USER MOD reduce.3.24.130724 H: found=0, std=0, add=1058, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 891 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 115 GLN :FLIP amide:sc= -3.76! C(o=-12!,f=-5.9!) USER MOD Set 1.2: A 117 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 129 LYS NZ :NH3+ 167:sc= -2.18! (180deg=-2.69!) USER MOD Set 2.1: A 21 MET CE :methyl 147:sc= 0 (180deg=0) USER MOD Set 2.2: A 100 LYS NZ :NH3+ 178:sc= 1.22 (180deg=1.13) USER MOD Set 3.1: A 5 THR OG1 : rot 19:sc= 2.1 USER MOD Set 3.2: A 39 THR OG1 : rot -40:sc= 0.784 USER MOD Set 4.1: A 7 LYS NZ :NH3+ -147:sc= 1.11 (180deg=-0.56) USER MOD Set 4.2: A 35 ASN : amide:sc= 0.557 K(o=1.7,f=-6.2!) USER MOD Set 5.1: A 11 ASN :FLIP amide:sc= -5.63! C(o=-12!,f=-10!) USER MOD Set 5.2: A 13 ASN : amide:sc= -4.32! C(o=-10!,f=-16!) USER MOD Single : A 1 ALA N :NH3+ -132:sc= 0.0995 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 153:sc= -1.92! (180deg=-3.21!) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -115:sc= -0.706 (180deg=-2.24!) USER MOD Single : A 24 ASN : amide:sc= -0.0072 K(o=-0.0072,f=-1.2) USER MOD Single : A 27 LYS NZ :NH3+ -106:sc= 1.07 (180deg=0.0975) USER MOD Single : A 29 LYS NZ :NH3+ 161:sc= -2.4! (180deg=-2.96!) USER MOD Single : A 33 HIS : no HD1:sc= -0.637 K(o=-0.64,f=-1.3) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 94:sc= 1.15 USER MOD Single : A 42 GLN : amide:sc= -3.02! C(o=-3!,f=-6.6!) USER MOD Single : A 45 ASN : amide:sc= -6.94! C(o=-6.9!,f=-7.2!) USER MOD Single : A 46 LYS NZ :NH3+ 178:sc= 1.35 (180deg=1.34) USER MOD Single : A 48 THR OG1 : rot -26:sc= -2.92! USER MOD Single : A 50 LYS NZ :NH3+ 141:sc= 1.02 (180deg=-0.586!) USER MOD Single : A 52 SER OG : rot 180:sc= -1.51 USER MOD Single : A 53 SER OG : rot 20:sc= 1.14 USER MOD Single : A 54 ASN : amide:sc= -0.163 K(o=-0.16,f=-2) USER MOD Single : A 57 ASN :FLIP amide:sc= 0.914 F(o=-0.08,f=0.91) USER MOD Single : A 70 TYR OH : rot -87:sc= 0.708 USER MOD Single : A 71 SER OG : rot 8:sc= -3.19! USER MOD Single : A 76 THR OG1 : rot 38:sc= 0.305 USER MOD Single : A 79 THR OG1 : rot -60:sc= 0.101 USER MOD Single : A 81 THR OG1 : rot -40:sc= -0.959 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.374 USER MOD Single : A 84 MET CE :methyl 154:sc= -9.73! (180deg=-11.1!) USER MOD Single : A 87 ASN :FLIP amide:sc= -0.725 F(o=-3.4!,f=-0.73) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 165:sc= -0.353 (180deg=-0.745) USER MOD Single : A 94 LYS NZ :NH3+ -120:sc= 1.27 (180deg=0.208) USER MOD Single : A 98 ASN : amide:sc= -0.0206 K(o=-0.021,f=-0.92) USER MOD Single : A 109 SER OG : rot -6:sc= 1.04 USER MOD Single : A 