USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 112 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 159 GLN : amide:sc= -0.0798 K(o=-0.08,f=-2.6!) USER MOD Set 2.1: A 116 THR OG1 : rot 113:sc= -0.645 USER MOD Set 2.2: A 155 TYR OH : rot -69:sc= 1.44 USER MOD Set 3.1: A 29 TYR OH : rot -93:sc= -1.71! USER MOD Set 3.2: A 33 GLN : amide:sc= -0.313 X(o=-2,f=-1.8) USER MOD Single : A 1 THR N :NH3+ -136:sc= 0.528 (180deg=-0.0022) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.237 USER MOD Single : A 7 GLN : amide:sc= -2.91 X(o=-2.9,f=-2.8) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS :FLIP no HE2:sc= -0.127 F(o=-0.9,f=-0.13) USER MOD Single : A 22 HIS : no HD1:sc= -0.0393 X(o=-0.039,f=-0.18) USER MOD Single : A 28 HIS : no HD1:sc= -0.0631 X(o=-0.063,f=0) USER MOD Single : A 34 THR OG1 : rot 39:sc= 1.29 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl -176:sc= -5.15! (180deg=-5.57!) USER MOD Single : A 45 THR OG1 : rot 70:sc= -1.12 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 150:sc= -1.03 USER MOD Single : A 51 LYS NZ :NH3+ -159:sc= -0.0671 (180deg=-0.357) USER MOD Single : A 58 THR OG1 : rot 73:sc= 1.14 USER MOD Single : A 59 ASN :FLIP amide:sc= -6.82! C(o=-7.9!,f=-6.8!) USER MOD Single : A 63 THR OG1 : rot 111:sc= -0.583 USER MOD Single : A 64 HIS :FLIP no HD1:sc= -2.83 F(o=-4.8!,f=-2.8) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.358 X(o=-0.36,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-3.3!) USER MOD Single : A 77 HIS : no HE2:sc= -0.0412 K(o=-0.041,f=-3.2!) 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= -0.56 X(o=-0.56,f=-0.19) USER MOD Single : A 89 HIS :FLIP no HD1:sc= -0.286 F(o=-1,f=-0.29) USER MOD Single : A 92 GLN : amide:sc= -0.035 K(o=-0.035,f=-2.5!) USER MOD Single : A 101 GLN : amide:sc= -0.0219 K(o=-0.022,f=-0.64) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot -150:sc= -1.25! USER MOD Single : A 126 THR OG1 : rot 97:sc= 0.903 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 143:sc= -2.46! (180deg=-4.03!) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 23:sc= 0.655 USER MOD Single : A 141 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= -1.18 K(o=-1.2,f=-13!) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0.276 USER MOD Single : A 153 HIS :FLIP no HD1:sc= -3.63 F(o=-6.8!,f=-3.6) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ -135:sc= 0.24 (180deg=0) USER MOD Single : A 170 NDP O2D : rot 180:sc= -1.46! USER MOD Single : A 170 NDP O3B : rot 180:sc= 0 USER MOD Single : A 170 NDP O3D : rot 99:sc= -4.39! USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -12.022 -3.678 2.812 1.00 1.00 N ATOM 2 CA THR A 1 -11.022 -3.783 3.913 1.00 1.00 C ATOM 3 C THR A 1 -9.729 -4.427 3.417 1.00 1.00 C ATOM 4 O THR A 1 -9.524 -5.636 3.575 1.00 1.00 O ATOM 5 CB THR A 1 -11.617 -4.635 5.040 1.00 1.00 C ATOM 6 OG1 THR A 1 -12.783 -5.316 4.611 1.00 1.00 O ATOM 7 CG2 THR A 1 -11.980 -3.822 6.267 1.00 1.00 C ATOM 0 H1 THR A 1 -12.469 -2.739 2.838 1.00 1.00 H new ATOM 0 H2 THR A 1 -11.546 -3.810 1.897 1.00 1.00 H new ATOM 0 H3 THR A 1 -12.749 -4.411 2.933 1.00 1.00 H new ATOM 0 HA THR A 1 -10.788 -2.782 4.275 1.00 1.00 H new ATOM 0 HB THR A 1 -10.834 -5.345 5.306 1.00 1.00 H new ATOM 0 HG1 THR A 1 -13.139 -5.852 5.350 1.00 1.00 H new ATOM 0 HG21 THR A 1 -12.396 -4.480 7.030 1.00 1.00 H new ATOM 0 HG22 THR A 1 -11.087 -3.334 6.657 1.00 1.00 H new ATOM 0 HG23 THR A 1 -12.718 -3.067 5.998 1.00 1.00 H new ATOM 17 N ALA A 2 -8.859 -3.626 2.802 1.00 1.00 N ATOM 18 CA ALA A 2 -7.604 -4.149 2.290 1.00 1.00 C ATOM 19 C ALA A 2 -6.437 -3.200 2.540 1.00 1.00 C ATOM 20 O ALA A 2 -6.584 -1.972 2.520 1.00 1.00 O ATOM 21 CB ALA A 2 -7.722 -4.428 0.807 1.00 1.00 C ATOM 0 H ALA A 2 -9.002 -2.627 2.650 1.00 1.00 H new ATOM 0 HA ALA A 2 -7.399 -5.075 2.828 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -6.776 -4.820 0.434 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -8.510 -5.161 0.636 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -7.965 -3.505 0.281 1.00 1.00 H new ATOM 27 N PHE A 3 -5.270 -3.783 2.766 1.00 1.00 N ATOM 28 CA PHE A 3 -4.048 -3.012 3.005 1.00 1.00 C ATOM 29 C PHE A 3 -3.081 -3.156 1.838 1.00 1.00 C ATOM 30 O PHE A 3 -2.727 -4.272 1.462 1.00 1.00 O ATOM 31 CB PHE A 3 -3.376 -3.487 4.294 1.00 1.00 C ATOM 32 CG PHE A 3 -3.974 -2.908 5.550 1.00 1.00 C ATOM 33 CD1 PHE A 3 -5.157 -2.187 5.513 1.00 1.00 C ATOM 34 CD2 PHE A 3 -3.339 -3.084 6.770 1.00 1.00 C ATOM 35 CE1 PHE A 3 -5.696 -1.653 6.667 1.00 1.00 C ATOM 36 CE2 PHE A 3 -3.873 -2.551 7.927 1.00 1.00 C ATOM 37 CZ PHE A 3 -5.053 -1.835 7.876 1.00 1.00 C ATOM 0 H PHE A 3 -5.138 -4.794 2.790 1.00 1.00 H new ATOM 0 HA PHE A 3 -4.319 -1.961 3.103 1.00 1.00 H new ATOM 0 HB2 PHE A 3 -3.437 -4.574 4.343 1.00 1.00 H new ATOM 0 HB3 PHE A 3 -2.318 -3.228 4.256 1.00 1.00 H new ATOM 0 HD1 PHE A 3 -5.664 -2.041 4.570 1.00 1.00 H new ATOM 0 HD2 PHE A 3 -2.417 -3.644 6.816 1.00 1.00 H new ATOM 0 HE1 PHE A 3 -6.619 -1.094 6.624 1.00 1.00 H new ATOM 0 HE2 PHE A 3 -3.368 -2.694 8.871 1.00 1.00 H new ATOM 0 HZ PHE A 3 -5.472 -1.418 8.780 1.00 1.00 H new ATOM 47 N LEU A 4 -2.648 -2.030 1.280 1.00 1.00 N ATOM 48 CA LEU A 4 -1.711 -2.063 0.167 1.00 1.00 C ATOM 49 C LEU A 4 -0.345 -1.535 0.598 1.00 1.00 C ATOM 50 O LEU A 4 -0.238 -0.411 1.083 1.00 1.00 O ATOM 51 CB LEU A 4 -2.238 -1.232 -1.001 1.00 1.00 C ATOM 52 CG LEU A 4 -3.762 -1.162 -1.114 1.00 1.00 C ATOM 53 CD1 LEU A 4 -4.161 -0.226 -2.244 1.00 1.00 C ATOM 54 CD2 LEU A 4 -4.351 -2.550 -1.325 1.00 1.00 C ATOM 0 H LEU A 4 -2.928 -1.095 1.577 1.00 1.00 H new ATOM 0 HA LEU A 4 -1.604 -3.099 -0.154 1.00 1.00 H new ATOM 0 HB2 LEU A 4 -1.849 -0.218 -0.909 1.00 1.00 H new ATOM 0 HB3 LEU A 4 -1.839 -1.644 -1.928 1.00 1.00 H new ATOM 0 HG LEU A 4 -4.163 -0.767 -0.181 1.00 1.00 H new ATOM 0 HD11 LEU A 4 -5.248 -0.184 -2.315 1.00 1.00 H new ATOM 0 HD12 LEU A 4 -3.772 0.772 -2.044 1.00 1.00 H new ATOM 0 HD13 LEU A 4 -3.750 -0.594 -3.184 1.00 1.00 H new ATOM 0 HD21 LEU A 4 -5.436 -2.477 -1.403 1.00 1.00 H new ATOM 0 HD22 LEU A 4 -3.950 -2.980 -2.243 1.00 1.00 H new ATOM 0 HD23 LEU A 4 -4.090 -3.188 -0.481 1.00 1.00 H new ATOM 66 N TRP A 5 0.693 -2.350 0.405 1.00 1.00 N ATOM 67 CA TRP A 5 2.048 -1.956 0.777 1.00 1.00 C ATOM 68 C TRP A 5 3.078 -2.596 -0.148 1.00 1.00 C ATOM 69 O TRP A 5 2.791 -3.608 -0.793 1.00 1.00 O ATOM 70 CB TRP A 5 2.337 -2.332 2.228 1.00 1.00 C ATOM 71 CG TRP A 5 2.871 -3.722 2.392 1.00 1.00 C ATOM 72 CD1 TRP A 5 4.150 -4.139 2.160 1.00 1.00 C ATOM 73 CD2 TRP A 5 2.148 -4.874 2.841 1.00 1.00 C ATOM 74 NE1 TRP A 5 4.266 -5.478 2.436 1.00 1.00 N ATOM 75 CE2 TRP A 5 3.052 -5.952 2.855 1.00 1.00 C ATOM 76 CE3 TRP A 5 0.825 -5.100 3.235 1.00 1.00 C ATOM 77 CZ2 TRP A 5 2.678 -7.233 3.245 1.00 1.00 C ATOM 78 CZ3 TRP A 5 0.454 -6.375 3.622 1.00 1.00 C ATOM 79 CH2 TRP A 5 1.378 -7.427 3.624 1.00 1.00 C ATOM 0 H TRP A 5 0.620 -3.281 -0.005 1.00 1.00 H new ATOM 0 HA TRP A 5 2.122 -0.873 0.674 1.00 1.00 H new ATOM 0 HB2 TRP A 5 3.056 -1.624 2.642 1.00 1.00 H new ATOM 0 HB3 TRP A 5 1.421 -2.233 2.810 1.00 1.00 H new ATOM 0 HD1 TRP A 5 4.953 -3.507 1.810 1.00 1.00 H new ATOM 0 HE1 TRP A 5 5.118 -6.031 2.344 1.00 1.00 H new ATOM 0 HE3 TRP A 5 0.106 -4.294 3.237 1.00 1.00 H new ATOM 0 HZ2 TRP A 5 3.389 -8.046 3.249 1.00 1.00 H new ATOM 0 HZ3 TRP A 5 -0.565 -6.562 3.928 1.00 1.00 H new ATOM 0 HH2 TRP A 5 1.058 -8.412 3.931 1.00 1.00 H new ATOM 90 N ALA A 6 4.279 -2.032 -0.190 1.00 1.00 N ATOM 91 CA ALA A 6 5.346 -2.564 -1.016 1.00 1.00 C ATOM 92 C ALA A 6 6.631 -2.682 -0.213 1.00 1.00 C ATOM 93 O ALA A 6 6.902 -1.842 0.651 1.00 1.00 O ATOM 94 CB ALA A 6 5.553 -1.679 -2.234 1.00 1.00 C ATOM 0 H ALA A 6 4.535 -1.201 0.343 1.00 1.00 H new ATOM 0 HA ALA A 6 5.065 -3.561 -1.355 1.00 1.00 H new ATOM 0 HB1 ALA A 6 6.356 -2.087 -2.848 1.00 1.00 H new ATOM 0 HB2 ALA A 6 4.633 -1.642 -2.818 1.00 1.00 H new ATOM 0 HB3 ALA A 6 5.818 -0.672 -1.911 1.00 1.00 H new ATOM 100 N GLN A 7 7.402 -3.733 -0.466 1.00 1.00 N ATOM 101 CA GLN A 7 8.646 -3.955 0.256 1.00 1.00 C ATOM 102 C GLN A 7 9.743 -4.522 -0.655 1.00 1.00 C ATOM 103 O GLN A 7 9.454 -5.228 -1.619 1.00 1.00 O ATOM 104 CB GLN A 7 8.358 -4.914 1.424 1.00 1.00 C ATOM 105 CG GLN A 7 9.576 -5.310 2.239 1.00 1.00 C ATOM 106 CD GLN A 7 9.817 -6.803 2.222 1.00 1.00 C ATOM 107 OE1 GLN A 7 10.147 -7.400 3.246 1.00 1.00 O ATOM 108 NE2 GLN A 7 9.657 -7.417 1.056 1.00 1.00 N ATOM 0 H GLN A 7 7.187 -4.444 -1.165 1.00 1.00 H new ATOM 0 HA GLN A 7 9.017 -3.001 0.631 1.00 1.00 H new ATOM 0 HB2 GLN A 7 7.630 -4.447 2.088 1.00 1.00 H new ATOM 0 HB3 GLN A 7 7.894 -5.817 1.028 1.00 1.00 H new ATOM 0 HG2 GLN A 7 10.455 -4.798 1.847 1.00 1.00 H new ATOM 0 HG3 GLN A 7 9.446 -4.977 3.269 1.00 1.00 H new ATOM 0 HE21 GLN A 7 9.382 -6.883 0.232 1.00 1.00 H new ATOM 0 HE22 GLN A 7 9.809 -8.423 0.984 1.00 1.00 H new ATOM 117 N ASP A 8 11.004 -4.231 -0.316 1.00 1.00 N ATOM 118 CA ASP A 8 12.148 -4.728 -1.070 1.00 1.00 C ATOM 119 C ASP A 8 12.371 -6.206 -0.766 1.00 1.00 C ATOM 120 O ASP A 8 11.973 -6.684 0.294 1.00 1.00 O ATOM 121 CB ASP A 8 13.411 -3.935 -0.736 1.00 1.00 C ATOM 122 CG ASP A 8 13.204 -2.442 -0.832 1.00 1.00 C ATOM 123 OD1 ASP A 8 12.104 -2.007 -1.238 1.00 1.00 O ATOM 124 OD2 ASP A 8 14.151 -1.701 -0.497 1.00 1.00 O ATOM 0 H ASP A 8 11.254 -3.649 0.483 1.00 1.00 H new ATOM 0 HA ASP A 8 11.935 -4.604 -2.132 1.00 1.00 H new ATOM 0 HB2 ASP A 8 13.738 -4.188 0.272 1.00 1.00 H new ATOM 0 HB3 ASP A 8 14.211 -4.231 -1.414 1.00 1.00 H new ATOM 129 N ARG A 9 12.980 -6.932 -1.694 1.00 1.00 N ATOM 130 CA ARG A 9 13.211 -8.356 -1.501 1.00 1.00 C ATOM 131 C ARG A 9 14.091 -8.616 -0.281 1.00 1.00 C ATOM 132 O ARG A 9 13.839 -9.540 0.494 1.00 1.00 O ATOM 133 CB ARG A 9 13.832 -8.984 -2.749 1.00 1.00 C ATOM 134 CG ARG A 9 15.120 -8.324 -3.200 1.00 1.00 C ATOM 135 CD ARG A 9 15.870 -9.201 -4.194 1.00 1.00 C ATOM 136 NE ARG A 9 14.966 -9.895 -5.109 1.00 1.00 N ATOM 137 CZ ARG A 9 15.291 -10.996 -5.786 1.00 1.00 C ATOM 138 NH1 ARG A 9 16.501 -11.529 -5.664 1.00 1.00 N ATOM 139 NH2 ARG A 9 14.402 -11.568 -6.584 1.00 1.00 N ATOM 0 H ARG A 9 13.320 -6.561 -2.581 1.00 1.00 H new ATOM 0 HA ARG A 9 12.242 -8.823 -1.325 1.00 1.00 H new ATOM 0 HB2 ARG A 9 14.026 -10.039 -2.553 1.00 1.00 H new ATOM 0 HB3 ARG A 9 13.109 -8.939 -3.563 1.00 1.00 H new ATOM 0 HG2 ARG A 9 14.897 -7.360 -3.658 1.00 1.00 H new ATOM 0 HG3 ARG A 9 15.753 -8.127 -2.335 1.00 1.00 H new ATOM 0 HD2 ARG A 9 16.563 -8.586 -4.768 1.00 1.00 H new ATOM 0 HD3 ARG A 9 16.468 -9.933 -3.651 1.00 1.00 H new ATOM 0 HE ARG A 9 14.029 -9.513 -5.237 1.00 1.00 H new ATOM 0 HH11 ARG A 9 17.189 -11.096 -5.049 1.00 1.00 H new ATOM 0 HH12 ARG A 9 16.742 -12.372 -6.186 1.00 1.00 H new ATOM 0 HH21 ARG A 9 13.470 -11.166 -6.680 1.00 1.00 H new ATOM 0 HH22 ARG A 9 14.650 -12.411 -7.103 1.00 1.00 H new ATOM 153 N ASP A 10 15.131 -7.807 -0.115 1.00 1.00 N ATOM 154 CA ASP A 10 16.051 -7.955 1.018 1.00 1.00 C ATOM 155 C ASP A 10 15.302 -7.779 2.332 1.00 1.00 C ATOM 156 O ASP A 10 15.641 -8.403 3.335 1.00 1.00 O ATOM 157 CB ASP A 10 17.195 -6.938 0.910 1.00 1.00 C ATOM 158 CG ASP A 10 18.404 -7.498 0.183 1.00 1.00 C ATOM 159 OD1 ASP A 10 18.332 -8.659 -0.271 1.00 1.00 O ATOM 160 OD2 ASP A 10 19.421 -6.782 0.075 1.00 1.00 O ATOM 0 H ASP A 10 15.362 -7.041 -0.747 1.00 1.00 H new ATOM 0 HA ASP A 10 16.477 -8.958 0.995 1.00 1.00 H new ATOM 0 HB2 ASP A 10 16.839 -6.050 0.387 1.00 1.00 H new ATOM 0 HB3 ASP A 10 17.491 -6.621 1.910 1.00 1.00 H new ATOM 165 N GLY A 11 14.277 -6.926 2.320 1.00 1.00 N ATOM 166 CA GLY A 11 13.486 -6.686 3.527 1.00 1.00 C ATOM 167 C GLY A 11 13.556 -5.239 3.973 1.00 1.00 C ATOM 168 O GLY A 11 13.810 -4.948 5.144 1.00 1.00 O ATOM 0 H GLY A 11 13.978 -6.397 1.501 1.00 1.00 H new ATOM 0 HA2 GLY A 11 12.447 -6.958 3.340 1.00 1.00 H new ATOM 0 HA3 GLY A 11 13.844 -7.331 4.330 1.00 1.00 H new ATOM 172 N LEU A 12 13.333 -4.326 3.047 1.00 1.00 N ATOM 173 CA LEU A 12 13.375 -2.898 3.333 1.00 1.00 C ATOM 174 C LEU A 12 12.130 -2.206 2.800 1.00 1.00 C ATOM 175 O LEU A 12 11.575 -2.613 1.774 1.00 1.00 O ATOM 176 CB LEU A 12 14.627 -2.261 2.699 1.00 1.00 C ATOM 177 CG LEU A 12 15.259 -1.131 3.512 1.00 1.00 C ATOM 178 CD1 LEU A 12 16.343 -1.691 4.413 1.00 1.00 C ATOM 179 CD2 LEU A 12 15.829 -0.067 2.585 1.00 1.00 C ATOM 0 H LEU A 12 13.118 -4.549 2.075 1.00 1.00 H new ATOM 0 HA LEU A 12 13.415 -2.772 4.415 1.00 1.00 H new ATOM 0 HB2 LEU A 12 15.374 -3.040 2.545 1.00 1.00 H new ATOM 0 HB3 LEU A 12 14.361 -1.876 1.715 1.00 1.00 H new ATOM 0 HG LEU A 12 14.492 -0.667 4.132 1.00 1.00 H new ATOM 0 HD11 LEU A 12 16.790 -0.882 4.990 1.00 1.00 H new ATOM 0 HD12 LEU A 12 15.909 -2.424 5.092 1.00 1.00 H new ATOM 0 HD13 LEU A 12 17.110 -2.170 3.805 1.00 1.00 H new ATOM 0 HD21 LEU A 12 16.276 0.731 3.178 1.00 1.00 H new ATOM 0 HD22 LEU A 12 16.590 -0.512 1.944 1.00 1.00 H new ATOM 0 HD23 LEU A 12 15.030 0.344 1.968 1.00 1.00 H new ATOM 191 N ILE A 13 11.701 -1.160 3.495 1.00 1.00 N ATOM 192 CA ILE A 13 10.525 -0.407 3.081 1.00 1.00 C ATOM 193 C ILE A 13 10.905 1.022 2.705 1.00 1.00 C ATOM 194 O ILE A 13 10.312 1.614 1.801 1.00 1.00 O ATOM 195 CB ILE A 13 9.438 -0.362 4.188 1.00 1.00 C ATOM 196 CG1 ILE A 13 10.058 -0.006 5.541 1.00 1.00 C ATOM 197 CG2 ILE A 13 8.701 -1.690 4.269 1.00 1.00 C ATOM 198 CD1 ILE A 13 9.030 0.324 6.597 1.00 1.00 C ATOM 0 H ILE A 13 12.148 -0.815 4.345 1.00 1.00 H new ATOM 0 HA ILE A 13 10.114 -0.925 2.214 1.00 1.00 H new ATOM 0 HB ILE A 13 8.718 0.414 3.928 1.00 1.00 H new ATOM 0 HG12 ILE A 13 10.668 -0.841 5.885 1.00 1.00 H new ATOM 0 HG13 ILE A 13 10.726 0.846 5.415 1.00 1.00 H new ATOM 0 HG21 ILE A 13 7.943 -1.638 5.051 1.00 1.00 H new ATOM 0 HG22 ILE A 13 8.222 -1.899 3.312 1.00 1.00 H new ATOM 0 HG23 ILE A 13 9.409 -2.485 4.502 1.00 1.00 H new ATOM 0 HD11 ILE A 13 9.534 0.567 7.532 1.00 1.00 H new ATOM 0 HD12 ILE A 13 8.436 1.178 6.272 1.00 1.00 H new ATOM 0 HD13 ILE A 13 8.377 -0.535 6.750 1.00 1.00 H new ATOM 210 N GLY A 14 11.895 1.589 3.394 1.00 1.00 N ATOM 211 CA GLY A 14 12.327 2.950 3.105 1.00 1.00 C ATOM 212 C GLY A 14 13.259 3.491 4.176 1.00 1.00 C ATOM 213 O GLY A 14 13.783 2.741 4.989 1.00 1.00 O ATOM 0 H GLY A 14 12.406 1.130 4.148 1.00 1.00 H new ATOM 0 HA2 GLY A 14 12.832 2.973 2.140 1.00 1.00 H new ATOM 0 HA3 GLY A 14 11.454 3.598 3.023 1.00 1.00 H new ATOM 217 N LYS A 15 13.448 4.821 4.170 1.00 1.00 N ATOM 218 CA LYS A 15 14.312 5.468 5.156 1.00 1.00 C ATOM 219 C LYS A 15 13.914 6.923 5.376 1.00 1.00 C ATOM 220 O LYS A 15 13.439 7.590 4.460 1.00 1.00 O ATOM 221 CB LYS A 15 15.766 5.394 4.703 1.00 1.00 C ATOM 222 CG LYS A 15 15.967 5.814 3.253 1.00 1.00 C ATOM 223 CD LYS A 15 17.162 6.750 3.108 1.00 1.00 C ATOM 224 CE LYS A 15 18.071 6.325 1.968 1.00 1.00 C ATOM 225 NZ LYS A 15 19.491 6.138 2.408 1.00 1.00 N ATOM 0 H LYS A 15 13.017 5.458 3.500 1.00 1.00 H new ATOM 0 HA LYS A 15 14.196 4.938 6.102 1.00 1.00 H new ATOM 0 HB2 LYS A 15 16.373 6.032 5.346 1.00 1.00 H new ATOM 0 HB3 LYS A 15 16.128 4.374 4.832 1.00 1.00 H new ATOM 0 HG2 LYS A 15 16.118 4.930 2.634 1.00 1.00 H new ATOM 0 HG3 LYS A 15 15.068 6.310 2.888 1.00 1.00 H new ATOM 0 HD2 LYS A 15 16.809 7.766 2.933 1.00 1.00 H new ATOM 0 HD3 LYS A 15 17.728 6.765 4.039 1.00 1.00 H new ATOM 0 HE2 LYS A 15 17.701 5.394 1.540 1.00 1.00 H new ATOM 0 HE3 LYS A 15 18.034 7.076 1.179 1.00 1.00 H new ATOM 0 HZ1 LYS A 15 20.071 5.848 1.595 1.00 1.00 H new ATOM 0 HZ2 LYS A 15 19.856 7.033 2.793 1.00 1.00 H new ATOM 0 HZ3 LYS A 15 19.533 5.403 3.142 1.00 1.00 H new ATOM 239 N ASP A 16 14.106 7.398 6.602 1.00 1.00 N ATOM 240 CA ASP A 16 13.763 8.766 6.959 1.00 1.00 C ATOM 241 C ASP A 16 12.379 9.149 6.433 1.00 1.00 C ATOM 242 O ASP A 16 12.158 10.295 6.020 1.00 1.00 O ATOM 243 CB ASP A 16 14.811 9.758 6.446 1.00 1.00 C ATOM 244 CG ASP A 16 14.719 9.982 4.950 1.00 1.00 C ATOM 245 OD1 ASP A 16 15.335 9.199 4.196 1.00 1.00 O ATOM 246 OD2 ASP A 16 14.040 10.943 4.532 1.00 1.00 O ATOM 0 H ASP A 16 14.500 6.851 7.368 1.00 1.00 H new ATOM 0 HA ASP A 16 13.745 8.816 8.048 1.00 1.00 H new ATOM 0 HB2 ASP A 16 14.686 10.711 6.961 1.00 1.00 H new ATOM 0 HB3 ASP A 16 15.806 9.390 6.694 1.00 1.00 H new ATOM 251 N GLY A 17 11.459 8.195 6.458 1.00 1.00 N ATOM 252 CA GLY A 17 10.107 8.451 5.987 1.00 1.00 C ATOM 253 C GLY A 17 10.047 8.911 4.536 1.00 1.00 C ATOM 254 O GLY A 17 9.245 9.783 4.187 1.00 1.00 O ATOM 0 H GLY A 17 11.622 7.246 6.796 1.00 1.00 H new ATOM 0 HA2 GLY A 17 9.514 7.543 6.097 1.00 1.00 H new ATOM 0 HA3 GLY A 17 9.648 9.210 6.620 1.00 1.00 H new ATOM 258 N HIS A 18 10.883 8.318 3.687 1.00 1.00 N ATOM 259 CA HIS A 18 10.913 8.673 2.264 1.00 1.00 C ATOM 260 C HIS A 18 11.072 7.428 1.394 1.00 1.00 C ATOM 261 O HIS A 18 11.562 6.397 1.857 1.00 1.00 O ATOM 262 CB HIS A 18 12.058 9.661 1.983 1.00 1.00 C ATOM 263 CG HIS A 18 11.952 10.367 0.663 1.00 1.00 C ATOM 264 ND1 HIS A 18 12.263 9.958 -0.583 1.00 1.00 N flip ATOM 265 CD2 HIS A 18 11.450 11.644 0.535 1.00 1.00 C flip ATOM 266 CE1 HIS A 18 11.947 10.983 -1.441 1.00 1.00 C flip ATOM 267 NE2 HIS A 18 11.458 11.991 -0.741 1.00 1.00 N flip ATOM 0 H HIS A 18 11.547 7.592 3.955 1.00 1.00 H new ATOM 0 HA HIS A 18 9.964 9.148 2.015 1.00 1.00 H new ATOM 0 HB2 HIS A 18 12.084 10.405 2.779 1.00 1.00 H new ATOM 0 HB3 HIS A 18 13.005 9.122 2.019 1.00 1.00 H new ATOM 0 HD1 HIS A 18 12.660 9.054 -0.841 1.00 1.00 H new ATOM 0 HD2 HIS A 18 11.104 12.264 1.349 1.00 1.00 H new ATOM 0 HE1 HIS A 18 12.077 10.967 -2.513 1.00 1.00 H new ATOM 276 N LEU A 19 10.654 7.527 0.142 1.00 1.00 N ATOM 277 CA LEU A 19 10.747 6.408 -0.784 1.00 1.00 C ATOM 278 C LEU A 19 12.078 6.431 -1.526 1.00 1.00 C ATOM 279 O LEU A 19 12.311 7.318 -2.345 1.00 1.00 O ATOM 280 CB LEU A 19 9.604 6.457 -1.789 1.00 1.00 C ATOM 281 CG LEU A 19 8.354 5.671 -1.386 1.00 1.00 C ATOM 282 CD1 LEU A 19 7.092 6.413 -1.807 1.00 1.00 C ATOM 283 CD2 LEU A 19 8.386 4.284 -1.989 1.00 1.00 C ATOM 0 H LEU A 19 10.246 8.372 -0.257 1.00 1.00 H new ATOM 0 HA LEU A 19 10.680 5.486 -0.207 1.00 1.00 H new ATOM 0 HB2 LEU A 19 9.324 7.498 -1.948 1.00 1.00 H new ATOM 0 HB3 LEU A 19 9.963 6.074 -2.744 1.00 1.00 H new ATOM 0 HG LEU A 19 8.343 5.574 -0.300 1.00 1.00 H new ATOM 0 HD11 LEU A 19 6.215 5.837 -1.511 1.00 1.00 H new ATOM 0 HD12 LEU A 19 7.065 7.389 -1.323 1.00 1.00 H new ATOM 0 HD13 LEU A 19 7.091 6.545 -2.889 1.00 1.00 H new ATOM 0 HD21 LEU A 19 7.490 3.738 -1.693 1.00 1.00 H new ATOM 0 HD22 LEU A 19 8.422 4.360 -3.076 1.00 1.00 H new ATOM 0 HD23 LEU A 19 9.269 3.753 -1.633 1.00 1.00 H new ATOM 295 N PRO A 20 12.980 5.476 -1.249 1.00 1.00 N ATOM 296 CA PRO A 20 14.291 5.430 -1.897 1.00 1.00 C ATOM 297 C PRO A 20 14.209 4.970 -3.343 1.00 1.00 C ATOM 298 O PRO A 20 15.011 5.372 -4.191 1.00 1.00 O ATOM 299 CB PRO A 20 15.072 4.411 -1.062 1.00 1.00 C ATOM 300 CG PRO A 20 14.026 3.522 -0.478 1.00 1.00 C ATOM 301 CD PRO A 20 12.801 4.379 -0.282 1.00 1.00 C ATOM 0 HA PRO A 20 14.754 6.416 -1.935 1.00 1.00 H new ATOM 0 HB2 PRO A 20 15.772 3.847 -1.678 