USER MOD reduce.3.24.130724 H: found=0, std=0, add=1262, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1255 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 153 HIS : no HE2:sc= -5.43! C(o=-4.2!,f=-9.4!) USER MOD Set 1.2: A 155 TYR OH : rot 164:sc= 1.27 USER MOD Set 2.1: A 138 LYS NZ :NH3+ -119:sc=-0.000178 (180deg=-0.483) USER MOD Set 2.2: A 141 SER OG : rot 13:sc= 0.781 USER MOD Single : A 1 THR N :NH3+ 151:sc= 0.272 (180deg=0.0143) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.142 USER MOD Single : A 7 GLN : amide:sc= -0.0494 X(o=-0.049,f=-0.1) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -2.31 K(o=-2.3,f=-5.3!) USER MOD Single : A 22 HIS : no HD1:sc= -1.3 K(o=-1.3,f=-0.47) USER MOD Single : A 28 HIS : no HD1:sc= -0.352 X(o=-0.35,f=-0.18) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.157 K(o=-0.16,f=-1.3) USER MOD Single : A 34 THR OG1 : rot -81:sc= 1.24 USER MOD Single : A 37 LYS NZ :NH3+ -117:sc= 0.0364 (180deg=0) USER MOD Single : A 39 MET CE :methyl -110:sc= -4.81! (180deg=-8.74!) USER MOD Single : A 45 THR OG1 : rot -140:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.035 USER MOD Single : A 48 SER OG : rot 98:sc= 0.085 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 1.44 K(o=1.4,f=-5.3!) USER MOD Single : A 63 THR OG1 : rot -170:sc= -0.297 USER MOD Single : A 64 HIS : no HD1:sc= -1.37 K(o=-1.4,f=-0.42) USER MOD Single : A 65 GLN : amide:sc= -0.403 K(o=-0.4,f=-1.4!) USER MOD Single : A 68 TYR OH : rot 30:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.729 K(o=-0.73,f=-4.7!) USER MOD Single : A 71 GLN : amide:sc= -1.35 X(o=-1.3,f=-1.7) USER MOD Single : A 77 HIS : no HE2:sc= -2.03 K(o=-2,f=-2.6) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 HIS : no HD1:sc= -0.298 X(o=-0.3,f=-0.012) USER MOD Single : A 92 GLN : amide:sc= -1.45 K(o=-1.5,f=-9.2!) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 104 THR OG1 : rot 87:sc= 1.21 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -117:sc= 0.682 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -156:sc= 0 (180deg=-0.949) USER MOD Single : A 132 ASN : amide:sc= -0.882 K(o=-0.88,f=-5.1!) USER MOD Single : A 137 THR OG1 : rot 80:sc= -1.82 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -0.0288 K(o=-0.029,f=-0.83) USER MOD Single : A 152 THR OG1 : rot 180:sc= -0.0415 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.223 USER MOD Single : A 159 GLN : amide:sc=-0.00907 K(o=-0.0091,f=-0.69) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 132.871 -7.939 -6.581 1.00 0.00 N ATOM 2 CA THR A 1 131.651 -7.084 -6.641 1.00 0.00 C ATOM 3 C THR A 1 130.655 -7.542 -5.574 1.00 0.00 C ATOM 4 O THR A 1 130.048 -8.590 -5.690 1.00 0.00 O ATOM 5 CB THR A 1 131.010 -7.208 -8.025 1.00 0.00 C ATOM 6 OG1 THR A 1 132.026 -7.374 -9.004 1.00 0.00 O ATOM 7 CG2 THR A 1 130.204 -5.945 -8.331 1.00 0.00 C ATOM 0 H1 THR A 1 133.304 -7.993 -7.525 1.00 0.00 H new ATOM 0 H2 THR A 1 133.551 -7.527 -5.911 1.00 0.00 H new ATOM 0 H3 THR A 1 132.610 -8.895 -6.265 1.00 0.00 H new ATOM 0 HA THR A 1 131.925 -6.045 -6.459 1.00 0.00 H new ATOM 0 HB THR A 1 130.346 -8.072 -8.042 1.00 0.00 H new ATOM 0 HG1 THR A 1 131.616 -7.455 -9.890 1.00 0.00 H new ATOM 0 HG21 THR A 1 129.748 -6.034 -9.317 1.00 0.00 H new ATOM 0 HG22 THR A 1 129.424 -5.821 -7.580 1.00 0.00 H new ATOM 0 HG23 THR A 1 130.865 -5.079 -8.314 1.00 0.00 H new ATOM 17 N ALA A 2 130.487 -6.762 -4.535 1.00 0.00 N ATOM 18 CA ALA A 2 129.531 -7.143 -3.454 1.00 0.00 C ATOM 19 C ALA A 2 128.889 -5.882 -2.871 1.00 0.00 C ATOM 20 O ALA A 2 129.564 -4.918 -2.563 1.00 0.00 O ATOM 21 CB ALA A 2 130.282 -7.889 -2.350 1.00 0.00 C ATOM 0 H ALA A 2 130.972 -5.877 -4.390 1.00 0.00 H new ATOM 0 HA ALA A 2 128.755 -7.788 -3.867 1.00 0.00 H new ATOM 0 HB1 ALA A 2 129.585 -8.168 -1.560 1.00 0.00 H new ATOM 0 HB2 ALA A 2 130.739 -8.788 -2.764 1.00 0.00 H new ATOM 0 HB3 ALA A 2 131.058 -7.244 -1.938 1.00 0.00 H new ATOM 27 N PHE A 3 127.589 -5.884 -2.720 1.00 0.00 N ATOM 28 CA PHE A 3 126.889 -4.691 -2.158 1.00 0.00 C ATOM 29 C PHE A 3 127.091 -4.648 -0.642 1.00 0.00 C ATOM 30 O PHE A 3 127.151 -5.672 0.013 1.00 0.00 O ATOM 31 CB PHE A 3 125.393 -4.787 -2.471 1.00 0.00 C ATOM 32 CG PHE A 3 125.088 -4.109 -3.791 1.00 0.00 C ATOM 33 CD1 PHE A 3 125.876 -4.366 -4.922 1.00 0.00 C ATOM 34 CD2 PHE A 3 124.006 -3.222 -3.882 1.00 0.00 C ATOM 35 CE1 PHE A 3 125.584 -3.738 -6.139 1.00 0.00 C ATOM 36 CE2 PHE A 3 123.714 -2.596 -5.098 1.00 0.00 C ATOM 37 CZ PHE A 3 124.502 -2.852 -6.226 1.00 0.00 C ATOM 0 H PHE A 3 126.980 -6.665 -2.963 1.00 0.00 H new ATOM 0 HA PHE A 3 127.298 -3.784 -2.604 1.00 0.00 H new ATOM 0 HB2 PHE A 3 125.090 -5.833 -2.513 1.00 0.00 H new ATOM 0 HB3 PHE A 3 124.817 -4.320 -1.673 1.00 0.00 H new ATOM 0 HD1 PHE A 3 126.710 -5.049 -4.854 1.00 0.00 H new ATOM 0 HD2 PHE A 3 123.398 -3.022 -3.012 1.00 0.00 H new ATOM 0 HE1 PHE A 3 126.192 -3.936 -7.009 1.00 0.00 H new ATOM 0 HE2 PHE A 3 122.879 -1.914 -5.167 1.00 0.00 H new ATOM 0 HZ PHE A 3 124.276 -2.366 -7.164 1.00 0.00 H new ATOM 47 N LEU A 4 127.197 -3.469 -0.082 1.00 0.00 N ATOM 48 CA LEU A 4 127.395 -3.350 1.394 1.00 0.00 C ATOM 49 C LEU A 4 126.815 -2.019 1.879 1.00 0.00 C ATOM 50 O LEU A 4 127.316 -0.959 1.552 1.00 0.00 O ATOM 51 CB LEU A 4 128.893 -3.402 1.707 1.00 0.00 C ATOM 52 CG LEU A 4 129.106 -3.373 3.223 1.00 0.00 C ATOM 53 CD1 LEU A 4 128.737 -4.732 3.820 1.00 0.00 C ATOM 54 CD2 LEU A 4 130.574 -3.066 3.525 1.00 0.00 C ATOM 0 H LEU A 4 127.155 -2.583 -0.585 1.00 0.00 H new ATOM 0 HA LEU A 4 126.888 -4.171 1.901 1.00 0.00 H new ATOM 0 HB2 LEU A 4 129.331 -4.307 1.286 1.00 0.00 H new ATOM 0 HB3 LEU A 4 129.401 -2.557 1.243 1.00 0.00 H new ATOM 0 HG LEU A 4 128.474 -2.601 3.662 1.00 0.00 H new ATOM 0 HD11 LEU A 4 128.889 -4.709 4.899 1.00 0.00 H new ATOM 0 HD12 LEU A 4 127.691 -4.952 3.606 1.00 0.00 H new ATOM 0 HD13 LEU A 4 129.367 -5.505 3.381 1.00 0.00 H new ATOM 0 HD21 LEU A 4 130.727 -3.045 4.604 1.00 0.00 H new ATOM 0 HD22 LEU A 4 131.205 -3.837 3.084 1.00 0.00 H new ATOM 0 HD23 LEU A 4 130.837 -2.096 3.102 1.00 0.00 H new ATOM 66 N TRP A 5 125.765 -2.067 2.662 1.00 0.00 N ATOM 67 CA TRP A 5 125.152 -0.807 3.174 1.00 0.00 C ATOM 68 C TRP A 5 124.424 -1.084 4.498 1.00 0.00 C ATOM 69 O TRP A 5 124.242 -2.223 4.889 1.00 0.00 O ATOM 70 CB TRP A 5 124.178 -0.241 2.122 1.00 0.00 C ATOM 71 CG TRP A 5 122.971 -1.123 1.973 1.00 0.00 C ATOM 72 CD1 TRP A 5 121.720 -0.790 2.370 1.00 0.00 C ATOM 73 CD2 TRP A 5 122.874 -2.462 1.401 1.00 0.00 C ATOM 74 NE1 TRP A 5 120.864 -1.835 2.080 1.00 0.00 N ATOM 75 CE2 TRP A 5 121.526 -2.888 1.482 1.00 0.00 C ATOM 76 CE3 TRP A 5 123.811 -3.340 0.825 1.00 0.00 C ATOM 77 CZ2 TRP A 5 121.123 -4.138 1.011 1.00 0.00 C ATOM 78 CZ3 TRP A 5 123.407 -4.600 0.350 1.00 0.00 C ATOM 79 CH2 TRP A 5 122.066 -4.996 0.444 1.00 0.00 C ATOM 0 H TRP A 5 125.307 -2.926 2.967 1.00 0.00 H new ATOM 0 HA TRP A 5 125.932 -0.068 3.358 1.00 0.00 H new ATOM 0 HB2 TRP A 5 123.866 0.762 2.413 1.00 0.00 H new ATOM 0 HB3 TRP A 5 124.687 -0.150 1.162 1.00 0.00 H new ATOM 0 HD1 TRP A 5 121.437 0.142 2.838 1.00 0.00 H new ATOM 0 HE1 TRP A 5 119.864 -1.829 2.283 1.00 0.00 H new ATOM 0 HE3 TRP A 5 124.847 -3.044 0.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 120.089 -4.439 1.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 124.134 -5.266 -0.090 1.00 0.00 H new ATOM 0 HH2 TRP A 5 121.762 -5.965 0.077 1.00 0.00 H new ATOM 90 N ALA A 6 124.008 -0.049 5.183 1.00 0.00 N ATOM 91 CA ALA A 6 123.290 -0.239 6.477 1.00 0.00 C ATOM 92 C ALA A 6 121.925 0.447 6.401 1.00 0.00 C ATOM 93 O ALA A 6 121.804 1.548 5.898 1.00 0.00 O ATOM 94 CB ALA A 6 124.111 0.378 7.611 1.00 0.00 C ATOM 0 H ALA A 6 124.136 0.922 4.899 1.00 0.00 H new ATOM 0 HA ALA A 6 123.154 -1.303 6.668 1.00 0.00 H new ATOM 0 HB1 ALA A 6 123.587 0.240 8.557 1.00 0.00 H new ATOM 0 HB2 ALA A 6 125.085 -0.108 7.661 1.00 0.00 H new ATOM 0 HB3 ALA A 6 124.247 1.443 7.424 1.00 0.00 H new ATOM 100 N GLN A 7 120.896 -0.197 6.895 1.00 0.00 N ATOM 101 CA GLN A 7 119.535 0.415 6.850 1.00 0.00 C ATOM 102 C GLN A 7 118.750 0.021 8.103 1.00 0.00 C ATOM 103 O GLN A 7 119.200 -0.775 8.906 1.00 0.00 O ATOM 104 CB GLN A 7 118.794 -0.082 5.607 1.00 0.00 C ATOM 105 CG GLN A 7 118.790 -1.612 5.590 1.00 0.00 C ATOM 106 CD GLN A 7 117.507 -2.113 4.924 1.00 0.00 C ATOM 107 OE1 GLN A 7 116.874 -3.027 5.411 1.00 0.00 O ATOM 108 NE2 GLN A 7 117.096 -1.547 3.822 1.00 0.00 N ATOM 0 H GLN A 7 120.941 -1.120 7.327 1.00 0.00 H new ATOM 0 HA GLN A 7 119.629 1.500 6.810 1.00 0.00 H new ATOM 0 HB2 GLN A 7 117.771 0.295 5.606 1.00 0.00 H new ATOM 0 HB3 GLN A 7 119.275 0.301 4.707 1.00 0.00 H new ATOM 0 HG2 GLN A 7 119.661 -1.982 5.049 1.00 0.00 H new ATOM 0 HG3 GLN A 7 118.858 -1.998 6.607 1.00 0.00 H new ATOM 0 HE21 GLN A 7 117.629 -0.779 3.414 1.00 0.00 H new ATOM 0 HE22 GLN A 7 116.242 -1.873 3.369 1.00 0.00 H new ATOM 117 N ASP A 8 117.576 0.576 8.272 1.00 0.00 N ATOM 118 CA ASP A 8 116.747 0.243 9.466 1.00 0.00 C ATOM 119 C ASP A 8 115.462 -0.460 9.014 1.00 0.00 C ATOM 120 O ASP A 8 115.330 -0.846 7.868 1.00 0.00 O ATOM 121 CB ASP A 8 116.398 1.535 10.217 1.00 0.00 C ATOM 122 CG ASP A 8 115.690 2.507 9.271 1.00 0.00 C ATOM 123 OD1 ASP A 8 116.254 2.808 8.231 1.00 0.00 O ATOM 124 OD2 ASP A 8 114.597 2.935 9.602 1.00 0.00 O ATOM 0 H ASP A 8 117.156 1.248 7.630 1.00 0.00 H new ATOM 0 HA ASP A 8 117.304 -0.420 10.128 1.00 0.00 H new ATOM 0 HB2 ASP A 8 115.757 1.310 11.069 1.00 0.00 H new ATOM 0 HB3 ASP A 8 117.304 1.993 10.613 1.00 0.00 H new ATOM 129 N ARG A 9 114.518 -0.633 9.907 1.00 0.00 N ATOM 130 CA ARG A 9 113.240 -1.316 9.539 1.00 0.00 C ATOM 131 C ARG A 9 112.555 -0.567 8.388 1.00 0.00 C ATOM 132 O ARG A 9 111.949 -1.169 7.522 1.00 0.00 O ATOM 133 CB ARG A 9 112.310 -1.345 10.757 1.00 0.00 C ATOM 134 CG ARG A 9 112.061 0.081 11.256 1.00 0.00 C ATOM 135 CD ARG A 9 111.700 0.048 12.742 1.00 0.00 C ATOM 136 NE ARG A 9 110.387 -0.648 12.921 1.00 0.00 N ATOM 137 CZ ARG A 9 109.254 -0.084 12.550 1.00 0.00 C ATOM 138 NH1 ARG A 9 109.225 1.114 12.013 1.00 0.00 N ATOM 139 NH2 ARG A 9 108.135 -0.731 12.724 1.00 0.00 N ATOM 0 H ARG A 9 114.579 -0.329 10.879 1.00 0.00 H new ATOM 0 HA ARG A 9 113.458 -2.335 9.219 1.00 0.00 H new ATOM 0 HB2 ARG A 9 111.364 -1.817 10.492 1.00 0.00 H new ATOM 0 HB3 ARG A 9 112.755 -1.945 11.551 1.00 0.00 H new ATOM 0 HG2 ARG A 9 112.950 0.692 11.101 1.00 0.00 H new ATOM 0 HG3 ARG A 9 111.254 0.541 10.685 1.00 0.00 H new ATOM 0 HD2 ARG A 9 112.477 -0.469 13.305 1.00 0.00 H new ATOM 0 HD3 ARG A 9 111.643 1.063 13.136 1.00 0.00 H new ATOM 0 HE ARG A 9 110.368 -1.578 13.339 1.00 0.00 H new ATOM 0 HH11 ARG A 9 110.093 1.632 11.874 1.00 0.00 H new ATOM 0 HH12 ARG A 9 108.335 1.527 11.735 1.00 0.00 H new ATOM 0 HH21 ARG A 9 108.143 -1.661 13.142 1.00 0.00 H new ATOM 0 HH22 ARG A 9 107.251 -0.307 12.442 1.00 0.00 H new ATOM 153 N ASP A 10 112.649 0.739 8.376 1.00 0.00 N ATOM 154 CA ASP A 10 112.008 1.530 7.284 1.00 0.00 C ATOM 155 C ASP A 10 112.817 1.375 5.995 1.00 0.00 C ATOM 156 O ASP A 10 112.321 0.895 4.994 1.00 0.00 O ATOM 157 CB ASP A 10 111.961 3.007 7.683 1.00 0.00 C ATOM 158 CG ASP A 10 110.744 3.258 8.575 1.00 0.00 C ATOM 159 OD1 ASP A 10 110.735 2.754 9.687 1.00 0.00 O ATOM 160 OD2 ASP A 10 109.842 3.950 8.132 1.00 0.00 O ATOM 0 H ASP A 10 113.143 1.291 9.077 1.00 0.00 H new ATOM 0 HA ASP A 10 110.994 1.165 7.121 1.00 0.00 H new ATOM 0 HB2 ASP A 10 112.874 3.281 8.211 1.00 0.00 H new ATOM 0 HB3 ASP A 10 111.907 3.633 6.793 1.00 0.00 H new ATOM 165 N GLY A 11 114.064 1.778 6.017 1.00 0.00 N ATOM 166 CA GLY A 11 114.916 1.658 4.797 1.00 0.00 C ATOM 167 C GLY A 11 115.711 2.950 4.597 1.00 0.00 C ATOM 168 O GLY A 11 115.799 3.468 3.499 1.00 0.00 O ATOM 0 H GLY A 11 114.528 2.185 6.829 1.00 0.00 H new ATOM 0 HA2 GLY A 11 115.596 0.812 4.898 1.00 0.00 H new ATOM 0 HA3 GLY A 11 114.293 1.463 3.924 1.00 0.00 H new ATOM 172 N LEU A 12 116.289 3.470 5.649 1.00 0.00 N ATOM 173 CA LEU A 12 117.083 4.728 5.530 1.00 0.00 C ATOM 174 C LEU A 12 118.571 4.384 5.442 1.00 0.00 C ATOM 175 O LEU A 12 119.072 3.572 6.196 1.00 0.00 O ATOM 176 CB LEU A 12 116.836 5.606 6.759 1.00 0.00 C ATOM 177 CG LEU A 12 117.230 7.049 6.446 1.00 0.00 C ATOM 178 CD1 LEU A 12 116.137 7.707 5.601 1.00 0.00 C ATOM 179 CD2 LEU A 12 117.398 7.827 7.754 1.00 0.00 C ATOM 0 H LEU A 12 116.245 3.075 6.589 1.00 0.00 H new ATOM 0 HA LEU A 12 116.779 5.266 4.632 1.00 0.00 H new ATOM 0 HB2 LEU A 12 115.786 5.559 7.046 1.00 0.00 H new ATOM 0 HB3 LEU A 12 117.415 5.236 7.605 1.00 0.00 H new ATOM 0 HG LEU A 12 118.170 7.056 5.894 1.00 0.00 H new ATOM 0 HD11 LEU A 12 116.419 8.736 5.378 1.00 0.00 H new ATOM 0 HD12 LEU A 12 116.015 7.155 4.669 1.00 0.00 H new ATOM 0 HD13 LEU A 12 115.197 7.700 6.153 1.00 0.00 H new ATOM 0 HD21 LEU A 12 117.679 8.856 7.532 1.00 0.00 H new ATOM 0 HD22 LEU A 12 116.458 7.819 8.306 1.00 0.00 H new ATOM 0 HD23 LEU A 12 118.177 7.361 8.357 1.00 0.00 H new ATOM 191 N ILE A 13 119.278 4.998 4.527 1.00 0.00 N ATOM 192 CA ILE A 13 120.735 4.711 4.384 1.00 0.00 C ATOM 193 C ILE A 13 121.545 5.910 4.886 1.00 0.00 C ATOM 194 O ILE A 13 122.652 5.762 5.368 1.00 0.00 O ATOM 195 CB ILE A 13 121.064 4.452 2.913 1.00 0.00 C ATOM 196 CG1 ILE A 13 120.566 5.625 2.064 1.00 0.00 C ATOM 197 CG2 ILE A 13 120.375 3.165 2.454 1.00 0.00 C ATOM 198 CD1 ILE A 13 121.108 5.490 0.639 1.00 0.00 C ATOM 0 H ILE A 13 118.907 5.687 3.872 1.00 0.00 H new ATOM 0 HA ILE A 13 120.989 3.830 4.973 1.00 0.00 H new ATOM 0 HB ILE A 13 122.143 4.349 2.796 1.00 0.00 H new ATOM 0 HG12 ILE A 13 119.476 5.641 2.050 1.00 0.00 H new ATOM 0 HG13 ILE A 13 120.893 6.569 2.501 1.00 0.00 H new ATOM 0 HG21 ILE A 13 120.610 2.981 1.406 1.00 0.00 H new ATOM 0 HG22 ILE A 13 120.728 2.328 3.057 1.00 0.00 H new ATOM 0 HG23 ILE A 13 119.296 3.268 2.572 1.00 0.00 H new ATOM 0 HD11 ILE A 13 120.754 6.325 0.034 1.00 0.00 H new ATOM 0 HD12 ILE A 13 122.198 5.496 0.662 1.00 0.00 H new ATOM 0 HD13 ILE A 13 120.759 4.553 0.204 1.00 0.00 H new ATOM 210 N GLY A 14 120.999 7.095 4.774 1.00 0.00 N ATOM 211 CA GLY A 14 121.730 8.309 5.242 1.00 0.00 C ATOM 212 C GLY A 14 120.725 9.405 5.597 1.00 0.00 C ATOM 213 O GLY A 14 119.527 9.193 5.562 1.00 0.00 O ATOM 0 H GLY A 14 120.076 7.273 4.377 1.00 0.00 H new ATOM 0 HA2 GLY A 14 122.341 8.066 6.111 1.00 0.00 H new ATOM 0 HA3 GLY A 14 122.408 8.661 4.464 1.00 0.00 H new ATOM 217 N LYS A 15 121.204 10.575 5.939 1.00 0.00 N ATOM 218 CA LYS A 15 120.281 11.691 6.300 1.00 0.00 C ATOM 219 C LYS A 15 120.988 13.030 6.086 1.00 0.00 C ATOM 220 O LYS A 15 121.864 13.407 6.841 1.00 0.00 O ATOM 221 CB LYS A 15 119.871 11.559 7.769 1.00 0.00 C ATOM 222 CG LYS A 15 118.661 12.456 8.042 1.00 0.00 C ATOM 223 CD LYS A 15 118.585 12.770 9.537 1.00 0.00 C ATOM 224 CE LYS A 15 117.961 14.153 9.736 1.00 0.00 C ATOM 225 NZ LYS A 15 118.056 14.540 11.173 1.00 0.00 N ATOM 0 H LYS A 15 122.197 10.804 5.983 1.00 0.00 H new ATOM 0 HA LYS A 15 119.393 11.646 5.669 1.00 0.00 H new ATOM 0 HB2 LYS A 15 119.628 10.522 7.998 1.00 0.00 H new ATOM 0 HB3 LYS A 15 120.701 11.842 8.416 1.00 0.00 H new ATOM 0 HG2 LYS A 15 118.743 13.380 7.469 1.00 0.00 H new ATOM 0 HG3 LYS A 15 117.747 11.960 7.717 1.00 0.00 H new ATOM 0 HD2 LYS A 15 117.990 12.014 10.049 1.00 0.00 H new ATOM 0 HD3 LYS A 15 119.582 12.742 9.977 1.00 0.00 H new ATOM 0 HE2 LYS A 15 118.474 14.888 9.116 1.00 0.00 H new ATOM 0 HE3 LYS A 15 116.918 14.142 9.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 117.632 15.480 11.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 117.547 13.844 11.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 119.055 14.567 11.460 1.00 0.00 H new ATOM 239 N ASP A 16 120.609 13.753 5.060 1.00 0.00 N ATOM 240 CA ASP A 16 121.248 15.076 4.782 1.00 0.00 C ATOM 241 C ASP A 16 122.755 14.894 4.562 1.00 0.00 C ATOM 242 O ASP A 16 123.533 15.801 4.789 1.00 0.00 O ATOM 243 CB ASP A 16 121.017 16.016 5.969 1.00 0.00 C ATOM 244 CG ASP A 16 119.770 16.866 5.713 1.00 0.00 C ATOM 245 OD1 ASP A 16 119.589 17.293 4.585 1.00 0.00 O ATOM 246 OD2 ASP A 16 119.018 17.074 6.651 1.00 0.00 O ATOM 0 H ASP A 16 119.880 13.481 4.400 1.00 0.00 H new ATOM 0 HA ASP A 16 120.804 15.504 3.884 1.00 0.00 H new ATOM 0 HB2 ASP A 16 120.894 15.438 6.885 1.00 0.00 H new ATOM 0 HB3 ASP A 16 121.885 16.659 6.111 1.00 0.00 H new ATOM 251 N GLY A 17 123.168 13.733 4.117 1.00 0.00 N ATOM 252 CA GLY A 17 124.622 13.493 3.877 1.00 0.00 C ATOM 253 C GLY A 17 125.243 12.811 5.098 1.00 0.00 C ATOM 254 O GLY A 17 126.058 11.917 4.970 1.00 0.00 O ATOM 0 H GLY A 17 122.559 12.941 3.910 1.00 0.00 H new ATOM 0 HA2 GLY A 17 124.756 12.869 2.993 1.00 0.00 H new ATOM 0 HA3 GLY A 17 125.128 14.438 3.680 1.00 0.00 H new ATOM 258 N HIS A 18 124.865 13.229 6.280 1.00 0.00 N ATOM 259 CA HIS A 18 125.434 12.610 7.516 1.00 0.00 C ATOM 260 C HIS A 18 124.566 11.423 7.942 1.00 0.00 C ATOM 261 O HIS A 18 123.414 11.321 7.566 1.00 0.00 O ATOM 262 CB HIS A 18 125.470 13.650 8.641 1.00 0.00 C ATOM 263 CG HIS A 18 124.101 14.244 8.828 1.00 0.00 C ATOM 264 ND1 HIS A 18 123.096 13.586 9.521 1.00 0.00 N ATOM 265 CD2 HIS A 18 123.554 15.436 8.420 1.00 0.00 C ATOM 266 CE1 HIS A 18 122.009 14.378 9.509 1.00 0.00 C ATOM 267 NE2 HIS A 18 122.234 15.519 8.851 1.00 0.00 N ATOM 0 H HIS A 18 124.186 13.973 6.442 1.00 0.00 H new ATOM 0 HA HIS A 18 126.447 12.262 7.313 1.00 0.00 H new ATOM 0 HB2 HIS A 18 125.805 13.185 9.568 1.00 0.00 H new ATOM 0 HB3 HIS A 18 126.187 14.435 8.401 1.00 0.00 H new ATOM 0 HD1 HIS A 18 123.168 12.668 9.960 1.00 0.00 H new ATOM 0 HD2 HIS A 18 124.071 16.194 7.851 1.00 0.00 H new ATOM 0 HE1 HIS A 18 121.069 14.123 9.975 1.00 0.00 H new ATOM 275 N LEU A 19 125.114 10.528 8.725 1.00 0.00 N ATOM 276 CA LEU A 19 124.329 9.344 9.182 1.00 0.00 C ATOM 277 C LEU A 19 123.203 9.810 10.119 1.00 0.00 C ATOM 278 O LEU A 19 123.379 10.759 10.857 1.00 0.00 O ATOM 279 CB LEU A 19 125.249 8.380 9.936 1.00 0.00 C ATOM 280 CG LEU A 19 126.137 7.635 8.939 1.00 0.00 C ATOM 281 CD1 LEU A 19 127.398 7.139 9.650 1.00 0.00 C ATOM 282 CD2 LEU A 19 125.371 6.438 8.371 1.00 0.00 C ATOM 0 H LEU A 19 126.074 10.568 9.068 1.00 0.00 H new ATOM 0 HA LEU A 19 123.901 8.837 8.318 1.00 0.00 H new ATOM 0 HB2 LEU A 19 125.865 8.930 10.647 1.00 0.00 H new ATOM 0 HB3 LEU A 19 124.655 7.670 10.512 1.00 0.00 H new ATOM 0 HG LEU A 19 126.417 8.308 8.128 1.00 0.00 H new ATOM 0 HD11 LEU A 19 128.031 6.608 8.939 1.00 0.00 H new ATOM 0 HD12 LEU A 19 127.944 7.990 10.058 1.00 0.00 H new ATOM 0 HD13 LEU A 19 127.118 6.466 10.460 1.00 0.00 H new ATOM 0 HD21 LEU A 19 126.003 5.906 