USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1025 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 2 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Set 1.2: A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -128:sc= 0.561 (180deg=-0.0435) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot -150:sc= -1.11 USER MOD Single : A 13 ASN : amide:sc= -0.106 K(o=-0.11,f=-1.7) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.492 X(o=-0.49,f=-0.51) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 60:sc= -1.57! USER MOD Single : A 39 ASN : amide:sc= -1.2 K(o=-1.2,f=-2.2) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.0554 X(o=-0.055,f=-0.085) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -0.487 USER MOD Single : A 56 GLN : amide:sc= -0.217 K(o=-0.22,f=-2.2!) USER MOD Single : A 57 SER OG : rot 100:sc= 0.51 USER MOD Single : A 58 LYS NZ :NH3+ -158:sc= -0.0438 (180deg=-0.284) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0.00981 USER MOD Single : A 64 HIS : no HD1:sc= -0.0159 X(o=-0.016,f=-0.092) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 79 SER OG : rot -34:sc= 1.14 USER MOD Single : A 81 MET CE :methyl -167:sc= 0 (180deg=-0.00876) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 83 TYR OH : rot 121:sc= 0.426 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0322 USER MOD Single : A 87 MET CE :methyl -137:sc= -0.554 (180deg=-1.65!) USER MOD Single : A 88 THR OG1 : rot 87:sc= 1.27 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.977 -7.807 -3.822 1.00 31.42 N ATOM 2 CA MET A 1 4.106 -8.493 -4.769 1.00 54.12 C ATOM 3 C MET A 1 2.728 -7.840 -4.811 1.00 53.13 C ATOM 4 O MET A 1 1.706 -8.525 -4.787 1.00 31.43 O ATOM 5 CB MET A 1 3.972 -9.970 -4.395 1.00 34.21 C ATOM 6 CG MET A 1 3.314 -10.197 -3.044 1.00 34.45 C ATOM 7 SD MET A 1 4.505 -10.252 -1.691 1.00 41.52 S ATOM 8 CE MET A 1 3.828 -11.578 -0.696 1.00 70.24 C ATOM 0 H1 MET A 1 5.871 -7.557 -4.291 1.00 31.42 H new ATOM 0 H2 MET A 1 4.509 -6.942 -3.484 1.00 31.42 H new ATOM 0 H3 MET A 1 5.173 -8.432 -3.015 1.00 31.42 H new ATOM 0 HA MET A 1 4.556 -8.416 -5.759 1.00 54.12 H new ATOM 0 HB2 MET A 1 3.391 -10.480 -5.163 1.00 34.21 H new ATOM 0 HB3 MET A 1 4.962 -10.426 -4.389 1.00 34.21 H new ATOM 0 HG2 MET A 1 2.594 -9.400 -2.857 1.00 34.45 H new ATOM 0 HG3 MET A 1 2.755 -11.133 -3.069 1.00 34.45 H new ATOM 0 HE1 MET A 1 4.457 -11.732 0.181 1.00 70.24 H new ATOM 0 HE2 MET A 1 2.819 -11.315 -0.378 1.00 70.24 H new ATOM 0 HE3 MET A 1 3.796 -12.495 -1.285 1.00 70.24 H new ATOM 18 N GLN A 2 2.708 -6.512 -4.874 1.00 64.54 N ATOM 19 CA GLN A 2 1.455 -5.768 -4.919 1.00 22.43 C ATOM 20 C GLN A 2 1.455 -4.771 -6.073 1.00 33.33 C ATOM 21 O GLN A 2 1.397 -3.560 -5.861 1.00 11.12 O ATOM 22 CB GLN A 2 1.226 -5.036 -3.596 1.00 13.52 C ATOM 23 CG GLN A 2 2.413 -4.197 -3.151 1.00 50.20 C ATOM 24 CD GLN A 2 2.228 -3.613 -1.764 1.00 41.44 C ATOM 25 OE1 GLN A 2 1.753 -4.289 -0.852 1.00 11.34 O ATOM 26 NE2 GLN A 2 2.604 -2.350 -1.599 1.00 13.32 N ATOM 0 H GLN A 2 3.545 -5.930 -4.895 1.00 64.54 H new ATOM 0 HA GLN A 2 0.644 -6.479 -5.078 1.00 22.43 H new ATOM 0 HB2 GLN A 2 0.352 -4.391 -3.694 1.00 13.52 H new ATOM 0 HB3 GLN A 2 0.998 -5.767 -2.821 1.00 13.52 H new ATOM 0 HG2 GLN A 2 3.313 -4.812 -3.165 1.00 50.20 H new ATOM 0 HG3 GLN A 2 2.569 -3.387 -3.864 1.00 50.20 H new ATOM 0 HE21 GLN A 2 2.993 -1.827 -2.384 1.00 13.32 H new ATOM 0 HE22 GLN A 2 2.504 -1.903 -0.688 1.00 13.32 H new ATOM 35 N LYS A 3 1.520 -5.289 -7.295 1.00 13.51 N ATOM 36 CA LYS A 3 1.526 -4.445 -8.484 1.00 11.30 C ATOM 37 C LYS A 3 1.595 -5.291 -9.751 1.00 55.13 C ATOM 38 O LYS A 3 1.696 -6.515 -9.687 1.00 61.20 O ATOM 39 CB LYS A 3 2.709 -3.475 -8.441 1.00 23.45 C ATOM 40 CG LYS A 3 2.371 -2.080 -8.935 1.00 52.32 C ATOM 41 CD LYS A 3 1.918 -1.180 -7.798 1.00 1.51 C ATOM 42 CE LYS A 3 0.401 -1.098 -7.721 1.00 62.14 C ATOM 43 NZ LYS A 3 -0.053 0.131 -7.014 1.00 33.11 N ATOM 0 H LYS A 3 1.569 -6.289 -7.488 1.00 13.51 H new ATOM 0 HA LYS A 3 0.597 -3.875 -8.499 1.00 11.30 H new ATOM 0 HB2 LYS A 3 3.077 -3.409 -7.417 1.00 23.45 H new ATOM 0 HB3 LYS A 3 3.521 -3.879 -9.046 1.00 23.45 H new ATOM 0 HG2 LYS A 3 3.244 -1.643 -9.420 1.00 52.32 H new ATOM 0 HG3 LYS A 3 1.585 -2.140 -9.688 1.00 52.32 H new ATOM 0 HD2 LYS A 3 2.311 -1.559 -6.854 1.00 1.51 H new ATOM 0 HD3 LYS A 3 2.331 -0.181 -7.937 1.00 1.51 H new ATOM 0 HE2 LYS A 3 -0.015 -1.112 -8.728 1.00 62.14 H new ATOM 0 HE3 LYS A 3 0.016 -1.977 -7.205 1.00 62.14 H new ATOM 0 HZ1 LYS A 3 -1.092 0.150 -6.983 1.00 33.11 H new ATOM 0 HZ2 LYS A 3 0.323 0.132 -6.044 1.00 33.11 H new ATOM 0 HZ3 LYS A 3 0.293 0.971 -7.521 1.00 33.11 H new ATOM 57 N GLY A 4 1.540 -4.629 -10.903 1.00 72.13 N ATOM 58 CA GLY A 4 1.599 -5.337 -12.169 1.00 15.21 C ATOM 59 C GLY A 4 0.224 -5.595 -12.753 1.00 51.22 C ATOM 60 O GLY A 4 0.069 -6.417 -13.657 1.00 25.51 O ATOM 0 H GLY A 4 1.456 -3.616 -10.982 1.00 72.13 H new ATOM 0 HA2 GLY A 4 2.189 -4.757 -12.879 1.00 15.21 H new ATOM 0 HA3 GLY A 4 2.114 -6.287 -12.027 1.00 15.21 H new ATOM 64 N LEU A 5 -0.778 -4.892 -12.236 1.00 71.24 N ATOM 65 CA LEU A 5 -2.148 -5.050 -12.712 1.00 33.24 C ATOM 66 C LEU A 5 -2.739 -3.706 -13.126 1.00 34.52 C ATOM 67 O LEU A 5 -2.261 -2.653 -12.709 1.00 4.54 O ATOM 68 CB LEU A 5 -3.015 -5.689 -11.625 1.00 54.40 C ATOM 69 CG LEU A 5 -2.996 -7.216 -11.562 1.00 73.24 C ATOM 70 CD1 LEU A 5 -3.440 -7.811 -12.890 1.00 51.51 C ATOM 71 CD2 LEU A 5 -1.609 -7.717 -11.189 1.00 21.42 C ATOM 0 H LEU A 5 -0.668 -4.208 -11.488 1.00 71.24 H new ATOM 0 HA LEU A 5 -2.131 -5.702 -13.585 1.00 33.24 H new ATOM 0 HB2 LEU A 5 -2.694 -5.302 -10.658 1.00 54.40 H new ATOM 0 HB3 LEU A 5 -4.045 -5.364 -11.772 1.00 54.40 H new ATOM 0 HG LEU A 5 -3.696 -7.537 -10.791 1.00 73.24 H new ATOM 0 HD11 LEU A 5 -3.420 -8.899 -12.826 1.00 51.51 H new ATOM 0 HD12 LEU A 5 -4.453 -7.479 -13.117 1.00 51.51 H new ATOM 0 HD13 LEU A 5 -2.765 -7.482 -13.680 1.00 51.51 H new ATOM 0 HD21 LEU A 5 -1.614 -8.806 -11.149 1.00 21.42 H new ATOM 0 HD22 LEU A 5 -0.889 -7.385 -11.937 1.00 21.42 H new ATOM 0 HD23 LEU A 5 -1.329 -7.319 -10.214 1.00 21.42 H new ATOM 83 N GLU A 6 -3.784 -3.753 -13.947 1.00 42.01 N ATOM 84 CA GLU A 6 -4.441 -2.538 -14.416 1.00 23.51 C ATOM 85 C GLU A 6 -5.759 -2.315 -13.681 1.00 53.12 C ATOM 86 O GLU A 6 -6.539 -3.248 -13.485 1.00 64.02 O ATOM 87 CB GLU A 6 -4.691 -2.617 -15.923 1.00 50.13 C ATOM 88 CG GLU A 6 -3.527 -3.204 -16.704 1.00 33.52 C ATOM 89 CD GLU A 6 -3.834 -4.582 -17.259 1.00 44.23 C ATOM 90 OE1 GLU A 6 -4.818 -4.710 -18.018 1.00 4.53 O ATOM 91 OE2 GLU A 6 -3.090 -5.531 -16.936 1.00 32.42 O ATOM 0 H GLU A 6 -4.193 -4.618 -14.301 1.00 42.01 H new ATOM 0 HA GLU A 6 -3.782 -1.695 -14.208 1.00 23.51 H new ATOM 0 HB2 GLU A 6 -5.580 -3.221 -16.104 1.00 50.13 H new ATOM 0 HB3 GLU A 6 -4.903 -1.617 -16.300 1.00 50.13 H new ATOM 0 HG2 GLU A 6 -3.270 -2.534 -17.525 1.00 33.52 H new ATOM 0 HG3 GLU A 6 -2.653 -3.264 -16.056 1.00 33.52 H new ATOM 98 N ILE A 7 -6.001 -1.073 -13.277 1.00 53.50 N ATOM 99 CA ILE A 7 -7.225 -0.726 -12.565 1.00 21.13 C ATOM 100 C ILE A 7 -7.741 0.644 -12.992 1.00 24.10 C ATOM 101 O ILE A 7 -6.960 1.546 -13.292 1.00 42.42 O ATOM 102 CB ILE A 7 -7.008 -0.728 -11.040 1.00 14.11 C ATOM 103 CG1 ILE A 7 -5.639 -0.138 -10.697 1.00 21.34 C ATOM 104 CG2 ILE A 7 -7.137 -2.140 -10.488 1.00 65.14 C ATOM 105 CD1 ILE A 7 -4.530 -1.166 -10.662 1.00 21.52 C ATOM 0 H ILE A 7 -5.366 -0.290 -13.430 1.00 53.50 H new ATOM 0 HA ILE A 7 -7.964 -1.485 -12.820 1.00 21.13 H new ATOM 0 HB ILE A 7 -7.776 -0.107 -10.578 1.00 14.11 H new ATOM 0 HG12 ILE A 7 -5.389 0.629 -11.430 1.00 21.34 H new ATOM 0 HG13 ILE A 7 -5.697 0.355 -9.727 1.00 21.34 H new ATOM 0 HG21 ILE A 7 -6.981 -2.125 -9.409 1.00 65.14 H new ATOM 0 HG22 ILE A 7 -8.133 -2.526 -10.705 1.00 65.14 H new ATOM 0 HG23 ILE A 7 -6.390 -2.782 -10.954 1.00 65.14 H new ATOM 0 HD11 ILE A 7 -3.588 -0.677 -10.413 1.00 21.52 H new ATOM 0 HD12 ILE A 7 -4.757 -1.921 -9.909 1.00 21.52 H new ATOM 0 HD13 ILE A 7 -4.444 -1.642 -11.639 1.00 21.52 H new ATOM 117 N ALA A 8 -9.061 0.792 -13.015 1.00 51.03 N ATOM 118 CA ALA A 8 -9.682 2.053 -13.402 1.00 4.12 C ATOM 119 C ALA A 8 -10.597 2.575 -12.299 1.00 44.33 C ATOM 120 O ALA A 8 -11.227 1.798 -11.582 1.00 4.24 O ATOM 121 CB ALA A 8 -10.459 1.883 -14.699 1.00 4.21 C ATOM 0 H ALA A 8 -9.721 0.054 -12.770 1.00 51.03 H new ATOM 0 HA ALA A 8 -8.891 2.786 -13.559 1.00 4.12 H new ATOM 0 HB1 ALA A 8 -10.917 2.832 -14.976 1.00 4.21 H new ATOM 0 HB2 ALA A 8 -9.781 1.563 -15.490 1.00 4.21 H new ATOM 0 HB3 ALA A 8 -11.236 1.131 -14.562 1.00 4.21 H new ATOM 127 N PHE A 9 -10.665 3.896 -12.169 1.00 43.14 N ATOM 128 CA PHE A 9 -11.502 4.522 -11.153 1.00 2.14 C ATOM 129 C PHE A 9 -12.191 5.766 -11.706 1.00 32.20 C ATOM 130 O PHE A 9 -11.581 6.558 -12.424 1.00 34.22 O ATOM 131 CB PHE A 9 -10.662 4.893 -9.928 1.00 74.31 C ATOM 132 CG PHE A 9 -11.423 5.673 -8.894 1.00 43.01 C ATOM 133 CD1 PHE A 9 -12.571 5.152 -8.319 1.00 63.15 C ATOM 134 CD2 PHE A 9 -10.989 6.928 -8.497 1.00 75.12 C ATOM 135 CE1 PHE A 9 -13.272 5.867 -7.367 1.00 55.24 C ATOM 136 CE2 PHE A 9 -11.687 7.647 -7.545 1.00 42.53 C ATOM 137 CZ PHE A 9 -12.830 7.117 -6.981 1.00 13.14 C ATOM 0 H PHE A 9 -10.150 4.553 -12.755 1.00 43.14 H new ATOM 0 HA PHE A 9 -12.268 3.805 -10.857 1.00 2.14 H new ATOM 0 HB2 PHE A 9 -10.276 3.981 -9.472 1.00 74.31 H new ATOM 0 HB3 PHE A 9 -9.801 5.477 -10.251 1.00 74.31 H new ATOM 0 HD1 PHE A 9 -12.922 4.176 -8.619 1.00 63.15 H new ATOM 0 HD2 PHE A 9 -10.096 7.348 -8.936 1.00 75.12 H new ATOM 0 HE1 PHE A 9 -14.164 5.449 -6.925 1.00 55.24 H new ATOM 0 HE2 PHE A 9 -11.338 8.623 -7.242 1.00 42.53 H new ATOM 0 HZ PHE A 9 -13.378 7.679 -6.239 1.00 13.14 H new ATOM 147 N GLN A 10 -13.466 5.929 -11.367 1.00 21.14 N ATOM 148 CA GLN A 10 -14.239 7.075 -11.830 1.00 62.04 C ATOM 149 C GLN A 10 -14.582 8.005 -10.671 1.00 43.25 C ATOM 150 O GLN A 10 -14.545 7.605 -9.507 1.00 70.24 O ATOM 151 CB GLN A 10 -15.521 6.607 -12.521 1.00 31.45 C ATOM 152 CG GLN A 10 -16.432 5.787 -11.621 1.00 23.13 C ATOM 153 CD GLN A 10 -17.880 5.822 -12.068 1.00 64.34 C ATOM 154 OE1 GLN A 10 -18.384 4.862 -12.651 1.00 75.34 O ATOM 155 NE2 GLN A 10 -18.557 6.931 -11.797 1.00 42.35 N ATOM 0 H GLN A 10 -13.985 5.282 -10.774 1.00 21.14 H new ATOM 0 HA GLN A 10 -13.630 7.627 -12.546 1.00 62.04 H new ATOM 0 HB2 GLN A 10 -16.068 7.478 -12.882 1.00 31.45 H new ATOM 0 HB3 GLN A 10 -15.256 6.012 -13.395 1.00 31.45 H new ATOM 0 HG2 GLN A 10 -16.086 4.754 -11.605 1.00 23.13 H new ATOM 0 HG3 GLN A 10 -16.362 6.163 -10.600 1.00 23.13 H new ATOM 0 HE21 GLN A 10 -18.099 7.702 -11.312 1.00 42.35 H new ATOM 0 HE22 GLN A 10 -19.535 7.012 -12.074 1.00 42.35 H new ATOM 164 N THR A 11 -14.915 9.250 -10.997 1.00 51.41 N ATOM 165 CA THR A 11 -15.263 10.238 -9.984 1.00 10.33 C ATOM 166 C THR A 11 -16.150 11.333 -10.565 1.00 14.10 C ATOM 167 O THR A 11 -16.112 11.604 -11.766 1.00 22.04 O ATOM 168 CB THR A 11 -14.005 10.883 -9.373 1.00 2.53 C ATOM 169 OG1 THR A 11 -14.363 12.066 -8.648 1.00 60.43 O ATOM 170 CG2 THR A 11 -12.995 11.233 -10.456 1.00 34.31 C ATOM 0 H THR A 11 -14.951 9.598 -11.955 1.00 51.41 H new ATOM 0 HA THR A 11 -15.808 9.710 -9.202 1.00 10.33 H new ATOM 0 HB THR A 11 -13.550 10.164 -8.692 1.00 2.53 H new ATOM 0 HG1 THR A 11 -13.619 12.703 -8.674 1.00 60.43 H new ATOM 0 HG21 THR A 11 -12.115 11.687 -10.000 1.00 34.31 H new ATOM 0 HG22 THR A 11 -12.702 10.327 -10.987 1.00 34.31 H new ATOM 0 HG23 THR A 11 -13.443 11.936 -11.158 1.00 34.31 H new ATOM 178 N ILE A 12 -16.948 11.960 -9.707 1.00 30.44 N ATOM 179 CA ILE A 12 -17.844 13.027 -10.136 1.00 24.51 C ATOM 180 C ILE A 12 -18.340 13.840 -8.945 1.00 44.14 C ATOM 181 O ILE A 12 -18.052 13.514 -7.795 1.00 33.53 O ATOM 182 CB ILE A 12 -19.057 12.469 -10.903 1.00 63.43 C ATOM 183 CG1 ILE A 12 -19.438 11.088 -10.364 1.00 52.50 C ATOM 184 CG2 ILE A 12 -18.754 12.396 -12.392 1.00 41.35 C ATOM 185 CD1 ILE A 12 -19.748 11.083 -8.883 1.00 62.34 C ATOM 0 H ILE A 12 -16.992 11.747 -8.710 1.00 30.44 H new ATOM 0 HA ILE A 12 -17.270 13.673 -10.800 1.00 24.51 H new ATOM 0 HB ILE A 12 -19.902 13.142 -10.756 1.00 63.43 H new ATOM 0 HG12 ILE A 12 -20.307 10.720 -10.910 1.00 52.50 H new ATOM 0 HG13 ILE A 12 -18.621 10.393 -10.559 1.00 52.50 H new ATOM 0 HG21 ILE A 12 -19.621 12.000 -12.921 1.00 41.35 H new ATOM 0 HG22 ILE A 12 -18.526 13.394 -12.766 1.00 41.35 H new ATOM 0 HG23 ILE A 12 -17.898 11.742 -12.557 1.00 41.35 H new ATOM 0 HD11 ILE A 12 -20.010 10.072 -8.570 1.00 62.34 H new ATOM 0 HD12 ILE A 12 -18.873 11.420 -8.327 1.00 62.34 H new ATOM 0 HD13 ILE A 12 -20.585 11.753 -8.684 1.00 62.34 H new ATOM 197 N ASN A 13 -19.088 14.901 -9.231 1.00 61.20 N ATOM 198 CA ASN A 13 -19.626 15.761 -8.183 1.00 42.25 C ATOM 199 C ASN A 13 -18.502 16.395 -7.370 1.00 3.32 C ATOM 200 O ASN A 13 -18.719 16.871 -6.256 1.00 54.25 O ATOM 201 CB ASN A 13 -20.549 14.962 -7.262 1.00 31.40 C ATOM 202 CG ASN A 13 -21.516 15.848 -6.501 1.00 40.44 C ATOM 203 OD1 ASN A 13 -21.522 17.068 -6.671 1.00 24.24 O ATOM 204 ND2 ASN A 13 -22.340 15.238 -5.658 1.00 22.15 N ATOM 0 H ASN A 13 -19.335 15.186 -10.179 1.00 61.20 H new ATOM 0 HA ASN A 13 -20.200 16.556 -8.659 1.00 42.25 H new ATOM 0 HB2 ASN A 13 -21.111 14.240 -7.854 1.00 31.40 H new ATOM 0 HB3 ASN A 13 -19.947 14.394 -6.553 1.00 31.40 H new ATOM 0 HD21 ASN A 13 -23.013 15.783 -5.119 1.00 22.15 H new ATOM 0 HD22 ASN A 13 -22.300 14.225 -5.549 1.00 22.15 H new ATOM 211 N GLY A 14 -17.298 16.398 -7.935 1.00 52.31 N ATOM 212 CA GLY A 14 -16.158 16.977 -7.249 1.00 22.32 C ATOM 213 C GLY A 14 -15.995 16.440 -5.840 1.00 54.34 C ATOM 214 O GLY A 14 -15.457 17.122 -4.967 1.00 33.44 O ATOM 0 H GLY A 14 -17.092 16.010 -8.855 1.00 52.31 H new ATOM 0 HA2 GLY A 14 -15.252 16.772 -7.820 1.00 22.32 H new ATOM 0 HA3 GLY A 14 -16.273 18.060 -7.211 1.00 22.32 H new ATOM 218 N LEU A 15 -16.463 15.217 -5.618 1.00 24.23 N ATOM 219 CA LEU A 15 -16.368 14.589 -4.304 1.00 52.22 C ATOM 220 C LEU A 15 -15.161 13.660 -4.230 1.00 44.31 C ATOM 221 O LEU A 15 -14.395 13.697 -3.267 1.00 44.30 O ATOM 222 CB LEU A 15 -17.647 13.807 -3.998 1.00 2.55 C ATOM 223 CG LEU A 15 -17.972 13.607 -2.517 1.00 12.10 C ATOM 224 CD1 LEU A 15 -16.901 12.763 -1.844 1.00 44.34 C ATOM 225 CD2 LEU A 15 -18.114 14.950 -1.816 1.00 15.04 C ATOM 0 H LEU A 15 -16.912 14.640 -6.330 1.00 24.23 H new ATOM 0 HA LEU A 15 -16.243 15.376 -3.560 1.00 52.22 H new ATOM 0 HB2 LEU A 15 -18.485 14.322 -4.467 1.00 2.55 H new ATOM 0 HB3 LEU A 15 -17.571 12.827 -4.469 1.00 2.55 H new ATOM 0 HG LEU A 15 -18.922 13.078 -2.442 1.00 12.10 H new ATOM 0 HD11 LEU A 15 -17.150 12.632 -0.791 1.00 44.34 H new ATOM 0 HD12 LEU A 15 -16.848 11.788 -2.329 1.00 44.34 H new ATOM 0 HD13 LEU A 15 -15.936 13.263 -1.929 1.00 44.34 H new ATOM 0 HD21 LEU A 15 -18.345 14.788 -0.763 1.00 15.04 H new ATOM 0 HD22 LEU A 15 -17.180 15.505 -1.901 1.00 15.04 H new ATOM 0 HD23 LEU A 15 -18.919 15.520 -2.281 1.00 15.04 