1.00 1.00 H new ATOM 0 HB3 PRO A 20 15.656 4.901 -0.283 1.00 1.00 H new ATOM 0 HG2 PRO A 20 13.812 2.685 -1.143 1.00 1.00 H new ATOM 0 HG3 PRO A 20 14.360 3.099 0.470 1.00 1.00 H new ATOM 0 HD2 PRO A 20 11.886 3.819 -0.477 1.00 1.00 H new ATOM 0 HD3 PRO A 20 12.734 4.753 0.740 1.00 1.00 H new ATOM 309 N TRP A 21 13.230 4.128 -3.632 1.00 1.00 N ATOM 310 CA TRP A 21 13.040 3.620 -4.982 1.00 1.00 C ATOM 311 C TRP A 21 11.771 4.187 -5.604 1.00 1.00 C ATOM 312 O TRP A 21 10.762 4.362 -4.925 1.00 1.00 O ATOM 313 CB TRP A 21 12.976 2.092 -4.961 1.00 1.00 C ATOM 314 CG TRP A 21 11.581 1.546 -4.837 1.00 1.00 C ATOM 315 CD1 TRP A 21 10.691 1.364 -5.858 1.00 1.00 C ATOM 316 CD2 TRP A 21 10.921 1.113 -3.647 1.00 1.00 C ATOM 317 NE1 TRP A 21 9.514 0.849 -5.370 1.00 1.00 N ATOM 318 CE2 TRP A 21 9.632 0.685 -4.014 1.00 1.00 C ATOM 319 CE3 TRP A 21 11.298 1.046 -2.305 1.00 1.00 C ATOM 320 CZ2 TRP A 21 8.718 0.198 -3.084 1.00 1.00 C ATOM 321 CZ3 TRP A 21 10.390 0.564 -1.383 1.00 1.00 C ATOM 322 CH2 TRP A 21 9.113 0.146 -1.777 1.00 1.00 C ATOM 0 H TRP A 21 12.555 3.782 -2.951 1.00 1.00 H new ATOM 0 HA TRP A 21 13.888 3.936 -5.589 1.00 1.00 H new ATOM 0 HB2 TRP A 21 13.428 1.706 -5.875 1.00 1.00 H new ATOM 0 HB3 TRP A 21 13.576 1.724 -4.129 1.00 1.00 H new ATOM 0 HD1 TRP A 21 10.884 1.591 -6.896 1.00 1.00 H new ATOM 0 HE1 TRP A 21 8.688 0.625 -5.925 1.00 1.00 H new ATOM 0 HE3 TRP A 21 12.282 1.365 -1.993 1.00 1.00 H new ATOM 0 HZ2 TRP A 21 7.733 -0.127 -3.384 1.00 1.00 H new ATOM 0 HZ3 TRP A 21 10.669 0.509 -0.341 1.00 1.00 H new ATOM 0 HH2 TRP A 21 8.425 -0.226 -1.032 1.00 1.00 H new ATOM 333 N HIS A 22 11.820 4.474 -6.901 1.00 1.00 N ATOM 334 CA HIS A 22 10.667 5.019 -7.604 1.00 1.00 C ATOM 335 C HIS A 22 10.219 4.076 -8.718 1.00 1.00 C ATOM 336 O HIS A 22 10.995 3.766 -9.622 1.00 1.00 O ATOM 337 CB HIS A 22 10.997 6.395 -8.187 1.00 1.00 C ATOM 338 CG HIS A 22 11.200 7.444 -7.139 1.00 1.00 C ATOM 339 ND1 HIS A 22 10.489 7.478 -5.957 1.00 1.00 N ATOM 340 CD2 HIS A 22 12.043 8.503 -7.098 1.00 1.00 C ATOM 341 CE1 HIS A 22 10.887 8.511 -5.236 1.00 1.00 C ATOM 342 NE2 HIS A 22 11.829 9.148 -5.906 1.00 1.00 N ATOM 0 H HIS A 22 12.645 4.338 -7.485 1.00 1.00 H new ATOM 0 HA HIS A 22 9.852 5.125 -6.888 1.00 1.00 H new ATOM 0 HB2 HIS A 22 11.898 6.318 -8.795 1.00 1.00 H new ATOM 0 HB3 HIS A 22 10.190 6.705 -8.851 1.00 1.00 H new ATOM 0 HD2 HIS A 22 12.752 8.787 -7.862 1.00 1.00 H new ATOM 0 HE1 HIS A 22 10.506 8.787 -4.264 1.00 1.00 H new ATOM 0 HE2 HIS A 22 12.319 9.985 -5.589 1.00 1.00 H new ATOM 351 N LEU A 23 8.978 3.606 -8.638 1.00 1.00 N ATOM 352 CA LEU A 23 8.442 2.691 -9.647 1.00 1.00 C ATOM 353 C LEU A 23 7.132 3.215 -10.221 1.00 1.00 C ATOM 354 O LEU A 23 6.045 2.904 -9.709 1.00 1.00 O ATOM 355 CB LEU A 23 8.237 1.300 -9.051 1.00 1.00 C ATOM 356 CG LEU A 23 8.952 0.173 -9.800 1.00 1.00 C ATOM 357 CD1 LEU A 23 10.452 0.222 -9.545 1.00 1.00 C ATOM 358 CD2 LEU A 23 8.389 -1.182 -9.394 1.00 1.00 C ATOM 0 H LEU A 23 8.325 3.841 -7.890 1.00 1.00 H new ATOM 0 HA LEU A 23 9.167 2.624 -10.458 1.00 1.00 H new ATOM 0 HB2 LEU A 23 8.583 1.308 -8.017 1.00 1.00 H new ATOM 0 HB3 LEU A 23 7.169 1.083 -9.028 1.00 1.00 H new ATOM 0 HG LEU A 23 8.781 0.313 -10.867 1.00 1.00 H new ATOM 0 HD11 LEU A 23 10.940 -0.588 -10.087 1.00 1.00 H new ATOM 0 HD12 LEU A 23 10.848 1.178 -9.887 1.00 1.00 H new ATOM 0 HD13 LEU A 23 10.643 0.111 -8.478 1.00 1.00 H new ATOM 0 HD21 LEU A 23 8.910 -1.970 -9.937 1.00 1.00 H new ATOM 0 HD22 LEU A 23 8.527 -1.327 -8.323 1.00 1.00 H new ATOM 0 HD23 LEU A 23 7.326 -1.220 -9.631 1.00 1.00 H new ATOM 370 N PRO A 24 7.209 4.032 -11.283 1.00 1.00 N ATOM 371 CA PRO A 24 6.025 4.616 -11.935 1.00 1.00 C ATOM 372 C PRO A 24 4.938 3.585 -12.198 1.00 1.00 C ATOM 373 O PRO A 24 3.752 3.888 -12.087 1.00 1.00 O ATOM 374 CB PRO A 24 6.585 5.172 -13.247 1.00 1.00 C ATOM 375 CG PRO A 24 7.999 5.505 -12.925 1.00 1.00 C ATOM 376 CD PRO A 24 8.457 4.454 -11.949 1.00 1.00 C ATOM 0 HA PRO A 24 5.543 5.370 -11.313 1.00 1.00 H new ATOM 0 HB2 PRO A 24 6.521 4.438 -14.051 1.00 1.00 H new ATOM 0 HB3 PRO A 24 6.033 6.053 -13.575 1.00 1.00 H new ATOM 0 HG2 PRO A 24 8.616 5.500 -13.823 1.00 1.00 H new ATOM 0 HG3 PRO A 24 8.077 6.502 -12.491 1.00 1.00 H new ATOM 0 HD2 PRO A 24 8.943 3.620 -12.456 1.00 1.00 H new ATOM 0 HD3 PRO A 24 9.176 4.856 -11.235 1.00 1.00 H new ATOM 384 N ASP A 25 5.340 2.363 -12.540 1.00 1.00 N ATOM 385 CA ASP A 25 4.393 1.290 -12.808 1.00 1.00 C ATOM 386 C ASP A 25 3.519 1.023 -11.588 1.00 1.00 C ATOM 387 O ASP A 25 2.290 1.018 -11.680 1.00 1.00 O ATOM 388 CB ASP A 25 5.127 0.009 -13.205 1.00 1.00 C ATOM 389 CG ASP A 25 5.678 0.079 -14.614 1.00 1.00 C ATOM 390 OD1 ASP A 25 5.712 1.193 -15.176 1.00 1.00 O ATOM 391 OD2 ASP A 25 6.084 -0.973 -15.153 1.00 1.00 O ATOM 0 H ASP A 25 6.319 2.093 -12.638 1.00 1.00 H new ATOM 0 HA ASP A 25 3.757 1.605 -13.635 1.00 1.00 H new ATOM 0 HB2 ASP A 25 5.944 -0.171 -12.506 1.00 1.00 H new ATOM 0 HB3 ASP A 25 4.446 -0.838 -13.125 1.00 1.00 H new ATOM 396 N ASP A 26 4.155 0.807 -10.432 1.00 1.00 N ATOM 397 CA ASP A 26 3.435 0.547 -9.196 1.00 1.00 C ATOM 398 C ASP A 26 2.619 1.765 -8.787 1.00 1.00 C ATOM 399 O ASP A 26 1.524 1.644 -8.232 1.00 1.00 O ATOM 400 CB ASP A 26 4.404 0.173 -8.064 1.00 1.00 C ATOM 401 CG ASP A 26 3.721 -0.538 -6.908 1.00 1.00 C ATOM 402 OD1 ASP A 26 3.120 0.154 -6.059 1.00 1.00 O ATOM 403 OD2 ASP A 26 3.804 -1.783 -6.841 1.00 1.00 O ATOM 0 H ASP A 26 5.170 0.809 -10.334 1.00 1.00 H new ATOM 0 HA ASP A 26 2.762 -0.292 -9.373 1.00 1.00 H new ATOM 0 HB2 ASP A 26 5.191 -0.467 -8.463 1.00 1.00 H new ATOM 0 HB3 ASP A 26 4.887 1.077 -7.693 1.00 1.00 H new ATOM 408 N LEU A 27 3.164 2.942 -9.066 1.00 1.00 N ATOM 409 CA LEU A 27 2.493 4.190 -8.722 1.00 1.00 C ATOM 410 C LEU A 27 1.175 4.316 -9.451 1.00 1.00 C ATOM 411 O LEU A 27 0.167 4.711 -8.867 1.00 1.00 O ATOM 412 CB LEU A 27 3.392 5.390 -9.048 1.00 1.00 C ATOM 413 CG LEU A 27 3.977 6.116 -7.832 1.00 1.00 C ATOM 414 CD1 LEU A 27 2.891 6.885 -7.094 1.00 1.00 C ATOM 415 CD2 LEU A 27 4.648 5.116 -6.907 1.00 1.00 C ATOM 0 H LEU A 27 4.066 3.059 -9.528 1.00 1.00 H new ATOM 0 HA LEU A 27 2.293 4.179 -7.651 1.00 1.00 H new ATOM 0 HB2 LEU A 27 4.214 5.048 -9.677 1.00 1.00 H new ATOM 0 HB3 LEU A 27 2.817 6.105 -9.636 1.00 1.00 H new ATOM 0 HG LEU A 27 4.724 6.832 -8.175 1.00 1.00 H new ATOM 0 HD11 LEU A 27 3.326 7.394 -6.234 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.447 7.621 -7.764 1.00 1.00 H new ATOM 0 HD13 LEU A 27 2.121 6.192 -6.755 1.00 1.00 H new ATOM 0 HD21 LEU A 27 5.062 5.639 -6.045 1.00 1.00 H new ATOM 0 HD22 LEU A 27 3.915 4.383 -6.570 1.00 1.00 H new ATOM 0 HD23 LEU A 27 5.450 4.607 -7.442 1.00 1.00 H new ATOM 427 N HIS A 28 1.178 3.947 -10.725 1.00 1.00 N ATOM 428 CA HIS A 28 -0.028 4.009 -11.532 1.00 1.00 C ATOM 429 C HIS A 28 -1.112 3.149 -10.899 1.00 1.00 C ATOM 430 O HIS A 28 -2.263 3.563 -10.820 1.00 1.00 O ATOM 431 CB HIS A 28 0.263 3.544 -12.960 1.00 1.00 C ATOM 432 CG HIS A 28 -0.699 4.098 -13.969 1.00 1.00 C ATOM 433 ND1 HIS A 28 -0.518 3.952 -15.328 1.00 1.00 N ATOM 434 CD2 HIS A 28 -1.852 4.793 -13.817 1.00 1.00 C ATOM 435 CE1 HIS A 28 -1.517 4.533 -15.969 1.00 1.00 C ATOM 436 NE2 HIS A 28 -2.339 5.050 -15.075 1.00 1.00 N ATOM 0 H HIS A 28 2.001 3.603 -11.219 1.00 1.00 H new ATOM 0 HA HIS A 28 -0.377 5.041 -11.575 1.00 1.00 H new ATOM 0 HB2 HIS A 28 1.276 3.840 -13.232 1.00 1.00 H new ATOM 0 HB3 HIS A 28 0.229 2.455 -12.995 1.00 1.00 H new ATOM 0 HD2 HIS A 28 -2.303 5.089 -12.882 1.00 1.00 H new ATOM 0 HE1 HIS A 28 -1.640 4.577 -17.041 1.00 1.00 H new ATOM 0 HE2 HIS A 28 -3.198 5.559 -15.285 1.00 1.00 H new ATOM 445 N TYR A 29 -0.726 1.966 -10.439 1.00 1.00 N ATOM 446 CA TYR A 29 -1.656 1.058 -9.795 1.00 1.00 C ATOM 447 C TYR A 29 -2.234 1.715 -8.554 1.00 1.00 C ATOM 448 O TYR A 29 -3.438 1.675 -8.310 1.00 1.00 O ATOM 449 CB TYR A 29 -0.956 -0.249 -9.426 1.00 1.00 C ATOM 450 CG TYR A 29 -1.721 -1.096 -8.431 1.00 1.00 C ATOM 451 CD1 TYR A 29 -2.808 -1.864 -8.833 1.00 1.00 C ATOM 452 CD2 TYR A 29 -1.350 -1.135 -7.093 1.00 1.00 C ATOM 453 CE1 TYR A 29 -3.502 -2.646 -7.929 1.00 1.00 C ATOM 454 CE2 TYR A 29 -2.040 -1.915 -6.183 1.00 1.00 C ATOM 455 CZ TYR A 29 -3.114 -2.669 -6.606 1.00 1.00 C ATOM 456 OH TYR A 29 -3.808 -3.456 -5.707 1.00 1.00 O ATOM 0 H TYR A 29 0.230 1.615 -10.502 1.00 1.00 H new ATOM 0 HA TYR A 29 -2.466 0.829 -10.488 1.00 1.00 H new ATOM 0 HB2 TYR A 29 -0.793 -0.831 -10.333 1.00 1.00 H new ATOM 0 HB3 TYR A 29 0.026 -0.019 -9.013 1.00 1.00 H new ATOM 0 HD1 TYR A 29 -3.115 -1.849 -9.868 1.00 1.00 H new ATOM 0 HD2 TYR A 29 -0.509 -0.546 -6.758 1.00 1.00 H new ATOM 0 HE1 TYR A 29 -4.345 -3.236 -8.257 1.00 1.00 H new ATOM 0 HE2 TYR A 29 -1.739 -1.933 -5.146 1.00 1.00 H new ATOM 0 HH TYR A 29 -4.505 -2.921 -5.274 1.00 1.00 H new ATOM 466 N PHE A 30 -1.356 2.328 -7.763 1.00 1.00 N ATOM 467 CA PHE A 30 -1.760 2.993 -6.528 1.00 1.00 C ATOM 468 C PHE A 30 -2.745 4.118 -6.814 1.00 1.00 C ATOM 469 O PHE A 30 -3.774 4.237 -6.139 1.00 1.00 O ATOM 470 CB PHE A 30 -0.530 3.533 -5.798 1.00 1.00 C ATOM 471 CG PHE A 30 -0.872 4.475 -4.673 1.00 1.00 C ATOM 472 CD1 PHE A 30 -1.097 3.983 -3.398 1.00 1.00 C ATOM 473 CD2 PHE A 30 -0.980 5.839 -4.892 1.00 1.00 C ATOM 474 CE1 PHE A 30 -1.423 4.834 -2.361 1.00 1.00 C ATOM 475 CE2 PHE A 30 -1.308 6.695 -3.857 1.00 1.00 C ATOM 476 CZ PHE A 30 -1.529 6.192 -2.590 1.00 1.00 C ATOM 0 H PHE A 30 -0.356 2.377 -7.957 1.00 1.00 H new ATOM 0 HA PHE A 30 -2.258 2.263 -5.890 1.00 1.00 H new ATOM 0 HB2 PHE A 30 0.045 2.696 -5.400 1.00 1.00 H new ATOM 0 HB3 PHE A 30 0.111 4.049 -6.513 1.00 1.00 H new ATOM 0 HD1 PHE A 30 -1.017 2.922 -3.213 1.00 1.00 H new ATOM 0 HD2 PHE A 30 -0.806 6.237 -5.881 1.00 1.00 H new ATOM 0 HE1 PHE A 30 -1.595 4.438 -1.371 1.00 1.00 H new ATOM 0 HE2 PHE A 30 -1.391 7.756 -4.039 1.00 1.00 H new ATOM 0 HZ PHE A 30 -1.784 6.859 -1.780 1.00 1.00 H new ATOM 486 N ARG A 31 -2.436 4.942 -7.817 1.00 1.00 N ATOM 487 CA ARG A 31 -3.306 6.058 -8.179 1.00 1.00 C ATOM 488 C ARG A 31 -4.672 5.550 -8.622 1.00 1.00 C ATOM 489 O ARG A 31 -5.697 6.093 -8.212 1.00 1.00 O ATOM 490 CB ARG A 31 -2.671 6.884 -9.303 1.00 1.00 C ATOM 491 CG ARG A 31 -3.444 8.137 -9.654 1.00 1.00 C ATOM 492 CD ARG A 31 -3.377 8.442 -11.142 1.00 1.00 C ATOM 493 NE ARG A 31 -2.007 8.715 -11.566 1.00 1.00 N ATOM 494 CZ ARG A 31 -1.638 8.878 -12.836 1.00 1.00 C ATOM 495 NH1 ARG A 31 -2.532 8.790 -13.815 1.00 1.00 N ATOM 496 NH2 ARG A 31 -0.370 9.129 -13.130 1.00 1.00 N ATOM 0 H ARG A 31 -1.595 4.857 -8.388 1.00 1.00 H new ATOM 0 HA ARG A 31 -3.434 6.690 -7.300 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -1.659 7.163 -9.009 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -2.583 6.261 -10.193 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -4.485 8.018 -9.354 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -3.044 8.981 -9.091 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -3.773 7.598 -11.707 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -4.008 9.301 -11.368 1.00 1.00 H new ATOM 0 HE ARG A 31 -1.288 8.785 -10.846 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -3.509 8.596 -13.597 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -2.241 8.916 -14.784 1.00 1.00 H new ATOM 0 HH21 ARG A 31 0.323 9.197 -12.384 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -0.087 9.254 -14.102 1.00 1.00 H new ATOM 510 N ALA A 32 -4.668 4.496 -9.434 1.00 1.00 N ATOM 511 CA ALA A 32 -5.905 3.887 -9.925 1.00 1.00 C ATOM 512 C ALA A 32 -6.715 3.301 -8.781 1.00 1.00 C ATOM 513 O ALA A 32 -7.942 3.360 -8.785 1.00 1.00 O ATOM 514 CB ALA A 32 -5.599 2.830 -10.981 1.00 1.00 C ATOM 0 H ALA A 32 -3.818 4.043 -9.768 1.00 1.00 H new ATOM 0 HA ALA A 32 -6.508 4.666 -10.391 1.00 1.00 H new ATOM 0 HB1 ALA A 32 -6.531 2.388 -11.334 1.00 1.00 H new ATOM 0 HB2 ALA A 32 -5.076 3.293 -11.818 1.00 1.00 H new ATOM 0 HB3 ALA A 32 -4.971 2.053 -10.546 1.00 1.00 H new ATOM 520 N GLN A 33 -6.023 2.724 -7.805 1.00 1.00 N ATOM 521 CA GLN A 33 -6.663 2.120 -6.648 1.00 1.00 C ATOM 522 C GLN A 33 -7.389 3.179 -5.824 1.00 1.00 C ATOM 523 O GLN A 33 -8.466 2.952 -5.299 1.00 1.00 O ATOM 524 CB GLN A 33 -5.635 1.414 -5.778 1.00 1.00 C ATOM 525 CG GLN A 33 -5.642 -0.099 -5.925 1.00 1.00 C ATOM 526 CD GLN A 33 -6.509 -0.782 -4.883 1.00 1.00 C ATOM 527 OE1 GLN A 33 -6.103 -1.764 -4.261 1.00 1.00 O ATOM 528 NE2 GLN A 33 -7.713 -0.258 -4.687 1.00 1.00 N ATOM 0 H GLN A 33 -5.005 2.663 -7.796 1.00 1.00 H new ATOM 0 HA GLN A 33 -7.388 1.389 -7.006 1.00 1.00 H new ATOM 0 HB2 GLN A 33 -4.643 1.789 -6.027 1.00 1.00 H new ATOM 0 HB3 GLN A 33 -5.819 1.669 -4.734 1.00 1.00 H new ATOM 0 HG2 GLN A 33 -6.001 -0.362 -6.920 1.00 1.00 H new ATOM 0 HG3 GLN A 33 -4.621 -0.473 -5.845 1.00 1.00 H new ATOM 0 HE21 GLN A 33 -8.008 0.557 -5.225 1.00 1.00 H new ATOM 0 HE22 GLN A 33 -8.343 -0.670 -3.998 1.00 1.00 H new ATOM 537 N THR A 34 -6.783 4.352 -5.708 1.00 1.00 N ATOM 538 CA THR A 34 -7.351 5.442 -4.915 1.00 1.00 C ATOM 539 C THR A 34 -8.503 6.142 -5.650 1.00 1.00 C ATOM 540 O THR A 34 -9.121 7.071 -5.107 1.00 1.00 O ATOM 541 CB THR A 34 -6.269 6.467 -4.568 1.00 1.00 C ATOM 542 OG1 THR A 34 -5.347 6.597 -5.638 1.00 1.00 O ATOM 543 CG2 THR A 34 -5.487 6.125 -3.317 1.00 1.00 C ATOM 0 H THR A 34 -5.894 4.577 -6.154 1.00 1.00 H new ATOM 0 HA THR A 34 -7.749 5.003 -4.000 1.00 1.00 H new ATOM 0 HB THR A 34 -6.802 7.400 -4.388 1.00 1.00 H new ATOM 0 HG1 THR A 34 -5.829 6.566 -6.491 1.00 1.00 H new ATOM 0 HG21 THR A 34 -4.738 6.896 -3.134 1.00 1.00 H new ATOM 0 HG22 THR A 34 -6.167 6.070 -2.467 1.00 1.00 H new ATOM 0 HG23 THR A 34 -4.992 5.163 -3.449 1.00 1.00 H new ATOM 551 N VAL A 35 -8.829 5.681 -6.841 1.00 1.00 N ATOM 552 CA VAL A 35 -9.931 6.276 -7.594 1.00 1.00 C ATOM 553 C VAL A 35 -11.241 5.567 -7.276 1.00 1.00 C ATOM 554 O VAL A 35 -11.379 4.364 -7.497 1.00 1.00 O ATOM 555 CB VAL A 35 -9.694 6.209 -9.124 1.00 1.00 C ATOM 556 CG1 VAL A 35 -10.489 7.285 -9.845 1.00 1.00 C ATOM 557 CG2 VAL A 35 -8.212 6.338 -9.438 1.00 1.00 C ATOM 0 H VAL A 35 -8.358 4.907 -7.309 1.00 1.00 H new ATOM 0 HA VAL A 35 -9.985 7.322 -7.293 1.00 1.00 H new ATOM 0 HB VAL A 35 -10.041 5.239 -9.480 1.00 1.00 H new ATOM 0 HG11 VAL A 35 -10.305 7.216 -10.917 1.00 1.00 H new ATOM 0 HG12 VAL A 35 -11.552 7.145 -9.649 1.00 1.00 H new ATOM 0 HG13 VAL A 35 -10.181 8.267 -9.486 1.00 1.00 H new ATOM 0 HG21 VAL A 35 -8.063 6.289 -10.517 1.00 1.00 H new ATOM 0 HG22 VAL A 35 -7.843 7.293 -9.064 1.00 1.00 H new ATOM 0 HG23 VAL A 35 -7.666 5.525 -8.959 1.00 1.00 H new ATOM 567 N GLY A 36 -12.185 6.327 -6.756 1.00 1.00 N ATOM 568 CA GLY A 36 -13.468 5.766 -6.393 1.00 1.00 C ATOM 569 C GLY A 36 -13.397 4.992 -5.086 1.00 1.00 C ATOM 570 O GLY A 36 -14.272 4.187 -4.788 1.00 1.00 O ATOM 0 H GLY A 36 -12.088 7.326 -6.577 1.00 1.00 H new ATOM 0 HA2 GLY A 36 -14.202 6.567 -6.302 1.00 1.00 H new ATOM 0 HA3 GLY A 36 -13.814 5.106 -7.188 1.00 1.00 H new ATOM 574 N LYS A 37 -12.352 5.240 -4.311 1.00 1.00 N ATOM 575 CA LYS A 37 -12.169 4.561 -3.040 1.00 1.00 C ATOM 576 C LYS A 37 -11.568 5.499 -2.011 1.00 1.00 C ATOM 577 O LYS A 37 -10.934 6.486 -2.365 1.00 1.00 O ATOM 578 CB LYS A 37 -11.270 3.338 -3.213 1.00 1.00 C ATOM 579 CG LYS A 37 -11.805 2.335 -4.225 1.00 1.00 C ATOM 580 CD LYS A 37 -11.253 0.949 -3.972 1.00 1.00 C ATOM 581 CE LYS A 37 -11.937 -0.079 -4.846 1.00 1.00 C ATOM 582 NZ LYS A 37 -11.205 -0.280 -6.131 1.00 1.00 N ATOM 0 H LYS A 37 -11.617 5.908 -4.542 1.00 1.00 H new ATOM 0 HA LYS A 37 -13.148 4.236 -2.687 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -10.279 3.666 -3.526 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -11.152 2.843 -2.249 1.00 1.00 H new ATOM 0 HG2 LYS A 37 -12.894 2.310 -4.174 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -11.540 2.656 -5.233 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -10.181 0.940 -4.167 1.00 1.00 H new ATOM 0 HD3 LYS A 37 -11.388 0.686 -2.923 1.00 1.00 H new ATOM 0 HE2 LYS A 37 -12.002 -1.027 -4.311 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -12.958 0.241 -5.054 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 -11.701 -0.991 -6.706 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -11.165 0.619 -6.652 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 -10.239 -0.609 -5.932 1.00 1.00 H new ATOM 596 N ILE A 38 -11.792 5.187 -0.735 1.00 1.00 N ATOM 597 CA ILE A 38 -11.283 6.010 0.356 1.00 1.00 C ATOM 598 C ILE A 38 -10.121 5.319 1.045 1.00 1.00 C ATOM 599 O ILE A 38 -10.220 4.156 1.437 1.00 1.00 O ATOM 600 CB ILE A 38 -12.383 6.303 1.390 1.00 1.00 C ATOM 601 CG1 ILE A 38 -13.658 6.785 0.686 1.00 1.00 C ATOM 602 CG2 ILE A 38 -11.908 7.345 2.390 1.00 1.00 C ATOM 603 CD1 ILE A 38 -14.804 7.049 1.633 1.00 1.00 C ATOM 0 H ILE A 38 -12.323 4.370 -0.434 1.00 1.00 H new ATOM 0 HA ILE A 38 -10.944 6.952 -0.074 1.00 1.00 H new ATOM 0 HB ILE A 38 -12.607 5.382 1.929 1.00 1.00 H new ATOM 0 HG12 ILE A 38 -13.436 7.698 0.133 1.00 1.00 H new ATOM 0 HG13 ILE A 38 -13.965 6.037 -0.045 1.00 1.00 H new ATOM 0 HG21 ILE A 38 -12.698 7.541 3.115 1.00 1.00 H new ATOM 0 HG22 ILE A 38 -11.024 6.975 2.909 1.00 1.00 H new ATOM 0 HG23 ILE A 38 -11.661 8.267 1.865 1.00 1.00 H new ATOM 0 HD11 ILE A 38 -15.673 7.387 1.068 1.00 1.00 H new ATOM 0 HD12 ILE A 38 -15.053 6.132 2.168 1.00 1.00 H new ATOM 0 HD13 ILE A 38 -14.515 7.819 2.348 1.00 1.00 H new ATOM 615 N MET A 39 -9.005 6.041 1.172 1.00 1.00 N ATOM 616 CA MET A 39 -7.804 5.503 1.790 1.00 1.00 C ATOM 617 C MET A 39 -7.276 6.431 2.877 1.00 1.00 C ATOM 618 O MET A 39 -7.428 7.646 2.791 1.00 1.00 O ATOM 619 CB MET A 39 -6.712 5.287 0.731 1.00 1.00 C ATOM 620 CG MET A 39 -5.479 6.150 0.954 1.00 1.00 C ATOM 621 SD MET A 39 -4.289 6.032 -0.387 1.00 1.00 S ATOM 622 CE MET A 39 -4.304 4.270 -0.693 1.00 1.00 C ATOM 0 H MET A 39 -8.914 7.005 0.851 1.00 1.00 H new ATOM 0 HA MET A 39 -8.067 4.549 2.246 1.00 1.00 H new ATOM 0 HB2 MET A 39 -6.417 4.238 0.732 1.00 1.00 H new ATOM 0 HB3 MET A 39 -7.124 5.502 -0.255 1.00 1.00 H new ATOM 0 HG2 MET A 39 -5.786 7.189 1.070 1.00 1.00 H new ATOM 0 HG3 MET A 39 -4.998 5.854 1.886 1.00 1.00 H new ATOM 0 HE1 MET A 39 -3.561 4.026 -1.453 1.00 1.00 H new ATOM 0 HE2 MET A 39 -4.068 3.739 0.229 1.00 1.00 H new ATOM 0 HE3 MET A 39 -5.292 3.970 -1.042 1.00 1.00 H new ATOM 632 N VAL A 40 -6.640 5.847 3.888 1.00 1.00 N ATOM 633 CA VAL A 40 -6.072 6.625 4.982 1.00 1.00 C ATOM 634 C VAL A 40 -4.563 6.424 5.030 1.00 1.00 C ATOM 635 O VAL A 40 -4.076 5.297 5.016 1.00 1.00 O ATOM 636 CB VAL A 40 -6.671 6.213 6.344 1.00 1.00 C ATOM 637 CG1 VAL A 40 -6.252 7.175 7.441 1.00 1.00 C ATOM 638 CG2 VAL A 40 -8.187 6.127 6.260 1.00 1.00 C ATOM 0 H VAL A 40 -6.506 4.839 3.972 1.00 1.00 H new ATOM 0 HA VAL A 40 -6.311 7.672 4.799 1.00 1.00 H new ATOM 0 HB VAL A 40 -6.282 5.226 6.595 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -6.689 6.859 8.388 1.00 1.00 H new ATOM 0 HG12 VAL A 40 -5.165 7.179 7.526 1.00 1.00 H new ATOM 0 HG13 VAL A 40 -6.600 8.179 7.197 