7.660 1.00 0.00 H new ATOM 0 HD22 LEU A 19 125.092 5.766 9.183 1.00 0.00 H new ATOM 0 HD23 LEU A 19 124.471 6.789 7.865 1.00 0.00 H new ATOM 294 N PRO A 20 122.072 9.133 10.072 1.00 0.00 N ATOM 295 CA PRO A 20 120.858 9.428 10.907 1.00 0.00 C ATOM 296 C PRO A 20 121.037 8.847 12.313 1.00 0.00 C ATOM 297 O PRO A 20 120.574 9.409 13.288 1.00 0.00 O ATOM 298 CB PRO A 20 119.677 8.764 10.208 1.00 0.00 C ATOM 299 CG PRO A 20 120.240 7.779 9.204 1.00 0.00 C ATOM 300 CD PRO A 20 121.756 7.946 9.193 1.00 0.00 C ATOM 0 HA PRO A 20 120.699 10.501 11.009 1.00 0.00 H new ATOM 0 HB2 PRO A 20 119.041 8.254 10.931 1.00 0.00 H new ATOM 0 HB3 PRO A 20 119.058 9.509 9.709 1.00 0.00 H new ATOM 0 HG2 PRO A 20 119.969 6.759 9.476 1.00 0.00 H new ATOM 0 HG3 PRO A 20 119.827 7.965 8.212 1.00 0.00 H new ATOM 0 HD2 PRO A 20 122.246 7.047 9.567 1.00 0.00 H new ATOM 0 HD3 PRO A 20 122.119 8.109 8.178 1.00 0.00 H new ATOM 308 N TRP A 21 121.703 7.725 12.421 1.00 0.00 N ATOM 309 CA TRP A 21 121.914 7.098 13.760 1.00 0.00 C ATOM 310 C TRP A 21 123.411 7.076 14.085 1.00 0.00 C ATOM 311 O TRP A 21 124.219 7.630 13.363 1.00 0.00 O ATOM 312 CB TRP A 21 121.370 5.665 13.747 1.00 0.00 C ATOM 313 CG TRP A 21 121.982 4.902 12.614 1.00 0.00 C ATOM 314 CD1 TRP A 21 123.260 4.458 12.579 1.00 0.00 C ATOM 315 CD2 TRP A 21 121.370 4.488 11.357 1.00 0.00 C ATOM 316 NE1 TRP A 21 123.470 3.798 11.382 1.00 0.00 N ATOM 317 CE2 TRP A 21 122.336 3.790 10.595 1.00 0.00 C ATOM 318 CE3 TRP A 21 120.083 4.648 10.811 1.00 0.00 C ATOM 319 CZ2 TRP A 21 122.037 3.269 9.335 1.00 0.00 C ATOM 320 CZ3 TRP A 21 119.779 4.126 9.543 1.00 0.00 C ATOM 321 CH2 TRP A 21 120.755 3.437 8.807 1.00 0.00 C ATOM 0 H TRP A 21 122.110 7.215 11.637 1.00 0.00 H new ATOM 0 HA TRP A 21 121.388 7.677 14.518 1.00 0.00 H new ATOM 0 HB2 TRP A 21 121.595 5.172 14.693 1.00 0.00 H new ATOM 0 HB3 TRP A 21 120.285 5.679 13.644 1.00 0.00 H new ATOM 0 HD1 TRP A 21 123.995 4.596 13.358 1.00 0.00 H new ATOM 0 HE1 TRP A 21 124.356 3.369 11.113 1.00 0.00 H new ATOM 0 HE3 TRP A 21 119.324 5.175 11.370 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 122.792 2.740 8.772 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 118.789 4.256 9.132 1.00 0.00 H new ATOM 0 HH2 TRP A 21 120.515 3.037 7.833 1.00 0.00 H new ATOM 332 N HIS A 22 123.781 6.440 15.168 1.00 0.00 N ATOM 333 CA HIS A 22 125.223 6.376 15.550 1.00 0.00 C ATOM 334 C HIS A 22 125.549 4.974 16.070 1.00 0.00 C ATOM 335 O HIS A 22 125.359 4.676 17.235 1.00 0.00 O ATOM 336 CB HIS A 22 125.506 7.406 16.647 1.00 0.00 C ATOM 337 CG HIS A 22 126.992 7.599 16.784 1.00 0.00 C ATOM 338 ND1 HIS A 22 127.708 8.441 15.948 1.00 0.00 N ATOM 339 CD2 HIS A 22 127.909 7.065 17.655 1.00 0.00 C ATOM 340 CE1 HIS A 22 128.997 8.391 16.332 1.00 0.00 C ATOM 341 NE2 HIS A 22 129.175 7.567 17.367 1.00 0.00 N ATOM 0 H HIS A 22 123.144 5.961 15.805 1.00 0.00 H new ATOM 0 HA HIS A 22 125.841 6.594 14.679 1.00 0.00 H new ATOM 0 HB2 HIS A 22 125.027 8.354 16.403 1.00 0.00 H new ATOM 0 HB3 HIS A 22 125.084 7.070 17.594 1.00 0.00 H new ATOM 0 HD2 HIS A 22 127.683 6.363 18.443 1.00 0.00 H new ATOM 0 HE1 HIS A 22 129.791 8.950 15.860 1.00 0.00 H new ATOM 0 HE2 HIS A 22 130.050 7.352 17.844 1.00 0.00 H new ATOM 349 N LEU A 23 126.037 4.113 15.214 1.00 0.00 N ATOM 350 CA LEU A 23 126.378 2.727 15.650 1.00 0.00 C ATOM 351 C LEU A 23 127.842 2.420 15.295 1.00 0.00 C ATOM 352 O LEU A 23 128.111 1.819 14.273 1.00 0.00 O ATOM 353 CB LEU A 23 125.458 1.731 14.939 1.00 0.00 C ATOM 354 CG LEU A 23 125.530 0.376 15.644 1.00 0.00 C ATOM 355 CD1 LEU A 23 124.781 0.453 16.975 1.00 0.00 C ATOM 356 CD2 LEU A 23 124.886 -0.694 14.760 1.00 0.00 C ATOM 0 H LEU A 23 126.214 4.312 14.229 1.00 0.00 H new ATOM 0 HA LEU A 23 126.244 2.641 16.728 1.00 0.00 H new ATOM 0 HB2 LEU A 23 124.433 2.101 14.943 1.00 0.00 H new ATOM 0 HB3 LEU A 23 125.755 1.626 13.896 1.00 0.00 H new ATOM 0 HG LEU A 23 126.573 0.118 15.827 1.00 0.00 H new ATOM 0 HD11 LEU A 23 124.832 -0.513 17.478 1.00 0.00 H new ATOM 0 HD12 LEU A 23 125.238 1.215 17.606 1.00 0.00 H new ATOM 0 HD13 LEU A 23 123.738 0.712 16.791 1.00 0.00 H new ATOM 0 HD21 LEU A 23 124.937 -1.660 15.262 1.00 0.00 H new ATOM 0 HD22 LEU A 23 123.843 -0.435 14.577 1.00 0.00 H new ATOM 0 HD23 LEU A 23 125.418 -0.750 13.810 1.00 0.00 H new ATOM 368 N PRO A 24 128.754 2.841 16.149 1.00 0.00 N ATOM 369 CA PRO A 24 130.240 2.645 15.995 1.00 0.00 C ATOM 370 C PRO A 24 130.544 1.194 15.603 1.00 0.00 C ATOM 371 O PRO A 24 131.476 0.925 14.869 1.00 0.00 O ATOM 372 CB PRO A 24 130.877 2.971 17.345 1.00 0.00 C ATOM 373 CG PRO A 24 129.798 3.542 18.240 1.00 0.00 C ATOM 374 CD PRO A 24 128.505 3.593 17.434 1.00 0.00 C ATOM 0 HA PRO A 24 130.638 3.291 15.212 1.00 0.00 H new ATOM 0 HB2 PRO A 24 131.308 2.074 17.791 1.00 0.00 H new ATOM 0 HB3 PRO A 24 131.689 3.687 17.221 1.00 0.00 H new ATOM 0 HG2 PRO A 24 129.671 2.923 19.128 1.00 0.00 H new ATOM 0 HG3 PRO A 24 130.074 4.539 18.583 1.00 0.00 H new ATOM 0 HD2 PRO A 24 127.685 3.141 17.992 1.00 0.00 H new ATOM 0 HD3 PRO A 24 128.220 4.625 17.228 1.00 0.00 H new ATOM 382 N ASP A 25 129.763 0.263 16.090 1.00 0.00 N ATOM 383 CA ASP A 25 129.998 -1.174 15.754 1.00 0.00 C ATOM 384 C ASP A 25 129.857 -1.378 14.243 1.00 0.00 C ATOM 385 O ASP A 25 130.613 -2.112 13.635 1.00 0.00 O ATOM 386 CB ASP A 25 128.972 -2.043 16.484 1.00 0.00 C ATOM 387 CG ASP A 25 129.387 -3.513 16.389 1.00 0.00 C ATOM 388 OD1 ASP A 25 129.021 -4.149 15.415 1.00 0.00 O ATOM 389 OD2 ASP A 25 130.063 -3.977 17.293 1.00 0.00 O ATOM 0 H ASP A 25 128.970 0.437 16.708 1.00 0.00 H new ATOM 0 HA ASP A 25 131.003 -1.459 16.065 1.00 0.00 H new ATOM 0 HB2 ASP A 25 128.902 -1.741 17.529 1.00 0.00 H new ATOM 0 HB3 ASP A 25 127.984 -1.904 16.045 1.00 0.00 H new ATOM 394 N ASP A 26 128.893 -0.732 13.637 1.00 0.00 N ATOM 395 CA ASP A 26 128.695 -0.880 12.166 1.00 0.00 C ATOM 396 C ASP A 26 129.898 -0.289 11.427 1.00 0.00 C ATOM 397 O ASP A 26 130.250 -0.728 10.348 1.00 0.00 O ATOM 398 CB ASP A 26 127.423 -0.140 11.746 1.00 0.00 C ATOM 399 CG ASP A 26 127.021 -0.575 10.336 1.00 0.00 C ATOM 400 OD1 ASP A 26 126.992 -1.769 10.092 1.00 0.00 O ATOM 401 OD2 ASP A 26 126.751 0.296 9.524 1.00 0.00 O ATOM 0 H ASP A 26 128.233 -0.107 14.100 1.00 0.00 H new ATOM 0 HA ASP A 26 128.600 -1.937 11.916 1.00 0.00 H new ATOM 0 HB2 ASP A 26 126.617 -0.354 12.448 1.00 0.00 H new ATOM 0 HB3 ASP A 26 127.591 0.937 11.772 1.00 0.00 H new ATOM 406 N LEU A 27 130.526 0.706 12.001 1.00 0.00 N ATOM 407 CA LEU A 27 131.708 1.334 11.340 1.00 0.00 C ATOM 408 C LEU A 27 132.902 0.380 11.411 1.00 0.00 C ATOM 409 O LEU A 27 133.748 0.368 10.536 1.00 0.00 O ATOM 410 CB LEU A 27 132.057 2.642 12.055 1.00 0.00 C ATOM 411 CG LEU A 27 131.205 3.778 11.487 1.00 0.00 C ATOM 412 CD1 LEU A 27 131.233 4.967 12.449 1.00 0.00 C ATOM 413 CD2 LEU A 27 131.768 4.207 10.131 1.00 0.00 C ATOM 0 H LEU A 27 130.270 1.111 12.901 1.00 0.00 H new ATOM 0 HA LEU A 27 131.472 1.541 10.296 1.00 0.00 H new ATOM 0 HB2 LEU A 27 131.881 2.542 13.126 1.00 0.00 H new ATOM 0 HB3 LEU A 27 133.116 2.868 11.926 1.00 0.00 H new ATOM 0 HG LEU A 27 130.178 3.435 11.363 1.00 0.00 H new ATOM 0 HD11 LEU A 27 130.626 5.777 12.044 1.00 0.00 H new ATOM 0 HD12 LEU A 27 130.833 4.662 13.416 1.00 0.00 H new ATOM 0 HD13 LEU A 27 132.260 5.311 12.573 1.00 0.00 H new ATOM 0 HD21 LEU A 27 131.162 5.017 9.725 1.00 0.00 H new ATOM 0 HD22 LEU A 27 132.795 4.550 10.256 1.00 0.00 H new ATOM 0 HD23 LEU A 27 131.749 3.360 9.445 1.00 0.00 H new ATOM 425 N HIS A 28 132.975 -0.416 12.447 1.00 0.00 N ATOM 426 CA HIS A 28 134.113 -1.373 12.584 1.00 0.00 C ATOM 427 C HIS A 28 133.995 -2.463 11.517 1.00 0.00 C ATOM 428 O HIS A 28 134.973 -2.851 10.905 1.00 0.00 O ATOM 429 CB HIS A 28 134.077 -2.013 13.973 1.00 0.00 C ATOM 430 CG HIS A 28 134.321 -0.959 15.018 1.00 0.00 C ATOM 431 ND1 HIS A 28 135.309 0.004 14.880 1.00 0.00 N ATOM 432 CD2 HIS A 28 133.715 -0.704 16.223 1.00 0.00 C ATOM 433 CE1 HIS A 28 135.268 0.786 15.974 1.00 0.00 C ATOM 434 NE2 HIS A 28 134.314 0.398 16.825 1.00 0.00 N ATOM 0 H HIS A 28 132.294 -0.444 13.206 1.00 0.00 H new ATOM 0 HA HIS A 28 135.054 -0.839 12.454 1.00 0.00 H new ATOM 0 HB2 HIS A 28 133.111 -2.489 14.141 1.00 0.00 H new ATOM 0 HB3 HIS A 28 134.834 -2.794 14.045 1.00 0.00 H new ATOM 0 HD2 HIS A 28 132.897 -1.273 16.640 1.00 0.00 H new ATOM 0 HE1 HIS A 28 135.926 1.625 16.144 1.00 0.00 H new ATOM 0 HE2 HIS A 28 134.076 0.819 17.723 1.00 0.00 H new ATOM 442 N TYR A 29 132.804 -2.959 11.292 1.00 0.00 N ATOM 443 CA TYR A 29 132.615 -4.027 10.265 1.00 0.00 C ATOM 444 C TYR A 29 132.894 -3.451 8.875 1.00 0.00 C ATOM 445 O TYR A 29 133.365 -4.143 7.992 1.00 0.00 O ATOM 446 CB TYR A 29 131.176 -4.544 10.326 1.00 0.00 C ATOM 447 CG TYR A 29 131.094 -5.881 9.630 1.00 0.00 C ATOM 448 CD1 TYR A 29 131.763 -6.991 10.160 1.00 0.00 C ATOM 449 CD2 TYR A 29 130.347 -6.012 8.452 1.00 0.00 C ATOM 450 CE1 TYR A 29 131.687 -8.230 9.513 1.00 0.00 C ATOM 451 CE2 TYR A 29 130.271 -7.251 7.805 1.00 0.00 C ATOM 452 CZ TYR A 29 130.941 -8.360 8.336 1.00 0.00 C ATOM 453 OH TYR A 29 130.867 -9.582 7.698 1.00 0.00 O ATOM 0 H TYR A 29 131.954 -2.670 11.776 1.00 0.00 H new ATOM 0 HA TYR A 29 133.304 -4.849 10.462 1.00 0.00 H new ATOM 0 HB2 TYR A 29 130.857 -4.641 11.364 1.00 0.00 H new ATOM 0 HB3 TYR A 29 130.502 -3.832 9.850 1.00 0.00 H new ATOM 0 HD1 TYR A 29 132.338 -6.891 11.069 1.00 0.00 H new ATOM 0 HD2 TYR A 29 129.830 -5.157 8.043 1.00 0.00 H new ATOM 0 HE1 TYR A 29 132.204 -9.085 9.922 1.00 0.00 H new ATOM 0 HE2 TYR A 29 129.696 -7.352 6.896 1.00 0.00 H new ATOM 0 HH TYR A 29 130.309 -9.499 6.897 1.00 0.00 H new ATOM 463 N PHE A 30 132.606 -2.189 8.677 1.00 0.00 N ATOM 464 CA PHE A 30 132.853 -1.558 7.347 1.00 0.00 C ATOM 465 C PHE A 30 134.358 -1.508 7.082 1.00 0.00 C ATOM 466 O PHE A 30 134.814 -1.781 5.987 1.00 0.00 O ATOM 467 CB PHE A 30 132.288 -0.136 7.345 1.00 0.00 C ATOM 468 CG PHE A 30 132.383 0.447 5.955 1.00 0.00 C ATOM 469 CD1 PHE A 30 131.716 -0.169 4.888 1.00 0.00 C ATOM 470 CD2 PHE A 30 133.140 1.604 5.732 1.00 0.00 C ATOM 471 CE1 PHE A 30 131.806 0.373 3.600 1.00 0.00 C ATOM 472 CE2 PHE A 30 133.229 2.145 4.444 1.00 0.00 C ATOM 473 CZ PHE A 30 132.562 1.530 3.378 1.00 0.00 C ATOM 0 H PHE A 30 132.209 -1.568 9.382 1.00 0.00 H new ATOM 0 HA PHE A 30 132.364 -2.144 6.569 1.00 0.00 H new ATOM 0 HB2 PHE A 30 131.249 -0.147 7.675 1.00 0.00 H new ATOM 0 HB3 PHE A 30 132.840 0.486 8.049 1.00 0.00 H new ATOM 0 HD1 PHE A 30 131.133 -1.062 5.059 1.00 0.00 H new ATOM 0 HD2 PHE A 30 133.655 2.079 6.554 1.00 0.00 H new ATOM 0 HE1 PHE A 30 131.292 -0.102 2.777 1.00 0.00 H new ATOM 0 HE2 PHE A 30 133.813 3.037 4.273 1.00 0.00 H new ATOM 0 HZ PHE A 30 132.631 1.948 2.385 1.00 0.00 H new ATOM 483 N ARG A 31 135.131 -1.158 8.078 1.00 0.00 N ATOM 484 CA ARG A 31 136.610 -1.083 7.899 1.00 0.00 C ATOM 485 C ARG A 31 137.158 -2.474 7.574 1.00 0.00 C ATOM 486 O ARG A 31 138.145 -2.612 6.876 1.00 0.00 O ATOM 487 CB ARG A 31 137.251 -0.570 9.192 1.00 0.00 C ATOM 488 CG ARG A 31 138.635 0.019 8.889 1.00 0.00 C ATOM 489 CD ARG A 31 139.726 -0.944 9.367 1.00 0.00 C ATOM 490 NE ARG A 31 140.024 -0.682 10.809 1.00 0.00 N ATOM 491 CZ ARG A 31 140.627 0.426 11.197 1.00 0.00 C ATOM 492 NH1 ARG A 31 140.991 1.349 10.337 1.00 0.00 N ATOM 493 NH2 ARG A 31 140.870 0.607 12.467 1.00 0.00 N ATOM 0 H ARG A 31 134.798 -0.920 9.012 1.00 0.00 H new ATOM 0 HA ARG A 31 136.844 -0.403 7.080 1.00 0.00 H new ATOM 0 HB2 ARG A 31 136.615 0.189 9.648 1.00 0.00 H new ATOM 0 HB3 ARG A 31 137.342 -1.384 9.911 1.00 0.00 H new ATOM 0 HG2 ARG A 31 138.738 0.197 7.819 1.00 0.00 H new ATOM 0 HG3 ARG A 31 138.746 0.983 9.385 1.00 0.00 H new ATOM 0 HD2 ARG A 31 139.400 -1.975 9.233 1.00 0.00 H new ATOM 0 HD3 ARG A 31 140.628 -0.815 8.769 1.00 0.00 H new ATOM 0 HE ARG A 31 139.755 -1.375 11.508 1.00 0.00 H new ATOM 0 HH11 ARG A 31 140.809 1.219 9.342 1.00 0.00 H new ATOM 0 HH12 ARG A 31 141.456 2.196 10.664 1.00 0.00 H new ATOM 0 HH21 ARG A 31 140.594 -0.103 13.145 1.00 0.00 H new ATOM 0 HH22 ARG A 31 141.335 1.459 12.781 1.00 0.00 H new ATOM 507 N ALA A 32 136.523 -3.503 8.075 1.00 0.00 N ATOM 508 CA ALA A 32 137.001 -4.891 7.803 1.00 0.00 C ATOM 509 C ALA A 32 136.564 -5.322 6.402 1.00 0.00 C ATOM 510 O ALA A 32 137.224 -6.115 5.756 1.00 0.00 O ATOM 511 CB ALA A 32 136.404 -5.847 8.839 1.00 0.00 C ATOM 0 H ALA A 32 135.692 -3.441 8.662 1.00 0.00 H new ATOM 0 HA ALA A 32 138.089 -4.917 7.865 1.00 0.00 H new ATOM 0 HB1 ALA A 32 136.752 -6.861 8.642 1.00 0.00 H new ATOM 0 HB2 ALA A 32 136.718 -5.543 9.838 1.00 0.00 H new ATOM 0 HB3 ALA A 32 135.316 -5.818 8.776 1.00 0.00 H new ATOM 517 N GLN A 33 135.457 -4.808 5.929 1.00 0.00 N ATOM 518 CA GLN A 33 134.971 -5.188 4.568 1.00 0.00 C ATOM 519 C GLN A 33 135.395 -4.121 3.555 1.00 0.00 C ATOM 520 O GLN A 33 134.665 -3.803 2.635 1.00 0.00 O ATOM 521 CB GLN A 33 133.445 -5.299 4.584 1.00 0.00 C ATOM 522 CG GLN A 33 133.035 -6.583 5.308 1.00 0.00 C ATOM 523 CD GLN A 33 132.909 -7.722 4.295 1.00 0.00 C ATOM 524 OE1 GLN A 33 132.398 -7.531 3.209 1.00 0.00 O ATOM 525 NE2 GLN A 33 133.356 -8.908 4.605 1.00 0.00 N ATOM 0 H GLN A 33 134.868 -4.141 6.427 1.00 0.00 H new ATOM 0 HA GLN A 33 135.403 -6.148 4.284 1.00 0.00 H new ATOM 0 HB2 GLN A 33 133.012 -4.433 5.084 1.00 0.00 H new ATOM 0 HB3 GLN A 33 133.059 -5.305 3.565 1.00 0.00 H new ATOM 0 HG2 GLN A 33 133.775 -6.837 6.067 1.00 0.00 H new ATOM 0 HG3 GLN A 33 132.087 -6.435 5.824 1.00 0.00 H new ATOM 0 HE21 GLN A 33 133.785 -9.069 5.516 1.00 0.00 H new ATOM 0 HE22 GLN A 33 133.276 -9.674 3.936 1.00 0.00 H new ATOM 534 N THR A 34 136.571 -3.571 3.718 1.00 0.00 N ATOM 535 CA THR A 34 137.054 -2.526 2.768 1.00 0.00 C ATOM 536 C THR A 34 138.580 -2.583 2.681 1.00 0.00 C ATOM 537 O THR A 34 139.150 -2.547 1.606 1.00 0.00 O ATOM 538 CB THR A 34 136.622 -1.144 3.265 1.00 0.00 C ATOM 539 OG1 THR A 34 136.999 -0.995 4.627 1.00 0.00 O ATOM 540 CG2 THR A 34 135.105 -1.003 3.134 1.00 0.00 C ATOM 0 H THR A 34 137.219 -3.802 4.471 1.00 0.00 H new ATOM 0 HA THR A 34 136.627 -2.706 1.782 1.00 0.00 H new ATOM 0 HB THR A 34 137.108 -0.373 2.666 1.00 0.00 H new ATOM 0 HG1 THR A 34 136.337 -1.435 5.200 1.00 0.00 H new ATOM 0 HG21 THR A 34 134.799 -0.019 3.488 1.00 0.00 H new ATOM 0 HG22 THR A 34 134.818 -1.118 2.089 1.00 0.00 H new ATOM 0 HG23 THR A 34 134.615 -1.772 3.731 1.00 0.00 H new ATOM 548 N VAL A 35 139.243 -2.672 3.806 1.00 0.00 N ATOM 549 CA VAL A 35 140.735 -2.731 3.802 1.00 0.00 C ATOM 550 C VAL A 35 141.201 -3.973 3.036 1.00 0.00 C ATOM 551 O VAL A 35 140.887 -5.090 3.402 1.00 0.00 O ATOM 552 CB VAL A 35 141.249 -2.795 5.243 1.00 0.00 C ATOM 553 CG1 VAL A 35 140.877 -1.503 5.973 1.00 0.00 C ATOM 554 CG2 VAL A 35 140.615 -3.989 5.965 1.00 0.00 C ATOM 0 H VAL A 35 138.813 -2.706 4.730 1.00 0.00 H new ATOM 0 HA VAL A 35 141.129 -1.839 3.315 1.00 0.00 H new ATOM 0 HB VAL A 35 142.333 -2.912 5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 35 141.242 -1.547 6.999 1.00 0.00 H new ATOM 0 HG12 VAL A 35 141.330 -0.653 5.463 1.00 0.00 H new ATOM 0 HG13 VAL A 35 139.793 -1.387 5.978 1.00 0.00 H new ATOM 0 HG21 VAL A 35 140.983 -4.032 6.990 1.00 0.00 H new ATOM 0 HG22 VAL A 35 139.531 -3.876 5.973 1.00 0.00 H new ATOM 0 HG23 VAL A 35 140.880 -4.910 5.446 1.00 0.00 H new ATOM 564 N GLY A 36 141.947 -3.782 1.977 1.00 0.00 N ATOM 565 CA GLY A 36 142.438 -4.946 1.182 1.00 0.00 C ATOM 566 C GLY A 36 141.685 -5.015 -0.149 1.00 0.00 C ATOM 567 O GLY A 36 142.199 -5.504 -1.136 1.00 0.00 O ATOM 0 H GLY A 36 142.237 -2.868 1.629 1.00 0.00 H new ATOM 0 HA2 GLY A 36 143.509 -4.850 1.001 1.00 0.00 H new ATOM 0 HA3 GLY A 36 142.291 -5.869 1.742 1.00 0.00 H new ATOM 571 N LYS A 37 140.467 -4.531 -0.180 1.00 0.00 N ATOM 572 CA LYS A 37 139.674 -4.568 -1.442 1.00 0.00 C ATOM 573 C LYS A 37 139.570 -3.155 -2.024 1.00 0.00 C ATOM 574 O LYS A 37 140.105 -2.210 -1.475 1.00 0.00 O ATOM 575 CB LYS A 37 138.270 -5.100 -1.145 1.00 0.00 C ATOM 576 CG LYS A 37 138.361 -6.568 -0.726 1.00 0.00 C ATOM 577 CD LYS A 37 137.101 -6.957 0.053 1.00 0.00 C ATOM 578 CE LYS A 37 137.349 -8.265 0.804 1.00 0.00 C ATOM 579 NZ LYS A 37 137.154 -9.415 -0.124 1.00 0.00 N ATOM 0 H LYS A 37 139.989 -4.112 0.618 1.00 0.00 H new ATOM 0 HA LYS A 37 140.168 -5.221 -2.161 1.00 0.00 H new ATOM 0 HB2 LYS A 37 137.807 -4.512 -0.353 1.00 0.00 H new ATOM 0 HB3 LYS A 37 137.637 -5.001 -2.027 1.00 0.00 H new ATOM 0 HG2 LYS A 37 138.467 -7.202 -1.606 1.00 0.00 H new ATOM 0 HG3 LYS A 37 139.246 -6.727 -0.110 1.00 0.00 H new ATOM 0 HD2 LYS A 37 136.836 -6.167 0.755 1.00 0.00 H new ATOM 0 HD3 LYS A 37 136.259 -7.071 -0.630 1.00 0.00 H new ATOM 0 HE2 LYS A 37 138.361 -8.278 1.209 1.00 0.00 H new ATOM 0 HE3 LYS A 37 136.666 -8.346 1.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 136.361 -9.999 0.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 136.945 -9.059 -1.