111 ASN : amide:sc=-0.00314 K(o=-0.0031,f=-0.59) USER MOD Single : A 116 THR OG1 : rot 180:sc= -2.38 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0689 USER MOD Single : A 119 TYR OH : rot -83:sc= -1.3! USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00226) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 12.481 -15.067 0.695 1.00 0.00 N ATOM 2 CA ALA A 1 12.084 -13.647 0.806 1.00 0.00 C ATOM 3 C ALA A 1 11.317 -13.420 2.103 1.00 0.00 C ATOM 4 O ALA A 1 11.488 -14.173 3.062 1.00 0.00 O ATOM 5 CB ALA A 1 11.242 -13.242 -0.396 1.00 0.00 C ATOM 0 H1 ALA A 1 13.487 -15.127 0.437 1.00 0.00 H new ATOM 0 H2 ALA A 1 12.329 -15.542 1.607 1.00 0.00 H new ATOM 0 H3 ALA A 1 11.907 -15.532 -0.037 1.00 0.00 H new ATOM 0 HA ALA A 1 12.980 -13.027 0.821 1.00 0.00 H new ATOM 0 HB1 ALA A 1 10.956 -12.194 -0.303 1.00 0.00 H new ATOM 0 HB2 ALA A 1 11.821 -13.380 -1.309 1.00 0.00 H new ATOM 0 HB3 ALA A 1 10.346 -13.861 -0.438 1.00 0.00 H new ATOM 13 N PHE A 2 10.490 -12.368 2.134 1.00 0.00 N ATOM 14 CA PHE A 2 9.702 -12.030 3.319 1.00 0.00 C ATOM 15 C PHE A 2 10.636 -11.700 4.474 1.00 0.00 C ATOM 16 O PHE A 2 10.454 -12.178 5.596 1.00 0.00 O ATOM 17 CB PHE A 2 8.758 -13.178 3.720 1.00 0.00 C ATOM 18 CG PHE A 2 7.665 -13.481 2.728 1.00 0.00 C ATOM 19 CD1 PHE A 2 7.958 -13.781 1.407 1.00 0.00 C ATOM 20 CD2 PHE A 2 6.339 -13.487 3.130 1.00 0.00 C ATOM 21 CE1 PHE A 2 6.954 -14.074 0.508 1.00 0.00 C ATOM 22 CE2 PHE A 2 5.331 -13.783 2.235 1.00 0.00 C ATOM 23 CZ PHE A 2 5.639 -14.074 0.923 1.00 0.00 C ATOM 0 H PHE A 2 10.351 -11.735 1.346 1.00 0.00 H new ATOM 0 HA PHE A 2 9.086 -11.163 3.080 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.351 -14.080 3.871 1.00 0.00 H new ATOM 0 HB3 PHE A 2 8.300 -12.934 4.679 1.00 0.00 H new ATOM 0 HD1 PHE A 2 8.986 -13.785 1.077 1.00 0.00 H new ATOM 0 HD2 PHE A 2 6.091 -13.257 4.156 1.00 0.00 H new ATOM 0 HE1 PHE A 2 7.197 -14.303 -0.519 1.00 0.00 H new ATOM 0 HE2 PHE A 2 4.302 -13.787 2.562 1.00 0.00 H new ATOM 0 HZ PHE A 2 4.851 -14.302 0.221 1.00 0.00 H new ATOM 32 N ASP A 3 11.697 -10.973 4.154 1.00 0.00 N ATOM 33 CA ASP A 3 12.746 -10.672 5.122 1.00 0.00 C ATOM 34 C ASP A 3 13.620 -9.554 4.598 1.00 0.00 C ATOM 35 O ASP A 3 14.773 -9.393 4.998 1.00 0.00 O ATOM 36 CB ASP A 3 13.608 -11.909 5.350 1.00 0.00 C ATOM 37 CG ASP A 3 14.458 -11.820 6.603 1.00 0.00 C ATOM 38 OD1 ASP A 3 13.891 -11.678 7.706 1.00 0.00 O ATOM 39 OD2 ASP A 3 15.699 -11.913 6.491 1.00 0.00 O ATOM 0 H ASP A 3 11.856 -10.578 3.227 1.00 0.00 H new ATOM 0 HA ASP A 3 12.283 -10.368 6.061 1.00 0.00 H new ATOM 0 HB2 ASP A 3 12.964 -12.786 5.417 1.00 0.00 H new ATOM 0 HB3 ASP A 3 14.258 -12.056 