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -8.589 5.835 7.230 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -8.591 7.099 5.977 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -8.468 5.385 5.513 1.00 1.00 H new ATOM 648 N VAL A 41 -3.832 7.521 5.065 1.00 1.00 N ATOM 649 CA VAL A 41 -2.377 7.463 5.092 1.00 1.00 C ATOM 650 C VAL A 41 -1.809 8.187 6.309 1.00 1.00 C ATOM 651 O VAL A 41 -2.174 9.330 6.592 1.00 1.00 O ATOM 652 CB VAL A 41 -1.768 8.092 3.817 1.00 1.00 C ATOM 653 CG1 VAL A 41 -1.306 7.000 2.861 1.00 1.00 C ATOM 654 CG2 VAL A 41 -2.772 9.022 3.145 1.00 1.00 C ATOM 0 H VAL A 41 -4.218 8.465 5.076 1.00 1.00 H new ATOM 0 HA VAL A 41 -2.110 6.407 5.144 1.00 1.00 H new ATOM 0 HB VAL A 41 -0.900 8.687 4.100 1.00 1.00 H new ATOM 0 HG11 VAL A 41 -0.879 7.455 1.967 1.00 1.00 H new ATOM 0 HG12 VAL A 41 -0.551 6.384 3.350 1.00 1.00 H new ATOM 0 HG13 VAL A 41 -2.156 6.378 2.581 1.00 1.00 H new ATOM 0 HG21 VAL A 41 -2.325 9.455 2.250 1.00 1.00 H new ATOM 0 HG22 VAL A 41 -3.663 8.458 2.869 1.00 1.00 H new ATOM 0 HG23 VAL A 41 -3.047 9.820 3.835 1.00 1.00 H new ATOM 664 N GLY A 42 -0.908 7.519 7.026 1.00 1.00 N ATOM 665 CA GLY A 42 -0.312 8.128 8.193 1.00 1.00 C ATOM 666 C GLY A 42 0.548 9.329 7.822 1.00 1.00 C ATOM 667 O GLY A 42 1.031 9.428 6.690 1.00 1.00 O ATOM 0 H GLY A 42 -0.585 6.574 6.818 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -1.097 8.441 8.882 1.00 1.00 H new ATOM 0 HA3 GLY A 42 0.297 7.392 8.717 1.00 1.00 H new ATOM 671 N ARG A 43 0.729 10.254 8.765 1.00 1.00 N ATOM 672 CA ARG A 43 1.527 11.460 8.528 1.00 1.00 C ATOM 673 C ARG A 43 2.989 11.137 8.193 1.00 1.00 C ATOM 674 O ARG A 43 3.546 11.687 7.266 1.00 1.00 O ATOM 675 CB ARG A 43 1.471 12.369 9.759 1.00 1.00 C ATOM 676 CG ARG A 43 1.417 13.851 9.431 1.00 1.00 C ATOM 677 CD ARG A 43 2.804 14.469 9.327 1.00 1.00 C ATOM 678 NE ARG A 43 2.998 15.172 8.060 1.00 1.00 N ATOM 679 CZ ARG A 43 3.939 16.093 7.850 1.00 1.00 C ATOM 680 NH1 ARG A 43 4.789 16.417 8.816 1.00 1.00 N ATOM 681 NH2 ARG A 43 4.031 16.695 6.671 1.00 1.00 N ATOM 0 H ARG A 43 0.333 10.192 9.703 1.00 1.00 H new ATOM 0 HA ARG A 43 1.098 11.968 7.665 1.00 1.00 H new ATOM 0 HB2 ARG A 43 0.595 12.107 10.352 1.00 1.00 H new ATOM 0 HB3 ARG A 43 2.346 12.177 10.380 1.00 1.00 H new ATOM 0 HG2 ARG A 43 0.886 13.994 8.490 1.00 1.00 H new ATOM 0 HG3 ARG A 43 0.846 14.371 10.201 1.00 1.00 H new ATOM 0 HD2 ARG A 43 2.954 15.164 10.153 1.00 1.00 H new ATOM 0 HD3 ARG A 43 3.557 13.688 9.427 1.00 1.00 H new ATOM 0 HE ARG A 43 2.373 14.943 7.287 1.00 1.00 H new ATOM 0 HH11 ARG A 43 4.725 15.961 9.726 1.00 1.00 H new ATOM 0 HH12 ARG A 43 5.506 17.122 8.649 1.00 1.00 H new ATOM 0 HH21 ARG A 43 3.381 16.454 5.923 1.00 1.00 H new ATOM 0 HH22 ARG A 43 4.752 17.399 6.513 1.00 1.00 H new ATOM 695 N ARG A 44 3.601 10.211 8.900 1.00 1.00 N ATOM 696 CA ARG A 44 4.994 9.874 8.613 1.00 1.00 C ATOM 697 C ARG A 44 5.112 9.380 7.179 1.00 1.00 C ATOM 698 O ARG A 44 6.093 9.664 6.485 1.00 1.00 O ATOM 699 CB ARG A 44 5.491 8.804 9.576 1.00 1.00 C ATOM 700 CG ARG A 44 6.055 9.360 10.869 1.00 1.00 C ATOM 701 CD ARG A 44 7.542 9.097 10.991 1.00 1.00 C ATOM 702 NE ARG A 44 8.213 10.116 11.802 1.00 1.00 N ATOM 703 CZ ARG A 44 9.508 10.081 12.112 1.00 1.00 C ATOM 704 NH1 ARG A 44 10.269 9.077 11.697 1.00 1.00 N ATOM 705 NH2 ARG A 44 10.041 11.054 12.839 1.00 1.00 N ATOM 0 H ARG A 44 3.175 9.684 9.662 1.00 1.00 H new ATOM 0 HA ARG A 44 5.608 10.765 8.740 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.668 8.128 9.810 1.00 1.00 H new ATOM 0 HB3 ARG A 44 6.260 8.211 9.080 1.00 1.00 H new ATOM 0 HG2 ARG A 44 5.870 10.433 10.915 1.00 1.00 H new ATOM 0 HG3 ARG A 44 5.535 8.911 11.715 1.00 1.00 H new ATOM 0 HD2 ARG A 44 7.701 8.115 11.437 1.00 1.00 H new ATOM 0 HD3 ARG A 44 7.989 9.072 9.997 1.00 1.00 H new ATOM 0 HE ARG A 44 7.657 10.897 12.149 1.00 1.00 H new ATOM 0 HH11 ARG A 44 9.863 8.327 11.138 1.00 1.00 H new ATOM 0 HH12 ARG A 44 11.260 9.055 11.937 1.00 1.00 H new ATOM 0 HH21 ARG A 44 9.459 11.828 13.160 1.00 1.00 H new ATOM 0 HH22 ARG A 44 11.033 11.028 13.077 1.00 1.00 H new ATOM 719 N THR A 45 4.102 8.655 6.751 1.00 1.00 N ATOM 720 CA THR A 45 4.041 8.116 5.403 1.00 1.00 C ATOM 721 C THR A 45 3.960 9.238 4.368 1.00 1.00 C ATOM 722 O THR A 45 4.648 9.204 3.340 1.00 1.00 O ATOM 723 CB THR A 45 2.877 7.131 5.274 1.00 1.00 C ATOM 724 OG1 THR A 45 3.156 5.939 5.979 1.00 1.00 O ATOM 725 CG2 THR A 45 2.572 6.751 3.849 1.00 1.00 C ATOM 0 H THR A 45 3.294 8.420 7.328 1.00 1.00 H new ATOM 0 HA THR A 45 4.961 7.566 5.205 1.00 1.00 H new ATOM 0 HB THR A 45 2.012 7.649 5.689 1.00 1.00 H new ATOM 0 HG1 THR A 45 3.133 6.116 6.943 1.00 1.00 H new ATOM 0 HG21 THR A 45 1.737 6.051 3.830 1.00 1.00 H new ATOM 0 HG22 THR A 45 2.309 7.644 3.282 1.00 1.00 H new ATOM 0 HG23 THR A 45 3.449 6.282 3.402 1.00 1.00 H new ATOM 733 N TYR A 46 3.124 10.236 4.633 1.00 1.00 N ATOM 734 CA TYR A 46 2.950 11.378 3.726 1.00 1.00 C ATOM 735 C TYR A 46 4.304 11.973 3.320 1.00 1.00 C ATOM 736 O TYR A 46 4.515 12.313 2.160 1.00 1.00 O ATOM 737 CB TYR A 46 2.096 12.460 4.391 1.00 1.00 C ATOM 738 CG TYR A 46 0.808 12.771 3.665 1.00 1.00 C ATOM 739 CD1 TYR A 46 0.118 11.800 2.951 1.00 1.00 C ATOM 740 CD2 TYR A 46 0.281 14.055 3.705 1.00 1.00 C ATOM 741 CE1 TYR A 46 -1.060 12.099 2.296 1.00 1.00 C ATOM 742 CE2 TYR A 46 -0.896 14.363 3.051 1.00 1.00 C ATOM 743 CZ TYR A 46 -1.563 13.382 2.349 1.00 1.00 C ATOM 744 OH TYR A 46 -2.735 13.689 1.687 1.00 1.00 O ATOM 0 H TYR A 46 2.549 10.282 5.474 1.00 1.00 H new ATOM 0 HA TYR A 46 2.445 11.017 2.830 1.00 1.00 H new ATOM 0 HB2 TYR A 46 1.859 12.146 5.407 1.00 1.00 H new ATOM 0 HB3 TYR A 46 2.685 13.374 4.469 1.00 1.00 H new ATOM 0 HD1 TYR A 46 0.509 10.794 2.907 1.00 1.00 H new ATOM 0 HD2 TYR A 46 0.800 14.825 4.256 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -1.585 11.332 1.745 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -1.292 15.367 3.089 1.00 1.00 H new ATOM 0 HH TYR A 46 -2.951 14.635 1.826 1.00 1.00 H new ATOM 754 N GLU A 47 5.210 12.089 4.284 1.00 1.00 N ATOM 755 CA GLU A 47 6.529 12.642 4.008 1.00 1.00 C ATOM 756 C GLU A 47 7.190 11.948 2.823 1.00 1.00 C ATOM 757 O GLU A 47 8.042 12.529 2.143 1.00 1.00 O ATOM 758 CB GLU A 47 7.424 12.517 5.242 1.00 1.00 C ATOM 759 CG GLU A 47 7.683 13.843 5.952 1.00 1.00 C ATOM 760 CD GLU A 47 7.990 13.670 7.420 1.00 1.00 C ATOM 761 OE1 GLU A 47 9.121 13.248 7.743 1.00 1.00 O ATOM 762 OE2 GLU A 47 7.107 13.969 8.252 1.00 1.00 O ATOM 0 H GLU A 47 5.058 11.811 5.253 1.00 1.00 H new ATOM 0 HA GLU A 47 6.399 13.695 3.757 1.00 1.00 H new ATOM 0 HB2 GLU A 47 6.963 11.823 5.945 1.00 1.00 H new ATOM 0 HB3 GLU A 47 8.378 12.082 4.945 1.00 1.00 H new ATOM 0 HG2 GLU A 47 8.517 14.352 5.469 1.00 1.00 H new ATOM 0 HG3 GLU A 47 6.810 14.486 5.841 1.00 1.00 H new ATOM 769 N SER A 48 6.810 10.695 2.586 1.00 1.00 N ATOM 770 CA SER A 48 7.363 9.918 1.494 1.00 1.00 C ATOM 771 C SER A 48 6.601 10.162 0.196 1.00 1.00 C ATOM 772 O SER A 48 7.204 10.273 -0.873 1.00 1.00 O ATOM 773 CB SER A 48 7.327 8.430 1.848 1.00 1.00 C ATOM 774 OG SER A 48 8.101 7.666 0.942 1.00 1.00 O ATOM 0 H SER A 48 6.115 10.198 3.144 1.00 1.00 H new ATOM 0 HA SER A 48 8.395 10.234 1.342 1.00 1.00 H new ATOM 0 HB2 SER A 48 7.702 8.286 2.861 1.00 1.00 H new ATOM 0 HB3 SER A 48 6.296 8.076 1.837 1.00 1.00 H new ATOM 0 HG SER A 48 8.461 6.879 1.402 1.00 1.00 H new ATOM 780 N PHE A 49 5.279 10.236 0.299 1.00 1.00 N ATOM 781 CA PHE A 49 4.416 10.458 -0.856 1.00 1.00 C ATOM 782 C PHE A 49 4.962 11.574 -1.759 1.00 1.00 C ATOM 783 O PHE A 49 4.850 12.752 -1.432 1.00 1.00 O ATOM 784 CB PHE A 49 3.009 10.817 -0.397 1.00 1.00 C ATOM 785 CG PHE A 49 2.109 9.625 -0.233 1.00 1.00 C ATOM 786 CD1 PHE A 49 2.617 8.392 0.148 1.00 1.00 C ATOM 787 CD2 PHE A 49 0.748 9.738 -0.462 1.00 1.00 C ATOM 788 CE1 PHE A 49 1.784 7.298 0.295 1.00 1.00 C ATOM 789 CE2 PHE A 49 -0.089 8.649 -0.315 1.00 1.00 C ATOM 790 CZ PHE A 49 0.430 7.427 0.062 1.00 1.00 C ATOM 0 H PHE A 49 4.776 10.144 1.182 1.00 1.00 H new ATOM 0 HA PHE A 49 4.390 9.533 -1.433 1.00 1.00 H new ATOM 0 HB2 PHE A 49 3.070 11.349 0.552 1.00 1.00 H new ATOM 0 HB3 PHE A 49 2.564 11.502 -1.119 1.00 1.00 H new ATOM 0 HD1 PHE A 49 3.676 8.285 0.332 1.00 1.00 H new ATOM 0 HD2 PHE A 49 0.335 10.691 -0.760 1.00 1.00 H new ATOM 0 HE1 PHE A 49 2.193 6.343 0.592 1.00 1.00 H new ATOM 0 HE2 PHE A 49 -1.149 8.754 -0.495 1.00 1.00 H new ATOM 0 HZ PHE A 49 -0.222 6.574 0.174 1.00 1.00 H new ATOM 800 N PRO A 50 5.555 11.216 -2.912 1.00 1.00 N ATOM 801 CA PRO A 50 6.105 12.194 -3.853 1.00 1.00 C ATOM 802 C PRO A 50 5.021 12.935 -4.629 1.00 1.00 C ATOM 803 O PRO A 50 5.265 14.019 -5.165 1.00 1.00 O ATOM 804 CB PRO A 50 6.953 11.339 -4.799 1.00 1.00 C ATOM 805 CG PRO A 50 6.269 10.014 -4.794 1.00 1.00 C ATOM 806 CD PRO A 50 5.739 9.828 -3.395 1.00 1.00 C ATOM 0 HA PRO A 50 6.667 12.976 -3.342 1.00 1.00 H new ATOM 0 HB2 PRO A 50 6.988 11.767 -5.801 1.00 1.00 H new ATOM 0 HB3 PRO A 50 7.983 11.259 -4.450 1.00 1.00 H new ATOM 0 HG2 PRO A 50 5.460 9.989 -5.525 1.00 1.00 H new ATOM 0 HG3 PRO A 50 6.962 9.216 -5.058 1.00 1.00 H new ATOM 0 HD2 PRO A 50 4.801 9.273 -3.391 1.00 1.00 H new ATOM 0 HD3 PRO A 50 6.440 9.274 -2.770 1.00 1.00 H new ATOM 814 N LYS A 51 3.832 12.345 -4.689 1.00 1.00 N ATOM 815 CA LYS A 51 2.715 12.959 -5.407 1.00 1.00 C ATOM 816 C LYS A 51 1.633 13.426 -4.444 1.00 1.00 C ATOM 817 O LYS A 51 0.558 12.830 -4.366 1.00 1.00 O ATOM 818 CB LYS A 51 2.120 11.970 -6.413 1.00 1.00 C ATOM 819 CG LYS A 51 3.161 11.213 -7.226 1.00 1.00 C ATOM 820 CD LYS A 51 2.670 10.948 -8.633 1.00 1.00 C ATOM 821 CE LYS A 51 3.826 10.729 -9.604 1.00 1.00 C ATOM 822 NZ LYS A 51 4.608 11.967 -9.825 1.00 1.00 N ATOM 0 H LYS A 51 3.615 11.449 -4.253 1.00 1.00 H new ATOM 0 HA LYS A 51 3.100 13.828 -5.941 1.00 1.00 H new ATOM 0 HB2 LYS A 51 1.499 11.252 -5.877 1.00 1.00 H new ATOM 0 HB3 LYS A 51 1.464 12.511 -7.095 1.00 1.00 H new ATOM 0 HG2 LYS A 51 4.086 11.788 -7.263 1.00 1.00 H new ATOM 0 HG3 LYS A 51 3.393 10.268 -6.735 1.00 1.00 H new ATOM 0 HD2 LYS A 51 2.024 10.070 -8.633 1.00 1.00 H new ATOM 0 HD3 LYS A 51 2.065 11.789 -8.972 1.00 1.00 H new ATOM 0 HE2 LYS A 51 4.482 9.950 -9.216 1.00 1.00 H new ATOM 0 HE3 LYS A 51 3.436 10.372 -10.557 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 5.134 11.890 -10.719 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 3.963 12.781 -9.872 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 5.277 12.100 -9.040 1.00 1.00 H new ATOM 836 N ARG A 52 1.927 14.495 -3.709 1.00 1.00 N ATOM 837 CA ARG A 52 0.987 15.058 -2.745 1.00 1.00 C ATOM 838 C ARG A 52 0.737 16.538 -3.048 1.00 1.00 C ATOM 839 O ARG A 52 1.679 17.267 -3.362 1.00 1.00 O ATOM 840 CB ARG A 52 1.541 14.900 -1.329 1.00 1.00 C ATOM 841 CG ARG A 52 0.479 14.794 -0.258 1.00 1.00 C ATOM 842 CD ARG A 52 0.011 16.173 0.190 1.00 1.00 C ATOM 843 NE ARG A 52 0.855 16.708 1.257 1.00 1.00 N ATOM 844 CZ ARG A 52 0.886 17.990 1.607 1.00 1.00 C ATOM 845 NH1 ARG A 52 0.115 18.874 0.985 1.00 1.00 N ATOM 846 NH2 ARG A 52 1.688 18.391 2.584 1.00 1.00 N ATOM 0 H ARG A 52 2.816 14.992 -3.764 1.00 1.00 H new ATOM 0 HA ARG A 52 0.041 14.522 -2.821 1.00 1.00 H new ATOM 0 HB2 ARG A 52 2.168 14.009 -1.293 1.00 1.00 H new ATOM 0 HB3 ARG A 52 2.184 15.751 -1.105 1.00 1.00 H new ATOM 0 HG2 ARG A 52 -0.369 14.225 -0.638 1.00 1.00 H new ATOM 0 HG3 ARG A 52 0.874 14.245 0.597 1.00 1.00 H new ATOM 0 HD2 ARG A 52 0.022 16.855 -0.660 1.00 1.00 H new ATOM 0 HD3 ARG A 52 -1.021 16.113 0.537 1.00 1.00 H new ATOM 0 HE ARG A 52 1.456 16.058 1.764 1.00 1.00 H new ATOM 0 HH11 ARG A 52 -0.505 18.571 0.234 1.00 1.00 H new ATOM 0 HH12 ARG A 52 0.143 19.856 1.258 1.00 1.00 H new ATOM 0 HH21 ARG A 52 2.281 17.716 3.067 1.00 1.00 H new ATOM 0 HH22 ARG A 52 1.712 19.375 2.853 1.00 1.00 H new ATOM 860 N PRO A 53 -0.528 17.014 -2.967 1.00 1.00 N ATOM 861 CA PRO A 53 -1.688 16.186 -2.595 1.00 1.00 C ATOM 862 C PRO A 53 -2.146 15.269 -3.718 1.00 1.00 C ATOM 863 O PRO A 53 -1.557 15.244 -4.795 1.00 1.00 O ATOM 864 CB PRO A 53 -2.769 17.216 -2.277 1.00 1.00 C ATOM 865 CG PRO A 53 -2.426 18.388 -3.133 1.00 1.00 C ATOM 866 CD PRO A 53 -0.919 18.408 -3.226 1.00 1.00 C ATOM 0 HA PRO A 53 -1.454 15.516 -1.768 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -3.763 16.833 -2.507 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -2.767 17.481 -1.220 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -2.877 18.295 -4.121 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -2.802 19.313 -2.697 1.00 1.00 H new ATOM 0 HD2 PRO A 53 -0.584 18.740 -4.209 1.00 1.00 H new ATOM 0 HD3 PRO A 53 -0.483 19.088 -2.494 1.00 1.00 H new ATOM 874 N LEU A 54 -3.209 14.512 -3.464 1.00 1.00 N ATOM 875 CA LEU A 54 -3.751 13.592 -4.454 1.00 1.00 C ATOM 876 C LEU A 54 -4.597 14.342 -5.481 1.00 1.00 C ATOM 877 O LEU A 54 -5.054 15.453 -5.230 1.00 1.00 O ATOM 878 CB LEU A 54 -4.598 12.516 -3.766 1.00 1.00 C ATOM 879 CG LEU A 54 -3.932 11.143 -3.655 1.00 1.00 C ATOM 880 CD1 LEU A 54 -3.293 10.969 -2.287 1.00 1.00 C ATOM 881 CD2 LEU A 54 -4.943 10.033 -3.911 1.00 1.00 C ATOM 0 H LEU A 54 -3.713 14.519 -2.577 1.00 1.00 H new ATOM 0 HA LEU A 54 -2.919 13.115 -4.971 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -4.854 12.861 -2.764 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -5.534 12.406 -4.314 1.00 1.00 H new ATOM 0 HG LEU A 54 -3.152 11.081 -4.413 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -2.824 9.987 -2.227 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -2.538 11.741 -2.137 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -4.058 11.054 -1.515 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -4.449 9.065 -3.827 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -5.746 10.096 -3.176 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -5.358 10.143 -4.913 1.00 1.00 H new ATOM 893 N PRO A 55 -4.799 13.734 -6.663 1.00 1.00 N ATOM 894 CA PRO A 55 -5.580 14.339 -7.744 1.00 1.00 C ATOM 895 C PRO A 55 -7.084 14.284 -7.492 1.00 1.00 C ATOM 896 O PRO A 55 -7.831 13.661 -8.250 1.00 1.00 O ATOM 897 CB PRO A 55 -5.205 13.481 -8.962 1.00 1.00 C ATOM 898 CG PRO A 55 -4.873 12.143 -8.375 1.00 1.00 C ATOM 899 CD PRO A 55 -4.255 12.420 -7.030 1.00 1.00 C ATOM 0 HA PRO A 55 -5.361 15.400 -7.860 1.00 1.00 H new ATOM 0 HB2 PRO A 55 -6.030 13.412 -9.671 1.00 1.00 H new ATOM 0 HB3 PRO A 55 -4.356 13.902 -9.501 1.00 1.00 H new ATOM 0 HG2 PRO A 55 -5.768 11.529 -8.274 1.00 1.00 H new ATOM 0 HG3 PRO A 55 -4.182 11.596 -9.017 1.00 1.00 H new ATOM 0 HD2 PRO A 55 -4.525 11.657 -6.300 1.00 1.00 H new ATOM 0 HD3 PRO A 55 -3.167 12.438 -7.085 1.00 1.00 H new ATOM 907 N GLU A 56 -7.524 14.963 -6.431 1.00 1.00 N ATOM 908 CA GLU A 56 -8.941 15.006 -6.076 1.00 1.00 C ATOM 909 C GLU A 56 -9.474 13.612 -5.755 1.00 1.00 C ATOM 910 O GLU A 56 -10.314 13.068 -6.481 1.00 1.00 O ATOM 911 CB GLU A 56 -9.760 15.635 -7.209 1.00 1.00 C ATOM 912 CG GLU A 56 -10.922 16.497 -6.733 1.00 1.00 C ATOM 913 CD GLU A 56 -11.613 17.231 -7.859 1.00 1.00 C ATOM 914 OE1 GLU A 56 -11.202 18.369 -8.170 1.00 1.00 O ATOM 915 OE2 GLU A 56 -12.574 16.672 -8.427 1.00 1.00 O ATOM 0 H GLU A 56 -6.918 15.491 -5.803 1.00 1.00 H new ATOM 0 HA GLU A 56 -9.041 15.622 -5.183 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -9.099 16.244 -7.826 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -10.148 14.841 -7.846 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -11.647 15.867 -6.218 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -10.556 17.221 -6.005 1.00 1.00 H new ATOM 922 N ARG A 57 -8.988 13.052 -4.656 1.00 1.00 N ATOM 923 CA ARG A 57 -9.417 11.723 -4.217 1.00 1.00 C ATOM 924 C ARG A 57 -9.756 11.743 -2.731 1.00 1.00 C ATOM 925 O ARG A 57 -9.345 12.651 -2.011 1.00 1.00 O ATOM 926 CB ARG A 57 -8.323 10.691 -4.496 1.00 1.00 C ATOM 927 CG ARG A 57 -8.596 9.836 -5.736 1.00 1.00 C ATOM 928 CD ARG A 57 -8.558 10.670 -7.012 1.00 1.00 C ATOM 929 NE ARG A 57 -7.816 10.009 -8.083 1.00 1.00 N ATOM 930 CZ ARG A 57 -7.944 10.315 -9.373 1.00 1.00 C ATOM 931 NH1 ARG A 57 -8.784 11.267 -9.756 1.00 1.00 N ATOM 932 NH2 ARG A 57 -7.225 9.669 -10.281 1.00 1.00 N ATOM 0 H ARG A 57 -8.297 13.493 -4.050 1.00 1.00 H new ATOM 0 HA ARG A 57 -10.310 11.443 -4.777 1.00 1.00 H new ATOM 0 HB2 ARG A 57 -7.371 11.207 -4.622 1.00 1.00 H new ATOM 0 HB3 ARG A 57 -8.220 10.038 -3.629 1.00 1.00 H new ATOM 0 HG2 ARG A 57 -7.855 9.039 -5.799 1.00 1.00 H new ATOM 0 HG3 ARG A 57 -9.571 9.358 -5.642 1.00 1.00 H new ATOM 0 HD2 ARG A 57 -9.577 10.866 -7.346 1.00 1.00 H new ATOM 0 HD3 ARG A 57 -8.101 11.636 -6.799 1.00 1.00 H new ATOM 0 HE ARG A 57 -7.161 9.270 -7.828 1.00 1.00 H new ATOM 0 HH11 ARG A 57 -9.336 11.769 -9.061 1.00 1.00 H new ATOM 0 HH12 ARG A 57 -8.878 11.497 -10.745 1.00 1.00 H new ATOM 0 HH21 ARG A 57 -6.575 8.939 -9.991 1.00 1.00 H new ATOM 0 HH22 ARG A 57 -7.322 9.903 -11.269 1.00 1.00 H new ATOM 946 N THR A 58 -10.507 10.731 -2.284 1.00 1.00 N ATOM 947 CA THR A 58 -10.894 10.642 -0.885 1.00 1.00 C ATOM 948 C THR A 58 -9.725 10.173 -0.031 1.00 1.00 C ATOM 949 O THR A 58 -9.663 9.012 0.380 1.00 1.00 O ATOM 950 CB THR A 58 -12.072 9.690 -0.710 1.00 1.00 C ATOM 951 OG1 THR A 58 -12.137 8.797 -1.811 1.00 1.00 O ATOM 952 CG2 THR A 58 -13.412 10.388 -0.590 1.00 1.00 C ATOM 0 H THR A 58 -10.853 9.971 -2.870 1.00 1.00 H new ATOM 0 HA THR A 58 -11.193 11.638 -0.558 1.00 1.00 H new ATOM 0 HB THR A 58 -11.890 9.164 0.227 1.00 1.00 H new ATOM 0 HG1 THR A 58 -11.407 8.146 -1.748 1.00 1.00 H new ATOM 0 HG21 THR A 58 -14.200 9.645 -0.468 1.00 1.00 H new ATOM 0 HG22 THR A 58 -13.401 11.050 0.276 1.00 1.00 H new ATOM 0 HG23 THR A 58 -13.600 10.972 -1.491 1.00 1.00 H new ATOM 960 N ASN A 59 -8.796 11.087 0.235 1.00 1.00 N ATOM 961 CA ASN A 59 -7.625 10.781 1.051 1.00 1.00 C ATOM 962 C ASN A 59 -7.789 11.353 2.455 1.00 1.00 C ATOM 963 O ASN A 59 -8.335 12.438 2.619 1.00 1.00 O ATOM 964 CB ASN A 59 -6.362 11.343 0.397 1.00 1.00 C ATOM 965 CG ASN A 59 -5.464 10.246 -0.134 1.00 1.00 C ATOM 966 OD1 ASN A 59 -5.930 9.544 -1.159 1.00 1.00 O flip ATOM 967 ND2 ASN A 59 -4.360 10.032 0.366 1.00 1.00 N flip ATOM 0 H ASN A 59 -8.832 12.048 -0.104 1.00 1.00 H new ATOM 0 HA ASN A 59 -7.530 9.698 1.126 1.00 1.00 H new ATOM 0 HB2 ASN A 59 -6.642 12.010 -0.419 1.00 1.00 H new ATOM 0 HB3 ASN A 59 -5.813 11.942 1.124 1.00 1.00 H new ATOM 0 HD21 ASN A 59 -4.039 10.595 1.154 1.00 1.00 H new ATOM 0 HD22 ASN A 59 -3.766 9.292 -0.007 1.00 1.00 H new ATOM 974 N VAL A 60 -7.327 10.622 3.467 1.00 1.00 N ATOM 975 CA VAL A 60 -7.423 11.080 4.864 1.00 1.00 C ATOM 976 C VAL A 60 -6.040 11.151 5.520 1.00 1.00 C ATOM 977 O VAL A 60 -5.285 10.178 5.467 1.00 1.00 O ATOM 978 CB VAL A 60 -8.326 10.151 5.697 1.00 1.00 C ATOM 979 CG1 VAL A 60 -8.451 10.663 7.129 1.00 1.00 C ATOM 980 CG2 VAL A 60 -9.692 10.019 5.043 1.00 1.00 C ATOM 0 H VAL A 60 -6.882 9.711 3.353 1.00 1.00 H new ATOM 0 HA VAL A 60 -7.862 12.078 4.840 1.00 1.00 H new ATOM 0 HB VAL A 60 -7.869 