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 138.020 -9.990 -0.151 1.00 0.00 H new ATOM 593 N ILE A 38 138.885 -3.010 -3.129 1.00 0.00 N ATOM 594 CA ILE A 38 138.739 -1.663 -3.755 1.00 0.00 C ATOM 595 C ILE A 38 137.428 -1.026 -3.287 1.00 0.00 C ATOM 596 O ILE A 38 136.352 -1.474 -3.638 1.00 0.00 O ATOM 597 CB ILE A 38 138.724 -1.806 -5.278 1.00 0.00 C ATOM 598 CG1 ILE A 38 139.969 -2.574 -5.728 1.00 0.00 C ATOM 599 CG2 ILE A 38 138.723 -0.417 -5.921 1.00 0.00 C ATOM 600 CD1 ILE A 38 139.787 -3.037 -7.175 1.00 0.00 C ATOM 0 H ILE A 38 138.419 -3.769 -3.626 1.00 0.00 H new ATOM 0 HA ILE A 38 139.577 -1.031 -3.460 1.00 0.00 H new ATOM 0 HB ILE A 38 137.830 -2.349 -5.584 1.00 0.00 H new ATOM 0 HG12 ILE A 38 140.851 -1.938 -5.646 1.00 0.00 H new ATOM 0 HG13 ILE A 38 140.134 -3.433 -5.078 1.00 0.00 H new ATOM 0 HG21 ILE A 38 138.712 -0.518 -7.006 1.00 0.00 H new ATOM 0 HG22 ILE A 38 137.838 0.132 -5.599 1.00 0.00 H new ATOM 0 HG23 ILE A 38 139.618 0.126 -5.616 1.00 0.00 H new ATOM 0 HD11 ILE A 38 140.673 -3.584 -7.496 1.00 0.00 H new ATOM 0 HD12 ILE A 38 138.915 -3.688 -7.242 1.00 0.00 H new ATOM 0 HD13 ILE A 38 139.643 -2.170 -7.819 1.00 0.00 H new ATOM 612 N MET A 39 137.513 0.015 -2.498 1.00 0.00 N ATOM 613 CA MET A 39 136.280 0.688 -2.000 1.00 0.00 C ATOM 614 C MET A 39 135.710 1.591 -3.098 1.00 0.00 C ATOM 615 O MET A 39 136.221 2.665 -3.355 1.00 0.00 O ATOM 616 CB MET A 39 136.621 1.533 -0.772 1.00 0.00 C ATOM 617 CG MET A 39 135.342 1.844 0.008 1.00 0.00 C ATOM 618 SD MET A 39 135.766 2.694 1.548 1.00 0.00 S ATOM 619 CE MET A 39 136.295 4.257 0.806 1.00 0.00 C ATOM 0 H MET A 39 138.389 0.428 -2.177 1.00 0.00 H new ATOM 0 HA MET A 39 135.540 -0.065 -1.729 1.00 0.00 H new ATOM 0 HB2 MET A 39 137.327 0.999 -0.135 1.00 0.00 H new ATOM 0 HB3 MET A 39 137.106 2.460 -1.079 1.00 0.00 H new ATOM 0 HG2 MET A 39 134.679 2.467 -0.593 1.00 0.00 H new ATOM 0 HG3 MET A 39 134.803 0.922 0.226 1.00 0.00 H new ATOM 0 HE1 MET A 39 137.374 4.364 0.913 1.00 0.00 H new ATOM 0 HE2 MET A 39 136.033 4.265 -0.252 1.00 0.00 H new ATOM 0 HE3 MET A 39 135.797 5.086 1.309 1.00 0.00 H new ATOM 629 N VAL A 40 134.656 1.159 -3.743 1.00 0.00 N ATOM 630 CA VAL A 40 134.045 1.986 -4.826 1.00 0.00 C ATOM 631 C VAL A 40 132.877 2.791 -4.252 1.00 0.00 C ATOM 632 O VAL A 40 132.001 2.250 -3.604 1.00 0.00 O ATOM 633 CB VAL A 40 133.535 1.071 -5.941 1.00 0.00 C ATOM 634 CG1 VAL A 40 133.048 1.920 -7.117 1.00 0.00 C ATOM 635 CG2 VAL A 40 134.669 0.156 -6.409 1.00 0.00 C ATOM 0 H VAL A 40 134.192 0.268 -3.566 1.00 0.00 H new ATOM 0 HA VAL A 40 134.793 2.667 -5.230 1.00 0.00 H new ATOM 0 HB VAL A 40 132.711 0.466 -5.564 1.00 0.00 H new ATOM 0 HG11 VAL A 40 132.685 1.268 -7.911 1.00 0.00 H new ATOM 0 HG12 VAL A 40 132.240 2.572 -6.785 1.00 0.00 H new ATOM 0 HG13 VAL A 40 133.872 2.526 -7.494 1.00 0.00 H new ATOM 0 HG21 VAL A 40 134.306 -0.496 -7.203 1.00 0.00 H new ATOM 0 HG22 VAL A 40 135.494 0.762 -6.785 1.00 0.00 H new ATOM 0 HG23 VAL A 40 135.016 -0.450 -5.572 1.00 0.00 H new ATOM 645 N VAL A 41 132.860 4.079 -4.488 1.00 0.00 N ATOM 646 CA VAL A 41 131.752 4.926 -3.959 1.00 0.00 C ATOM 647 C VAL A 41 131.486 6.082 -4.925 1.00 0.00 C ATOM 648 O VAL A 41 132.131 6.207 -5.949 1.00 0.00 O ATOM 649 CB VAL A 41 132.146 5.485 -2.591 1.00 0.00 C ATOM 650 CG1 VAL A 41 132.261 4.339 -1.584 1.00 0.00 C ATOM 651 CG2 VAL A 41 133.493 6.202 -2.701 1.00 0.00 C ATOM 0 H VAL A 41 133.568 4.580 -5.025 1.00 0.00 H new ATOM 0 HA VAL A 41 130.850 4.322 -3.859 1.00 0.00 H new ATOM 0 HB VAL A 41 131.385 6.189 -2.255 1.00 0.00 H new ATOM 0 HG11 VAL A 41 132.542 4.738 -0.609 1.00 0.00 H new ATOM 0 HG12 VAL A 41 131.302 3.827 -1.504 1.00 0.00 H new ATOM 0 HG13 VAL A 41 133.021 3.634 -1.920 1.00 0.00 H new ATOM 0 HG21 VAL A 41 133.774 6.600 -1.726 1.00 0.00 H new ATOM 0 HG22 VAL A 41 134.254 5.498 -3.038 1.00 0.00 H new ATOM 0 HG23 VAL A 41 133.413 7.019 -3.418 1.00 0.00 H new ATOM 661 N GLY A 42 130.537 6.926 -4.605 1.00 0.00 N ATOM 662 CA GLY A 42 130.219 8.078 -5.498 1.00 0.00 C ATOM 663 C GLY A 42 130.887 9.345 -4.963 1.00 0.00 C ATOM 664 O GLY A 42 131.711 9.292 -4.068 1.00 0.00 O ATOM 0 H GLY A 42 129.968 6.865 -3.761 1.00 0.00 H new ATOM 0 HA2 GLY A 42 130.566 7.872 -6.511 1.00 0.00 H new ATOM 0 HA3 GLY A 42 129.140 8.220 -5.554 1.00 0.00 H new ATOM 668 N ARG A 43 130.537 10.484 -5.505 1.00 0.00 N ATOM 669 CA ARG A 43 131.146 11.764 -5.037 1.00 0.00 C ATOM 670 C ARG A 43 130.514 12.174 -3.705 1.00 0.00 C ATOM 671 O ARG A 43 131.188 12.649 -2.810 1.00 0.00 O ATOM 672 CB ARG A 43 130.896 12.856 -6.078 1.00 0.00 C ATOM 673 CG ARG A 43 131.802 14.057 -5.794 1.00 0.00 C ATOM 674 CD ARG A 43 132.195 14.738 -7.110 1.00 0.00 C ATOM 675 NE ARG A 43 131.946 16.210 -7.002 1.00 0.00 N ATOM 676 CZ ARG A 43 130.722 16.702 -7.015 1.00 0.00 C ATOM 677 NH1 ARG A 43 129.669 15.924 -7.123 1.00 0.00 N ATOM 678 NH2 ARG A 43 130.554 17.992 -6.919 1.00 0.00 N ATOM 0 H ARG A 43 129.852 10.582 -6.255 1.00 0.00 H new ATOM 0 HA ARG A 43 132.219 11.628 -4.902 1.00 0.00 H new ATOM 0 HB2 ARG A 43 131.091 12.470 -7.078 1.00 0.00 H new ATOM 0 HB3 ARG A 43 129.850 13.163 -6.053 1.00 0.00 H new ATOM 0 HG2 ARG A 43 131.287 14.767 -5.147 1.00 0.00 H new ATOM 0 HG3 ARG A 43 132.696 13.731 -5.262 1.00 0.00 H new ATOM 0 HD2 ARG A 43 133.246 14.551 -7.329 1.00 0.00 H new ATOM 0 HD3 ARG A 43 131.618 14.320 -7.935 1.00 0.00 H new ATOM 0 HE ARG A 43 132.739 16.846 -6.917 1.00 0.00 H new ATOM 0 HH11 ARG A 43 129.787 14.914 -7.199 1.00 0.00 H new ATOM 0 HH12 ARG A 43 128.733 16.330 -7.130 1.00 0.00 H new ATOM 0 HH21 ARG A 43 131.364 18.607 -6.835 1.00 0.00 H new ATOM 0 HH22 ARG A 43 129.613 18.386 -6.928 1.00 0.00 H new ATOM 692 N ARG A 44 129.224 11.995 -3.571 1.00 0.00 N ATOM 693 CA ARG A 44 128.537 12.373 -2.301 1.00 0.00 C ATOM 694 C ARG A 44 129.080 11.517 -1.152 1.00 0.00 C ATOM 695 O ARG A 44 129.395 12.019 -0.090 1.00 0.00 O ATOM 696 CB ARG A 44 127.031 12.139 -2.446 1.00 0.00 C ATOM 697 CG ARG A 44 126.343 13.452 -2.826 1.00 0.00 C ATOM 698 CD ARG A 44 125.918 14.192 -1.556 1.00 0.00 C ATOM 699 NE ARG A 44 125.697 15.637 -1.871 1.00 0.00 N ATOM 700 CZ ARG A 44 125.361 16.502 -0.933 1.00 0.00 C ATOM 701 NH1 ARG A 44 125.205 16.133 0.318 1.00 0.00 N ATOM 702 NH2 ARG A 44 125.179 17.752 -1.256 1.00 0.00 N ATOM 0 H ARG A 44 128.616 11.602 -4.290 1.00 0.00 H new ATOM 0 HA ARG A 44 128.721 13.426 -2.087 1.00 0.00 H new ATOM 0 HB2 ARG A 44 126.842 11.383 -3.208 1.00 0.00 H new ATOM 0 HB3 ARG A 44 126.620 11.758 -1.511 1.00 0.00 H new ATOM 0 HG2 ARG A 44 127.020 14.073 -3.412 1.00 0.00 H new ATOM 0 HG3 ARG A 44 125.473 13.251 -3.451 1.00 0.00 H new ATOM 0 HD2 ARG A 44 125.005 13.753 -1.155 1.00 0.00 H new ATOM 0 HD3 ARG A 44 126.685 14.089 -0.789 1.00 0.00 H new ATOM 0 HE ARG A 44 125.808 15.961 -2.832 1.00 0.00 H new ATOM 0 HH11 ARG A 44 125.344 15.158 0.583 1.00 0.00 H new ATOM 0 HH12 ARG A 44 124.945 16.822 1.024 1.00 0.00 H new ATOM 0 HH21 ARG A 44 125.297 18.051 -2.224 1.00 0.00 H new ATOM 0 HH22 ARG A 44 124.919 18.431 -0.541 1.00 0.00 H new ATOM 716 N THR A 45 129.187 10.229 -1.361 1.00 0.00 N ATOM 717 CA THR A 45 129.706 9.332 -0.286 1.00 0.00 C ATOM 718 C THR A 45 131.190 9.621 -0.051 1.00 0.00 C ATOM 719 O THR A 45 131.693 9.467 1.046 1.00 0.00 O ATOM 720 CB THR A 45 129.533 7.873 -0.713 1.00 0.00 C ATOM 721 OG1 THR A 45 128.232 7.691 -1.255 1.00 0.00 O ATOM 722 CG2 THR A 45 129.714 6.959 0.501 1.00 0.00 C ATOM 0 H THR A 45 128.937 9.760 -2.232 1.00 0.00 H new ATOM 0 HA THR A 45 129.151 9.511 0.635 1.00 0.00 H new ATOM 0 HB THR A 45 130.280 7.624 -1.467 1.00 0.00 H new ATOM 0 HG1 THR A 45 127.870 6.831 -0.955 1.00 0.00 H new ATOM 0 HG21 THR A 45 129.591 5.920 0.196 1.00 0.00 H new ATOM 0 HG22 THR A 45 130.712 7.099 0.916 1.00 0.00 H new ATOM 0 HG23 THR A 45 128.969 7.206 1.257 1.00 0.00 H new ATOM 730 N TYR A 46 131.892 10.037 -1.075 1.00 0.00 N ATOM 731 CA TYR A 46 133.346 10.340 -0.921 1.00 0.00 C ATOM 732 C TYR A 46 133.527 11.488 0.074 1.00 0.00 C ATOM 733 O TYR A 46 134.305 11.394 1.006 1.00 0.00 O ATOM 734 CB TYR A 46 133.928 10.744 -2.277 1.00 0.00 C ATOM 735 CG TYR A 46 135.433 10.812 -2.178 1.00 0.00 C ATOM 736 CD1 TYR A 46 136.162 9.680 -1.798 1.00 0.00 C ATOM 737 CD2 TYR A 46 136.100 12.009 -2.468 1.00 0.00 C ATOM 738 CE1 TYR A 46 137.557 9.743 -1.707 1.00 0.00 C ATOM 739 CE2 TYR A 46 137.495 12.073 -2.376 1.00 0.00 C ATOM 740 CZ TYR A 46 138.225 10.940 -1.996 1.00 0.00 C ATOM 741 OH TYR A 46 139.600 11.002 -1.905 1.00 0.00 O ATOM 0 H TYR A 46 131.519 10.180 -2.013 1.00 0.00 H new ATOM 0 HA TYR A 46 133.864 9.455 -0.551 1.00 0.00 H new ATOM 0 HB2 TYR A 46 133.635 10.023 -3.040 1.00 0.00 H new ATOM 0 HB3 TYR A 46 133.529 11.711 -2.583 1.00 0.00 H new ATOM 0 HD1 TYR A 46 135.648 8.757 -1.575 1.00 0.00 H new ATOM 0 HD2 TYR A 46 135.538 12.883 -2.763 1.00 0.00 H new ATOM 0 HE1 TYR A 46 138.119 8.868 -1.414 1.00 0.00 H new ATOM 0 HE2 TYR A 46 138.009 12.997 -2.598 1.00 0.00 H new ATOM 0 HH TYR A 46 139.903 11.904 -2.140 1.00 0.00 H new ATOM 751 N GLU A 47 132.814 12.567 -0.118 1.00 0.00 N ATOM 752 CA GLU A 47 132.935 13.728 0.811 1.00 0.00 C ATOM 753 C GLU A 47 132.303 13.384 2.166 1.00 0.00 C ATOM 754 O GLU A 47 132.618 13.992 3.173 1.00 0.00 O ATOM 755 CB GLU A 47 132.215 14.937 0.209 1.00 0.00 C ATOM 756 CG GLU A 47 132.928 15.368 -1.075 1.00 0.00 C ATOM 757 CD GLU A 47 132.245 16.614 -1.642 1.00 0.00 C ATOM 758 OE1 GLU A 47 131.866 17.467 -0.858 1.00 0.00 O ATOM 759 OE2 GLU A 47 132.114 16.695 -2.852 1.00 0.00 O ATOM 0 H GLU A 47 132.150 12.694 -0.882 1.00 0.00 H new ATOM 0 HA GLU A 47 133.990 13.961 0.956 1.00 0.00 H new ATOM 0 HB2 GLU A 47 131.176 14.685 -0.006 1.00 0.00 H new ATOM 0 HB3 GLU A 47 132.202 15.759 0.924 1.00 0.00 H new ATOM 0 HG2 GLU A 47 133.978 15.577 -0.868 1.00 0.00 H new ATOM 0 HG3 GLU A 47 132.902 14.561 -1.807 1.00 0.00 H new ATOM 766 N SER A 48 131.413 12.422 2.199 1.00 0.00 N ATOM 767 CA SER A 48 130.760 12.045 3.488 1.00 0.00 C ATOM 768 C SER A 48 131.814 11.532 4.471 1.00 0.00 C ATOM 769 O SER A 48 131.660 11.650 5.673 1.00 0.00 O ATOM 770 CB SER A 48 129.727 10.946 3.231 1.00 0.00 C ATOM 771 OG SER A 48 128.937 10.763 4.398 1.00 0.00 O ATOM 0 H SER A 48 131.112 11.882 1.388 1.00 0.00 H new ATOM 0 HA SER A 48 130.267 12.920 3.912 1.00 0.00 H new ATOM 0 HB2 SER A 48 129.093 11.217 2.387 1.00 0.00 H new ATOM 0 HB3 SER A 48 130.228 10.015 2.967 1.00 0.00 H new ATOM 0 HG SER A 48 128.094 11.253 4.302 1.00 0.00 H new ATOM 777 N PHE A 49 132.883 10.962 3.972 1.00 0.00 N ATOM 778 CA PHE A 49 133.950 10.440 4.879 1.00 0.00 C ATOM 779 C PHE A 49 134.655 11.619 5.567 1.00 0.00 C ATOM 780 O PHE A 49 134.609 12.728 5.074 1.00 0.00 O ATOM 781 CB PHE A 49 134.974 9.642 4.067 1.00 0.00 C ATOM 782 CG PHE A 49 134.270 8.601 3.224 1.00 0.00 C ATOM 783 CD1 PHE A 49 133.359 7.715 3.814 1.00 0.00 C ATOM 784 CD2 PHE A 49 134.531 8.524 1.851 1.00 0.00 C ATOM 785 CE1 PHE A 49 132.711 6.753 3.030 1.00 0.00 C ATOM 786 CE2 PHE A 49 133.883 7.564 1.067 1.00 0.00 C ATOM 787 CZ PHE A 49 132.973 6.678 1.656 1.00 0.00 C ATOM 0 H PHE A 49 133.062 10.836 2.976 1.00 0.00 H new ATOM 0 HA PHE A 49 133.499 9.791 5.630 1.00 0.00 H new ATOM 0 HB2 PHE A 49 135.546 10.314 3.427 1.00 0.00 H new ATOM 0 HB3 PHE A 49 135.685 9.159 4.737 1.00 0.00 H new ATOM 0 HD1 PHE A 49 133.157 7.774 4.873 1.00 0.00 H new ATOM 0 HD2 PHE A 49 135.234 9.207 1.396 1.00 0.00 H new ATOM 0 HE1 PHE A 49 132.009 6.069 3.484 1.00 0.00 H new ATOM 0 HE2 PHE A 49 134.085 7.506 0.008 1.00 0.00 H new ATOM 0 HZ PHE A 49 132.473 5.936 1.051 1.00 0.00 H new ATOM 797 N PRO A 50 135.293 11.349 6.688 1.00 0.00 N ATOM 798 CA PRO A 50 136.047 12.352 7.514 1.00 0.00 C ATOM 799 C PRO A 50 137.427 12.600 6.899 1.00 0.00 C ATOM 800 O PRO A 50 137.751 13.705 6.505 1.00 0.00 O ATOM 801 CB PRO A 50 136.188 11.749 8.909 1.00 0.00 C ATOM 802 CG PRO A 50 135.815 10.284 8.812 1.00 0.00 C ATOM 803 CD PRO A 50 135.402 10.008 7.369 1.00 0.00 C ATOM 0 HA PRO A 50 135.525 13.308 7.554 1.00 0.00 H new ATOM 0 HB2 PRO A 50 137.209 11.861 9.274 1.00 0.00 H new ATOM 0 HB3 PRO A 50 135.538 12.264 9.617 1.00 0.00 H new ATOM 0 HG2 PRO A 50 136.658 9.654 9.096 1.00 0.00 H new ATOM 0 HG3 PRO A 50 134.999 10.051 9.495 1.00 0.00 H new ATOM 0 HD2 PRO A 50 136.138 9.378 6.869 1.00 0.00 H new ATOM 0 HD3 PRO A 50 134.451 9.477 7.333 1.00 0.00 H new ATOM 811 N LYS A 51 138.239 11.578 6.815 1.00 0.00 N ATOM 812 CA LYS A 51 139.601 11.739 6.229 1.00 0.00 C ATOM 813 C LYS A 51 139.621 11.143 4.820 1.00 0.00 C ATOM 814 O LYS A 51 139.635 9.939 4.647 1.00 0.00 O ATOM 815 CB LYS A 51 140.622 11.012 7.107 1.00 0.00 C ATOM 816 CG LYS A 51 142.036 11.281 6.586 1.00 0.00 C ATOM 817 CD LYS A 51 142.925 10.070 6.875 1.00 0.00 C ATOM 818 CE LYS A 51 143.429 10.139 8.318 1.00 0.00 C ATOM 819 NZ LYS A 51 144.657 10.982 8.375 1.00 0.00 N ATOM 0 H LYS A 51 138.015 10.634 7.129 1.00 0.00 H new ATOM 0 HA LYS A 51 139.855 12.798 6.179 1.00 0.00 H new ATOM 0 HB2 LYS A 51 140.534 11.350 8.139 1.00 0.00 H new ATOM 0 HB3 LYS A 51 140.421 9.941 7.104 1.00 0.00 H new ATOM 0 HG2 LYS A 51 142.009 11.478 5.514 1.00 0.00 H new ATOM 0 HG3 LYS A 51 142.448 12.170 7.063 1.00 0.00 H new ATOM 0 HD2 LYS A 51 142.364 9.148 6.718 1.00 0.00 H new ATOM 0 HD3 LYS A 51 143.768 10.052 6.185 1.00 0.00 H new ATOM 0 HE2 LYS A 51 142.657 10.557 8.964 1.00 0.00 H new ATOM 0 HE3 LYS A 51 143.645 9.137 8.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 145.000 11.029 9.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 145.393 10.565 7.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 144.436 11.941 8.039 1.00 0.00 H new ATOM 833 N ARG A 52 139.620 11.979 3.811 1.00 0.00 N ATOM 834 CA ARG A 52 139.638 11.467 2.409 1.00 0.00 C ATOM 835 C ARG A 52 141.035 11.683 1.802 1.00 0.00 C ATOM 836 O ARG A 52 141.617 12.735 1.982 1.00 0.00 O ATOM 837 CB ARG A 52 138.603 12.227 1.573 1.00 0.00 C ATOM 838 CG ARG A 52 137.242 12.183 2.271 1.00 0.00 C ATOM 839 CD ARG A 52 136.295 13.187 1.610 1.00 0.00 C ATOM 840 NE ARG A 52 136.941 14.536 1.577 1.00 0.00 N ATOM 841 CZ ARG A 52 137.007 15.293 2.655 1.00 0.00 C ATOM 842 NH1 ARG A 52 136.509 14.899 3.805 1.00 0.00 N ATOM 843 NH2 ARG A 52 137.582 16.463 2.578 1.00 0.00 N ATOM 0 H ARG A 52 139.607 12.995 3.900 1.00 0.00 H new ATOM 0 HA ARG A 52 139.399 10.404 2.410 1.00 0.00 H new ATOM 0 HB2 ARG A 52 138.920 13.261 1.438 1.00 0.00 H new ATOM 0 HB3 ARG A 52 138.528 11.784 0.580 1.00 0.00 H new ATOM 0 HG2 ARG A 52 136.823 11.178 2.211 1.00 0.00 H new ATOM 0 HG3 ARG A 52 137.357 12.418 3.329 1.00 0.00 H new ATOM 0 HD2 ARG A 52 136.053 12.863 0.598 1.00 0.00 H new ATOM 0 HD3 ARG A 52 135.356 13.235 2.162 1.00 0.00 H new ATOM 0 HE ARG A 52 137.339 14.878 0.702 1.00 0.00 H new ATOM 0 HH11 ARG A 52 136.058 13.987 3.880 1.00 0.00 H new ATOM 0 HH12 ARG A 52 136.574 15.505 4.623 1.00 0.00 H new ATOM 0 HH21 ARG A 52 137.973 16.782 1.692 1.00 0.00 H new ATOM 0 HH22 ARG A 52 137.640 17.058 3.404 1.00 0.00 H new ATOM 857 N PRO A 53 141.539 10.691 1.094 1.00 0.00 N ATOM 858 CA PRO A 53 140.904 9.354 0.812 1.00 0.00 C ATOM 859 C PRO A 53 141.164 8.402 1.983 1.00 0.00 C ATOM 860 O PRO A 53 141.981 8.673 2.843 1.00 0.00 O ATOM 861 CB PRO A 53 141.567 8.827 -0.457 1.00 0.00 C ATOM 862 CG PRO A 53 142.813 9.658 -0.691 1.00 0.00 C ATOM 863 CD PRO A 53 142.876 10.710 0.414 1.00 0.00 C ATOM 0 HA PRO A 53 139.825 9.438 0.686 1.00 0.00 H new ATOM 0 HB2 PRO A 53 141.823 7.773 -0.348 1.00 0.00 H new ATOM 0 HB3 PRO A 53 140.888 8.904 -1.306 1.00 0.00 H new ATOM 0 HG2 PRO A 53 143.703 9.029 -0.673 1.00 0.00 H new ATOM 0 HG3 PRO A 53 142.779 10.133 -1.671 1.00 0.00 H new ATOM 0 HD2 PRO A 53 143.674 10.483 1.121 1.00 0.00 H new ATOM 0 HD3 PRO A 53 143.087 11.696 -0.000 1.00 0.00 H new ATOM 871 N LEU A 54 140.478 7.287 2.018 1.00 0.00 N ATOM 872 CA LEU A 54 140.684 6.313 3.129 1.00 0.00 C ATOM 873 C LEU A 54 141.962 5.499 2.859 1.00 0.00 C ATOM 874 O LEU A 54 142.127 4.978 1.775 1.00 0.00 O ATOM 875 CB LEU A 54 139.483 5.365 3.202 1.00 0.00 C ATOM 876 CG LEU A 54 138.312 6.078 3.880 1.00 0.00 C ATOM 877 CD1 LEU A 54 137.047 5.224 3.753 1.00 0.00 C ATOM 878 CD2 LEU A 54 138.638 6.292 5.361 1.00 0.00 C ATOM 0 H LEU A 54 139.784 7.011 1.324 1.00 0.00 H new ATOM 0 HA LEU A 54 140.783 6.849 4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 54 139.197 5.045 2.200 1.00 0.00 H new ATOM 0 HB3 LEU A 54 139.748 4.467 3.760 1.00 0.00 H new ATOM 0 HG LEU A 54 138.146 7.042 3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 54 136.214 5.734 4.237 1.00 0.00 H new ATOM 0 HD12 LEU A 54 136.816 5.071 2.699 1.00 0.00 H new ATOM 0 HD13 LEU A 54 137.210 4.259 4.233 1.00 0.00 H new ATOM 0 HD21 LEU A 54 137.805 6.800 5.847 1.00 0.00 H new ATOM 0 HD22 LEU A 54 138.804 5.327 5.840 1.00 0.00 H new ATOM 0 HD23 LEU A 54 139.537 6.901 5.451 1.00 0.00 H new ATOM 890 N PRO A 55 142.838 5.406 3.843 1.00 0.00 N ATOM 891 CA PRO A 55 144.139 4.656 3.761 1.00 0.00 C ATOM 892 C PRO A 55 143.890 3.155 3.946 1.00 0.00 C ATOM 893 O PRO A 55 142.807 2.738 4.306 1.00 0.00 O ATOM 894 CB PRO A 55 145.021 5.186 4.887 1.00 0.00 C ATOM 895 CG PRO A 55 144.131 5.965 5.832 1.00 0.00 C ATOM 896 CD PRO A 55 142.734 6.010 5.222 1.00 0.00 C ATOM 0 HA PRO A 55 144.616 4.797 2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 55 145.510 4.364 5.410 1.00 0.00 H new ATOM 0 HB3 PRO A 55 145.809 5.825 4.489 1.00 0.00 H new ATOM 0 HG2 PRO A 55 144.105 5.489 6.812 1.00 0.00 H new ATOM 0 HG3 PRO A 55 144.518 6.974 5.977 1.00 0.00 H new ATOM 0 HD2 PRO A 55 142.027 5.452 5.836 1.00 0.00 H new ATOM 0 HD3 PRO A 55 142.369 7.036 5.168 1.00 0.00 H new ATOM 904 N GLU A 56 144.891 2.346 3.704 1.00 0.00 N ATOM 905 CA GLU A 56 144.733 0.868 3.861 1.00 0.00 C ATOM 906 C GLU A 56 143.644 0.353 2.914 1.00 0.00 C ATOM 907 O GLU A 56 143.014 -0.655 3.174 1.00 0.00 O ATOM 908 CB GLU A 56 144.350 0.540 5.309 1.00 0.00 C ATOM 909 CG GLU A 56 145.613 0.218 6.112 1.00 0.00 C ATOM 910 CD GLU A 56 145.260 -0.706 7.281 1.00 0.00 C ATOM 911 OE1 GLU A 56 144.347 -1.501 7.129 1.00 0.00 O ATOM 912 OE2 GLU A 56 145.910 -0.603 8.308 1.00 0.00 O ATOM 0 H GLU A 56 145.817 2.649 3.402 1.00 0.00 H new ATOM 0 HA GLU A 56 145.678 0.383 3.616 1.00 0.00 H new ATOM 0 HB2 GLU A 56 143.826 1.384 5.758 1.00 0.00 H new ATOM 0 HB3 GLU A 56 143.666 -0.308 5.332 1.00 0.00 H new ATOM 0 HG2 GLU A 56 146.352 -0.259 5.469 1.00 0.00 H new ATOM 0 HG3 GLU A 56 146.062 1.138 6.486 1.00 0.00 H new ATOM 919 N ARG A 57 143.422 1.033 1.815 1.00 0.00 N ATOM 920 CA ARG A 57 142.380 0.580 0.844 1.00 0.00 C ATOM 921 C ARG A 57 142.368 1.517 -0.366 1.00 0.00 C ATOM 922 O ARG A 57 142.804 2.652 -0.288 1.00 0.00 O ATOM 923 CB ARG A 57 141.003 0.591 1.519 1.00 0.00 C ATOM 924 CG ARG A 57 140.699 1.991 2.061 1.00 0.00 C ATOM 925 CD ARG A 57 139.661 1.894 3.184 1.00 0.00 C ATOM 926 NE ARG A 57 140.352 1.946 4.509 1.00 0.00 N ATOM 927 CZ ARG A 57 139.682 1.848 5.640 1.00 0.00 C ATOM 928 NH1 ARG A 57 138.378 1.694 5.655 1.00 0.00 N ATOM 929 NH2 ARG A 57 140.331 1.903 6.771 1.00 0.00 N ATOM 0 H ARG A 57 143.919 1.883 1.549 1.00 0.00 H new ATOM 0 HA ARG A 57 142.609 -0.434 0.515 1.00 0.00 H new ATOM 0 HB2 ARG A 57 140.236 0.294 0.804 1.00 0.00 H new ATOM 0 HB3 ARG A 57 140.981 -0.136 2.331 1.00 0.00 H new ATOM 0 HG2 ARG A 57 141.612 2.453 2.435 1.00 0.00 H new ATOM 0 HG3 ARG A 57 140.324 2.628 1.260 1.00 0.00 H new ATOM 0 HD2 ARG A 57 138.945 2.712 3.103 1.00 0.00 H new ATOM 0 HD3 ARG A 57 139.097 0.966 3.093 1.00 0.00 H new ATOM 0 HE ARG A 57 141.365 2.060 4.538 1.00 0.00 H new ATOM 0 HH11 ARG A 57 137.860 1.648 4.778 1.00 0.00 H new ATOM 0 HH12 ARG A 57 137.883 1.621 6.544 1.00 0.00 H new ATOM 0 HH21 ARG A 57 141.344 2.021 6.772 1.00 0.00 H new ATOM 0 HH22 ARG A 57 139.825 1.829 7.653 1.00 0.00 H new ATOM 943 N THR A 58 141.870 1.050 -1.484 1.00 0.00 N ATOM 944 CA THR A 58 141.825 1.906 -2.706 1.00 0.00 C ATOM 945 C THR A 58 140.539 2.736 -2.701 1.00 0.00 C ATOM 946 O THR A 58 139.503 2.286 -2.248 1.00 0.00 O ATOM 947 CB THR A 58 141.854 1.019 -3.952 1.00 0.00 C ATOM 948 OG1 THR A 58 142.923 0.088 -3.844 1.00 0.00 O ATOM 949 CG2 THR A 58 142.054 1.887 -5.196 1.00 0.00 C ATOM 0 H THR A 58 141.492 0.110 -1.602 1.00 0.00 H new ATOM 0 HA THR A 58 142.688 2.572 -2.714 1.00 0.00 H new ATOM 0 HB THR A 58 140.910 