4.487 1.00 0.00 H new ATOM 43 N GLY A 4 13.062 -8.767 3.709 1.00 0.00 N ATOM 44 CA GLY A 4 13.797 -7.672 3.156 1.00 0.00 C ATOM 45 C GLY A 4 13.402 -6.376 3.810 1.00 0.00 C ATOM 46 O GLY A 4 12.251 -6.214 4.215 1.00 0.00 O ATOM 0 H GLY A 4 12.109 -8.869 3.360 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.865 -7.841 3.290 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.616 -7.612 2.083 1.00 0.00 H new ATOM 50 N THR A 5 14.294 -5.413 3.800 1.00 0.00 N ATOM 51 CA THR A 5 13.969 -4.116 4.234 1.00 0.00 C ATOM 52 C THR A 5 14.816 -3.198 3.418 1.00 0.00 C ATOM 53 O THR A 5 15.893 -3.585 2.983 1.00 0.00 O ATOM 54 CB THR A 5 14.195 -3.900 5.736 1.00 0.00 C ATOM 55 OG1 THR A 5 13.745 -2.593 6.060 1.00 0.00 O ATOM 56 CG2 THR A 5 15.657 -4.065 6.124 1.00 0.00 C ATOM 0 H THR A 5 15.258 -5.528 3.487 1.00 0.00 H new ATOM 0 HA THR A 5 12.904 -3.929 4.095 1.00 0.00 H new ATOM 0 HB THR A 5 13.638 -4.654 6.292 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.144 -2.270 5.356 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.769 -3.903 7.196 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.989 -5.072 5.872 1.00 0.00 H new ATOM 0 HG23 THR A 5 16.262 -3.338 5.582 1.00 0.00 H new ATOM 64 N TRP A 6 14.211 -2.137 2.973 1.00 0.00 N ATOM 65 CA TRP A 6 14.736 -1.351 1.939 1.00 0.00 C ATOM 66 C TRP A 6 14.085 -0.049 2.252 1.00 0.00 C ATOM 67 O TRP A 6 12.962 -0.104 2.740 1.00 0.00 O ATOM 68 CB TRP A 6 14.279 -1.883 0.596 1.00 0.00 C ATOM 69 CG TRP A 6 13.745 -3.291 0.561 1.00 0.00 C ATOM 70 CD1 TRP A 6 14.325 -4.375 -0.028 1.00 0.00 C ATOM 71 CD2 TRP A 6 12.481 -3.734 1.044 1.00 0.00 C ATOM 72 NE1 TRP A 6 13.495 -5.458 0.055 1.00 0.00 N ATOM 73 CE2 TRP A 6 12.355 -5.086 0.702 1.00 0.00 C ATOM 74 CE3 TRP A 6 11.445 -3.113 1.731 1.00 0.00 C ATOM 75 CZ2 TRP A 6 11.227 -5.822 1.008 1.00 0.00 C ATOM 76 CZ3 TRP A 6 10.326 -3.846 2.040 1.00 0.00 C ATOM 77 CH2 TRP A 6 10.221 -5.182 1.671 1.00 0.00 C ATOM 0 H TRP A 6 13.320 -1.801 3.339 1.00 0.00 H new ATOM 0 HA TRP A 6 15.824 -1.314 1.879 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.504 -1.218 0.215 1.00 0.00 H new ATOM 0 HB3 TRP A 6 15.119 -1.823 -0.095 1.00 0.00 H new ATOM 0 HD1 TRP A 6 15.300 -4.378 -0.493 1.00 0.00 H new ATOM 0 HE1 TRP A 6 13.696 -6.390 -0.307 1.00 0.00 H new ATOM 0 HE3 TRP A 6 11.519 -2.074 2.