9.162 5.735 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.093 9.993 7.700 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.464 10.700 7.590 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -8.886 11.663 7.121 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -10.320 9.360 5.642 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -10.159 11.001 4.974 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -9.578 9.601 4.043 1.00 1.00 H new ATOM 990 N VAL A 61 -5.715 12.278 6.158 1.00 1.00 N ATOM 991 CA VAL A 61 -4.419 12.394 6.830 1.00 1.00 C ATOM 992 C VAL A 61 -4.561 12.077 8.314 1.00 1.00 C ATOM 993 O VAL A 61 -5.442 12.603 8.971 1.00 1.00 O ATOM 994 CB VAL A 61 -3.810 13.808 6.690 1.00 1.00 C ATOM 995 CG1 VAL A 61 -3.167 14.263 8.000 1.00 1.00 C ATOM 996 CG2 VAL A 61 -2.797 13.839 5.560 1.00 1.00 C ATOM 0 H VAL A 61 -6.313 13.102 6.223 1.00 1.00 H new ATOM 0 HA VAL A 61 -3.753 11.679 6.347 1.00 1.00 H new ATOM 0 HB VAL A 61 -4.617 14.502 6.454 1.00 1.00 H new ATOM 0 HG11 VAL A 61 -2.747 15.261 7.872 1.00 1.00 H new ATOM 0 HG12 VAL A 61 -3.921 14.285 8.787 1.00 1.00 H new ATOM 0 HG13 VAL A 61 -2.374 13.568 8.277 1.00 1.00 H new ATOM 0 HG21 VAL A 61 -2.378 14.841 5.475 1.00 1.00 H new ATOM 0 HG22 VAL A 61 -1.998 13.128 5.768 1.00 1.00 H new ATOM 0 HG23 VAL A 61 -3.287 13.570 4.624 1.00 1.00 H new ATOM 1006 N LEU A 62 -3.701 11.201 8.849 1.00 1.00 N ATOM 1007 CA LEU A 62 -3.786 10.849 10.262 1.00 1.00 C ATOM 1008 C LEU A 62 -2.740 11.623 11.057 1.00 1.00 C ATOM 1009 O LEU A 62 -1.546 11.576 10.755 1.00 1.00 O ATOM 1010 CB LEU A 62 -3.575 9.340 10.440 1.00 1.00 C ATOM 1011 CG LEU A 62 -4.579 8.634 11.363 1.00 1.00 C ATOM 1012 CD1 LEU A 62 -4.738 7.173 10.971 1.00 1.00 C ATOM 1013 CD2 LEU A 62 -4.143 8.738 12.820 1.00 1.00 C ATOM 0 H LEU A 62 -2.955 10.734 8.333 1.00 1.00 H new ATOM 0 HA LEU A 62 -4.776 11.113 10.634 1.00 1.00 H new ATOM 0 HB2 LEU A 62 -3.616 8.867 9.459 1.00 1.00 H new ATOM 0 HB3 LEU A 62 -2.571 9.175 10.831 1.00 1.00 H new ATOM 0 HG LEU A 62 -5.542 9.133 11.251 1.00 1.00 H new ATOM 0 HD11 LEU A 62 -5.454 6.693 11.638 1.00 1.00 H new ATOM 0 HD12 LEU A 62 -5.099 7.109 9.945 1.00 1.00 H new ATOM 0 HD13 LEU A 62 -3.775 6.669 11.049 1.00 1.00 H new ATOM 0 HD21 LEU A 62 -4.870 8.231 13.454 1.00 1.00 H new ATOM 0 HD22 LEU A 62 -3.166 8.270 12.942 1.00 1.00 H new ATOM 0 HD23 LEU A 62 -4.081 9.788 13.107 1.00 1.00 H new ATOM 1025 N THR A 63 -3.203 12.330 12.090 1.00 1.00 N ATOM 1026 CA THR A 63 -2.305 13.111 12.934 1.00 1.00 C ATOM 1027 C THR A 63 -2.641 12.940 14.403 1.00 1.00 C ATOM 1028 O THR A 63 -3.764 12.594 14.764 1.00 1.00 O ATOM 1029 CB THR A 63 -2.377 14.590 12.559 1.00 1.00 C ATOM 1030 OG1 THR A 63 -3.527 15.201 13.117 1.00 1.00 O ATOM 1031 CG2 THR A 63 -2.414 14.840 11.073 1.00 1.00 C ATOM 0 H THR A 63 -4.186 12.376 12.358 1.00 1.00 H new ATOM 0 HA THR A 63 -1.292 12.744 12.768 1.00 1.00 H new ATOM 0 HB THR A 63 -1.460 15.021 12.961 1.00 1.00 H new ATOM 0 HG1 THR A 63 -3.256 15.832 13.816 1.00 1.00 H new ATOM 0 HG21 THR A 63 -2.465 15.913 10.886 1.00 1.00 H new ATOM 0 HG22 THR A 63 -1.513 14.434 10.613 1.00 1.00 H new ATOM 0 HG23 THR A 63 -3.291 14.355 10.644 1.00 1.00 H new ATOM 1039 N HIS A 64 -1.656 13.195 15.252 1.00 1.00 N ATOM 1040 CA HIS A 64 -1.830 13.079 16.695 1.00 1.00 C ATOM 1041 C HIS A 64 -2.810 14.111 17.217 1.00 1.00 C ATOM 1042 O HIS A 64 -3.639 13.814 18.083 1.00 1.00 O ATOM 1043 CB HIS A 64 -0.485 13.232 17.413 1.00 1.00 C ATOM 1044 CG HIS A 64 0.299 11.956 17.517 1.00 1.00 C ATOM 1045 ND1 HIS A 64 1.517 11.625 17.028 1.00 1.00 N flip ATOM 1046 CD2 HIS A 64 -0.160 10.841 18.185 1.00 1.00 C flip ATOM 1047 CE1 HIS A 64 1.769 10.329 17.405 1.00 1.00 C flip ATOM 1048 NE2 HIS A 64 0.744 9.878 18.103 1.00 1.00 N flip ATOM 0 H HIS A 64 -0.721 13.486 14.965 1.00 1.00 H new ATOM 0 HA HIS A 64 -2.234 12.087 16.899 1.00 1.00 H new ATOM 0 HB2 HIS A 64 0.115 13.973 16.885 1.00 1.00 H new ATOM 0 HB3 HIS A 64 -0.662 13.621 18.416 1.00 1.00 H new ATOM 0 HD2 HIS A 64 -1.109 10.765 18.695 1.00 1.00 H new ATOM 0 HE1 HIS A 64 2.662 9.769 17.168 1.00 1.00 H new ATOM 0 HE2 HIS A 64 0.662 8.946 18.510 1.00 1.00 H new ATOM 1057 N GLN A 65 -2.716 15.331 16.697 1.00 1.00 N ATOM 1058 CA GLN A 65 -3.593 16.404 17.128 1.00 1.00 C ATOM 1059 C GLN A 65 -4.659 16.707 16.082 1.00 1.00 C ATOM 1060 O GLN A 65 -4.346 16.904 14.907 1.00 1.00 O ATOM 1061 CB GLN A 65 -2.777 17.672 17.408 1.00 1.00 C ATOM 1062 CG GLN A 65 -1.816 17.544 18.577 1.00 1.00 C ATOM 1063 CD GLN A 65 -2.316 18.261 19.813 1.00 1.00 C ATOM 1064 OE1 GLN A 65 -2.030 19.440 20.016 1.00 1.00 O ATOM 1065 NE2 GLN A 65 -3.088 17.561 20.637 1.00 1.00 N ATOM 0 H GLN A 65 -2.042 15.597 15.979 1.00 1.00 H new ATOM 0 HA GLN A 65 -4.091 16.078 18.041 1.00 1.00 H new ATOM 0 HB2 GLN A 65 -2.212 17.932 16.513 1.00 1.00 H new ATOM 0 HB3 GLN A 65 -3.462 18.497 17.603 1.00 1.00 H new ATOM 0 HG2 GLN A 65 -1.666 16.489 18.807 1.00 1.00 H new ATOM 0 HG3 GLN A 65 -0.845 17.949 18.292 1.00 1.00 H new ATOM 0 HE21 GLN A 65 -3.301 16.585 20.431 1.00 1.00 H new ATOM 0 HE22 GLN A 65 -3.468 18.000 21.476 1.00 1.00 H new ATOM 1074 N GLU A 66 -5.910 16.761 16.521 1.00 1.00 N ATOM 1075 CA GLU A 66 -7.033 17.055 15.637 1.00 1.00 C ATOM 1076 C GLU A 66 -6.928 18.493 15.135 1.00 1.00 C ATOM 1077 O GLU A 66 -7.298 18.803 14.004 1.00 1.00 O ATOM 1078 CB GLU A 66 -8.363 16.847 16.373 1.00 1.00 C ATOM 1079 CG GLU A 66 -8.596 17.851 17.492 1.00 1.00 C ATOM 1080 CD GLU A 66 -9.987 17.743 18.078 1.00 1.00 C ATOM 1081 OE1 GLU A 66 -10.942 18.225 17.431 1.00 1.00 O ATOM 1082 OE2 GLU A 66 -10.128 17.169 19.177 1.00 1.00 O ATOM 0 H GLU A 66 -6.175 16.604 17.493 1.00 1.00 H new ATOM 0 HA GLU A 66 -7.001 16.375 14.786 1.00 1.00 H new ATOM 0 HB2 GLU A 66 -9.181 16.916 15.656 1.00 1.00 H new ATOM 0 HB3 GLU A 66 -8.387 15.839 16.788 1.00 1.00 H new ATOM 0 HG2 GLU A 66 -7.859 17.692 18.279 1.00 1.00 H new ATOM 0 HG3 GLU A 66 -8.442 18.860 17.110 1.00 1.00 H new ATOM 1089 N ASP A 67 -6.445 19.365 16.004 1.00 1.00 N ATOM 1090 CA ASP A 67 -6.288 20.780 15.681 1.00 1.00 C ATOM 1091 C ASP A 67 -5.219 20.988 14.606 1.00 1.00 C ATOM 1092 O ASP A 67 -5.242 21.986 13.890 1.00 1.00 O ATOM 1093 CB ASP A 67 -5.910 21.567 16.938 1.00 1.00 C ATOM 1094 CG ASP A 67 -7.025 22.463 17.429 1.00 1.00 C ATOM 1095 OD1 ASP A 67 -8.124 21.949 17.722 1.00 1.00 O ATOM 1096 OD2 ASP A 67 -6.792 23.687 17.531 1.00 1.00 O ATOM 0 H ASP A 67 -6.151 19.118 16.949 1.00 1.00 H new ATOM 0 HA ASP A 67 -7.240 21.143 15.294 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -5.637 20.869 17.729 1.00 1.00 H new ATOM 0 HB3 ASP A 67 -5.029 22.173 16.730 1.00 1.00 H new ATOM 1101 N TYR A 68 -4.270 20.048 14.498 1.00 1.00 N ATOM 1102 CA TYR A 68 -3.202 20.168 13.510 1.00 1.00 C ATOM 1103 C TYR A 68 -3.786 20.201 12.095 1.00 1.00 C ATOM 1104 O TYR A 68 -4.666 19.416 11.750 1.00 1.00 O ATOM 1105 CB TYR A 68 -2.223 18.990 13.650 1.00 1.00 C ATOM 1106 CG TYR A 68 -1.014 19.075 12.732 1.00 1.00 C ATOM 1107 CD1 TYR A 68 -0.525 20.311 12.320 1.00 1.00 C ATOM 1108 CD2 TYR A 68 -0.369 17.930 12.278 1.00 1.00 C ATOM 1109 CE1 TYR A 68 0.571 20.401 11.483 1.00 1.00 C ATOM 1110 CE2 TYR A 68 0.727 18.012 11.441 1.00 1.00 C ATOM 1111 CZ TYR A 68 1.193 19.250 11.047 1.00 1.00 C ATOM 1112 OH TYR A 68 2.282 19.348 10.208 1.00 1.00 O ATOM 0 H TYR A 68 -4.224 19.209 15.076 1.00 1.00 H new ATOM 0 HA TYR A 68 -2.665 21.100 13.686 1.00 1.00 H new ATOM 0 HB2 TYR A 68 -1.879 18.939 14.683 1.00 1.00 H new ATOM 0 HB3 TYR A 68 -2.757 18.062 13.445 1.00 1.00 H new ATOM 0 HD1 TYR A 68 -1.010 21.214 12.660 1.00 1.00 H new ATOM 0 HD2 TYR A 68 -0.731 16.960 12.585 1.00 1.00 H new ATOM 0 HE1 TYR A 68 0.938 21.368 11.172 1.00 1.00 H new ATOM 0 HE2 TYR A 68 1.216 17.113 11.097 1.00 1.00 H new ATOM 0 HH TYR A 68 2.609 18.450 9.990 1.00 1.00 H new ATOM 1122 N GLN A 69 -3.292 21.138 11.291 1.00 1.00 N ATOM 1123 CA GLN A 69 -3.743 21.327 9.930 1.00 1.00 C ATOM 1124 C GLN A 69 -3.165 20.293 8.978 1.00 1.00 C ATOM 1125 O GLN A 69 -1.973 20.005 9.000 1.00 1.00 O ATOM 1126 CB GLN A 69 -3.346 22.719 9.488 1.00 1.00 C ATOM 1127 CG GLN A 69 -4.521 23.644 9.237 1.00 1.00 C ATOM 1128 CD GLN A 69 -4.115 24.918 8.503 1.00 1.00 C ATOM 1129 OE1 GLN A 69 -4.849 25.418 7.651 1.00 1.00 O ATOM 1130 NE2 GLN A 69 -2.934 25.434 8.824 1.00 1.00 N ATOM 0 H GLN A 69 -2.561 21.790 11.576 1.00 1.00 H new ATOM 0 HA GLN A 69 -4.826 21.204 9.904 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -2.704 23.162 10.250 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -2.754 22.645 8.576 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -5.276 23.117 8.653 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -4.981 23.908 10.189 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -2.358 24.986 9.537 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -2.603 26.279 8.358 1.00 1.00 H new ATOM 1139 N ALA A 70 -4.024 19.756 8.120 1.00 1.00 N ATOM 1140 CA ALA A 70 -3.614 18.770 7.127 1.00 1.00 C ATOM 1141 C ALA A 70 -4.057 19.203 5.729 1.00 1.00 C ATOM 1142 O ALA A 70 -5.087 19.837 5.575 1.00 1.00 O ATOM 1143 CB ALA A 70 -4.179 17.403 7.463 1.00 1.00 C ATOM 0 H ALA A 70 -5.017 19.989 8.092 1.00 1.00 H new ATOM 0 HA ALA A 70 -2.526 18.703 7.141 1.00 1.00 H new ATOM 0 HB1 ALA A 70 -3.861 16.683 6.709 1.00 1.00 H new ATOM 0 HB2 ALA A 70 -3.815 17.089 8.441 1.00 1.00 H new ATOM 0 HB3 ALA A 70 -5.268 17.453 7.480 1.00 1.00 H new ATOM 1149 N GLN A 71 -3.251 18.890 4.721 1.00 1.00 N ATOM 1150 CA GLN A 71 -3.580 19.296 3.366 1.00 1.00 C ATOM 1151 C GLN A 71 -3.986 18.131 2.472 1.00 1.00 C ATOM 1152 O GLN A 71 -3.253 17.156 2.323 1.00 1.00 O ATOM 1153 CB GLN A 71 -2.398 20.038 2.742 1.00 1.00 C ATOM 1154 CG GLN A 71 -2.581 21.550 2.738 1.00 1.00 C ATOM 1155 CD GLN A 71 -2.066 22.198 4.016 1.00 1.00 C ATOM 1156 OE1 GLN A 71 -2.432 21.807 5.125 1.00 1.00 O ATOM 1157 NE2 GLN A 71 -1.177 23.172 3.859 1.00 1.00 N ATOM 0 H GLN A 71 -2.381 18.366 4.816 1.00 1.00 H new ATOM 0 HA GLN A 71 -4.445 19.955 3.439 1.00 1.00 H new ATOM 0 HB2 GLN A 71 -1.489 19.789 3.290 1.00 1.00 H new ATOM 0 HB3 GLN A 71 -2.258 19.692 1.718 1.00 1.00 H new ATOM 0 HG2 GLN A 71 -2.058 21.975 1.881 1.00 1.00 H new ATOM 0 HG3 GLN A 71 -3.638 21.785 2.614 1.00 1.00 H new ATOM 0 HE21 GLN A 71 -0.902 23.465 2.922 1.00 1.00 H new ATOM 0 HE22 GLN A 71 -0.769 23.627 4.676 1.00 1.00 H new ATOM 1166 N GLY A 72 -5.146 18.265 1.856 1.00 1.00 N ATOM 1167 CA GLY A 72 -5.649 17.265 0.931 1.00 1.00 C ATOM 1168 C GLY A 72 -6.223 16.030 1.595 1.00 1.00 C ATOM 1169 O GLY A 72 -6.741 15.147 0.922 1.00 1.00 O ATOM 0 H GLY A 72 -5.764 19.066 1.982 1.00 1.00 H new ATOM 0 HA2 GLY A 72 -6.420 17.719 0.308 1.00 1.00 H new ATOM 0 HA3 GLY A 72 -4.840 16.962 0.267 1.00 1.00 H new ATOM 1173 N ALA A 73 -6.138 15.935 2.920 1.00 1.00 N ATOM 1174 CA ALA A 73 -6.678 14.748 3.587 1.00 1.00 C ATOM 1175 C ALA A 73 -7.242 15.055 4.976 1.00 1.00 C ATOM 1176 O ALA A 73 -6.661 15.828 5.732 1.00 1.00 O ATOM 1177 CB ALA A 73 -5.603 13.683 3.647 1.00 1.00 C ATOM 0 H ALA A 73 -5.719 16.633 3.534 1.00 1.00 H new ATOM 0 HA ALA A 73 -7.522 14.382 3.002 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -5.997 12.796 4.142 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -5.290 13.425 2.635 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -4.747 14.061 4.207 1.00 1.00 H new ATOM 1183 N VAL A 74 -8.368 14.423 5.316 1.00 1.00 N ATOM 1184 CA VAL A 74 -9.042 14.639 6.607 1.00 1.00 C ATOM 1185 C VAL A 74 -8.178 14.216 7.785 1.00 1.00 C ATOM 1186 O VAL A 74 -7.530 13.177 7.739 1.00 1.00 O ATOM 1187 CB VAL A 74 -10.371 13.859 6.658 1.00 1.00 C ATOM 1188 CG1 VAL A 74 -10.831 13.664 8.098 1.00 1.00 C ATOM 1189 CG2 VAL A 74 -11.434 14.569 5.838 1.00 1.00 C ATOM 0 H VAL A 74 -8.839 13.750 4.711 1.00 1.00 H new ATOM 0 HA VAL A 74 -9.231 15.710 6.687 1.00 1.00 H new ATOM 0 HB VAL A 74 -10.208 12.872 6.224 1.00 1.00 H new ATOM 0 HG11 VAL A 74 -11.770 13.111 8.108 1.00 1.00 H new ATOM 0 HG12 VAL A 74 -10.075 13.105 8.649 1.00 1.00 H new ATOM 0 HG13 VAL A 74 -10.977 14.636 8.568 1.00 1.00 H new ATOM 0 HG21 VAL A 74 -12.366 14.006 5.884 1.00 1.00 H new ATOM 0 HG22 VAL A 74 -11.595 15.570 6.239 1.00 1.00 H new ATOM 0 HG23 VAL A 74 -11.105 14.642 4.801 1.00 1.00 H new ATOM 1199 N VAL A 75 -8.171 15.058 8.830 1.00 1.00 N ATOM 1200 CA VAL A 75 -7.360 14.806 10.017 1.00 1.00 C ATOM 1201 C VAL A 75 -8.137 14.064 11.091 1.00 1.00 C ATOM 1202 O VAL A 75 -9.105 14.588 11.647 1.00 1.00 O ATOM 1203 CB VAL A 75 -6.851 16.122 10.614 1.00 1.00 C ATOM 1204 CG1 VAL A 75 -5.646 15.890 11.519 1.00 1.00 C ATOM 1205 CG2 VAL A 75 -6.516 17.116 9.504 1.00 1.00 C ATOM 0 H VAL A 75 -8.720 15.917 8.871 1.00 1.00 H new ATOM 0 HA VAL A 75 -6.523 14.187 9.694 1.00 1.00 H new ATOM 0 HB VAL A 75 -7.646 16.545 11.228 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -5.309 16.843 11.927 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -5.927 15.225 12.335 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -4.840 15.436 10.942 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -6.156 18.046 9.945 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -5.743 16.696 8.861 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -7.410 17.317 8.913 1.00 1.00 H new ATOM 1215 N VAL A 76 -7.692 12.840 11.396 1.00 1.00 N ATOM 1216 CA VAL A 76 -8.338 12.032 12.424 1.00 1.00 C ATOM 1217 C VAL A 76 -7.306 11.576 13.461 1.00 1.00 C ATOM 1218 O VAL A 76 -6.283 10.979 13.122 1.00 1.00 O ATOM 1219 CB VAL A 76 -9.028 10.803 11.804 1.00 1.00 C ATOM 1220 CG1 VAL A 76 -10.351 10.514 12.506 1.00 1.00 C ATOM 1221 CG2 VAL A 76 -9.245 10.994 10.311 1.00 1.00 C ATOM 0 H VAL A 76 -6.892 12.394 10.947 1.00 1.00 H new ATOM 0 HA VAL A 76 -9.095 12.646 12.912 1.00 1.00 H new ATOM 0 HB VAL A 76 -8.371 9.944 11.943 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -10.821 9.642 12.052 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -10.167 10.318 13.562 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -11.012 11.375 12.406 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -9.734 10.111 9.899 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -9.874 11.869 10.144 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -8.283 11.139 9.819 1.00 1.00 H new ATOM 1231 N HIS A 77 -7.603 11.834 14.734 1.00 1.00 N ATOM 1232 CA HIS A 77 -6.726 11.420 15.822 1.00 1.00 C ATOM 1233 C HIS A 77 -6.815 9.924 16.072 1.00 1.00 C ATOM 1234 O HIS A 77 -5.820 9.284 16.411 1.00 1.00 O ATOM 1235 CB HIS A 77 -7.020 12.195 17.116 1.00 1.00 C ATOM 1236 CG HIS A 77 -8.479 12.337 17.431 1.00 1.00 C ATOM 1237 ND1 HIS A 77 -9.169 11.441 18.221 1.00 1.00 N ATOM 1238 CD2 HIS A 77 -9.383 13.264 17.038 1.00 1.00 C ATOM 1239 CE1 HIS A 77 -10.434 11.812 18.301 1.00 1.00 C ATOM 1240 NE2 HIS A 77 -10.590 12.916 17.592 1.00 1.00 N ATOM 0 H HIS A 77 -8.444 12.327 15.034 1.00 1.00 H new ATOM 0 HA HIS A 77 -5.708 11.655 15.511 1.00 1.00 H new ATOM 0 HB2 HIS A 77 -6.528 11.691 17.948 1.00 1.00 H new ATOM 0 HB3 HIS A 77 -6.578 13.189 17.039 1.00 1.00 H new ATOM 0 HD1 HIS A 77 -8.765 10.620 18.673 1.00 1.00 H new ATOM 0 HD2 HIS A 77 -9.191 14.119 16.406 1.00 1.00 H new ATOM 0 HE1 HIS A 77 -11.209 11.300 18.852 1.00 1.00 H new ATOM 1249 N ASP A 78 -8.026 9.385 15.963 1.00 1.00 N ATOM 1250 CA ASP A 78 -8.239 7.971 16.232 1.00 1.00 C ATOM 1251 C ASP A 78 -8.287 7.126 14.971 1.00 1.00 C ATOM 1252 O ASP A 78 -9.219 7.235 14.172 1.00 1.00 O ATOM 1253 CB ASP A 78 -9.520 7.754 17.048 1.00 1.00 C ATOM 1254 CG ASP A 78 -9.326 8.119 18.513 1.00 1.00 C ATOM 1255 OD1 ASP A 78 -8.344 8.828 18.812 1.00 1.00 O ATOM 1256 OD2 ASP A 78 -10.145 7.694 19.356 1.00 1.00 O ATOM 0 H ASP A 78 -8.864 9.900 15.694 1.00 1.00 H new ATOM 0 HA ASP A 78 -7.376 7.643 16.811 1.00 1.00 H new ATOM 0 HB2 ASP A 78 -10.325 8.356 16.627 1.00 1.00 H new ATOM 0 HB3 ASP A 78 -9.828 6.711 16.971 1.00 1.00 H new ATOM 1261 N VAL A 79 -7.293 6.270 14.833 1.00 1.00 N ATOM 1262 CA VAL A 79 -7.200 5.361 13.695 1.00 1.00 C ATOM 1263 C VAL A 79 -8.372 4.380 13.693 1.00 1.00 C ATOM 1264 O VAL A 79 -8.961 4.095 12.657 1.00 1.00 O ATOM 1265 CB VAL A 79 -5.872 4.579 13.717 1.00 1.00 C ATOM 1266 CG1 VAL A 79 -4.688 5.521 13.590 1.00 1.00 C ATOM 1267 CG2 VAL A 79 -5.761 3.752 14.984 1.00 1.00 C ATOM 0 H VAL A 79 -6.527 6.181 15.501 1.00 1.00 H new ATOM 0 HA VAL A 79 -7.236 5.964 12.787 1.00 1.00 H new ATOM 0 HB VAL A 79 -5.862 3.903 12.862 1.00 1.00 H new ATOM 0 HG11 VAL A 79 -3.762 4.946 13.608 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -4.757 6.068 12.650 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -4.693 6.226 14.421 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -4.817 3.207 14.981 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -5.798 4.410 15.852 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -6.588 3.044 15.030 1.00 1.00 H new ATOM 1277 N ALA A 80 -8.676 3.862 14.886 1.00 1.00 N ATOM 1278 CA ALA A 80 -9.763 2.885 15.056 1.00 1.00 C ATOM 1279 C ALA A 80 -11.111 3.490 14.689 1.00 1.00 C ATOM 1280 O ALA A 80 -11.971 2.807 14.116 1.00 1.00 O ATOM 1281 CB ALA A 80 -9.775 2.375 16.490 1.00 1.00 C ATOM 0 H ALA A 80 -8.188 4.100 15.749 1.00 1.00 H new ATOM 0 HA ALA A 80 -9.585 2.048 14.381 1.00 1.00 H new ATOM 0 HB1 ALA A 80 -10.581 1.652 16.612 1.00 1.00 H new ATOM 0 HB2 ALA A 80 -8.821 1.897 16.714 1.00 1.00 H new ATOM 0 HB3 ALA A 80 -9.931 3.211 17.172 1.00 1.00 H new ATOM 1287 N ALA A 81 -11.309 4.767 15.014 1.00 1.00 N ATOM 1288 CA ALA A 81 -12.573 5.430 14.703 1.00 1.00 C ATOM 1289 C ALA A 81 -12.798 5.488 13.191 1.00 1.00 C ATOM 1290 O ALA A 81 -13.922 5.307 12.714 1.00 1.00 O ATOM 1291 CB ALA A 81 -12.592 6.831 15.287 1.00 1.00 C ATOM 0 H ALA A 81 -10.622 5.355 15.485 1.00 1.00 H new ATOM 0 HA ALA A 81 -13.380 4.850 15.150 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -13.540 7.312 15.047 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -12.477 6.776 16.369 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -11.773 7.412 14.864 1.00 1.00 H new ATOM 1297 N VAL A 82 -11.732 5.728 12.440 1.00 1.00 N ATOM 1298 CA VAL A 82 -11.828 5.794 10.990 1.00 1.00 C ATOM 1299 C VAL A 82 -12.272 4.446 10.438 1.00 1.00 C ATOM 1300 O VAL A 82 -13.130 4.366 9.569 1.00 1.00 O ATOM 1301 CB VAL A 82 -10.486 6.198 10.351 1.00 1.00 C ATOM 1302 CG1 VAL A 82 -10.616 6.311 8.832 1.00 1.00 C ATOM 1303 CG2 VAL A 82 -10.000 7.511 10.943 1.00 1.00 C ATOM 0 H VAL A 82 -10.794 5.880 12.810 1.00 1.00 H new ATOM 0 HA VAL A 82 -12.565 6.557 10.739 1.00 1.00 H new ATOM 0 HB VAL A 82 -9.753 5.421 10.569 1.00 1.00 H new ATOM 0 HG11 VAL A 82 -9.655 6.597 8.405 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -10.924 5.350 8.421 1.00 1.00 H new ATOM 0 HG13 VAL A 82 -11.362 7.067 8.586 1.00 1.00 H new ATOM 0 HG21 VAL A 82 -9.051 7.788 10.484 1.00 1.00 H new ATOM 0 HG22 VAL A 82 -10.737 8.291 10.751 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -9.864 7.397 12.018 1.00 1.00 H new ATOM 1313 N PHE A 83 -11.663 3.385 