0.481 -4.037 1.00 0.00 H new ATOM 0 HG1 THR A 58 142.942 -0.482 -4.641 1.00 0.00 H new ATOM 0 HG21 THR A 58 142.074 1.253 -6.083 1.00 0.00 H new ATOM 0 HG22 THR A 58 141.233 2.600 -5.278 1.00 0.00 H new ATOM 0 HG23 THR A 58 142.997 2.428 -5.115 1.00 0.00 H new ATOM 957 N ASN A 59 140.601 3.943 -3.203 1.00 0.00 N ATOM 958 CA ASN A 59 139.387 4.811 -3.231 1.00 0.00 C ATOM 959 C ASN A 59 139.012 5.114 -4.684 1.00 0.00 C ATOM 960 O ASN A 59 139.718 5.820 -5.380 1.00 0.00 O ATOM 961 CB ASN A 59 139.679 6.121 -2.496 1.00 0.00 C ATOM 962 CG ASN A 59 139.842 5.842 -1.001 1.00 0.00 C ATOM 963 OD1 ASN A 59 139.005 6.220 -0.206 1.00 0.00 O ATOM 964 ND2 ASN A 59 140.893 5.192 -0.582 1.00 0.00 N ATOM 0 H ASN A 59 141.443 4.365 -3.595 1.00 0.00 H new ATOM 0 HA ASN A 59 138.560 4.297 -2.741 1.00 0.00 H new ATOM 0 HB2 ASN A 59 140.586 6.578 -2.892 1.00 0.00 H new ATOM 0 HB3 ASN A 59 138.867 6.830 -2.658 1.00 0.00 H new ATOM 0 HD21 ASN A 59 141.012 5.001 0.413 1.00 0.00 H new ATOM 0 HD22 ASN A 59 141.596 4.875 -1.249 1.00 0.00 H new ATOM 971 N VAL A 60 137.905 4.587 -5.142 1.00 0.00 N ATOM 972 CA VAL A 60 137.474 4.838 -6.548 1.00 0.00 C ATOM 973 C VAL A 60 136.222 5.716 -6.547 1.00 0.00 C ATOM 974 O VAL A 60 135.134 5.258 -6.252 1.00 0.00 O ATOM 975 CB VAL A 60 137.165 3.507 -7.234 1.00 0.00 C ATOM 976 CG1 VAL A 60 136.872 3.750 -8.716 1.00 0.00 C ATOM 977 CG2 VAL A 60 138.370 2.573 -7.102 1.00 0.00 C ATOM 0 H VAL A 60 137.280 3.991 -4.599 1.00 0.00 H new ATOM 0 HA VAL A 60 138.273 5.345 -7.088 1.00 0.00 H new ATOM 0 HB VAL A 60 136.295 3.050 -6.761 1.00 0.00 H new ATOM 0 HG11 VAL A 60 136.652 2.800 -9.204 1.00 0.00 H new ATOM 0 HG12 VAL A 60 136.014 4.415 -8.813 1.00 0.00 H new ATOM 0 HG13 VAL A 60 137.741 4.208 -9.188 1.00 0.00 H new ATOM 0 HG21 VAL A 60 138.150 1.624 -7.591 1.00 0.00 H new ATOM 0 HG22 VAL A 60 139.239 3.031 -7.574 1.00 0.00 H new ATOM 0 HG23 VAL A 60 138.580 2.397 -6.047 1.00 0.00 H new ATOM 987 N VAL A 61 136.368 6.975 -6.875 1.00 0.00 N ATOM 988 CA VAL A 61 135.191 7.892 -6.896 1.00 0.00 C ATOM 989 C VAL A 61 134.586 7.915 -8.302 1.00 0.00 C ATOM 990 O VAL A 61 135.290 8.036 -9.287 1.00 0.00 O ATOM 991 CB VAL A 61 135.637 9.304 -6.510 1.00 0.00 C ATOM 992 CG1 VAL A 61 134.412 10.211 -6.382 1.00 0.00 C ATOM 993 CG2 VAL A 61 136.376 9.256 -5.170 1.00 0.00 C ATOM 0 H VAL A 61 137.256 7.408 -7.130 1.00 0.00 H new ATOM 0 HA VAL A 61 134.444 7.540 -6.185 1.00 0.00 H new ATOM 0 HB VAL A 61 136.301 9.697 -7.280 1.00 0.00 H new ATOM 0 HG11 VAL A 61 134.731 11.216 -6.107 1.00 0.00 H new ATOM 0 HG12 VAL A 61 133.884 10.246 -7.335 1.00 0.00 H new ATOM 0 HG13 VAL A 61 133.747 9.818 -5.613 1.00 0.00 H new ATOM 0 HG21 VAL A 61 136.694 10.261 -4.894 1.00 0.00 H new ATOM 0 HG22 VAL A 61 135.711 8.862 -4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 61 137.250 8.610 -5.259 1.00 0.00 H new ATOM 1003 N LEU A 62 133.285 7.802 -8.397 1.00 0.00 N ATOM 1004 CA LEU A 62 132.622 7.817 -9.734 1.00 0.00 C ATOM 1005 C LEU A 62 131.637 8.986 -9.799 1.00 0.00 C ATOM 1006 O LEU A 62 130.673 9.037 -9.059 1.00 0.00 O ATOM 1007 CB LEU A 62 131.869 6.502 -9.944 1.00 0.00 C ATOM 1008 CG LEU A 62 131.323 6.448 -11.372 1.00 0.00 C ATOM 1009 CD1 LEU A 62 132.415 5.941 -12.316 1.00 0.00 C ATOM 1010 CD2 LEU A 62 130.125 5.498 -11.423 1.00 0.00 C ATOM 0 H LEU A 62 132.653 7.700 -7.603 1.00 0.00 H new ATOM 0 HA LEU A 62 133.375 7.932 -10.514 1.00 0.00 H new ATOM 0 HB2 LEU A 62 132.534 5.657 -9.766 1.00 0.00 H new ATOM 0 HB3 LEU A 62 131.052 6.420 -9.228 1.00 0.00 H new ATOM 0 HG LEU A 62 131.010 7.446 -11.680 1.00 0.00 H new ATOM 0 HD11 LEU A 62 132.027 5.902 -13.334 1.00 0.00 H new ATOM 0 HD12 LEU A 62 133.270 6.616 -12.279 1.00 0.00 H new ATOM 0 HD13 LEU A 62 132.727 4.943 -12.008 1.00 0.00 H new ATOM 0 HD21 LEU A 62 129.735 5.459 -12.440 1.00 0.00 H new ATOM 0 HD22 LEU A 62 130.438 4.500 -11.116 1.00 0.00 H new ATOM 0 HD23 LEU A 62 129.347 5.857 -10.750 1.00 0.00 H new ATOM 1022 N THR A 63 131.875 9.925 -10.680 1.00 0.00 N ATOM 1023 CA THR A 63 130.958 11.096 -10.801 1.00 0.00 C ATOM 1024 C THR A 63 130.651 11.356 -12.277 1.00 0.00 C ATOM 1025 O THR A 63 131.201 10.717 -13.154 1.00 0.00 O ATOM 1026 CB THR A 63 131.627 12.331 -10.193 1.00 0.00 C ATOM 1027 OG1 THR A 63 130.814 13.472 -10.430 1.00 0.00 O ATOM 1028 CG2 THR A 63 133.000 12.538 -10.834 1.00 0.00 C ATOM 0 H THR A 63 132.668 9.930 -11.322 1.00 0.00 H new ATOM 0 HA THR A 63 130.029 10.886 -10.270 1.00 0.00 H new ATOM 0 HB THR A 63 131.749 12.187 -9.119 1.00 0.00 H new ATOM 0 HG1 THR A 63 131.308 14.282 -10.185 1.00 0.00 H new ATOM 0 HG21 THR A 63 133.475 13.418 -10.400 1.00 0.00 H new ATOM 0 HG22 THR A 63 133.623 11.662 -10.651 1.00 0.00 H new ATOM 0 HG23 THR A 63 132.882 12.682 -11.908 1.00 0.00 H new ATOM 1036 N HIS A 64 129.779 12.291 -12.555 1.00 0.00 N ATOM 1037 CA HIS A 64 129.430 12.600 -13.973 1.00 0.00 C ATOM 1038 C HIS A 64 130.076 13.926 -14.382 1.00 0.00 C ATOM 1039 O HIS A 64 129.557 14.648 -15.213 1.00 0.00 O ATOM 1040 CB HIS A 64 127.908 12.706 -14.114 1.00 0.00 C ATOM 1041 CG HIS A 64 127.375 13.702 -13.121 1.00 0.00 C ATOM 1042 ND1 HIS A 64 126.416 13.364 -12.178 1.00 0.00 N ATOM 1043 CD2 HIS A 64 127.657 15.028 -12.909 1.00 0.00 C ATOM 1044 CE1 HIS A 64 126.158 14.467 -11.449 1.00 0.00 C ATOM 1045 NE2 HIS A 64 126.888 15.509 -11.853 1.00 0.00 N ATOM 0 H HIS A 64 129.293 12.855 -11.858 1.00 0.00 H new ATOM 0 HA HIS A 64 129.799 11.803 -14.619 1.00 0.00 H new ATOM 0 HB2 HIS A 64 127.647 13.013 -15.127 1.00 0.00 H new ATOM 0 HB3 HIS A 64 127.449 11.731 -13.948 1.00 0.00 H new ATOM 0 HD2 HIS A 64 128.368 15.611 -13.476 1.00 0.00 H new ATOM 0 HE1 HIS A 64 125.447 14.504 -10.637 1.00 0.00 H new ATOM 0 HE2 HIS A 64 126.883 16.454 -11.470 1.00 0.00 H new ATOM 1053 N GLN A 65 131.205 14.249 -13.803 1.00 0.00 N ATOM 1054 CA GLN A 65 131.892 15.527 -14.152 1.00 0.00 C ATOM 1055 C GLN A 65 133.353 15.239 -14.506 1.00 0.00 C ATOM 1056 O GLN A 65 133.989 14.392 -13.908 1.00 0.00 O ATOM 1057 CB GLN A 65 131.836 16.480 -12.956 1.00 0.00 C ATOM 1058 CG GLN A 65 132.264 17.881 -13.398 1.00 0.00 C ATOM 1059 CD GLN A 65 131.615 18.924 -12.487 1.00 0.00 C ATOM 1060 OE1 GLN A 65 130.479 18.772 -12.082 1.00 0.00 O ATOM 1061 NE2 GLN A 65 132.292 19.987 -12.145 1.00 0.00 N ATOM 0 H GLN A 65 131.681 13.681 -13.102 1.00 0.00 H new ATOM 0 HA GLN A 65 131.394 15.986 -15.006 1.00 0.00 H new ATOM 0 HB2 GLN A 65 130.826 16.509 -12.548 1.00 0.00 H new ATOM 0 HB3 GLN A 65 132.491 16.122 -12.161 1.00 0.00 H new ATOM 0 HG2 GLN A 65 133.349 17.971 -13.356 1.00 0.00 H new ATOM 0 HG3 GLN A 65 131.969 18.053 -14.433 1.00 0.00 H new ATOM 0 HE21 GLN A 65 133.245 20.116 -12.484 1.00 0.00 H new ATOM 0 HE22 GLN A 65 131.868 20.689 -11.539 1.00 0.00 H new ATOM 1070 N GLU A 66 133.885 15.936 -15.478 1.00 0.00 N ATOM 1071 CA GLU A 66 135.304 15.710 -15.881 1.00 0.00 C ATOM 1072 C GLU A 66 136.184 16.822 -15.305 1.00 0.00 C ATOM 1073 O GLU A 66 137.159 17.226 -15.908 1.00 0.00 O ATOM 1074 CB GLU A 66 135.408 15.715 -17.407 1.00 0.00 C ATOM 1075 CG GLU A 66 134.995 14.347 -17.953 1.00 0.00 C ATOM 1076 CD GLU A 66 135.073 14.360 -19.480 1.00 0.00 C ATOM 1077 OE1 GLU A 66 134.334 15.120 -20.084 1.00 0.00 O ATOM 1078 OE2 GLU A 66 135.869 13.610 -20.020 1.00 0.00 O ATOM 0 H GLU A 66 133.395 16.654 -16.011 1.00 0.00 H new ATOM 0 HA GLU A 66 135.641 14.747 -15.497 1.00 0.00 H new ATOM 0 HB2 GLU A 66 134.767 16.493 -17.823 1.00 0.00 H new ATOM 0 HB3 GLU A 66 136.429 15.946 -17.711 1.00 0.00 H new ATOM 0 HG2 GLU A 66 135.648 13.572 -17.552 1.00 0.00 H new ATOM 0 HG3 GLU A 66 133.981 14.107 -17.632 1.00 0.00 H new ATOM 1085 N ASP A 67 135.843 17.317 -14.141 1.00 0.00 N ATOM 1086 CA ASP A 67 136.654 18.404 -13.517 1.00 0.00 C ATOM 1087 C ASP A 67 136.894 18.084 -12.039 1.00 0.00 C ATOM 1088 O ASP A 67 137.076 18.972 -11.228 1.00 0.00 O ATOM 1089 CB ASP A 67 135.904 19.731 -13.635 1.00 0.00 C ATOM 1090 CG ASP A 67 136.901 20.889 -13.573 1.00 0.00 C ATOM 1091 OD1 ASP A 67 137.421 21.254 -14.614 1.00 0.00 O ATOM 1092 OD2 ASP A 67 137.126 21.393 -12.485 1.00 0.00 O ATOM 0 H ASP A 67 135.036 17.013 -13.596 1.00 0.00 H new ATOM 0 HA ASP A 67 137.612 18.480 -14.031 1.00 0.00 H new ATOM 0 HB2 ASP A 67 135.349 19.765 -14.573 1.00 0.00 H new ATOM 0 HB3 ASP A 67 135.175 19.822 -12.830 1.00 0.00 H new ATOM 1097 N TYR A 68 136.896 16.823 -11.684 1.00 0.00 N ATOM 1098 CA TYR A 68 137.125 16.441 -10.260 1.00 0.00 C ATOM 1099 C TYR A 68 138.613 16.163 -10.038 1.00 0.00 C ATOM 1100 O TYR A 68 139.336 15.841 -10.961 1.00 0.00 O ATOM 1101 CB TYR A 68 136.319 15.181 -9.936 1.00 0.00 C ATOM 1102 CG TYR A 68 136.056 15.118 -8.450 1.00 0.00 C ATOM 1103 CD1 TYR A 68 135.354 16.151 -7.819 1.00 0.00 C ATOM 1104 CD2 TYR A 68 136.513 14.024 -7.706 1.00 0.00 C ATOM 1105 CE1 TYR A 68 135.109 16.090 -6.442 1.00 0.00 C ATOM 1106 CE2 TYR A 68 136.269 13.964 -6.328 1.00 0.00 C ATOM 1107 CZ TYR A 68 135.567 14.997 -5.697 1.00 0.00 C ATOM 1108 OH TYR A 68 135.325 14.938 -4.339 1.00 0.00 O ATOM 0 H TYR A 68 136.748 16.041 -12.322 1.00 0.00 H new ATOM 0 HA TYR A 68 136.807 17.256 -9.610 1.00 0.00 H new ATOM 0 HB2 TYR A 68 135.376 15.189 -10.483 1.00 0.00 H new ATOM 0 HB3 TYR A 68 136.866 14.294 -10.257 1.00 0.00 H new ATOM 0 HD1 TYR A 68 135.001 16.995 -8.394 1.00 0.00 H new ATOM 0 HD2 TYR A 68 137.053 13.227 -8.194 1.00 0.00 H new ATOM 0 HE1 TYR A 68 134.566 16.886 -5.954 1.00 0.00 H new ATOM 0 HE2 TYR A 68 136.622 13.121 -5.753 1.00 0.00 H new ATOM 0 HH TYR A 68 134.488 15.405 -4.135 1.00 0.00 H new ATOM 1118 N GLN A 69 139.072 16.287 -8.819 1.00 0.00 N ATOM 1119 CA GLN A 69 140.514 16.031 -8.526 1.00 0.00 C ATOM 1120 C GLN A 69 140.653 15.440 -7.122 1.00 0.00 C ATOM 1121 O GLN A 69 140.615 16.150 -6.135 1.00 0.00 O ATOM 1122 CB GLN A 69 141.292 17.346 -8.606 1.00 0.00 C ATOM 1123 CG GLN A 69 141.845 17.528 -10.021 1.00 0.00 C ATOM 1124 CD GLN A 69 143.087 16.653 -10.200 1.00 0.00 C ATOM 1125 OE1 GLN A 69 143.142 15.546 -9.703 1.00 0.00 O ATOM 1126 NE2 GLN A 69 144.093 17.106 -10.897 1.00 0.00 N ATOM 0 H GLN A 69 138.509 16.555 -8.012 1.00 0.00 H new ATOM 0 HA GLN A 69 140.914 15.328 -9.257 1.00 0.00 H new ATOM 0 HB2 GLN A 69 140.641 18.182 -8.348 1.00 0.00 H new ATOM 0 HB3 GLN A 69 142.108 17.342 -7.883 1.00 0.00 H new ATOM 0 HG2 GLN A 69 141.087 17.257 -10.757 1.00 0.00 H new ATOM 0 HG3 GLN A 69 142.097 18.575 -10.193 1.00 0.00 H new ATOM 0 HE21 GLN A 69 144.047 18.036 -11.314 1.00 0.00 H new ATOM 0 HE22 GLN A 69 144.925 16.530 -11.024 1.00 0.00 H new ATOM 1135 N ALA A 70 140.813 14.144 -7.029 1.00 0.00 N ATOM 1136 CA ALA A 70 140.957 13.496 -5.692 1.00 0.00 C ATOM 1137 C ALA A 70 142.437 13.439 -5.309 1.00 0.00 C ATOM 1138 O ALA A 70 143.301 13.312 -6.157 1.00 0.00 O ATOM 1139 CB ALA A 70 140.391 12.075 -5.750 1.00 0.00 C ATOM 0 H ALA A 70 140.850 13.506 -7.824 1.00 0.00 H new ATOM 0 HA ALA A 70 140.411 14.075 -4.947 1.00 0.00 H new ATOM 0 HB1 ALA A 70 140.496 11.601 -4.774 1.00 0.00 H new ATOM 0 HB2 ALA A 70 139.336 12.114 -6.023 1.00 0.00 H new ATOM 0 HB3 ALA A 70 140.937 11.496 -6.495 1.00 0.00 H new ATOM 1145 N GLN A 71 142.734 13.534 -4.037 1.00 0.00 N ATOM 1146 CA GLN A 71 144.156 13.488 -3.590 1.00 0.00 C ATOM 1147 C GLN A 71 144.508 12.067 -3.147 1.00 0.00 C ATOM 1148 O GLN A 71 144.329 11.704 -2.000 1.00 0.00 O ATOM 1149 CB GLN A 71 144.355 14.450 -2.417 1.00 0.00 C ATOM 1150 CG GLN A 71 144.212 15.892 -2.910 1.00 0.00 C ATOM 1151 CD GLN A 71 142.729 16.256 -3.002 1.00 0.00 C ATOM 1152 OE1 GLN A 71 142.249 16.634 -4.053 1.00 0.00 O ATOM 1153 NE2 GLN A 71 141.978 16.157 -1.941 1.00 0.00 N ATOM 0 H GLN A 71 142.050 13.642 -3.288 1.00 0.00 H new ATOM 0 HA GLN A 71 144.804 13.782 -4.416 1.00 0.00 H new ATOM 0 HB2 GLN A 71 143.621 14.246 -1.637 1.00 0.00 H new ATOM 0 HB3 GLN A 71 145.340 14.302 -1.974 1.00 0.00 H new ATOM 0 HG2 GLN A 71 144.723 16.573 -2.229 1.00 0.00 H new ATOM 0 HG3 GLN A 71 144.686 16.003 -3.886 1.00 0.00 H new ATOM 0 HE21 GLN A 71 142.380 15.840 -1.059 1.00 0.00 H new ATOM 0 HE22 GLN A 71 140.988 16.397 -1.993 1.00 0.00 H new ATOM 1162 N GLY A 72 145.007 11.263 -4.052 1.00 0.00 N ATOM 1163 CA GLY A 72 145.374 9.861 -3.694 1.00 0.00 C ATOM 1164 C GLY A 72 144.282 8.906 -4.180 1.00 0.00 C ATOM 1165 O GLY A 72 144.545 7.762 -4.501 1.00 0.00 O ATOM 0 H GLY A 72 145.176 11.519 -5.025 1.00 0.00 H new ATOM 0 HA2 GLY A 72 146.330 9.597 -4.147 1.00 0.00 H new ATOM 0 HA3 GLY A 72 145.497 9.771 -2.615 1.00 0.00 H new ATOM 1169 N ALA A 73 143.058 9.368 -4.234 1.00 0.00 N ATOM 1170 CA ALA A 73 141.941 8.494 -4.697 1.00 0.00 C ATOM 1171 C ALA A 73 141.889 8.501 -6.227 1.00 0.00 C ATOM 1172 O ALA A 73 142.358 9.423 -6.868 1.00 0.00 O ATOM 1173 CB ALA A 73 140.617 9.019 -4.140 1.00 0.00 C ATOM 0 H ALA A 73 142.785 10.316 -3.976 1.00 0.00 H new ATOM 0 HA ALA A 73 142.106 7.476 -4.343 1.00 0.00 H new ATOM 0 HB1 ALA A 73 139.801 8.380 -4.478 1.00 0.00 H new ATOM 0 HB2 ALA A 73 140.653 9.015 -3.051 1.00 0.00 H new ATOM 0 HB3 ALA A 73 140.452 10.037 -4.493 1.00 0.00 H new ATOM 1179 N VAL A 74 141.319 7.479 -6.814 1.00 0.00 N ATOM 1180 CA VAL A 74 141.231 7.416 -8.302 1.00 0.00 C ATOM 1181 C VAL A 74 139.934 8.084 -8.765 1.00 0.00 C ATOM 1182 O VAL A 74 138.937 8.069 -8.067 1.00 0.00 O ATOM 1183 CB VAL A 74 141.241 5.954 -8.754 1.00 0.00 C ATOM 1184 CG1 VAL A 74 141.301 5.890 -10.282 1.00 0.00 C ATOM 1185 CG2 VAL A 74 142.467 5.249 -8.167 1.00 0.00 C ATOM 0 H VAL A 74 140.910 6.684 -6.324 1.00 0.00 H new ATOM 0 HA VAL A 74 142.084 7.936 -8.738 1.00 0.00 H new ATOM 0 HB VAL A 74 140.334 5.461 -8.406 1.00 0.00 H new ATOM 0 HG11 VAL A 74 141.308 4.848 -10.603 1.00 0.00 H new ATOM 0 HG12 VAL A 74 140.430 6.393 -10.702 1.00 0.00 H new ATOM 0 HG13 VAL A 74 142.208 6.383 -10.631 1.00 0.00 H new ATOM 0 HG21 VAL A 74 142.476 4.207 -8.488 1.00 0.00 H new ATOM 0 HG22 VAL A 74 143.373 5.744 -8.516 1.00 0.00 H new ATOM 0 HG23 VAL A 74 142.426 5.293 -7.079 1.00 0.00 H new ATOM 1195 N VAL A 75 139.942 8.667 -9.937 1.00 0.00 N ATOM 1196 CA VAL A 75 138.714 9.339 -10.454 1.00 0.00 C ATOM 1197 C VAL A 75 138.344 8.744 -11.815 1.00 0.00 C ATOM 1198 O VAL A 75 139.017 8.968 -12.803 1.00 0.00 O ATOM 1199 CB VAL A 75 138.979 10.838 -10.607 1.00 0.00 C ATOM 1200 CG1 VAL A 75 137.683 11.550 -11.000 1.00 0.00 C ATOM 1201 CG2 VAL A 75 139.486 11.403 -9.277 1.00 0.00 C ATOM 0 H VAL A 75 140.749 8.706 -10.559 1.00 0.00 H new ATOM 0 HA VAL A 75 137.892 9.186 -9.754 1.00 0.00 H new ATOM 0 HB VAL A 75 139.729 10.996 -11.382 1.00 0.00 H new ATOM 0 HG11 VAL A 75 137.873 12.618 -11.109 1.00 0.00 H new ATOM 0 HG12 VAL A 75 137.319 11.148 -11.946 1.00 0.00 H new ATOM 0 HG13 VAL A 75 136.932 11.392 -10.226 1.00 0.00 H new ATOM 0 HG21 VAL A 75 139.675 12.471 -9.384 1.00 0.00 H new ATOM 0 HG22 VAL A 75 138.734 11.243 -8.504 1.00 0.00 H new ATOM 0 HG23 VAL A 75 140.410 10.897 -8.995 1.00 0.00 H new ATOM 1211 N VAL A 76 137.276 7.989 -11.869 1.00 0.00 N ATOM 1212 CA VAL A 76 136.852 7.375 -13.162 1.00 0.00 C ATOM 1213 C VAL A 76 135.508 7.966 -13.591 1.00 0.00 C ATOM 1214 O VAL A 76 134.760 8.479 -12.779 1.00 0.00 O ATOM 1215 CB VAL A 76 136.710 5.861 -12.987 1.00 0.00 C ATOM 1216 CG1 VAL A 76 138.085 5.248 -12.711 1.00 0.00 C ATOM 1217 CG2 VAL A 76 135.778 5.569 -11.810 1.00 0.00 C ATOM 0 H VAL A 76 136.679 7.771 -11.071 1.00 0.00 H new ATOM 0 HA VAL A 76 137.602 7.584 -13.925 1.00 0.00 H new ATOM 0 HB VAL A 76 136.294 5.428 -13.897 1.00 0.00 H new ATOM 0 HG11 VAL A 76 137.984 4.170 -12.586 1.00 0.00 H new ATOM 0 HG12 VAL A 76 138.751 5.456 -13.549 1.00 0.00 H new ATOM 0 HG13 VAL A 76 138.501 5.681 -11.801 1.00 0.00 H new ATOM 0 HG21 VAL A 76 135.677 4.491 -11.685 1.00 0.00 H new ATOM 0 HG22 VAL A 76 136.194 6.002 -10.900 1.00 0.00 H new ATOM 0 HG23 VAL A 76 134.798 6.005 -12.005 1.00 0.00 H new ATOM 1227 N HIS A 77 135.200 7.900 -14.861 1.00 0.00 N ATOM 1228 CA HIS A 77 133.905 8.457 -15.353 1.00 0.00 C ATOM 1229 C HIS A 77 133.301 7.506 -16.388 1.00 0.00 C ATOM 1230 O HIS A 77 132.665 7.930 -17.335 1.00 0.00 O ATOM 1231 CB HIS A 77 134.150 9.823 -15.998 1.00 0.00 C ATOM 1232 CG HIS A 77 134.762 10.752 -14.985 1.00 0.00 C ATOM 1233 ND1 HIS A 77 135.945 11.433 -15.225 1.00 0.00 N ATOM 1234 CD2 HIS A 77 134.364 11.125 -13.725 1.00 0.00 C ATOM 1235 CE1 HIS A 77 136.216 12.173 -14.135 1.00 0.00 C ATOM 1236 NE2 HIS A 77 135.284 12.022 -13.190 1.00 0.00 N ATOM 0 H HIS A 77 135.791 7.483 -15.580 1.00 0.00 H new ATOM 0 HA HIS A 77 133.216 8.568 -14.516 1.00 0.00 H new ATOM 0 HB2 HIS A 77 134.812 9.718 -16.858 1.00 0.00 H new ATOM 0 HB3 HIS A 77 133.211 10.237 -16.367 1.00 0.00 H new ATOM 0 HD1 HIS A 77 136.508 11.382 -16.074 1.00 0.00 H new ATOM 0 HD2 HIS A 77 133.473 10.776 -13.225 1.00 0.00 H new ATOM 0 HE1 HIS A 77 137.081 12.811 -14.036 1.00 0.00 H new ATOM 1244 N ASP A 78 133.494 6.224 -16.211 1.00 0.00 N ATOM 1245 CA ASP A 78 132.934 5.235 -17.179 1.00 0.00 C ATOM 1246 C ASP A 78 132.651 3.917 -16.455 1.00 0.00 C ATOM 1247 O ASP A 78 133.459 3.441 -15.680 1.00 0.00 O ATOM 1248 CB ASP A 78 133.943 4.995 -18.303 1.00 0.00 C ATOM 1249 CG ASP A 78 133.701 6.001 -19.430 1.00 0.00 C ATOM 1250 OD1 ASP A 78 132.920 5.694 -20.315 1.00 0.00 O ATOM 1251 OD2 ASP A 78 134.300 7.063 -19.387 1.00 0.00 O ATOM 0 H ASP A 78 134.017 5.819 -15.435 1.00 0.00 H new ATOM 0 HA ASP A 78 132.007 5.623 -17.601 1.00 0.00 H new ATOM 0 HB2 ASP A 78 134.959 5.097 -17.922 1.00 0.00 H new ATOM 0 HB3 ASP A 78 133.846 3.978 -18.682 1.00 0.00 H new ATOM 1256 N VAL A 79 131.510 3.328 -16.705 1.00 0.00 N ATOM 1257 CA VAL A 79 131.164 2.038 -16.037 1.00 0.00 C ATOM 1258 C VAL A 79 132.169 0.961 -16.450 1.00 0.00 C ATOM 1259 O VAL A 79 132.562 0.130 -15.652 1.00 0.00 O ATOM 1260 CB VAL A 79 129.756 1.609 -16.456 1.00 0.00 C ATOM 1261 CG1 VAL A 79 129.338 0.374 -15.656 1.00 0.00 C ATOM 1262 CG2 VAL A 79 128.772 2.749 -16.181 1.00 0.00 C ATOM 0 H VAL A 79 130.801 3.686 -17.345 1.00 0.00 H new ATOM 0 HA VAL A 79 131.198 2.169 -14.955 1.00 0.00 H new ATOM 0 HB VAL A 79 129.752 1.372 -17.520 1.00 0.00 H new ATOM 0 HG11 VAL A 79 128.335 0.069 -15.955 1.00 0.00 H new ATOM 0 HG12 VAL A 79 130.037 -0.439 -15.850 1.00 0.00 H new ATOM 0 HG13 VAL A 79 129.343 0.611 -14.592 1.00 0.00 H new ATOM 0 HG21 VAL A 79 127.769 2.444 -16.479 1.00 0.00 H new ATOM 0 HG22 VAL A 79 128.778 2.986 -15.117 1.00 0.00 H new ATOM 0 HG23 VAL A 79 129.068 3.630 -16.751 1.00 0.00 H new ATOM 1272 N ALA A 80 132.586 0.971 -17.691 1.00 0.00 N ATOM 1273 CA ALA A 80 133.567 -0.049 -18.164 1.00 0.00 C ATOM 1274 C ALA A 80 134.914 0.183 -17.477 1.00 0.00 C ATOM 1275 O ALA A 80 135.644 -0.748 -17.193 