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 11.145 -6.863 0.733 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 9.515 -3.377 2.578 1.00 0.00 H new ATOM 0 HH2 TRP A 6 9.321 -5.727 1.915 1.00 0.00 H new ATOM 87 N LYS A 7 14.758 1.072 2.301 1.00 0.00 N ATOM 88 CA LYS A 7 14.135 2.104 3.070 1.00 0.00 C ATOM 89 C LYS A 7 14.766 3.439 2.891 1.00 0.00 C ATOM 90 O LYS A 7 15.910 3.659 3.259 1.00 0.00 O ATOM 91 CB LYS A 7 14.135 1.710 4.536 1.00 0.00 C ATOM 92 CG LYS A 7 15.274 0.818 5.004 1.00 0.00 C ATOM 93 CD LYS A 7 16.661 1.404 4.739 1.00 0.00 C ATOM 94 CE LYS A 7 17.162 2.257 5.902 1.00 0.00 C ATOM 95 NZ LYS A 7 16.484 3.581 5.981 1.00 0.00 N ATOM 0 H LYS A 7 15.654 1.281 1.861 1.00 0.00 H new ATOM 0 HA LYS A 7 13.113 2.204 2.704 1.00 0.00 H new ATOM 0 HB2 LYS A 7 14.150 2.622 5.133 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.195 1.203 4.752 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.165 0.635 6.073 1.00 0.00 H new ATOM 0 HG3 LYS A 7 15.196 -0.148 4.505 1.00 0.00 H new ATOM 0 HD2 LYS A 7 17.366 0.593 4.556 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.630 2.010 3.834 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.005 1.717 6.836 1.00 0.00 H new ATOM 0 HE3 LYS A 7 18.236 2.410 5.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 17.151 4.291 6.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 16.160 3.862 5.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 15.667 3.515 6.621 1.00 0.00 H new ATOM 105 N VAL A 8 14.018 4.338 2.331 1.00 0.00 N ATOM 106 CA VAL A 8 14.549 5.624 2.030 1.00 0.00 C ATOM 107 C VAL A 8 13.476 6.615 1.769 1.00 0.00 C ATOM 108 O VAL A 8 13.470 7.719 2.302 1.00 0.00 O ATOM 109 CB VAL A 8 15.390 5.531 0.744 1.00 0.00 C ATOM 110 CG1 VAL A 8 16.823 5.177 1.021 1.00 0.00 C ATOM 111 CG2 VAL A 8 14.807 4.470 -0.171 1.00 0.00 C ATOM 0 H VAL A 8 13.040 4.203 2.075 1.00 0.00 H new ATOM 0 HA VAL A 8 15.140 5.942 2.889 1.00 0.00 H new ATOM 0 HB VAL A 8 15.363 6.515 0.275 1.00 0.00 H new ATOM 0 HG11 VAL A 8 17.373 5.124 0.081 1.00 0.00 H new ATOM 0 HG12 VAL A 8 17.269 5.939 1.660 1.00 0.00 H new ATOM 0 HG13 VAL A 8 16.869 4.211 1.523 1.00 0.00 H new ATOM 0 HG21 VAL A 8 15.404 4.406 -1.081 1.00 0.00 H new ATOM 0 HG22 VAL A 8 14.816 3.506 0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 8 13.781 4.735 -0.428 1.00 0.00 H new ATOM 121 N ASP A 9 12.787 6.299 0.724 1.00 0.00 N ATOM 122 CA ASP A 9 11.968 7.235 0.069 1.00 0.00 C ATOM 123 C ASP A 9 10.625 6.623 -0.204 1.00 0.00 C ATOM 124 O ASP A 9 10.323 5.507 0.228 1.00 0.00 O ATOM 125 CB ASP A 9 12.664 7.630 -1.226 1.00 0.00 C ATOM 126 CG ASP A 9 13.780 8.635 -1.032 1.00 0.00 C ATOM 127 OD1 ASP A 9 13.685 9.484 -0.128 1.00 0.00 O ATOM 128 OD2 ASP A 9 14.738 8.602 -1.831 1.00 0.00 O ATOM 0 H ASP A 9 12.784 5.370 0.304 1.00 0.00 H new ATOM 0 HA ASP A 9 11.810 8.120 0.685 1.00 0.00 H new ATOM 0 HB2 ASP A 9 13.070 6.735 -1.698 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.927 8.046 -1.913 1.00 