10.983 1.00 1.00 N ATOM 1314 CA PHE A 83 -11.964 2.021 10.591 1.00 1.00 C ATOM 1315 C PHE A 83 -13.413 1.658 10.865 1.00 1.00 C ATOM 1316 O PHE A 83 -14.077 1.057 10.013 1.00 1.00 O ATOM 1317 CB PHE A 83 -11.048 1.047 11.326 1.00 1.00 C ATOM 1318 CG PHE A 83 -11.273 -0.395 10.959 1.00 1.00 C ATOM 1319 CD1 PHE A 83 -10.737 -0.929 9.797 1.00 1.00 C ATOM 1320 CD2 PHE A 83 -12.028 -1.215 11.783 1.00 1.00 C ATOM 1321 CE1 PHE A 83 -10.950 -2.254 9.465 1.00 1.00 C ATOM 1322 CE2 PHE A 83 -12.246 -2.539 11.455 1.00 1.00 C ATOM 1323 CZ PHE A 83 -11.705 -3.060 10.295 1.00 1.00 C ATOM 0 H PHE A 83 -10.949 3.459 11.708 1.00 1.00 H new ATOM 0 HA PHE A 83 -11.795 1.949 9.517 1.00 1.00 H new ATOM 0 HB2 PHE A 83 -10.011 1.308 11.114 1.00 1.00 H new ATOM 0 HB3 PHE A 83 -11.194 1.166 12.400 1.00 1.00 H new ATOM 0 HD1 PHE A 83 -10.147 -0.303 9.144 1.00 1.00 H new ATOM 0 HD2 PHE A 83 -12.451 -0.814 12.692 1.00 1.00 H new ATOM 0 HE1 PHE A 83 -10.527 -2.659 8.558 1.00 1.00 H new ATOM 0 HE2 PHE A 83 -12.839 -3.166 12.104 1.00 1.00 H new ATOM 0 HZ PHE A 83 -11.872 -4.096 10.038 1.00 1.00 H new ATOM 1333 N ALA A 84 -13.897 2.014 12.048 1.00 1.00 N ATOM 1334 CA ALA A 84 -15.274 1.714 12.428 1.00 1.00 C ATOM 1335 C ALA A 84 -16.256 2.436 11.514 1.00 1.00 C ATOM 1336 O ALA A 84 -17.292 1.898 11.149 1.00 1.00 O ATOM 1337 CB ALA A 84 -15.505 2.095 13.892 1.00 1.00 C ATOM 0 H ALA A 84 -13.360 2.509 12.760 1.00 1.00 H new ATOM 0 HA ALA A 84 -15.445 0.643 12.317 1.00 1.00 H new ATOM 0 HB1 ALA A 84 -16.535 1.868 14.169 1.00 1.00 H new ATOM 0 HB2 ALA A 84 -14.825 1.527 14.527 1.00 1.00 H new ATOM 0 HB3 ALA A 84 -15.320 3.161 14.024 1.00 1.00 H new ATOM 1343 N TYR A 85 -15.906 3.673 11.140 1.00 1.00 N ATOM 1344 CA TYR A 85 -16.769 4.455 10.264 1.00 1.00 C ATOM 1345 C TYR A 85 -16.946 3.742 8.934 1.00 1.00 C ATOM 1346 O TYR A 85 -18.061 3.616 8.436 1.00 1.00 O ATOM 1347 CB TYR A 85 -16.178 5.847 10.029 1.00 1.00 C ATOM 1348 CG TYR A 85 -16.848 6.922 10.849 1.00 1.00 C ATOM 1349 CD1 TYR A 85 -18.079 7.447 10.472 1.00 1.00 C ATOM 1350 CD2 TYR A 85 -16.248 7.418 11.998 1.00 1.00 C ATOM 1351 CE1 TYR A 85 -18.691 8.436 11.218 1.00 1.00 C ATOM 1352 CE2 TYR A 85 -16.854 8.407 12.750 1.00 1.00 C ATOM 1353 CZ TYR A 85 -18.075 8.912 12.356 1.00 1.00 C ATOM 1354 OH TYR A 85 -18.670 9.897 13.111 1.00 1.00 O ATOM 0 H TYR A 85 -15.047 4.142 11.427 1.00 1.00 H new ATOM 0 HA TYR A 85 -17.740 4.564 10.746 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -15.114 5.828 10.266 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -16.265 6.098 8.972 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -18.565 7.076 9.582 1.00 1.00 H new ATOM 0 HD2 TYR A 85 -15.292 7.025 12.310 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -19.647 8.834 10.911 1.00 1.00 H new ATOM 0 HE2 TYR A 85 -16.374 8.782 13.642 1.00 1.00 H new ATOM 0 HH TYR A 85 -18.098 10.112 13.878 1.00 1.00 H new ATOM 1364 N ALA A 86 -15.838 3.268 8.378 1.00 1.00 N ATOM 1365 CA ALA A 86 -15.858 2.543 7.118 1.00 1.00 C ATOM 1366 C ALA A 86 -16.630 1.247 7.264 1.00 1.00 C ATOM 1367 O ALA A 86 -17.356 0.835 6.361 1.00 1.00 O ATOM 1368 CB ALA A 86 -14.447 2.278 6.637 1.00 1.00 C ATOM 0 H ALA A 86 -14.909 3.375 8.785 1.00 1.00 H new ATOM 0 HA ALA A 86 -16.362 3.157 6.372 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -14.481 1.735 5.693 1.00 1.00 H new ATOM 0 HB2 ALA A 86 -13.928 3.226 6.492 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -13.915 1.683 7.379 1.00 1.00 H new ATOM 1374 N LYS A 87 -16.489 0.604 8.422 1.00 1.00 N ATOM 1375 CA LYS A 87 -17.188 -0.657 8.685 1.00 1.00 C ATOM 1376 C LYS A 87 -18.702 -0.442 8.650 1.00 1.00 C ATOM 1377 O LYS A 87 -19.447 -1.290 8.170 1.00 1.00 O ATOM 1378 CB LYS A 87 -16.765 -1.233 10.037 1.00 1.00 C ATOM 1379 CG LYS A 87 -17.405 -2.568 10.362 1.00 1.00 C ATOM 1380 CD LYS A 87 -17.771 -2.660 11.841 1.00 1.00 C ATOM 1381 CE LYS A 87 -16.543 -2.845 12.708 1.00 1.00 C ATOM 1382 NZ LYS A 87 -16.369 -4.264 13.144 1.00 1.00 N ATOM 0 H LYS A 87 -15.902 0.931 9.189 1.00 1.00 H new ATOM 0 HA LYS A 87 -16.918 -1.370 7.906 1.00 1.00 H new ATOM 0 HB2 LYS A 87 -15.681 -1.348 10.049 1.00 1.00 H new ATOM 0 HB3 LYS A 87 -17.018 -0.519 10.821 1.00 1.00 H new ATOM 0 HG2 LYS A 87 -18.300 -2.703 9.754 1.00 1.00 H new ATOM 0 HG3 LYS A 87 -16.720 -3.375 10.103 1.00 1.00 H new ATOM 0 HD2 LYS A 87 -18.298 -1.755 12.143 1.00 1.00 H new ATOM 0 HD3 LYS A 87 -18.456 -3.494 11.996 1.00 1.00 H new ATOM 0 HE2 LYS A 87 -15.659 -2.525 12.156 1.00 1.00 H new ATOM 0 HE3 LYS A 87 -16.620 -2.204 13.586 1.00 1.00 H new ATOM 0 HZ1 LYS A 87 -15.517 -4.344 13.735 1.00 1.00 H new ATOM 0 HZ2 LYS A 87 -17.200 -4.563 13.693 1.00 1.00 H new ATOM 0 HZ3 LYS A 87 -16.269 -4.874 12.308 1.00 1.00 H new ATOM 1396 N GLN A 88 -19.145 0.701 9.161 1.00 1.00 N ATOM 1397 CA GLN A 88 -20.566 1.012 9.188 1.00 1.00 C ATOM 1398 C GLN A 88 -21.111 1.126 7.772 1.00 1.00 C ATOM 1399 O GLN A 88 -22.219 0.666 7.479 1.00 1.00 O ATOM 1400 CB GLN A 88 -20.822 2.322 9.949 1.00 1.00 C ATOM 1401 CG GLN A 88 -20.818 2.165 11.467 1.00 1.00 C ATOM 1402 CD GLN A 88 -21.960 1.322 11.991 1.00 1.00 C ATOM 1403 OE1 GLN A 88 -23.032 1.834 12.312 1.00 1.00 O ATOM 1404 NE2 GLN A 88 -21.731 0.018 12.093 1.00 1.00 N ATOM 0 H GLN A 88 -18.544 1.422 9.559 1.00 1.00 H new ATOM 0 HA GLN A 88 -21.080 0.201 9.704 1.00 1.00 H new ATOM 0 HB2 GLN A 88 -20.061 3.050 9.667 1.00 1.00 H new ATOM 0 HB3 GLN A 88 -21.784 2.730 9.638 1.00 1.00 H new ATOM 0 HG2 GLN A 88 -19.874 1.715 11.775 1.00 1.00 H new ATOM 0 HG3 GLN A 88 -20.866 3.152 11.926 1.00 1.00 H new ATOM 0 HE21 GLN A 88 -20.827 -0.364 11.815 1.00 1.00 H new ATOM 0 HE22 GLN A 88 -22.459 -0.601 12.449 1.00 1.00 H new ATOM 1413 N HIS A 89 -20.315 1.728 6.893 1.00 1.00 N ATOM 1414 CA HIS A 89 -20.696 1.893 5.494 1.00 1.00 C ATOM 1415 C HIS A 89 -20.082 0.785 4.636 1.00 1.00 C ATOM 1416 O HIS A 89 -18.944 0.900 4.182 1.00 1.00 O ATOM 1417 CB HIS A 89 -20.227 3.256 4.978 1.00 1.00 C ATOM 1418 CG HIS A 89 -20.825 4.407 5.733 1.00 1.00 C ATOM 1419 ND1 HIS A 89 -21.133 4.538 7.044 1.00 1.00 N flip ATOM 1420 CD2 HIS A 89 -21.175 5.601 5.137 1.00 1.00 C flip ATOM 1421 CE1 HIS A 89 -21.657 5.796 7.215 1.00 1.00 C flip ATOM 1422 NE2 HIS A 89 -21.670 6.417 6.050 1.00 1.00 N flip ATOM 0 H HIS A 89 -19.399 2.111 7.126 1.00 1.00 H new ATOM 0 HA HIS A 89 -21.782 1.834 5.426 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -19.140 3.310 5.046 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -20.485 3.347 3.923 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -21.062 5.832 4.088 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -22.002 6.210 8.151 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -22.005 7.366 5.883 1.00 1.00 H new ATOM 1431 N PRO A 90 -20.821 -0.325 4.400 1.00 1.00 N ATOM 1432 CA PRO A 90 -20.320 -1.446 3.592 1.00 1.00 C ATOM 1433 C PRO A 90 -19.959 -1.029 2.175 1.00 1.00 C ATOM 1434 O PRO A 90 -19.050 -1.598 1.559 1.00 1.00 O ATOM 1435 CB PRO A 90 -21.481 -2.449 3.589 1.00 1.00 C ATOM 1436 CG PRO A 90 -22.684 -1.667 4.007 1.00 1.00 C ATOM 1437 CD PRO A 90 -22.179 -0.560 4.889 1.00 1.00 C ATOM 0 HA PRO A 90 -19.398 -1.857 4.004 1.00 1.00 H new ATOM 0 HB2 PRO A 90 -21.620 -2.885 2.600 1.00 1.00 H new ATOM 0 HB3 PRO A 90 -21.290 -3.273 4.277 1.00 1.00 H new ATOM 0 HG2 PRO A 90 -23.208 -1.265 3.140 1.00 1.00 H new ATOM 0 HG3 PRO A 90 -23.392 -2.299 4.543 1.00 1.00 H new ATOM 0 HD2 PRO A 90 -22.796 0.334 4.804 1.00 1.00 H new ATOM 0 HD3 PRO A 90 -22.182 -0.851 5.939 1.00 1.00 H new ATOM 1445 N ASP A 91 -20.678 -0.037 1.654 1.00 1.00 N ATOM 1446 CA ASP A 91 -20.432 0.455 0.309 1.00 1.00 C ATOM 1447 C ASP A 91 -19.046 1.073 0.225 1.00 1.00 C ATOM 1448 O ASP A 91 -18.370 0.983 -0.795 1.00 1.00 O ATOM 1449 CB ASP A 91 -21.490 1.488 -0.067 1.00 1.00 C ATOM 1450 CG ASP A 91 -21.325 2.020 -1.476 1.00 1.00 C ATOM 1451 OD1 ASP A 91 -20.374 2.793 -1.721 1.00 1.00 O ATOM 1452 OD2 ASP A 91 -22.149 1.654 -2.339 1.00 1.00 O ATOM 0 H ASP A 91 -21.434 0.439 2.146 1.00 1.00 H new ATOM 0 HA ASP A 91 -20.487 -0.380 -0.390 1.00 1.00 H new ATOM 0 HB2 ASP A 91 -22.479 1.040 0.033 1.00 1.00 H new ATOM 0 HB3 ASP A 91 -21.444 2.319 0.637 1.00 1.00 H new ATOM 1457 N GLN A 92 -18.630 1.725 1.316 1.00 1.00 N ATOM 1458 CA GLN A 92 -17.325 2.369 1.375 1.00 1.00 C ATOM 1459 C GLN A 92 -16.214 1.368 1.650 1.00 1.00 C ATOM 1460 O GLN A 92 -16.322 0.524 2.535 1.00 1.00 O ATOM 1461 CB GLN A 92 -17.308 3.451 2.467 1.00 1.00 C ATOM 1462 CG GLN A 92 -18.055 4.704 2.074 1.00 1.00 C ATOM 1463 CD GLN A 92 -18.046 5.762 3.160 1.00 1.00 C ATOM 1464 OE1 GLN A 92 -18.009 5.434 4.345 1.00 1.00 O ATOM 1465 NE2 GLN A 92 -18.079 7.027 2.768 1.00 1.00 N ATOM 0 H GLN A 92 -19.183 1.818 2.168 1.00 1.00 H new ATOM 0 HA GLN A 92 -17.148 2.824 0.400 1.00 1.00 H new ATOM 0 HB2 GLN A 92 -17.746 3.045 3.379 1.00 1.00 H new ATOM 0 HB3 GLN A 92 -16.274 3.709 2.698 1.00 1.00 H new ATOM 0 HG2 GLN A 92 -17.611 5.117 1.168 1.00 1.00 H new ATOM 0 HG3 GLN A 92 -19.086 4.446 1.834 1.00 1.00 H new ATOM 0 HE21 GLN A 92 -18.109 7.252 1.774 1.00 1.00 H new ATOM 0 HE22 GLN A 92 -18.074 7.776 3.461 1.00 1.00 H new ATOM 1474 N GLU A 93 -15.128 1.485 0.899 1.00 1.00 N ATOM 1475 CA GLU A 93 -13.985 0.603 1.069 1.00 1.00 C ATOM 1476 C GLU A 93 -12.785 1.379 1.579 1.00 1.00 C ATOM 1477 O GLU A 93 -12.408 2.393 1.000 1.00 1.00 O ATOM 1478 CB GLU A 93 -13.627 -0.096 -0.250 1.00 1.00 C ATOM 1479 CG GLU A 93 -13.242 -1.551 -0.079 1.00 1.00 C ATOM 1480 CD GLU A 93 -14.430 -2.494 -0.028 1.00 1.00 C ATOM 1481 OE1 GLU A 93 -15.298 -2.420 -0.924 1.00 1.00 O ATOM 1482 OE2 GLU A 93 -14.479 -3.322 0.905 1.00 1.00 O ATOM 0 H GLU A 93 -15.016 2.184 0.165 1.00 1.00 H new ATOM 0 HA GLU A 93 -14.257 -0.156 1.802 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -14.477 -0.031 -0.929 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -12.801 0.437 -0.722 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -12.591 -1.845 -0.903 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -12.664 -1.659 0.839 1.00 1.00 H new ATOM 1489 N LEU A 94 -12.196 0.908 2.669 1.00 1.00 N ATOM 1490 CA LEU A 94 -11.048 1.579 3.250 1.00 1.00 C ATOM 1491 C LEU A 94 -9.735 0.856 2.936 1.00 1.00 C ATOM 1492 O LEU A 94 -9.585 -0.341 3.185 1.00 1.00 O ATOM 1493 CB LEU A 94 -11.215 1.716 4.769 1.00 1.00 C ATOM 1494 CG LEU A 94 -10.839 3.086 5.351 1.00 1.00 C ATOM 1495 CD1 LEU A 94 -11.846 4.137 4.901 1.00 1.00 C ATOM 1496 CD2 LEU A 94 -10.787 3.023 6.875 1.00 1.00 C ATOM 0 H LEU A 94 -12.494 0.068 3.165 1.00 1.00 H new ATOM 0 HA LEU A 94 -10.998 2.570 2.799 1.00 1.00 H new ATOM 0 HB2 LEU A 94 -12.253 1.504 5.024 1.00 1.00 H new ATOM 0 HB3 LEU A 94 -10.606 0.954 5.255 1.00 1.00 H new ATOM 0 HG LEU A 94 -9.851 3.362 4.984 1.00 1.00 H new ATOM 0 HD11 LEU A 94 -11.572 5.106 5.318 1.00 1.00 H new ATOM 0 HD12 LEU A 94 -11.847 4.198 3.813 1.00 1.00 H new ATOM 0 HD13 LEU A 94 -12.841 3.860 5.250 1.00 1.00 H new ATOM 0 HD21 LEU A 94 -10.519 4.003 7.271 1.00 1.00 H new ATOM 0 HD22 LEU A 94 -11.764 2.731 7.261 1.00 1.00 H new ATOM 0 HD23 LEU A 94 -10.041 2.291 7.184 1.00 1.00 H new ATOM 1508 N VAL A 95 -8.793 1.615 2.400 1.00 1.00 N ATOM 1509 CA VAL A 95 -7.460 1.098 2.055 1.00 1.00 C ATOM 1510 C VAL A 95 -6.390 1.888 2.793 1.00 1.00 C ATOM 1511 O VAL A 95 -6.432 3.119 2.813 1.00 1.00 O ATOM 1512 CB VAL A 95 -7.186 1.171 0.541 1.00 1.00 C ATOM 1513 CG1 VAL A 95 -8.101 2.177 -0.143 1.00 1.00 C ATOM 1514 CG2 VAL A 95 -5.732 1.491 0.257 1.00 1.00 C ATOM 0 H VAL A 95 -8.921 2.605 2.189 1.00 1.00 H new ATOM 0 HA VAL A 95 -7.432 0.051 2.355 1.00 1.00 H new ATOM 0 HB VAL A 95 -7.401 0.186 0.127 1.00 1.00 H new ATOM 0 HG11 VAL A 95 -7.880 2.203 -1.210 1.00 1.00 H new ATOM 0 HG12 VAL A 95 -9.140 1.883 0.006 1.00 1.00 H new ATOM 0 HG13 VAL A 95 -7.939 3.166 0.285 1.00 1.00 H new ATOM 0 HG21 VAL A 95 -5.573 1.535 -0.820 1.00 1.00 H new ATOM 0 HG22 VAL A 95 -5.478 2.453 0.701 1.00 1.00 H new ATOM 0 HG23 VAL A 95 -5.098 0.715 0.686 1.00 1.00 H new ATOM 1524 N ILE A 96 -5.456 1.198 3.431 1.00 1.00 N ATOM 1525 CA ILE A 96 -4.413 1.889 4.185 1.00 1.00 C ATOM 1526 C ILE A 96 -3.057 1.890 3.483 1.00 1.00 C ATOM 1527 O ILE A 96 -2.482 0.836 3.193 1.00 1.00 O ATOM 1528 CB ILE A 96 -4.243 1.274 5.584 1.00 1.00 C ATOM 1529 CG1 ILE A 96 -5.211 1.940 6.569 1.00 1.00 C ATOM 1530 CG2 ILE A 96 -2.801 1.417 6.048 1.00 1.00 C ATOM 1531 CD1 ILE A 96 -5.255 1.251 7.922 1.00 1.00 C ATOM 0 H ILE A 96 -5.396 0.180 3.445 1.00 1.00 H new ATOM 0 HA ILE A 96 -4.750 2.923 4.263 1.00 1.00 H new ATOM 0 HB ILE A 96 -4.479 0.211 5.541 1.00 1.00 H new ATOM 0 HG12 ILE A 96 -4.919 2.981 6.708 1.00 1.00 H new ATOM 0 HG13 ILE A 96 -6.212 1.944 6.138 1.00 1.00 H new ATOM 0 HG21 ILE A 96 -2.693 0.978 7.040 1.00 1.00 H new ATOM 0 HG22 ILE A 96 -2.141 0.902 5.349 1.00 1.00 H new ATOM 0 HG23 ILE A 96 -2.535 2.473 6.088 1.00 1.00 H new ATOM 0 HD11 ILE A 96 -5.958 1.771 8.572 1.00 1.00 H new ATOM 0 HD12 ILE A 96 -5.576 0.217 7.794 1.00 1.00 H new ATOM 0 HD13 ILE A 96 -4.263 1.270 8.372 1.00 1.00 H new ATOM 1543 N ALA A 97 -2.551 3.081 3.226 1.00 1.00 N ATOM 1544 CA ALA A 97 -1.260 3.246 2.589 1.00 1.00 C ATOM 1545 C ALA A 97 -0.217 3.659 3.619 1.00 1.00 C ATOM 1546 O ALA A 97 0.290 4.775 3.600 1.00 1.00 O ATOM 1547 CB ALA A 97 -1.357 4.289 1.476 1.00 1.00 C ATOM 0 H ALA A 97 -3.021 3.957 3.452 1.00 1.00 H new ATOM 0 HA ALA A 97 -0.955 2.296 2.150 1.00 1.00 H new ATOM 0 HB1 ALA A 97 -0.383 4.407 1.002 1.00 1.00 H new ATOM 0 HB2 ALA A 97 -2.084 3.962 0.733 1.00 1.00 H new ATOM 0 HB3 ALA A 97 -1.673 5.243 1.898 1.00 1.00 H new ATOM 1553 N GLY A 98 0.087 2.742 4.530 1.00 1.00 N ATOM 1554 CA GLY A 98 1.063 3.018 5.578 1.00 1.00 C ATOM 1555 C GLY A 98 0.454 3.732 6.772 1.00 1.00 C ATOM 1556 O GLY A 98 -0.730 4.048 6.767 1.00 1.00 O ATOM 0 H GLY A 98 -0.324 1.809 4.565 1.00 1.00 H new ATOM 0 HA2 GLY A 98 1.509 2.080 5.909 1.00 1.00 H new ATOM 0 HA3 GLY A 98 1.868 3.627 5.168 1.00 1.00 H new ATOM 1560 N GLY A 99 1.268 3.991 7.807 1.00 1.00 N ATOM 1561 CA GLY A 99 2.669 3.607 7.796 1.00 1.00 C ATOM 1562 C GLY A 99 2.892 2.166 8.224 1.00 1.00 C ATOM 1563 O GLY A 99 1.940 1.425 8.446 1.00 1.00 O ATOM 0 H GLY A 99 0.970 4.466 8.659 1.00 1.00 H new ATOM 0 HA2 GLY A 99 3.071 3.749 6.793 1.00 1.00 H new ATOM 0 HA3 GLY A 99 3.227 4.268 8.460 1.00 1.00 H new ATOM 1567 N ALA A 100 4.148 1.774 8.326 1.00 1.00 N ATOM 1568 CA ALA A 100 4.508 0.413 8.712 1.00 1.00 C ATOM 1569 C ALA A 100 4.038 0.083 10.122 1.00 1.00 C ATOM 1570 O ALA A 100 3.578 -1.029 10.391 1.00 1.00 O ATOM 1571 CB ALA A 100 6.013 0.228 8.602 1.00 1.00 C ATOM 0 H ALA A 100 4.947 2.382 8.146 1.00 1.00 H new ATOM 0 HA ALA A 100 4.006 -0.274 8.031 1.00 1.00 H new ATOM 0 HB1 ALA A 100 6.277 -0.789 8.891 1.00 1.00 H new ATOM 0 HB2 ALA A 100 6.327 0.406 7.574 1.00 1.00 H new ATOM 0 HB3 ALA A 100 6.516 0.935 9.262 1.00 1.00 H new ATOM 1577 N GLN A 101 4.126 1.058 11.029 1.00 1.00 N ATOM 1578 CA GLN A 101 3.687 0.840 12.401 1.00 1.00 C ATOM 1579 C GLN A 101 2.189 0.551 12.400 1.00 1.00 C ATOM 1580 O GLN A 101 1.698 -0.332 13.110 1.00 1.00 O ATOM 1581 CB GLN A 101 3.983 2.062 13.256 1.00 1.00 C ATOM 1582 CG GLN A 101 5.459 2.239 13.541 1.00 1.00 C ATOM 1583 CD GLN A 101 5.949 1.322 14.648 1.00 1.00 C ATOM 1584 OE1 GLN A 101 6.168 0.130 14.432 1.00 1.00 O ATOM 1585 NE2 GLN A 101 6.126 1.877 15.841 1.00 1.00 N ATOM 0 H GLN A 101 4.492 1.991 10.839 1.00 1.00 H new ATOM 0 HA GLN A 101 4.226 -0.008 12.823 1.00 1.00 H new ATOM 0 HB2 GLN A 101 3.606 2.952 12.751 1.00 1.00 H new ATOM 0 HB3 GLN A 101 3.444 1.978 14.199 1.00 1.00 H new ATOM 0 HG2 GLN A 101 6.028 2.043 12.632 1.00 1.00 H new ATOM 0 HG3 GLN A 101 5.651 3.275 13.820 1.00 1.00 H new ATOM 0 HE21 GLN A 101 5.932 2.869 15.976 1.00 1.00 H new ATOM 0 HE22 GLN A 101 6.456 1.311 16.623 1.00 1.00 H new ATOM 1594 N ILE A 102 1.490 1.285 11.554 1.00 1.00 N ATOM 1595 CA ILE A 102 0.057 1.120 11.379 1.00 1.00 C ATOM 1596 C ILE A 102 -0.247 -0.250 10.791 1.00 1.00 C ATOM 1597 O ILE A 102 -1.206 -0.923 11.189 1.00 1.00 O ATOM 1598 CB ILE A 102 -0.545 2.196 10.471 1.00 1.00 C ATOM 1599 CG1 ILE A 102 -0.983 3.406 11.295 1.00 1.00 C ATOM 1600 CG2 ILE A 102 -1.712 1.621 9.680 1.00 1.00 C ATOM 1601 CD1 ILE A 102 0.117 4.418 11.495 1.00 1.00 C ATOM 0 H ILE A 102 1.899 2.013 10.968 1.00 1.00 H new ATOM 0 HA ILE A 102 -0.395 1.217 12.366 1.00 1.00 H new ATOM 0 HB ILE A 102 0.216 2.529 9.765 1.00 1.00 H new ATOM 0 HG12 ILE A 102 -1.826 3.888 10.800 1.00 1.00 H new ATOM 0 HG13 ILE A 102 -1.336 3.066 12.268 1.00 1.00 H new ATOM 0 HG21 ILE A 102 -2.133 2.395 9.038 1.00 1.00 H new ATOM 0 HG22 ILE A 102 -1.362 0.791 9.067 1.00 1.00 H new ATOM 0 HG23 ILE A 102 -2.478 1.265 10.369 1.00 1.00 H new ATOM 0 HD11 ILE A 102 -0.259 5.252 12.088 1.00 1.00 H new ATOM 0 HD12 ILE A 102 0.952 3.950 12.016 1.00 1.00 H new ATOM 0 HD13 ILE A 102 0.455 4.785 10.526 1.00 1.00 H new ATOM 1613 N PHE A 103 0.556 -0.650 9.806 1.00 1.00 N ATOM 1614 CA PHE A 103 0.375 -1.925 9.122 1.00 1.00 C ATOM 1615 C PHE A 103 0.482 -3.096 10.090 1.00 1.00 C ATOM 1616 O PHE A 103 -0.338 -4.006 10.062 1.00 1.00 O ATOM 1617 CB PHE A 103 1.419 -2.087 8.008 1.00 1.00 C ATOM 1618 CG PHE A 103 1.000 -1.534 6.671 1.00 1.00 C ATOM 1619 CD1 PHE A 103 -0.281 -1.735 6.184 1.00 1.00 C ATOM 1620 CD2 PHE A 103 1.902 -0.818 5.902 1.00 1.00 C ATOM 1621 CE1 PHE A 103 -0.656 -1.232 4.954 1.00 1.00 C ATOM 1622 CE2 PHE A 103 1.533 -0.311 4.670 1.00 1.00 C ATOM 1623 CZ PHE A 103 0.253 -0.519 4.196 1.00 1.00 C ATOM 0 H PHE A 103 1.345 -0.102 9.463 1.00 1.00 H new ATOM 0 HA PHE A 103 -0.625 -1.925 8.688 1.00 1.00 H new ATOM 0 HB2 PHE A 103 2.341 -1.594 8.317 1.00 1.00 H new ATOM 0 HB3 PHE A 103 1.647 -3.147 7.893 1.00 1.00 H new ATOM 0 HD1 PHE A 103 -0.995 -2.292 6.773 1.00 1.00 H new ATOM 0 HD2 PHE A 103 2.905 -0.654 6.269 1.00 1.00 H new ATOM 0 HE1 PHE A 103 -1.658 -1.396 4.585 1.00 1.00 H new ATOM 0 HE2 PHE A 103 2.245 0.247 4.079 1.00 1.00 H new ATOM 0 HZ PHE A 103 -0.038 -0.125 3.233 1.00 1.00 H new ATOM 1633 N THR A 104 1.499 -3.076 10.945 1.00 1.00 N ATOM 1634 CA THR A 104 1.702 -4.146 11.922 1.00 1.00 C ATOM 1635 C THR A 104 0.545 -4.223 12.919 1.00 1.00 C ATOM 1636 O THR A 104 0.047 -5.306 13.229 1.00 1.00 O ATOM 1637 CB THR A 104 3.035 -3.960 12.642 1.00 1.00 C ATOM 1638 OG1 THR A 104 3.189 -4.920 13.673 1.00 1.00 O ATOM 1639 CG2 THR A 104 3.212 -2.594 13.266 1.00 1.00 C ATOM 0 H THR A 104 2.196 -2.333 10.983 1.00 1.00 H new ATOM 0 HA THR A 104 1.728 -5.094 11.384 1.00 1.00 H new ATOM 0 HB THR A 104 3.789 -4.081 11.864 1.00 1.00 H new ATOM 0 HG1 THR A 104 4.050 -4.784 14.121 1.00 1.00 H new ATOM 0 HG21 THR A 104 4.183 -2.542 13.758 1.00 1.00 H new ATOM 0 HG22 THR A 104 3.156 -1.830 12.491 1.00 1.00 H new ATOM 0 HG23 THR A 104 2.424 -2.424 14.000 1.00 1.00 H new ATOM 1647 N ALA A 105 0.126 -3.072 13.439 1.00 1.00 N ATOM 1648 CA ALA A 105 -0.975 -3.027 14.402 1.00 1.00 C ATOM 1649 C ALA A 105 -2.284 -3.490 13.784 1.00 1.00 C ATOM 1650 O ALA A 105 -3.090 -4.161 