1.00 0.00 O ATOM 1276 CB ALA A 80 133.740 0.074 -19.680 1.00 0.00 C ATOM 0 H ALA A 80 132.288 1.644 -18.397 1.00 0.00 H new ATOM 0 HA ALA A 80 133.201 -1.046 -17.920 1.00 0.00 H new ATOM 0 HB1 ALA A 80 134.457 -0.671 -20.026 1.00 0.00 H new ATOM 0 HB2 ALA A 80 132.780 -0.090 -20.170 1.00 0.00 H new ATOM 0 HB3 ALA A 80 134.106 1.071 -19.925 1.00 0.00 H new ATOM 1282 N ALA A 81 135.246 1.421 -17.209 1.00 0.00 N ATOM 1283 CA ALA A 81 136.544 1.726 -16.539 1.00 0.00 C ATOM 1284 C ALA A 81 136.513 1.196 -15.103 1.00 0.00 C ATOM 1285 O ALA A 81 137.520 0.776 -14.567 1.00 0.00 O ATOM 1286 CB ALA A 81 136.765 3.240 -16.519 1.00 0.00 C ATOM 0 H ALA A 81 134.671 2.235 -17.427 1.00 0.00 H new ATOM 0 HA ALA A 81 137.357 1.248 -17.086 1.00 0.00 H new ATOM 0 HB1 ALA A 81 137.713 3.463 -16.030 1.00 0.00 H new ATOM 0 HB2 ALA A 81 136.787 3.618 -17.541 1.00 0.00 H new ATOM 0 HB3 ALA A 81 135.953 3.719 -15.972 1.00 0.00 H new ATOM 1292 N VAL A 82 135.360 1.213 -14.482 1.00 0.00 N ATOM 1293 CA VAL A 82 135.253 0.712 -13.080 1.00 0.00 C ATOM 1294 C VAL A 82 135.476 -0.803 -13.065 1.00 0.00 C ATOM 1295 O VAL A 82 136.086 -1.338 -12.158 1.00 0.00 O ATOM 1296 CB VAL A 82 133.860 1.031 -12.528 1.00 0.00 C ATOM 1297 CG1 VAL A 82 133.783 0.619 -11.055 1.00 0.00 C ATOM 1298 CG2 VAL A 82 133.595 2.533 -12.647 1.00 0.00 C ATOM 0 H VAL A 82 134.488 1.553 -14.887 1.00 0.00 H new ATOM 0 HA VAL A 82 136.007 1.197 -12.460 1.00 0.00 H new ATOM 0 HB VAL A 82 133.112 0.481 -13.099 1.00 0.00 H new ATOM 0 HG11 VAL A 82 132.791 0.847 -10.665 1.00 0.00 H new ATOM 0 HG12 VAL A 82 133.971 -0.451 -10.966 1.00 0.00 H new ATOM 0 HG13 VAL A 82 134.532 1.167 -10.484 1.00 0.00 H new ATOM 0 HG21 VAL A 82 132.604 2.760 -12.254 1.00 0.00 H new ATOM 0 HG22 VAL A 82 134.345 3.081 -12.077 1.00 0.00 H new ATOM 0 HG23 VAL A 82 133.647 2.830 -13.695 1.00 0.00 H new ATOM 1308 N PHE A 83 134.985 -1.494 -14.062 1.00 0.00 N ATOM 1309 CA PHE A 83 135.163 -2.973 -14.115 1.00 0.00 C ATOM 1310 C PHE A 83 136.568 -3.301 -14.626 1.00 0.00 C ATOM 1311 O PHE A 83 137.161 -4.292 -14.243 1.00 0.00 O ATOM 1312 CB PHE A 83 134.124 -3.579 -15.059 1.00 0.00 C ATOM 1313 CG PHE A 83 132.808 -3.725 -14.331 1.00 0.00 C ATOM 1314 CD1 PHE A 83 132.731 -4.513 -13.176 1.00 0.00 C ATOM 1315 CD2 PHE A 83 131.666 -3.075 -14.811 1.00 0.00 C ATOM 1316 CE1 PHE A 83 131.513 -4.649 -12.501 1.00 0.00 C ATOM 1317 CE2 PHE A 83 130.447 -3.210 -14.136 1.00 0.00 C ATOM 1318 CZ PHE A 83 130.371 -3.997 -12.981 1.00 0.00 C ATOM 0 H PHE A 83 134.467 -1.094 -14.844 1.00 0.00 H new ATOM 0 HA PHE A 83 135.033 -3.389 -13.116 1.00 0.00 H new ATOM 0 HB2 PHE A 83 133.999 -2.943 -15.936 1.00 0.00 H new ATOM 0 HB3 PHE A 83 134.464 -4.551 -15.416 1.00 0.00 H new ATOM 0 HD1 PHE A 83 133.612 -5.016 -12.806 1.00 0.00 H new ATOM 0 HD2 PHE A 83 131.725 -2.469 -15.703 1.00 0.00 H new ATOM 0 HE1 PHE A 83 131.454 -5.257 -11.610 1.00 0.00 H new ATOM 0 HE2 PHE A 83 129.566 -2.707 -14.506 1.00 0.00 H new ATOM 0 HZ PHE A 83 129.431 -4.101 -12.460 1.00 0.00 H new ATOM 1328 N ALA A 84 137.102 -2.473 -15.487 1.00 0.00 N ATOM 1329 CA ALA A 84 138.469 -2.727 -16.030 1.00 0.00 C ATOM 1330 C ALA A 84 139.492 -2.635 -14.896 1.00 0.00 C ATOM 1331 O ALA A 84 140.462 -3.370 -14.863 1.00 0.00 O ATOM 1332 CB ALA A 84 138.796 -1.681 -17.098 1.00 0.00 C ATOM 0 H ALA A 84 136.648 -1.630 -15.838 1.00 0.00 H new ATOM 0 HA ALA A 84 138.505 -3.722 -16.473 1.00 0.00 H new ATOM 0 HB1 ALA A 84 139.794 -1.866 -17.495 1.00 0.00 H new ATOM 0 HB2 ALA A 84 138.067 -1.745 -17.906 1.00 0.00 H new ATOM 0 HB3 ALA A 84 138.760 -0.686 -16.655 1.00 0.00 H new ATOM 1338 N TYR A 85 139.281 -1.738 -13.967 1.00 0.00 N ATOM 1339 CA TYR A 85 140.235 -1.590 -12.829 1.00 0.00 C ATOM 1340 C TYR A 85 140.235 -2.873 -11.994 1.00 0.00 C ATOM 1341 O TYR A 85 141.258 -3.293 -11.488 1.00 0.00 O ATOM 1342 CB TYR A 85 139.806 -0.411 -11.953 1.00 0.00 C ATOM 1343 CG TYR A 85 140.904 -0.091 -10.966 1.00 0.00 C ATOM 1344 CD1 TYR A 85 140.951 -0.752 -9.732 1.00 0.00 C ATOM 1345 CD2 TYR A 85 141.874 0.866 -11.284 1.00 0.00 C ATOM 1346 CE1 TYR A 85 141.969 -0.454 -8.817 1.00 0.00 C ATOM 1347 CE2 TYR A 85 142.892 1.164 -10.369 1.00 0.00 C ATOM 1348 CZ TYR A 85 142.938 0.504 -9.136 1.00 0.00 C ATOM 1349 OH TYR A 85 143.941 0.797 -8.234 1.00 0.00 O ATOM 0 H TYR A 85 138.486 -1.100 -13.948 1.00 0.00 H new ATOM 0 HA TYR A 85 141.237 -1.408 -13.216 1.00 0.00 H new ATOM 0 HB2 TYR A 85 139.596 0.460 -12.574 1.00 0.00 H new ATOM 0 HB3 TYR A 85 138.885 -0.654 -11.423 1.00 0.00 H new ATOM 0 HD1 TYR A 85 140.203 -1.491 -9.486 1.00 0.00 H new ATOM 0 HD2 TYR A 85 141.838 1.375 -12.236 1.00 0.00 H new ATOM 0 HE1 TYR A 85 142.006 -0.964 -7.865 1.00 0.00 H new ATOM 0 HE2 TYR A 85 143.641 1.902 -10.615 1.00 0.00 H new ATOM 0 HH TYR A 85 144.531 1.482 -8.612 1.00 0.00 H new ATOM 1359 N ALA A 86 139.092 -3.495 -11.850 1.00 0.00 N ATOM 1360 CA ALA A 86 139.013 -4.752 -11.050 1.00 0.00 C ATOM 1361 C ALA A 86 139.572 -5.915 -11.873 1.00 0.00 C ATOM 1362 O ALA A 86 140.159 -6.837 -11.340 1.00 0.00 O ATOM 1363 CB ALA A 86 137.554 -5.037 -10.690 1.00 0.00 C ATOM 0 H ALA A 86 138.208 -3.184 -12.254 1.00 0.00 H new ATOM 0 HA ALA A 86 139.597 -4.639 -10.136 1.00 0.00 H new ATOM 0 HB1 ALA A 86 137.496 -5.955 -10.106 1.00 0.00 H new ATOM 0 HB2 ALA A 86 137.155 -4.209 -10.105 1.00 0.00 H new ATOM 0 HB3 ALA A 86 136.969 -5.151 -11.603 1.00 0.00 H new ATOM 1369 N LYS A 87 139.393 -5.873 -13.169 1.00 0.00 N ATOM 1370 CA LYS A 87 139.911 -6.971 -14.038 1.00 0.00 C ATOM 1371 C LYS A 87 141.439 -7.003 -13.961 1.00 0.00 C ATOM 1372 O LYS A 87 142.040 -8.054 -13.853 1.00 0.00 O ATOM 1373 CB LYS A 87 139.479 -6.722 -15.485 1.00 0.00 C ATOM 1374 CG LYS A 87 139.503 -8.041 -16.260 1.00 0.00 C ATOM 1375 CD LYS A 87 138.567 -7.939 -17.466 1.00 0.00 C ATOM 1376 CE LYS A 87 138.762 -9.159 -18.368 1.00 0.00 C ATOM 1377 NZ LYS A 87 137.865 -9.048 -19.553 1.00 0.00 N ATOM 0 H LYS A 87 138.909 -5.123 -13.663 1.00 0.00 H new ATOM 0 HA LYS A 87 139.509 -7.925 -13.697 1.00 0.00 H new ATOM 0 HB2 LYS A 87 138.477 -6.293 -15.508 1.00 0.00 H new ATOM 0 HB3 LYS A 87 140.146 -6.000 -15.955 1.00 0.00 H new ATOM 0 HG2 LYS A 87 140.518 -8.263 -16.591 1.00 0.00 H new ATOM 0 HG3 LYS A 87 139.192 -8.861 -15.613 1.00 0.00 H new ATOM 0 HD2 LYS A 87 137.531 -7.882 -17.132 1.00 0.00 H new ATOM 0 HD3 LYS A 87 138.773 -7.025 -18.023 1.00 0.00 H new ATOM 0 HE2 LYS A 87 139.801 -9.224 -18.690 1.00 0.00 H new ATOM 0 HE3 LYS A 87 138.541 -10.072 -17.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 137.997 -9.877 -20.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 136.875 -9.005 -19.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 138.096 -8.184 -20.084 1.00 0.00 H new ATOM 1391 N GLN A 88 142.066 -5.855 -14.013 1.00 0.00 N ATOM 1392 CA GLN A 88 143.556 -5.806 -13.943 1.00 0.00 C ATOM 1393 C GLN A 88 144.020 -6.313 -12.575 1.00 0.00 C ATOM 1394 O GLN A 88 145.097 -6.863 -12.443 1.00 0.00 O ATOM 1395 CB GLN A 88 144.028 -4.363 -14.139 1.00 0.00 C ATOM 1396 CG GLN A 88 145.490 -4.361 -14.592 1.00 0.00 C ATOM 1397 CD GLN A 88 145.865 -2.967 -15.100 1.00 0.00 C ATOM 1398 OE1 GLN A 88 146.582 -2.241 -14.441 1.00 0.00 O ATOM 1399 NE2 GLN A 88 145.405 -2.562 -16.251 1.00 0.00 N ATOM 0 H GLN A 88 141.608 -4.948 -14.101 1.00 0.00 H new ATOM 0 HA GLN A 88 143.978 -6.436 -14.726 1.00 0.00 H new ATOM 0 HB2 GLN A 88 143.406 -3.863 -14.881 1.00 0.00 H new ATOM 0 HB3 GLN A 88 143.924 -3.805 -13.208 1.00 0.00 H new ATOM 0 HG2 GLN A 88 146.139 -4.644 -13.763 1.00 0.00 H new ATOM 0 HG3 GLN A 88 145.639 -5.099 -15.380 1.00 0.00 H new ATOM 0 HE21 GLN A 88 144.803 -3.173 -16.803 1.00 0.00 H new ATOM 0 HE22 GLN A 88 145.647 -1.634 -16.599 1.00 0.00 H new ATOM 1408 N HIS A 89 143.214 -6.131 -11.560 1.00 0.00 N ATOM 1409 CA HIS A 89 143.599 -6.599 -10.196 1.00 0.00 C ATOM 1410 C HIS A 89 142.621 -7.691 -9.733 1.00 0.00 C ATOM 1411 O HIS A 89 141.589 -7.383 -9.170 1.00 0.00 O ATOM 1412 CB HIS A 89 143.544 -5.422 -9.220 1.00 0.00 C ATOM 1413 CG HIS A 89 144.500 -4.352 -9.670 1.00 0.00 C ATOM 1414 ND1 HIS A 89 144.360 -3.027 -9.287 1.00 0.00 N ATOM 1415 CD2 HIS A 89 145.614 -4.394 -10.470 1.00 0.00 C ATOM 1416 CE1 HIS A 89 145.364 -2.333 -9.852 1.00 0.00 C ATOM 1417 NE2 HIS A 89 146.159 -3.118 -10.583 1.00 0.00 N ATOM 0 H HIS A 89 142.303 -5.677 -11.619 1.00 0.00 H new ATOM 0 HA HIS A 89 144.611 -7.004 -10.223 1.00 0.00 H new ATOM 0 HB2 HIS A 89 142.531 -5.023 -9.172 1.00 0.00 H new ATOM 0 HB3 HIS A 89 143.803 -5.757 -8.215 1.00 0.00 H new ATOM 0 HD2 HIS A 89 146.008 -5.282 -10.941 1.00 0.00 H new ATOM 0 HE1 HIS A 89 145.509 -1.270 -9.729 1.00 0.00 H new ATOM 0 HE2 HIS A 89 146.987 -2.842 -11.111 1.00 0.00 H new ATOM 1425 N PRO A 90 142.968 -8.937 -9.979 1.00 0.00 N ATOM 1426 CA PRO A 90 142.154 -10.146 -9.606 1.00 0.00 C ATOM 1427 C PRO A 90 142.293 -10.423 -8.106 1.00 0.00 C ATOM 1428 O PRO A 90 141.390 -10.943 -7.478 1.00 0.00 O ATOM 1429 CB PRO A 90 142.703 -11.318 -10.418 1.00 0.00 C ATOM 1430 CG PRO A 90 143.981 -10.856 -11.086 1.00 0.00 C ATOM 1431 CD PRO A 90 144.224 -9.411 -10.668 1.00 0.00 C ATOM 0 HA PRO A 90 141.096 -9.992 -9.819 1.00 0.00 H new ATOM 0 HB2 PRO A 90 142.897 -12.174 -9.771 1.00 0.00 H new ATOM 0 HB3 PRO A 90 141.976 -11.640 -11.164 1.00 0.00 H new ATOM 0 HG2 PRO A 90 144.818 -11.487 -10.788 1.00 0.00 H new ATOM 0 HG3 PRO A 90 143.895 -10.932 -12.170 1.00 0.00 H new ATOM 0 HD2 PRO A 90 145.081 -9.342 -9.999 1.00 0.00 H new ATOM 0 HD3 PRO A 90 144.446 -8.790 -11.536 1.00 0.00 H new ATOM 1439 N ASP A 91 143.416 -10.075 -7.531 1.00 0.00 N ATOM 1440 CA ASP A 91 143.622 -10.311 -6.073 1.00 0.00 C ATOM 1441 C ASP A 91 142.617 -9.475 -5.277 1.00 0.00 C ATOM 1442 O ASP A 91 142.161 -9.876 -4.223 1.00 0.00 O ATOM 1443 CB ASP A 91 145.044 -9.903 -5.684 1.00 0.00 C ATOM 1444 CG ASP A 91 146.016 -11.027 -6.047 1.00 0.00 C ATOM 1445 OD1 ASP A 91 146.297 -11.183 -7.223 1.00 0.00 O ATOM 1446 OD2 ASP A 91 146.461 -11.712 -5.141 1.00 0.00 O ATOM 0 H ASP A 91 144.201 -9.636 -8.012 1.00 0.00 H new ATOM 0 HA ASP A 91 143.475 -11.368 -5.852 1.00 0.00 H new ATOM 0 HB2 ASP A 91 145.324 -8.985 -6.200 1.00 0.00 H new ATOM 0 HB3 ASP A 91 145.094 -9.696 -4.615 1.00 0.00 H new ATOM 1451 N GLN A 92 142.270 -8.318 -5.778 1.00 0.00 N ATOM 1452 CA GLN A 92 141.294 -7.446 -5.061 1.00 0.00 C ATOM 1453 C GLN A 92 139.915 -7.589 -5.705 1.00 0.00 C ATOM 1454 O GLN A 92 139.792 -8.023 -6.835 1.00 0.00 O ATOM 1455 CB GLN A 92 141.750 -5.988 -5.150 1.00 0.00 C ATOM 1456 CG GLN A 92 142.807 -5.717 -4.077 1.00 0.00 C ATOM 1457 CD GLN A 92 144.201 -5.942 -4.665 1.00 0.00 C ATOM 1458 OE1 GLN A 92 144.437 -6.926 -5.338 1.00 0.00 O ATOM 1459 NE2 GLN A 92 145.142 -5.066 -4.438 1.00 0.00 N ATOM 0 H GLN A 92 142.622 -7.938 -6.657 1.00 0.00 H new ATOM 0 HA GLN A 92 141.240 -7.746 -4.014 1.00 0.00 H new ATOM 0 HB2 GLN A 92 142.160 -5.784 -6.139 1.00 0.00 H new ATOM 0 HB3 GLN A 92 140.899 -5.321 -5.014 1.00 0.00 H new ATOM 0 HG2 GLN A 92 142.716 -4.694 -3.712 1.00 0.00 H new ATOM 0 HG3 GLN A 92 142.650 -6.376 -3.223 1.00 0.00 H new ATOM 0 HE21 GLN A 92 144.944 -4.240 -3.873 1.00 0.00 H new ATOM 0 HE22 GLN A 92 146.075 -5.208 -4.825 1.00 0.00 H new ATOM 1468 N GLU A 93 138.878 -7.226 -4.994 1.00 0.00 N ATOM 1469 CA GLU A 93 137.501 -7.336 -5.557 1.00 0.00 C ATOM 1470 C GLU A 93 136.839 -5.957 -5.560 1.00 0.00 C ATOM 1471 O GLU A 93 137.385 -4.997 -5.050 1.00 0.00 O ATOM 1472 CB GLU A 93 136.675 -8.297 -4.700 1.00 0.00 C ATOM 1473 CG GLU A 93 137.118 -9.736 -4.975 1.00 0.00 C ATOM 1474 CD GLU A 93 136.405 -10.683 -4.009 1.00 0.00 C ATOM 1475 OE1 GLU A 93 136.580 -10.521 -2.813 1.00 0.00 O ATOM 1476 OE2 GLU A 93 135.693 -11.555 -4.483 1.00 0.00 O ATOM 0 H GLU A 93 138.927 -6.857 -4.044 1.00 0.00 H new ATOM 0 HA GLU A 93 137.555 -7.715 -6.578 1.00 0.00 H new ATOM 0 HB2 GLU A 93 136.804 -8.061 -3.644 1.00 0.00 H new ATOM 0 HB3 GLU A 93 135.615 -8.182 -4.925 1.00 0.00 H new ATOM 0 HG2 GLU A 93 136.887 -10.008 -6.005 1.00 0.00 H new ATOM 0 HG3 GLU A 93 138.198 -9.824 -4.857 1.00 0.00 H new ATOM 1483 N LEU A 94 135.667 -5.855 -6.132 1.00 0.00 N ATOM 1484 CA LEU A 94 134.959 -4.541 -6.175 1.00 0.00 C ATOM 1485 C LEU A 94 133.966 -4.457 -5.014 1.00 0.00 C ATOM 1486 O LEU A 94 133.217 -5.381 -4.759 1.00 0.00 O ATOM 1487 CB LEU A 94 134.206 -4.411 -7.501 1.00 0.00 C ATOM 1488 CG LEU A 94 133.992 -2.932 -7.825 1.00 0.00 C ATOM 1489 CD1 LEU A 94 135.193 -2.403 -8.611 1.00 0.00 C ATOM 1490 CD2 LEU A 94 132.724 -2.775 -8.666 1.00 0.00 C ATOM 0 H LEU A 94 135.168 -6.628 -6.573 1.00 0.00 H new ATOM 0 HA LEU A 94 135.686 -3.734 -6.089 1.00 0.00 H new ATOM 0 HB2 LEU A 94 134.771 -4.891 -8.300 1.00 0.00 H new ATOM 0 HB3 LEU A 94 133.246 -4.923 -7.437 1.00 0.00 H new ATOM 0 HG LEU A 94 133.887 -2.368 -6.898 1.00 0.00 H new ATOM 0 HD11 LEU A 94 135.041 -1.349 -8.842 1.00 0.00 H new ATOM 0 HD12 LEU A 94 136.098 -2.517 -8.013 1.00 0.00 H new ATOM 0 HD13 LEU A 94 135.298 -2.966 -9.538 1.00 0.00 H new ATOM 0 HD21 LEU A 94 132.570 -1.721 -8.898 1.00 0.00 H new ATOM 0 HD22 LEU A 94 132.830 -3.339 -9.593 1.00 0.00 H new ATOM 0 HD23 LEU A 94 131.868 -3.153 -8.107 1.00 0.00 H new ATOM 1502 N VAL A 95 133.958 -3.353 -4.310 1.00 0.00 N ATOM 1503 CA VAL A 95 133.016 -3.197 -3.163 1.00 0.00 C ATOM 1504 C VAL A 95 132.155 -1.950 -3.378 1.00 0.00 C ATOM 1505 O VAL A 95 132.664 -0.861 -3.566 1.00 0.00 O ATOM 1506 CB VAL A 95 133.812 -3.051 -1.865 1.00 0.00 C ATOM 1507 CG1 VAL A 95 132.852 -3.037 -0.675 1.00 0.00 C ATOM 1508 CG2 VAL A 95 134.780 -4.227 -1.725 1.00 0.00 C ATOM 0 H VAL A 95 134.565 -2.552 -4.482 1.00 0.00 H new ATOM 0 HA VAL A 95 132.374 -4.075 -3.097 1.00 0.00 H new ATOM 0 HB VAL A 95 134.375 -2.118 -1.888 1.00 0.00 H new ATOM 0 HG11 VAL A 95 133.420 -2.933 0.249 1.00 0.00 H new ATOM 0 HG12 VAL A 95 132.163 -2.199 -0.774 1.00 0.00 H new ATOM 0 HG13 VAL A 95 132.288 -3.970 -0.651 1.00 0.00 H new ATOM 0 HG21 VAL A 95 135.347 -4.123 -0.800 1.00 0.00 H new ATOM 0 HG22 VAL A 95 134.218 -5.160 -1.703 1.00 0.00 H new ATOM 0 HG23 VAL A 95 135.466 -4.237 -2.572 1.00 0.00 H new ATOM 1518 N ILE A 96 130.855 -2.105 -3.349 1.00 0.00 N ATOM 1519 CA ILE A 96 129.953 -0.933 -3.550 1.00 0.00 C ATOM 1520 C ILE A 96 129.414 -0.468 -2.195 1.00 0.00 C ATOM 1521 O ILE A 96 128.700 -1.188 -1.521 1.00 0.00 O ATOM 1522 CB ILE A 96 128.782 -1.333 -4.456 1.00 0.00 C ATOM 1523 CG1 ILE A 96 129.312 -2.014 -5.731 1.00 0.00 C ATOM 1524 CG2 ILE A 96 127.977 -0.086 -4.833 1.00 0.00 C ATOM 1525 CD1 ILE A 96 130.237 -1.062 -6.502 1.00 0.00 C ATOM 0 H ILE A 96 130.380 -2.994 -3.194 1.00 0.00 H new ATOM 0 HA ILE A 96 130.511 -0.123 -4.019 1.00 0.00 H new ATOM 0 HB ILE A 96 128.139 -2.032 -3.922 1.00 0.00 H new ATOM 0 HG12 ILE A 96 129.853 -2.923 -5.467 1.00 0.00 H new ATOM 0 HG13 ILE A 96 128.477 -2.313 -6.365 1.00 0.00 H new ATOM 0 HG21 ILE A 96 127.145 -0.371 -5.477 1.00 0.00 H new ATOM 0 HG22 ILE A 96 127.591 0.385 -3.929 1.00 0.00 H new ATOM 0 HG23 ILE A 96 128.621 0.617 -5.362 1.00 0.00 H new ATOM 0 HD11 ILE A 96 130.603 -1.559 -7.401 1.00 0.00 H new ATOM 0 HD12 ILE A 96 129.684 -0.165 -6.783 1.00 0.00 H new ATOM 0 HD13 ILE A 96 131.081 -0.785 -5.871 1.00 0.00 H new ATOM 1537 N ALA A 97 129.756 0.730 -1.794 1.00 0.00 N ATOM 1538 CA ALA A 97 129.272 1.254 -0.483 1.00 0.00 C ATOM 1539 C ALA A 97 128.125 2.242 -0.715 1.00 0.00 C ATOM 1540 O ALA A 97 127.258 2.403 0.123 1.00 0.00 O ATOM 1541 CB ALA A 97 130.421 1.964 0.236 1.00 0.00 C ATOM 0 H ALA A 97 130.352 1.369 -2.321 1.00 0.00 H new ATOM 0 HA ALA A 97 128.915 0.426 0.129 1.00 0.00 H new ATOM 0 HB1 ALA A 97 130.069 2.347 1.194 1.00 0.00 H new ATOM 0 HB2 ALA A 97 131.236 1.260 0.404 1.00 0.00 H new ATOM 0 HB3 ALA A 97 130.778 2.792 -0.377 1.00 0.00 H new ATOM 1547 N GLY A 98 128.118 2.905 -1.844 1.00 0.00 N ATOM 1548 CA GLY A 98 127.030 3.885 -2.137 1.00 0.00 C ATOM 1549 C GLY A 98 127.577 5.010 -3.033 1.00 0.00 C ATOM 1550 O GLY A 98 128.702 4.941 -3.485 1.00 0.00 O ATOM 0 H GLY A 98 128.821 2.809 -2.577 1.00 0.00 H new ATOM 0 HA2 GLY A 98 126.199 3.383 -2.632 1.00 0.00 H new ATOM 0 HA3 GLY A 98 126.642 4.302 -1.208 1.00 0.00 H new ATOM 1554 N GLY A 99 126.809 6.052 -3.307 1.00 0.00 N ATOM 1555 CA GLY A 99 125.415 6.173 -2.768 1.00 0.00 C ATOM 1556 C GLY A 99 124.436 5.473 -3.714 1.00 0.00 C ATOM 1557 O GLY A 99 124.788 4.532 -4.399 1.00 0.00 O ATOM 0 H GLY A 99 127.101 6.834 -3.893 1.00 0.00 H new ATOM 0 HA2 GLY A 99 125.358 5.727 -1.775 1.00 0.00 H new ATOM 0 HA3 GLY A 99 125.145 7.224 -2.662 1.00 0.00 H new ATOM 1561 N ALA A 100 123.210 5.930 -3.755 1.00 0.00 N ATOM 1562 CA ALA A 100 122.197 5.300 -4.655 1.00 0.00 C ATOM 1563 C ALA A 100 122.634 5.459 -6.112 1.00 0.00 C ATOM 1564 O ALA A 100 122.332 4.632 -6.951 1.00 0.00 O ATOM 1565 CB ALA A 100 120.842 5.979 -4.453 1.00 0.00 C ATOM 0 H ALA A 100 122.866 6.715 -3.202 1.00 0.00 H new ATOM 0 HA ALA A 100 122.112 4.240 -4.416 1.00 0.00 H new ATOM 0 HB1 ALA A 100 120.103 5.519 -5.110 1.00 0.00 H new ATOM 0 HB2 ALA A 100 120.528 5.863 -3.416 1.00 0.00 H new ATOM 0 HB3 ALA A 100 120.928 7.040 -4.690 1.00 0.00 H new ATOM 1571 N GLN A 101 123.343 6.516 -6.416 1.00 0.00 N ATOM 1572 CA GLN A 101 123.804 6.739 -7.818 1.00 0.00 C ATOM 1573 C GLN A 101 124.746 5.606 -8.235 1.00 0.00 C ATOM 1574 O GLN A 101 124.830 5.257 -9.397 1.00 0.00 O ATOM 1575 CB GLN A 101 124.543 8.076 -7.905 1.00 0.00 C ATOM 1576 CG GLN A 101 123.532 9.207 -8.110 1.00 0.00 C ATOM 1577 CD GLN A 101 124.263 10.550 -8.113 1.00 0.00 C ATOM 1578 OE1 GLN A 101 125.046 10.832 -7.227 1.00 0.00 O ATOM 1579 NE2 GLN A 101 124.038 11.400 -9.078 1.00 0.00 N ATOM 0 H GLN A 101 123.623 7.236 -5.750 1.00 0.00 H new ATOM 0 HA GLN A 101 122.942 6.756 -8.485 1.00 0.00 H new ATOM 0 HB2 GLN A 101 125.116 8.247 -6.993 1.00 0.00 H new ATOM 0 HB3 GLN A 101 125.255 8.057 -8.730 1.00 0.00 H new ATOM 0 HG2 GLN A 101 123.001 9.068 -9.052 1.00 0.00 H new ATOM 0 HG3 GLN A 101 122.785 9.189 -7.317 1.00 0.00 H new ATOM 0 HE21 GLN A 101 123.381 11.165 -9.822 1.00 0.00 H new ATOM 0 HE22 GLN A 101 124.519 12.299 -9.088 1.00 0.00 H new ATOM 1588 N ILE A 102 125.455 5.035 -7.294 1.00 0.00 N ATOM 1589 CA ILE A 102 126.396 3.925 -7.628 1.00 0.00 C ATOM 1590 C ILE A 102 125.634 2.598 -7.647 1.00 0.00 C ATOM 1591 O ILE A 102 125.897 1.736 -8.464 1.00 0.00 O ATOM 1592 CB ILE A 102 127.507 3.863 -6.574 1.00 0.00 C ATOM 1593 CG1 ILE A 102 128.182 5.240 -6.448 1.00 0.00 C ATOM 1594 CG2 ILE A 102 128.545 2.813 -6.980 1.00 0.00 C ATOM 1595 CD1 ILE A 102 128.796 5.660 -7.791 1.00 0.00 C ATOM 0 H ILE A 102 125.422 5.291 -6.307 1.00 0.00 H new ATOM 0 HA ILE A 102 