H new ATOM 237 N ASP A 16 -14.996 12.830 -5.254 1.00 21.11 N ATOM 238 CA ASP A 16 -13.879 11.893 -5.307 1.00 14.42 C ATOM 239 C ASP A 16 -12.647 12.551 -5.920 1.00 1.24 C ATOM 240 O ASP A 16 -11.563 11.968 -5.933 1.00 13.40 O ATOM 241 CB ASP A 16 -14.265 10.652 -6.114 1.00 3.45 C ATOM 242 CG ASP A 16 -14.738 9.513 -5.232 1.00 65.14 C ATOM 243 OD1 ASP A 16 -14.056 9.217 -4.229 1.00 11.42 O ATOM 244 OD2 ASP A 16 -15.789 8.916 -5.547 1.00 64.10 O ATOM 0 H ASP A 16 -15.621 12.787 -6.059 1.00 21.11 H new ATOM 0 HA ASP A 16 -13.639 11.593 -4.287 1.00 14.42 H new ATOM 0 HB2 ASP A 16 -15.053 10.912 -6.821 1.00 3.45 H new ATOM 0 HB3 ASP A 16 -13.407 10.322 -6.700 1.00 3.45 H new ATOM 249 N GLU A 17 -12.822 13.768 -6.426 1.00 62.44 N ATOM 250 CA GLU A 17 -11.724 14.503 -7.042 1.00 64.03 C ATOM 251 C GLU A 17 -10.508 14.537 -6.121 1.00 44.40 C ATOM 252 O GLU A 17 -9.378 14.321 -6.559 1.00 5.33 O ATOM 253 CB GLU A 17 -12.162 15.930 -7.380 1.00 63.41 C ATOM 254 CG GLU A 17 -12.729 16.689 -6.193 1.00 2.42 C ATOM 255 CD GLU A 17 -13.308 18.035 -6.584 1.00 2.21 C ATOM 256 OE1 GLU A 17 -13.435 18.297 -7.798 1.00 71.42 O ATOM 257 OE2 GLU A 17 -13.634 18.827 -5.675 1.00 22.13 O ATOM 0 H GLU A 17 -13.713 14.265 -6.421 1.00 62.44 H new ATOM 0 HA GLU A 17 -11.447 13.988 -7.962 1.00 64.03 H new ATOM 0 HB2 GLU A 17 -11.308 16.479 -7.777 1.00 63.41 H new ATOM 0 HB3 GLU A 17 -12.913 15.893 -8.169 1.00 63.41 H new ATOM 0 HG2 GLU A 17 -13.505 16.088 -5.719 1.00 2.42 H new ATOM 0 HG3 GLU A 17 -11.943 16.837 -5.452 1.00 2.42 H new ATOM 264 N SER A 18 -10.748 14.811 -4.843 1.00 14.12 N ATOM 265 CA SER A 18 -9.674 14.879 -3.860 1.00 25.52 C ATOM 266 C SER A 18 -8.925 13.551 -3.781 1.00 51.34 C ATOM 267 O SER A 18 -7.695 13.521 -3.733 1.00 64.23 O ATOM 268 CB SER A 18 -10.234 15.243 -2.484 1.00 33.22 C ATOM 269 OG SER A 18 -10.341 16.648 -2.332 1.00 75.34 O ATOM 0 H SER A 18 -11.678 14.990 -4.464 1.00 14.12 H new ATOM 0 HA SER A 18 -8.975 15.653 -4.176 1.00 25.52 H new ATOM 0 HB2 SER A 18 -11.214 14.784 -2.354 1.00 33.22 H new ATOM 0 HB3 SER A 18 -9.587 14.838 -1.706 1.00 33.22 H new ATOM 0 HG SER A 18 -10.703 16.854 -1.445 1.00 75.34 H new ATOM 275 N LEU A 19 -9.676 12.456 -3.769 1.00 33.23 N ATOM 276 CA LEU A 19 -9.086 11.124 -3.696 1.00 63.12 C ATOM 277 C LEU A 19 -8.221 10.844 -4.921 1.00 40.22 C ATOM 278 O LEU A 19 -7.162 10.225 -4.818 1.00 42.23 O ATOM 279 CB LEU A 19 -10.182 10.064 -3.579 1.00 73.11 C ATOM 280 CG LEU A 19 -9.706 8.615 -3.473 1.00 34.35 C ATOM 281 CD1 LEU A 19 -9.458 8.031 -4.855 1.00 12.31 C ATOM 282 CD2 LEU A 19 -8.448 8.528 -2.621 1.00 71.22 C ATOM 0 H LEU A 19 -10.695 12.464 -3.809 1.00 33.23 H new ATOM 0 HA LEU A 19 -8.453 11.082 -2.809 1.00 63.12 H new ATOM 0 HB2 LEU A 19 -10.787 10.292 -2.702 1.00 73.11 H new ATOM 0 HB3 LEU A 19 -10.835 10.148 -4.448 1.00 73.11 H new ATOM 0 HG LEU A 19 -10.489 8.030 -2.990 1.00 34.35 H new ATOM 0 HD11 LEU A 19 -9.120 6.999 -4.759 1.00 12.31 H new ATOM 0 HD12 LEU A 19 -10.382 8.058 -5.432 1.00 12.31 H new ATOM 0 HD13 LEU A 19 -8.694 8.617 -5.366 1.00 12.31 H new ATOM 0 HD21 LEU A 19 -8.123 7.489 -2.556 1.00 71.22 H new ATOM 0 HD22 LEU A 19 -7.659 9.127 -3.075 1.00 71.22 H new ATOM 0 HD23 LEU A 19 -8.659 8.905 -1.620 1.00 71.22 H new ATOM 294 N VAL A 20 -8.679 11.306 -6.080 1.00 42.44 N ATOM 295 CA VAL A 20 -7.946 11.109 -7.325 1.00 42.12 C ATOM 296 C VAL A 20 -6.609 11.841 -7.298 1.00 1.43 C ATOM 297 O VAL A 20 -5.557 11.240 -7.511 1.00 62.12 O ATOM 298 CB VAL A 20 -8.760 11.595 -8.539 1.00 40.10 C ATOM 299 CG1 VAL A 20 -7.948 11.454 -9.818 1.00 35.42 C ATOM 300 CG2 VAL A 20 -10.070 10.830 -8.642 1.00 75.50 C ATOM 0 H VAL A 20 -9.554 11.819 -6.183 1.00 42.44 H new ATOM 0 HA VAL A 20 -7.769 10.038 -7.421 1.00 42.12 H new ATOM 0 HB VAL A 20 -8.992 12.651 -8.400 1.00 40.10 H new ATOM 0 HG11 VAL A 20 -8.539 11.802 -10.665 1.00 35.42 H new ATOM 0 HG12 VAL A 20 -7.040 12.051 -9.740 1.00 35.42 H new ATOM 0 HG13 VAL A 20 -7.682 10.407 -9.967 1.00 35.42 H new ATOM 0 HG21 VAL A 20 -10.632 11.186 -9.505 1.00 75.50 H new ATOM 0 HG22 VAL A 20 -9.862 9.766 -8.758 1.00 75.50 H new ATOM 0 HG23 VAL A 20 -10.656 10.988 -7.737 1.00 75.50 H new ATOM 310 N GLN A 21 -6.659 13.143 -7.033 1.00 23.10 N ATOM 311 CA GLN A 21 -5.451 13.957 -6.978 1.00 4.52 C ATOM 312 C GLN A 21 -4.554 13.523 -5.823 1.00 45.24 C ATOM 313 O GLN A 21 -3.328 13.573 -5.924 1.00 51.12 O ATOM 314 CB GLN A 21 -5.813 15.436 -6.829 1.00 14.01 C ATOM 315 CG GLN A 21 -6.662 15.734 -5.603 1.00 65.00 C ATOM 316 CD GLN A 21 -7.333 17.091 -5.674 1.00 12.11 C ATOM 317 OE1 GLN A 21 -8.075 17.381 -6.613 1.00 44.42 O ATOM 318 NE2 GLN A 21 -7.077 17.931 -4.678 1.00 50.51 N ATOM 0 H GLN A 21 -7.522 13.656 -6.853 1.00 23.10 H new ATOM 0 HA GLN A 21 -4.906 13.816 -7.911 1.00 4.52 H new ATOM 0 HB2 GLN A 21 -4.896 16.023 -6.777 1.00 14.01 H new ATOM 0 HB3 GLN A 21 -6.349 15.762 -7.720 1.00 14.01 H new ATOM 0 HG2 GLN A 21 -7.424 14.961 -5.497 1.00 65.00 H new ATOM 0 HG3 GLN A 21 -6.036 15.689 -4.712 1.00 65.00 H new ATOM 0 HE21 GLN A 21 -6.456 17.649 -3.920 1.00 50.51 H new ATOM 0 HE22 GLN A 21 -7.502 18.858 -4.671 1.00 50.51 H new ATOM 327 N ALA A 22 -5.173 13.098 -4.727 1.00 63.41 N ATOM 328 CA ALA A 22 -4.430 12.653 -3.554 1.00 71.03 C ATOM 329 C ALA A 22 -3.711 11.336 -3.827 1.00 4.34 C ATOM 330 O ALA A 22 -2.506 11.217 -3.601 1.00 3.15 O ATOM 331 CB ALA A 22 -5.364 12.510 -2.362 1.00 21.44 C ATOM 0 H ALA A 22 -6.187 13.052 -4.626 1.00 63.41 H new ATOM 0 HA ALA A 22 -3.677 13.406 -3.323 1.00 71.03 H new ATOM 0 HB1 ALA A 22 -4.796 12.177 -1.493 1.00 21.44 H new ATOM 0 HB2 ALA A 22 -5.828 13.472 -2.146 1.00 21.44 H new ATOM 0 HB3 ALA A 22 -6.138 11.778 -2.592 1.00 21.44 H new ATOM 337 N LEU A 23 -4.456 10.350 -4.312 1.00 60.14 N ATOM 338 CA LEU A 23 -3.889 9.040 -4.615 1.00 40.32 C ATOM 339 C LEU A 23 -2.815 9.148 -5.693 1.00 24.04 C ATOM 340 O LEU A 23 -1.837 8.401 -5.685 1.00 5.25 O ATOM 341 CB LEU A 23 -4.989 8.079 -5.070 1.00 2.31 C ATOM 342 CG LEU A 23 -5.298 8.074 -6.567 1.00 72.54 C ATOM 343 CD1 LEU A 23 -4.387 7.099 -7.297 1.00 45.31 C ATOM 344 CD2 LEU A 23 -6.759 7.723 -6.809 1.00 32.43 C ATOM 0 H LEU A 23 -5.454 10.432 -4.504 1.00 60.14 H new ATOM 0 HA LEU A 23 -3.429 8.652 -3.706 1.00 40.32 H new ATOM 0 HB2 LEU A 23 -4.706 7.069 -4.774 1.00 2.31 H new ATOM 0 HB3 LEU A 23 -5.904 8.325 -4.531 1.00 2.31 H new ATOM 0 HG LEU A 23 -5.115 9.074 -6.959 1.00 72.54 H new ATOM 0 HD11 LEU A 23 -4.622 7.109 -8.361 1.00 45.31 H new ATOM 0 HD12 LEU A 23 -3.348 7.394 -7.152 1.00 45.31 H new ATOM 0 HD13 LEU A 23 -4.538 6.094 -6.902 1.00 45.31 H new ATOM 0 HD21 LEU A 23 -6.961 7.724 -7.880 1.00 32.43 H new ATOM 0 HD22 LEU A 23 -6.968 6.734 -6.401 1.00 32.43 H new ATOM 0 HD23 LEU A 23 -7.396 8.459 -6.319 1.00 32.43 H new ATOM 356 N ALA A 24 -3.003 10.084 -6.617 1.00 61.33 N ATOM 357 CA ALA A 24 -2.048 10.292 -7.699 1.00 10.13 C ATOM 358 C ALA A 24 -0.705 10.772 -7.160 1.00 3.11 C ATOM 359 O ALA A 24 0.347 10.266 -7.548 1.00 44.31 O ATOM 360 CB ALA A 24 -2.601 11.289 -8.706 1.00 72.25 C ATOM 0 H ALA A 24 -3.808 10.710 -6.638 1.00 61.33 H new ATOM 0 HA ALA A 24 -1.889 9.337 -8.199 1.00 10.13 H new ATOM 0 HB1 ALA A 24 -1.878 11.435 -9.508 1.00 72.25 H new ATOM 0 HB2 ALA A 24 -3.533 10.907 -9.123 1.00 72.25 H new ATOM 0 HB3 ALA A 24 -2.789 12.241 -8.210 1.00 72.25 H new ATOM 366 N GLY A 25 -0.748 11.753 -6.263 1.00 20.20 N ATOM 367 CA GLY A 25 0.473 12.285 -5.686 1.00 53.13 C ATOM 368 C GLY A 25 1.125 11.320 -4.717 1.00 21.41 C ATOM 369 O GLY A 25 2.351 11.256 -4.622 1.00 51.45 O ATOM 0 H GLY A 25 -1.606 12.189 -5.926 1.00 20.20 H new ATOM 0 HA2 GLY A 25 1.175 12.522 -6.485 1.00 53.13 H new ATOM 0 HA3 GLY A 25 0.250 13.219 -5.169 1.00 53.13 H new ATOM 373 N VAL A 26 0.304 10.566 -3.992 1.00 62.34 N ATOM 374 CA VAL A 26 0.808 9.599 -3.024 1.00 64.14 C ATOM 375 C VAL A 26 1.579 8.480 -3.716 1.00 33.41 C ATOM 376 O VAL A 26 2.713 8.172 -3.348 1.00 60.53 O ATOM 377 CB VAL A 26 -0.336 8.984 -2.197 1.00 0.33 C ATOM 378 CG1 VAL A 26 0.194 7.893 -1.280 1.00 25.31 C ATOM 379 CG2 VAL A 26 -1.053 10.062 -1.397 1.00 62.12 C ATOM 0 H VAL A 26 -0.713 10.606 -4.057 1.00 62.34 H new ATOM 0 HA VAL A 26 1.479 10.140 -2.356 1.00 64.14 H new ATOM 0 HB VAL A 26 -1.054 8.532 -2.882 1.00 0.33 H new ATOM 0 HG11 VAL A 26 -0.629 7.470 -0.704 1.00 25.31 H new ATOM 0 HG12 VAL A 26 0.658 7.109 -1.878 1.00 25.31 H new ATOM 0 HG13 VAL A 26 0.933 8.317 -0.600 1.00 25.31 H new ATOM 0 HG21 VAL A 26 -1.859 9.610 -0.818 1.00 62.12 H new ATOM 0 HG22 VAL A 26 -0.347 10.544 -0.721 1.00 62.12 H new ATOM 0 HG23 VAL A 26 -1.468 10.805 -2.078 1.00 62.12 H new ATOM 389 N THR A 27 0.955 7.873 -4.721 1.00 62.32 N ATOM 390 CA THR A 27 1.581 6.787 -5.465 1.00 22.34 C ATOM 391 C THR A 27 2.785 7.285 -6.256 1.00 70.42 C ATOM 392 O THR A 27 3.804 6.601 -6.350 1.00 73.35 O ATOM 393 CB THR A 27 0.585 6.121 -6.432 1.00 74.21 C ATOM 394 OG1 THR A 27 1.218 5.033 -7.115 1.00 54.25 O ATOM 395 CG2 THR A 27 0.060 7.127 -7.446 1.00 20.44 C ATOM 0 H THR A 27 0.016 8.115 -5.038 1.00 62.32 H new ATOM 0 HA THR A 27 1.911 6.051 -4.732 1.00 22.34 H new ATOM 0 HB THR A 27 -0.256 5.744 -5.850 1.00 74.21 H new ATOM 0 HG1 THR A 27 0.577 4.614 -7.727 1.00 54.25 H new ATOM 0 HG21 THR A 27 -0.642 6.633 -8.118 1.00 20.44 H new ATOM 0 HG22 THR A 27 -0.447 7.939 -6.924 1.00 20.44 H new ATOM 0 HG23 THR A 27 0.892 7.530 -8.023 1.00 20.44 H new ATOM 403 N ALA A 28 2.661 8.480 -6.823 1.00 41.22 N ATOM 404 CA ALA A 28 3.741 9.071 -7.605 1.00 34.45 C ATOM 405 C ALA A 28 4.892 9.510 -6.706 1.00 60.52 C ATOM 406 O ALA A 28 6.052 9.498 -7.117 1.00 62.54 O ATOM 407 CB ALA A 28 3.222 10.249 -8.415 1.00 0.41 C ATOM 0 H ALA A 28 1.824 9.058 -6.756 1.00 41.22 H new ATOM 0 HA ALA A 28 4.119 8.312 -8.290 1.00 34.45 H new ATOM 0 HB1 ALA A 28 4.039 10.681 -8.994 1.00 0.41 H new ATOM 0 HB2 ALA A 28 2.438 9.908 -9.091 1.00 0.41 H new ATOM 0 HB3 ALA A 28 2.817 11.004 -7.741 1.00 0.41 H new ATOM 413 N SER A 29 4.564 9.897 -5.478 1.00 14.30 N ATOM 414 CA SER A 29 5.570 10.345 -4.523 1.00 24.43 C ATOM 415 C SER A 29 6.322 9.157 -3.929 1.00 60.14 C ATOM 416 O SER A 29 7.551 9.159 -3.858 1.00 21.11 O ATOM 417 CB SER A 29 4.917 11.159 -3.405 1.00 11.24 C ATOM 418 OG SER A 29 5.887 11.639 -2.489 1.00 73.15 O ATOM 0 H SER A 29 3.609 9.909 -5.121 1.00 14.30 H new ATOM 0 HA SER A 29 6.283 10.977 -5.054 1.00 24.43 H new ATOM 0 HB2 SER A 29 4.371 11.999 -3.834 1.00 11.24 H new ATOM 0 HB3 SER A 29 4.190 10.541 -2.878 1.00 11.24 H new ATOM 0 HG SER A 29 5.444 12.157 -1.785 1.00 73.15 H new ATOM 424 N ASP A 30 5.574 8.144 -3.505 1.00 44.03 N ATOM 425 CA ASP A 30 6.168 6.948 -2.919 1.00 5.32 C ATOM 426 C ASP A 30 6.655 5.994 -4.005 1.00 52.33 C ATOM 427 O ASP A 30 7.424 5.071 -3.737 1.00 11.14 O ATOM 428 CB ASP A 30 5.157 6.240 -2.016 1.00 54.35 C ATOM 429 CG ASP A 30 5.822 5.321 -1.011 1.00 14.34 C ATOM 430 OD1 ASP A 30 6.826 5.740 -0.399 1.00 21.04 O ATOM 431 OD2 ASP A 30 5.338 4.183 -0.836 1.00 71.01 O ATOM 0 H ASP A 30 4.555 8.127 -3.556 1.00 44.03 H new ATOM 0 HA ASP A 30 7.025 7.255 -2.320 1.00 5.32 H new ATOM 0 HB2 ASP A 30 4.564 6.985 -1.486 1.00 54.35 H new ATOM 0 HB3 ASP A 30 4.467 5.662 -2.631 1.00 54.35 H new ATOM 436 N PHE A 31 6.200 6.223 -5.233 1.00 24.20 N ATOM 437 CA PHE A 31 6.587 5.382 -6.360 1.00 44.42 C ATOM 438 C PHE A 31 7.112 4.033 -5.878 1.00 10.23 C ATOM 439 O PHE A 31 8.292 3.711 -6.018 1.00 0.31 O ATOM 440 CB PHE A 31 7.653 6.084 -7.205 1.00 11.23 C ATOM 441 CG PHE A 31 8.542 6.998 -6.410 1.00 72.21 C ATOM 442 CD1 PHE A 31 9.271 6.514 -5.336 1.00 1.32 C ATOM 443 CD2 PHE A 31 8.648 8.340 -6.738 1.00 24.22 C ATOM 444 CE1 PHE A 31 10.089 7.353 -4.603 1.00 1.14 C ATOM 445 CE2 PHE A 31 9.465 9.183 -6.008 1.00 42.35 C ATOM 446 CZ PHE A 31 10.187 8.689 -4.940 1.00 62.21 C ATOM 0 H PHE A 31 5.564 6.983 -5.473 1.00 24.20 H new ATOM 0 HA PHE A 31 5.702 5.210 -6.973 1.00 44.42 H new ATOM 0 HB2 PHE A 31 8.268 5.331 -7.699 1.00 11.23 H new ATOM 0 HB3 PHE A 31 7.162 6.660 -7.990 1.00 11.23 H new ATOM 0 HD1 PHE A 31 9.199 5.470 -5.069 1.00 1.32 H new ATOM 0 HD2 PHE A 31 8.086 8.732 -7.573 1.00 24.22 H new ATOM 0 HE1 PHE A 31 10.651 6.964 -3.767 1.00 1.14 H new ATOM 0 HE2 PHE A 31 9.538 10.227 -6.273 1.00 42.35 H new ATOM 0 HZ PHE A 31 10.827 9.346 -4.369 1.00 62.21 H new ATOM 456 N PRO A 32 6.215 3.224 -5.295 1.00 12.33 N ATOM 457 CA PRO A 32 6.563 1.897 -4.779 1.00 61.13 C ATOM 458 C PRO A 32 6.877 0.906 -5.895 1.00 3.01 C ATOM 459 O PRO A 32 7.655 -0.029 -5.706 1.00 61.52 O ATOM 460 CB PRO A 32 5.303 1.468 -4.023 1.00 3.43 C ATOM 461 CG PRO A 32 4.197 2.229 -4.668 1.00 12.32 C ATOM 462 CD PRO A 32 4.791 3.543 -5.094 1.00 43.12 C ATOM 0 HA PRO A 32 7.460 1.923 -4.160 1.00 61.13 H new ATOM 0 HB2 PRO A 32 5.142 0.393 -4.101 1.00 3.43 H new ATOM 0 HB3 PRO A 32 5.379 1.703 -2.961 1.00 3.43 H new ATOM 0 HG2 PRO A 32 3.797 1.686 -5.524 1.00 12.32 H new ATOM 0 HG3 PRO A 32 3.371 2.381 -3.973 1.00 12.32 H new ATOM 0 HD2 PRO A 32 4.329 3.915 -6.009 1.00 43.12 H new ATOM 0 HD3 PRO A 32 4.655 4.311 -4.333 1.00 43.12 H new ATOM 470 N ASP A 33 6.269 1.118 -7.056 1.00 74.45 N ATOM 471 CA ASP A 33 6.485 0.243 -8.203 1.00 51.45 C ATOM 472 C ASP A 33 7.550 0.819 -9.132 1.00 30.31 C ATOM 473 O ASP A 33 8.088 0.115 -9.988 1.00 53.55 O ATOM 474 CB ASP A 33 5.178 0.040 -8.971 1.00 15.32 C ATOM 475 CG ASP A 33 4.687 1.316 -9.626 1.00 54.21 C ATOM 476 OD1 ASP A 33 5.142 2.405 -9.219 1.00 11.14 O ATOM 477 OD2 ASP A 33 3.846 1.226 -10.546 1.00 4.01 O ATOM 0 H ASP A 33 5.623 1.888 -7.229 1.00 74.45 H new ATOM 0 HA ASP A 33 6.833 -0.721 -7.832 1.00 51.45 H new ATOM 0 HB2 ASP A 33 5.324 -0.724 -9.735 1.00 15.32 H new ATOM 0 HB3 ASP A 33 4.413 -0.332 -8.289 1.00 15.32 H new ATOM 482 N LEU A 34 7.849 2.101 -8.957 1.00 44.03 N ATOM 483 CA LEU A 34 8.850 2.772 -9.780 1.00 51.01 C ATOM 484 C LEU A 34 8.541 2.597 -11.264 1.00 0.24 C ATOM 485 O LEU A 34 9.435 2.672 -12.107 1.00 13.20 O ATOM 486 CB LEU A 34 10.244 2.225 -9.470 1.00 23.11 C ATOM 487 CG LEU A 34 10.732 2.407 -8.032 1.00 60.31 C ATOM 488 CD1 LEU A 34 11.789 1.367 -7.691 1.00 54.35 C ATOM 489 CD2 LEU A 34 11.279 3.812 -7.828 1.00 55.20 C ATOM 0 H LEU A 34 7.413 2.697 -8.253 1.00 44.03 H new ATOM 0 HA LEU A 34 8.824 3.836 -9.545 1.00 51.01 H new ATOM 0 HB2 LEU A 34 10.255 1.161 -9.704 1.00 23.11 H new ATOM 0 HB3 LEU A 34 10.958 2.706 -10.138 1.00 23.11 H new ATOM 0 HG LEU A 34 9.884 2.268 -7.361 1.00 60.31 H new ATOM 0 HD11 LEU A 34 12.124 1.512 -6.664 1.00 54.35 H new ATOM 0 HD12 LEU A 34 11.364 0.369 -7.796 1.00 54.35 H new ATOM 0 HD13 LEU A 34 12.637 1.474 -8.368 1.00 54.35 H new ATOM 0 HD21 LEU A 34 11.622 3.923 -6.799 1.00 55.20 H new ATOM 0 HD22 LEU A 34 12.114 3.980 -8.509 1.00 55.20 H new ATOM 0 HD23 LEU A 34 10.494 4.541 -8.030 1.00 55.20 H new ATOM 501 N ASP A 35 7.270 2.366 -11.575 1.00 4.13 N ATOM 502 CA ASP A 35 6.843 2.184 -12.957 1.00 15.01 C ATOM 503 C ASP A 35 5.333 2.361 -13.086 1.00 72.11 C ATOM 504 O ASP A 35 4.693 1.726 -13.925 1.00 64.32 O ATOM 505 CB ASP A 35 7.251 0.799 -13.462 1.00 3.35 C ATOM 506 CG ASP A 35 8.658 0.781 -14.026 1.00 24.24 C ATOM 507 OD1 ASP A 35 9.018 1.730 -14.752 1.00 44.31 O ATOM 508 OD2 ASP A 35 9.399 -0.184 -13.741 1.00 44.33 O ATOM 0 H ASP A 35 6.518 2.300 -10.889 1.00 4.13 H new ATOM 0 HA ASP A 35 7.334 2.943 -13.566 1.00 15.01 H new ATOM 0 HB2 ASP A 35 7.181 0.082 -12.644 1.00 3.35 H new ATOM 0 HB3 ASP A 35 6.550 0.475 -14.231 1.00 3.35 H new ATOM 513 N ILE A 36 4.770 3.226 -12.250 1.00 10.43 N ATOM 514 CA ILE A 36 3.336 3.486 -12.271 1.00 51.20 C ATOM 515 C ILE A 36 2.944 4.305 -13.496 1.00 13.41 C ATOM 516 O ILE A 36 3.509 5.369 -13.753 1.00 33.23 O ATOM 517 CB ILE A 36 2.880 4.230 -11.002 1.00 53.51 C ATOM 518 CG1 ILE A 36 1.429 4.694 -11.150 1.00 41.12 C ATOM 519 CG2 ILE A 36 3.794 5.414 -10.725 1.00 2.31 C ATOM 520 CD1 ILE A 36 1.297 6.139 -11.577 1.00 42.31 C ATOM 0 H ILE A 36 5.285 3.759 -11.549 1.00 10.43 H new ATOM 0 HA ILE A 36 2.840 2.516 -12.311 1.00 51.20 H new ATOM 0 HB ILE A 36 2.938 3.545 -10.156 1.00 53.51 H new ATOM 0 HG12 ILE A 36 0.926 4.060 -11.881 1.00 41.12 H new ATOM 0 HG13 ILE A 36 0.913 4.556 -10.200 1.00 41.12 H new ATOM 0 HG21 ILE A 36 3.459 5.930 -9.825 1.00 2.31 H new ATOM 0 HG22 ILE A 36 4.815 5.060 -10.581 1.00 2.31 H new ATOM 0 HG23 ILE A 36 3.764 6.102 -11.570 1.00 2.31 H new ATOM 0 HD11 ILE A 36 0.242 6.398 -11.662 1.00 42.31 H new ATOM 0 HD12 ILE A 36 1.770 6.782 -10.835 1.00 42.31 H new ATOM 0 HD13 ILE A 36 1.784 6.279 -12.542 1.00 42.31 H new ATOM 532 N LYS A 37 1.971 3.804 -14.249 1.00 54.32 N ATOM 533 CA LYS A 37 1.499 4.490 -15.446 1.00 71.14 C ATOM 534 C LYS A 37 0.001 4.765 -15.361 1.00 71.44 C ATOM 535 O LYS A 37 -0.817 3.921 -15.730 1.00 24.22 O ATOM 536 CB LYS A 37 1.805 3.655 -16.692 1.00 22.34 C ATOM 537 CG LYS A 37 3.051 4.105 -17.435 1.00 13.20 C ATOM 538 CD LYS A 37 4.306 3.479 -16.851 1.00 31.02 C ATOM 539 CE LYS A 37 5.087 4.477 -16.009 1.00 73.31 C ATOM 540 NZ LYS A 37 6.457 4.704 -16.547 1.00 32.53 N ATOM 0 H LYS A 37 1.493 2.925 -14.051 1.00 54.32 H new ATOM 0 HA LYS A 37 2.022 5.444 -15.518 1.00 71.14 H new ATOM 0 HB2 LYS A 37 1.923 2.612 -16.400 1.00 22.34 H new ATOM 0 HB3 LYS A 37 0.952 3.702 -17.369 1.00 22.34 H new ATOM 0 HG2 LYS A 37 2.965 3.835 -18.488 1.00 13.20 H new ATOM 0 HG3 LYS A 37 3.130 5.191 -17.390 1.00 13.20 H new ATOM 0 HD2 LYS A 37 4.034 2.619 -16.239 1.00 31.02 H new ATOM 0 HD3 LYS A 37 4.938 3.109 -17.658 1.00 31.02 H new ATOM 0 HE2 LYS A 37 4.548 5.424 -15.976 1.00 73.31 H new ATOM 0 HE3 LYS A 37 5.155 4.113 -14.984 1.00 73.31 H new ATOM 0 HZ1 LYS A 37 6.957 5.390 -15.946 1.00 32.53 H new ATOM 0 HZ2 LYS A 37 6.980 3.805 -16.555 1.00 32.53 H new ATOM 0 HZ3 LYS A 37 6.392 5.076 -17.516 1.00 32.53 H new ATOM 554 N TYR A 38 -0.352 5.949 -14.875 1.00 40.45 N ATOM 555 CA TYR A 38 -1.752 6.334 -14.742 1.00 1.54 C ATOM 556 C TYR A 38 -2.046 7.604 -15.536 1.00 31.53 C ATOM 557 O TYR A 38 -1.141 8.228 -16.087 1.00 61.44 O ATOM 558 CB TYR A 38 -2.105 6.548 -13.269 1.00 34.32 C ATOM 559 CG TYR A 38 -1.879 7.964 -12.791 1.00 11.14 C ATOM 560 CD1 TYR A 38 -0.621 8.550 -12.862 1.00 61.54 C ATOM 561 CD2 TYR A 38 -2.923 8.717 -12.266 1.00 64.43 C ATOM 562 CE1 TYR A 38 -0.409 9.843 -12.426 1.00 50.11 C ATOM 563 CE2 TYR A 38 -2.720 10.011 -11.829 1.00 53.20 C ATOM 564 CZ TYR A 38 -1.462 10.570 -11.911 1.00 21.02 C ATOM 565 OH TYR A 38 -1.256 11.859 -11.475 1.00 30.11 O ATOM 0 H TYR A 38 0.312 6.659 -14.566 1.00 40.45 H new ATOM 0 HA TYR A 38 -2.364 5.526 -15.143 1.00 1.54 H new ATOM 0 HB2 TYR A 38 -3.151 6.283 -13.113 1.00 34.32 H new ATOM 0 HB3 TYR A 38 -1.510 5.868 -12.659 1.00 34.32 H new ATOM 0 HD1 TYR A 38 0.206 7.984 -13.265 1.00 61.54 H new ATOM 0 HD2 TYR A 38 -3.909 8.283 -12.199 1.00 64.43 H new ATOM 0 HE1 TYR A 38 0.576 10.282 -12.488 1.00 50.11 H new ATOM 0 HE2 TYR A 38 -3.542 10.583 -11.425 1.00 53.20 H new ATOM 0 HH TYR A 38 -0.928 12.407 -12.218 1.00 30.11 H new ATOM 575 N ASN A 39 -3.320 7.979 -15.588 1.00 10.13 N ATOM 576 CA ASN A 39 -3.736 9.174 -16.314 1.00 24.33 C ATOM 577 C ASN A 39 -5.165 9.563 -15.947 1.00 45.34 C ATOM 578 O ASN A 39 -6.025 8.702 -15.761 1.00 41.34 O ATOM 579 CB ASN A 39 -3.629 8.942 -17.822 1.00 70.13 C ATOM 580 CG ASN A 39 -2.274 9.342 -18.374 1.00 73.34 C ATOM 581 OD1 ASN A 39 -1.681 10.328 -17.938 1.00 45.15 O ATOM 582 ND2 ASN A 39 -1.779 8.575 -19.339 1.00 52.32 N ATOM 0 H ASN A 39 -4.082 7.473 -15.136 1.00 10.13 H new ATOM 0 HA ASN A 39 -3.072 9.991 -16.031 1.00 24.33 H new ATOM 0 HB2 ASN A 39 -3.810 7.889 -18.039 1.00 70.13 H new ATOM 0 HB3 ASN A 39 -4.408 9.511 -18.330 1.00 70.13 H new ATOM 0 HD21 ASN A 39 -0.871 8.794 -19.750 1.00 52.32 H new ATOM 0 HD22 ASN A 39 -2.306 7.767 -19.669 1.00 52.32 H new ATOM 589 N ILE A 40 -5.409 10.865 -15.846 1.00 54.34 N ATOM 590 CA ILE A 40 -6.734 11.369 -15.504 1.00 61.33 C ATOM 591 C ILE A 40 -7.321 12.192 -16.646 1.00 22.11 C ATOM 592 O ILE A 40 -6.755 13.210 -17.046 1.00 74.43 O ATOM 593 CB ILE A 40 -6.696 12.233 -14.230 1.00 30.30 C ATOM 594 CG1 ILE A 40 -5.281 12.262 -13.649 1.00 63.22 C ATOM 595 CG2 ILE A 40 -7.685 11.704 -13.202 1.00 54.22 C ATOM 596 CD1 ILE A 40 -5.187 12.980 -12.321 1.00 73.20 C ATOM 0 H ILE A 40 -4.707 11.590 -15.996 1.00 54.34 H new ATOM 0 HA ILE A 40 -7.366 10.499 -15.324 1.00 61.33 H new ATOM 0 HB ILE A 40 -6.982 13.252 -14.491 1.00 30.30 H new ATOM 0 HG12 ILE A 40 -4.927 11.239 -13.525 1.00 63.22 H new ATOM 0 HG13 ILE A 40 -4.614 12.746 -14.362 1.00 63.22 H new ATOM 0 HG21 ILE A 40 -7.647 12.325 -12.307 1.00 54.22 H new ATOM 0 HG22 ILE A 40 -8.692 11.730 -13.619 1.00 54.22 H new ATOM 0 HG23 ILE A 40 -7.426 10.677 -12.943 1.00 54.22 H new ATOM 0 HD11 ILE A 40 -4.155 12.961 -11.969 1.00 73.20 H new ATOM 0 HD12 ILE A 40 -5.510 14.014 -12.443 1.00 73.20 H new ATOM 0 HD13 ILE A 40 -5.828 12.483 -11.593 1.00 73.20 H new ATOM 608 N PHE A 41 -8.460 11.746 -17.165 1.00 63.52 N ATOM 609 CA PHE A 41 -9.125 12.441 -18.261 1.00 2.23 C ATOM 610 C PHE A 41 -10.598 12.677 -17.940 1.00 40.25 C ATOM 611 O PHE A 41 -11.228 11.883 -17.241 1.00 31.02 O ATOM 612 CB PHE A 41 -8.995 11.638 -19.557 1.00 33.15 C ATOM 613 CG PHE A 41 -9.047 10.151 -19.348 1.00 1.40 C ATOM 614 CD1 PHE A 41 -10.258 9.507 -19.156 1.00 14.13 C ATOM 615 CD2 PHE A 41 -7.884 9.398 -19.345 1.00 0.23 C ATOM 616 CE1 PHE A 41 -10.308 8.140 -18.963 1.00 34.53 C ATOM 617 CE2 PHE A 41 -7.928 8.030 -19.153 1.00 2.13 C ATOM 618 CZ PHE A 41 -9.142 7.400 -18.962 1.00 61.15 C ATOM 0 H PHE A 41 -8.942 10.906 -16.844 1.00 63.52 H new ATOM 0 HA PHE A 41 -8.640 13.408 -18.392 1.00 2.23 H new ATOM 0 HB2 PHE A 41 -9.795 11.930 -20.238 1.00 33.15 H new ATOM 0 HB3 PHE A 41 -8.054 11.896 -20.042 1.00 33.15 H new ATOM 0 HD1 PHE A 41 -11.174 10.080 -19.157 1.00 14.13 H new ATOM 0 HD2 PHE A 41 -6.932 9.886 -19.494 1.00 0.23 H new ATOM 0 HE1 PHE A 41 -11.259 7.650 -18.813 1.00 34.53 H new ATOM 0 HE2 PHE A 41 -7.014 7.454 -19.152 1.00 2.13 H new ATOM 0 HZ PHE A 41 -9.179 6.331 -18.812 1.00 61.15 H new ATOM 628 N LEU A 42 -11.141 13.774 -18.457 1.00 1.35 N ATOM 629 CA LEU A 42 -12.540 14.117 -18.226 1.00 31.30 C ATOM 630 C LEU A 42 -13.374 13.876 -19.481 1.00 25.24 C ATOM 631 O LEU A 42 -12.992 14.279 -20.579 1.00 41.52 O ATOM 632 CB LEU A 42 -12.663 15.578 -17.791 1.00 41.12 C ATOM 633 CG LEU A 42 -14.016 16.243 -18.047 1.00 20.02 C ATOM 634 CD1 LEU A 42 -15.115 15.532 -17.272 1.00 41.13 C ATOM 635 CD2 LEU A 42 -13.965 17.717 -17.672 1.00 51.14 C ATOM 0 H LEU A 42 -10.634 14.441 -19.039 1.00 1.35 H new ATOM 0 HA LEU A 42 -12.919 13.475 -17.431 1.00 31.30 H new ATOM 0 HB2 LEU A 42 -12.447 15.638 -16.724 1.00 41.12 H new ATOM 0 HB3 LEU A 42 -11.894 16.155 -18.305 1.00 41.12 H new ATOM 0 HG LEU A 42 -14.242 16.167 -19.111 1.00 20.02 H new ATOM 0 HD11 LEU A 42 -16.071 16.019 -17.466 1.00 41.13 H new ATOM 0 HD12 LEU A 42 -15.168 14.490 -17.588 1.00 41.13 H new ATOM 0 HD13 LEU A 42 -14.895 15.577 -16.205 1.00 41.13 H new ATOM 0 HD21 LEU A 42 -14.936 18.174 -17.861 1.00 51.14 H new ATOM 0 HD22 LEU A 42 -13.717 17.815 -16.615 1.00 51.14 H new ATOM 0 HD23 LEU A 42 -13.205 18.219 -18.271 1.00 51.14 H new ATOM 647 N VAL A 43 -14.515 13.217 -19.309 1.00 31.31 N ATOM 648 CA VAL A 43 -15.405 12.925 -20.427 1.00 22.25 C ATOM 649 C VAL A 43 -16.692 13.737 -20.331 1.00 65.22 C ATOM 650 O VAL A 43 -17.271 13.877 -19.254 1.00 4.42 O ATOM 651 CB VAL A 43 -15.759 11.427 -20.486 1.00 11.05 C ATOM 652 CG1 VAL A 43 -14.640 10.589 -19.886 1.00 43.45 C ATOM 653 CG2 VAL A 43 -17.075 11.163 -19.770 1.00 73.31 C ATOM 0 H VAL A 43 -14.845 12.875 -18.407 1.00 31.31 H new ATOM 0 HA VAL A 43 -14.872 13.201 -21.337 1.00 22.25 H new ATOM 0 HB VAL A 43 -15.875 11.140 -21.531 1.00 11.05 H new ATOM 0 HG11 VAL A 43 -14.908 9.534 -19.937 1.00 43.45 H new ATOM 0 HG12 VAL A 43 -13.720 10.757 -20.446 1.00 43.45 H new ATOM 0 HG13 VAL A 43 -14.489 10.875 -18.845 1.00 43.45 H new ATOM 0 HG21 VAL A 43 -17.310 10.100 -19.821 1.00 73.31 H new ATOM 0 HG22 VAL A 43 -16.989 11.466 -18.726 1.00 73.31 H new ATOM 0 HG23 VAL A 43 -17.871 11.734 -20.249 1.00 73.31 H new ATOM 663 N ASP A 44 -17.134 14.269 -21.465 1.00 40.00 N ATOM 664 CA ASP A 44 -18.354 15.066 -21.510 1.00 51.55 C ATOM 665 C ASP A 44 -19.226 14.659 -22.694 1.00 61.20 C ATOM 666 O ASP A 44 -18.930 14.995 -23.842 1.00 31.24 O ATOM 667 CB ASP A 44 -18.013 16.555 -21.601 1.00 30.31 C ATOM 668 CG ASP A 44 -16.774 16.815 -22.435 1.00 10.01 C ATOM 669 OD1 ASP A 44 -16.587 16.116 -23.452 1.00 43.24 O ATOM 670 OD2 ASP A 44 -15.991 17.717 -22.069 1.00 52.14 O ATOM 0 H ASP A 44 -16.666 14.163 -22.365 1.00 40.00 H new ATOM 0 HA ASP A 44 -18.911 14.884 -20.591 1.00 51.55 H new ATOM 0 HB2 ASP A 44 -18.857 17.092 -22.033 1.00 30.31 H new ATOM 0 HB3 ASP A 44 -17.862 16.952 -20.597 1.00 30.31 H new ATOM 675 N LEU A 45 -20.301 13.932 -22.408 1.00 3.40 N ATOM 676 CA LEU A 45 -21.216 13.477 -23.449 1.00 1.41 C ATOM 677 C LEU A 45 -22.630 13.317 -22.899 1.00 44.41 C ATOM 678 O LEU A 45 -22.822 13.137 -21.697 1.00 32.45 O ATOM 679 CB LEU A 45 -20.732 12.151 -24.037 1.00 21.32 C ATOM 680 CG LEU A 45 -20.488 12.135 -25.546 1.00 70.32 C ATOM 681 CD1 LEU A 45 -21.756 12.512 -26.296 1.00 13.01 C ATOM 682 CD2 LEU A 45 -19.350 13.076 -25.913 1.00 23.24 C ATOM 0 H LEU A 45 -20.560 13.645 -21.464 1.00 3.40 H new ATOM 0 HA LEU A 45 -21.235 14.231 -24.236 1.00 1.41 H new ATOM 0 HB2 LEU A 45 -19.805 11.871 -23.536 1.00 21.32 H new ATOM 0 HB3 LEU A 45 -21.467 11.382 -23.800 1.00 21.32 H new ATOM 0 HG LEU A 45 -20.205 11.124 -25.838 1.00 70.32 H new ATOM 0 HD11 LEU A 45 -21.563 12.495 -27.369 1.00 13.01 H new ATOM 0 HD12 LEU A 45 -22.545 11.799 -26.058 1.00 13.01 H new ATOM 0 HD13 LEU A 45 -22.070 13.513 -26.000 1.00 13.01 H new ATOM 0 HD21 LEU A 45 -19.191 13.051 -26.991 1.00 23.24 H new ATOM 0 HD22 LEU A 45 -19.604 14.091 -25.607 1.00 23.24 H new ATOM 0 HD23 LEU A 45 -18.439 12.761 -25.404 1.00 23.24 H new ATOM 694 N TYR A 46 -23.615 13.383 -23.787 1.00 70.04 N ATOM 695 CA TYR A 46 -25.012 13.246 -23.391 1.00 65.42 C ATOM 696 C TYR A 46 -25.432 14.389 -22.473 1.00 54.11 C ATOM 697 O TYR A 46 -26.404 14.276 -21.727 1.00 52.13 O ATOM 698 CB TYR A 46 -25.235 11.905 -22.690 1.00 20.23 C ATOM 699 CG TYR A 46 -24.755 10.715 -23.490 1.00 50.32 C ATOM 700 CD1 TYR A 46 -25.477 10.251 -24.582 1.00 70.35 C ATOM 701 CD2 TYR A 46 -23.579 10.056 -23.154 1.00 45.44 C ATOM 702 CE1 TYR A 46 -25.043 9.164 -25.316 1.00 25.20 C ATOM 703 CE2 TYR A 46 -23.136 8.969 -23.883 1.00 44.52 C ATOM 704 CZ TYR A 46 -23.871 8.527 -24.963 1.00 33.34 C ATOM 705 OH TYR A 46 -23.434 7.445 -25.692 1.00 33.53 O ATOM 0 H TYR A 46 -23.472 13.531 -24.786 1.00 70.04 H new ATOM 0 HA TYR A 46 -25.625 13.284 -24.292 1.00 65.42 H new ATOM 0 HB2 TYR A 46 -24.721 11.917 -21.729 1.00 20.23 H new ATOM 0 HB3 TYR A 46 -26.298 11.786 -22.481 1.00 20.23 H new ATOM 0 HD1 TYR A 46 -26.394 10.749 -24.862 1.00 70.35 H new ATOM 0 HD2 TYR A 46 -23.001 10.399 -22.309 1.00 45.44 H new ATOM 0 HE1 TYR A 46 -25.618 8.815 -26.161 1.00 25.20 H new ATOM 0 HE2 TYR A 46 -22.219 8.468 -23.609 1.00 44.52 H new ATOM 0 HH TYR A 46 -22.593 7.113 -25.313 1.00 33.53 H new ATOM 715 N GLY A 47 -24.692 15.492 -22.535 1.00 31.15 N ATOM 716 CA GLY A 47 -25.003 16.641 -21.705 1.00 12.31 C ATOM 717 C GLY A 47 -24.424 16.523 -20.309 1.00 62.32 C ATOM 718 O GLY A 47 -24.431 17.487 -19.544 1.00 62.42 O ATOM 0 H GLY A 47 -23.883 15.610 -23.145 1.00 31.15 H new ATOM 0 HA2 GLY A 47 -24.617 17.543 -22.180 1.00 12.31 H new ATOM 0 HA3 GLY A 47 -26.085 16.754 -21.638 1.00 12.31 H new ATOM 722 N GLN A 48 -23.923 15.337 -19.977 1.00 4.40 N ATOM 723 CA GLN A 48 -23.339 15.097 -18.663 1.00 32.55 C ATOM 724 C GLN A 48 -21.839 14.843 -18.771 1.00 11.41 C ATOM 725 O GLN A 48 -21.381 14.133 -19.666 1.00 54.24 O ATOM 726 CB GLN A 48 -24.022 13.905 -17.989 1.00 11.13 C ATOM 727 CG GLN A 48 -25.539 14.008 -17.963 1.00 64.55 C ATOM 728 CD GLN A 48 -26.025 15.321 -17.383 1.00 73.15 C ATOM 729 OE1 GLN A 48 -25.543 15.770 -16.343 1.00 51.03 O ATOM 730 NE2 GLN A 48 -26.986 15.945 -18.055 1.00 30.01 N ATOM 0 H GLN A 48 -23.910 14.529 -20.599 1.00 4.40 H new ATOM 0 HA GLN A 48 -23.495 15.989 -18.056 1.00 32.55 H new ATOM 0 HB2 GLN A 48 -23.737 12.991 -18.510 1.00 11.13 H new ATOM 0 HB3 GLN A 48 -23.654 13.817 -16.967 1.00 11.13 H new ATOM 0 HG2 GLN A 48 -25.924 13.898 -18.977 1.00 64.55 H new ATOM 0 HG3 GLN A 48 -25.945 13.184 -17.377 1.00 64.55 H new ATOM 0 HE21 GLN A 48 -27.356 15.536 -18.913 1.00 30.01 H new ATOM 0 HE22 GLN A 48 -27.354 16.833 -17.713 1.00 30.01 H new ATOM 739 N LYS A 49 -21.078 15.429 -17.853 1.00 45.32 N ATOM 740 CA LYS A 49 -19.628 15.267 -17.844 1.00 15.31 C ATOM 741 C LYS A 49 -19.171 14.533 -16.588 1.00 11.15 C ATOM 742 O LYS A 49 -19.569 14.879 -15.475 1.00 55.10 O ATOM 743 CB LYS A 49 -18.942 16.632 -17.928 1.00 44.33 C ATOM 744 CG LYS A 49 -19.513 17.661 -16.968 1.00 41.11 C ATOM 745 CD LYS A 49 -20.231 18.777 -17.709 1.00 22.13 C ATOM 746 CE LYS A 49 -19.345 20.004 -17.863 1.00 21.34 C ATOM 747 NZ LYS A 49 -20.132 21.215 -18.225 1.00 74.51 N ATOM 0 H LYS A 49 -21.441 16.020 -17.105 1.00 45.32 H new ATOM 0 HA LYS A 49 -19.348 14.672 -18.713 1.00 15.31 H new ATOM 0 HB2 LYS A 49 -17.879 16.508 -17.724 1.00 44.33 H new ATOM 0 HB3 LYS A 49 -19.029 17.011 -18.946 1.00 44.33 H new ATOM 0 HG2 LYS A 49 -20.206 17.174 -16.281 1.00 41.11 H new ATOM 0 HG3 LYS A 49 -18.709 18.082 -16.364 1.00 41.11 H new ATOM 0 HD2 LYS A 49 -20.538 18.423 -18.693 1.00 22.13 H new ATOM 0 HD3 LYS A 49 -21.139 19.048 -17.170 1.00 22.13 H new ATOM 0 HE2 LYS A 49 -18.809 20.184 -16.931 1.00 21.34 H new ATOM 0 HE3 LYS A 49 -18.594 19.816 -18.631 1.00 21.34 H new ATOM 0 HZ1 LYS A 49 -19.492 22.029 -18.321 1.00 74.51 H new ATOM 0 HZ2 LYS A 49 -20.623 21.053 -19.127 1.00 74.51 H new ATOM 0 HZ3 LYS A 49 -20.831 21.410 -17.480 1.00 74.51 H new ATOM 761 N TYR A 50 -18.332 13.520 -16.772 1.00 74.14 N ATOM 762 CA TYR A 50 -17.822 12.737 -15.654 1.00 