0.00 H new ATOM 132 N ARG A 10 9.891 7.325 -0.997 1.00 0.00 N ATOM 133 CA ARG A 10 8.570 6.970 -1.421 1.00 0.00 C ATOM 134 C ARG A 10 8.282 7.975 -2.481 1.00 0.00 C ATOM 135 O ARG A 10 9.045 8.895 -2.619 1.00 0.00 O ATOM 136 CB ARG A 10 7.534 7.054 -0.304 1.00 0.00 C ATOM 137 CG ARG A 10 7.066 8.472 -0.038 1.00 0.00 C ATOM 138 CD ARG A 10 5.702 8.516 0.645 1.00 0.00 C ATOM 139 NE ARG A 10 5.582 7.575 1.771 1.00 0.00 N ATOM 140 CZ ARG A 10 6.211 7.702 2.947 1.00 0.00 C ATOM 141 NH1 ARG A 10 7.001 8.742 3.182 1.00 0.00 N ATOM 142 NH2 ARG A 10 6.041 6.779 3.895 1.00 0.00 N ATOM 0 H ARG A 10 10.209 8.211 -1.391 1.00 0.00 H new ATOM 0 HA ARG A 10 8.517 5.934 -1.756 1.00 0.00 H new ATOM 0 HB2 ARG A 10 6.675 6.436 -0.565 1.00 0.00 H new ATOM 0 HB3 ARG A 10 7.959 6.639 0.610 1.00 0.00 H new ATOM 0 HG2 ARG A 10 7.799 8.982 0.587 1.00 0.00 H new ATOM 0 HG3 ARG A 10 7.015 9.018 -0.980 1.00 0.00 H new ATOM 0 HD2 ARG A 10 5.517 9.528 1.005 1.00 0.00 H new ATOM 0 HD3 ARG A 10 4.928 8.293 -0.090 1.00 0.00 H new ATOM 0 HE ARG A 10 4.974 6.765 1.646 1.00 0.00 H new ATOM 0 HH11 ARG A 10 7.134 9.454 2.464 1.00 0.00 H new ATOM 0 HH12 ARG A 10 7.475 8.829 4.081 1.00 0.00 H new ATOM 0 HH21 ARG A 10 5.433 5.978 3.724 1.00 0.00 H new ATOM 0 HH22 ARG A 10 6.519 6.874 4.791 1.00 0.00 H new ATOM 153 N ASN A 11 7.202 7.876 -3.161 1.00 0.00 N ATOM 154 CA ASN A 11 6.972 8.710 -4.302 1.00 0.00 C ATOM 155 C ASN A 11 6.488 10.059 -3.887 1.00 0.00 C ATOM 156 O ASN A 11 6.091 10.280 -2.741 1.00 0.00 O ATOM 157 CB ASN A 11 5.812 8.115 -5.066 1.00 0.00 C ATOM 158 CG ASN A 11 4.477 8.421 -4.377 1.00 0.00 C ATOM 159 OD1 ASN A 11 3.656 9.264 -4.994 1.00 0.00 O flip ATOM 160 ND2 ASN A 11 4.208 7.947 -3.281 1.00 0.00 N flip ATOM 0 H ASN A 11 6.449 7.221 -2.952 1.00 0.00 H new ATOM 0 HA ASN A 11 7.900 8.782 -4.869 1.00 0.00 H new ATOM 0 HB2 ASN A 11 5.800 8.513 -6.081 1.00 0.00 H new ATOM 0 HB3 ASN A 11 5.943 7.036 -5.148 1.00 0.00 H new ATOM 0 HD21 ASN A 11 4.858 7.302 -2.831 1.00 0.00 H new ATOM 0 HD22 ASN A 11 3.334 8.197 -2.818 1.00 0.00 H new ATOM 166 N GLU A 12 6.407 10.938 -4.852 1.00 0.00 N ATOM 167 CA GLU A 12 5.838 12.189 -4.567 1.00 0.00 C ATOM 168 C GLU A 12 4.406 12.140 -4.946 1.00 0.00 C ATOM 169 O GLU A 12 4.025 12.373 -6.062 1.00 0.00 O ATOM 170 CB GLU A 12 6.482 13.363 -5.276 1.00 0.00 C ATOM 171 CG GLU A 12 7.846 13.799 -4.771 1.00 0.00 C ATOM 172 CD GLU A 12 8.977 12.853 -5.113 1.00 0.00 C ATOM 173 OE1 GLU A 12 8.756 11.886 -5.861 1.00 0.00 O ATOM 174 OE2 GLU A 12 10.113 13.104 -4.653 1.00 0.00 O ATOM 0 H GLU A 12 6.724 10.799 -5.811 1.00 0.00 H new ATOM 0 HA GLU A 12 5.994 12.361 -3.502 1.00 0.00 H new ATOM 0 