126.836 4.104 -8.609 1.00 0.00 H new ATOM 0 HB ILE A 102 127.074 3.587 -5.612 1.00 0.00 H new ATOM 0 HG12 ILE A 102 127.451 5.982 -6.127 1.00 0.00 H new ATOM 0 HG13 ILE A 102 128.957 5.204 -5.682 1.00 0.00 H new ATOM 0 HG21 ILE A 102 129.334 2.771 -6.229 1.00 0.00 H new ATOM 0 HG22 ILE A 102 128.065 1.837 -7.057 1.00 0.00 H new ATOM 0 HG23 ILE A 102 128.976 3.082 -7.944 1.00 0.00 H new ATOM 0 HD11 ILE A 102 129.270 6.636 -7.685 1.00 0.00 H new ATOM 0 HD12 ILE A 102 129.542 4.926 -8.095 1.00 0.00 H new ATOM 0 HD13 ILE A 102 128.013 5.717 -8.547 1.00 0.00 H new ATOM 1607 N PHE A 103 124.693 2.429 -6.752 1.00 0.00 N ATOM 1608 CA PHE A 103 123.911 1.159 -6.714 1.00 0.00 C ATOM 1609 C PHE A 103 123.071 1.038 -7.989 1.00 0.00 C ATOM 1610 O PHE A 103 122.926 -0.035 -8.546 1.00 0.00 O ATOM 1611 CB PHE A 103 122.984 1.159 -5.493 1.00 0.00 C ATOM 1612 CG PHE A 103 123.799 1.113 -4.217 1.00 0.00 C ATOM 1613 CD1 PHE A 103 124.834 0.178 -4.067 1.00 0.00 C ATOM 1614 CD2 PHE A 103 123.511 2.006 -3.176 1.00 0.00 C ATOM 1615 CE1 PHE A 103 125.576 0.137 -2.881 1.00 0.00 C ATOM 1616 CE2 PHE A 103 124.255 1.966 -1.991 1.00 0.00 C ATOM 1617 CZ PHE A 103 125.287 1.031 -1.843 1.00 0.00 C ATOM 0 H PHE A 103 124.434 3.118 -6.046 1.00 0.00 H new ATOM 0 HA PHE A 103 124.598 0.315 -6.647 1.00 0.00 H new ATOM 0 HB2 PHE A 103 122.359 2.052 -5.502 1.00 0.00 H new ATOM 0 HB3 PHE A 103 122.314 0.300 -5.536 1.00 0.00 H new ATOM 0 HD1 PHE A 103 125.059 -0.511 -4.868 1.00 0.00 H new ATOM 0 HD2 PHE A 103 122.714 2.726 -3.288 1.00 0.00 H new ATOM 0 HE1 PHE A 103 126.372 -0.584 -2.767 1.00 0.00 H new ATOM 0 HE2 PHE A 103 124.033 2.656 -1.191 1.00 0.00 H new ATOM 0 HZ PHE A 103 125.860 1.000 -0.928 1.00 0.00 H new ATOM 1627 N THR A 104 122.517 2.130 -8.451 1.00 0.00 N ATOM 1628 CA THR A 104 121.682 2.089 -9.689 1.00 0.00 C ATOM 1629 C THR A 104 122.545 1.659 -10.876 1.00 0.00 C ATOM 1630 O THR A 104 122.070 1.030 -11.803 1.00 0.00 O ATOM 1631 CB THR A 104 121.103 3.480 -9.959 1.00 0.00 C ATOM 1632 OG1 THR A 104 120.523 3.989 -8.766 1.00 0.00 O ATOM 1633 CG2 THR A 104 120.034 3.389 -11.049 1.00 0.00 C ATOM 0 H THR A 104 122.608 3.051 -8.022 1.00 0.00 H new ATOM 0 HA THR A 104 120.870 1.375 -9.554 1.00 0.00 H new ATOM 0 HB THR A 104 121.899 4.146 -10.290 1.00 0.00 H new ATOM 0 HG1 THR A 104 121.211 4.442 -8.235 1.00 0.00 H new ATOM 0 HG21 THR A 104 119.623 4.381 -11.239 1.00 0.00 H new ATOM 0 HG22 THR A 104 120.480 2.999 -11.964 1.00 0.00 H new ATOM 0 HG23 THR A 104 119.236 2.723 -10.721 1.00 0.00 H new ATOM 1641 N ALA A 105 123.810 1.998 -10.856 1.00 0.00 N ATOM 1642 CA ALA A 105 124.712 1.615 -11.982 1.00 0.00 C ATOM 1643 C ALA A 105 125.032 0.121 -11.898 1.00 0.00 C ATOM 1644 O ALA A 105 125.134 -0.557 -12.904 1.00 0.00 O ATOM 1645 CB ALA A 105 126.011 2.419 -11.890 1.00 0.00 C ATOM 0 H ALA A 105 124.257 2.525 -10.106 1.00 0.00 H new ATOM 0 HA ALA A 105 124.217 1.827 -12.930 1.00 0.00 H new ATOM 0 HB1 ALA A 105 126.671 2.140 -12.712 1.00 0.00 H new ATOM 0 HB2 ALA A 105 125.785 3.484 -11.951 1.00 0.00 H new ATOM 0 HB3 ALA A 105 126.504 2.207 -10.941 1.00 0.00 H new ATOM 1651 N PHE A 106 125.191 -0.394 -10.705 1.00 0.00 N ATOM 1652 CA PHE A 106 125.506 -1.845 -10.547 1.00 0.00 C ATOM 1653 C PHE A 106 124.305 -2.565 -9.929 1.00 0.00 C ATOM 1654 O PHE A 106 124.458 -3.456 -9.116 1.00 0.00 O ATOM 1655 CB PHE A 106 126.723 -2.002 -9.635 1.00 0.00 C ATOM 1656 CG PHE A 106 127.878 -1.205 -10.194 1.00 0.00 C ATOM 1657 CD1 PHE A 106 128.441 -1.557 -11.426 1.00 0.00 C ATOM 1658 CD2 PHE A 106 128.385 -0.113 -9.479 1.00 0.00 C ATOM 1659 CE1 PHE A 106 129.512 -0.818 -11.944 1.00 0.00 C ATOM 1660 CE2 PHE A 106 129.455 0.626 -9.997 1.00 0.00 C ATOM 1661 CZ PHE A 106 130.018 0.274 -11.229 1.00 0.00 C ATOM 0 H PHE A 106 125.116 0.129 -9.833 1.00 0.00 H new ATOM 0 HA PHE A 106 125.724 -2.280 -11.523 1.00 0.00 H new ATOM 0 HB2 PHE A 106 126.483 -1.658 -8.629 1.00 0.00 H new ATOM 0 HB3 PHE A 106 126.998 -3.054 -9.555 1.00 0.00 H new ATOM 0 HD1 PHE A 106 128.049 -2.399 -11.978 1.00 0.00 H new ATOM 0 HD2 PHE A 106 127.951 0.159 -8.528 1.00 0.00 H new ATOM 0 HE1 PHE A 106 129.947 -1.090 -12.894 1.00 0.00 H new ATOM 0 HE2 PHE A 106 129.846 1.468 -9.446 1.00 0.00 H new ATOM 0 HZ PHE A 106 130.843 0.845 -11.628 1.00 0.00 H new ATOM 1671 N LYS A 107 123.112 -2.182 -10.310 1.00 0.00 N ATOM 1672 CA LYS A 107 121.894 -2.838 -9.751 1.00 0.00 C ATOM 1673 C LYS A 107 121.885 -4.318 -10.138 1.00 0.00 C ATOM 1674 O LYS A 107 121.784 -5.187 -9.293 1.00 0.00 O ATOM 1675 CB LYS A 107 120.645 -2.156 -10.314 1.00 0.00 C ATOM 1676 CG LYS A 107 119.473 -2.358 -9.352 1.00 0.00 C ATOM 1677 CD LYS A 107 118.155 -2.211 -10.114 1.00 0.00 C ATOM 1678 CE LYS A 107 117.004 -2.724 -9.247 1.00 0.00 C ATOM 1679 NZ LYS A 107 115.890 -3.185 -10.123 1.00 0.00 N ATOM 0 H LYS A 107 122.930 -1.441 -10.987 1.00 0.00 H new ATOM 0 HA LYS A 107 121.900 -2.748 -8.665 1.00 0.00 H new ATOM 0 HB2 LYS A 107 120.832 -1.092 -10.457 1.00 0.00 H new ATOM 0 HB3 LYS A 107 120.401 -2.571 -11.292 1.00 0.00 H new ATOM 0 HG2 LYS A 107 119.532 -3.345 -8.893 1.00 0.00 H new ATOM 0 HG3 LYS A 107 119.522 -1.628 -8.544 1.00 0.00 H new ATOM 0 HD2 LYS A 107 117.989 -1.166 -10.376 1.00 0.00 H new ATOM 0 HD3 LYS A 107 118.198 -2.771 -11.048 1.00 0.00 H new ATOM 0 HE2 LYS A 107 117.347 -3.543 -8.616 1.00 0.00 H new ATOM 0 HE3 LYS A 107 116.655 -1.934 -8.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 115.107 -3.534 -9.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 115.557 -2.392 -10.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 116.228 -3.951 -10.740 1.00 0.00 H new ATOM 1693 N ASP A 108 121.988 -4.608 -11.410 1.00 0.00 N ATOM 1694 CA ASP A 108 121.986 -6.032 -11.863 1.00 0.00 C ATOM 1695 C ASP A 108 123.423 -6.472 -12.165 1.00 0.00 C ATOM 1696 O ASP A 108 123.717 -6.982 -13.231 1.00 0.00 O ATOM 1697 CB ASP A 108 121.127 -6.162 -13.124 1.00 0.00 C ATOM 1698 CG ASP A 108 119.654 -5.956 -12.762 1.00 0.00 C ATOM 1699 OD1 ASP A 108 119.176 -6.655 -11.886 1.00 0.00 O ATOM 1700 OD2 ASP A 108 119.030 -5.101 -13.370 1.00 0.00 O ATOM 0 H ASP A 108 122.074 -3.918 -12.156 1.00 0.00 H new ATOM 0 HA ASP A 108 121.573 -6.667 -11.079 1.00 0.00 H new ATOM 0 HB2 ASP A 108 121.437 -5.425 -13.865 1.00 0.00 H new ATOM 0 HB3 ASP A 108 121.268 -7.145 -13.573 1.00 0.00 H new ATOM 1705 N ASP A 109 124.320 -6.275 -11.231 1.00 0.00 N ATOM 1706 CA ASP A 109 125.740 -6.677 -11.453 1.00 0.00 C ATOM 1707 C ASP A 109 126.374 -7.076 -10.118 1.00 0.00 C ATOM 1708 O ASP A 109 127.524 -6.776 -9.854 1.00 0.00 O ATOM 1709 CB ASP A 109 126.511 -5.501 -12.057 1.00 0.00 C ATOM 1710 CG ASP A 109 126.007 -5.235 -13.477 1.00 0.00 C ATOM 1711 OD1 ASP A 109 126.531 -5.843 -14.394 1.00 0.00 O ATOM 1712 OD2 ASP A 109 125.103 -4.428 -13.621 1.00 0.00 O ATOM 0 H ASP A 109 124.128 -5.852 -10.323 1.00 0.00 H new ATOM 0 HA ASP A 109 125.777 -7.525 -12.137 1.00 0.00 H new ATOM 0 HB2 ASP A 109 126.380 -4.612 -11.441 1.00 0.00 H new ATOM 0 HB3 ASP A 109 127.578 -5.722 -12.074 1.00 0.00 H new ATOM 1717 N VAL A 110 125.633 -7.753 -9.279 1.00 0.00 N ATOM 1718 CA VAL A 110 126.184 -8.178 -7.958 1.00 0.00 C ATOM 1719 C VAL A 110 125.556 -9.519 -7.553 1.00 0.00 C ATOM 1720 O VAL A 110 124.409 -9.792 -7.855 1.00 0.00 O ATOM 1721 CB VAL A 110 125.872 -7.100 -6.908 1.00 0.00 C ATOM 1722 CG1 VAL A 110 124.356 -6.919 -6.777 1.00 0.00 C ATOM 1723 CG2 VAL A 110 126.455 -7.511 -5.550 1.00 0.00 C ATOM 0 H VAL A 110 124.667 -8.030 -9.453 1.00 0.00 H new ATOM 0 HA VAL A 110 127.265 -8.302 -8.027 1.00 0.00 H new ATOM 0 HB VAL A 110 126.321 -6.159 -7.226 1.00 0.00 H new ATOM 0 HG11 VAL A 110 124.144 -6.153 -6.031 1.00 0.00 H new ATOM 0 HG12 VAL A 110 123.942 -6.614 -7.738 1.00 0.00 H new ATOM 0 HG13 VAL A 110 123.902 -7.861 -6.469 1.00 0.00 H new ATOM 0 HG21 VAL A 110 126.230 -6.743 -4.810 1.00 0.00 H new ATOM 0 HG22 VAL A 110 126.014 -8.457 -5.236 1.00 0.00 H new ATOM 0 HG23 VAL A 110 127.535 -7.626 -5.638 1.00 0.00 H new ATOM 1733 N ASP A 111 126.303 -10.349 -6.871 1.00 0.00 N ATOM 1734 CA ASP A 111 125.762 -11.672 -6.439 1.00 0.00 C ATOM 1735 C ASP A 111 125.564 -11.669 -4.922 1.00 0.00 C ATOM 1736 O ASP A 111 124.527 -12.062 -4.423 1.00 0.00 O ATOM 1737 CB ASP A 111 126.747 -12.777 -6.823 1.00 0.00 C ATOM 1738 CG ASP A 111 126.574 -13.126 -8.302 1.00 0.00 C ATOM 1739 OD1 ASP A 111 126.483 -12.208 -9.101 1.00 0.00 O ATOM 1740 OD2 ASP A 111 126.535 -14.306 -8.612 1.00 0.00 O ATOM 0 H ASP A 111 127.268 -10.166 -6.594 1.00 0.00 H new ATOM 0 HA ASP A 111 124.806 -11.852 -6.931 1.00 0.00 H new ATOM 0 HB2 ASP A 111 127.769 -12.449 -6.633 1.00 0.00 H new ATOM 0 HB3 ASP A 111 126.576 -13.660 -6.208 1.00 0.00 H new ATOM 1745 N THR A 112 126.553 -11.225 -4.190 1.00 0.00 N ATOM 1746 CA THR A 112 126.435 -11.189 -2.703 1.00 0.00 C ATOM 1747 C THR A 112 125.889 -9.826 -2.271 1.00 0.00 C ATOM 1748 O THR A 112 126.213 -8.808 -2.853 1.00 0.00 O ATOM 1749 CB THR A 112 127.813 -11.411 -2.075 1.00 0.00 C ATOM 1750 OG1 THR A 112 128.449 -12.511 -2.711 1.00 0.00 O ATOM 1751 CG2 THR A 112 127.656 -11.701 -0.582 1.00 0.00 C ATOM 0 H THR A 112 127.440 -10.885 -4.560 1.00 0.00 H new ATOM 0 HA THR A 112 125.756 -11.975 -2.372 1.00 0.00 H new ATOM 0 HB THR A 112 128.421 -10.515 -2.205 1.00 0.00 H new ATOM 0 HG1 THR A 112 129.332 -12.654 -2.311 1.00 0.00 H new ATOM 0 HG21 THR A 112 128.638 -11.859 -0.137 1.00 0.00 H new ATOM 0 HG22 THR A 112 127.169 -10.855 -0.096 1.00 0.00 H new ATOM 0 HG23 THR A 112 127.049 -12.596 -0.447 1.00 0.00 H new ATOM 1759 N LEU A 113 125.064 -9.801 -1.254 1.00 0.00 N ATOM 1760 CA LEU A 113 124.493 -8.507 -0.781 1.00 0.00 C ATOM 1761 C LEU A 113 124.608 -8.418 0.743 1.00 0.00 C ATOM 1762 O LEU A 113 123.891 -9.083 1.467 1.00 0.00 O ATOM 1763 CB LEU A 113 123.020 -8.422 -1.184 1.00 0.00 C ATOM 1764 CG LEU A 113 122.889 -8.613 -2.695 1.00 0.00 C ATOM 1765 CD1 LEU A 113 121.441 -8.966 -3.040 1.00 0.00 C ATOM 1766 CD2 LEU A 113 123.280 -7.316 -3.406 1.00 0.00 C ATOM 0 H LEU A 113 124.762 -10.623 -0.731 1.00 0.00 H new ATOM 0 HA LEU A 113 125.045 -7.683 -1.234 1.00 0.00 H new ATOM 0 HB2 LEU A 113 122.445 -9.185 -0.660 1.00 0.00 H new ATOM 0 HB3 LEU A 113 122.608 -7.456 -0.892 1.00 0.00 H new ATOM 0 HG LEU A 113 123.547 -9.419 -3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 113 121.347 -9.102 -4.117 1.00 0.00 H new ATOM 0 HD12 LEU A 113 121.160 -9.888 -2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 113 120.783 -8.159 -2.717 1.00 0.00 H new ATOM 0 HD21 LEU A 113 123.187 -7.450 -4.484 1.00 0.00 H new ATOM 0 HD22 LEU A 113 122.621 -6.511 -3.082 1.00 0.00 H new ATOM 0 HD23 LEU A 113 124.311 -7.062 -3.159 1.00 0.00 H new ATOM 1778 N LEU A 114 125.503 -7.597 1.231 1.00 0.00 N ATOM 1779 CA LEU A 114 125.669 -7.452 2.706 1.00 0.00 C ATOM 1780 C LEU A 114 124.838 -6.265 3.194 1.00 0.00 C ATOM 1781 O LEU A 114 124.946 -5.168 2.678 1.00 0.00 O ATOM 1782 CB LEU A 114 127.145 -7.209 3.032 1.00 0.00 C ATOM 1783 CG LEU A 114 127.885 -8.547 3.081 1.00 0.00 C ATOM 1784 CD1 LEU A 114 129.348 -8.335 2.690 1.00 0.00 C ATOM 1785 CD2 LEU A 114 127.813 -9.115 4.500 1.00 0.00 C ATOM 0 H LEU A 114 126.127 -7.020 0.668 1.00 0.00 H new ATOM 0 HA LEU A 114 125.333 -8.362 3.202 1.00 0.00 H new ATOM 0 HB2 LEU A 114 127.593 -6.561 2.278 1.00 0.00 H new ATOM 0 HB3 LEU A 114 127.237 -6.695 3.989 1.00 0.00 H new ATOM 0 HG LEU A 114 127.421 -9.246 2.385 1.00 0.00 H new ATOM 0 HD11 LEU A 114 129.876 -9.288 2.725 1.00 0.00 H new ATOM 0 HD12 LEU A 114 129.399 -7.928 1.680 1.00 0.00 H new ATOM 0 HD13 LEU A 114 129.813 -7.637 3.386 1.00 0.00 H new ATOM 0 HD21 LEU A 114 128.340 -10.069 4.537 1.00 0.00 H new ATOM 0 HD22 LEU A 114 128.278 -8.416 5.196 1.00 0.00 H new ATOM 0 HD23 LEU A 114 126.770 -9.265 4.779 1.00 0.00 H new ATOM 1797 N VAL A 115 124.006 -6.476 4.184 1.00 0.00 N ATOM 1798 CA VAL A 115 123.161 -5.363 4.708 1.00 0.00 C ATOM 1799 C VAL A 115 123.101 -5.442 6.239 1.00 0.00 C ATOM 1800 O VAL A 115 123.121 -6.513 6.815 1.00 0.00 O ATOM 1801 CB VAL A 115 121.749 -5.476 4.111 1.00 0.00 C ATOM 1802 CG1 VAL A 115 121.116 -6.812 4.510 1.00 0.00 C ATOM 1803 CG2 VAL A 115 120.875 -4.326 4.622 1.00 0.00 C ATOM 0 H VAL A 115 123.877 -7.373 4.651 1.00 0.00 H new ATOM 0 HA VAL A 115 123.592 -4.403 4.423 1.00 0.00 H new ATOM 0 HB VAL A 115 121.821 -5.422 3.025 1.00 0.00 H new ATOM 0 HG11 VAL A 115 120.116 -6.883 4.082 1.00 0.00 H new ATOM 0 HG12 VAL A 115 121.730 -7.632 4.136 1.00 0.00 H new ATOM 0 HG13 VAL A 115 121.051 -6.874 5.596 1.00 0.00 H new ATOM 0 HG21 VAL A 115 119.876 -4.411 4.196 1.00 0.00 H new ATOM 0 HG22 VAL A 115 120.811 -4.373 5.709 1.00 0.00 H new ATOM 0 HG23 VAL A 115 121.316 -3.374 4.325 1.00 0.00 H new ATOM 1813 N THR A 116 123.025 -4.311 6.895 1.00 0.00 N ATOM 1814 CA THR A 116 122.960 -4.308 8.386 1.00 0.00 C ATOM 1815 C THR A 116 121.608 -3.750 8.835 1.00 0.00 C ATOM 1816 O THR A 116 121.380 -2.555 8.807 1.00 0.00 O ATOM 1817 CB THR A 116 124.084 -3.431 8.944 1.00 0.00 C ATOM 1818 OG1 THR A 116 125.321 -3.831 8.372 1.00 0.00 O ATOM 1819 CG2 THR A 116 124.148 -3.588 10.465 1.00 0.00 C ATOM 0 H THR A 116 123.005 -3.389 6.460 1.00 0.00 H new ATOM 0 HA THR A 116 123.075 -5.326 8.757 1.00 0.00 H new ATOM 0 HB THR A 116 123.889 -2.387 8.697 1.00 0.00 H new ATOM 0 HG1 THR A 116 125.914 -4.165 9.077 1.00 0.00 H new ATOM 0 HG21 THR A 116 124.948 -2.963 10.862 1.00 0.00 H new ATOM 0 HG22 THR A 116 123.198 -3.282 10.903 1.00 0.00 H new ATOM 0 HG23 THR A 116 124.343 -4.631 10.715 1.00 0.00 H new ATOM 1827 N ARG A 117 120.711 -4.609 9.248 1.00 0.00 N ATOM 1828 CA ARG A 117 119.368 -4.139 9.700 1.00 0.00 C ATOM 1829 C ARG A 117 119.465 -3.608 11.131 1.00 0.00 C ATOM 1830 O ARG A 117 120.072 -4.223 11.989 1.00 0.00 O ATOM 1831 CB ARG A 117 118.379 -5.306 9.658 1.00 0.00 C ATOM 1832 CG ARG A 117 118.127 -5.714 8.205 1.00 0.00 C ATOM 1833 CD ARG A 117 116.870 -6.584 8.122 1.00 0.00 C ATOM 1834 NE ARG A 117 117.258 -8.030 8.142 1.00 0.00 N ATOM 1835 CZ ARG A 117 117.420 -8.694 9.272 1.00 0.00 C ATOM 1836 NH1 ARG A 117 117.246 -8.127 10.443 1.00 0.00 N ATOM 1837 NH2 ARG A 117 117.762 -9.953 9.222 1.00 0.00 N ATOM 0 H ARG A 117 120.852 -5.618 9.291 1.00 0.00 H new ATOM 0 HA ARG A 117 119.023 -3.343 9.040 1.00 0.00 H new ATOM 0 HB2 ARG A 117 118.775 -6.152 10.220 1.00 0.00 H new ATOM 0 HB3 ARG A 117 117.441 -5.018 10.133 1.00 0.00 H new ATOM 0 HG2 ARG A 117 118.008 -4.826 7.584 1.00 0.00 H new ATOM 0 HG3 ARG A 117 118.986 -6.262 7.817 1.00 0.00 H new ATOM 0 HD2 ARG A 117 116.207 -6.363 8.958 1.00 0.00 H new ATOM 0 HD3 ARG A 117 116.318 -6.358 7.210 1.00 0.00 H new ATOM 0 HE ARG A 117 117.401 -8.516 7.257 1.00 0.00 H new ATOM 0 HH11 ARG A 117 116.977 -7.145 10.499 1.00 0.00 H new ATOM 0 HH12 ARG A 117 117.379 -8.669 11.297 1.00 0.00 H new ATOM 0 HH21 ARG A 117 117.900 -10.409 8.320 1.00 0.00 H new ATOM 0 HH22 ARG A 117 117.891 -10.481 10.085 1.00 0.00 H new ATOM 1851 N LEU A 118 118.870 -2.473 11.392 1.00 0.00 N ATOM 1852 CA LEU A 118 118.920 -1.894 12.767 1.00 0.00 C ATOM 1853 C LEU A 118 117.576 -2.124 13.463 1.00 0.00 C ATOM 1854 O LEU A 118 116.615 -2.549 12.848 1.00 0.00 O ATOM 1855 CB LEU A 118 119.199 -0.392 12.678 1.00 0.00 C ATOM 1856 CG LEU A 118 120.700 -0.141 12.832 1.00 0.00 C ATOM 1857 CD1 LEU A 118 121.373 -0.215 11.461 1.00 0.00 C ATOM 1858 CD2 LEU A 118 120.926 1.246 13.436 1.00 0.00 C ATOM 0 H LEU A 118 118.350 -1.921 10.710 1.00 0.00 H new ATOM 0 HA LEU A 118 119.713 -2.376 13.338 1.00 0.00 H new ATOM 0 HB2 LEU A 118 118.851 -0.003 11.721 1.00 0.00 H new ATOM 0 HB3 LEU A 118 118.649 0.137 13.456 1.00 0.00 H new ATOM 0 HG LEU A 118 121.129 -0.898 13.489 1.00 0.00 H new ATOM 0 HD11 LEU A 118 122.443 -0.036 11.571 1.00 0.00 H new ATOM 0 HD12 LEU A 118 121.213 -1.203 11.030 1.00 0.00 H new ATOM 0 HD13 LEU A 118 120.944 0.542 10.804 1.00 0.00 H new ATOM 0 HD21 LEU A 118 121.996 1.425 13.546 1.00 0.00 H new ATOM 0 HD22 LEU A 118 120.497 2.003 12.780 1.00 0.00 H new ATOM 0 HD23 LEU A 118 120.447 1.300 14.414 1.00 0.00 H new ATOM 1870 N ALA A 119 117.504 -1.846 14.739 1.00 0.00 N ATOM 1871 CA ALA A 119 116.226 -2.047 15.484 1.00 0.00 C ATOM 1872 C ALA A 119 115.565 -0.691 15.739 1.00 0.00 C ATOM 1873 O ALA A 119 114.360 -0.553 15.653 1.00 0.00 O ATOM 1874 CB ALA A 119 116.516 -2.733 16.820 1.00 0.00 C ATOM 0 H ALA A 119 118.278 -1.487 15.298 1.00 0.00 H new ATOM 0 HA ALA A 119 115.556 -2.672 14.893 1.00 0.00 H new ATOM 0 HB1 ALA A 119 115.583 -2.880 17.364 1.00 0.00 H new ATOM 0 HB2 ALA A 119 116.986 -3.700 16.638 1.00 0.00 H new ATOM 0 HB3 ALA A 119 117.186 -2.109 17.411 1.00 0.00 H new ATOM 1880 N GLY A 120 116.349 0.311 16.054 1.00 0.00 N ATOM 1881 CA GLY A 120 115.775 1.663 16.318 1.00 0.00 C ATOM 1882 C GLY A 120 115.246 2.259 15.011 1.00 0.00 C ATOM 1883 O GLY A 120 115.850 2.113 13.966 1.00 0.00 O ATOM 0 H GLY A 120 117.364 0.249 16.139 1.00 0.00 H new ATOM 0 HA2 GLY A 120 114.970 1.591 17.049 1.00 0.00 H new ATOM 0 HA3 GLY A 120 116.536 2.316 16.745 1.00 0.00 H new ATOM 1887 N SER A 121 114.124 2.929 15.068 1.00 0.00 N ATOM 1888 CA SER A 121 113.546 3.540 13.834 1.00 0.00 C ATOM 1889 C SER A 121 114.247 4.870 13.549 1.00 0.00 C ATOM 1890 O SER A 121 114.594 5.605 14.454 1.00 0.00 O ATOM 1891 CB SER A 121 112.052 3.786 14.040 1.00 0.00 C ATOM 1892 OG SER A 121 111.873 4.813 15.006 1.00 0.00 O ATOM 0 H SER A 121 113.582 3.080 15.919 1.00 0.00 H new ATOM 0 HA SER A 121 113.690 2.864 12.991 1.00 0.00 H new ATOM 0 HB2 SER A 121 111.586 4.073 13.097 1.00 0.00 H new ATOM 0 HB3 SER A 121 111.563 2.870 14.372 1.00 0.00 H new ATOM 0 HG SER A 121 110.915 4.974 15.139 1.00 0.00 H new ATOM 1898 N PHE A 122 114.455 5.181 12.295 1.00 0.00 N ATOM 1899 CA PHE A 122 115.133 6.462 11.938 1.00 0.00 C ATOM 1900 C PHE A 122 114.485 7.049 10.682 1.00 0.00 C ATOM 1901 O PHE A 122 114.161 6.336 9.750 1.00 0.00 O ATOM 1902 CB PHE A 122 116.616 6.197 11.669 1.00 0.00 C ATOM 1903 CG PHE A 122 117.263 5.638 12.914 1.00 0.00 C ATOM 1904 CD1 PHE A 122 117.635 6.497 13.955 1.00 0.00 C ATOM 1905 CD2 PHE A 122 117.489 4.261 13.029 1.00 0.00 C ATOM 1906 CE1 PHE A 122 118.234 5.979 15.110 1.00 0.00 C ATOM 1907 CE2 PHE A 122 118.088 3.744 14.183 1.00 0.00 C ATOM 1908 CZ PHE A 122 118.460 4.603 15.223 1.00 0.00 C ATOM 0 H PHE A 122 114.183 4.601 11.501 1.00 0.00 H new ATOM 0 HA PHE A 122 115.033 7.168 12.763 1.00 0.00 H new ATOM 0 HB2 PHE A 122 116.727 5.495 10.843 1.00 0.00 H new ATOM 0 HB3 PHE A 122 117.113 7.120 11.372 1.00 0.00 H new ATOM 0 HD1 PHE A 122 117.460 7.559 13.867 1.00 0.00 H new ATOM 0 HD2 PHE A 122 117.201 3.598 12.227 1.00 0.00 H new ATOM 0 HE1 