24.43 C ATOM 763 C TYR A 50 -16.302 12.621 -15.718 1.00 43.33 C ATOM 764 O TYR A 50 -15.701 12.764 -16.784 1.00 32.14 O ATOM 765 CB TYR A 50 -18.450 11.342 -15.651 1.00 54.11 C ATOM 766 CG TYR A 50 -19.940 11.349 -15.907 1.00 55.33 C ATOM 767 CD1 TYR A 50 -20.443 11.448 -17.199 1.00 30.32 C ATOM 768 CD2 TYR A 50 -20.846 11.257 -14.857 1.00 60.43 C ATOM 769 CE1 TYR A 50 -21.804 11.455 -17.437 1.00 43.41 C ATOM 770 CE2 TYR A 50 -22.208 11.262 -15.086 1.00 53.14 C ATOM 771 CZ TYR A 50 -22.682 11.362 -16.378 1.00 12.21 C ATOM 772 OH TYR A 50 -24.038 11.368 -16.611 1.00 53.03 O ATOM 0 H TYR A 50 -17.991 13.222 -17.686 1.00 74.14 H new ATOM 0 HA TYR A 50 -18.091 13.252 -14.732 1.00 24.43 H new ATOM 0 HB2 TYR A 50 -17.962 10.731 -16.411 1.00 54.11 H new ATOM 0 HB3 TYR A 50 -18.257 10.868 -14.689 1.00 54.11 H new ATOM 0 HD1 TYR A 50 -19.758 11.521 -18.031 1.00 30.32 H new ATOM 0 HD2 TYR A 50 -20.479 11.180 -13.844 1.00 60.43 H new ATOM 0 HE1 TYR A 50 -22.178 11.533 -18.447 1.00 43.41 H new ATOM 0 HE2 TYR A 50 -22.898 11.188 -14.259 1.00 53.14 H new ATOM 0 HH TYR A 50 -24.517 11.294 -15.759 1.00 53.03 H new ATOM 782 N PHE A 51 -15.685 12.361 -14.570 1.00 14.40 N ATOM 783 CA PHE A 51 -14.235 12.227 -14.494 1.00 74.20 C ATOM 784 C PHE A 51 -13.830 10.759 -14.387 1.00 52.54 C ATOM 785 O PHE A 51 -14.368 10.014 -13.568 1.00 44.11 O ATOM 786 CB PHE A 51 -13.692 13.006 -13.295 1.00 3.13 C ATOM 787 CG PHE A 51 -13.793 14.496 -13.452 1.00 55.32 C ATOM 788 CD1 PHE A 51 -15.028 15.125 -13.441 1.00 34.42 C ATOM 789 CD2 PHE A 51 -12.654 15.269 -13.611 1.00 34.10 C ATOM 790 CE1 PHE A 51 -15.125 16.496 -13.586 1.00 63.43 C ATOM 791 CE2 PHE A 51 -12.744 16.640 -13.756 1.00 55.55 C ATOM 792 CZ PHE A 51 -13.981 17.255 -13.743 1.00 74.41 C ATOM 0 H PHE A 51 -16.167 12.239 -13.679 1.00 14.40 H new ATOM 0 HA PHE A 51 -13.808 12.638 -15.409 1.00 74.20 H new ATOM 0 HB2 PHE A 51 -14.237 12.705 -12.400 1.00 3.13 H new ATOM 0 HB3 PHE A 51 -12.648 12.735 -13.139 1.00 3.13 H new ATOM 0 HD1 PHE A 51 -15.925 14.537 -13.318 1.00 34.42 H new ATOM 0 HD2 PHE A 51 -11.684 14.794 -13.622 1.00 34.10 H new ATOM 0 HE1 PHE A 51 -16.094 16.974 -13.577 1.00 63.43 H new ATOM 0 HE2 PHE A 51 -11.848 17.230 -13.879 1.00 55.55 H new ATOM 0 HZ PHE A 51 -14.054 18.327 -13.855 1.00 74.41 H new ATOM 802 N ARG A 52 -12.879 10.352 -15.222 1.00 14.31 N ATOM 803 CA ARG A 52 -12.403 8.974 -15.223 1.00 50.45 C ATOM 804 C ARG A 52 -10.879 8.926 -15.162 1.00 71.00 C ATOM 805 O ARG A 52 -10.198 9.774 -15.739 1.00 3.23 O ATOM 806 CB ARG A 52 -12.897 8.243 -16.473 1.00 32.12 C ATOM 807 CG ARG A 52 -13.872 7.116 -16.173 1.00 54.21 C ATOM 808 CD ARG A 52 -15.259 7.420 -16.718 1.00 71.01 C ATOM 809 NE ARG A 52 -15.398 7.020 -18.116 1.00 22.43 N ATOM 810 CZ ARG A 52 -16.569 6.881 -18.728 1.00 24.33 C ATOM 811 NH1 ARG A 52 -17.696 7.109 -18.069 1.00 11.14 N ATOM 812 NH2 ARG A 52 -16.613 6.513 -20.002 1.00 11.01 N ATOM 0 H ARG A 52 -12.424 10.956 -15.906 1.00 14.31 H new ATOM 0 HA ARG A 52 -12.801 8.477 -14.338 1.00 50.45 H new ATOM 0 HB2 ARG A 52 -13.378 8.961 -17.137 1.00 32.12 H new ATOM 0 HB3 ARG A 52 -12.039 7.837 -17.009 1.00 32.12 H new ATOM 0 HG2 ARG A 52 -13.503 6.188 -16.610 1.00 54.21 H new ATOM 0 HG3 ARG A 52 -13.929 6.960 -15.096 1.00 54.21 H new ATOM 0 HD2 ARG A 52 -16.006 6.902 -16.117 1.00 71.01 H new ATOM 0 HD3 ARG A 52 -15.459 8.487 -16.625 1.00 71.01 H new ATOM 0 HE ARG A 52 -14.549 6.837 -18.652 1.00 22.43 H new ATOM 0 HH11 ARG A 52 -17.666 7.392 -17.090 1.00 11.14 H new ATOM 0 HH12 ARG A 52 -18.594 7.002 -18.541 1.00 11.14 H new ATOM 0 HH21 ARG A 52 -15.747 6.337 -20.512 1.00 11.01 H new ATOM 0 HH22 ARG A 52 -17.512 6.406 -20.471 1.00 11.01 H new ATOM 826 N ILE A 53 -10.352 7.929 -14.459 1.00 41.13 N ATOM 827 CA ILE A 53 -8.909 7.770 -14.323 1.00 54.34 C ATOM 828 C ILE A 53 -8.473 6.361 -14.709 1.00 3.03 C ATOM 829 O ILE A 53 -9.103 5.376 -14.322 1.00 13.21 O ATOM 830 CB ILE A 53 -8.444 8.065 -12.885 1.00 63.31 C ATOM 831 CG1 ILE A 53 -8.529 6.799 -12.029 1.00 54.51 C ATOM 832 CG2 ILE A 53 -9.279 9.181 -12.276 1.00 32.41 C ATOM 833 CD1 ILE A 53 -7.261 5.976 -12.039 1.00 44.01 C ATOM 0 H ILE A 53 -10.902 7.220 -13.975 1.00 41.13 H new ATOM 0 HA ILE A 53 -8.446 8.488 -15.000 1.00 54.34 H new ATOM 0 HB ILE A 53 -7.405 8.392 -12.915 1.00 63.31 H new ATOM 0 HG12 ILE A 53 -8.762 7.080 -11.002 1.00 54.51 H new ATOM 0 HG13 ILE A 53 -9.355 6.184 -12.386 1.00 54.51 H new ATOM 0 HG21 ILE A 53 -8.938 9.377 -11.260 1.00 32.41 H new ATOM 0 HG22 ILE A 53 -9.172 10.085 -12.876 1.00 32.41 H new ATOM 0 HG23 ILE A 53 -10.327 8.882 -12.255 1.00 32.41 H new ATOM 0 HD11 ILE A 53 -7.394 5.095 -11.411 1.00 44.01 H new ATOM 0 HD12 ILE A 53 -7.037 5.664 -13.059 1.00 44.01 H new ATOM 0 HD13 ILE A 53 -6.436 6.575 -11.653 1.00 44.01 H new ATOM 845 N LEU A 54 -7.389 6.271 -15.472 1.00 2.45 N ATOM 846 CA LEU A 54 -6.865 4.982 -15.908 1.00 72.24 C ATOM 847 C LEU A 54 -5.473 4.737 -15.335 1.00 32.31 C ATOM 848 O LEU A 54 -4.534 5.480 -15.619 1.00 2.35 O ATOM 849 CB LEU A 54 -6.818 4.919 -17.436 1.00 51.31 C ATOM 850 CG LEU A 54 -6.937 3.526 -18.055 1.00 13.12 C ATOM 851 CD1 LEU A 54 -6.787 3.599 -19.566 1.00 64.34 C ATOM 852 CD2 LEU A 54 -5.899 2.587 -17.458 1.00 33.10 C ATOM 0 H LEU A 54 -6.856 7.076 -15.801 1.00 2.45 H new ATOM 0 HA LEU A 54 -7.532 4.203 -15.538 1.00 72.24 H new ATOM 0 HB2 LEU A 54 -7.623 5.540 -17.830 1.00 51.31 H new ATOM 0 HB3 LEU A 54 -5.880 5.364 -17.769 1.00 51.31 H new ATOM 0 HG LEU A 54 -7.927 3.131 -17.828 1.00 13.12 H new ATOM 0 HD11 LEU A 54 -6.874 2.598 -19.989 1.00 64.34 H new ATOM 0 HD12 LEU A 54 -7.568 4.237 -19.979 1.00 64.34 H new ATOM 0 HD13 LEU A 54 -5.810 4.014 -19.815 1.00 64.34 H new ATOM 0 HD21 LEU A 54 -5.998 1.600 -17.910 1.00 33.10 H new ATOM 0 HD22 LEU A 54 -4.900 2.977 -17.654 1.00 33.10 H new ATOM 0 HD23 LEU A 54 -6.054 2.510 -16.382 1.00 33.10 H new ATOM 864 N PHE A 55 -5.347 3.688 -14.528 1.00 54.14 N ATOM 865 CA PHE A 55 -4.070 3.344 -13.916 1.00 24.22 C ATOM 866 C PHE A 55 -3.627 1.944 -14.331 1.00 71.31 C ATOM 867 O PHE A 55 -4.339 0.965 -14.107 1.00 52.33 O ATOM 868 CB PHE A 55 -4.172 3.427 -12.391 1.00 43.44 C ATOM 869 CG PHE A 55 -3.048 2.733 -11.676 1.00 50.24 C ATOM 870 CD1 PHE A 55 -1.754 2.796 -12.167 1.00 24.15 C ATOM 871 CD2 PHE A 55 -3.286 2.017 -10.514 1.00 53.32 C ATOM 872 CE1 PHE A 55 -0.717 2.158 -11.511 1.00 12.52 C ATOM 873 CE2 PHE A 55 -2.254 1.378 -9.854 1.00 1.21 C ATOM 874 CZ PHE A 55 -0.968 1.448 -10.353 1.00 71.15 C ATOM 0 H PHE A 55 -6.114 3.062 -14.283 1.00 54.14 H new ATOM 0 HA PHE A 55 -3.325 4.060 -14.263 1.00 24.22 H new ATOM 0 HB2 PHE A 55 -4.189 4.475 -12.093 1.00 43.44 H new ATOM 0 HB3 PHE A 55 -5.119 2.990 -12.074 1.00 43.44 H new ATOM 0 HD1 PHE A 55 -1.553 3.350 -13.072 1.00 24.15 H new ATOM 0 HD2 PHE A 55 -4.290 1.958 -10.120 1.00 53.32 H new ATOM 0 HE1 PHE A 55 0.288 2.215 -11.904 1.00 12.52 H new ATOM 0 HE2 PHE A 55 -2.453 0.824 -8.948 1.00 1.21 H new ATOM 0 HZ PHE A 55 -0.160 0.949 -9.839 1.00 71.15 H new ATOM 884 N GLN A 56 -2.447 1.858 -14.937 1.00 74.02 N ATOM 885 CA GLN A 56 -1.910 0.578 -15.385 1.00 54.51 C ATOM 886 C GLN A 56 -0.443 0.438 -14.996 1.00 25.11 C ATOM 887 O GLN A 56 0.273 1.431 -14.867 1.00 24.13 O ATOM 888 CB GLN A 56 -2.064 0.439 -16.901 1.00 10.34 C ATOM 889 CG GLN A 56 -1.043 1.241 -17.692 1.00 21.32 C ATOM 890 CD GLN A 56 -1.580 1.713 -19.028 1.00 53.13 C ATOM 891 OE1 GLN A 56 -2.747 1.494 -19.354 1.00 33.51 O ATOM 892 NE2 GLN A 56 -0.730 2.367 -19.811 1.00 63.51 N ATOM 0 H GLN A 56 -1.845 2.659 -15.129 1.00 74.02 H new ATOM 0 HA GLN A 56 -2.474 -0.216 -14.896 1.00 54.51 H new ATOM 0 HB2 GLN A 56 -1.976 -0.613 -17.172 1.00 10.34 H new ATOM 0 HB3 GLN A 56 -3.066 0.759 -17.187 1.00 10.34 H new ATOM 0 HG2 GLN A 56 -0.731 2.105 -17.105 1.00 21.32 H new ATOM 0 HG3 GLN A 56 -0.155 0.630 -17.857 1.00 21.32 H new ATOM 0 HE21 GLN A 56 0.229 2.527 -19.502 1.00 63.51 H new ATOM 0 HE22 GLN A 56 -1.036 2.710 -20.722 1.00 63.51 H new ATOM 901 N SER A 57 -0.001 -0.802 -14.810 1.00 2.11 N ATOM 902 CA SER A 57 1.381 -1.072 -14.431 1.00 62.21 C ATOM 903 C SER A 57 2.269 -1.195 -15.666 1.00 33.51 C ATOM 904 O SER A 57 1.802 -1.060 -16.797 1.00 73.51 O ATOM 905 CB SER A 57 1.463 -2.354 -13.600 1.00 70.22 C ATOM 906 OG SER A 57 1.187 -2.095 -12.235 1.00 34.43 O ATOM 0 H SER A 57 -0.580 -1.635 -14.916 1.00 2.11 H new ATOM 0 HA SER A 57 1.737 -0.235 -13.831 1.00 62.21 H new ATOM 0 HB2 SER A 57 0.754 -3.087 -13.985 1.00 70.22 H new ATOM 0 HB3 SER A 57 2.457 -2.791 -13.697 1.00 70.22 H new ATOM 0 HG SER A 57 0.260 -2.343 -12.036 1.00 34.43 H new ATOM 912 N LYS A 58 3.553 -1.453 -15.440 1.00 54.15 N ATOM 913 CA LYS A 58 4.508 -1.596 -16.533 1.00 30.24 C ATOM 914 C LYS A 58 4.258 -2.885 -17.309 1.00 34.11 C ATOM 915 O LYS A 58 4.120 -2.869 -18.532 1.00 52.43 O ATOM 916 CB LYS A 58 5.939 -1.585 -15.991 1.00 0.55 C ATOM 917 CG LYS A 58 6.817 -0.514 -16.615 1.00 23.11 C ATOM 918 CD LYS A 58 7.064 -0.785 -18.089 1.00 61.45 C ATOM 919 CE LYS A 58 8.441 -1.389 -18.322 1.00 53.24 C ATOM 920 NZ LYS A 58 9.529 -0.414 -18.035 1.00 64.11 N ATOM 0 H LYS A 58 3.956 -1.567 -14.510 1.00 54.15 H new ATOM 0 HA LYS A 58 4.375 -0.753 -17.211 1.00 30.24 H new ATOM 0 HB2 LYS A 58 5.909 -1.435 -14.912 1.00 0.55 H new ATOM 0 HB3 LYS A 58 6.392 -2.561 -16.165 1.00 0.55 H new ATOM 0 HG2 LYS A 58 6.343 0.460 -16.498 1.00 23.11 H new ATOM 0 HG3 LYS A 58 7.770 -0.470 -16.087 1.00 23.11 H new ATOM 0 HD2 LYS A 58 6.299 -1.463 -18.468 1.00 61.45 H new ATOM 0 HD3 LYS A 58 6.973 0.145 -18.651 1.00 61.45 H new ATOM 0 HE2 LYS A 58 8.564 -2.268 -17.689 1.00 53.24 H new ATOM 0 HE3 LYS A 58 8.519 -1.727 -19.355 1.00 53.24 H new ATOM 0 HZ1 LYS A 58 10.393 -0.700 -18.537 1.00 64.11 H new ATOM 0 HZ2 LYS A 58 9.240 0.533 -18.355 1.00 64.11 H new ATOM 0 HZ3 LYS A 58 9.715 -0.392 -17.012 1.00 64.11 H new ATOM 934 N LYS A 59 4.199 -4.001 -16.590 1.00 75.24 N ATOM 935 CA LYS A 59 3.962 -5.299 -17.211 1.00 32.45 C ATOM 936 C LYS A 59 2.477 -5.504 -17.496 1.00 4.52 C ATOM 937 O LYS A 59 2.107 -6.183 -18.454 1.00 55.32 O ATOM 938 CB LYS A 59 4.477 -6.421 -16.306 1.00 62.21 C ATOM 939 CG LYS A 59 5.890 -6.192 -15.798 1.00 63.55 C ATOM 940 CD LYS A 59 6.821 -7.320 -16.212 1.00 72.30 C ATOM 941 CE LYS A 59 7.291 -7.157 -17.649 1.00 54.44 C ATOM 942 NZ LYS A 59 7.706 -8.455 -18.248 1.00 61.14 N ATOM 0 H LYS A 59 4.312 -4.033 -15.577 1.00 75.24 H new ATOM 0 HA LYS A 59 4.502 -5.325 -18.157 1.00 32.45 H new ATOM 0 HB2 LYS A 59 3.806 -6.526 -15.454 1.00 62.21 H new ATOM 0 HB3 LYS A 59 4.445 -7.362 -16.854 1.00 62.21 H new ATOM 0 HG2 LYS A 59 6.268 -5.246 -16.186 1.00 63.55 H new ATOM 0 HG3 LYS A 59 5.878 -6.109 -14.711 1.00 63.55 H new ATOM 0 HD2 LYS A 59 7.684 -7.343 -15.547 1.00 72.30 H new ATOM 0 HD3 LYS A 59 6.308 -8.275 -16.102 1.00 72.30 H new ATOM 0 HE2 LYS A 59 6.490 -6.721 -18.246 1.00 54.44 H new ATOM 0 HE3 LYS A 59 8.127 -6.459 -17.680 1.00 54.44 H new ATOM 0 HZ1 LYS A 59 8.019 -8.301 -19.228 1.00 61.14 H new ATOM 0 HZ2 LYS A 59 8.488 -8.859 -17.694 1.00 61.14 H new ATOM 0 HZ3 LYS A 59 6.901 -9.113 -18.242 1.00 61.14 H new ATOM 956 N LEU A 60 1.632 -4.911 -16.660 1.00 1.13 N ATOM 957 CA LEU A 60 0.187 -5.026 -16.823 1.00 60.52 C ATOM 958 C LEU A 60 -0.186 -6.375 -17.430 1.00 72.21 C ATOM 959 O LEU A 60 -0.927 -6.442 -18.411 1.00 65.12 O ATOM 960 CB LEU A 60 -0.338 -3.894 -17.707 1.00 13.21 C ATOM 961 CG LEU A 60 0.526 -3.528 -18.914 1.00 23.21 C ATOM 962 CD1 LEU A 60 0.199 -4.426 -20.097 1.00 32.12 C ATOM 963 CD2 LEU A 60 0.334 -2.065 -19.284 1.00 2.42 C ATOM 0 H LEU A 60 1.923 -4.346 -15.862 1.00 1.13 H new ATOM 0 HA LEU A 60 -0.272 -4.952 -15.837 1.00 60.52 H new ATOM 0 HB2 LEU A 60 -1.329 -4.170 -18.066 1.00 13.21 H new ATOM 0 HB3 LEU A 60 -0.459 -3.004 -17.089 1.00 13.21 H new ATOM 0 HG LEU A 60 1.572 -3.680 -18.647 1.00 23.21 H new ATOM 0 HD11 LEU A 60 0.824 -4.150 -20.947 1.00 32.12 H new ATOM 0 HD12 LEU A 60 0.389 -5.465 -19.829 1.00 32.12 H new ATOM 0 HD13 LEU A 60 -0.851 -4.307 -20.365 1.00 32.12 H new ATOM 0 HD21 LEU A 60 0.957 -1.823 -20.145 1.00 2.42 H new ATOM 0 HD22 LEU A 60 -0.712 -1.887 -19.531 1.00 2.42 H new ATOM 0 HD23 LEU A 60 0.620 -1.436 -18.441 1.00 2.42 H new ATOM 975 N SER A 61 0.330 -7.448 -16.838 1.00 53.23 N ATOM 976 CA SER A 61 0.052 -8.795 -17.321 1.00 70.35 C ATOM 977 C SER A 61 -1.077 -9.438 -16.521 1.00 3.43 C ATOM 978 O SER A 61 -1.265 -9.136 -15.343 1.00 21.44 O ATOM 979 CB SER A 61 1.311 -9.661 -17.235 1.00 13.53 C ATOM 980 OG SER A 61 1.049 -10.986 -17.662 1.00 32.11 O ATOM 0 H SER A 61 0.943 -7.410 -16.023 1.00 53.23 H new ATOM 0 HA SER A 61 -0.260 -8.723 -18.363 1.00 70.35 H new ATOM 0 HB2 SER A 61 2.098 -9.226 -17.851 1.00 13.53 H new ATOM 0 HB3 SER A 61 1.679 -9.672 -16.209 1.00 13.53 H new ATOM 0 HG SER A 61 1.869 -11.518 -17.599 1.00 32.11 H new ATOM 986 N GLU A 62 -1.824 -10.324 -17.170 1.00 74.43 N ATOM 987 CA GLU A 62 -2.935 -11.009 -16.519 1.00 51.12 C ATOM 988 C GLU A 62 -2.427 -12.013 -15.489 1.00 4.24 C ATOM 989 O GLU A 62 -3.149 -12.394 -14.567 1.00 14.54 O ATOM 990 CB GLU A 62 -3.803 -11.723 -17.558 1.00 4.20 C ATOM 991 CG GLU A 62 -4.676 -10.783 -18.371 1.00 51.53 C ATOM 992 CD GLU A 62 -5.530 -11.514 -19.389 1.00 12.51 C ATOM 993 OE1 GLU A 62 -5.088 -12.570 -19.886 1.00 41.03 O ATOM 994 OE2 GLU A 62 -6.642 -11.028 -19.688 1.00 23.45 O ATOM 0 H GLU A 62 -1.681 -10.585 -18.146 1.00 74.43 H new ATOM 0 HA GLU A 62 -3.538 -10.261 -16.005 1.00 51.12 H new ATOM 0 HB2 GLU A 62 -3.158 -12.283 -18.235 1.00 4.20 H new ATOM 0 HB3 GLU A 62 -4.439 -12.449 -17.051 1.00 4.20 H new ATOM 0 HG2 GLU A 62 -5.322 -10.220 -17.698 1.00 51.53 H new ATOM 0 HG3 GLU A 62 -4.044 -10.059 -18.885 1.00 51.53 H new ATOM 1001 N LEU A 63 -1.179 -12.438 -15.652 1.00 22.33 N ATOM 1002 CA LEU A 63 -0.572 -13.399 -14.737 1.00 11.25 C ATOM 1003 C LEU A 63 -0.641 -12.898 -13.297 1.00 70.04 C ATOM 1004 O LEU A 63 -1.137 -11.802 -13.033 1.00 61.13 O ATOM 1005 CB LEU A 63 0.883 -13.658 -15.129 1.00 64.02 C ATOM 1006 CG LEU A 63 1.113 -14.754 -16.170 1.00 74.23 C ATOM 1007 CD1 LEU A 63 0.282 -14.489 -17.416 1.00 74.41 C ATOM 1008 CD2 LEU A 63 2.589 -14.854 -16.523 1.00 45.14 C ATOM 0 H LEU A 63 -0.568 -12.133 -16.409 1.00 22.33 H new ATOM 0 HA LEU A 63 -1.132 -14.332 -14.806 1.00 11.25 H new ATOM 0 HB2 LEU A 63 1.307 -12.729 -15.510 1.00 64.02 H new ATOM 0 HB3 LEU A 63 1.440 -13.917 -14.229 1.00 64.02 H new ATOM 0 HG LEU A 63 0.797 -15.706 -15.743 1.00 74.23 H new ATOM 0 HD11 LEU A 63 0.458 -15.279 -18.146 1.00 74.41 H new ATOM 0 HD12 LEU A 63 -0.775 -14.469 -17.151 1.00 74.41 H new ATOM 0 HD13 LEU A 63 0.566 -13.528 -17.845 1.00 74.41 H new ATOM 0 HD21 LEU A 63 2.733 -15.639 -17.265 1.00 45.14 H new ATOM 0 HD22 LEU A 63 2.931 -13.903 -16.930 1.00 45.14 H new ATOM 0 HD23 LEU A 63 3.162 -15.092 -15.627 1.00 45.14 H new ATOM 1020 N HIS A 64 -0.138 -13.707 -12.370 1.00 14.10 N ATOM 1021 CA HIS A 64 -0.140 -13.345 -10.957 1.00 53.41 C ATOM 1022 C HIS A 64 -1.567 -13.232 -10.427 1.00 25.20 C ATOM 1023 O HIS A 64 -2.098 -12.139 -10.231 1.00 44.24 O ATOM 1024 CB HIS A 64 0.600 -12.024 -10.747 1.00 0.53 C ATOM 1025 CG HIS A 64 1.922 -11.959 -11.448 1.00 30.42 C ATOM 1026 ND1 HIS A 64 2.133 -11.215 -12.589 1.00 61.55 N ATOM 1027 CD2 HIS A 64 3.105 -12.551 -11.162 1.00 4.12 C ATOM 1028 CE1 HIS A 64 3.389 -11.354 -12.976 1.00 53.53 C ATOM 1029 NE2 HIS A 64 4.000 -12.159 -12.127 1.00 4.45 N ATOM 0 H HIS A 64 0.276 -14.617 -12.572 1.00 14.10 H new ATOM 0 HA HIS A 64 0.373 -14.132 -10.405 1.00 53.41 H new ATOM 0 HB2 HIS A 64 -0.028 -11.205 -11.098 1.00 0.53 H new ATOM 0 HB3 HIS A 64 0.756 -11.871 -9.679 1.00 0.53 H new ATOM 0 HD2 HIS A 64 3.307 -13.209 -10.330 1.00 4.12 H new ATOM 0 HE1 HIS A 64 3.839 -10.888 -13.840 1.00 53.53 H new ATOM 0 HE2 HIS A 64 4.978 -12.444 -12.179 1.00 4.45 H new ATOM 1037 N PRO A 65 -2.203 -14.389 -10.189 1.00 41.31 N ATOM 1038 CA PRO A 65 -3.576 -14.446 -9.679 1.00 20.31 C ATOM 1039 C PRO A 65 -3.676 -13.980 -8.230 1.00 72.15 C ATOM 1040 O PRO A 65 -4.665 -13.365 -7.835 1.00 14.44 O ATOM 1041 CB PRO A 65 -3.933 -15.931 -9.789 1.00 13.32 C ATOM 1042 CG PRO A 65 -2.625 -16.640 -9.734 1.00 24.45 C ATOM 1043 CD PRO A 65 -1.631 -15.729 -10.400 1.00 21.25 C ATOM 0 HA PRO A 65 -4.245 -13.790 -10.235 1.00 20.31 H new ATOM 0 HB2 PRO A 65 -4.587 -16.242 -8.974 1.00 13.32 H new ATOM 0 HB3 PRO A 65 -4.460 -16.144 -10.719 1.00 13.32 H new ATOM 0 HG2 PRO A 65 -2.336 -16.846 -8.703 1.00 24.45 H new ATOM 0 HG3 PRO A 65 -2.680 -17.600 -10.248 1.00 24.45 H new ATOM 0 HD2 PRO A 65 -0.641 -15.819 -9.953 1.00 21.25 H new ATOM 0 HD3 PRO A 65 -1.524 -15.958 -11.460 1.00 21.25 H new ATOM 1051 N GLU A 66 -2.646 -14.277 -7.445 1.00 65.32 N ATOM 1052 CA GLU A 66 -2.619 -13.888 -6.040 1.00 73.02 C ATOM 1053 C GLU A 66 -2.439 -12.380 -5.897 1.00 4.42 C ATOM 1054 O GLU A 66 -2.884 -11.782 -4.918 1.00 51.51 O ATOM 1055 CB GLU A 66 -1.494 -14.620 -5.306 1.00 43.32 C ATOM 1056 CG GLU A 66 -1.987 -15.566 -4.224 1.00 63.05 C ATOM 1057 CD GLU A 66 -2.191 -16.979 -4.735 1.00 32.33 C ATOM 1058 OE1 GLU A 66 -1.189 -17.627 -5.104 1.00 51.32 O ATOM 1059 OE2 GLU A 66 -3.352 -17.438 -4.765 1.00 12.32 O ATOM 0 H GLU A 66 -1.819 -14.786 -7.758 1.00 65.32 H new ATOM 0 HA GLU A 66 -3.574 -14.166 -5.594 1.00 73.02 H new ATOM 0 HB2 GLU A 66 -0.906 -15.184 -6.030 1.00 43.32 H new ATOM 0 HB3 GLU A 66 -0.826 -13.885 -4.857 1.00 43.32 H new ATOM 0 HG2 GLU A 66 -1.269 -15.580 -3.404 1.00 63.05 H new ATOM 0 HG3 GLU A 66 -2.927 -15.191 -3.819 1.00 63.05 H new ATOM 1066 N GLU A 67 -1.781 -11.772 -6.880 1.00 32.22 N ATOM 1067 CA GLU A 67 -1.540 -10.334 -6.862 1.00 72.12 C ATOM 1068 C GLU A 67 -2.815 -9.565 -7.197 1.00 42.21 C ATOM 1069 O GLU A 67 -3.019 -8.446 -6.725 1.00 74.31 O ATOM 1070 CB GLU A 67 -0.435 -9.968 -7.854 1.00 44.35 C ATOM 1071 CG GLU A 67 0.948 -10.422 -7.420 1.00 25.41 C ATOM 1072 CD GLU A 67 2.059 -9.708 -8.166 1.00 74.21 C ATOM 1073 OE1 GLU A 67 1.915 -9.501 -9.389 1.00 15.21 O ATOM 1074 OE2 GLU A 67 3.072 -9.356 -7.526 1.00 72.31 O ATOM 0 H GLU A 67 -1.406 -12.253 -7.698 1.00 32.22 H new ATOM 0 HA GLU A 67 -1.222 -10.057 -5.857 1.00 72.12 H new ATOM 0 HB2 GLU A 67 -0.666 -10.412 -8.822 1.00 44.35 H new ATOM 0 HB3 GLU A 67 -0.426 -8.887 -7.992 1.00 44.35 H new ATOM 0 HG2 GLU A 67 1.064 -10.248 -6.350 1.00 25.41 H new ATOM 0 HG3 GLU A 67 1.040 -11.496 -7.580 1.00 25.41 H new ATOM 1081 N ARG A 68 -3.668 -10.172 -8.015 1.00 60.41 N ATOM 1082 CA ARG A 68 -4.922 -9.545 -8.415 1.00 44.31 C ATOM 1083 C ARG A 68 -5.707 -9.072 -7.195 1.00 25.01 C ATOM 1084 O ARG A 68 -6.149 -7.925 -7.134 1.00 11.32 O ATOM 1085 CB ARG A 68 -5.768 -10.522 -9.232 1.00 73.41 C ATOM 1086 CG ARG A 68 -5.584 -10.380 -10.734 1.00 64.11 C ATOM 1087 CD ARG A 68 -6.100 -11.602 -11.477 1.00 75.11 C ATOM 1088 NE ARG A 68 -7.429 -11.999 -11.020 1.00 32.44 N ATOM 1089 CZ ARG A 68 -8.011 -13.145 -11.357 1.00 64.11 C ATOM 1090 NH1 ARG A 68 -7.383 -14.002 -12.151 1.00 32.25 N ATOM 1091 NH2 ARG A 68 -9.222 -13.436 -10.900 1.00 50.42 N ATOM 0 H ARG A 68 -3.514 -11.098 -8.414 1.00 60.41 H new ATOM 0 HA ARG A 68 -4.685 -8.678 -9.031 1.00 44.31 H new ATOM 0 HB2 ARG A 68 -5.516 -11.541 -8.939 1.00 73.41 H new ATOM 0 HB3 ARG A 68 -6.819 -10.371 -8.988 1.00 73.41 H new ATOM 0 HG2 ARG A 68 -6.110 -9.492 -11.084 1.00 64.11 H new ATOM 0 HG3 ARG A 68 -4.528 -10.235 -10.960 1.00 64.11 H new ATOM 0 HD2 ARG A 68 -6.132 -11.390 -12.546 1.00 75.11 H new ATOM 0 HD3 ARG A 68 -5.406 -12.431 -11.338 1.00 75.11 H new ATOM 0 HE ARG A 68 -7.939 -11.361 -10.408 1.00 32.44 H new ATOM 0 HH11 ARG A 68 -6.452 -13.782 -12.504 1.00 32.25 H new ATOM 0 HH12 ARG A 68 -7.831 -14.881 -12.409 1.00 32.25 H new ATOM 0 HH21 ARG A 68 -9.708 -12.780 -10.289 1.00 50.42 H new ATOM 0 HH22 ARG A 68 -9.667 -14.316 -11.160 1.00 50.42 H new ATOM 1105 N LYS A 69 -5.876 -9.964 -6.225 1.00 72.31 N ATOM 1106 CA LYS A 69 -6.607 -9.640 -5.006 1.00 3.04 C ATOM 1107 C LYS A 69 -5.852 -8.604 -4.178 1.00 72.15 C ATOM 1108 O LYS A 69 -6.458 -7.780 -3.493 1.00 73.22 O ATOM 1109 CB LYS A 69 -6.837 -10.903 -4.173 1.00 60.43 C ATOM 1110 CG LYS A 69 -5.564 -11.677 -3.878 1.00 20.34 C ATOM 1111 CD LYS A 69 -5.823 -12.835 -2.928 1.00 70.12 C ATOM 1112 CE LYS A 69 -6.096 -12.346 -1.514 1.00 52.01 C ATOM 1113 NZ LYS A 69 -6.081 -13.462 -0.528 1.00 62.15 N ATOM 0 H LYS A 69 -5.516 -10.918 -6.260 1.00 72.31 H new ATOM 0 HA LYS A 69 -7.571 -9.220 -5.292 1.00 3.04 H new ATOM 0 HB2 LYS A 69 -7.310 -10.626 -3.231 1.00 60.43 H new ATOM 0 HB3 LYS A 69 -7.534 -11.554 -4.700 1.00 60.43 H new ATOM 0 HG2 LYS A 69 -5.144 -12.056 -4.809 1.00 20.34 H new ATOM 0 HG3 LYS A 69 -4.822 -11.007 -3.443 1.00 20.34 H new ATOM 0 HD2 LYS A 69 -6.674 -13.416 -3.284 1.00 70.12 H new ATOM 0 HD3 LYS A 69 -4.961 -13.503 -2.923 1.00 70.12 H new ATOM 0 HE2 LYS A 69 -5.347 -11.605 -1.235 1.00 52.01 H new ATOM 0 HE3 LYS A 69 -7.065 -11.847 -1.483 1.00 52.01 H new ATOM 0 HZ1 LYS A 69 -6.271 -13.087 0.423 1.00 62.15 H new ATOM 0 HZ2 LYS A 69 -6.813 -14.157 -0.779 1.00 62.15 H new ATOM 0 HZ3 LYS A 69 -5.148 -13.922 -0.539 1.00 62.15 H new ATOM 1127 N LYS A 70 -4.526 -8.650 -4.248 1.00 71.10 N ATOM 1128 CA LYS A 70 -3.688 -7.714 -3.508 1.00 63.23 C ATOM 1129 C LYS A 70 -3.861 -6.294 -4.036 1.00 54.32 C ATOM 1130 O LYS A 70 -4.120 -5.364 -3.272 1.00 5.22 O ATOM 1131 CB LYS A 70 -2.218 -8.129 -3.604 1.00 3.02 C ATOM 1132 CG LYS A 70 -1.315 -7.401 -2.623 1.00 13.41 C ATOM 1133 CD LYS A 70 -1.150 -8.182 -1.331 1.00 34.45 C ATOM 1134 CE LYS A 70 -2.356 -8.012 -0.418 1.00 64.25 C ATOM 1135 NZ LYS A 70 -2.044 -8.389 0.988 1.00 35.51 N ATOM 0 H LYS A 70 -4.008 -9.326 -4.810 1.00 71.10 H new ATOM 0 HA LYS A 70 -3.998 -7.735 -2.463 1.00 63.23 H new ATOM 0 HB2 LYS A 70 -2.140 -9.202 -3.429 1.00 3.02 H new ATOM 0 HB3 LYS A 70 -1.863 -7.945 -4.618 1.00 3.02 H new ATOM 0 HG2 LYS A 70 -0.338 -7.239 -3.078 1.00 13.41 H new ATOM 0 HG3 LYS A 70 -1.732 -6.418 -2.404 1.00 13.41 H new ATOM 0 HD2 LYS A 70 -1.011 -9.239 -1.559 1.00 34.45 H new ATOM 0 HD3 LYS A 70 -0.251 -7.846 -0.814 1.00 34.45 H new ATOM 0 HE2 LYS A 70 -2.693 -6.976 -0.450 1.00 64.25 H new ATOM 0 HE3 LYS A 70 -3.179 -8.626 -0.785 1.00 64.25 H new ATOM 0 HZ1 LYS A 70 -2.890 -8.259 1.578 1.00 35.51 H new ATOM 0 HZ2 LYS A 70 -1.747 -9.385 1.023 1.00 35.51 H new ATOM 0 HZ3 LYS A 70 -1.276 -7.786 1.347 1.00 35.51 H new ATOM 1149 N VAL A 71 -3.719 -6.133 -5.348 1.00 74.21 N ATOM 1150 CA VAL A 71 -3.863 -4.826 -5.978 1.00 72.34 C ATOM 1151 C VAL A 71 -5.300 -4.326 -5.884 1.00 11.21 C ATOM 1152 O VAL A 71 -5.542 -3.130 -5.722 1.00 51.43 O ATOM 1153 CB VAL A 71 -3.442 -4.868 -7.459 1.00 71.14 C ATOM 1154 CG1 VAL A 71 -1.967 -5.219 -7.586 1.00 35.24 C ATOM 1155 CG2 VAL A 71 -4.302 -5.858 -8.230 1.00 33.43 C ATOM 0 H VAL A 71 -3.504 -6.892 -5.995 1.00 74.21 H new ATOM 0 HA VAL A 71 -3.207 -4.141 -5.440 1.00 72.34 H new ATOM 0 HB VAL A 71 -3.594 -3.878 -7.889 1.00 71.14 H new ATOM 0 HG11 VAL A 71 -1.688 -5.244 -8.639 1.00 35.24 H new ATOM 0 HG12 VAL A 71 -1.369 -4.468 -7.070 1.00 35.24 H new ATOM 0 HG13 VAL A 71 -1.786 -6.197 -7.140 1.00 35.24 H new ATOM 0 HG21 VAL A 71 -3.990 -5.874 -9.274 1.00 33.43 H new ATOM 0 HG22 VAL A 71 -4.185 -6.853 -7.801 1.00 33.43 H new ATOM 0 HG23 VAL A 71 -5.348 -5.557 -8.168 1.00 33.43 H new ATOM 1165 N ARG A 72 -6.250 -5.249 -5.985 1.00 75.33 N ATOM 1166 CA ARG A 72 -7.664 -4.902 -5.912 1.00 15.30 C ATOM 1167 C ARG A 72 -8.007 -4.304 -4.551 1.00 15.04 C ATOM 1168 O ARG A 72 -8.578 -3.217 -4.466 1.00 4.12 O ATOM 1169 CB ARG A 72 -8.529 -6.137 -6.171 1.00 52.21 C ATOM 1170 CG ARG A 72 -8.636 -6.508 -7.641 1.00 62.02 C ATOM 1171 CD ARG A 72 -9.663 -5.647 -8.360 1.00 20.50 C ATOM 1172 NE ARG A 72 -11.005 -5.823 -7.811 1.00 22.12 N ATOM 1173 CZ ARG A 72 -11.728 -6.925 -7.975 1.00 24.40 C ATOM 1174 NH1 ARG A 72 -11.240 -7.945 -8.669 1.00 1.34 N ATOM 1175 NH2 ARG A 72 -12.941 -7.010 -7.444 1.00 42.13 N ATOM 0 H ARG A 72 -6.066 -6.243 -6.118 1.00 75.33 H new ATOM 0 HA ARG A 72 -7.869 -4.156 -6.680 1.00 15.30 H new ATOM 0 HB2 ARG A 72 -8.115 -6.982 -5.621 1.00 52.21 H new ATOM 0 HB3 ARG A 72 -9.529 -5.959 -5.776 1.00 52.21 H new ATOM 0 HG2 ARG A 72 -7.663 -6.391 -8.119 1.00 62.02 H new ATOM 0 HG3 ARG A 72 -8.912 -7.558 -7.733 1.00 62.02 H new ATOM 0 HD2 ARG A 72 -9.375 -4.599 -8.283 1.00 20.50 H new ATOM 0 HD3 ARG A 72 -9.669 -5.899 -9.420 1.00 20.50 H new ATOM 0 HE ARG A 72 -11.409 -5.057 -7.272 1.00 22.12 H new ATOM 0 HH11 ARG A 72 -10.308 -7.884 -9.078 1.00 1.34 H new ATOM 0 HH12 ARG A 72 -11.797 -8.790 -8.794 1.00 1.34 H new ATOM 0 HH21 ARG A 72 -13.319 -6.228 -6.909 1.00 42.13 H new ATOM 0 HH22 ARG A 72 -13.495 -7.857 -7.571 1.00 42.13 H new ATOM 1189 N GLU A 73 -7.656 -5.023 -3.489 1.00 13.22 N ATOM 1190 CA GLU A 73 -7.929 -4.563 -2.132 1.00 63.30 C ATOM 1191 C GLU A 73 -7.042 -3.374 -1.772 1.00 74.31 C ATOM 1192 O GLU A 73 -7.454 -2.479 -1.034 1.00 53.23 O ATOM 1193 CB GLU A 73 -7.708 -5.699 -1.131 1.00 70.31 C ATOM 1194 CG GLU A 73 -6.252 -6.109 -0.986 1.00 41.50 C ATOM 1195 CD GLU A 73 -6.088 -7.438 -0.276 1.00 24.12 C ATOM 1196 OE1 GLU A 73 -6.404 -8.480 -0.888 1.00 12.13 O ATOM 1197 OE2 GLU A 73 -5.643 -7.437 0.891 1.00 61.31 O ATOM 0 H GLU A 73 -7.183 -5.925 -3.542 1.00 13.22 H new ATOM 0 HA GLU A 73 -8.971 -4.245 -2.086 1.00 63.30 H new ATOM 0 HB2 GLU A 73 -8.089 -5.393 -0.157 1.00 70.31 H new ATOM 0 HB3 GLU A 73 -8.291 -6.565 -1.443 1.00 70.31 H new ATOM 0 HG2 GLU A 73 -5.796 -6.171 -1.974 1.00 41.50 H new ATOM 0 HG3 GLU A 73 -5.715 -5.338 -0.434 1.00 41.50 H new ATOM 1204 N LYS A 74 -5.822 -3.373 -2.298 1.00 53.21 N ATOM 1205 CA LYS A 74 -4.876 -2.295 -2.034 1.00 72.24 C ATOM 1206 C LYS A 74 -5.420 -0.960 -2.533 1.00 3.12 C ATOM 1207 O LYS A 74 -5.487 0.013 -1.782 1.00 11.41 O ATOM 1208 CB LYS A 74 -3.533 -2.593 -2.704 1.00 63.00 C ATOM 1209 CG LYS A 74 -2.490 -1.510 -2.484 1.00 73.51 C ATOM 1210 CD LYS A 74 -2.148 -1.357 -1.012 1.00 1.13 C ATOM 1211 CE LYS A 74 -1.421 -2.582 -0.478 1.00 11.33 C ATOM 1212 NZ LYS A 74 -0.696 -2.288 0.789 1.00 1.12 N ATOM 0 H LYS A 74 -5.465 -4.107 -2.910 1.00 53.21 H new ATOM 0 HA LYS A 74 -4.731 -2.228 -0.956 1.00 72.24 H new ATOM 0 HB2 LYS A 74 -3.148 -3.539 -2.323 1.00 63.00 H new ATOM 0 HB3 LYS A 74 -3.691 -2.721 -3.775 1.00 63.00 H new ATOM 0 HG2 LYS A 74 -1.588 -1.753 -3.045 1.00 73.51 H new ATOM 0 HG3 LYS A 74 -2.861 -0.562 -2.873 1.00 73.51 H new ATOM 0 HD2 LYS A 74 -1.525 -0.473 -0.872 1.00 1.13 H new ATOM 0 HD3 LYS A 74 -3.062 -1.197 -0.440 1.00 1.13 H new ATOM 0 HE2 LYS A 74 -2.139 -3.385 -0.308 1.00 11.33 H new ATOM 0 HE3 LYS A 74 -0.714 -2.940 -1.226 1.00 11.33 H new ATOM 0 HZ1 LYS A 74 -0.214 -3.148 1.121 1.00 1.12 H new ATOM 0 HZ2 LYS A 74 0.006 -1.540 0.621 1.00 1.12 H new ATOM 0 HZ3 LYS A 74 -1.374 -1.971 1.511 1.00 1.12 H new ATOM 1226 N PHE A 75 -5.808 -0.921 -3.803 1.00 64.32 N ATOM 1227 CA PHE A 75 -6.346 0.295 -4.402 1.00 21.25 C ATOM 1228 C PHE A 75 -7.745 0.590 -3.869 1.00 21.24 C ATOM 1229 O PHE A 75 -8.127 1.749 -3.704 1.00 65.31 O ATOM 1230 CB PHE A 75 -6.385 0.164 -5.926 1.00 15.45 C ATOM 1231 CG PHE A 75 -7.760 -0.103 -6.469 1.00 10.12 C ATOM 1232 CD1 PHE A 75 -8.613 0.944 -6.777 1.00 13.30 C ATOM 1233 CD2 PHE A 75 -8.199 -1.402 -6.671 1.00 0.51 C ATOM 1234 CE1 PHE A 75 -9.879 0.702 -7.277 1.00 63.14 C ATOM 1235 CE2 PHE A 75 -9.463 -1.650 -7.171 1.00 70.04 C ATOM 1236 CZ PHE A 75 -10.304 -0.597 -7.474 1.00 34.21 C ATOM 0 H PHE A 75 -5.760 -1.718 -4.438 1.00 64.32 H new ATOM 0 HA PHE A 75 -5.691 1.124 -4.133 1.00 21.25 H new ATOM 0 HB2 PHE A 75 -5.999 1.081 -6.372 1.00 15.45 H new ATOM 0 HB3 PHE A 75 -5.719 -0.644 -6.231 1.00 15.45 H new ATOM 0 HD1 PHE A 75 -8.285 1.962 -6.625 1.00 13.30 H new ATOM 0 HD2 PHE A 75 -7.546 -2.229 -6.435 1.00 0.51 H new ATOM 0 HE1 PHE A 75 -10.534 1.527 -7.513 1.00 63.14 H new ATOM 0 HE2 PHE A 75 -9.793 -2.667 -7.325 1.00 70.04 H new ATOM 0 HZ PHE A 75 -11.292 -0.789 -7.864 1.00 34.21 H new ATOM 1246 N ASP A 76 -8.505 -0.467 -3.601 1.00 45.35 N ATOM 1247 CA ASP A 76 -9.861 -0.322 -3.087 1.00 33.43 C ATOM 1248 C ASP A 76 -9.851 0.307 -1.697 1.00 72.01 C ATOM 1249 O ASP A 76 -10.584 1.260 -1.432 1.00 65.41 O ATOM 1250 CB ASP A 76 -10.559 -1.683 -3.039 1.00 41.30 C ATOM 1251 CG ASP A 76 -11.892 -1.625 -2.319 1.00 41.22 C ATOM 1252 OD1 ASP A 76 -12.907 -1.312 -2.976 1.00 30.04 O ATOM 1253 OD2 ASP A 76 -11.920 -1.891 -1.099 1.00 70.43 O ATOM 0 H ASP A 76 -8.204 -1.433 -3.731 1.00 45.35 H new ATOM 0 HA ASP A 76 -10.410 0.336 -3.760 1.00 33.43 H new ATOM 0 HB2 ASP A 76 -10.714 -2.045 -4.056 1.00 41.30 H new ATOM 0 HB3 ASP A 76 -9.911 -2.403 -2.540 1.00 41.30 H new ATOM 1258 N GLU A 77 -9.017 -0.233 -0.814 1.00 72.52 N ATOM 1259 CA GLU A 77 -8.914 0.275 0.549 1.00 71.33 C ATOM 1260 C GLU A 77 -8.301 1.672 0.563 1.00 2.04 C ATOM 1261 O GLU A 77 -8.824 2.584 1.202 1.00 52.24 O ATOM 1262 CB GLU A 77 -8.073 -0.672 1.408 1.00 74.24 C ATOM 1263 CG GLU A 77 -8.760 -1.994 1.706 1.00 31.35 C ATOM 1264 CD GLU A 77 -7.826 -3.007 2.340 1.00 42.12 C ATOM 1265 OE1 GLU A 77 -6.626 -2.696 2.489 1.00 1.42 O ATOM 1266 OE2 GLU A 77 -8.296 -4.111 2.686 1.00 24.02 O ATOM 0 H GLU A 77 -8.403 -1.022 -1.018 1.00 72.52 H new ATOM 0 HA GLU A 77 -9.920 0.334 0.965 1.00 71.33 H new ATOM 0 HB2 GLU A 77 -7.129 -0.869 0.899 1.00 74.24 H new ATOM 0 HB3 GLU A 77 -7.831 -0.178 2.349 1.00 74.24 H new ATOM 0 HG2 GLU A 77 -9.605 -1.818 2.372 1.00 31.35 H new ATOM 0 HG3 GLU A 77 -9.163 -2.406 0.781 1.00 31.35 H new ATOM 1273 N ASN A 78 -7.187 1.831 -0.145 1.00 32.53 N ATOM 1274 CA ASN A 78 -6.501 3.116 -0.213 1.00 31.34 C ATOM 1275 C ASN A 78 -7.427 4.198 -0.760 1.00 45.10 C ATOM 1276 O ASN A 78 -7.352 5.357 -0.352 1.00 52.23 O ATOM 1277 CB ASN A 78 -5.252 3.005 -1.090 1.00 35.12 C ATOM 1278 CG ASN A 78 -4.453 4.293 -1.123 1.00 1.13 C ATOM 1279 OD1 ASN A 78 -4.463 5.068 -0.166 1.00 74.20 O ATOM 1280 ND2 ASN A 78 -3.755 4.528 -2.228 1.00 22.13 N ATOM 0 H ASN A 78 -6.740 1.086 -0.680 1.00 32.53 H new ATOM 0 HA ASN A 78 -6.203 3.395 0.798 1.00 31.34 H new ATOM 0 HB2 ASN A 78 -4.621 2.198 -0.718 1.00 35.12 H new ATOM 0 HB3 ASN A 78 -5.546 2.737 -2.105 1.00 35.12 H new ATOM 0 HD21 ASN A 78 -3.198 5.379 -2.308 1.00 22.13 H new ATOM 0 HD22 ASN A 78 -3.776 3.858 -2.997 1.00 22.13 H new ATOM 1287 N SER A 79 -8.298 3.811 -1.686 1.00 33.03 N ATOM 1288 CA SER A 79 -9.237 4.749 -2.292 1.00 25.53 C ATOM 1289 C SER A 79 -10.379 5.070 -1.333 1.00 3.42 C ATOM 1290 O SER A 79 -10.843 6.209 -1.263 1.00 23.54 O ATOM 1291 CB SER A 79 -9.796 4.173 -3.594 1.00 61.22 C ATOM 1292 OG SER A 79 -10.623 3.051 -3.342 1.00 34.53 O ATOM 0 H SER A 79 -8.373 2.855 -2.033 1.00 33.03 H new ATOM 0 HA SER A 79 -8.700 5.672 -2.512 1.00 25.53 H new ATOM 0 HB2 SER A 79 -10.367 4.939 -4.118 1.00 61.22 H new ATOM 0 HB3 SER A 79 -8.975 3.883 -4.249 1.00 61.22 H new ATOM 0 HG SER A 79 -10.280 2.559 -2.567 1.00 34.53 H new ATOM 1298 N ARG A 80 -10.827 4.059 -0.596 1.00 0.30 N ATOM 1299 CA ARG A 80 -11.915 4.233 0.358 1.00 15.02 C ATOM 1300 C ARG A 80 -11.398 4.805 1.675 1.00 52.12 C ATOM 1301 O ARG A 80 -12.179 5.163 2.557 1.00 64.34 O ATOM 1302 CB ARG A 80 -12.618 2.898 0.611 1.00 14.01 C ATOM 1303 CG ARG A 80 -11.980 2.073 1.716 1.00 5.03 C ATOM 1304 CD ARG A 80 -12.714 2.246 3.036 1.00 13.23 C ATOM 1305 NE ARG A 80 -12.627 1.052 3.872 1.00 22.22 N ATOM 1306 CZ ARG A 80 -12.996 1.019 5.148 1.00 63.11 C ATOM 1307 NH1 ARG A 80 -13.475 2.109 5.731 1.00 30.21 N ATOM 1308 NH2 ARG A 80 -12.886 -0.106 5.843 1.00 70.23 N ATOM 0 H ARG A 80 -10.453 3.111 -0.641 1.00 0.30 H new ATOM 0 HA ARG A 80 -12.629 4.937 -0.069 1.00 15.02 H new ATOM 0 HB2 ARG A 80 -13.660 3.089 0.867 1.00 14.01 H new ATOM 0 HB3 ARG A 80 -12.618 2.317 -0.311 1.00 14.01 H new ATOM 0 HG2 ARG A 80 -11.982 1.020 1.433 1.00 5.03 H new ATOM 0 HG3 ARG A 80 -10.938 2.369 1.837 1.00 5.03 H new ATOM 0 HD2 ARG A 80 -12.296 3.097 3.574 1.00 13.23 H new ATOM 0 HD3 ARG A 80 -13.761 2.476 2.841 1.00 13.23 H new ATOM 0 HE ARG A 80 -12.263 0.196 3.453 1.00 22.22 H new ATOM 0 HH11 ARG A 80 -13.561 2.976 5.200 1.00 30.21 H new ATOM 0 HH12 ARG A 80 -13.758 2.081 6.711 1.00 30.21 H new ATOM 0 HH21 ARG A 80 -12.518 -0.947 5.398 1.00 70.23 H new ATOM 0 HH22 ARG A 80 -13.170 -0.130 6.822 1.00 70.23 H new ATOM 1322 N MET A 81 -10.078 4.888 1.800 1.00 64.41 N ATOM 1323 CA MET A 81 -9.457 5.417 3.009 1.00 65.24 C ATOM 1324 C MET A 81 -10.226 6.626 3.531 1.00 73.32 C ATOM 1325 O MET A 81 -10.683 7.464 2.754 1.00 31.11 O ATOM 1326 CB MET A 81 -8.002 5.804 2.733 1.00 73.30 C ATOM 1327 CG MET A 81 -7.017 4.671 2.970 1.00 23.01 C ATOM 1328 SD MET A 81 -6.878 4.224 4.711 1.00 1.25 S ATOM 1329 CE MET A 81 -7.548 2.563 4.689 1.00 3.23 C ATOM 0 H MET A 81 -9.418 4.596 1.080 1.00 64.41 H new ATOM 0 HA MET A 81 -9.480 4.637 3.770 1.00 65.24 H new ATOM 0 HB2 MET A 81 -7.914 6.141 1.700 1.00 73.30 H new ATOM 0 HB3 MET A 81 -7.732 6.648 3.368 1.00 73.30 H new ATOM 0 HG2 MET A 81 -7.330 3.797 2.398 1.00 23.01 H new ATOM 0 HG3 MET A 81 -6.036 4.963 2.594 1.00 23.01 H new ATOM 0 HE1 MET A 81 -7.745 2.237 5.710 1.00 3.23 H new ATOM 0 HE2 MET A 81 -8.477 2.553 4.119 1.00 3.23 H new ATOM 0 HE3 MET A 81 -6.830 1.887 4.224 1.00 3.23 H new ATOM 1339 N GLN A 82 -10.366 6.708 4.850 1.00 1.10 N ATOM 1340 CA GLN A 82 -11.082 7.815 5.474 1.00 25.54 C ATOM 1341 C GLN A 82 -10.517 9.155 5.017 1.00 40.33 C ATOM 1342 O GLN A 82 -9.315 9.288 4.787 1.00 43.04 O ATOM 1343 CB GLN A 82 -11.000 7.707 6.998 1.00 35.01 C ATOM 1344 CG GLN A 82 -11.418 6.347 7.535 1.00 3.41 C ATOM 1345 CD GLN A 82 -11.516 6.323 9.048 1.00 73.54 C ATOM 1346 OE1 GLN A 82 -12.024 7.260 9.664 1.00 74.14 O ATOM 1347 NE2 GLN A 82 -11.030 5.247 9.655 1.00 21.33 N ATOM 0 H GLN A 82 -9.994 6.022 5.507 1.00 1.10 H new ATOM 0 HA GLN A 82 -12.127 7.758 5.168 1.00 25.54 H new ATOM 0 HB2 GLN A 82 -9.978 7.915 7.314 1.00 35.01 H new ATOM 0 HB3 GLN A 82 -11.633 8.474 7.443 1.00 35.01 H new ATOM 0 HG2 GLN A 82 -12.382 6.072 7.108 1.00 3.41 H new ATOM 0 HG3 GLN A 82 -10.699 5.595 7.209 1.00 3.41 H new ATOM 0 HE21 GLN A 82 -10.618 4.494 9.105 1.00 21.33 H new ATOM 0 HE22 GLN A 82 -11.069 5.174 10.672 1.00 21.33 H new ATOM 1356 N TYR A 83 -11.392 10.146 4.886 1.00 1.32 N ATOM 1357 CA TYR A 83 -10.981 11.477 4.453 1.00 30.51 C ATOM 1358 C TYR A 83 -9.912 12.046 5.381 1.00 61.40 C ATOM 1359 O TYR A 83 -9.000 12.745 4.940 1.00 23.42 O ATOM 1360 CB TYR A 83 -12.187 12.417 4.409 1.00 21.42 C ATOM 1361 CG TYR A 83 -12.502 12.933 3.024 1.00 44.44 C ATOM 1362 CD1 TYR A 83 -11.499 13.441 2.206 1.00 71.21 C ATOM 1363 CD2 TYR A 83 -13.801 12.915 2.532 1.00 10.43 C ATOM 1364 CE1 TYR A 83 -11.782 13.915 0.939 1.00 21.35 C ATOM 1365 CE2 TYR A 83 -14.093 13.386 1.267 1.00 62.13 C ATOM 1366 CZ TYR A 83 -13.080 13.885 0.474 1.00 30.32 C ATOM 1367 OH TYR A 83 -13.367 14.356 -0.787 1.00 22.44 O ATOM 0 H TYR A 83 -12.390 10.053 5.073 1.00 1.32 H new ATOM 0 HA TYR A 83 -10.559 11.391 3.452 1.00 30.51 H new ATOM 0 HB2 TYR A 83 -13.060 11.893 4.800 1.00 21.42 H new ATOM 0 HB3 TYR A 83 -12.001 13.264 5.070 1.00 21.42 H new ATOM 0 HD1 TYR A 83 -10.481 13.466 2.567 1.00 71.21 H new ATOM 0 HD2 TYR A 83 -14.597 12.526 3.150 1.00 10.43 H new ATOM 0 HE1 TYR A 83 -10.991 14.307 0.317 1.00 21.35 H new ATOM 0 HE2 TYR A 83 -15.109 13.364 0.900 1.00 62.13 H new ATOM 0 HH TYR A 83 -13.772 13.640 -1.319 1.00 22.44 H new ATOM 1377 N SER A 84 -10.032 11.740 6.669 1.00 61.20 N ATOM 1378 CA SER A 84 -9.079 12.222 7.661 1.00 5.52 C ATOM 1379 C SER A 84 -7.668 11.740 7.339 1.00 64.42 C ATOM 1380 O SER A 84 -6.726 12.530 7.289 1.00 13.53 O ATOM 1381 CB SER A 84 -9.484 11.752 9.060 1.00 44.34 C ATOM 1382 OG SER A 84 -10.892 11.776 9.218 1.00 64.14 O ATOM 0 H SER A 84 -10.780 11.160 7.050 1.00 61.20 H new ATOM 0 HA SER A 84 -9.086 13.312 7.635 1.00 5.52 H new ATOM 0 HB2 SER A 84 -9.113 10.741 9.229 1.00 44.34 H new ATOM 0 HB3 SER A 84 -9.020 12.392 9.811 1.00 44.34 H new ATOM 0 HG SER A 84 -11.125 11.470 10.119 1.00 64.14 H new ATOM 1388 N GLU A 85 -7.531 10.435 7.121 1.00 44.54 N ATOM 1389 CA GLU A 85 -6.235 9.847 6.804 1.00 62.32 C ATOM 1390 C GLU A 85 -5.786 10.241 5.400 1.00 54.44 C ATOM 1391 O GLU A 85 -4.594 10.404 5.139 1.00 64.20 O ATOM 1392 CB GLU A 85 -6.300 8.322 6.921 1.00 40.44 C ATOM 1393 CG GLU A 85 -4.986 7.687 7.342 1.00 4.55 C ATOM 1394 CD GLU A 85 -4.487 8.210 8.676 1.00 44.24 C ATOM 1395 OE1 GLU A 85 -5.295 8.798 9.423 1.00 14.14 O ATOM 1396 OE2 GLU A 85 -3.286 8.031 8.971 1.00 73.33 O ATOM 0 H GLU A 85 -8.300 9.766 7.158 1.00 44.54 H new ATOM 0 HA GLU A 85 -5.507 10.229 7.520 1.00 62.32 H new ATOM 0 HB2 GLU A 85 -7.071 8.054 7.643 1.00 40.44 H new ATOM 0 HB3 GLU A 85 -6.604 7.905 5.961 1.00 40.44 H new ATOM 0 HG2 GLU A 85 -5.112 6.606 7.404 1.00 4.55 H new ATOM 0 HG3 GLU A 85 -4.233 7.877 6.577 1.00 4.55 H new ATOM 1403 N LEU A 86 -6.750 10.393 4.498 1.00 14.53 N ATOM 1404 CA LEU A 86 -6.456 10.769 3.119 1.00 34.35 C ATOM 1405 C LEU A 86 -5.888 12.182 3.049 1.00 10.42 C ATOM 1406 O LEU A 86 -4.831 12.408 2.460 1.00 13.44 O ATOM 1407 CB LEU A 86 -7.720 10.672 2.263 1.00 33.32 C ATOM 1408 CG LEU A 86 -7.557 10.000 0.899 1.00 31.14 C ATOM 1409 CD1 LEU A 86 -8.684 9.008 0.655 1.00 42.24 C ATOM 1410 CD2 LEU A 86 -7.513 11.043 -0.207 1.00 42.43 C ATOM 0 H LEU A 86 -7.742 10.262 4.697 1.00 14.53 H new ATOM 0 HA LEU A 86 -5.708 10.077 2.731 1.00 34.35 H new ATOM 0 HB2 LEU A 86 -8.476 10.125 2.827 1.00 33.32 H new ATOM 0 HB3 LEU A 86 -8.106 11.679 2.106 1.00 33.32 H new ATOM 0 HG LEU A 86 -6.613 9.455 0.894 1.00 31.14 H new ATOM 0 HD11 LEU A 86 -8.552 8.540 -0.320 1.00 42.24 H new ATOM 0 HD12 LEU A 86 -8.669 8.242 1.430 1.00 42.24 H new ATOM 0 HD13 LEU A 86 -9.640 9.530 0.680 1.00 42.24 H new ATOM 0 HD21 LEU A 86 -7.397 10.547 -1.171 1.00 42.43 H new ATOM 0 HD22 LEU A 86 -8.440 11.616 -0.204 1.00 42.43 H new ATOM 0 HD23 LEU A 86 -6.671 11.714 -0.041 1.00 42.43 H new ATOM 1422 N MET A 87 -6.596 13.130 3.656 1.00 63.14 N ATOM 1423 CA MET A 87 -6.159 14.521 3.665 1.00 53.45 C ATOM 1424 C MET A 87 -4.880 14.685 4.479 1.00 63.35 C ATOM 1425 O MET A 87 -4.093 15.602 4.241 1.00 21.12 O ATOM 1426 CB MET A 87 -7.259 15.419 4.235 1.00 3.33 C ATOM 1427 CG MET A 87 -7.929 16.298 3.191 1.00 20.44 C ATOM 1428 SD MET A 87 -8.585 15.351 1.804 1.00 23.42 S ATOM 1429 CE MET A 87 -7.359 15.700 0.546 1.00 41.31 C ATOM 0 H MET A 87 -7.474 12.960 4.147 1.00 63.14 H new ATOM 0 HA MET A 87 -5.953 14.818 2.636 1.00 53.45 H new ATOM 0 HB2 MET A 87 -8.015 14.795 4.712 1.00 3.33 H new ATOM 0 HB3 MET A 87 -6.832 16.053 5.012 1.00 3.33 H new ATOM 0 HG2 MET A 87 -8.739 16.858 3.659 1.00 20.44 H new ATOM 0 HG3 MET A 87 -7.209 17.028 2.820 1.00 20.44 H new ATOM 0 HE1 MET A 87 -7.858 15.899 -0.403 1.00 41.31 H new ATOM 0 HE2 MET A 87 -6.775 16.572 0.839 1.00 41.31 H new ATOM 0 HE3 MET A 87 -6.697 14.841 0.435 1.00 41.31 H new ATOM 1439 N THR A 88 -4.677 13.789 5.440 1.00 3.31 N ATOM 1440 CA THR A 88 -3.494 13.835 6.290 1.00 44.21 C ATOM 1441 C THR A 88 -2.268 13.306 5.555 1.00 63.24 C ATOM 1442 O THR A 88 -1.157 13.806 5.737 1.00 74.13 O ATOM 1443 CB THR A 88 -3.697 13.019 7.580 1.00 24.32 C ATOM 1444 OG1 THR A 88 -4.637 13.679 8.435 1.00 74.54 O ATOM 1445 CG2 THR A 88 -2.378 12.833 8.316 1.00 14.44 C ATOM 0 H THR A 88 -5.317 13.023 5.649 1.00 3.31 H new ATOM 0 HA THR A 88 -3.334 14.881 6.552 1.00 44.21 H new ATOM 0 HB THR A 88 -4.083 12.038 7.305 1.00 24.32 H new ATOM 0 HG1 THR A 88 -5.547 13.404 8.195 1.00 74.54 H new ATOM 0 HG21 THR A 88 -2.546 12.254 9.224 1.00 14.44 H new ATOM 0 HG22 THR A 88 -1.674 12.304 7.673 1.00 14.44 H new ATOM 0 HG23 THR A 88 -1.967 13.808 8.579 1.00 14.44 H new ATOM 1453 N LYS A 89 -2.475 12.291 4.722 1.00 11.13 N ATOM 1454 CA LYS A 89 -1.387 11.694 3.957 1.00 52.12 C ATOM 1455 C LYS A 89 -1.013 12.573 2.767 1.00 22.44 C ATOM 1456 O LYS A 89 0.003 12.344 2.110 1.00 53.02 O ATOM 1457 CB LYS A 89 -1.785 10.299 3.469 1.00 50.21 C ATOM 1458 CG LYS A 89 -0.831 9.204 3.914 1.00 51.21 C ATOM 1459 CD LYS A 89 -1.219 8.644 5.272 1.00 14.41 C ATOM 1460 CE LYS A 89 -0.614 9.459 6.405 1.00 51.43 C ATOM 1461 NZ LYS A 89 -0.010 8.590 7.452 1.00 14.34 N ATOM 0 H LYS A 89 -3.387 11.865 4.560 1.00 11.13 H new ATOM 0 HA LYS A 89 -0.519 11.610 4.611 1.00 52.12 H new ATOM 0 HB2 LYS A 89 -2.786 10.068 3.833 1.00 50.21 H new ATOM 0 HB3 LYS A 89 -1.836 10.305 2.380 1.00 50.21 H new ATOM 0 HG2 LYS A 89 -0.827 8.402 3.176 1.00 51.21 H new ATOM 0 HG3 LYS A 89 0.183 9.600 3.959 1.00 51.21 H new ATOM 0 HD2 LYS A 89 -2.305 8.637 5.367 1.00 14.41 H new ATOM 0 HD3 LYS A 89 -0.886 7.609 5.349 1.00 14.41 H new ATOM 0 HE2 LYS A 89 0.148 10.128 6.005 1.00 51.43 H new ATOM 0 HE3 LYS A 89 -1.385 10.086 6.853 1.00 51.43 H new ATOM 0 HZ1 LYS A 89 0.391 9.183 8.206 1.00 14.34 H new ATOM 0 HZ2 LYS A 89 -0.742 7.969 7.852 1.00 14.34 H new ATOM 0 HZ3 LYS A 89 0.743 8.010 7.030 1.00 14.34 H new ATOM 1475 N TYR A 90 -1.838 13.578 2.498 1.00 41.04 N ATOM 1476 CA TYR A 90 -1.594 14.490 1.387 1.00 45.33 C ATOM 1477 C TYR A 90 -1.198 15.874 1.894 1.00 35.45 C ATOM 1478 O TYR A 90 -0.416 16.581 1.259 1.00 55.32 O ATOM 1479 CB TYR A 90 -2.837 14.595 0.503 1.00 53.34 C ATOM 1480 CG TYR A 90 -2.838 15.809 -0.400 1.00 32.34 C ATOM 1481 CD1 TYR A 90 -1.983 15.888 -1.492 1.00 33.51 C ATOM 1482 CD2 TYR A 90 -3.695 16.876 -0.160 1.00 50.10 C ATOM 1483 CE1 TYR A 90 -1.980 16.995 -2.318 1.00 73.42 C ATOM 1484 CE2 TYR A 90 -3.700 17.986 -0.982 1.00 1.51 C ATOM 1485 CZ TYR A 90 -2.840 18.041 -2.059 1.00 54.23 C ATOM 1486 OH TYR A 90 -2.842 19.145 -2.881 1.00 5.12 O ATOM 0 H TYR A 90 -2.682 13.782 3.034 1.00 41.04 H new ATOM 0 HA TYR A 90 -0.770 14.090 0.797 1.00 45.33 H new ATOM 0 HB2 TYR A 90 -2.914 13.697 -0.110 1.00 53.34 H new ATOM 0 HB3 TYR A 90 -3.723 14.624 1.138 1.00 53.34 H new ATOM 0 HD1 TYR A 90 -1.309 15.070 -1.699 1.00 33.51 H new ATOM 0 HD2 TYR A 90 -4.368 16.837 0.683 1.00 50.10 H new ATOM 0 HE1 TYR A 90 -1.308 17.041 -3.162 1.00 73.42 H new ATOM 0 HE2 TYR A 90 -4.374 18.806 -0.783 1.00 1.51 H new ATOM 0 HH TYR A 90 -3.507 19.790 -2.561 1.00 5.12 H new ATOM 1496 N HIS A 91 -1.745 16.253 3.046 1.00 63.54 N ATOM 1497 CA HIS A 91 -1.449 17.551 3.641 1.00 33.33 C ATOM 1498 C HIS A 91 -0.334 17.433 4.676 1.00 61.35 C ATOM 1499 O HIS A 91 0.386 18.396 4.939 1.00 42.02 O ATOM 1500 CB HIS A 91 -2.704 18.134 4.292 1.00 41.54 C ATOM 1501 CG HIS A 91 -2.733 19.632 4.300 1.00 62.10 C ATOM 1502 ND1 HIS A 91 -2.737 20.378 5.460 1.00 41.15 N ATOM 1503 CD2 HIS A 91 -2.757 20.523 3.281 1.00 34.41 C ATOM 1504 CE1 HIS A 91 -2.765 21.663 5.154 1.00 65.14 C ATOM 1505 NE2 HIS A 91 -2.777 21.778 3.838 1.00 61.32 N ATOM 0 H HIS A 91 -2.395 15.680 3.585 1.00 63.54 H new ATOM 0 HA HIS A 91 -1.115 18.219 2.847 1.00 33.33 H new ATOM 0 HB2 HIS A 91 -3.583 17.764 3.764 1.00 41.54 H new ATOM 0 HB3 HIS A 91 -2.773 17.772 5.318 1.00 41.54 H new ATOM 0 HD2 HIS A 91 -2.760 20.290 2.226 1.00 34.41 H new ATOM 0 HE1 HIS A 91 -2.776 22.480 5.860 1.00 65.14 H new ATOM 0 HE2 HIS A 91 -2.798 22.656 3.320 1.00 61.32 H new ATOM 1513 N ASP A 92 -0.198 16.247 5.259 1.00 65.04 N ATOM 1514 CA ASP A 92 0.830 16.003 6.264 1.00 63.00 C ATOM 1515 C ASP A 92 2.036 15.299 5.649 1.00 51.12 C ATOM 1516 O ASP A 92 3.172 15.755 5.788 1.00 72.25 O ATOM 1517 CB ASP A 92 0.264 15.163 7.410 1.00 52.30 C ATOM 1518 CG ASP A 92 0.749 15.634 8.767 1.00 30.31 C ATOM 1519 OD1 ASP A 92 0.153 16.586 9.313 1.00 21.13 O ATOM 1520 OD2 ASP A 92 1.724 15.049 9.283 1.00 11.15 O ATOM 0 H ASP A 92 -0.787 15.440 5.053 1.00 65.04 H new ATOM 0 HA ASP A 92 1.155 16.967 6.656 1.00 63.00 H new ATOM 0 HB2 ASP A 92 -0.825 15.203 7.383 1.00 52.30 H new ATOM 0 HB3 ASP A 92 0.548 14.120 7.267 1.00 52.30 H new ATOM 1525 N LEU A 93 1.782 14.186 4.970 1.00 74.10 N ATOM 1526 CA LEU A 93 2.846 13.418 4.334 1.00 61.41 C ATOM 1527 C LEU A 93 3.590 14.265 3.307 1.00 5.11 C ATOM 1528 O LEU A 93 4.712 13.942 2.915 1.00 72.13 O ATOM 1529 CB LEU A 93 2.270 12.170 3.661 1.00 11.43 C ATOM 1530 CG LEU A 93 2.979 10.852 3.972 1.00 65.04 C ATOM 1531 CD1 LEU A 93 4.457 10.946 3.624 1.00 51.24 C ATOM 1532 CD2 LEU A 93 2.797 10.480 5.436 1.00 62.01 C ATOM 0 H LEU A 93 0.848 13.795 4.846 1.00 74.10 H new ATOM 0 HA LEU A 93 3.552 13.114 5.107 1.00 61.41 H new ATOM 0 HB2 LEU A 93 1.224 12.074 3.953 1.00 11.43 H new ATOM 0 HB3 LEU A 93 2.287 12.323 2.582 1.00 11.43 H new ATOM 0 HG LEU A 93 2.531 10.068 3.361 1.00 65.04 H new ATOM 0 HD11 LEU A 93 4.945 9.999 3.852 1.00 51.24 H new ATOM 0 HD12 LEU A 93 4.568 11.165 2.562 1.00 51.24 H new ATOM 0 HD13 LEU A 93 4.918 11.742 4.208 1.00 51.24 H new ATOM 0 HD21 LEU A 93 3.309 9.539 5.639 1.00 62.01 H new ATOM 0 HD22 LEU A 93 3.217 11.264 6.066 1.00 62.01 H new ATOM 0 HD23 LEU A 93 1.735 10.370 5.654 1.00 62.01 H new ATOM 1544 N LYS A 94 2.960 15.353 2.877 1.00 62.32 N ATOM 1545 CA LYS A 94 3.563 16.250 1.898 1.00 11.12 C ATOM 1546 C LYS A 94 4.819 16.906 2.463 1.00 52.32 C ATOM 1547 O LYS A 94 5.625 17.469 1.721 1.00 20.34 O ATOM 1548 CB LYS A 94 2.559 17.325 1.475 1.00 