14.432 1.00 1.00 O ATOM 1651 CB ALA A 105 -1.133 -1.617 14.960 1.00 1.00 C ATOM 0 H ALA A 105 0.528 -2.162 13.213 1.00 1.00 H new ATOM 0 HA ALA A 105 -0.728 -3.712 15.213 1.00 1.00 H new ATOM 0 HB1 ALA A 105 -1.956 -1.599 15.675 1.00 1.00 H new ATOM 0 HB2 ALA A 105 -0.211 -1.318 15.459 1.00 1.00 H new ATOM 0 HB3 ALA A 105 -1.345 -0.925 14.145 1.00 1.00 H new ATOM 1657 N PHE A 106 -2.501 -3.132 12.525 1.00 1.00 N ATOM 1658 CA PHE A 106 -3.732 -3.501 11.821 1.00 1.00 C ATOM 1659 C PHE A 106 -3.498 -4.642 10.818 1.00 1.00 C ATOM 1660 O PHE A 106 -4.321 -4.858 9.930 1.00 1.00 O ATOM 1661 CB PHE A 106 -4.309 -2.276 11.112 1.00 1.00 C ATOM 1662 CG PHE A 106 -5.052 -1.336 12.021 1.00 1.00 C ATOM 1663 CD1 PHE A 106 -6.311 -1.667 12.496 1.00 1.00 C ATOM 1664 CD2 PHE A 106 -4.495 -0.126 12.394 1.00 1.00 C ATOM 1665 CE1 PHE A 106 -6.999 -0.804 13.330 1.00 1.00 C ATOM 1666 CE2 PHE A 106 -5.178 0.740 13.226 1.00 1.00 C ATOM 1667 CZ PHE A 106 -6.432 0.401 13.694 1.00 1.00 C ATOM 0 H PHE A 106 -1.844 -2.587 11.967 1.00 1.00 H new ATOM 0 HA PHE A 106 -4.447 -3.862 12.560 1.00 1.00 H new ATOM 0 HB2 PHE A 106 -3.497 -1.732 10.630 1.00 1.00 H new ATOM 0 HB3 PHE A 106 -4.982 -2.610 10.323 1.00 1.00 H new ATOM 0 HD1 PHE A 106 -6.759 -2.608 12.212 1.00 1.00 H new ATOM 0 HD2 PHE A 106 -3.515 0.145 12.031 1.00 1.00 H new ATOM 0 HE1 PHE A 106 -7.979 -1.073 13.696 1.00 1.00 H new ATOM 0 HE2 PHE A 106 -4.731 1.681 13.510 1.00 1.00 H new ATOM 0 HZ PHE A 106 -6.968 1.077 14.343 1.00 1.00 H new ATOM 1677 N LYS A 107 -2.387 -5.365 10.963 1.00 1.00 N ATOM 1678 CA LYS A 107 -2.082 -6.464 10.058 1.00 1.00 C ATOM 1679 C LYS A 107 -3.134 -7.577 10.135 1.00 1.00 C ATOM 1680 O LYS A 107 -3.522 -8.140 9.119 1.00 1.00 O ATOM 1681 CB LYS A 107 -0.702 -7.034 10.389 1.00 1.00 C ATOM 1682 CG LYS A 107 -0.725 -8.138 11.429 1.00 1.00 C ATOM 1683 CD LYS A 107 0.685 -8.589 11.766 1.00 1.00 C ATOM 1684 CE LYS A 107 1.382 -9.216 10.562 1.00 1.00 C ATOM 1685 NZ LYS A 107 1.792 -10.630 10.825 1.00 1.00 N ATOM 0 H LYS A 107 -1.692 -5.209 11.693 1.00 1.00 H new ATOM 0 HA LYS A 107 -2.090 -6.071 9.041 1.00 1.00 H new ATOM 0 HB2 LYS A 107 -0.250 -7.419 9.475 1.00 1.00 H new ATOM 0 HB3 LYS A 107 -0.062 -6.226 10.745 1.00 1.00 H new ATOM 0 HG2 LYS A 107 -1.224 -7.784 12.331 1.00 1.00 H new ATOM 0 HG3 LYS A 107 -1.303 -8.984 11.056 1.00 1.00 H new ATOM 0 HD2 LYS A 107 1.265 -7.736 12.118 1.00 1.00 H new ATOM 0 HD3 LYS A 107 0.651 -9.310 12.582 1.00 1.00 H new ATOM 0 HE2 LYS A 107 0.714 -9.186 9.701 1.00 1.00 H new ATOM 0 HE3 LYS A 107 2.261 -8.626 10.304 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 2.261 -11.018 9.982 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 2.449 -10.657 11.630 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 0.951 -11.200 11.046 1.00 1.00 H new ATOM 1699 N ASP A 108 -3.581 -7.906 11.346 1.00 1.00 N ATOM 1700 CA ASP A 108 -4.580 -8.961 11.535 1.00 1.00 C ATOM 1701 C ASP A 108 -6.012 -8.413 11.512 1.00 1.00 C ATOM 1702 O ASP A 108 -6.968 -9.183 11.648 1.00 1.00 O ATOM 1703 CB ASP A 108 -4.331 -9.686 12.864 1.00 1.00 C ATOM 1704 CG ASP A 108 -3.204 -10.708 12.770 1.00 1.00 C ATOM 1705 OD1 ASP A 108 -2.666 -10.894 11.659 1.00 1.00 O ATOM 1706 OD2 ASP A 108 -2.870 -11.324 13.805 1.00 1.00 O ATOM 0 H ASP A 108 -3.270 -7.460 12.209 1.00 1.00 H new ATOM 0 HA ASP A 108 -4.477 -9.658 10.703 1.00 1.00 H new ATOM 0 HB2 ASP A 108 -4.089 -8.953 13.634 1.00 1.00 H new ATOM 0 HB3 ASP A 108 -5.247 -10.188 13.178 1.00 1.00 H new ATOM 1711 N ASP A 109 -6.168 -7.091 11.355 1.00 1.00 N ATOM 1712 CA ASP A 109 -7.489 -6.469 11.346 1.00 1.00 C ATOM 1713 C ASP A 109 -8.063 -6.359 9.929 1.00 1.00 C ATOM 1714 O ASP A 109 -9.165 -5.843 9.756 1.00 1.00 O ATOM 1715 CB ASP A 109 -7.416 -5.085 11.988 1.00 1.00 C ATOM 1716 CG ASP A 109 -8.275 -4.976 13.244 1.00 1.00 C ATOM 1717 OD1 ASP A 109 -9.434 -5.442 13.209 1.00 1.00 O ATOM 1718 OD2 ASP A 109 -7.787 -4.432 14.258 1.00 1.00 O ATOM 0 H ASP A 109 -5.394 -6.437 11.233 1.00 1.00 H new ATOM 0 HA ASP A 109 -8.158 -7.108 11.922 1.00 1.00 H new ATOM 0 HB2 ASP A 109 -6.380 -4.859 12.240 1.00 1.00 H new ATOM 0 HB3 ASP A 109 -7.739 -4.336 11.265 1.00 1.00 H new ATOM 1723 N VAL A 110 -7.325 -6.819 8.920 1.00 1.00 N ATOM 1724 CA VAL A 110 -7.791 -6.728 7.536 1.00 1.00 C ATOM 1725 C VAL A 110 -7.964 -8.104 6.902 1.00 1.00 C ATOM 1726 O VAL A 110 -7.063 -8.938 6.947 1.00 1.00 O ATOM 1727 CB VAL A 110 -6.787 -5.910 6.682 1.00 1.00 C ATOM 1728 CG1 VAL A 110 -7.519 -5.096 5.627 1.00 1.00 C ATOM 1729 CG2 VAL A 110 -5.945 -5.011 7.561 1.00 1.00 C ATOM 0 H VAL A 110 -6.410 -7.255 9.032 1.00 1.00 H new ATOM 0 HA VAL A 110 -8.761 -6.231 7.559 1.00 1.00 H new ATOM 0 HB VAL A 110 -6.123 -6.609 6.174 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -6.797 -4.530 5.039 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -8.075 -5.766 4.971 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -8.210 -4.408 6.113 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -5.248 -4.446 6.942 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -6.592 -4.320 8.101 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -5.387 -5.618 8.274 1.00 1.00 H new ATOM 1739 N ASP A 111 -9.125 -8.338 6.308 1.00 1.00 N ATOM 1740 CA ASP A 111 -9.409 -9.609 5.658 1.00 1.00 C ATOM 1741 C ASP A 111 -8.496 -9.844 4.457 1.00 1.00 C ATOM 1742 O ASP A 111 -8.094 -10.982 4.164 1.00 1.00 O ATOM 1743 CB ASP A 111 -10.884 -9.667 5.229 1.00 1.00 C ATOM 1744 CG ASP A 111 -11.599 -10.894 5.770 1.00 1.00 C ATOM 1745 OD1 ASP A 111 -10.937 -11.934 5.975 1.00 1.00 O ATOM 1746 OD2 ASP A 111 -12.828 -10.811 5.982 1.00 1.00 O ATOM 0 H ASP A 111 -9.888 -7.662 6.263 1.00 1.00 H new ATOM 0 HA ASP A 111 -9.215 -10.403 6.379 1.00 1.00 H new ATOM 0 HB2 ASP A 111 -11.396 -8.769 5.576 1.00 1.00 H new ATOM 0 HB3 ASP A 111 -10.943 -9.666 4.141 1.00 1.00 H new ATOM 1751 N THR A 112 -8.167 -8.770 3.738 1.00 1.00 N ATOM 1752 CA THR A 112 -7.303 -8.887 2.568 1.00 1.00 C ATOM 1753 C THR A 112 -6.010 -8.086 2.737 1.00 1.00 C ATOM 1754 O THR A 112 -6.041 -6.878 3.045 1.00 1.00 O ATOM 1755 CB THR A 112 -8.040 -8.416 1.319 1.00 1.00 C ATOM 1756 OG1 THR A 112 -9.278 -9.093 1.179 1.00 1.00 O ATOM 1757 CG2 THR A 112 -7.253 -8.626 0.039 1.00 1.00 C ATOM 0 H THR A 112 -8.482 -7.822 3.943 1.00 1.00 H new ATOM 0 HA THR A 112 -7.037 -9.939 2.461 1.00 1.00 H new ATOM 0 HB THR A 112 -8.189 -7.346 1.462 1.00 1.00 H new ATOM 0 HG1 THR A 112 -9.735 -8.775 0.373 1.00 1.00 H new ATOM 0 HG21 THR A 112 -7.836 -8.269 -0.810 1.00 1.00 H new ATOM 0 HG22 THR A 112 -6.315 -8.073 0.093 1.00 1.00 H new ATOM 0 HG23 THR A 112 -7.041 -9.688 -0.088 1.00 1.00 H new ATOM 1765 N LEU A 113 -4.875 -8.746 2.527 1.00 1.00 N ATOM 1766 CA LEU A 113 -3.570 -8.099 2.640 1.00 1.00 C ATOM 1767 C LEU A 113 -2.840 -8.114 1.304 1.00 1.00 C ATOM 1768 O LEU A 113 -2.703 -9.163 0.680 1.00 1.00 O ATOM 1769 CB LEU A 113 -2.724 -8.785 3.708 1.00 1.00 C ATOM 1770 CG LEU A 113 -3.221 -8.597 5.141 1.00 1.00 C ATOM 1771 CD1 LEU A 113 -4.041 -9.798 5.580 1.00 1.00 C ATOM 1772 CD2 LEU A 113 -2.046 -8.377 6.081 1.00 1.00 C ATOM 0 H LEU A 113 -4.832 -9.734 2.276 1.00 1.00 H new ATOM 0 HA LEU A 113 -3.732 -7.062 2.933 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -2.685 -9.852 3.490 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -1.704 -8.408 3.640 1.00 1.00 H new ATOM 0 HG LEU A 113 -3.861 -7.715 5.176 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -4.387 -9.648 6.603 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -4.900 -9.913 4.919 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -3.425 -10.696 5.534 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -2.414 -8.244 7.098 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -1.384 -9.242 6.044 1.00 1.00 H new ATOM 0 HD23 LEU A 113 -1.497 -7.487 5.775 1.00 1.00 H new ATOM 1784 N LEU A 114 -2.377 -6.948 0.871 1.00 1.00 N ATOM 1785 CA LEU A 114 -1.663 -6.841 -0.401 1.00 1.00 C ATOM 1786 C LEU A 114 -0.174 -6.655 -0.164 1.00 1.00 C ATOM 1787 O LEU A 114 0.244 -5.739 0.548 1.00 1.00 O ATOM 1788 CB LEU A 114 -2.195 -5.661 -1.214 1.00 1.00 C ATOM 1789 CG LEU A 114 -2.526 -5.973 -2.677 1.00 1.00 C ATOM 1790 CD1 LEU A 114 -3.884 -6.681 -2.768 1.00 1.00 C ATOM 1791 CD2 LEU A 114 -2.539 -4.691 -3.486 1.00 1.00 C ATOM 0 H LEU A 114 -2.480 -6.068 1.375 1.00 1.00 H new ATOM 0 HA LEU A 114 -1.825 -7.765 -0.956 1.00 1.00 H new ATOM 0 HB2 LEU A 114 -3.094 -5.281 -0.728 1.00 1.00 H new ATOM 0 HB3 LEU A 114 -1.456 -4.860 -1.188 1.00 1.00 H new ATOM 0 HG LEU A 114 -1.762 -6.635 -3.085 1.00 1.00 H new ATOM 0 HD11 LEU A 114 -4.111 -6.899 -3.811 1.00 1.00 H new ATOM 0 HD12 LEU A 114 -3.848 -7.612 -2.202 1.00 1.00 H new ATOM 0 HD13 LEU A 114 -4.659 -6.036 -2.355 1.00 1.00 H new ATOM 0 HD21 LEU A 114 -2.775 -4.919 -4.525 1.00 1.00 H new ATOM 0 HD22 LEU A 114 -3.292 -4.014 -3.083 1.00 1.00 H new ATOM 0 HD23 LEU A 114 -1.559 -4.217 -3.432 1.00 1.00 H new ATOM 1803 N VAL A 115 0.622 -7.519 -0.770 1.00 1.00 N ATOM 1804 CA VAL A 115 2.068 -7.452 -0.640 1.00 1.00 C ATOM 1805 C VAL A 115 2.748 -7.323 -1.997 1.00 1.00 C ATOM 1806 O VAL A 115 2.450 -8.069 -2.932 1.00 1.00 O ATOM 1807 CB VAL A 115 2.631 -8.688 0.088 1.00 1.00 C ATOM 1808 CG1 VAL A 115 2.187 -9.962 -0.598 1.00 1.00 C ATOM 1809 CG2 VAL A 115 4.153 -8.622 0.170 1.00 1.00 C ATOM 0 H VAL A 115 0.289 -8.280 -1.361 1.00 1.00 H new ATOM 0 HA VAL A 115 2.282 -6.562 -0.048 1.00 1.00 H new ATOM 0 HB VAL A 115 2.236 -8.692 1.104 1.00 1.00 H new ATOM 0 HG11 VAL A 115 2.596 -10.822 -0.068 1.00 1.00 H new ATOM 0 HG12 VAL A 115 1.098 -10.017 -0.594 1.00 1.00 H new ATOM 0 HG13 VAL A 115 2.547 -9.966 -1.627 1.00 1.00 H new ATOM 0 HG21 VAL A 115 4.528 -9.505 0.688 1.00 1.00 H new ATOM 0 HG22 VAL A 115 4.570 -8.587 -0.836 1.00 1.00 H new ATOM 0 HG23 VAL A 115 4.449 -7.727 0.717 1.00 1.00 H new ATOM 1819 N THR A 116 3.669 -6.365 -2.096 1.00 1.00 N ATOM 1820 CA THR A 116 4.421 -6.129 -3.337 1.00 1.00 C ATOM 1821 C THR A 116 5.906 -6.373 -3.108 1.00 1.00 C ATOM 1822 O THR A 116 6.504 -5.842 -2.171 1.00 1.00 O ATOM 1823 CB THR A 116 4.203 -4.698 -3.826 1.00 1.00 C ATOM 1824 OG1 THR A 116 3.359 -4.674 -4.969 1.00 1.00 O ATOM 1825 CG2 THR A 116 5.492 -3.998 -4.201 1.00 1.00 C ATOM 0 H THR A 116 3.916 -5.736 -1.332 1.00 1.00 H new ATOM 0 HA THR A 116 4.059 -6.822 -4.096 1.00 1.00 H new ATOM 0 HB THR A 116 3.745 -4.174 -2.987 1.00 1.00 H new ATOM 0 HG1 THR A 116 2.511 -4.240 -4.740 1.00 1.00 H new ATOM 0 HG21 THR A 116 5.271 -2.986 -4.540 1.00 1.00 H new ATOM 0 HG22 THR A 116 6.148 -3.954 -3.332 1.00 1.00 H new ATOM 0 HG23 THR A 116 5.986 -4.549 -5.001 1.00 1.00 H new ATOM 1833 N ARG A 117 6.504 -7.196 -3.955 1.00 1.00 N ATOM 1834 CA ARG A 117 7.918 -7.514 -3.833 1.00 1.00 C ATOM 1835 C ARG A 117 8.724 -6.923 -4.978 1.00 1.00 C ATOM 1836 O ARG A 117 8.324 -6.983 -6.145 1.00 1.00 O ATOM 1837 CB ARG A 117 8.120 -9.035 -3.801 1.00 1.00 C ATOM 1838 CG ARG A 117 9.144 -9.502 -2.783 1.00 1.00 C ATOM 1839 CD ARG A 117 9.443 -10.990 -2.944 1.00 1.00 C ATOM 1840 NE ARG A 117 9.344 -11.714 -1.671 1.00 1.00 N ATOM 1841 CZ ARG A 117 8.195 -12.108 -1.129 1.00 1.00 C ATOM 1842 NH1 ARG A 117 7.044 -11.864 -1.744 1.00 1.00 N ATOM 1843 NH2 ARG A 117 8.195 -12.749 0.032 1.00 1.00 N ATOM 0 H ARG A 117 6.033 -7.656 -4.734 1.00 1.00 H new ATOM 0 HA ARG A 117 8.273 -7.076 -2.900 1.00 1.00 H new ATOM 0 HB2 ARG A 117 7.165 -9.513 -3.585 1.00 1.00 H new ATOM 0 HB3 ARG A 117 8.428 -9.371 -4.791 1.00 1.00 H new ATOM 0 HG2 ARG A 117 10.064 -8.929 -2.899 1.00 1.00 H new ATOM 0 HG3 ARG A 117 8.774 -9.310 -1.776 1.00 1.00 H new ATOM 0 HD2 ARG A 117 8.747 -11.424 -3.662 1.00 1.00 H new ATOM 0 HD3 ARG A 117 10.445 -11.116 -3.355 1.00 1.00 H new ATOM 0 HE ARG A 117 10.208 -11.928 -1.172 1.00 1.00 H new ATOM 0 HH11 ARG A 117 7.037 -11.372 -2.637 1.00 1.00 H new ATOM 0 HH12 ARG A 117 6.166 -12.169 -1.323 1.00 1.00 H new ATOM 0 HH21 ARG A 117 9.076 -12.940 0.509 1.00 1.00 H new ATOM 0 HH22 ARG A 117 7.314 -13.051 0.448 1.00 1.00 H new ATOM 1857 N LEU A 118 9.863 -6.333 -4.631 1.00 1.00 N ATOM 1858 CA LEU A 118 10.736 -5.706 -5.610 1.00 1.00 C ATOM 1859 C LEU A 118 11.988 -6.536 -5.816 1.00 1.00 C ATOM 1860 O LEU A 118 12.671 -6.902 -4.850 1.00 1.00 O ATOM 1861 CB LEU A 118 11.106 -4.285 -5.192 1.00 1.00 C ATOM 1862 CG LEU A 118 10.066 -3.209 -5.521 1.00 1.00 C ATOM 1863 CD1 LEU A 118 10.424 -2.509 -6.834 1.00 1.00 C ATOM 1864 CD2 LEU A 118 8.677 -3.817 -5.611 1.00 1.00 C ATOM 0 H LEU A 118 10.203 -6.277 -3.671 1.00 1.00 H new ATOM 0 HA LEU A 118 10.192 -5.650 -6.553 1.00 1.00 H new ATOM 0 HB2 LEU A 118 11.285 -4.276 -4.117 1.00 1.00 H new ATOM 0 HB3 LEU A 118 12.046 -4.016 -5.674 1.00 1.00 H new ATOM 0 HG LEU A 118 10.068 -2.472 -4.718 1.00 1.00 H new ATOM 0 HD11 LEU A 118 9.677 -1.747 -7.056 1.00 1.00 H new ATOM 0 HD12 LEU A 118 11.404 -2.040 -6.741 1.00 1.00 H new ATOM 0 HD13 LEU A 118 10.447 -3.240 -7.642 1.00 1.00 H new ATOM 0 HD21 LEU A 118 7.953 -3.037 -5.845 1.00 1.00 H new ATOM 0 HD22 LEU A 118 8.661 -4.574 -6.395 1.00 1.00 H new ATOM 0 HD23 LEU A 118 8.419 -4.277 -4.657 1.00 1.00 H new ATOM 1876 N ALA A 119 12.289 -6.828 -7.072 1.00 1.00 N ATOM 1877 CA ALA A 119 13.467 -7.609 -7.405 1.00 1.00 C ATOM 1878 C ALA A 119 14.733 -6.866 -6.990 1.00 1.00 C ATOM 1879 O ALA A 119 15.685 -7.469 -6.499 1.00 1.00 O ATOM 1880 CB ALA A 119 13.496 -7.933 -8.886 1.00 1.00 C ATOM 0 H ALA A 119 11.733 -6.536 -7.876 1.00 1.00 H new ATOM 0 HA ALA A 119 13.423 -8.549 -6.854 1.00 1.00 H new ATOM 0 HB1 ALA A 119 14.387 -8.519 -9.113 1.00 1.00 H new ATOM 0 HB2 ALA A 119 12.608 -8.507 -9.150 1.00 1.00 H new ATOM 0 HB3 ALA A 119 13.514 -7.007 -9.461 1.00 1.00 H new ATOM 1886 N GLY A 120 14.735 -5.545 -7.171 1.00 1.00 N ATOM 1887 CA GLY A 120 15.889 -4.761 -6.780 1.00 1.00 C ATOM 1888 C GLY A 120 15.963 -4.600 -5.279 1.00 1.00 C ATOM 1889 O GLY A 120 15.026 -4.952 -4.573 1.00 1.00 O ATOM 0 H GLY A 120 13.966 -5.012 -7.577 1.00 1.00 H new ATOM 0 HA2 GLY A 120 16.798 -5.243 -7.141 1.00 1.00 H new ATOM 0 HA3 GLY A 120 15.840 -3.779 -7.251 1.00 1.00 H new ATOM 1893 N SER A 121 17.078 -4.050 -4.791 1.00 1.00 N ATOM 1894 CA SER A 121 17.252 -3.855 -3.356 1.00 1.00 C ATOM 1895 C SER A 121 17.800 -2.465 -3.034 1.00 1.00 C ATOM 1896 O SER A 121 18.558 -1.891 -3.816 1.00 1.00 O ATOM 1897 CB SER A 121 18.186 -4.923 -2.789 1.00 1.00 C ATOM 1898 OG SER A 121 17.822 -5.289 -1.470 1.00 1.00 O ATOM 0 H SER A 121 17.862 -3.737 -5.363 1.00 1.00 H new ATOM 0 HA SER A 121 16.270 -3.944 -2.892 1.00 1.00 H new ATOM 0 HB2 SER A 121 18.164 -5.804 -3.431 1.00 1.00 H new ATOM 0 HB3 SER A 121 19.210 -4.551 -2.794 1.00 1.00 H new ATOM 0 HG SER A 121 18.622 -5.559 -0.973 1.00 1.00 H new ATOM 1904 N PHE A 122 17.415 -1.944 -1.879 1.00 1.00 N ATOM 1905 CA PHE A 122 17.871 -0.633 -1.436 1.00 1.00 C ATOM 1906 C PHE A 122 18.339 -0.689 0.014 1.00 1.00 C ATOM 1907 O PHE A 122 17.859 -1.504 0.813 1.00 1.00 O ATOM 1908 CB PHE A 122 16.746 0.403 -1.591 1.00 1.00 C ATOM 1909 CG PHE A 122 16.830 1.189 -2.873 1.00 1.00 C ATOM 1910 CD1 PHE A 122 16.296 0.677 -4.045 1.00 1.00 C ATOM 1911 CD2 PHE A 122 17.433 2.436 -2.905 1.00 1.00 C ATOM 1912 CE1 PHE A 122 16.360 1.395 -5.224 1.00 1.00 C ATOM 1913 CE2 PHE A 122 17.501 3.159 -4.081 1.00 1.00 C ATOM 1914 CZ PHE A 122 16.964 2.637 -5.242 1.00 1.00 C ATOM 0 H PHE A 122 16.784 -2.411 -1.228 1.00 1.00 H new ATOM 0 HA PHE A 122 18.713 -0.333 -2.059 1.00 1.00 H new ATOM 0 HB2 PHE A 122 15.784 -0.107 -1.549 1.00 1.00 H new ATOM 0 HB3 PHE A 122 16.778 1.093 -0.748 1.00 1.00 H new ATOM 0 HD1 PHE A 122 15.824 -0.295 -4.037 1.00 1.00 H new ATOM 0 HD2 PHE A 122 17.855 2.848 -2.000 1.00 1.00 H new ATOM 0 HE1 PHE A 122 15.938 0.986 -6.130 1.00 1.00 H new ATOM 0 HE2 PHE A 122 17.973 4.130 -4.092 1.00 1.00 H new ATOM 0 HZ PHE A 122 17.016 3.199 -6.163 1.00 1.00 H new ATOM 1924 N GLU A 123 19.286 0.175 0.355 1.00 1.00 N ATOM 1925 CA GLU A 123 19.826 0.236 1.696 1.00 1.00 C ATOM 1926 C GLU A 123 19.052 1.228 2.546 1.00 1.00 C ATOM 1927 O GLU A 123 18.698 2.314 2.084 1.00 1.00 O ATOM 1928 CB GLU A 123 21.316 0.606 1.656 1.00 1.00 C ATOM 1929 CG GLU A 123 22.191 -0.491 1.084 1.00 1.00 C ATOM 1930 CD GLU A 123 23.507 0.036 0.536 1.00 1.00 C ATOM 1931 OE1 GLU A 123 24.107 0.920 1.181 1.00 1.00 O ATOM 1932 OE2 GLU A 123 23.934 -0.437 -0.538 1.00 1.00 O ATOM 0 H GLU A 123 19.697 0.849 -0.292 1.00 1.00 H new ATOM 0 HA GLU A 123 19.725 -0.750 2.151 1.00 1.00 H new ATOM 0 HB2 GLU A 123 21.443 1.510 1.060 1.00 1.00 H new ATOM 0 HB3 GLU A 123 21.652 0.840 2.666 1.00 1.00 H new ATOM 0 HG2 GLU A 123 22.394 -1.230 1.859 1.00 1.00 H new ATOM 0 HG3 GLU A 123 21.650 -1.004 0.289 1.00 1.00 H new ATOM 1939 N GLY A 124 18.785 0.852 3.803 1.00 1.00 N ATOM 1940 CA GLY A 124 18.047 1.727 4.697 1.00 1.00 C ATOM 1941 C GLY A 124 18.106 1.281 6.139 1.00 1.00 C ATOM 1942 O GLY A 124 18.572 0.181 6.450 1.00 1.00 O ATOM 0 H GLY A 124 19.067 -0.039 4.211 1.00 1.00 H new ATOM 0 HA2 GLY A 124 18.446 2.738 4.618 1.00 1.00 H new ATOM 0 HA3 GLY A 124 17.006 1.769 4.378 1.00 1.00 H new ATOM 1946 N ASP A 125 17.637 2.140 7.039 1.00 1.00 N ATOM 1947 CA ASP A 125 17.628 1.844 8.469 1.00 1.00 C ATOM 1948 C ASP A 125 16.320 1.207 8.922 1.00 1.00 C ATOM 1949 O ASP A 125 16.152 0.908 10.103 1.00 1.00 O ATOM 1950 CB ASP A 125 17.864 3.118 9.279 1.00 1.00 C ATOM 1951 CG ASP A 125 16.767 4.137 9.062 1.00 1.00 C ATOM 1952 OD1 ASP A 125 16.882 4.948 8.119 1.00 1.00 O ATOM 1953 OD2 ASP A 125 15.789 4.125 9.839 1.00 1.00 O ATOM 0 H ASP A 125 17.255 3.055 6.801 1.00 1.00 H new ATOM 0 HA ASP A 125 18.433 1.130 8.644 1.00 1.00 H new ATOM 0 HB2 ASP A 125 17.923 2.869 10.338 1.00 1.00 H new ATOM 0 HB3 ASP A 125 18.824 3.553 9.000 1.00 1.00 H new ATOM 1958 N THR A 126 15.378 1.002 7.998 1.00 1.00 N ATOM 1959 CA THR A 126 14.093 0.413 8.350 1.00 1.00 C ATOM 1960 C THR A 126 13.889 -0.930 7.653 1.00 1.00 C ATOM 1961 O THR A 126 14.036 -1.045 6.439 1.00 1.00 O ATOM 1962 CB THR A 126 12.962 1.378 7.975 1.00 1.00 C ATOM 1963 OG1 THR A 126 13.456 2.695 7.806 1.00 1.00 O ATOM 1964 CG2 THR A 126 11.866 1.431 9.014 1.00 1.00 C ATOM 0 H THR A 126 15.483 1.234 7.010 1.00 1.00 H new ATOM 0 HA THR A 126 14.081 0.237 9.426 1.00 1.00 H new ATOM 0 HB THR A 126 12.548 0.993 7.043 1.00 1.00 H new ATOM 0 HG1 THR A 126 13.623 2.862 6.855 1.00 1.00 H new ATOM 0 HG21 THR A 126 11.094 2.130 8.693 1.00 1.00 H new ATOM 0 HG22 THR A 126 11.430 0.439 9.134 1.00 1.00 H new ATOM 0 HG23 THR A 126 12.282 1.762 9.966 1.00 1.00 H new ATOM 1972 N LYS A 127 13.544 -1.952 8.441 1.00 1.00 N ATOM 1973 CA LYS A 127 13.312 -3.281 7.908 1.00 1.00 C ATOM 1974 C LYS A 127 11.902 -3.756 8.232 1.00 1.00 C ATOM 1975 O LYS A 127 11.377 -3.507 9.325 1.00 1.00 O ATOM 1976 CB LYS A 127 14.345 -4.257 8.472 1.00 1.00 C ATOM 1977 CG LYS A 127 15.664 -3.608 8.826 1.00 1.00 C ATOM 1978 CD LYS A 127 16.797 -4.624 8.820 1.00 1.00 C ATOM 1979 CE LYS A 127 18.073 -4.028 9.385 1.00 1.00 C ATOM 1980 NZ LYS A 127 18.382 -4.548 10.745 1.00 1.00 N ATOM 0 H LYS