789 1.00 0.00 H new ATOM 0 HD12 LEU A 84 153.242 7.568 1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 84 151.974 8.047 0.048 1.00 0.00 H new ATOM 0 HD21 LEU A 84 149.722 6.442 1.409 1.00 0.00 H new ATOM 0 HD22 LEU A 84 150.006 6.441 -0.348 1.00 0.00 H new ATOM 0 HD23 LEU A 84 149.969 4.904 0.548 1.00 0.00 H new ATOM 1407 N LEU A 85 154.975 3.669 -1.756 1.00 0.00 N ATOM 1408 CA LEU A 85 155.810 3.514 -2.937 1.00 0.00 C ATOM 1409 C LEU A 85 155.677 2.141 -3.600 1.00 0.00 C ATOM 1410 O LEU A 85 155.131 2.026 -4.694 1.00 0.00 O ATOM 1411 CB LEU A 85 157.269 3.729 -2.520 1.00 0.00 C ATOM 1412 CG LEU A 85 157.586 3.311 -1.079 1.00 0.00 C ATOM 1413 CD1 LEU A 85 158.899 2.549 -1.013 1.00 0.00 C ATOM 1414 CD2 LEU A 85 157.638 4.529 -0.168 1.00 0.00 C ATOM 0 H LEU A 85 154.562 2.809 -1.396 1.00 0.00 H new ATOM 0 HA LEU A 85 155.481 4.249 -3.672 1.00 0.00 H new ATOM 0 HB2 LEU A 85 157.914 3.169 -3.198 1.00 0.00 H new ATOM 0 HB3 LEU A 85 157.517 4.783 -2.642 1.00 0.00 H new ATOM 0 HG LEU A 85 156.788 2.652 -0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 85 159.102 2.263 0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 85 158.831 1.654 -1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 85 159.706 3.183 -1.380 1.00 0.00 H new ATOM 0 HD21 LEU A 85 157.864 4.212 0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 85 158.413 5.211 -0.517 1.00 0.00 H new ATOM 0 HD23 LEU A 85 156.674 5.037 -0.184 1.00 0.00 H new ATOM 1426 N ARG A 86 156.224 1.117 -2.931 1.00 0.00 N ATOM 1427 CA ARG A 86 156.239 -0.266 -3.422 1.00 0.00 C ATOM 1428 C ARG A 86 155.222 -0.532 -4.527 1.00 0.00 C ATOM 1429 O ARG A 86 154.157 -1.094 -4.279 1.00 0.00 O ATOM 1430 CB ARG A 86 156.016 -1.235 -2.260 1.00 0.00 C ATOM 1431 CG ARG A 86 157.228 -2.101 -1.955 1.00 0.00 C ATOM 1432 CD ARG A 86 156.862 -3.281 -1.068 1.00 0.00 C ATOM 1433 NE ARG A 86 157.606 -4.486 -1.425 1.00 0.00 N ATOM 1434 CZ ARG A 86 157.732 -5.544 -0.628 1.00 0.00 C ATOM 1435 NH1 ARG A 86 157.168 -5.548 0.574 1.00 0.00 N ATOM 1436 NH2 ARG A 86 158.422 -6.602 -1.032 1.00 0.00 N ATOM 0 H ARG A 86 156.674 1.228 -2.022 1.00 0.00 H new ATOM 0 HA ARG A 86 157.222 -0.427 -3.864 1.00 0.00 H new ATOM 0 HB2 ARG A 86 155.751 -0.667 -1.368 1.00 0.00 H new ATOM 0 HB3 ARG A 86 155.167 -1.879 -2.491 1.00 0.00 H new ATOM 0 HG2 ARG A 86 157.660 -2.466 -2.887 1.00 0.00 H new ATOM 0 HG3 ARG A 86 157.992 -1.499 -1.464 1.00 0.00 H new ATOM 0 HD2 ARG A 86 157.061 -3.027 -0.027 1.00 0.00 H new ATOM 0 HD3 ARG A 86 155.793 -3.478 -1.149 1.00 0.00 H new ATOM 0 HE ARG A 86 158.056 -4.518 -2.340 1.00 0.00 H new ATOM 0 HH11 ARG A 86 156.635 -4.738 0.890 1.00 0.00 H new ATOM 0 HH12 ARG A 86 157.267 -6.361 1.181 1.00 0.00 H new ATOM 0 HH21 ARG A 86 158.857 -6.605 -1.955 1.00 0.00 H new ATOM 0 HH22 ARG A 86 158.518 -7.412 -0.420 1.00 0.00 H new ATOM 1450 N PHE A 87 155.572 -0.143 -5.751 1.00 0.00 N ATOM 1451 CA PHE A 87 154.702 -0.354 -6.901 1.00 0.00 C ATOM 1452 C PHE A 87 155.276 -1.431 -7.809 1.00 0.00 C ATOM 1453 O PHE A 87 156.308 -1.229 -8.450 1.00 0.00 O ATOM 1454 CB PHE A 87 154.505 0.949 -7.682 1.00 0.00 C ATOM 1455 CG PHE A 87 153.126 1.530 -7.541 1.00 0.00 C ATOM 1456 CD1 PHE A 87 152.064 1.014 -8.267 1.00 0.00 C ATOM 1457 CD2 PHE A 87 152.891 2.592 -6.682 1.00 0.00 C ATOM 1458 CE1 PHE A 87 150.795 1.546 -8.139 1.00 0.00 C ATOM 1459 CE2 PHE A 87 151.624 3.128 -6.550 1.00 0.00 C ATOM 1460 CZ PHE A 87 150.574 2.604 -7.280 1.00 0.00 C ATOM 0 H PHE A 87 156.454 0.321 -5.970 1.00 0.00 H new ATOM 0 HA PHE A 87 153.730 -0.684 -6.536 1.00 0.00 H new ATOM 0 HB2 PHE A 87 155.236 1.682 -7.341 1.00 0.00 H new ATOM 0 HB3 PHE A 87 154.707 0.765 -8.737 1.00 0.00 H new ATOM 0 HD1 PHE A 87 152.230 0.186 -8.941 1.00 0.00 H new ATOM 0 HD2 PHE A 87 153.708 3.006 -6.109 1.00 0.00 H new ATOM 0 HE1 PHE A 87 149.976 1.134 -8.711 1.00 0.00 H new ATOM 0 HE2 PHE A 87 151.455 3.956 -5.877 1.00 0.00 H new ATOM 0 HZ PHE A 87 149.583 3.021 -7.179 1.00 0.00 H new ATOM 1470 N ASN A 88 154.610 -2.578 -7.854 1.00 0.00 N ATOM 1471 CA ASN A 88 155.074 -3.687 -8.683 1.00 0.00 C ATOM 1472 C ASN A 88 153.925 -4.600 -9.093 1.00 0.00 C ATOM 1473 O ASN A 88 152.825 -4.522 -8.547 1.00 0.00 O ATOM 1474 CB ASN A 88 156.135 -4.498 -7.938 1.00 0.00 C ATOM 1475 CG ASN A 88 157.222 -3.626 -7.340 1.00 0.00 C ATOM 1476 OD1 ASN A 88 158.128 -3.176 -8.040 1.00 0.00 O ATOM 1477 ND2 ASN A 88 157.137 -3.385 -6.037 1.00 0.00 N ATOM 0 H ASN A 88 153.754 -2.766 -7.332 1.00 0.00 H new ATOM 0 HA ASN A 88 155.509 -3.261 -9.587 1.00 0.00 H new ATOM 0 HB2 ASN A 88 155.657 -5.072 -7.144 1.00 0.00 H new ATOM 0 HB3 ASN A 88 156.586 -5.216 -8.623 1.00 0.00 H new ATOM 0 HD21 ASN A 88 157.841 -2.806 -5.578 1.00 0.00 H new ATOM 0 HD22 ASN A 88 156.368 -3.779 -5.495 1.00 0.00 H new ATOM 1484 N GLY A 89 154.196 -5.471 -10.062 1.00 0.00 N ATOM 1485 CA GLY A 89 153.187 -6.397 -10.538 1.00 0.00 C ATOM 1486 C GLY A 89 153.396 -6.789 -11.990 1.00 0.00 C ATOM 1487 O GLY A 89 152.589 -6.437 -12.850 1.00 0.00 O ATOM 0 H GLY A 89 155.101 -5.550 -10.526 1.00 0.00 H new ATOM 0 HA2 GLY A 89 153.199 -7.293 -9.918 1.00 0.00 H new ATOM 0 HA3 GLY A 89 152.202 -5.945 -10.425 1.00 0.00 H new ATOM 1491 N PRO A 90 154.482 -7.520 -12.297 1.00 0.00 N ATOM 1492 CA PRO A 90 154.784 -7.950 -13.661 1.00 0.00 C ATOM 1493 C PRO A 90 154.047 -9.229 -14.046 1.00 0.00 C ATOM 1494 O PRO A 90 154.026 -10.198 -13.287 1.00 0.00 O ATOM 1495 CB PRO A 90 156.287 -8.198 -13.607 1.00 0.00 C ATOM 1496 CG PRO A 90 156.535 -8.665 -12.212 1.00 0.00 C ATOM 1497 CD PRO A 90 155.506 -7.987 -11.341 1.00 0.00 C ATOM 0 HA PRO A 90 154.476 -7.215 -14.405 1.00 0.00 H new ATOM 0 HB2 PRO A 90 156.593 -8.947 -14.337 1.00 0.00 H new ATOM 0 HB3 PRO A 90 156.848 -7.290 -13.828 1.00 0.00 H new ATOM 0 HG2 PRO A 90 156.446 -9.749 -12.145 1.00 0.00 H new ATOM 0 HG3 PRO A 90 157.544 -8.408 -11.891 1.00 0.00 H new ATOM 0 HD2 PRO A 90 155.085 -8.677 -10.610 1.00 0.00 H new ATOM 0 HD3 PRO A 90 155.940 -7.157 -10.783 1.00 0.00 H new ATOM 1505 N VAL A 91 153.444 -9.227 -15.231 1.00 0.00 N ATOM 1506 CA VAL A 91 152.707 -10.387 -15.716 1.00 0.00 C ATOM 1507 C VAL A 91 153.350 -10.958 -16.976 1.00 0.00 C ATOM 1508 O VAL A 91 154.217 -11.847 -16.847 1.00 0.00 O ATOM 1509 CB VAL A 91 151.237 -10.039 -16.015 1.00 0.00 C ATOM 1510 CG1 VAL A 91 150.449 -11.294 -16.358 1.00 0.00 C ATOM 1511 CG2 VAL A 91 150.611 -9.315 -14.833 1.00 0.00 C ATOM 1512 OXT VAL A 91 152.981 -10.509 -18.082 1.00 0.00 O ATOM 0 H VAL A 91 153.452 -8.434 -15.873 1.00 0.00 H new ATOM 0 HA VAL A 91 152.739 -11.134 -14.923 1.00 0.00 H new ATOM 0 HB VAL A 91 151.208 -9.374 -16.878 1.00 0.00 H new ATOM 0 HG11 VAL A 91 149.413 -11.027 -16.566 1.00 0.00 H new ATOM 0 HG12 VAL A 91 150.885 -11.769 -17.237 1.00 0.00 H new ATOM 0 HG13 VAL A 91 150.484 -11.987 -15.517 1.00 0.00 H new ATOM 0 HG21 VAL A 91 149.572 -9.076 -15.061 1.00 0.00 H new ATOM 0 HG22 VAL A 91 150.651 -9.955 -13.952 1.00 0.00 H new ATOM 0 HG23 VAL A 91 151.160 -8.394 -14.638 1.00 0.00 H new TER 1522 VAL A 91