21.02 C ATOM 1549 CG LYS A 94 1.856 17.994 2.644 1.00 72.15 C ATOM 1550 CD LYS A 94 2.340 19.420 2.843 1.00 55.51 C ATOM 1551 CE LYS A 94 3.492 19.485 3.833 1.00 22.12 C ATOM 1552 NZ LYS A 94 3.419 20.700 4.692 1.00 72.45 N ATOM 0 H LYS A 94 2.032 15.635 3.191 1.00 62.32 H new ATOM 0 HA LYS A 94 3.844 15.660 1.025 1.00 11.12 H new ATOM 0 HB2 LYS A 94 3.078 18.085 0.891 1.00 21.02 H new ATOM 0 HB3 LYS A 94 1.812 16.875 0.821 1.00 21.02 H new ATOM 0 HG2 LYS A 94 0.780 17.995 2.470 1.00 72.15 H new ATOM 0 HG3 LYS A 94 2.032 17.419 3.553 1.00 72.15 H new ATOM 0 HD2 LYS A 94 2.658 19.834 1.886 1.00 55.51 H new ATOM 0 HD3 LYS A 94 1.516 20.038 3.200 1.00 55.51 H new ATOM 0 HE2 LYS A 94 3.481 18.595 4.462 1.00 22.12 H new ATOM 0 HE3 LYS A 94 4.437 19.480 3.291 1.00 22.12 H new ATOM 0 HZ1 LYS A 94 4.222 20.707 5.353 1.00 72.45 H new ATOM 0 HZ2 LYS A 94 3.455 21.550 4.094 1.00 72.45 H new ATOM 0 HZ3 LYS A 94 2.529 20.692 5.229 1.00 72.45 H new ATOM 1566 N LYS A 95 4.980 16.830 3.779 1.00 31.25 N ATOM 1567 CA LYS A 95 6.139 17.414 4.444 1.00 20.52 C ATOM 1568 C LYS A 95 7.434 16.810 3.910 1.00 31.30 C ATOM 1569 O LYS A 95 8.452 17.494 3.808 1.00 32.34 O ATOM 1570 CB LYS A 95 6.048 17.197 5.956 1.00 24.44 C ATOM 1571 CG LYS A 95 7.303 17.611 6.706 1.00 33.54 C ATOM 1572 CD LYS A 95 7.604 19.088 6.516 1.00 21.35 C ATOM 1573 CE LYS A 95 6.602 19.961 7.256 1.00 74.43 C ATOM 1574 NZ LYS A 95 7.148 20.460 8.548 1.00 52.12 N ATOM 0 H LYS A 95 4.322 16.369 4.407 1.00 31.25 H new ATOM 0 HA LYS A 95 6.145 18.484 4.236 1.00 20.52 H new ATOM 0 HB2 LYS A 95 5.200 17.760 6.345 1.00 24.44 H new ATOM 0 HB3 LYS A 95 5.848 16.144 6.152 1.00 24.44 H new ATOM 0 HG2 LYS A 95 7.181 17.397 7.768 1.00 33.54 H new ATOM 0 HG3 LYS A 95 8.149 17.018 6.357 1.00 33.54 H new ATOM 0 HD2 LYS A 95 8.611 19.304 6.874 1.00 21.35 H new ATOM 0 HD3 LYS A 95 7.585 19.331 5.454 1.00 21.35 H new ATOM 0 HE2 LYS A 95 6.325 20.808 6.628 1.00 74.43 H new ATOM 0 HE3 LYS A 95 5.692 19.391 7.442 1.00 74.43 H new ATOM 0 HZ1 LYS A 95 6.435 21.051 9.021 1.00 52.12 H new ATOM 0 HZ2 LYS A 95 7.389 19.653 9.158 1.00 52.12 H new ATOM 0 HZ3 LYS A 95 8.002 21.026 8.369 1.00 52.12 H new ATOM 1588 N GLN A 96 7.386 15.526 3.569 1.00 25.13 N ATOM 1589 CA GLN A 96 8.556 14.832 3.045 1.00 64.52 C ATOM 1590 C GLN A 96 8.254 14.204 1.688 1.00 42.10 C ATOM 1591 O GLN A 96 8.893 13.233 1.286 1.00 63.12 O ATOM 1592 CB GLN A 96 9.019 13.754 4.027 1.00 72.32 C ATOM 1593 CG GLN A 96 9.101 14.237 5.466 1.00 64.32 C ATOM 1594 CD GLN A 96 9.864 13.279 6.360 1.00 11.10 C ATOM 1595 OE1 GLN A 96 9.616 12.073 6.352 1.00 71.02 O ATOM 1596 NE2 GLN A 96 10.799 13.812 7.138 1.00 14.31 N ATOM 0 H GLN A 96 6.550 14.946 3.646 1.00 25.13 H new ATOM 0 HA GLN A 96 9.354 15.564 2.917 1.00 64.52 H new ATOM 0 HB2 GLN A 96 8.333 12.908 3.975 1.00 72.32 H new ATOM 0 HB3 GLN A 96 9.999 13.390 3.718 1.00 72.32 H new ATOM 0 HG2 GLN A 96 9.584 15.214 5.491 1.00 64.32 H new ATOM 0 HG3 GLN A 96 8.093 14.370 5.859 1.00 64.32 H new ATOM 0 HE21 GLN A 96 10.972 14.817 7.113 1.00 14.31 H new ATOM 0 HE22 GLN A 96 11.345 13.216 7.761 1.00 14.31 H new ATOM 1605 N GLY A 97 7.274 14.766 0.986 1.00 4.14 N ATOM 1606 CA GLY A 97 6.904 14.248 -0.318 1.00 22.14 C ATOM 1607 C GLY A 97 6.537 15.347 -1.295 1.00 63.33 C ATOM 1608 O GLY A 97 6.361 16.501 -0.906 1.00 55.31 O ATOM 0 H GLY A 97 6.730 15.571 1.297 1.00 4.14 H new ATOM 0 HA2 GLY A 97 7.733 13.667 -0.723 1.00 22.14 H new ATOM 0 HA3 GLY A 97 6.060 13.566 -0.209 1.00 22.14 H new ATOM 1612 N LYS A 98 6.424 14.989 -2.570 1.00 33.32 N ATOM 1613 CA LYS A 98 6.076 15.952 -3.608 1.00 10.14 C ATOM 1614 C LYS A 98 4.926 15.435 -4.466 1.00 42.44 C ATOM 1615 O LYS A 98 4.760 14.227 -4.635 1.00 15.02 O ATOM 1616 CB LYS A 98 7.293 16.245 -4.488 1.00 54.43 C ATOM 1617 CG LYS A 98 8.620 16.068 -3.771 1.00 13.10 C ATOM 1618 CD LYS A 98 9.141 14.647 -3.906 1.00 11.24 C ATOM 1619 CE LYS A 98 9.939 14.228 -2.681 1.00 21.14 C ATOM 1620 NZ LYS A 98 11.100 13.369 -3.043 1.00 24.13 N ATOM 0 H LYS A 98 6.569 14.038 -2.909 1.00 33.32 H new ATOM 0 HA LYS A 98 5.757 16.874 -3.122 1.00 10.14 H new ATOM 0 HB2 LYS A 98 7.269 15.588 -5.357 1.00 54.43 H new ATOM 0 HB3 LYS A 98 7.224 17.267 -4.860 1.00 54.43 H new ATOM 0 HG2 LYS A 98 9.351 16.765 -4.180 1.00 13.10 H new ATOM 0 HG3 LYS A 98 8.500 16.314 -2.716 1.00 13.10 H new ATOM 0 HD2 LYS A 98 8.304 13.963 -4.048 1.00 11.24 H new ATOM 0 HD3 LYS A 98 9.769 14.571 -4.794 1.00 11.24 H new ATOM 0 HE2 LYS A 98 10.293 15.116 -2.157 1.00 21.14 H new ATOM 0 HE3 LYS A 98 9.289 13.689 -1.991 1.00 21.14 H new ATOM 0 HZ1 LYS A 98 11.618 13.105 -2.181 1.00 24.13 H new ATOM 0 HZ2 LYS A 98 10.761 12.510 -3.520 1.00 24.13 H new ATOM 0 HZ3 LYS A 98 11.733 13.892 -3.681 1.00 24.13 H new ATOM 1634 N ILE A 99 4.137 16.357 -5.008 1.00 4.41 N ATOM 1635 CA ILE A 99 3.006 15.994 -5.851 1.00 55.03 C ATOM 1636 C ILE A 99 2.799 17.015 -6.965 1.00 3.33 C ATOM 1637 O ILE A 99 2.989 18.215 -6.765 1.00 44.30 O ATOM 1638 CB ILE A 99 1.707 15.876 -5.031 1.00 43.31 C ATOM 1639 CG1 ILE A 99 0.511 15.655 -5.959 1.00 14.53 C ATOM 1640 CG2 ILE A 99 1.503 17.121 -4.181 1.00 50.42 C ATOM 1641 CD1 ILE A 99 -0.809 15.546 -5.227 1.00 42.20 C ATOM 0 H ILE A 99 4.261 17.361 -4.878 1.00 4.41 H new ATOM 0 HA ILE A 99 3.239 15.024 -6.290 1.00 55.03 H new ATOM 0 HB ILE A 99 1.790 15.016 -4.366 1.00 43.31 H new ATOM 0 HG12 ILE A 99 0.456 16.479 -6.670 1.00 14.53 H new ATOM 0 HG13 ILE A 99 0.673 14.745 -6.537 1.00 14.53 H new ATOM 0 HG21 ILE A 99 0.581 17.023 -3.607 1.00 50.42 H new ATOM 0 HG22 ILE A 99 2.345 17.237 -3.498 1.00 50.42 H new ATOM 0 HG23 ILE A 99 1.437 17.996 -4.827 1.00 50.42 H new ATOM 0 HD11 ILE A 99 -1.612 15.390 -5.947 1.00 42.20 H new ATOM 0 HD12 ILE A 99 -0.773 14.704 -4.535 1.00 42.20 H new ATOM 0 HD13 ILE A 99 -0.994 16.465 -4.671 1.00 42.20 H new ATOM 1653 N LYS A 100 2.407 16.532 -8.139 1.00 24.45 N ATOM 1654 CA LYS A 100 2.171 17.401 -9.285 1.00 4.43 C ATOM 1655 C LYS A 100 0.733 17.274 -9.777 1.00 43.32 C ATOM 1656 O LYS A 100 0.175 16.178 -9.816 1.00 63.44 O ATOM 1657 CB LYS A 100 3.142 17.061 -10.418 1.00 32.40 C ATOM 1658 CG LYS A 100 4.597 17.033 -9.985 1.00 3.23 C ATOM 1659 CD LYS A 100 5.533 17.280 -11.157 1.00 34.14 C ATOM 1660 CE LYS A 100 5.650 18.763 -11.474 1.00 34.13 C ATOM 1661 NZ LYS A 100 6.119 18.997 -12.867 1.00 65.33 N ATOM 0 H LYS A 100 2.246 15.542 -8.322 1.00 24.45 H new ATOM 0 HA LYS A 100 2.338 18.431 -8.969 1.00 4.43 H new ATOM 0 HB2 LYS A 100 2.877 16.089 -10.833 1.00 32.40 H new ATOM 0 HB3 LYS A 100 3.024 17.792 -11.218 1.00 32.40 H new ATOM 0 HG2 LYS A 100 4.764 17.790 -9.219 1.00 3.23 H new ATOM 0 HG3 LYS A 100 4.825 16.067 -9.534 1.00 3.23 H new ATOM 0 HD2 LYS A 100 6.519 16.877 -10.927 1.00 34.14 H new ATOM 0 HD3 LYS A 100 5.167 16.747 -12.035 1.00 34.14 H new ATOM 0 HE2 LYS A 100 4.681 19.242 -11.332 1.00 34.13 H new ATOM 0 HE3 LYS A 100 6.343 19.230 -10.774 1.00 34.13 H new ATOM 0 HZ1 LYS A 100 6.186 20.020 -13.044 1.00 65.33 H new ATOM 0 HZ2 LYS A 100 7.055 18.562 -12.996 1.00 65.33 H new ATOM 0 HZ3 LYS A 100 5.445 18.573 -13.536 1.00 65.33 H new ATOM 1675 N ASP A 101 0.140 18.402 -10.153 1.00 71.32 N ATOM 1676 CA ASP A 101 -1.233 18.416 -10.646 1.00 24.21 C ATOM 1677 C ASP A 101 -1.265 18.610 -12.159 1.00 20.23 C ATOM 1678 O ASP A 101 -1.373 19.734 -12.648 1.00 13.30 O ATOM 1679 CB ASP A 101 -2.032 19.525 -9.960 1.00 20.32 C ATOM 1680 CG ASP A 101 -3.464 19.595 -10.452 1.00 51.41 C ATOM 1681 OD1 ASP A 101 -3.697 20.212 -11.512 1.00 42.44 O ATOM 1682 OD2 ASP A 101 -4.353 19.035 -9.777 1.00 25.54 O ATOM 0 H ASP A 101 0.588 19.318 -10.126 1.00 71.32 H new ATOM 0 HA ASP A 101 -1.687 17.453 -10.412 1.00 24.21 H new ATOM 0 HB2 ASP A 101 -2.029 19.358 -8.883 1.00 20.32 H new ATOM 0 HB3 ASP A 101 -1.543 20.483 -10.136 1.00 20.32 H new ATOM 1687 N ARG A 102 -1.169 17.507 -12.894 1.00 31.22 N ATOM 1688 CA ARG A 102 -1.185 17.556 -14.351 1.00 30.22 C ATOM 1689 C ARG A 102 -2.583 17.880 -14.869 1.00 34.34 C ATOM 1690 O ARG A 102 -3.592 17.608 -14.217 1.00 21.22 O ATOM 1691 CB ARG A 102 -0.710 16.223 -14.932 1.00 72.04 C ATOM 1692 CG ARG A 102 -1.775 15.138 -14.918 1.00 1.41 C ATOM 1693 CD ARG A 102 -1.999 14.596 -13.515 1.00 65.10 C ATOM 1694 NE ARG A 102 -3.058 15.315 -12.813 1.00 2.15 N ATOM 1695 CZ ARG A 102 -3.184 15.330 -11.490 1.00 73.43 C ATOM 1696 NH1 ARG A 102 -2.322 14.668 -10.731 1.00 62.12 N ATOM 1697 NH2 ARG A 102 -4.175 16.008 -10.925 1.00 22.43 N ATOM 0 H ARG A 102 -1.079 16.569 -12.504 1.00 31.22 H new ATOM 0 HA ARG A 102 -0.506 18.347 -14.671 1.00 30.22 H new ATOM 0 HB2 ARG A 102 -0.378 16.381 -15.958 1.00 72.04 H new ATOM 0 HB3 ARG A 102 0.156 15.878 -14.367 1.00 72.04 H new ATOM 0 HG2 ARG A 102 -2.710 15.540 -15.308 1.00 1.41 H new ATOM 0 HG3 ARG A 102 -1.477 14.325 -15.580 1.00 1.41 H new ATOM 0 HD2 ARG A 102 -2.255 13.538 -13.572 1.00 65.10 H new ATOM 0 HD3 ARG A 102 -1.072 14.669 -12.946 1.00 65.10 H new ATOM 0 HE ARG A 102 -3.738 15.834 -13.368 1.00 2.15 H new ATOM 0 HH11 ARG A 102 -1.560 14.145 -11.162 1.00 62.12 H new ATOM 0 HH12 ARG A 102 -2.421 14.681 -9.716 1.00 62.12 H new ATOM 0 HH21 ARG A 102 -4.840 16.518 -11.506 1.00 22.43 H new ATOM 0 HH22 ARG A 102 -4.271 16.019 -9.910 1.00 22.43 H new ATOM 1711 N PRO A 103 -2.647 18.475 -16.069 1.00 10.22 N ATOM 1712 CA PRO A 103 -3.916 18.849 -16.701 1.00 22.03 C ATOM 1713 C PRO A 103 -4.719 17.634 -17.152 1.00 21.21 C ATOM 1714 O PRO A 103 -4.170 16.692 -17.724 1.00 31.11 O ATOM 1715 CB PRO A 103 -3.479 19.680 -17.910 1.00 3.04 C ATOM 1716 CG PRO A 103 -2.103 19.201 -18.221 1.00 61.12 C ATOM 1717 CD PRO A 103 -1.485 18.829 -16.902 1.00 32.24 C ATOM 0 HA PRO A 103 -4.572 19.384 -16.014 1.00 22.03 H new ATOM 0 HB2 PRO A 103 -4.150 19.532 -18.756 1.00 3.04 H new ATOM 0 HB3 PRO A 103 -3.485 20.746 -17.681 1.00 3.04 H new ATOM 0 HG2 PRO A 103 -2.131 18.344 -18.894 1.00 61.12 H new ATOM 0 HG3 PRO A 103 -1.523 19.978 -18.718 1.00 61.12 H new ATOM 0 HD2 PRO A 103 -0.794 17.992 -17.004 1.00 32.24 H new ATOM 0 HD3 PRO A 103 -0.921 19.658 -16.474 1.00 32.24 H new ATOM 1725 N VAL A 104 -6.022 17.661 -16.891 1.00 51.44 N ATOM 1726 CA VAL A 104 -6.901 16.562 -17.272 1.00 53.54 C ATOM 1727 C VAL A 104 -7.080 16.501 -18.785 1.00 72.12 C ATOM 1728 O VAL A 104 -7.260 17.526 -19.443 1.00 3.22 O ATOM 1729 CB VAL A 104 -8.285 16.694 -16.608 1.00 4.21 C ATOM 1730 CG1 VAL A 104 -9.020 17.913 -17.143 1.00 13.32 C ATOM 1731 CG2 VAL A 104 -9.102 15.430 -16.825 1.00 72.14 C ATOM 0 H VAL A 104 -6.492 18.432 -16.417 1.00 51.44 H new ATOM 0 HA VAL A 104 -6.427 15.643 -16.927 1.00 53.54 H new ATOM 0 HB VAL A 104 -8.143 16.828 -15.536 1.00 4.21 H new ATOM 0 HG11 VAL A 104 -9.995 17.990 -16.662 1.00 13.32 H new ATOM 0 HG12 VAL A 104 -8.439 18.810 -16.930 1.00 13.32 H new ATOM 0 HG13 VAL A 104 -9.153 17.814 -18.220 1.00 13.32 H new ATOM 0 HG21 VAL A 104 -10.077 15.541 -16.349 1.00 72.14 H new ATOM 0 HG22 VAL A 104 -9.237 15.263 -17.894 1.00 72.14 H new ATOM 0 HG23 VAL A 104 -8.579 14.579 -16.388 1.00 72.14 H new ATOM 1741 N LYS A 105 -7.031 15.291 -19.332 1.00 45.24 N ATOM 1742 CA LYS A 105 -7.189 15.093 -20.768 1.00 43.43 C ATOM 1743 C LYS A 105 -8.662 14.963 -21.140 1.00 72.44 C ATOM 1744 O LYS A 105 -9.436 14.324 -20.429 1.00 34.42 O ATOM 1745 CB LYS A 105 -6.425 13.846 -21.219 1.00 52.14 C ATOM 1746 CG LYS A 105 -4.944 14.090 -21.450 1.00 1.01 C ATOM 1747 CD LYS A 105 -4.709 15.036 -22.615 1.00 53.25 C ATOM 1748 CE LYS A 105 -4.275 16.413 -22.137 1.00 24.00 C ATOM 1749 NZ LYS A 105 -3.170 16.966 -22.969 1.00 15.30 N ATOM 0 H LYS A 105 -6.883 14.432 -18.802 1.00 45.24 H new ATOM 0 HA LYS A 105 -6.780 15.966 -21.277 1.00 43.43 H new ATOM 0 HB2 LYS A 105 -6.543 13.066 -20.467 1.00 52.14 H new ATOM 0 HB3 LYS A 105 -6.871 13.471 -22.140 1.00 52.14 H new ATOM 0 HG2 LYS A 105 -4.498 14.506 -20.547 1.00 1.01 H new ATOM 0 HG3 LYS A 105 -4.444 13.141 -21.644 1.00 1.01 H new ATOM 0 HD2 LYS A 105 -3.946 14.621 -23.273 1.00 53.25 H new ATOM 0 HD3 LYS A 105 -5.623 15.125 -23.203 1.00 53.25 H new ATOM 0 HE2 LYS A 105 -5.127 17.093 -22.166 1.00 24.00 H new ATOM 0 HE3 LYS A 105 -3.952 16.352 -21.098 1.00 24.00 H new ATOM 0 HZ1 LYS A 105 -2.903 17.905 -22.611 1.00 15.30 H new ATOM 0 HZ2 LYS A 105 -2.348 16.331 -22.921 1.00 15.30 H new ATOM 0 HZ3 LYS A 105 -3.487 17.049 -23.956 1.00 15.30 H new ATOM 1763 N GLU A 106 -9.042 15.571 -22.260 1.00 24.20 N ATOM 1764 CA GLU A 106 -10.423 15.521 -22.726 1.00 25.45 C ATOM 1765 C GLU A 106 -10.744 14.157 -23.330 1.00 64.13 C ATOM 1766 O GLU A 106 -9.932 13.579 -24.053 1.00 43.01 O ATOM 1767 CB GLU A 106 -10.676 16.621 -23.758 1.00 13.11 C ATOM 1768 CG GLU A 106 -9.687 16.614 -24.911 1.00 70.31 C ATOM 1769 CD GLU A 106 -8.596 17.654 -24.750 1.00 43.12 C ATOM 1770 OE1 GLU A 106 -8.928 18.820 -24.451 1.00 11.24 O ATOM 1771 OE2 GLU A 106 -7.410 17.303 -24.924 1.00 31.11 O ATOM 0 H GLU A 106 -8.413 16.104 -22.861 1.00 24.20 H new ATOM 0 HA GLU A 106 -11.076 15.681 -21.868 1.00 25.45 H new ATOM 0 HB2 GLU A 106 -11.685 16.509 -24.155 1.00 13.11 H new ATOM 0 HB3 GLU A 106 -10.635 17.590 -23.261 1.00 13.11 H new ATOM 0 HG2 GLU A 106 -9.233 15.626 -24.989 1.00 70.31 H new ATOM 0 HG3 GLU A 106 -10.221 16.795 -25.844 1.00 70.31 H new ATOM 1778 N VAL A 107 -11.934 13.648 -23.029 1.00 21.34 N ATOM 1779 CA VAL A 107 -12.364 12.353 -23.542 1.00 63.51 C ATOM 1780 C VAL A 107 -13.453 12.513 -24.597 1.00 3.42 C ATOM 1781 O VAL A 107 -14.340 13.358 -24.465 1.00 63.53 O ATOM 1782 CB VAL A 107 -12.889 11.447 -22.412 1.00 64.01 C ATOM 1783 CG1 VAL A 107 -13.872 10.425 -22.960 1.00 74.43 C ATOM 1784 CG2 VAL A 107 -11.733 10.759 -21.701 1.00 50.10 C ATOM 0 H VAL A 107 -12.618 14.113 -22.432 1.00 21.34 H new ATOM 0 HA VAL A 107 -11.489 11.887 -23.995 1.00 63.51 H new ATOM 0 HB VAL A 107 -13.414 12.068 -21.686 1.00 64.01 H new ATOM 0 HG11 VAL A 107 -14.232 9.794 -22.147 1.00 74.43 H new ATOM 0 HG12 VAL A 107 -14.715 10.941 -23.419 1.00 74.43 H new ATOM 0 HG13 VAL A 107 -13.375 9.806 -23.707 1.00 74.43 H new ATOM 0 HG21 VAL A 107 -12.122 10.123 -20.906 1.00 50.10 H new ATOM 0 HG22 VAL A 107 -11.178 10.150 -22.414 1.00 50.10 H new ATOM 0 HG23 VAL A 107 -11.070 11.511 -21.273 1.00 50.10 H new ATOM 1794 N HIS A 108 -13.380 11.698 -25.644 1.00 30.32 N ATOM 1795 CA HIS A 108 -14.361 11.749 -26.722 1.00 60.51 C ATOM 1796 C HIS A 108 -15.075 10.408 -26.871 1.00 11.45 C ATOM 1797 O HIS A 108 -14.763 9.448 -26.168 1.00 33.15 O ATOM 1798 CB HIS A 108 -13.683 12.127 -28.039 1.00 71.03 C ATOM 1799 CG HIS A 108 -12.982 13.450 -27.994 1.00 32.22 C ATOM 1800 ND1 HIS A 108 -13.646 14.648 -27.833 1.00 63.12 N ATOM 1801 CD2 HIS A 108 -11.668 13.759 -28.087 1.00 63.11 C ATOM 1802 CE1 HIS A 108 -12.770 15.637 -27.832 1.00 22.15 C ATOM 1803 NE2 HIS A 108 -11.562 15.124 -27.984 1.00 11.24 N ATOM 0 H HIS A 108 -12.652 10.995 -25.769 1.00 30.32 H new ATOM 0 HA HIS A 108 -15.101 12.509 -26.471 1.00 60.51 H new ATOM 0 HB2 HIS A 108 -12.963 11.352 -28.303 