A 127 13.421 -1.876 9.451 1.00 1.00 H new ATOM 0 HA LYS A 127 13.415 -3.242 6.824 1.00 1.00 H new ATOM 0 HB2 LYS A 127 13.934 -4.733 9.362 1.00 1.00 H new ATOM 0 HB3 LYS A 127 14.523 -5.046 7.742 1.00 1.00 H new ATOM 0 HG2 LYS A 127 15.883 -2.811 8.115 1.00 1.00 H new ATOM 0 HG3 LYS A 127 15.592 -3.146 9.810 1.00 1.00 H new ATOM 0 HD2 LYS A 127 16.509 -5.496 9.407 1.00 1.00 H new ATOM 0 HD3 LYS A 127 16.974 -4.969 7.801 1.00 1.00 H new ATOM 0 HE2 LYS A 127 18.904 -4.251 8.715 1.00 1.00 H new ATOM 0 HE3 LYS A 127 17.978 -2.943 9.426 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 19.261 -4.114 11.091 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 17.602 -4.313 11.392 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 18.499 -5.581 10.704 1.00 1.00 H new ATOM 1994 N MET A 128 11.289 -4.442 7.279 1.00 1.00 N ATOM 1995 CA MET A 128 9.934 -4.946 7.446 1.00 1.00 C ATOM 1996 C MET A 128 9.920 -6.172 8.353 1.00 1.00 C ATOM 1997 O MET A 128 10.831 -7.007 8.296 1.00 1.00 O ATOM 1998 CB MET A 128 9.343 -5.311 6.081 1.00 1.00 C ATOM 1999 CG MET A 128 7.832 -5.157 6.004 1.00 1.00 C ATOM 2000 SD MET A 128 7.136 -5.818 4.478 1.00 1.00 S ATOM 2001 CE MET A 128 6.358 -7.324 5.078 1.00 1.00 C ATOM 0 H MET A 128 11.711 -4.663 6.377 1.00 1.00 H new ATOM 0 HA MET A 128 9.332 -4.164 7.908 1.00 1.00 H new ATOM 0 HB2 MET A 128 9.802 -4.683 5.317 1.00 1.00 H new ATOM 0 HB3 MET A 128 9.606 -6.342 5.846 1.00 1.00 H new ATOM 0 HG2 MET A 128 7.376 -5.664 6.855 1.00 1.00 H new ATOM 0 HG3 MET A 128 7.575 -4.101 6.087 1.00 1.00 H new ATOM 0 HE1 MET A 128 5.423 -7.489 4.542 1.00 1.00 H new ATOM 0 HE2 MET A 128 7.026 -8.169 4.912 1.00 1.00 H new ATOM 0 HE3 MET A 128 6.153 -7.228 6.144 1.00 1.00 H new ATOM 2011 N ILE A 129 8.890 -6.268 9.182 1.00 1.00 N ATOM 2012 CA ILE A 129 8.756 -7.383 10.091 1.00 1.00 C ATOM 2013 C ILE A 129 8.503 -8.685 9.342 1.00 1.00 C ATOM 2014 O ILE A 129 8.070 -8.675 8.189 1.00 1.00 O ATOM 2015 CB ILE A 129 7.619 -7.160 11.096 1.00 1.00 C ATOM 2016 CG1 ILE A 129 6.313 -6.815 10.362 1.00 1.00 C ATOM 2017 CG2 ILE A 129 7.987 -6.066 12.090 1.00 1.00 C ATOM 2018 CD1 ILE A 129 5.876 -5.374 10.527 1.00 1.00 C ATOM 0 H ILE A 129 8.137 -5.583 9.239 1.00 1.00 H new ATOM 0 HA ILE A 129 9.700 -7.455 10.631 1.00 1.00 H new ATOM 0 HB ILE A 129 7.464 -8.084 11.653 1.00 1.00 H new ATOM 0 HG12 ILE A 129 6.438 -7.027 9.300 1.00 1.00 H new ATOM 0 HG13 ILE A 129 5.520 -7.468 10.726 1.00 1.00 H new ATOM 0 HG21 ILE A 129 7.167 -5.923 12.794 1.00 1.00 H new ATOM 0 HG22 ILE A 129 8.886 -6.356 12.634 1.00 1.00 H new ATOM 0 HG23 ILE A 129 8.171 -5.135 11.554 1.00 1.00 H new ATOM 0 HD11 ILE A 129 4.948 -5.210 9.980 1.00 1.00 H new ATOM 0 HD12 ILE A 129 5.717 -5.161 11.584 1.00 1.00 H new ATOM 0 HD13 ILE A 129 6.649 -4.712 10.136 1.00 1.00 H new ATOM 2030 N PRO A 130 8.766 -9.826 9.995 1.00 1.00 N ATOM 2031 CA PRO A 130 8.559 -11.147 9.392 1.00 1.00 C ATOM 2032 C PRO A 130 7.105 -11.394 9.009 1.00 1.00 C ATOM 2033 O PRO A 130 6.187 -10.960 9.684 1.00 1.00 O ATOM 2034 CB PRO A 130 8.986 -12.125 10.485 1.00 1.00 C ATOM 2035 CG PRO A 130 9.809 -11.326 11.441 1.00 1.00 C ATOM 2036 CD PRO A 130 9.283 -9.928 11.381 1.00 1.00 C ATOM 0 HA PRO A 130 9.124 -11.251 8.466 1.00 1.00 H new ATOM 0 HB2 PRO A 130 8.119 -12.559 10.983 1.00 1.00 H new ATOM 0 HB3 PRO A 130 9.562 -12.951 10.068 1.00 1.00 H new ATOM 0 HG2 PRO A 130 9.731 -11.728 12.451 1.00 1.00 H new ATOM 0 HG3 PRO A 130 10.863 -11.357 11.166 1.00 1.00 H new ATOM 0 HD2 PRO A 130 8.498 -9.760 12.118 1.00 1.00 H new ATOM 0 HD3 PRO A 130 10.065 -9.194 11.575 1.00 1.00 H new ATOM 2044 N LEU A 131 6.916 -12.107 7.900 1.00 1.00 N ATOM 2045 CA LEU A 131 5.581 -12.426 7.406 1.00 1.00 C ATOM 2046 C LEU A 131 5.254 -13.895 7.643 1.00 1.00 C ATOM 2047 O LEU A 131 6.024 -14.777 7.260 1.00 1.00 O ATOM 2048 CB LEU A 131 5.477 -12.098 5.920 1.00 1.00 C ATOM 2049 CG LEU A 131 4.953 -10.699 5.592 1.00 1.00 C ATOM 2050 CD1 LEU A 131 5.431 -10.252 4.220 1.00 1.00 C ATOM 2051 CD2 LEU A 131 3.430 -10.668 5.657 1.00 1.00 C ATOM 0 H LEU A 131 7.675 -12.475 7.326 1.00 1.00 H new ATOM 0 HA LEU A 131 4.859 -11.820 7.954 1.00 1.00 H new ATOM 0 HB2 LEU A 131 6.463 -12.213 5.470 1.00 1.00 H new ATOM 0 HB3 LEU A 131 4.824 -12.832 5.448 1.00 1.00 H new ATOM 0 HG LEU A 131 5.347 -10.007 6.336 1.00 1.00 H new ATOM 0 HD11 LEU A 131 5.046 -9.254 4.008 1.00 1.00 H new ATOM 0 HD12 LEU A 131 6.521 -10.232 4.203 1.00 1.00 H new ATOM 0 HD13 LEU A 131 5.069 -10.949 3.464 1.00 1.00 H new ATOM 0 HD21 LEU A 131 3.076 -9.664 5.421 1.00 1.00 H new ATOM 0 HD22 LEU A 131 3.021 -11.376 4.937 1.00 1.00 H new ATOM 0 HD23 LEU A 131 3.103 -10.941 6.660 1.00 1.00 H new ATOM 2063 N ASN A 132 4.109 -14.170 8.275 1.00 1.00 N ATOM 2064 CA ASN A 132 3.722 -15.552 8.537 1.00 1.00 C ATOM 2065 C ASN A 132 2.911 -16.099 7.377 1.00 1.00 C ATOM 2066 O ASN A 132 1.746 -15.754 7.196 1.00 1.00 O ATOM 2067 CB ASN A 132 2.912 -15.645 9.822 1.00 1.00 C ATOM 2068 CG ASN A 132 3.782 -15.991 11.008 1.00 1.00 C ATOM 2069 OD1 ASN A 132 3.537 -16.985 11.693 1.00 1.00 O ATOM 2070 ND2 ASN A 132 4.807 -15.184 11.257 1.00 1.00 N ATOM 0 H ASN A 132 3.448 -13.467 8.607 1.00 1.00 H new ATOM 0 HA ASN A 132 4.629 -16.147 8.650 1.00 1.00 H new ATOM 0 HB2 ASN A 132 2.409 -14.695 10.005 1.00 1.00 H new ATOM 0 HB3 ASN A 132 2.135 -16.401 9.708 1.00 1.00 H new ATOM 0 HD21 ASN A 132 5.429 -15.377 12.042 1.00 1.00 H new ATOM 0 HD22 ASN A 132 4.972 -14.371 10.663 1.00 1.00 H new ATOM 2077 N TRP A 133 3.550 -16.965 6.615 1.00 1.00 N ATOM 2078 CA TRP A 133 2.918 -17.593 5.468 1.00 1.00 C ATOM 2079 C TRP A 133 1.707 -18.410 5.894 1.00 1.00 C ATOM 2080 O TRP A 133 0.687 -18.426 5.204 1.00 1.00 O ATOM 2081 CB TRP A 133 3.921 -18.490 4.738 1.00 1.00 C ATOM 2082 CG TRP A 133 4.920 -17.725 3.922 1.00 1.00 C ATOM 2083 CD1 TRP A 133 5.395 -16.474 4.183 1.00 1.00 C ATOM 2084 CD2 TRP A 133 5.561 -18.160 2.722 1.00 1.00 C ATOM 2085 NE1 TRP A 133 6.297 -16.103 3.215 1.00 1.00 N ATOM 2086 CE2 TRP A 133 6.415 -17.122 2.307 1.00 1.00 C ATOM 2087 CE3 TRP A 133 5.497 -19.327 1.958 1.00 1.00 C ATOM 2088 CZ2 TRP A 133 7.198 -17.217 1.163 1.00 1.00 C ATOM 2089 CZ3 TRP A 133 6.275 -19.420 0.820 1.00 1.00 C ATOM 2090 CH2 TRP A 133 7.117 -18.370 0.433 1.00 1.00 C ATOM 0 H TRP A 133 4.516 -17.253 6.771 1.00 1.00 H new ATOM 0 HA TRP A 133 2.582 -16.806 4.792 1.00 1.00 H new ATOM 0 HB2 TRP A 133 4.451 -19.100 5.469 1.00 1.00 H new ATOM 0 HB3 TRP A 133 3.378 -19.174 4.086 1.00 1.00 H new ATOM 0 HD1 TRP A 133 5.105 -15.865 5.026 1.00 1.00 H new ATOM 0 HE1 TRP A 133 6.797 -15.215 3.179 1.00 1.00 H new ATOM 0 HE3 TRP A 133 4.851 -20.142 2.251 1.00 1.00 H new ATOM 0 HZ2 TRP A 133 7.848 -16.409 0.861 1.00 1.00 H new ATOM 0 HZ3 TRP A 133 6.233 -20.317 0.219 1.00 1.00 H new ATOM 0 HH2 TRP A 133 7.715 -18.473 -0.461 1.00 1.00 H new ATOM 2101 N ASP A 134 1.835 -19.098 7.024 1.00 1.00 N ATOM 2102 CA ASP A 134 0.756 -19.944 7.532 1.00 1.00 C ATOM 2103 C ASP A 134 -0.479 -19.134 7.910 1.00 1.00 C ATOM 2104 O ASP A 134 -1.607 -19.604 7.777 1.00 1.00 O ATOM 2105 CB ASP A 134 1.250 -20.709 8.753 1.00 1.00 C ATOM 2106 CG ASP A 134 0.305 -21.835 9.147 1.00 1.00 C ATOM 2107 OD1 ASP A 134 -0.300 -22.449 8.241 1.00 1.00 O ATOM 2108 OD2 ASP A 134 0.172 -22.102 10.360 1.00 1.00 O ATOM 0 H ASP A 134 2.673 -19.088 7.606 1.00 1.00 H new ATOM 0 HA ASP A 134 0.470 -20.632 6.737 1.00 1.00 H new ATOM 0 HB2 ASP A 134 2.238 -21.121 8.546 1.00 1.00 H new ATOM 0 HB3 ASP A 134 1.361 -20.020 9.591 1.00 1.00 H new ATOM 2113 N ASP A 135 -0.266 -17.925 8.425 1.00 1.00 N ATOM 2114 CA ASP A 135 -1.380 -17.086 8.858 1.00 1.00 C ATOM 2115 C ASP A 135 -2.288 -16.682 7.690 1.00 1.00 C ATOM 2116 O ASP A 135 -3.504 -16.557 7.869 1.00 1.00 O ATOM 2117 CB ASP A 135 -0.848 -15.837 9.546 1.00 1.00 C ATOM 2118 CG ASP A 135 -1.358 -15.715 10.975 1.00 1.00 C ATOM 2119 OD1 ASP A 135 -1.353 -16.731 11.703 1.00 1.00 O ATOM 2120 OD2 ASP A 135 -1.751 -14.596 11.363 1.00 1.00 O ATOM 0 H ASP A 135 0.656 -17.508 8.552 1.00 1.00 H new ATOM 0 HA ASP A 135 -1.979 -17.672 9.555 1.00 1.00 H new ATOM 0 HB2 ASP A 135 0.242 -15.861 9.550 1.00 1.00 H new ATOM 0 HB3 ASP A 135 -1.145 -14.955 8.978 1.00 1.00 H new ATOM 2125 N PHE A 136 -1.711 -16.445 6.521 1.00 1.00 N ATOM 2126 CA PHE A 136 -2.492 -16.024 5.371 1.00 1.00 C ATOM 2127 C PHE A 136 -2.201 -16.873 4.127 1.00 1.00 C ATOM 2128 O PHE A 136 -1.089 -17.336 3.931 1.00 1.00 O ATOM 2129 CB PHE A 136 -2.182 -14.565 5.067 1.00 1.00 C ATOM 2130 CG PHE A 136 -2.716 -13.620 6.098 1.00 1.00 C ATOM 2131 CD1 PHE A 136 -4.053 -13.253 6.083 1.00 1.00 C ATOM 2132 CD2 PHE A 136 -1.893 -13.101 7.086 1.00 1.00 C ATOM 2133 CE1 PHE A 136 -4.558 -12.386 7.034 1.00 1.00 C ATOM 2134 CE2 PHE A 136 -2.393 -12.234 8.039 1.00 1.00 C ATOM 2135 CZ PHE A 136 -3.727 -11.877 8.013 1.00 1.00 C ATOM 0 H PHE A 136 -0.710 -16.537 6.346 1.00 1.00 H new ATOM 0 HA PHE A 136 -3.545 -16.154 5.619 1.00 1.00 H new ATOM 0 HB2 PHE A 136 -1.102 -14.438 4.992 1.00 1.00 H new ATOM 0 HB3 PHE A 136 -2.602 -14.306 4.095 1.00 1.00 H new ATOM 0 HD1 PHE A 136 -4.707 -13.649 5.320 1.00 1.00 H new ATOM 0 HD2 PHE A 136 -0.849 -13.377 7.111 1.00 1.00 H new ATOM 0 HE1 PHE A 136 -5.601 -12.107 7.012 1.00 1.00 H new ATOM 0 HE2 PHE A 136 -1.742 -11.836 8.803 1.00 1.00 H new ATOM 0 HZ PHE A 136 -4.120 -11.200 8.757 1.00 1.00 H new ATOM 2145 N THR A 137 -3.214 -17.023 3.282 1.00 1.00 N ATOM 2146 CA THR A 137 -3.078 -17.782 2.041 1.00 1.00 C ATOM 2147 C THR A 137 -3.319 -16.873 0.845 1.00 1.00 C ATOM 2148 O THR A 137 -4.311 -16.166 0.792 1.00 1.00 O ATOM 2149 CB THR A 137 -4.059 -18.957 2.036 1.00 1.00 C ATOM 2150 OG1 THR A 137 -3.481 -20.102 1.439 1.00 1.00 O ATOM 2151 CG2 THR A 137 -5.362 -18.676 1.312 1.00 1.00 C ATOM 0 H THR A 137 -4.142 -16.628 3.433 1.00 1.00 H new ATOM 0 HA THR A 137 -2.065 -18.179 1.973 1.00 1.00 H new ATOM 0 HB THR A 137 -4.283 -19.126 3.089 1.00 1.00 H new ATOM 0 HG1 THR A 137 -4.128 -20.838 1.450 1.00 1.00 H new ATOM 0 HG21 THR A 137 -6.000 -19.559 1.355 1.00 1.00 H new ATOM 0 HG22 THR A 137 -5.870 -17.838 1.789 1.00 1.00 H new ATOM 0 HG23 THR A 137 -5.154 -18.429 0.271 1.00 1.00 H new ATOM 2159 N LYS A 138 -2.388 -16.877 -0.118 1.00 1.00 N ATOM 2160 CA LYS A 138 -2.526 -16.022 -1.291 1.00 1.00 C ATOM 2161 C LYS A 138 -3.661 -16.500 -2.185 1.00 1.00 C ATOM 2162 O LYS A 138 -3.674 -17.645 -2.637 1.00 1.00 O ATOM 2163 CB LYS A 138 -1.204 -15.994 -2.086 1.00 1.00 C ATOM 2164 CG LYS A 138 -1.015 -17.144 -3.068 1.00 1.00 C ATOM 2165 CD LYS A 138 -0.953 -18.496 -2.370 1.00 1.00 C ATOM 2166 CE LYS A 138 -0.937 -19.631 -3.382 1.00 1.00 C ATOM 2167 NZ LYS A 138 0.429 -19.930 -3.877 1.00 1.00 N ATOM 0 H LYS A 138 -1.547 -17.454 -0.105 1.00 1.00 H new ATOM 0 HA LYS A 138 -2.761 -15.014 -0.950 1.00 1.00 H new ATOM 0 HB2 LYS A 138 -1.149 -15.055 -2.636 1.00 1.00 H new ATOM 0 HB3 LYS A 138 -0.373 -15.999 -1.380 1.00 1.00 H new ATOM 0 HG2 LYS A 138 -1.836 -17.145 -3.785 1.00 1.00 H new ATOM 0 HG3 LYS A 138 -0.097 -16.988 -3.635 1.00 1.00 H new ATOM 0 HD2 LYS A 138 -0.060 -18.547 -1.747 1.00 1.00 H new ATOM 0 HD3 LYS A 138 -1.811 -18.607 -1.707 1.00 1.00 H new ATOM 0 HE2 LYS A 138 -1.359 -20.526 -2.926 1.00 1.00 H new ATOM 0 HE3 LYS A 138 -1.577 -19.371 -4.225 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 0.386 -20.710 -4.564 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 0.824 -19.085 -4.337 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 1.035 -20.205 -3.078 1.00 1.00 H new ATOM 2181 N VAL A 139 -4.586 -15.593 -2.472 1.00 1.00 N ATOM 2182 CA VAL A 139 -5.694 -15.908 -3.358 1.00 1.00 C ATOM 2183 C VAL A 139 -5.174 -16.195 -4.759 1.00 1.00 C ATOM 2184 O VAL A 139 -5.630 -17.125 -5.419 1.00 1.00 O ATOM 2185 CB VAL A 139 -6.729 -14.766 -3.424 1.00 1.00 C ATOM 2186 CG1 VAL A 139 -7.190 -14.375 -2.028 1.00 1.00 C ATOM 2187 CG2 VAL A 139 -6.159 -13.560 -4.159 1.00 1.00 C ATOM 0 H VAL A 139 -4.590 -14.641 -2.106 1.00 1.00 H new ATOM 0 HA VAL A 139 -6.191 -16.789 -2.952 1.00 1.00 H new ATOM 0 HB VAL A 139 -7.594 -15.126 -3.981 1.00 1.00 H new ATOM 0 HG11 VAL A 139 -7.919 -13.568 -2.098 1.00 1.00 H new ATOM 0 HG12 VAL A 139 -7.648 -15.236 -1.541 1.00 1.00 H new ATOM 0 HG13 VAL A 139 -6.334 -14.040 -1.443 1.00 1.00 H new ATOM 0 HG21 VAL A 139 -6.907 -12.768 -4.193 1.00 1.00 H new ATOM 0 HG22 VAL A 139 -5.273 -13.200 -3.636 1.00 1.00 H new ATOM 0 HG23 VAL A 139 -5.889 -13.848 -5.175 1.00 1.00 H new ATOM 2197 N SER A 140 -4.238 -15.362 -5.184 1.00 1.00 N ATOM 2198 CA SER A 140 -3.641 -15.482 -6.510 1.00 1.00 C ATOM 2199 C SER A 140 -2.274 -14.812 -6.539 1.00 1.00 C ATOM 2200 O SER A 140 -1.932 -14.046 -5.634 1.00 1.00 O ATOM 2201 CB SER A 140 -4.555 -14.856 -7.562 1.00 1.00 C ATOM 2202 OG SER A 140 -5.601 -15.744 -7.917 1.00 1.00 O ATOM 0 H SER A 140 -3.871 -14.590 -4.628 1.00 1.00 H new ATOM 0 HA SER A 140 -3.516 -16.541 -6.738 1.00 1.00 H new ATOM 0 HB2 SER A 140 -4.976 -13.927 -7.177 1.00 1.00 H new ATOM 0 HB3 SER A 140 -3.974 -14.600 -8.448 1.00 1.00 H new ATOM 0 HG SER A 140 -5.745 -16.387 -7.191 1.00 1.00 H new ATOM 2208 N SER A 141 -1.491 -15.093 -7.572 1.00 1.00 N ATOM 2209 CA SER A 141 -0.154 -14.513 -7.717 1.00 1.00 C ATOM 2210 C SER A 141 0.069 -13.980 -9.129 1.00 1.00 C ATOM 2211 O SER A 141 -0.503 -14.494 -10.103 1.00 1.00 O ATOM 2212 CB SER A 141 0.927 -15.541 -7.383 1.00 1.00 C ATOM 2213 OG SER A 141 0.369 -16.843 -7.221 1.00 1.00 O ATOM 0 H SER A 141 -1.757 -15.723 -8.329 1.00 1.00 H new ATOM 0 HA SER A 141 -0.085 -13.682 -7.015 1.00 1.00 H new ATOM 0 HB2 SER A 141 1.673 -15.559 -8.177 1.00 1.00 H new ATOM 0 HB3 SER A 141 1.442 -15.247 -6.468 1.00 1.00 H new ATOM 0 HG SER A 141 1.083 -17.481 -7.010 1.00 1.00 H new ATOM 2219 N ARG A 142 0.893 -12.942 -9.241 1.00 1.00 N ATOM 2220 CA ARG A 142 1.187 -12.330 -10.534 1.00 1.00 C ATOM 2221 C ARG A 142 2.685 -12.108 -10.724 1.00 1.00 C ATOM 2222 O ARG A 142 3.415 -11.814 -9.773 1.00 1.00 O ATOM 2223 CB ARG A 142 0.460 -10.988 -10.659 1.00 1.00 C ATOM 2224 CG ARG A 142 -1.017 -11.101 -10.984 1.00 1.00 C ATOM 2225 CD ARG A 142 -1.759 -9.815 -10.660 1.00 1.00 C ATOM 2226 NE ARG A 142 -2.452 -9.268 -11.822 1.00 1.00 N ATOM 2227 CZ ARG A 142 -3.129 -8.121 -11.815 1.00 1.00 C ATOM 2228 NH1 ARG A 142 -3.225 -7.402 -10.703 1.00 1.00 N ATOM 2229 NH2 ARG A 142 -3.705 -7.687 -12.928 1.00 1.00 N ATOM 0 H ARG A 142 1.370 -12.506 -8.451 1.00 1.00 H new ATOM 0 HA ARG A 142 0.839 -13.016 -11.307 1.00 1.00 H new ATOM 0 HB2 ARG A 142 0.572 -10.440 -9.724 1.00 1.00 H new ATOM 0 HB3 ARG A 142 0.946 -10.397 -11.435 1.00 1.00 H new ATOM 0 HG2 ARG A 142 -1.141 -11.337 -12.041 1.00 1.00 H new ATOM 0 HG3 ARG A 142 -1.453 -11.926 -10.420 1.00 1.00 H new ATOM 0 HD2 ARG A 142 -2.481 -10.005 -9.865 1.00 1.00 H new ATOM 0 HD3 ARG A 142 -1.053 -9.077 -10.280 1.00 1.00 H new ATOM 0 HE ARG A 142 -2.416 -9.797 -12.693 1.00 1.00 H new ATOM 0 HH11 ARG A 142 -2.778 -7.727 -9.845 1.00 1.00 H new ATOM 0 HH12 ARG A 142 -3.745 -6.525 -10.706 1.00 1.00 H new ATOM 0 HH21 ARG A 142 -3.629 -8.231 -13.787 1.00 1.00 H new ATOM 0 HH22 ARG A 142 -4.224 -6.809 -12.925 1.00 1.00 H new ATOM 2243 N THR A 143 3.140 -12.255 -11.958 1.00 1.00 N ATOM 2244 CA THR A 143 4.550 -12.076 -12.272 1.00 1.00 C ATOM 2245 C THR A 143 4.739 -10.945 -13.290 1.00 1.00 C ATOM 2246 O THR A 143 4.092 -10.912 -14.339 1.00 1.00 O ATOM 2247 CB THR A 143 5.132 -13.382 -12.823 1.00 1.00 C ATOM 2248 OG1 THR A 143 4.268 -14.473 -12.549 1.00 1.00 O ATOM 2249 CG2 THR A 143 6.496 -13.725 -12.247 1.00 1.00 C ATOM 0 H THR A 143 2.555 -12.497 -12.758 1.00 1.00 H new ATOM 0 HA THR A 143 5.077 -11.807 -11.357 1.00 1.00 H new ATOM 0 HB THR A 143 5.237 -13.218 -13.895 1.00 1.00 H new ATOM 0 HG1 THR A 143 4.657 -15.297 -12.910 1.00 1.00 H new ATOM 0 HG21 THR A 143 6.849 -14.661 -12.680 1.00 1.00 H new ATOM 0 HG22 THR A 143 7.201 -12.928 -12.482 1.00 1.00 H new ATOM 0 HG23 THR A 143 6.418 -13.833 -11.165 1.00 1.00 H new ATOM 2257 N VAL A 144 5.650 -10.025 -12.968 1.00 1.00 N ATOM 2258 CA VAL A 144 5.942 -8.881 -13.844 1.00 1.00 C ATOM 2259 C VAL A 144 7.398 -8.908 -14.305 1.00 1.00 C ATOM 2260 O VAL A 144 8.309 -9.047 -13.493 1.00 1.00 O ATOM 2261 CB VAL A 144 5.660 -7.538 -13.147 1.00 1.00 C ATOM 2262 CG1 VAL A 144 5.901 -6.386 -14.117 1.00 1.00 C ATOM 2263 CG2 VAL A 144 4.232 -7.509 -12.618 1.00 1.00 C ATOM 0 H VAL A 144 6.199 -10.047 -12.109 1.00 1.00 H new ATOM 0 HA VAL A 144 5.282 -8.970 -14.707 1.00 1.00 H new ATOM 0 HB VAL A 144 6.339 -7.426 -12.302 1.00 1.00 H new ATOM 0 HG11 VAL A 144 5.699 -5.440 -13.615 1.00 1.00 H new ATOM 0 HG12 VAL A 144 6.938 -6.404 -14.453 1.00 1.00 H new ATOM 0 HG13 VAL A 144 5.239 -6.490 -14.977 1.00 1.00 H new ATOM 0 HG21 VAL A 144 4.045 -6.554 -12.127 1.00 1.00 H new ATOM 0 HG22 VAL A 144 3.535 -7.634 -13.446 1.00 1.00 H new ATOM 0 HG23 VAL A 144 4.093 -8.318 -11.901 1.00 1.00 H new ATOM 2273 N GLU A 145 7.605 -8.785 -15.609 1.00 1.00 N ATOM 2274 CA GLU A 145 8.947 -8.816 -16.182 1.00 1.00 C ATOM 2275 C GLU A 145 9.288 -7.511 -16.902 1.00 1.00 C ATOM 2276 O GLU A 145 8.434 -6.871 -17.509 1.00 1.00 O ATOM 2277 CB GLU A 145 9.080 -10.002 -17.141 1.00 1.00 C ATOM 2278 CG GLU A 145 8.141 -11.147 -16.806 1.00 1.00 C ATOM 2279 CD GLU A 145 8.664 -12.500 -17.251 1.00 1.00 C ATOM 2280 OE1 GLU A 145 9.741 -12.916 -16.775 1.00 1.00 O ATOM 2281 OE2 GLU A 145 7.983 -13.149 -18.073 1.00 1.00 O ATOM 0 H GLU A 145 6.859 -8.662 -16.294 1.00 1.00 H new ATOM 0 HA GLU A 145 9.656 -8.932 -15.362 1.00 1.00 H new ATOM 0 HB2 GLU A 145 8.882 -9.663 -18.158 1.00 1.00 H new ATOM 0 HB3 GLU A 145 10.108 -10.365 -17.120 1.00 1.00 H new ATOM 0 HG2 GLU A 145 7.972 -11.166 -15.729 1.00 1.00 H new ATOM 0 HG3 GLU A 145 7.175 -10.966 -17.277 1.00 1.00 H new ATOM 2288 N ASP A 146 10.561 -7.121 -16.831 1.00 1.00 N ATOM 2289 CA ASP A 146 11.029 -5.892 -17.466 1.00 1.00 C ATOM 2290 C ASP A 146 12.501 -5.997 -17.854 1.00 1.00 C ATOM 2291 O ASP A 146 13.176 -6.965 -17.503 1.00 1.00 O ATOM 2292 CB ASP A 146 10.807 -4.686 -16.546 1.00 1.00 C ATOM 2293 CG ASP A 146 9.594 -3.873 -16.937 1.00 1.00 C ATOM 2294 OD1 ASP A 146 9.295 -3.801 -18.146 1.00 1.00 O ATOM 2295 OD2 ASP A 146 8.939 -3.310 -16.035 1.00 1.00 O ATOM 0 H ASP A 146 11.287 -7.641 -16.338 1.00 1.00 H new ATOM 0 HA ASP A 146 10.447 -5.748 -18.376 1.00 1.00 H new ATOM 0 HB2 ASP A 146 10.692 -5.033 -15.519 1.00 1.00 H new ATOM 0 HB3 ASP A 146 11.691 -4.048 -16.569 1.00 1.00 H new ATOM 2300 N THR A 147 12.985 -4.998 -18.591 1.00 1.00 N ATOM 2301 CA THR A 147 14.382 -4.979 -19.031 1.00 1.00 C ATOM 2302 C THR A 147 15.341 -4.947 -17.846 1.00 1.00 C ATOM 2303 O THR A 147 16.331 -5.678 -17.820 1.00 1.00 O ATOM 2304 CB THR A 147 14.661 -3.774 -19.949 1.00 1.00 C ATOM 2305 OG1 THR A 147 16.020 -3.756 -20.360 1.00 1.00 O ATOM 2306 CG2 THR A 147 14.372 -2.435 -19.293 1.00 1.00 C ATOM 0 H THR A 147 12.435 -4.195 -18.895 1.00 1.00 H new ATOM 0 HA THR A 147 14.549 -5.899 -19.591 1.00 1.00 H new ATOM 0 HB THR A 147 13.988 -3.903 -20.797 1.00 1.00 H new ATOM 0 HG1 