PHE A 122 118.521 6.641 15.913 1.00 0.00 H new ATOM 0 HE2 PHE A 122 118.263 2.682 14.271 1.00 0.00 H new ATOM 0 HZ PHE A 122 118.922 4.203 16.114 1.00 0.00 H new ATOM 1918 N GLU A 123 114.293 8.344 10.654 1.00 0.00 N ATOM 1919 CA GLU A 123 113.665 8.988 9.463 1.00 0.00 C ATOM 1920 C GLU A 123 114.698 9.863 8.752 1.00 0.00 C ATOM 1921 O GLU A 123 115.511 10.514 9.382 1.00 0.00 O ATOM 1922 CB GLU A 123 112.486 9.853 9.913 1.00 0.00 C ATOM 1923 CG GLU A 123 112.953 10.835 10.989 1.00 0.00 C ATOM 1924 CD GLU A 123 111.858 11.871 11.248 1.00 0.00 C ATOM 1925 OE1 GLU A 123 110.907 11.539 11.936 1.00 0.00 O ATOM 1926 OE2 GLU A 123 111.987 12.978 10.751 1.00 0.00 O ATOM 0 H GLU A 123 114.545 8.984 11.407 1.00 0.00 H new ATOM 0 HA GLU A 123 113.310 8.218 8.779 1.00 0.00 H new ATOM 0 HB2 GLU A 123 112.076 10.397 9.063 1.00 0.00 H new ATOM 0 HB3 GLU A 123 111.687 9.223 10.303 1.00 0.00 H new ATOM 0 HG2 GLU A 123 113.185 10.299 11.909 1.00 0.00 H new ATOM 0 HG3 GLU A 123 113.869 11.332 10.670 1.00 0.00 H new ATOM 1933 N GLY A 124 114.671 9.881 7.443 1.00 0.00 N ATOM 1934 CA GLY A 124 115.649 10.712 6.681 1.00 0.00 C ATOM 1935 C GLY A 124 115.177 10.854 5.232 1.00 0.00 C ATOM 1936 O GLY A 124 114.060 10.506 4.899 1.00 0.00 O ATOM 0 H GLY A 124 114.012 9.355 6.869 1.00 0.00 H new ATOM 0 HA2 GLY A 124 115.744 11.695 7.142 1.00 0.00 H new ATOM 0 HA3 GLY A 124 116.636 10.250 6.710 1.00 0.00 H new ATOM 1940 N ASP A 125 116.023 11.362 4.371 1.00 0.00 N ATOM 1941 CA ASP A 125 115.633 11.532 2.941 1.00 0.00 C ATOM 1942 C ASP A 125 116.358 10.490 2.087 1.00 0.00 C ATOM 1943 O ASP A 125 115.822 9.992 1.115 1.00 0.00 O ATOM 1944 CB ASP A 125 116.019 12.935 2.470 1.00 0.00 C ATOM 1945 CG ASP A 125 114.986 13.945 2.974 1.00 0.00 C ATOM 1946 OD1 ASP A 125 114.808 14.031 4.178 1.00 0.00 O ATOM 1947 OD2 ASP A 125 114.390 14.616 2.147 1.00 0.00 O ATOM 0 H ASP A 125 116.969 11.667 4.599 1.00 0.00 H new ATOM 0 HA ASP A 125 114.556 11.399 2.840 1.00 0.00 H new ATOM 0 HB2 ASP A 125 117.010 13.195 2.843 1.00 0.00 H new ATOM 0 HB3 ASP A 125 116.070 12.963 1.382 1.00 0.00 H new ATOM 1952 N THR A 126 117.573 10.159 2.444 1.00 0.00 N ATOM 1953 CA THR A 126 118.342 9.151 1.659 1.00 0.00 C ATOM 1954 C THR A 126 117.784 7.753 1.936 1.00 0.00 C ATOM 1955 O THR A 126 117.804 7.280 3.056 1.00 0.00 O ATOM 1956 CB THR A 126 119.816 9.200 2.067 1.00 0.00 C ATOM 1957 OG1 THR A 126 120.178 10.543 2.362 1.00 0.00 O ATOM 1958 CG2 THR A 126 120.684 8.676 0.922 1.00 0.00 C ATOM 0 H THR A 126 118.066 10.546 3.249 1.00 0.00 H new ATOM 0 HA THR A 126 118.251 9.375 0.596 1.00 0.00 H new ATOM 0 HB THR A 126 119.970 8.578 2.949 1.00 0.00 H new ATOM 0 HG1 THR A 126 121.121 10.577 2.625 1.00 0.00 H new ATOM 0 HG21 THR A 126 121.733 8.712 1.215 1.00 0.00 H new ATOM 0 HG22 THR A 126 120.405 7.647 0.696 1.00 0.00 H new ATOM 0 HG23 THR A 126 120.533 9.295 0.038 1.00 0.00 H new ATOM 1966 N LYS A 127 117.284 7.094 0.922 1.00 0.00 N ATOM 1967 CA LYS A 127 116.721 5.726 1.115 1.00 0.00 C ATOM 1968 C LYS A 127 117.451 4.740 0.201 1.00 0.00 C ATOM 1969 O LYS A 127 118.188 5.131 -0.684 1.00 0.00 O ATOM 1970 CB LYS A 127 115.230 5.735 0.768 1.00 0.00 C ATOM 1971 CG LYS A 127 114.439 6.345 1.927 1.00 0.00 C ATOM 1972 CD LYS A 127 113.015 6.658 1.465 1.00 0.00 C ATOM 1973 CE LYS A 127 112.106 6.820 2.684 1.00 0.00 C ATOM 1974 NZ LYS A 127 110.695 6.547 2.292 1.00 0.00 N ATOM 0 H LYS A 127 117.242 7.447 -0.034 1.00 0.00 H new ATOM 0 HA LYS A 127 116.851 5.423 2.154 1.00 0.00 H new ATOM 0 HB2 LYS A 127 115.061 6.309 -0.143 1.00 0.00 H new ATOM 0 HB3 LYS A 127 114.885 4.720 0.573 1.00 0.00 H new ATOM 0 HG2 LYS A 127 114.416 5.653 2.769 1.00 0.00 H new ATOM 0 HG3 LYS A 127 114.928 7.255 2.276 1.00 0.00 H new ATOM 0 HD2 LYS A 127 113.007 7.570 0.869 1.00 0.00 H new ATOM 0 HD3 LYS A 127 112.644 5.857 0.826 1.00 0.00 H new ATOM 0 HE2 LYS A 127 112.414 6.135 3.474 1.00 0.00 H new ATOM 0 HE3 LYS A 127 112.194 7.830 3.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 110.077 6.657 3.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 110.404 7.217 1.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 110.617 5.576 1.929 1.00 0.00 H new ATOM 1988 N MET A 128 117.249 3.464 0.413 1.00 0.00 N ATOM 1989 CA MET A 128 117.927 2.442 -0.439 1.00 0.00 C ATOM 1990 C MET A 128 117.031 2.095 -1.629 1.00 0.00 C ATOM 1991 O MET A 128 115.819 2.086 -1.522 1.00 0.00 O ATOM 1992 CB MET A 128 118.186 1.181 0.389 1.00 0.00 C ATOM 1993 CG MET A 128 119.105 0.239 -0.390 1.00 0.00 C ATOM 1994 SD MET A 128 120.773 0.937 -0.455 1.00 0.00 S ATOM 1995 CE MET A 128 121.566 -0.446 -1.311 1.00 0.00 C ATOM 0 H MET A 128 116.643 3.086 1.141 1.00 0.00 H new ATOM 0 HA MET A 128 118.874 2.841 -0.802 1.00 0.00 H new ATOM 0 HB2 MET A 128 118.643 1.447 1.342 1.00 0.00 H new ATOM 0 HB3 MET A 128 117.244 0.682 0.616 1.00 0.00 H new ATOM 0 HG2 MET A 128 119.128 -0.741 0.088 1.00 0.00 H new ATOM 0 HG3 MET A 128 118.721 0.093 -1.400 1.00 0.00 H new ATOM 0 HE1 MET A 128 122.634 -0.445 -1.093 1.00 0.00 H new ATOM 0 HE2 MET A 128 121.127 -1.384 -0.971 1.00 0.00 H new ATOM 0 HE3 MET A 128 121.415 -0.343 -2.386 1.00 0.00 H new ATOM 2005 N ILE A 129 117.621 1.812 -2.763 1.00 0.00 N ATOM 2006 CA ILE A 129 116.813 1.464 -3.968 1.00 0.00 C ATOM 2007 C ILE A 129 116.098 0.124 -3.738 1.00 0.00 C ATOM 2008 O ILE A 129 116.447 -0.605 -2.830 1.00 0.00 O ATOM 2009 CB ILE A 129 117.735 1.349 -5.184 1.00 0.00 C ATOM 2010 CG1 ILE A 129 118.862 0.360 -4.879 1.00 0.00 C ATOM 2011 CG2 ILE A 129 118.333 2.720 -5.502 1.00 0.00 C ATOM 2012 CD1 ILE A 129 119.498 -0.110 -6.188 1.00 0.00 C ATOM 0 H ILE A 129 118.631 1.807 -2.905 1.00 0.00 H new ATOM 0 HA ILE A 129 116.072 2.244 -4.146 1.00 0.00 H new ATOM 0 HB ILE A 129 117.162 0.994 -6.041 1.00 0.00 H new ATOM 0 HG12 ILE A 129 119.613 0.833 -4.247 1.00 0.00 H new ATOM 0 HG13 ILE A 129 118.471 -0.494 -4.326 1.00 0.00 H new ATOM 0 HG21 ILE A 129 118.990 2.638 -6.368 1.00 0.00 H new ATOM 0 HG22 ILE A 129 117.531 3.425 -5.720 1.00 0.00 H new ATOM 0 HG23 ILE A 129 118.905 3.075 -4.645 1.00 0.00 H new ATOM 0 HD11 ILE A 129 120.301 -0.814 -5.970 1.00 0.00 H new ATOM 0 HD12 ILE A 129 118.743 -0.599 -6.804 1.00 0.00 H new ATOM 0 HD13 ILE A 129 119.904 0.748 -6.724 1.00 0.00 H new ATOM 2024 N PRO A 130 115.116 -0.167 -4.565 1.00 0.00 N ATOM 2025 CA PRO A 130 114.289 -1.420 -4.521 1.00 0.00 C ATOM 2026 C PRO A 130 115.046 -2.568 -5.193 1.00 0.00 C ATOM 2027 O PRO A 130 115.246 -2.571 -6.393 1.00 0.00 O ATOM 2028 CB PRO A 130 113.000 -1.115 -5.282 1.00 0.00 C ATOM 2029 CG PRO A 130 113.214 0.180 -6.039 1.00 0.00 C ATOM 2030 CD PRO A 130 114.619 0.675 -5.713 1.00 0.00 C ATOM 0 HA PRO A 130 114.075 -1.721 -3.495 1.00 0.00 H new ATOM 0 HB2 PRO A 130 112.760 -1.926 -5.970 1.00 0.00 H new ATOM 0 HB3 PRO A 130 112.161 -1.022 -4.593 1.00 0.00 H new ATOM 0 HG2 PRO A 130 113.103 0.020 -7.111 1.00 0.00 H new ATOM 0 HG3 PRO A 130 112.469 0.921 -5.749 1.00 0.00 H new ATOM 0 HD2 PRO A 130 115.275 0.577 -6.578 1.00 0.00 H new ATOM 0 HD3 PRO A 130 114.605 1.731 -5.442 1.00 0.00 H new ATOM 2038 N LEU A 131 115.466 -3.543 -4.426 1.00 0.00 N ATOM 2039 CA LEU A 131 116.211 -4.696 -5.011 1.00 0.00 C ATOM 2040 C LEU A 131 115.335 -5.950 -4.956 1.00 0.00 C ATOM 2041 O LEU A 131 114.422 -6.042 -4.157 1.00 0.00 O ATOM 2042 CB LEU A 131 117.493 -4.933 -4.211 1.00 0.00 C ATOM 2043 CG LEU A 131 118.392 -3.699 -4.309 1.00 0.00 C ATOM 2044 CD1 LEU A 131 119.357 -3.675 -3.122 1.00 0.00 C ATOM 2045 CD2 LEU A 131 119.189 -3.752 -5.613 1.00 0.00 C ATOM 0 H LEU A 131 115.324 -3.589 -3.417 1.00 0.00 H new ATOM 0 HA LEU A 131 116.466 -4.476 -6.048 1.00 0.00 H new ATOM 0 HB2 LEU A 131 117.251 -5.138 -3.168 1.00 0.00 H new ATOM 0 HB3 LEU A 131 118.017 -5.809 -4.594 1.00 0.00 H new ATOM 0 HG LEU A 131 117.777 -2.799 -4.295 1.00 0.00 H new ATOM 0 HD11 LEU A 131 119.998 -2.796 -3.192 1.00 0.00 H new ATOM 0 HD12 LEU A 131 118.789 -3.638 -2.192 1.00 0.00 H new ATOM 0 HD13 LEU A 131 119.973 -4.574 -3.135 1.00 0.00 H new ATOM 0 HD21 LEU A 131 119.830 -2.873 -5.684 1.00 0.00 H new ATOM 0 HD22 LEU A 131 119.804 -4.652 -5.627 1.00 0.00 H new ATOM 0 HD23 LEU A 131 118.502 -3.769 -6.459 1.00 0.00 H new ATOM 2057 N ASN A 132 115.609 -6.912 -5.799 1.00 0.00 N ATOM 2058 CA ASN A 132 114.797 -8.164 -5.804 1.00 0.00 C ATOM 2059 C ASN A 132 115.327 -9.118 -4.731 1.00 0.00 C ATOM 2060 O ASN A 132 116.487 -9.484 -4.733 1.00 0.00 O ATOM 2061 CB ASN A 132 114.898 -8.833 -7.176 1.00 0.00 C ATOM 2062 CG ASN A 132 113.749 -9.829 -7.344 1.00 0.00 C ATOM 2063 OD1 ASN A 132 113.833 -10.953 -6.891 1.00 0.00 O ATOM 2064 ND2 ASN A 132 112.671 -9.461 -7.979 1.00 0.00 N ATOM 0 H ASN A 132 116.363 -6.884 -6.486 1.00 0.00 H new ATOM 0 HA ASN A 132 113.755 -7.922 -5.594 1.00 0.00 H new ATOM 0 HB2 ASN A 132 114.859 -8.080 -7.963 1.00 0.00 H new ATOM 0 HB3 ASN A 132 115.855 -9.346 -7.273 1.00 0.00 H new ATOM 0 HD21 ASN A 132 111.899 -10.117 -8.095 1.00 0.00 H new ATOM 0 HD22 ASN A 132 112.600 -8.517 -8.359 1.00 0.00 H new ATOM 2071 N TRP A 133 114.482 -9.521 -3.816 1.00 0.00 N ATOM 2072 CA TRP A 133 114.925 -10.453 -2.737 1.00 0.00 C ATOM 2073 C TRP A 133 114.496 -11.884 -3.079 1.00 0.00 C ATOM 2074 O TRP A 133 115.104 -12.842 -2.643 1.00 0.00 O ATOM 2075 CB TRP A 133 114.288 -10.035 -1.410 1.00 0.00 C ATOM 2076 CG TRP A 133 114.782 -8.677 -1.027 1.00 0.00 C ATOM 2077 CD1 TRP A 133 114.126 -7.518 -1.261 1.00 0.00 C ATOM 2078 CD2 TRP A 133 116.021 -8.316 -0.350 1.00 0.00 C ATOM 2079 NE1 TRP A 133 114.883 -6.468 -0.770 1.00 0.00 N ATOM 2080 CE2 TRP A 133 116.060 -6.909 -0.200 1.00 0.00 C ATOM 2081 CE3 TRP A 133 117.106 -9.065 0.143 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 117.135 -6.269 0.418 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 118.188 -8.424 0.765 1.00 0.00 C ATOM 2084 CH2 TRP A 133 118.203 -7.029 0.902 1.00 0.00 C ATOM 0 H TRP A 133 113.502 -9.243 -3.770 1.00 0.00 H new ATOM 0 HA TRP A 133 116.011 -10.413 -2.651 1.00 0.00 H new ATOM 0 HB2 TRP A 133 113.202 -10.026 -1.502 1.00 0.00 H new ATOM 0 HB3 TRP A 133 114.536 -10.757 -0.632 1.00 0.00 H new ATOM 0 HD1 TRP A 133 113.168 -7.426 -1.751 1.00 0.00 H new ATOM 0 HE1 TRP A 133 114.605 -5.488 -0.823 1.00 0.00 H new ATOM 0 HE3 TRP A 133 117.106 -10.140 0.042 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 117.142 -5.194 0.521 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 119.014 -9.009 1.141 1.00 0.00 H new ATOM 0 HH2 TRP A 133 119.039 -6.542 1.381 1.00 0.00 H new ATOM 2095 N ASP A 134 113.450 -12.034 -3.857 1.00 0.00 N ATOM 2096 CA ASP A 134 112.975 -13.401 -4.231 1.00 0.00 C ATOM 2097 C ASP A 134 114.086 -14.161 -4.964 1.00 0.00 C ATOM 2098 O ASP A 134 114.128 -15.377 -4.949 1.00 0.00 O ATOM 2099 CB ASP A 134 111.753 -13.280 -5.145 1.00 0.00 C ATOM 2100 CG ASP A 134 110.547 -12.816 -4.327 1.00 0.00 C ATOM 2101 OD1 ASP A 134 110.722 -11.942 -3.495 1.00 0.00 O ATOM 2102 OD2 ASP A 134 109.469 -13.342 -4.547 1.00 0.00 O ATOM 0 H ASP A 134 112.905 -11.266 -4.249 1.00 0.00 H new ATOM 0 HA ASP A 134 112.707 -13.947 -3.326 1.00 0.00 H new ATOM 0 HB2 ASP A 134 111.955 -12.571 -5.948 1.00 0.00 H new ATOM 0 HB3 ASP A 134 111.540 -14.241 -5.614 1.00 0.00 H new ATOM 2107 N ASP A 135 114.985 -13.455 -5.606 1.00 0.00 N ATOM 2108 CA ASP A 135 116.093 -14.133 -6.340 1.00 0.00 C ATOM 2109 C ASP A 135 117.347 -14.168 -5.461 1.00 0.00 C ATOM 2110 O ASP A 135 118.454 -14.012 -5.939 1.00 0.00 O ATOM 2111 CB ASP A 135 116.394 -13.366 -7.630 1.00 0.00 C ATOM 2112 CG ASP A 135 115.209 -13.494 -8.588 1.00 0.00 C ATOM 2113 OD1 ASP A 135 115.069 -14.547 -9.188 1.00 0.00 O ATOM 2114 OD2 ASP A 135 114.463 -12.536 -8.706 1.00 0.00 O ATOM 0 H ASP A 135 114.997 -12.436 -5.652 1.00 0.00 H new ATOM 0 HA ASP A 135 115.795 -15.153 -6.584 1.00 0.00 H new ATOM 0 HB2 ASP A 135 116.582 -12.316 -7.406 1.00 0.00 H new ATOM 0 HB3 ASP A 135 117.297 -13.759 -8.097 1.00 0.00 H new ATOM 2119 N PHE A 136 117.178 -14.373 -4.178 1.00 0.00 N ATOM 2120 CA PHE A 136 118.352 -14.422 -3.259 1.00 0.00 C ATOM 2121 C PHE A 136 118.014 -15.298 -2.052 1.00 0.00 C ATOM 2122 O PHE A 136 116.876 -15.678 -1.851 1.00 0.00 O ATOM 2123 CB PHE A 136 118.688 -13.007 -2.782 1.00 0.00 C ATOM 2124 CG PHE A 136 119.340 -12.234 -3.904 1.00 0.00 C ATOM 2125 CD1 PHE A 136 118.551 -11.504 -4.801 1.00 0.00 C ATOM 2126 CD2 PHE A 136 120.733 -12.246 -4.046 1.00 0.00 C ATOM 2127 CE1 PHE A 136 119.155 -10.786 -5.840 1.00 0.00 C ATOM 2128 CE2 PHE A 136 121.336 -11.528 -5.085 1.00 0.00 C ATOM 2129 CZ PHE A 136 120.547 -10.799 -5.982 1.00 0.00 C ATOM 0 H PHE A 136 116.273 -14.509 -3.728 1.00 0.00 H new ATOM 0 HA PHE A 136 119.209 -14.840 -3.786 1.00 0.00 H new ATOM 0 HB2 PHE A 136 117.781 -12.498 -2.455 1.00 0.00 H new ATOM 0 HB3 PHE A 136 119.356 -13.052 -1.922 1.00 0.00 H new ATOM 0 HD1 PHE A 136 117.477 -11.495 -4.691 1.00 0.00 H new ATOM 0 HD2 PHE A 136 121.342 -12.809 -3.354 1.00 0.00 H new ATOM 0 HE1 PHE A 136 118.547 -10.222 -6.532 1.00 0.00 H new ATOM 0 HE2 PHE A 136 122.410 -11.537 -5.195 1.00 0.00 H new ATOM 0 HZ PHE A 136 121.013 -10.246 -6.784 1.00 0.00 H new ATOM 2139 N THR A 137 118.997 -15.621 -1.250 1.00 0.00 N ATOM 2140 CA THR A 137 118.742 -16.474 -0.052 1.00 0.00 C ATOM 2141 C THR A 137 119.737 -16.114 1.052 1.00 0.00 C ATOM 2142 O THR A 137 120.855 -15.715 0.786 1.00 0.00 O ATOM 2143 CB THR A 137 118.910 -17.947 -0.430 1.00 0.00 C ATOM 2144 OG1 THR A 137 118.373 -18.165 -1.727 1.00 0.00 O ATOM 2145 CG2 THR A 137 118.172 -18.823 0.584 1.00 0.00 C ATOM 0 H THR A 137 119.967 -15.330 -1.374 1.00 0.00 H new ATOM 0 HA THR A 137 117.726 -16.304 0.305 1.00 0.00 H new ATOM 0 HB THR A 137 119.969 -18.205 -0.427 1.00 0.00 H new ATOM 0 HG1 THR A 137 119.020 -17.872 -2.402 1.00 0.00 H new ATOM 0 HG21 THR A 137 118.292 -19.872 0.314 1.00 0.00 H new ATOM 0 HG22 THR A 137 118.585 -18.655 1.579 1.00 0.00 H new ATOM 0 HG23 THR A 137 117.112 -18.567 0.583 1.00 0.00 H new ATOM 2153 N LYS A 138 119.335 -16.255 2.290 1.00 0.00 N ATOM 2154 CA LYS A 138 120.249 -15.925 3.422 1.00 0.00 C ATOM 2155 C LYS A 138 121.076 -17.160 3.784 1.00 0.00 C ATOM 2156 O LYS A 138 120.576 -18.270 3.791 1.00 0.00 O ATOM 2157 CB LYS A 138 119.422 -15.491 4.634 1.00 0.00 C ATOM 2158 CG LYS A 138 120.223 -14.489 5.467 1.00 0.00 C ATOM 2159 CD LYS A 138 119.261 -13.545 6.191 1.00 0.00 C ATOM 2160 CE LYS A 138 118.605 -14.281 7.360 1.00 0.00 C ATOM 2161 NZ LYS A 138 119.507 -14.233 8.545 1.00 0.00 N ATOM 0 H LYS A 138 118.410 -16.586 2.565 1.00 0.00 H new ATOM 0 HA LYS A 138 120.916 -15.114 3.128 1.00 0.00 H new ATOM 0 HB2 LYS A 138 118.485 -15.040 4.306 1.00 0.00 H new ATOM 0 HB3 LYS A 138 119.163 -16.359 5.240 1.00 0.00 H new ATOM 0 HG2 LYS A 138 120.846 -15.016 6.190 1.00 0.00 H new ATOM 0 HG3 LYS A 138 120.894 -13.919 4.824 1.00 0.00 H new ATOM 0 HD2 LYS A 138 119.799 -12.670 6.555 1.00 0.00 H new ATOM 0 HD3 LYS A 138 118.498 -13.186 5.500 1.00 0.00 H new ATOM 0 HE2 LYS A 138 117.646 -13.822 7.601 1.00 0.00 H new ATOM 0 HE3 LYS A 138 118.403 -15.316 7.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 119.770 -15.201 8.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 120.365 -13.696 8.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 119.017 -13.769 9.336 1.00 0.00 H new ATOM 2175 N VAL A 139 122.337 -16.974 4.083 1.00 0.00 N ATOM 2176 CA VAL A 139 123.203 -18.133 4.445 1.00 0.00 C ATOM 2177 C VAL A 139 123.933 -17.839 5.759 1.00 0.00 C ATOM 2178 O VAL A 139 124.033 -18.689 6.624 1.00 0.00 O ATOM 2179 CB VAL A 139 124.227 -18.377 3.333 1.00 0.00 C ATOM 2180 CG1 VAL A 139 123.503 -18.830 2.064 1.00 0.00 C ATOM 2181 CG2 VAL A 139 124.991 -17.081 3.046 1.00 0.00 C ATOM 0 H VAL A 139 122.803 -16.067 4.092 1.00 0.00 H new ATOM 0 HA VAL A 139 122.583 -19.021 4.567 1.00 0.00 H new ATOM 0 HB VAL A 139 124.928 -19.150 3.650 1.00 0.00 H new ATOM 0 HG11 VAL A 139 124.231 -19.004 1.272 1.00 0.00 H new ATOM 0 HG12 VAL A 139 122.959 -19.753 2.265 1.00 0.00 H new ATOM 0 HG13 VAL A 139 122.802 -18.057 1.749 1.00 0.00 H new ATOM 0 HG21 VAL A 139 125.720 -17.256 2.254 1.00 0.00 H new ATOM 0 HG22 VAL A 139 124.290 -16.308 2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 139 125.507 -16.756 3.949 1.00 0.00 H new ATOM 2191 N SER A 140 124.442 -16.643 5.913 1.00 0.00 N ATOM 2192 CA SER A 140 125.167 -16.289 7.169 1.00 0.00 C ATOM 2193 C SER A 140 124.467 -15.111 7.848 1.00 0.00 C ATOM 2194 O SER A 140 123.738 -14.365 7.221 1.00 0.00 O ATOM 2195 CB SER A 140 126.607 -15.900 6.833 1.00 0.00 C ATOM 2196 OG SER A 140 127.262 -17.005 6.225 1.00 0.00 O ATOM 0 H SER A 140 124.386 -15.896 5.221 1.00 0.00 H new ATOM 0 HA SER A 140 125.169 -17.147 7.841 1.00 0.00 H new ATOM 0 HB2 SER A 140 126.617 -15.042 6.161 1.00 0.00 H new ATOM 0 HB3 SER A 140 127.136 -15.602 7.738 1.00 0.00 H new ATOM 0 HG SER A 140 128.185 -16.758 6.007 1.00 0.00 H new ATOM 2202 N SER A 141 124.683 -14.941 9.127 1.00 0.00 N ATOM 2203 CA SER A 141 124.036 -13.813 9.860 1.00 0.00 C ATOM 2204 C SER A 141 124.650 -13.693 11.256 1.00 0.00 C ATOM 2205 O SER A 141 125.165 -14.652 11.801 1.00 0.00 O ATOM 2206 CB SER A 141 122.536 -14.083 9.986 1.00 0.00 C ATOM 2207 OG SER A 141 121.853 -12.853 10.192 1.00 0.00 O ATOM 0 H SER A 141 125.282 -15.538 9.697 1.00 0.00 H new ATOM 0 HA SER A 141 124.195 -12.884 9.312 1.00 0.00 H new ATOM 0 HB2 SER A 141 122.166 -14.571 9.085 1.00 0.00 H new ATOM 0 HB3 SER A 141 122.346 -14.762 10.817 1.00 0.00 H new ATOM 0 HG SER A 141 122.461 -12.107 10.010 1.00 0.00 H new ATOM 2213 N ARG A 142 124.600 -12.521 11.837 1.00 0.00 N ATOM 2214 CA ARG A 142 125.179 -12.327 13.199 1.00 0.00 C ATOM 2215 C ARG A 142 124.335 -11.311 13.971 1.00 0.00 C ATOM 2216 O ARG A 142 124.285 -10.145 13.627 1.00 0.00 O ATOM 2217 CB ARG A 142 126.614 -11.810 13.073 1.00 0.00 C ATOM 2218 CG ARG A 142 127.298 -11.868 14.441 1.00 0.00 C ATOM 2219 CD ARG A 142 128.661 -11.177 14.360 1.00 0.00 C ATOM 2220 NE ARG A 142 129.043 -10.668 15.713 1.00 0.00 N ATOM 2221 CZ ARG A 142 130.082 -9.875 15.882 1.00 0.00 C ATOM 2222 NH1 ARG A 142 130.831 -9.495 14.871 1.00 0.00 N ATOM 2223 NH2 ARG A 142 130.376 -9.456 17.083 1.00 0.00 N ATOM 0 H ARG A 142 124.181 -11.688 11.424 1.00 0.00 H new ATOM 0 HA ARG A 142 125.181 -13.277 13.733 1.00 0.00 H new ATOM 0 HB2 ARG A 142 127.167 -12.412 12.352 1.00 0.00 H new ATOM 0 HB3 ARG A 142 126.612 -10.786 12.698 1.00 0.00 H new ATOM 0 HG2 ARG A 142 126.676 -11.381 15.192 1.00 0.00 H new ATOM 0 HG3 ARG A 142 127.422 -12.905 14.754 1.00 0.00 H new ATOM 0 HD2 ARG A 142 129.414 -11.876 13.997 1.00 0.00 H new ATOM 0 HD3 ARG A 142 128.621 -10.353 13.648 1.00 0.00 H