1.00 71.03 H new ATOM 0 HB3 HIS A 108 -14.432 12.149 -28.831 1.00 71.03 H new ATOM 0 HD2 HIS A 108 -10.854 13.062 -28.218 1.00 63.11 H new ATOM 0 HE1 HIS A 108 -13.002 16.686 -27.725 1.00 22.15 H new ATOM 0 HE2 HIS A 108 -10.692 15.656 -28.019 1.00 11.24 H new ATOM 1811 N GLU A 109 -16.034 10.353 -27.789 1.00 75.01 N ATOM 1812 CA GLU A 109 -16.793 9.131 -28.027 1.00 72.24 C ATOM 1813 C GLU A 109 -15.988 8.146 -28.870 1.00 41.03 C ATOM 1814 O GLU A 109 -15.587 8.457 -29.991 1.00 63.22 O ATOM 1815 CB GLU A 109 -18.116 9.453 -28.725 1.00 52.32 C ATOM 1816 CG GLU A 109 -18.926 10.533 -28.026 1.00 64.24 C ATOM 1817 CD GLU A 109 -20.420 10.346 -28.200 1.00 73.04 C ATOM 1818 OE1 GLU A 109 -21.014 9.559 -27.434 1.00 3.35 O ATOM 1819 OE2 GLU A 109 -20.996 10.987 -29.104 1.00 54.40 O ATOM 0 H GLU A 109 -16.304 11.140 -28.380 1.00 75.01 H new ATOM 0 HA GLU A 109 -17.002 8.671 -27.061 1.00 72.24 H new ATOM 0 HB2 GLU A 109 -17.910 9.770 -29.747 1.00 52.32 H new ATOM 0 HB3 GLU A 109 -18.715 8.544 -28.787 1.00 52.32 H new ATOM 0 HG2 GLU A 109 -18.685 10.532 -26.963 1.00 64.24 H new ATOM 0 HG3 GLU A 109 -18.638 11.509 -28.417 1.00 64.24 H new ATOM 1826 N GLU A 110 -15.755 6.958 -28.321 1.00 75.10 N ATOM 1827 CA GLU A 110 -14.997 5.928 -29.022 1.00 1.43 C ATOM 1828 C GLU A 110 -14.720 4.739 -28.107 1.00 2.13 C ATOM 1829 O GLU A 110 -15.280 4.638 -27.015 1.00 10.31 O ATOM 1830 CB GLU A 110 -13.678 6.502 -29.544 1.00 51.02 C ATOM 1831 CG GLU A 110 -13.520 6.390 -31.051 1.00 54.43 C ATOM 1832 CD GLU A 110 -12.162 5.853 -31.458 1.00 2.34 C ATOM 1833 OE1 GLU A 110 -11.923 4.642 -31.274 1.00 31.51 O ATOM 1834 OE2 GLU A 110 -11.337 6.646 -31.960 1.00 33.33 O ATOM 0 H GLU A 110 -16.080 6.685 -27.393 1.00 75.10 H new ATOM 0 HA GLU A 110 -15.595 5.583 -29.866 1.00 1.43 H new ATOM 0 HB2 GLU A 110 -13.609 7.551 -29.257 1.00 51.02 H new ATOM 0 HB3 GLU A 110 -12.850 5.984 -29.061 1.00 51.02 H new ATOM 0 HG2 GLU A 110 -14.298 5.737 -31.446 1.00 54.43 H new ATOM 0 HG3 GLU A 110 -13.668 7.371 -31.502 1.00 54.43 H new ATOM 1841 N TYR A 111 -13.853 3.841 -28.560 1.00 63.12 N ATOM 1842 CA TYR A 111 -13.503 2.657 -27.785 1.00 20.32 C ATOM 1843 C TYR A 111 -11.992 2.548 -27.608 1.00 5.23 C ATOM 1844 O TYR A 111 -11.313 1.865 -28.375 1.00 3.41 O ATOM 1845 CB TYR A 111 -14.039 1.397 -28.468 1.00 13.43 C ATOM 1846 CG TYR A 111 -15.482 1.514 -28.906 1.00 45.25 C ATOM 1847 CD1 TYR A 111 -16.520 1.223 -28.031 1.00 32.33 C ATOM 1848 CD2 TYR A 111 -15.806 1.915 -30.197 1.00 23.23 C ATOM 1849 CE1 TYR A 111 -17.839 1.327 -28.427 1.00 55.22 C ATOM 1850 CE2 TYR A 111 -17.122 2.024 -30.601 1.00 61.44 C ATOM 1851 CZ TYR A 111 -18.135 1.728 -29.713 1.00 52.53 C ATOM 1852 OH TYR A 111 -19.448 1.834 -30.113 1.00 43.11 O ATOM 0 H TYR A 111 -13.379 3.910 -29.461 1.00 63.12 H new ATOM 0 HA TYR A 111 -13.960 2.751 -26.800 1.00 20.32 H new ATOM 0 HB2 TYR A 111 -13.421 1.174 -29.338 1.00 13.43 H new ATOM 0 HB3 TYR A 111 -13.943 0.554 -27.784 1.00 13.43 H new ATOM 0 HD1 TYR A 111 -16.292 0.910 -27.023 1.00 32.33 H new ATOM 0 HD2 TYR A 111 -15.015 2.145 -30.896 1.00 23.23 H new ATOM 0 HE1 TYR A 111 -18.634 1.096 -27.734 1.00 55.22 H new ATOM 0 HE2 TYR A 111 -17.357 2.339 -31.607 1.00 61.44 H new ATOM 0 HH TYR A 111 -19.483 2.129 -31.047 1.00 43.11 H new ATOM 1862 N ASP A 112 -11.472 3.226 -26.591 1.00 3.35 N ATOM 1863 CA ASP A 112 -10.041 3.206 -26.310 1.00 2.03 C ATOM 1864 C ASP A 112 -9.775 2.768 -24.873 1.00 32.21 C ATOM 1865 O ASP A 112 -8.998 1.844 -24.628 1.00 34.22 O ATOM 1866 CB ASP A 112 -9.432 4.587 -26.556 1.00 5.22 C ATOM 1867 CG ASP A 112 -7.941 4.523 -26.825 1.00 21.24 C ATOM 1868 OD1 ASP A 112 -7.554 4.053 -27.915 1.00 71.43 O ATOM 1869 OD2 ASP A 112 -7.161 4.943 -25.945 1.00 11.41 O ATOM 0 H ASP A 112 -12.020 3.797 -25.947 1.00 3.35 H new ATOM 0 HA ASP A 112 -9.574 2.486 -26.982 1.00 2.03 H new ATOM 0 HB2 ASP A 112 -9.931 5.055 -27.404 1.00 5.22 H new ATOM 0 HB3 ASP A 112 -9.615 5.221 -25.689 1.00 5.22 H new ATOM 1874 N LEU A 113 -10.424 3.437 -23.926 1.00 42.13 N ATOM 1875 CA LEU A 113 -10.257 3.118 -22.513 1.00 32.34 C ATOM 1876 C LEU A 113 -10.630 1.665 -22.235 1.00 30.00 C ATOM 1877 O LEU A 113 -10.909 0.899 -23.157 1.00 34.41 O ATOM 1878 CB LEU A 113 -11.115 4.049 -21.655 1.00 11.34 C ATOM 1879 CG LEU A 113 -11.151 5.516 -22.086 1.00 74.33 C ATOM 1880 CD1 LEU A 113 -11.915 6.352 -21.071 1.00 45.31 C ATOM 1881 CD2 LEU A 113 -9.739 6.053 -22.269 1.00 75.13 C ATOM 0 H LEU A 113 -11.071 4.204 -24.112 1.00 42.13 H new ATOM 0 HA LEU A 113 -9.207 3.260 -22.255 1.00 32.34 H new ATOM 0 HB2 LEU A 113 -12.136 3.667 -21.650 1.00 11.34 H new ATOM 0 HB3 LEU A 113 -10.752 4.002 -20.628 1.00 11.34 H new ATOM 0 HG LEU A 113 -11.669 5.581 -23.043 1.00 74.33 H new ATOM 0 HD11 LEU A 113 -11.930 7.393 -21.394 1.00 45.31 H new ATOM 0 HD12 LEU A 113 -12.937 5.982 -20.991 1.00 45.31 H new ATOM 0 HD13 LEU A 113 -11.426 6.281 -20.099 1.00 45.31 H new ATOM 0 HD21 LEU A 113 -9.784 7.098 -22.576 1.00 75.13 H new ATOM 0 HD22 LEU A 113 -9.195 5.974 -21.328 1.00 75.13 H new ATOM 0 HD23 LEU A 113 -9.225 5.472 -23.035 1.00 75.13 H new ATOM 1893 N TRP A 114 -10.634 1.294 -20.960 1.00 10.33 N ATOM 1894 CA TRP A 114 -10.975 -0.066 -20.561 1.00 30.54 C ATOM 1895 C TRP A 114 -12.410 -0.405 -20.950 1.00 42.32 C ATOM 1896 O TRP A 114 -12.754 -1.572 -21.130 1.00 61.23 O ATOM 1897 CB TRP A 114 -10.789 -0.239 -19.052 1.00 62.33 C ATOM 1898 CG TRP A 114 -9.354 -0.383 -18.644 1.00 0.14 C ATOM 1899 CD1 TRP A 114 -8.705 0.321 -17.670 1.00 2.11 C ATOM 1900 CD2 TRP A 114 -8.391 -1.285 -19.199 1.00 21.11 C ATOM 1901 NE1 TRP A 114 -7.396 -0.089 -17.586 1.00 71.15 N ATOM 1902 CE2 TRP A 114 -7.179 -1.074 -18.513 1.00 64.21 C ATOM 1903 CE3 TRP A 114 -8.435 -2.252 -20.207 1.00 0.11 C ATOM 1904 CZ2 TRP A 114 -6.023 -1.794 -18.806 1.00 34.14 C ATOM 1905 CZ3 TRP A 114 -7.287 -2.965 -20.496 1.00 74.41 C ATOM 1906 CH2 TRP A 114 -6.095 -2.734 -19.797 1.00 71.33 C ATOM 0 H TRP A 114 -10.405 1.916 -20.185 1.00 10.33 H new ATOM 0 HA TRP A 114 -10.306 -0.749 -21.084 1.00 30.54 H new ATOM 0 HB2 TRP A 114 -11.221 0.620 -18.539 1.00 62.33 H new ATOM 0 HB3 TRP A 114 -11.343 -1.118 -18.723 1.00 62.33 H new ATOM 0 HD1 TRP A 114 -9.155 1.087 -17.056 1.00 2.11 H new ATOM 0 HE1 TRP A 114 -6.699 0.280 -16.939 1.00 71.15 H new ATOM 0 HE3 TRP A 114 -9.350 -2.439 -20.750 1.00 0.11 H new ATOM 0 HZ2 TRP A 114 -5.103 -1.616 -18.270 1.00 34.14 H new ATOM 0 HZ3 TRP A 114 -7.309 -3.713 -21.274 1.00 74.41 H new ATOM 0 HH2 TRP A 114 -5.216 -3.310 -20.046 1.00 71.33 H new ATOM 1917 N GLU A 115 -13.242 0.624 -21.079 1.00 1.13 N ATOM 1918 CA GLU A 115 -14.640 0.434 -21.447 1.00 20.54 C ATOM 1919 C GLU A 115 -15.210 -0.819 -20.788 1.00 30.41 C ATOM 1920 O GLU A 115 -15.501 -1.809 -21.460 1.00 22.32 O ATOM 1921 CB GLU A 115 -14.781 0.333 -22.967 1.00 32.01 C ATOM 1922 CG GLU A 115 -13.831 -0.669 -23.601 1.00 53.15 C ATOM 1923 CD GLU A 115 -14.045 -0.809 -25.096 1.00 65.12 C ATOM 1924 OE1 GLU A 115 -15.215 -0.815 -25.531 1.00 61.12 O ATOM 1925 OE2 GLU A 115 -13.040 -0.913 -25.831 1.00 1.50 O ATOM 0 H GLU A 115 -12.972 1.597 -20.934 1.00 1.13 H new ATOM 0 HA GLU A 115 -15.203 1.298 -21.094 1.00 20.54 H new ATOM 0 HB2 GLU A 115 -15.806 0.054 -23.211 1.00 32.01 H new ATOM 0 HB3 GLU A 115 -14.606 1.315 -23.406 1.00 32.01 H new ATOM 0 HG2 GLU A 115 -12.803 -0.360 -23.412 1.00 53.15 H new ATOM 0 HG3 GLU A 115 -13.964 -1.641 -23.126 1.00 53.15 H new ATOM 1932 N ASP A 116 -15.366 -0.769 -19.470 1.00 12.53 N ATOM 1933 CA ASP A 116 -15.902 -1.898 -18.719 1.00 64.30 C ATOM 1934 C ASP A 116 -15.953 -1.584 -17.227 1.00 63.21 C ATOM 1935 O ASP A 116 -17.013 -1.595 -16.601 1.00 50.25 O ATOM 1936 CB ASP A 116 -15.053 -3.147 -18.961 1.00 64.31 C ATOM 1937 CG ASP A 116 -14.979 -4.043 -17.740 1.00 5.41 C ATOM 1938 OD1 ASP A 116 -16.045 -4.366 -17.175 1.00 63.25 O ATOM 1939 OD2 ASP A 116 -13.854 -4.420 -17.349 1.00 74.42 O ATOM 0 H ASP A 116 -15.129 0.042 -18.899 1.00 12.53 H new ATOM 0 HA ASP A 116 -16.918 -2.085 -19.067 1.00 64.30 H new ATOM 0 HB2 ASP A 116 -15.470 -3.710 -19.796 1.00 64.31 H new ATOM 0 HB3 ASP A 116 -14.046 -2.847 -19.250 1.00 64.31 H new ATOM 1944 N PRO A 117 -14.780 -1.299 -16.642 1.00 11.33 N ATOM 1945 CA PRO A 117 -14.665 -0.977 -15.216 1.00 43.22 C ATOM 1946 C PRO A 117 -15.276 0.378 -14.877 1.00 2.35 C ATOM 1947 O PRO A 117 -16.094 0.489 -13.963 1.00 1.11 O ATOM 1948 CB PRO A 117 -13.153 -0.956 -14.979 1.00 23.25 C ATOM 1949 CG PRO A 117 -12.564 -0.639 -16.310 1.00 32.11 C ATOM 1950 CD PRO A 117 -13.477 -1.268 -17.326 1.00 42.33 C ATOM 0 HA PRO A 117 -15.199 -1.693 -14.592 1.00 43.22 H new ATOM 0 HB2 PRO A 117 -12.879 -0.206 -14.237 1.00 23.25 H new ATOM 0 HB3 PRO A 117 -12.797 -1.917 -14.608 1.00 23.25 H new ATOM 0 HG2 PRO A 117 -12.496 0.438 -16.460 1.00 32.11 H new ATOM 0 HG3 PRO A 117 -11.553 -1.037 -16.394 1.00 32.11 H new ATOM 0 HD2 PRO A 117 -13.519 -0.683 -18.245 1.00 42.33 H new ATOM 0 HD3 PRO A 117 -13.144 -2.269 -17.601 1.00 42.33 H new ATOM 1958 N ILE A 118 -14.874 1.406 -15.617 1.00 72.43 N ATOM 1959 CA ILE A 118 -15.384 2.753 -15.395 1.00 32.22 C ATOM 1960 C ILE A 118 -16.771 2.923 -16.005 1.00 15.14 C ATOM 1961 O ILE A 118 -17.486 3.875 -15.690 1.00 32.31 O ATOM 1962 CB ILE A 118 -14.441 3.817 -15.987 1.00 72.31 C ATOM 1963 CG1 ILE A 118 -14.671 3.951 -17.494 1.00 1.22 C ATOM 1964 CG2 ILE A 118 -12.991 3.460 -15.697 1.00 31.14 C ATOM 1965 CD1 ILE A 118 -14.276 2.719 -18.278 1.00 3.34 C ATOM 0 H ILE A 118 -14.196 1.331 -16.376 1.00 72.43 H new ATOM 0 HA ILE A 118 -15.445 2.893 -14.316 1.00 32.22 H new ATOM 0 HB ILE A 118 -14.659 4.776 -15.518 1.00 72.31 H new ATOM 0 HG12 ILE A 118 -15.724 4.164 -17.675 1.00 1.22 H new ATOM 0 HG13 ILE A 118 -14.104 4.805 -17.865 1.00 1.22 H new ATOM 0 HG21 ILE A 118 -12.337 4.221 -16.122 1.00 31.14 H new ATOM 0 HG22 ILE A 118 -12.837 3.410 -14.619 1.00 31.14 H new ATOM 0 HG23 ILE A 118 -12.758 2.493 -16.142 1.00 31.14 H new ATOM 0 HD11 ILE A 118 -14.467 2.886 -19.338 1.00 3.34 H new ATOM 0 HD12 ILE A 118 -13.216 2.516 -18.127 1.00 3.34 H new ATOM 0 HD13 ILE A 118 -14.861 1.866 -17.934 1.00 3.34 H new ATOM 1977 N TRP A 119 -17.146 1.994 -16.877 1.00 10.33 N ATOM 1978 CA TRP A 119 -18.449 2.041 -17.530 1.00 34.43 C ATOM 1979 C TRP A 119 -19.571 1.800 -16.525 1.00 24.50 C ATOM 1980 O TRP A 119 -20.608 2.460 -16.570 1.00 70.21 O ATOM 1981 CB TRP A 119 -18.519 1.001 -18.649 1.00 70.15 C ATOM 1982 CG TRP A 119 -19.666 1.216 -19.590 1.00 12.34 C ATOM 1983 CD1 TRP A 119 -20.836 0.513 -19.630 1.00 21.40 C ATOM 1984 CD2 TRP A 119 -19.752 2.201 -20.626 1.00 21.33 C ATOM 1985 NE1 TRP A 119 -21.644 1.000 -20.629 1.00 3.20 N ATOM 1986 CE2 TRP A 119 -21.002 2.037 -21.254 1.00 30.51 C ATOM 1987 CE3 TRP A 119 -18.896 3.206 -21.083 1.00 25.05 C ATOM 1988 CZ2 TRP A 119 -21.413 2.840 -22.314 1.00 70.23 C ATOM 1989 CZ3 TRP A 119 -19.305 4.002 -22.135 1.00 42.13 C ATOM 1990 CH2 TRP A 119 -20.554 3.816 -22.741 1.00 55.12 C ATOM 0 H TRP A 119 -16.567 1.200 -17.148 1.00 10.33 H new ATOM 0 HA TRP A 119 -18.577 3.035 -17.958 1.00 34.43 H new ATOM 0 HB2 TRP A 119 -17.587 1.022 -19.213 1.00 70.15 H new ATOM 0 HB3 TRP A 119 -18.602 0.008 -18.207 1.00 70.15 H new ATOM 0 HD1 TRP A 119 -21.089 -0.306 -18.973 1.00 21.40 H new ATOM 0 HE1 TRP A 119 -22.571 0.647 -20.867 1.00 3.20 H new ATOM 0 HE3 TRP A 119 -17.931 3.358 -20.622 1.00 25.05 H new ATOM 0 HZ2 TRP A 119 -22.376 2.698 -22.783 1.00 70.23 H new ATOM 0 HZ3 TRP A 119 -18.650 4.781 -22.497 1.00 42.13 H new ATOM 0 HH2 TRP A 119 -20.845 4.455 -23.561 1.00 55.12 H new ATOM 2001 N GLN A 120 -19.354 0.851 -15.620 1.00 33.42 N ATOM 2002 CA GLN A 120 -20.348 0.523 -14.604 1.00 53.35 C ATOM 2003 C GLN A 120 -20.009 1.191 -13.276 1.00 34.02 C ATOM 2004 O GLN A 120 -20.714 2.095 -12.826 1.00 73.13 O ATOM 2005 CB GLN A 120 -20.439 -0.992 -14.419 1.00 24.42 C ATOM 2006 CG GLN A 120 -21.686 -1.441 -13.675 1.00 52.10 C ATOM 2007 CD GLN A 120 -21.876 -2.945 -13.707 1.00 4.31 C ATOM 2008 OE1 GLN A 120 -21.091 -3.668 -14.322 1.00 14.11 O ATOM 2009 NE2 GLN A 120 -22.920 -3.424 -13.042 1.00 74.23 N ATOM 0 H GLN A 120 -18.500 0.296 -15.569 1.00 33.42 H new ATOM 0 HA GLN A 120 -21.314 0.898 -14.942 1.00 53.35 H new ATOM 0 HB2 GLN A 120 -20.418 -1.471 -15.398 1.00 24.42 H new ATOM 0 HB3 GLN A 120 -19.559 -1.337 -13.877 1.00 24.42 H new ATOM 0 HG2 GLN A 120 -21.626 -1.108 -12.639 1.00 52.10 H new ATOM 0 HG3 GLN A 120 -22.560 -0.959 -14.114 1.00 52.10 H new ATOM 0 HE21 GLN A 120 -23.544 -2.788 -12.546 1.00 74.23 H new ATOM 0 HE22 GLN A 120 -23.098 -4.428 -13.027 1.00 74.23 H new ATOM 2018 N TYR A 121 -18.927 0.740 -12.652 1.00 61.11 N ATOM 2019 CA TYR A 121 -18.496 1.292 -11.373 1.00 71.21 C ATOM 2020 C TYR A 121 -16.989 1.136 -11.192 1.00 53.03 C ATOM 2021 O TYR A 121 -16.437 0.055 -11.398 1.00 21.23 O ATOM 2022 CB TYR A 121 -19.233 0.604 -10.223 1.00 22.53 C ATOM 2023 CG TYR A 121 -18.816 -0.835 -10.011 1.00 55.44 C ATOM 2024 CD1 TYR A 121 -19.194 -1.826 -10.909 1.00 24.44 C ATOM 2025 CD2 TYR A 121 -18.047 -1.202 -8.914 1.00 51.14 C ATOM 2026 CE1 TYR A 121 -18.816 -3.142 -10.719 1.00 52.23 C ATOM 2027 CE2 TYR A 121 -17.664 -2.514 -8.718 1.00 21.40 C ATOM 2028 CZ TYR A 121 -18.051 -3.481 -9.623 1.00 10.31 C ATOM 2029 OH TYR A 121 -17.673 -4.790 -9.430 1.00 44.40 O ATOM 0 H TYR A 121 -18.332 -0.007 -13.011 1.00 61.11 H new ATOM 0 HA TYR A 121 -18.736 2.355 -11.366 1.00 71.21 H new ATOM 0 HB2 TYR A 121 -19.058 1.163 -9.304 1.00 22.53 H new ATOM 0 HB3 TYR A 121 -20.305 0.638 -10.418 1.00 22.53 H new ATOM 0 HD1 TYR A 121 -19.793 -1.564 -11.769 1.00 24.44 H new ATOM 0 HD2 TYR A 121 -17.744 -0.448 -8.202 1.00 51.14 H new ATOM 0 HE1 TYR A 121 -19.118 -3.901 -11.425 1.00 52.23 H new ATOM 0 HE2 TYR A 121 -17.064 -2.782 -7.861 1.00 21.40 H new ATOM 0 HH TYR A 121 -17.137 -4.859 -8.612 1.00 44.40 H new ATOM 2039 N ILE A 122 -16.331 2.224 -10.806 1.00 61.42 N ATOM 2040 CA ILE A 122 -14.889 2.208 -10.596 1.00 4.53 C ATOM 2041 C ILE A 122 -14.162 1.637 -11.808 1.00 71.05 C ATOM 2042 O ILE A 122 -13.825 0.453 -11.843 1.00 11.40 O ATOM 2043 CB ILE A 122 -14.510 1.386 -9.350 1.00 31.21 C ATOM 2044 CG1 ILE A 122 -15.182 1.968 -8.104 1.00 62.43 C ATOM 2045 CG2 ILE A 122 -12.999 1.352 -9.177 1.00 10.04 C ATOM 2046 CD1 ILE A 122 -15.634 0.917 -7.115 1.00 24.52 C ATOM 0 H ILE A 122 -16.773 3.127 -10.633 1.00 61.42 H new ATOM 0 HA ILE A 122 -14.582 3.243 -10.446 1.00 4.53 H new ATOM 0 HB ILE A 122 -14.863 0.364 -9.486 1.00 31.21 H new ATOM 0 HG12 ILE A 122 -14.487 2.646 -7.609 1.00 62.43 H new ATOM 0 HG13 ILE A 122 -16.043 2.562 -8.410 1.00 62.43 H new ATOM 0 HG21 ILE A 122 -12.747 0.767 -8.292 1.00 10.04 H new ATOM 0 HG22 ILE A 122 -12.542 0.896 -10.055 1.00 10.04 H new ATOM 0 HG23 ILE A 122 -12.623 2.368 -9.059 1.00 10.04 H new ATOM 0 HD11 ILE A 122 -16.101 1.401 -6.257 1.00 24.52 H new ATOM 0 HD12 ILE A 122 -16.354 0.253 -7.593 1.00 24.52 H new ATOM 0 HD13 ILE A 122 -14.773 0.338 -6.780 1.00 24.52 H new TER 2058 ILE A 122