THR A 147 16.175 -2.984 -20.943 1.00 1.00 H new ATOM 0 HG21 THR A 147 14.590 -1.631 -19.996 1.00 1.00 H new ATOM 0 HG22 THR A 147 13.322 -2.390 -19.005 1.00 1.00 H new ATOM 0 HG23 THR A 147 14.996 -2.322 -18.407 1.00 1.00 H new ATOM 2314 N ASN A 148 15.067 -4.082 -16.877 1.00 1.00 N ATOM 2315 CA ASN A 148 15.907 -3.959 -15.699 1.00 1.00 C ATOM 2316 C ASN A 148 15.458 -4.958 -14.634 1.00 1.00 C ATOM 2317 O ASN A 148 14.272 -5.059 -14.345 1.00 1.00 O ATOM 2318 CB ASN A 148 15.838 -2.534 -15.133 1.00 1.00 C ATOM 2319 CG ASN A 148 16.875 -2.283 -14.054 1.00 1.00 C ATOM 2320 OD1 ASN A 148 17.158 -3.159 -13.237 1.00 1.00 O ATOM 2321 ND2 ASN A 148 17.442 -1.083 -14.044 1.00 1.00 N ATOM 0 H ASN A 148 14.264 -3.453 -16.887 1.00 1.00 H new ATOM 0 HA ASN A 148 16.937 -4.172 -15.985 1.00 1.00 H new ATOM 0 HB2 ASN A 148 15.981 -1.818 -15.943 1.00 1.00 H new ATOM 0 HB3 ASN A 148 14.843 -2.358 -14.724 1.00 1.00 H new ATOM 0 HD21 ASN A 148 18.144 -0.856 -13.339 1.00 1.00 H new ATOM 0 HD22 ASN A 148 17.176 -0.388 -14.741 1.00 1.00 H new ATOM 2328 N PRO A 149 16.398 -5.726 -14.040 1.00 1.00 N ATOM 2329 CA PRO A 149 16.066 -6.714 -13.017 1.00 1.00 C ATOM 2330 C PRO A 149 15.334 -6.077 -11.845 1.00 1.00 C ATOM 2331 O PRO A 149 14.416 -6.676 -11.281 1.00 1.00 O ATOM 2332 CB PRO A 149 17.425 -7.255 -12.564 1.00 1.00 C ATOM 2333 CG PRO A 149 18.427 -6.292 -13.095 1.00 1.00 C ATOM 2334 CD PRO A 149 17.838 -5.704 -14.339 1.00 1.00 C ATOM 0 HA PRO A 149 15.403 -7.490 -13.399 1.00 1.00 H new ATOM 0 HB2 PRO A 149 17.480 -7.321 -11.477 1.00 1.00 H new ATOM 0 HB3 PRO A 149 17.599 -8.258 -12.953 1.00 1.00 H new ATOM 0 HG2 PRO A 149 18.642 -5.514 -12.363 1.00 1.00 H new ATOM 0 HG3 PRO A 149 19.370 -6.794 -13.313 1.00 1.00 H new ATOM 0 HD2 PRO A 149 18.200 -4.693 -14.523 1.00 1.00 H new ATOM 0 HD3 PRO A 149 18.080 -6.295 -15.223 1.00 1.00 H new ATOM 2342 N ALA A 150 15.743 -4.863 -11.485 1.00 1.00 N ATOM 2343 CA ALA A 150 15.125 -4.138 -10.382 1.00 1.00 C ATOM 2344 C ALA A 150 13.672 -3.817 -10.698 1.00 1.00 C ATOM 2345 O ALA A 150 12.804 -3.855 -9.816 1.00 1.00 O ATOM 2346 CB ALA A 150 15.885 -2.851 -10.105 1.00 1.00 C ATOM 0 H ALA A 150 16.503 -4.361 -11.944 1.00 1.00 H new ATOM 0 HA ALA A 150 15.160 -4.772 -9.496 1.00 1.00 H new ATOM 0 HB1 ALA A 150 15.412 -2.320 -9.279 1.00 1.00 H new ATOM 0 HB2 ALA A 150 16.916 -3.087 -9.842 1.00 1.00 H new ATOM 0 HB3 ALA A 150 15.872 -2.222 -10.995 1.00 1.00 H new ATOM 2352 N LEU A 151 13.414 -3.504 -11.962 1.00 1.00 N ATOM 2353 CA LEU A 151 12.078 -3.162 -12.443 1.00 1.00 C ATOM 2354 C LEU A 151 11.129 -4.348 -12.295 1.00 1.00 C ATOM 2355 O LEU A 151 9.943 -4.171 -11.984 1.00 1.00 O ATOM 2356 CB LEU A 151 12.141 -2.711 -13.904 1.00 1.00 C ATOM 2357 CG LEU A 151 12.198 -1.203 -14.117 1.00 1.00 C ATOM 2358 CD1 LEU A 151 12.673 -0.902 -15.527 1.00 1.00 C ATOM 2359 CD2 LEU A 151 10.831 -0.562 -13.849 1.00 1.00 C ATOM 0 H LEU A 151 14.130 -3.480 -12.688 1.00 1.00 H new ATOM 0 HA LEU A 151 11.695 -2.341 -11.837 1.00 1.00 H new ATOM 0 HB2 LEU A 151 13.019 -3.161 -14.369 1.00 1.00 H new ATOM 0 HB3 LEU A 151 11.268 -3.103 -14.426 1.00 1.00 H new ATOM 0 HG LEU A 151 12.907 -0.773 -13.410 1.00 1.00 H new ATOM 0 HD11 LEU A 151 12.712 0.177 -15.675 1.00 1.00 H new ATOM 0 HD12 LEU A 151 13.667 -1.325 -15.674 1.00 1.00 H new ATOM 0 HD13 LEU A 151 11.981 -1.342 -16.246 1.00 1.00 H new ATOM 0 HD21 LEU A 151 10.897 0.514 -14.007 1.00 1.00 H new ATOM 0 HD22 LEU A 151 10.091 -0.985 -14.529 1.00 1.00 H new ATOM 0 HD23 LEU A 151 10.532 -0.760 -12.820 1.00 1.00 H new ATOM 2371 N THR A 152 11.625 -5.548 -12.530 1.00 1.00 N ATOM 2372 CA THR A 152 10.792 -6.751 -12.427 1.00 1.00 C ATOM 2373 C THR A 152 10.328 -6.945 -10.991 1.00 1.00 C ATOM 2374 O THR A 152 11.108 -6.810 -10.047 1.00 1.00 O ATOM 2375 CB THR A 152 11.589 -7.966 -12.906 1.00 1.00 C ATOM 2376 OG1 THR A 152 11.722 -7.941 -14.314 1.00 1.00 O ATOM 2377 CG2 THR A 152 10.962 -9.302 -12.525 1.00 1.00 C ATOM 0 H THR A 152 12.595 -5.725 -12.793 1.00 1.00 H new ATOM 0 HA THR A 152 9.910 -6.637 -13.058 1.00 1.00 H new ATOM 0 HB THR A 152 12.555 -7.891 -12.408 1.00 1.00 H new ATOM 0 HG1 THR A 152 12.235 -8.722 -14.608 1.00 1.00 H new ATOM 0 HG21 THR A 152 11.584 -10.115 -12.899 1.00 1.00 H new ATOM 0 HG22 THR A 152 10.887 -9.372 -11.440 1.00 1.00 H new ATOM 0 HG23 THR A 152 9.967 -9.375 -12.963 1.00 1.00 H new ATOM 2385 N HIS A 153 9.047 -7.274 -10.827 1.00 1.00 N ATOM 2386 CA HIS A 153 8.479 -7.487 -9.499 1.00 1.00 C ATOM 2387 C HIS A 153 7.321 -8.489 -9.542 1.00 1.00 C ATOM 2388 O HIS A 153 6.771 -8.768 -10.606 1.00 1.00 O ATOM 2389 CB HIS A 153 7.998 -6.161 -8.920 1.00 1.00 C ATOM 2390 CG HIS A 153 7.260 -5.321 -9.922 1.00 1.00 C ATOM 2391 ND1 HIS A 153 7.557 -4.119 -10.471 1.00 1.00 N flip ATOM 2392 CD2 HIS A 153 6.053 -5.703 -10.469 1.00 1.00 C flip ATOM 2393 CE1 HIS A 153 6.535 -3.800 -11.329 1.00 1.00 C flip ATOM 2394 NE2 HIS A 153 5.641 -4.772 -11.312 1.00 1.00 N flip ATOM 0 H HIS A 153 8.387 -7.398 -11.594 1.00 1.00 H new ATOM 0 HA HIS A 153 9.260 -7.901 -8.861 1.00 1.00 H new ATOM 0 HB2 HIS A 153 7.347 -6.357 -8.068 1.00 1.00 H new ATOM 0 HB3 HIS A 153 8.855 -5.602 -8.545 1.00 1.00 H new ATOM 0 HD2 HIS A 153 5.527 -6.619 -10.244 1.00 1.00 H new ATOM 0 HE1 HIS A 153 6.472 -2.900 -11.922 1.00 1.00 H new ATOM 0 HE2 HIS A 153 4.779 -4.800 -11.857 1.00 1.00 H new ATOM 2403 N THR A 154 6.959 -9.013 -8.372 1.00 1.00 N ATOM 2404 CA THR A 154 5.866 -9.975 -8.273 1.00 1.00 C ATOM 2405 C THR A 154 4.754 -9.457 -7.381 1.00 1.00 C ATOM 2406 O THR A 154 4.987 -9.035 -6.255 1.00 1.00 O ATOM 2407 CB THR A 154 6.378 -11.311 -7.732 1.00 1.00 C ATOM 2408 OG1 THR A 154 7.704 -11.192 -7.264 1.00 1.00 O ATOM 2409 CG2 THR A 154 6.362 -12.422 -8.770 1.00 1.00 C ATOM 0 H THR A 154 7.406 -8.788 -7.483 1.00 1.00 H new ATOM 0 HA THR A 154 5.464 -10.121 -9.276 1.00 1.00 H new ATOM 0 HB THR A 154 5.696 -11.572 -6.923 1.00 1.00 H new ATOM 0 HG1 THR A 154 8.009 -12.058 -6.921 1.00 1.00 H new ATOM 0 HG21 THR A 154 6.737 -13.343 -8.323 1.00 1.00 H new ATOM 0 HG22 THR A 154 5.342 -12.578 -9.120 1.00 1.00 H new ATOM 0 HG23 THR A 154 6.996 -12.143 -9.612 1.00 1.00 H new ATOM 2417 N TYR A 155 3.531 -9.482 -7.906 1.00 1.00 N ATOM 2418 CA TYR A 155 2.370 -9.006 -7.166 1.00 1.00 C ATOM 2419 C TYR A 155 1.546 -10.181 -6.656 1.00 1.00 C ATOM 2420 O TYR A 155 1.234 -11.102 -7.419 1.00 1.00 O ATOM 2421 CB TYR A 155 1.520 -8.105 -8.060 1.00 1.00 C ATOM 2422 CG TYR A 155 1.412 -6.684 -7.557 1.00 1.00 C ATOM 2423 CD1 TYR A 155 0.535 -6.361 -6.530 1.00 1.00 C ATOM 2424 CD2 TYR A 155 2.195 -5.672 -8.097 1.00 1.00 C ATOM 2425 CE1 TYR A 155 0.440 -5.066 -6.054 1.00 1.00 C ATOM 2426 CE2 TYR A 155 2.107 -4.374 -7.627 1.00 1.00 C ATOM 2427 CZ TYR A 155 1.228 -4.077 -6.606 1.00 1.00 C ATOM 2428 OH TYR A 155 1.131 -2.787 -6.121 1.00 1.00 O ATOM 0 H TYR A 155 3.321 -9.828 -8.842 1.00 1.00 H new ATOM 0 HA TYR A 155 2.711 -8.429 -6.306 1.00 1.00 H new ATOM 0 HB2 TYR A 155 1.947 -8.095 -9.063 1.00 1.00 H new ATOM 0 HB3 TYR A 155 0.519 -8.529 -8.143 1.00 1.00 H new ATOM 0 HD1 TYR A 155 -0.083 -7.133 -6.096 1.00 1.00 H new ATOM 0 HD2 TYR A 155 2.884 -5.902 -8.897 1.00 1.00 H new ATOM 0 HE1 TYR A 155 -0.247 -4.830 -5.255 1.00 1.00 H new ATOM 0 HE2 TYR A 155 2.723 -3.598 -8.057 1.00 1.00 H new ATOM 0 HH TYR A 155 0.260 -2.410 -6.365 1.00 1.00 H new ATOM 2438 N GLU A 156 1.215 -10.161 -5.366 1.00 1.00 N ATOM 2439 CA GLU A 156 0.436 -11.248 -4.775 1.00 1.00 C ATOM 2440 C GLU A 156 -0.666 -10.719 -3.870 1.00 1.00 C ATOM 2441 O GLU A 156 -0.513 -9.687 -3.209 1.00 1.00 O ATOM 2442 CB GLU A 156 1.350 -12.172 -3.983 1.00 1.00 C ATOM 2443 CG GLU A 156 2.198 -13.063 -4.871 1.00 1.00 C ATOM 2444 CD GLU A 156 2.886 -14.172 -4.097 1.00 1.00 C ATOM 2445 OE1 GLU A 156 2.248 -15.223 -3.879 1.00 1.00 O ATOM 2446 OE2 GLU A 156 4.063 -13.994 -3.719 1.00 1.00 O ATOM 0 H GLU A 156 1.469 -9.416 -4.718 1.00 1.00 H new ATOM 0 HA GLU A 156 -0.032 -11.802 -5.589 1.00 1.00 H new ATOM 0 HB2 GLU A 156 2.003 -11.573 -3.348 1.00 1.00 H new ATOM 0 HB3 GLU A 156 0.746 -12.794 -3.323 1.00 1.00 H new ATOM 0 HG2 GLU A 156 1.569 -13.502 -5.646 1.00 1.00 H new ATOM 0 HG3 GLU A 156 2.950 -12.457 -5.376 1.00 1.00 H new ATOM 2453 N VAL A 157 -1.785 -11.453 -3.839 1.00 1.00 N ATOM 2454 CA VAL A 157 -2.940 -11.093 -3.021 1.00 1.00 C ATOM 2455 C VAL A 157 -3.251 -12.203 -2.024 1.00 1.00 C ATOM 2456 O VAL A 157 -3.302 -13.380 -2.409 1.00 1.00 O ATOM 2457 CB VAL A 157 -4.178 -10.809 -3.891 1.00 1.00 C ATOM 2458 CG1 VAL A 157 -5.412 -10.582 -3.021 1.00 1.00 C ATOM 2459 CG2 VAL A 157 -3.925 -9.608 -4.789 1.00 1.00 C ATOM 0 H VAL A 157 -1.911 -12.309 -4.379 1.00 1.00 H new ATOM 0 HA VAL A 157 -2.689 -10.182 -2.478 1.00 1.00 H new ATOM 0 HB VAL A 157 -4.365 -11.680 -4.520 1.00 1.00 H new ATOM 0 HG11 VAL A 157 -6.274 -10.383 -3.657 1.00 1.00 H new ATOM 0 HG12 VAL A 157 -5.602 -11.471 -2.420 1.00 1.00 H new ATOM 0 HG13 VAL A 157 -5.242 -9.729 -2.364 1.00 1.00 H new ATOM 0 HG21 VAL A 157 -4.808 -9.418 -5.399 1.00 1.00 H new ATOM 0 HG22 VAL A 157 -3.713 -8.733 -4.175 1.00 1.00 H new ATOM 0 HG23 VAL A 157 -3.073 -9.812 -5.437 1.00 1.00 H new ATOM 2469 N TRP A 158 -3.422 -11.848 -0.752 1.00 1.00 N ATOM 2470 CA TRP A 158 -3.701 -12.845 0.281 1.00 1.00 C ATOM 2471 C TRP A 158 -4.825 -12.415 1.205 1.00 1.00 C ATOM 2472 O TRP A 158 -5.051 -11.222 1.434 1.00 1.00 O ATOM 2473 CB TRP A 158 -2.468 -13.121 1.139 1.00 1.00 C ATOM 2474 CG TRP A 158 -1.169 -13.196 0.393 1.00 1.00 C ATOM 2475 CD1 TRP A 158 -0.630 -12.243 -0.421 1.00 1.00 C ATOM 2476 CD2 TRP A 158 -0.230 -14.278 0.422 1.00 1.00 C ATOM 2477 NE1 TRP A 158 0.585 -12.666 -0.903 1.00 1.00 N ATOM 2478 CE2 TRP A 158 0.854 -13.911 -0.400 1.00 1.00 C ATOM 2479 CE3 TRP A 158 -0.199 -15.520 1.062 1.00 1.00 C ATOM 2480 CZ2 TRP A 158 1.953 -14.743 -0.596 1.00 1.00 C ATOM 2481 CZ3 TRP A 158 0.893 -16.344 0.866 1.00 1.00 C ATOM 2482 CH2 TRP A 158 1.956 -15.952 0.042 1.00 1.00 C ATOM 0 H TRP A 158 -3.373 -10.887 -0.413 1.00 1.00 H new ATOM 0 HA TRP A 158 -3.997 -13.748 -0.253 1.00 1.00 H new ATOM 0 HB2 TRP A 158 -2.389 -12.339 1.894 1.00 1.00 H new ATOM 0 HB3 TRP A 158 -2.618 -14.062 1.669 1.00 1.00 H new ATOM 0 HD1 TRP A 158 -1.091 -11.294 -0.653 1.00 1.00 H new ATOM 0 HE1 TRP A 158 1.189 -12.138 -1.533 1.00 1.00 H new ATOM 0 HE3 TRP A 158 -1.014 -15.830 1.699 1.00 1.00 H new ATOM 0 HZ2 TRP A 158 2.774 -14.444 -1.230 1.00 1.00 H new ATOM 0 HZ3 TRP A 158 0.927 -17.306 1.356 1.00 1.00 H new ATOM 0 HH2 TRP A 158 2.795 -16.619 -0.092 1.00 1.00 H new ATOM 2493 N GLN A 159 -5.505 -13.422 1.742 1.00 1.00 N ATOM 2494 CA GLN A 159 -6.609 -13.217 2.669 1.00 1.00 C ATOM 2495 C GLN A 159 -6.551 -14.256 3.784 1.00 1.00 C ATOM 2496 O GLN A 159 -5.979 -15.338 3.606 1.00 1.00 O ATOM 2497 CB GLN A 159 -7.949 -13.325 1.941 1.00 1.00 C ATOM 2498 CG GLN A 159 -8.117 -12.342 0.795 1.00 1.00 C ATOM 2499 CD GLN A 159 -9.545 -12.221 0.323 1.00 1.00 C ATOM 2500 OE1 GLN A 159 -9.845 -12.465 -0.845 1.00 1.00 O ATOM 2501 NE2 GLN A 159 -10.439 -11.834 1.226 1.00 1.00 N ATOM 0 H GLN A 159 -5.305 -14.403 1.546 1.00 1.00 H new ATOM 0 HA GLN A 159 -6.519 -12.218 3.096 1.00 1.00 H new ATOM 0 HB2 GLN A 159 -8.059 -14.338 1.555 1.00 1.00 H new ATOM 0 HB3 GLN A 159 -8.754 -13.169 2.660 1.00 1.00 H new ATOM 0 HG2 GLN A 159 -7.761 -11.361 1.110 1.00 1.00 H new ATOM 0 HG3 GLN A 159 -7.490 -12.656 -0.040 1.00 1.00 H new ATOM 0 HE21 GLN A 159 -10.146 -11.642 2.184 1.00 1.00 H new ATOM 0 HE22 GLN A 159 -11.418 -11.729 0.961 1.00 1.00 H new ATOM 2510 N LYS A 160 -7.134 -13.937 4.926 1.00 1.00 N ATOM 2511 CA LYS A 160 -7.134 -14.855 6.068 1.00 1.00 C ATOM 2512 C LYS A 160 -7.941 -16.110 5.757 1.00 1.00 C ATOM 2513 O LYS A 160 -9.045 -16.046 5.216 1.00 1.00 O ATOM 2514 CB LYS A 160 -7.707 -14.158 7.313 1.00 1.00 C ATOM 2515 CG LYS A 160 -7.654 -15.016 8.568 1.00 1.00 C ATOM 2516 CD LYS A 160 -6.483 -14.636 9.457 1.00 1.00 C ATOM 2517 CE LYS A 160 -6.292 -15.659 10.580 1.00 1.00 C ATOM 2518 NZ LYS A 160 -5.926 -15.017 11.874 1.00 1.00 N ATOM 0 H LYS A 160 -7.614 -13.053 5.094 1.00 1.00 H new ATOM 0 HA LYS A 160 -6.103 -15.148 6.267 1.00 1.00 H new ATOM 0 HB2 LYS A 160 -7.154 -13.235 7.490 1.00 1.00 H new ATOM 0 HB3 LYS A 160 -8.742 -13.877 7.118 1.00 1.00 H new ATOM 0 HG2 LYS A 160 -8.585 -14.905 9.124 1.00 1.00 H new ATOM 0 HG3 LYS A 160 -7.573 -16.066 8.288 1.00 1.00 H new ATOM 0 HD2 LYS A 160 -5.574 -14.573 8.859 1.00 1.00 H new ATOM 0 HD3 LYS A 160 -6.652 -13.648 9.885 1.00 1.00 H new ATOM 0 HE2 LYS A 160 -7.211 -16.231 10.708 1.00 1.00 H new ATOM 0 HE3 LYS A 160 -5.514 -16.367 10.295 1.00 1.00 H new ATOM 0 HZ1 LYS A 160 -5.807 -15.749 12.603 1.00 1.00 H new ATOM 0 HZ2 LYS A 160 -5.035 -14.493 11.762 1.00 1.00 H new ATOM 0 HZ3 LYS A 160 -6.680 -14.361 12.161 1.00 1.00 H new ATOM 2532 N LYS A 161 -7.387 -17.249 6.108 1.00 1.00 N ATOM 2533 CA LYS A 161 -8.064 -18.516 5.870 1.00 1.00 C ATOM 2534 C LYS A 161 -8.290 -19.268 7.173 1.00 1.00 C ATOM 2535 O LYS A 161 -7.401 -19.320 8.029 1.00 1.00 O ATOM 2536 CB LYS A 161 -7.235 -19.385 4.920 1.00 1.00 C ATOM 2537 CG LYS A 161 -5.774 -19.521 5.338 1.00 1.00 C ATOM 2538 CD LYS A 161 -5.192 -20.860 4.885 1.00 1.00 C ATOM 2539 CE LYS A 161 -3.778 -21.064 5.410 1.00 1.00 C ATOM 2540 NZ LYS A 161 -3.781 -21.604 6.790 1.00 1.00 N ATOM 0 H LYS A 161 -6.475 -17.330 6.557 1.00 1.00 H new ATOM 0 HA LYS A 161 -9.032 -18.300 5.419 1.00 1.00 H new ATOM 0 HB2 LYS A 161 -7.683 -20.377 4.864 1.00 1.00 H new ATOM 0 HB3 LYS A 161 -7.280 -18.958 3.918 1.00 1.00 H new ATOM 0 HG2 LYS A 161 -5.193 -18.705 4.909 1.00 1.00 H new ATOM 0 HG3 LYS A 161 -5.693 -19.434 6.422 1.00 1.00 H new ATOM 0 HD2 LYS A 161 -5.831 -21.671 5.234 1.00 1.00 H new ATOM 0 HD3 LYS A 161 -5.186 -20.905 3.796 1.00 1.00 H new ATOM 0 HE2 LYS A 161 -3.240 -21.747 4.753 1.00 1.00 H new ATOM 0 HE3 LYS A 161 -3.242 -20.115 5.391 1.00 1.00 H new ATOM 0 HZ1 LYS A 161 -3.089 -21.085 7.367 1.00 1.00 H new ATOM 0 HZ2 LYS A 161 -4.729 -21.494 7.204 1.00 1.00 H new ATOM 0 HZ3 LYS A 161 -3.527 -22.612 6.769 1.00 1.00 H new ATOM 2554 N ALA A 162 -9.474 -19.854 7.323 1.00 1.00 N ATOM 2555 CA ALA A 162 -9.808 -20.599 8.528 1.00 1.00 C ATOM 2556 C ALA A 162 -11.124 -21.352 8.370 1.00 1.00 C ATOM 2557 O ALA A 162 -11.592 -21.498 7.219 1.00 1.00 O ATOM 2558 CB ALA A 162 -9.879 -19.659 9.721 1.00 1.00 C ATOM 2559 OXT ALA A 162 -11.672 -21.796 9.395 1.00 1.00 O ATOM 0 H ALA A 162 -10.217 -19.826 6.624 1.00 1.00 H new ATOM 0 HA ALA A 162 -9.021 -21.334 8.698 1.00 1.00 H new ATOM 0 HB1 ALA A 162 -10.130 -20.227 10.617 1.00 1.00 H new ATOM 0 HB2 ALA A 162 -8.914 -19.172 9.858 1.00 1.00 H new ATOM 0 HB3 ALA A 162 -10.645 -18.904 9.544 1.00 1.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 3.066 6.012 10.377 1.00 1.00 P HETATM 2567 O1A NDP A 170 2.712 4.599 10.611 1.00 1.00 O HETATM 2568 O2A NDP A 170 3.078 6.498 8.981 1.00 1.00 O HETATM 2569 O5B NDP A 170 2.241 6.992 11.322 1.00 1.00 O HETATM 2570 C5B NDP A 170 2.909 7.875 12.243 1.00 1.00 C HETATM 2571 C4B NDP A 170 2.220 9.218 12.258 1.00 1.00 C HETATM 2572 O4B NDP A 170 0.793 9.006 12.408 1.00 1.00 O HETATM 2573 C3B NDP A 170 2.613 10.134 13.407 1.00 1.00 C HETATM 2574 O3B NDP A 170 3.724 10.946 13.027 1.00 1.00 O HETATM 2575 C2B NDP A 170 1.356 10.968 13.606 1.00 1.00 C HETATM 2576 O2B NDP A 170 1.269 12.068 12.724 1.00 1.00 O HETATM 2577 C1B NDP A 170 0.259 9.940 13.327 1.00 1.00 C HETATM 2578 N9A NDP A 170 -0.161 9.221 14.527 1.00 1.00 N HETATM 2579 C8A NDP A 170 0.578 8.344 15.275 1.00 1.00 C HETATM 2580 N7A NDP A 170 -0.062 7.858 16.314 1.00 1.00 N HETATM 2581 C5A NDP A 170 -1.307 8.466 16.247 1.00 1.00 C HETATM 2582 C6A NDP A 170 -2.355 8.548 17.176 1.00 1.00 C HETATM 2583 N6A NDP A 170 -2.403 7.803 18.284 1.00 1.00 N HETATM 2584 N1A NDP A 170 -3.353 9.422 16.933 1.00 1.00 N HETATM 2585 C2A NDP A 170 -3.297 10.162 15.825 1.00 1.00 C HETATM 2586 N3A NDP A 170 -2.370 10.187 14.877 1.00 1.00 N HETATM 2587 C4A NDP A 170 -1.387 9.305 15.149 1.00 1.00 C HETATM 2588 O3 NDP A 170 4.556 6.287 11.036 1.00 1.00 O HETATM 2589 PN NDP A 170 5.960 5.436 11.194 1.00 1.00 P HETATM 2590 O1N NDP A 170 6.782 6.097 12.223 1.00 1.00 O HETATM 2591 O2N NDP A 170 5.618 4.017 11.402 1.00 1.00 O HETATM 2592 O5D NDP A 170 6.533 5.690 9.729 1.00 1.00 O HETATM 2593 C5D NDP A 170 6.265 4.763 8.661 1.00 1.00 C HETATM 2594 C4D NDP A 170 7.129 5.084 7.464 1.00 1.00 C HETATM 2595 O4D NDP A 170 7.570 3.847 6.848 1.00 1.00 O HETATM 2596 C3D NDP A 170 6.431 5.856 6.355 1.00 1.00 C HETATM 2597 O3D NDP A 170 6.573 7.264 6.559 1.00 1.00 O HETATM 2598 C2D NDP A 170 7.197 5.424 5.108 1.00 1.00 C HETATM 2599 O2D NDP A 170 8.385 6.184 4.859 1.00 1.00 O HETATM 2600 C1D NDP A 170 7.543 3.972 5.439 1.00 1.00 C HETATM 2601 N1N NDP A 170 6.577 3.012 4.909 1.00 1.00 N HETATM 2602 C2N NDP A 170 6.750 2.015 4.063 1.00 1.00 C HETATM 2603 C3N NDP A 170 5.849 1.197 3.624 1.00 1.00 C HETATM 2604 C7N NDP A 170 6.431 0.269 2.701 1.00 1.00 C HETATM 2605 O7N NDP A 170 5.626 -0.779 2.745 1.00 1.00 O HETATM 2606 N7N NDP A 170 7.532 0.364 1.906 1.00 1.00 N HETATM 2607 C4N NDP A 170 4.452 1.378 4.124 1.00 1.00 C HETATM 2608 C5N NDP A 170 4.190 2.449 5.048 1.00 1.00 C HETATM 2609 C6N NDP A 170 5.180 3.300 5.488 1.00 1.00 C HETATM 2610 P2B NDP A 170 1.722 13.654 13.008 1.00 1.00 P HETATM 2611 O1X NDP A 170 2.917 13.714 11.977 1.00 1.00 O HETATM 2612 O2X NDP A 170 0.517 14.401 12.435 1.00 1.00 O HETATM 2613 O3X NDP A 170 2.277 13.530 14.427 1.00 1.00 O HETATM 0 HO3N NDP A 170 7.297 7.605 5.993 1.00 1.00 H new HETATM 0 HO3A NDP A 170 3.969 11.534 13.772 1.00 1.00 H new HETATM 0 HO2N NDP A 170 8.822 5.851 4.048 1.00 1.00 H new HETATM 0 H72N NDP A 170 7.795 -0.416 1.304 1.00 1.00 H new HETATM 0 H71N NDP A 170 8.094 1.215 1.913 1.00 1.00 H new HETATM 0 H62A NDP A 170 -3.187 7.899 18.930 1.00 1.00 H new HETATM 0 H61A NDP A 170 -1.656 7.138 18.484 1.00 1.00 H new HETATM 0 H52N NDP A 170 6.459 3.744 8.996 1.00 1.00 H new HETATM 0 H52A NDP A 170 2.904 7.443 13.244 1.00 1.00 H new HETATM 0 H51N NDP A 170 5.212 4.812 8.383 1.00 1.00 H new HETATM 0 H51A NDP A 170 3.953 7.995 11.953 1.00 1.00 H new HETATM 0 H42N NDP A 170 3.805 1.521 3.258 1.00 1.00 H new HETATM 0 H41N NDP A 170 4.146 0.446 4.600 1.00 1.00 H new HETATM 0 H8A NDP A 170 1.605 8.073 15.030 1.00 1.00 H new HETATM 0 H6N NDP A 170 4.989 4.112 6.190 1.00 1.00 H new HETATM 0 H5N NDP A 170 3.173 2.592 5.413 1.00 1.00 H new HETATM 0 H4D NDP A 170 7.933 5.701 7.864 1.00 1.00 H new HETATM 0 H4B NDP A 170 2.516 9.695 11.324 1.00 1.00 H new HETATM 0 H3D NDP A 170 5.360 5.660 6.300 1.00 1.00 H new HETATM 0 H3B NDP A 170 2.924 9.611 14.312 1.00 1.00 H new HETATM 0 H2N NDP A 170 7.764 1.864 3.693 1.00 1.00 H new HETATM 0 H2D NDP A 170 6.612 5.568 4.200 1.00 1.00 H new HETATM 0 H2B NDP A 170 1.307 11.432 14.591 1.00 1.00 H new HETATM 0 H2A NDP A 170 -4.134 10.845 15.677 1.00 1.00 H new HETATM 0 H1D NDP A 170 8.504 3.746 4.978 1.00 1.00 H new HETATM 0 H1B NDP A 170 -0.617 10.461 12.942 1.00 1.00 H new