new ATOM 0 HE ARG A 142 128.487 -10.941 16.523 1.00 0.00 H new ATOM 0 HH11 ARG A 142 130.614 -9.814 13.927 1.00 0.00 H new ATOM 0 HH12 ARG A 142 131.629 -8.881 15.030 1.00 0.00 H new ATOM 0 HH21 ARG A 142 129.804 -9.743 17.877 1.00 0.00 H new ATOM 0 HH22 ARG A 142 131.178 -8.842 17.227 1.00 0.00 H new ATOM 2237 N THR A 143 123.673 -11.747 15.011 1.00 0.00 N ATOM 2238 CA THR A 143 122.829 -10.816 15.815 1.00 0.00 C ATOM 2239 C THR A 143 123.694 -10.125 16.871 1.00 0.00 C ATOM 2240 O THR A 143 124.346 -10.770 17.669 1.00 0.00 O ATOM 2241 CB THR A 143 121.712 -11.603 16.504 1.00 0.00 C ATOM 2242 OG1 THR A 143 121.221 -12.600 15.618 1.00 0.00 O ATOM 2243 CG2 THR A 143 120.577 -10.652 16.886 1.00 0.00 C ATOM 0 H THR A 143 123.681 -12.713 15.339 1.00 0.00 H new ATOM 0 HA THR A 143 122.390 -10.065 15.157 1.00 0.00 H new ATOM 0 HB THR A 143 122.103 -12.078 17.404 1.00 0.00 H new ATOM 0 HG1 THR A 143 120.507 -13.106 16.059 1.00 0.00 H new ATOM 0 HG21 THR A 143 119.782 -11.213 17.377 1.00 0.00 H new ATOM 0 HG22 THR A 143 120.955 -9.889 17.566 1.00 0.00 H new ATOM 0 HG23 THR A 143 120.184 -10.175 15.988 1.00 0.00 H new ATOM 2251 N VAL A 144 123.701 -8.816 16.878 1.00 0.00 N ATOM 2252 CA VAL A 144 124.521 -8.071 17.879 1.00 0.00 C ATOM 2253 C VAL A 144 123.619 -7.121 18.669 1.00 0.00 C ATOM 2254 O VAL A 144 122.937 -6.287 18.104 1.00 0.00 O ATOM 2255 CB VAL A 144 125.601 -7.264 17.154 1.00 0.00 C ATOM 2256 CG1 VAL A 144 126.536 -6.620 18.182 1.00 0.00 C ATOM 2257 CG2 VAL A 144 126.408 -8.195 16.246 1.00 0.00 C ATOM 0 H VAL A 144 123.172 -8.230 16.231 1.00 0.00 H new ATOM 0 HA VAL A 144 124.993 -8.778 18.562 1.00 0.00 H new ATOM 0 HB VAL A 144 125.130 -6.486 16.553 1.00 0.00 H new ATOM 0 HG11 VAL A 144 127.305 -6.046 17.665 1.00 0.00 H new ATOM 0 HG12 VAL A 144 125.963 -5.958 18.831 1.00 0.00 H new ATOM 0 HG13 VAL A 144 127.007 -7.398 18.783 1.00 0.00 H new ATOM 0 HG21 VAL A 144 127.178 -7.622 15.729 1.00 0.00 H new ATOM 0 HG22 VAL A 144 126.878 -8.973 16.848 1.00 0.00 H new ATOM 0 HG23 VAL A 144 125.744 -8.654 15.514 1.00 0.00 H new ATOM 2267 N GLU A 145 123.612 -7.243 19.972 1.00 0.00 N ATOM 2268 CA GLU A 145 122.758 -6.351 20.809 1.00 0.00 C ATOM 2269 C GLU A 145 123.637 -5.320 21.520 1.00 0.00 C ATOM 2270 O GLU A 145 124.520 -5.666 22.283 1.00 0.00 O ATOM 2271 CB GLU A 145 122.011 -7.189 21.849 1.00 0.00 C ATOM 2272 CG GLU A 145 121.042 -8.137 21.142 1.00 0.00 C ATOM 2273 CD GLU A 145 120.369 -9.043 22.174 1.00 0.00 C ATOM 2274 OE1 GLU A 145 121.083 -9.634 22.969 1.00 0.00 O ATOM 2275 OE2 GLU A 145 119.153 -9.130 22.154 1.00 0.00 O ATOM 0 H GLU A 145 124.163 -7.925 20.493 1.00 0.00 H new ATOM 0 HA GLU A 145 122.039 -5.836 20.172 1.00 0.00 H new ATOM 0 HB2 GLU A 145 122.720 -7.759 22.450 1.00 0.00 H new ATOM 0 HB3 GLU A 145 121.466 -6.538 22.532 1.00 0.00 H new ATOM 0 HG2 GLU A 145 120.289 -7.566 20.598 1.00 0.00 H new ATOM 0 HG3 GLU A 145 121.577 -8.739 20.408 1.00 0.00 H new ATOM 2282 N ASP A 146 123.400 -4.057 21.274 1.00 0.00 N ATOM 2283 CA ASP A 146 124.216 -2.993 21.931 1.00 0.00 C ATOM 2284 C ASP A 146 123.640 -2.694 23.317 1.00 0.00 C ATOM 2285 O ASP A 146 122.748 -3.375 23.787 1.00 0.00 O ATOM 2286 CB ASP A 146 124.180 -1.723 21.077 1.00 0.00 C ATOM 2287 CG ASP A 146 125.528 -1.006 21.167 1.00 0.00 C ATOM 2288 OD1 ASP A 146 125.797 -0.420 22.203 1.00 0.00 O ATOM 2289 OD2 ASP A 146 126.270 -1.055 20.200 1.00 0.00 O ATOM 0 H ASP A 146 122.674 -3.716 20.644 1.00 0.00 H new ATOM 0 HA ASP A 146 125.247 -3.333 22.031 1.00 0.00 H new ATOM 0 HB2 ASP A 146 123.960 -1.976 20.040 1.00 0.00 H new ATOM 0 HB3 ASP A 146 123.383 -1.064 21.420 1.00 0.00 H new ATOM 2294 N THR A 147 124.145 -1.679 23.972 1.00 0.00 N ATOM 2295 CA THR A 147 123.634 -1.327 25.329 1.00 0.00 C ATOM 2296 C THR A 147 122.160 -0.925 25.230 1.00 0.00 C ATOM 2297 O THR A 147 121.356 -1.275 26.073 1.00 0.00 O ATOM 2298 CB THR A 147 124.445 -0.157 25.891 1.00 0.00 C ATOM 2299 OG1 THR A 147 124.500 0.885 24.928 1.00 0.00 O ATOM 2300 CG2 THR A 147 125.864 -0.628 26.218 1.00 0.00 C ATOM 0 H THR A 147 124.892 -1.078 23.623 1.00 0.00 H new ATOM 0 HA THR A 147 123.732 -2.188 25.990 1.00 0.00 H new ATOM 0 HB THR A 147 123.969 0.212 26.799 1.00 0.00 H new ATOM 0 HG1 THR A 147 125.018 1.635 25.287 1.00 0.00 H new ATOM 0 HG21 THR A 147 126.441 0.206 26.618 1.00 0.00 H new ATOM 0 HG22 THR A 147 125.821 -1.427 26.958 1.00 0.00 H new ATOM 0 HG23 THR A 147 126.342 -0.998 25.311 1.00 0.00 H new ATOM 2308 N ASN A 148 121.804 -0.191 24.206 1.00 0.00 N ATOM 2309 CA ASN A 148 120.385 0.240 24.043 1.00 0.00 C ATOM 2310 C ASN A 148 119.677 -0.691 23.046 1.00 0.00 C ATOM 2311 O ASN A 148 120.329 -1.416 22.321 1.00 0.00 O ATOM 2312 CB ASN A 148 120.344 1.675 23.515 1.00 0.00 C ATOM 2313 CG ASN A 148 120.757 2.641 24.627 1.00 0.00 C ATOM 2314 OD1 ASN A 148 120.351 2.488 25.762 1.00 0.00 O ATOM 2315 ND2 ASN A 148 121.553 3.636 24.347 1.00 0.00 N ATOM 0 H ASN A 148 122.438 0.129 23.474 1.00 0.00 H new ATOM 0 HA ASN A 148 119.879 0.193 25.008 1.00 0.00 H new ATOM 0 HB2 ASN A 148 121.014 1.779 22.661 1.00 0.00 H new ATOM 0 HB3 ASN A 148 119.341 1.916 23.164 1.00 0.00 H new ATOM 0 HD21 ASN A 148 121.835 4.286 25.081 1.00 0.00 H new ATOM 0 HD22 ASN A 148 121.894 3.764 23.394 1.00 0.00 H new ATOM 2322 N PRO A 149 118.361 -0.646 23.034 1.00 0.00 N ATOM 2323 CA PRO A 149 117.477 -1.468 22.140 1.00 0.00 C ATOM 2324 C PRO A 149 117.415 -0.836 20.747 1.00 0.00 C ATOM 2325 O PRO A 149 117.280 -1.523 19.751 1.00 0.00 O ATOM 2326 CB PRO A 149 116.092 -1.473 22.784 1.00 0.00 C ATOM 2327 CG PRO A 149 116.091 -0.416 23.871 1.00 0.00 C ATOM 2328 CD PRO A 149 117.476 0.220 23.895 1.00 0.00 C ATOM 0 HA PRO A 149 117.858 -2.483 22.027 1.00 0.00 H new ATOM 0 HB2 PRO A 149 115.323 -1.260 22.041 1.00 0.00 H new ATOM 0 HB3 PRO A 149 115.867 -2.454 23.203 1.00 0.00 H new ATOM 0 HG2 PRO A 149 115.327 0.336 23.673 1.00 0.00 H new ATOM 0 HG3 PRO A 149 115.857 -0.861 24.838 1.00 0.00 H new ATOM 0 HD2 PRO A 149 117.441 1.240 23.512 1.00 0.00 H new ATOM 0 HD3 PRO A 149 117.860 0.275 24.914 1.00 0.00 H new ATOM 2336 N ALA A 150 117.513 0.468 20.673 1.00 0.00 N ATOM 2337 CA ALA A 150 117.461 1.155 19.350 1.00 0.00 C ATOM 2338 C ALA A 150 118.774 0.917 18.601 1.00 0.00 C ATOM 2339 O ALA A 150 118.804 0.861 17.386 1.00 0.00 O ATOM 2340 CB ALA A 150 117.261 2.657 19.563 1.00 0.00 C ATOM 0 H ALA A 150 117.627 1.087 21.476 1.00 0.00 H new ATOM 0 HA ALA A 150 116.631 0.757 18.766 1.00 0.00 H new ATOM 0 HB1 ALA A 150 117.223 3.160 18.597 1.00 0.00 H new ATOM 0 HB2 ALA A 150 116.327 2.827 20.098 1.00 0.00 H new ATOM 0 HB3 ALA A 150 118.091 3.055 20.147 1.00 0.00 H new ATOM 2346 N LEU A 151 119.858 0.779 19.320 1.00 0.00 N ATOM 2347 CA LEU A 151 121.178 0.544 18.661 1.00 0.00 C ATOM 2348 C LEU A 151 121.317 -0.928 18.244 1.00 0.00 C ATOM 2349 O LEU A 151 122.256 -1.292 17.561 1.00 0.00 O ATOM 2350 CB LEU A 151 122.302 0.902 19.636 1.00 0.00 C ATOM 2351 CG LEU A 151 122.350 2.419 19.829 1.00 0.00 C ATOM 2352 CD1 LEU A 151 123.263 2.756 21.009 1.00 0.00 C ATOM 2353 CD2 LEU A 151 122.896 3.075 18.560 1.00 0.00 C ATOM 0 H LEU A 151 119.886 0.819 20.339 1.00 0.00 H new ATOM 0 HA LEU A 151 121.243 1.170 17.771 1.00 0.00 H new ATOM 0 HB2 LEU A 151 122.137 0.408 20.594 1.00 0.00 H new ATOM 0 HB3 LEU A 151 123.257 0.544 19.253 1.00 0.00 H new ATOM 0 HG LEU A 151 121.346 2.792 20.030 1.00 0.00 H new ATOM 0 HD11 LEU A 151 123.297 3.837 21.146 1.00 0.00 H new ATOM 0 HD12 LEU A 151 122.876 2.288 21.914 1.00 0.00 H new ATOM 0 HD13 LEU A 151 124.268 2.384 20.809 1.00 0.00 H new ATOM 0 HD21 LEU A 151 122.931 4.156 18.695 1.00 0.00 H new ATOM 0 HD22 LEU A 151 123.900 2.702 18.361 1.00 0.00 H new ATOM 0 HD23 LEU A 151 122.246 2.836 17.718 1.00 0.00 H new ATOM 2365 N THR A 152 120.398 -1.780 18.645 1.00 0.00 N ATOM 2366 CA THR A 152 120.491 -3.224 18.267 1.00 0.00 C ATOM 2367 C THR A 152 120.492 -3.363 16.741 1.00 0.00 C ATOM 2368 O THR A 152 119.708 -2.739 16.051 1.00 0.00 O ATOM 2369 CB THR A 152 119.290 -3.980 18.844 1.00 0.00 C ATOM 2370 OG1 THR A 152 119.139 -3.644 20.216 1.00 0.00 O ATOM 2371 CG2 THR A 152 119.519 -5.485 18.707 1.00 0.00 C ATOM 0 H THR A 152 119.590 -1.535 19.217 1.00 0.00 H new ATOM 0 HA THR A 152 121.415 -3.641 18.668 1.00 0.00 H new ATOM 0 HB THR A 152 118.388 -3.702 18.299 1.00 0.00 H new ATOM 0 HG1 THR A 152 118.370 -4.125 20.588 1.00 0.00 H new ATOM 0 HG21 THR A 152 118.664 -6.022 19.118 1.00 0.00 H new ATOM 0 HG22 THR A 152 119.636 -5.741 17.654 1.00 0.00 H new ATOM 0 HG23 THR A 152 120.420 -5.767 19.251 1.00 0.00 H new ATOM 2379 N HIS A 153 121.370 -4.178 16.213 1.00 0.00 N ATOM 2380 CA HIS A 153 121.435 -4.366 14.734 1.00 0.00 C ATOM 2381 C HIS A 153 121.764 -5.827 14.419 1.00 0.00 C ATOM 2382 O HIS A 153 122.095 -6.601 15.298 1.00 0.00 O ATOM 2383 CB HIS A 153 122.521 -3.460 14.148 1.00 0.00 C ATOM 2384 CG HIS A 153 123.821 -3.698 14.867 1.00 0.00 C ATOM 2385 ND1 HIS A 153 124.048 -3.238 16.155 1.00 0.00 N ATOM 2386 CD2 HIS A 153 124.972 -4.347 14.492 1.00 0.00 C ATOM 2387 CE1 HIS A 153 125.292 -3.614 16.506 1.00 0.00 C ATOM 2388 NE2 HIS A 153 125.899 -4.293 15.529 1.00 0.00 N ATOM 0 H HIS A 153 122.047 -4.723 16.746 1.00 0.00 H new ATOM 0 HA HIS A 153 120.472 -4.107 14.294 1.00 0.00 H new ATOM 0 HB2 HIS A 153 122.641 -3.661 13.083 1.00 0.00 H new ATOM 0 HB3 HIS A 153 122.227 -2.415 14.244 1.00 0.00 H new ATOM 0 HD1 HIS A 153 123.392 -2.711 16.731 1.00 0.00 H new ATOM 0 HD2 HIS A 153 125.133 -4.826 13.538 1.00 0.00 H new ATOM 0 HE1 HIS A 153 125.744 -3.393 17.462 1.00 0.00 H new ATOM 2396 N THR A 154 121.676 -6.208 13.169 1.00 0.00 N ATOM 2397 CA THR A 154 121.983 -7.617 12.786 1.00 0.00 C ATOM 2398 C THR A 154 122.531 -7.650 11.358 1.00 0.00 C ATOM 2399 O THR A 154 121.897 -7.178 10.431 1.00 0.00 O ATOM 2400 CB THR A 154 120.704 -8.456 12.863 1.00 0.00 C ATOM 2401 OG1 THR A 154 120.007 -8.141 14.060 1.00 0.00 O ATOM 2402 CG2 THR A 154 121.061 -9.944 12.855 1.00 0.00 C ATOM 0 H THR A 154 121.404 -5.601 12.396 1.00 0.00 H new ATOM 0 HA THR A 154 122.727 -8.026 13.469 1.00 0.00 H new ATOM 0 HB THR A 154 120.073 -8.234 12.003 1.00 0.00 H new ATOM 0 HG1 THR A 154 119.187 -8.675 14.111 1.00 0.00 H new ATOM 0 HG21 THR A 154 120.148 -10.537 12.910 1.00 0.00 H new ATOM 0 HG22 THR A 154 121.596 -10.185 11.936 1.00 0.00 H new ATOM 0 HG23 THR A 154 121.694 -10.171 13.713 1.00 0.00 H new ATOM 2410 N TYR A 155 123.703 -8.203 11.175 1.00 0.00 N ATOM 2411 CA TYR A 155 124.300 -8.271 9.809 1.00 0.00 C ATOM 2412 C TYR A 155 123.653 -9.416 9.027 1.00 0.00 C ATOM 2413 O TYR A 155 123.211 -10.395 9.597 1.00 0.00 O ATOM 2414 CB TYR A 155 125.806 -8.519 9.923 1.00 0.00 C ATOM 2415 CG TYR A 155 126.439 -7.416 10.735 1.00 0.00 C ATOM 2416 CD1 TYR A 155 126.508 -6.117 10.216 1.00 0.00 C ATOM 2417 CD2 TYR A 155 126.957 -7.691 12.006 1.00 0.00 C ATOM 2418 CE1 TYR A 155 127.095 -5.093 10.970 1.00 0.00 C ATOM 2419 CE2 TYR A 155 127.544 -6.666 12.759 1.00 0.00 C ATOM 2420 CZ TYR A 155 127.613 -5.368 12.242 1.00 0.00 C ATOM 2421 OH TYR A 155 128.191 -4.358 12.984 1.00 0.00 O ATOM 0 H TYR A 155 124.273 -8.611 11.916 1.00 0.00 H new ATOM 0 HA TYR A 155 124.125 -7.330 9.288 1.00 0.00 H new ATOM 0 HB2 TYR A 155 125.991 -9.484 10.394 1.00 0.00 H new ATOM 0 HB3 TYR A 155 126.255 -8.558 8.930 1.00 0.00 H new ATOM 0 HD1 TYR A 155 126.109 -5.905 9.235 1.00 0.00 H new ATOM 0 HD2 TYR A 155 126.904 -8.693 12.406 1.00 0.00 H new ATOM 0 HE1 TYR A 155 127.148 -4.091 10.571 1.00 0.00 H new ATOM 0 HE2 TYR A 155 127.944 -6.878 13.740 1.00 0.00 H new ATOM 0 HH TYR A 155 128.262 -4.639 13.920 1.00 0.00 H new ATOM 2431 N GLU A 156 123.594 -9.297 7.724 1.00 0.00 N ATOM 2432 CA GLU A 156 122.976 -10.374 6.896 1.00 0.00 C ATOM 2433 C GLU A 156 123.803 -10.579 5.626 1.00 0.00 C ATOM 2434 O GLU A 156 124.160 -9.633 4.949 1.00 0.00 O ATOM 2435 CB GLU A 156 121.549 -9.971 6.516 1.00 0.00 C ATOM 2436 CG GLU A 156 120.599 -10.306 7.666 1.00 0.00 C ATOM 2437 CD GLU A 156 120.577 -9.147 8.664 1.00 0.00 C ATOM 2438 OE1 GLU A 156 120.297 -8.037 8.244 1.00 0.00 O ATOM 2439 OE2 GLU A 156 120.841 -9.390 9.829 1.00 0.00 O ATOM 0 H GLU A 156 123.948 -8.498 7.198 1.00 0.00 H new ATOM 0 HA GLU A 156 122.951 -11.302 7.467 1.00 0.00 H new ATOM 0 HB2 GLU A 156 121.508 -8.904 6.296 1.00 0.00 H new ATOM 0 HB3 GLU A 156 121.241 -10.495 5.612 1.00 0.00 H new ATOM 0 HG2 GLU A 156 119.595 -10.488 7.281 1.00 0.00 H new ATOM 0 HG3 GLU A 156 120.921 -11.221 8.163 1.00 0.00 H new ATOM 2446 N VAL A 157 124.108 -11.810 5.300 1.00 0.00 N ATOM 2447 CA VAL A 157 124.912 -12.089 4.075 1.00 0.00 C ATOM 2448 C VAL A 157 124.031 -12.782 3.033 1.00 0.00 C ATOM 2449 O VAL A 157 124.049 -13.992 2.899 1.00 0.00 O ATOM 2450 CB VAL A 157 126.091 -12.997 4.433 1.00 0.00 C ATOM 2451 CG1 VAL A 157 127.002 -13.156 3.214 1.00 0.00 C ATOM 2452 CG2 VAL A 157 126.884 -12.373 5.583 1.00 0.00 C ATOM 0 H VAL A 157 123.833 -12.635 5.833 1.00 0.00 H new ATOM 0 HA VAL A 157 125.288 -11.151 3.666 1.00 0.00 H new ATOM 0 HB VAL A 157 125.717 -13.975 4.737 1.00 0.00 H new ATOM 0 HG11 VAL A 157 127.842 -13.803 3.469 1.00 0.00 H new ATOM 0 HG12 VAL A 157 126.438 -13.600 2.394 1.00 0.00 H new ATOM 0 HG13 VAL A 157 127.376 -12.179 2.910 1.00 0.00 H new ATOM 0 HG21 VAL A 157 127.724 -13.019 5.839 1.00 0.00 H new ATOM 0 HG22 VAL A 157 127.258 -11.395 5.279 1.00 0.00 H new ATOM 0 HG23 VAL A 157 126.236 -12.259 6.452 1.00 0.00 H new ATOM 2462 N TRP A 158 123.261 -12.022 2.298 1.00 0.00 N ATOM 2463 CA TRP A 158 122.374 -12.626 1.261 1.00 0.00 C ATOM 2464 C TRP A 158 123.218 -13.079 0.068 1.00 0.00 C ATOM 2465 O TRP A 158 124.201 -12.451 -0.279 1.00 0.00 O ATOM 2466 CB TRP A 158 121.351 -11.586 0.797 1.00 0.00 C ATOM 2467 CG TRP A 158 120.409 -11.279 1.915 1.00 0.00 C ATOM 2468 CD1 TRP A 158 120.697 -10.496 2.980 1.00 0.00 C ATOM 2469 CD2 TRP A 158 119.036 -11.730 2.098 1.00 0.00 C ATOM 2470 NE1 TRP A 158 119.588 -10.438 3.805 1.00 0.00 N ATOM 2471 CE2 TRP A 158 118.539 -11.184 3.305 1.00 0.00 C ATOM 2472 CE3 TRP A 158 118.183 -12.554 1.342 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 117.241 -11.444 3.745 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 116.875 -12.818 1.782 1.00 0.00 C ATOM 2475 CH2 TRP A 158 116.406 -12.264 2.982 1.00 0.00 C ATOM 0 H TRP A 158 123.209 -11.006 2.372 1.00 0.00 H new ATOM 0 HA TRP A 158 121.853 -13.485 1.684 1.00 0.00 H new ATOM 0 HB2 TRP A 158 121.860 -10.677 0.477 1.00 0.00 H new ATOM 0 HB3 TRP A 158 120.799 -11.962 -0.064 1.00 0.00 H new ATOM 0 HD1 TRP A 158 121.639 -9.998 3.157 1.00 0.00 H new ATOM 0 HE1 TRP A 158 119.550 -9.909 4.676 1.00 0.00 H new ATOM 0 HE3 TRP A 158 118.536 -12.987 0.417 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 116.884 -11.014 4.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 116.227 -13.451 1.193 1.00 0.00 H new ATOM 0 HH2 TRP A 158 115.400 -12.471 3.316 1.00 0.00 H new ATOM 2486 N GLN A 159 122.840 -14.164 -0.558 1.00 0.00 N ATOM 2487 CA GLN A 159 123.615 -14.665 -1.731 1.00 0.00 C ATOM 2488 C GLN A 159 122.651 -15.026 -2.862 1.00 0.00 C ATOM 2489 O GLN A 159 121.518 -15.402 -2.626 1.00 0.00 O ATOM 2490 CB GLN A 159 124.410 -15.907 -1.322 1.00 0.00 C ATOM 2491 CG GLN A 159 125.678 -15.480 -0.581 1.00 0.00 C ATOM 2492 CD GLN A 159 126.670 -16.645 -0.551 1.00 0.00 C ATOM 2493 OE1 GLN A 159 126.322 -17.743 -0.166 1.00 0.00 O ATOM 2494 NE2 GLN A 159 127.898 -16.450 -0.944 1.00 0.00 N ATOM 0 H GLN A 159 122.026 -14.725 -0.306 1.00 0.00 H new ATOM 0 HA GLN A 159 124.301 -13.890 -2.072 1.00 0.00 H new ATOM 0 HB2 GLN A 159 123.801 -16.548 -0.684 1.00 0.00 H new ATOM 0 HB3 GLN A 159 124.671 -16.492 -2.204 1.00 0.00 H new ATOM 0 HG2 GLN A 159 126.128 -14.619 -1.075 1.00 0.00 H new ATOM 0 HG3 GLN A 159 125.432 -15.172 0.435 1.00 0.00 H new ATOM 0 HE21 GLN A 159 128.190 -15.528 -1.267 1.00 0.00 H new ATOM 0 HE22 GLN A 159 128.567 -17.220 -0.928 1.00 0.00 H new ATOM 2503 N LYS A 160 123.095 -14.916 -4.089 1.00 0.00 N ATOM 2504 CA LYS A 160 122.211 -15.249 -5.245 1.00 0.00 C ATOM 2505 C LYS A 160 122.144 -16.768 -5.414 1.00 0.00 C ATOM 2506 O LYS A 160 123.137 -17.458 -5.292 1.00 0.00 O ATOM 2507 CB LYS A 160 122.775 -14.618 -6.520 1.00 0.00 C ATOM 2508 CG LYS A 160 121.725 -14.683 -7.630 1.00 0.00 C ATOM 2509 CD LYS A 160 122.125 -13.743 -8.769 1.00 0.00 C ATOM 2510 CE LYS A 160 123.082 -14.468 -9.718 1.00 0.00 C ATOM 2511 NZ LYS A 160 122.971 -13.875 -11.081 1.00 0.00 N ATOM 0 H LYS A 160 124.035 -14.609 -4.339 1.00 0.00 H new ATOM 0 HA LYS A 160 121.210 -14.859 -5.060 1.00 0.00 H new ATOM 0 HB2 LYS A 160 123.057 -13.582 -6.332 1.00 0.00 H new ATOM 0 HB3 LYS A 160 123.679 -15.143 -6.829 1.00 0.00 H new ATOM 0 HG2 LYS A 160 121.636 -15.704 -8.001 1.00 0.00 H new ATOM 0 HG3 LYS A 160 120.748 -14.401 -7.238 1.00 0.00 H new ATOM 0 HD2 LYS A 160 121.239 -13.414 -9.311 1.00 0.00 H new ATOM 0 HD3 LYS A 160 122.603 -12.850 -8.367 1.00 0.00 H new ATOM 0 HE2 LYS A 160 124.106 -14.383 -9.355 1.00 0.00 H new ATOM 0 HE3 LYS A 160 122.843 -15.531 -9.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 123.621 -14.367 -11.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 121.995 -13.978 -11.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 123.219 -12.866 -11.042 1.00 0.00 H new ATOM 2525 N LYS A 161 120.976 -17.290 -5.695 1.00 0.00 N ATOM 2526 CA LYS A 161 120.833 -18.764 -5.876 1.00 0.00 C ATOM 2527 C LYS A 161 120.756 -19.094 -7.370 1.00 0.00 C ATOM 2528 O LYS A 161 121.141 -20.168 -7.794 1.00 0.00 O ATOM 2529 CB LYS A 161 119.555 -19.245 -5.179 1.00 0.00 C ATOM 2530 CG LYS A 161 118.364 -18.406 -5.647 1.00 0.00 C ATOM 2531 CD LYS A 161 117.062 -19.146 -5.329 1.00 0.00 C ATOM 2532 CE LYS A 161 116.735 -18.987 -3.843 1.00 0.00 C ATOM 2533 NZ LYS A 161 115.329 -19.417 -3.596 1.00 0.00 N ATOM 0 H LYS A 161 120.114 -16.756 -5.807 1.00 0.00 H new ATOM 0 HA LYS A 161 121.696 -19.266 -5.439 1.00 0.00 H new ATOM 0 HB2 LYS A 161 119.381 -20.297 -5.403 1.00 0.00 H new ATOM 0 HB3 LYS A 161 119.667 -19.164 -4.098 1.00 0.00 H new ATOM 0 HG2 LYS A 161 118.373 -17.435 -5.152 1.00 0.00 H new ATOM 0 HG3 LYS A 161 118.436 -18.219 -6.718 1.00 0.00 H new ATOM 0 HD2 LYS A 161 116.248 -18.749 -5.936 1.00 0.00 H new ATOM 0 HD3 LYS A 161 117.161 -20.202 -5.580 1.00 0.00 H new ATOM 0 HE2 LYS A 161 117.421 -19.585 -3.243 1.00 0.00 H new ATOM 0 HE3 LYS A 161 116.868 -17.949 -3.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 115.105 -19.309 -2.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 114.682 -18.828 -4.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 115.217 -20.414 -3.871 1.00 0.00 H new