HB2 GLU A 12 6.574 13.113 -6.333 1.00 0.00 H new ATOM 0 HB3 GLU A 12 5.805 14.215 -5.208 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.074 14.782 -5.184 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.799 13.911 -3.688 1.00 0.00 H new ATOM 179 N ASN A 13 3.650 12.239 -3.929 1.00 0.00 N ATOM 180 CA ASN A 13 2.298 12.633 -4.056 1.00 0.00 C ATOM 181 C ASN A 13 2.363 14.104 -4.069 1.00 0.00 C ATOM 182 O ASN A 13 1.645 14.785 -4.792 1.00 0.00 O ATOM 183 CB ASN A 13 1.494 12.188 -2.874 1.00 0.00 C ATOM 184 CG ASN A 13 1.253 10.706 -2.829 1.00 0.00 C ATOM 185 OD1 ASN A 13 2.129 9.915 -2.532 1.00 0.00 O ATOM 186 ND2 ASN A 13 0.051 10.343 -3.190 1.00 0.00 N ATOM 0 H ASN A 13 3.949 12.048 -2.973 1.00 0.00 H new ATOM 0 HA ASN A 13 1.827 12.203 -4.940 1.00 0.00 H new ATOM 0 HB2 ASN A 13 2.008 12.491 -1.962 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.533 12.703 -2.885 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -0.191 9.353 -3.233 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.645 11.049 -3.428 1.00 0.00 H new ATOM 192 N TYR A 14 3.466 14.521 -3.475 1.00 0.00 N ATOM 193 CA TYR A 14 3.952 15.822 -3.578 1.00 0.00 C ATOM 194 C TYR A 14 4.226 16.143 -5.019 1.00 0.00 C ATOM 195 O TYR A 14 4.625 17.229 -5.300 1.00 0.00 O ATOM 196 CB TYR A 14 5.261 15.928 -2.790 1.00 0.00 C ATOM 197 CG TYR A 14 6.002 17.258 -2.876 1.00 0.00 C ATOM 198 CD1 TYR A 14 5.321 18.465 -2.951 1.00 0.00 C ATOM 199 CD2 TYR A 14 7.390 17.293 -2.911 1.00 0.00 C ATOM 200 CE1 TYR A 14 5.990 19.663 -3.061 1.00 0.00 C ATOM 201 CE2 TYR A 14 8.072 18.491 -3.018 1.00 0.00 C ATOM 202 CZ TYR A 14 7.367 19.673 -3.096 1.00 0.00 C ATOM 203 OH TYR A 14 8.042 20.869 -3.202 1.00 0.00 O ATOM 0 H TYR A 14 4.046 13.916 -2.894 1.00 0.00 H new ATOM 0 HA TYR A 14 3.215 16.520 -3.180 1.00 0.00 H new ATOM 0 HB2 TYR A 14 5.045 15.725 -1.741 1.00 0.00 H new ATOM 0 HB3 TYR A 14 5.932 15.141 -3.135 1.00 0.00 H new ATOM 0 HD1 TYR A 14 4.241 18.464 -2.922 1.00 0.00 H new ATOM 0 HD2 TYR A 14 7.946 16.369 -2.854 1.00 0.00 H new ATOM 0 HE1 TYR A 14 5.438 20.590 -3.120 1.00 0.00 H new ATOM 0 HE2 TYR A 14 9.152 18.501 -3.040 1.00 0.00 H new ATOM 0 HH TYR A 14 9.007 20.700 -3.212 1.00 0.00 H new ATOM 212 N GLU A 15 4.187 15.162 -5.910 1.00 0.00 N ATOM 213 CA GLU A 15 4.253 15.481 -7.317 1.00 0.00 C ATOM 214 C GLU A 15 2.970 15.130 -7.968 1.00 0.00 C ATOM 215 O GLU A 15 2.527 15.765 -8.880 1.00 0.00 O ATOM 216 CB GLU A 15 5.420 14.821 -8.030 1.00 0.00 C ATOM 217 CG GLU A 15 5.224 13.316 -8.251 1.00 0.00 C ATOM 218 CD GLU A 15 6.237 12.684 -9.188 1.00 0.00 C ATOM 219 OE1 GLU A 15 6.295 13.079 -10.368 1.00 0.00 O ATOM 220 OE2 GLU A 15 6.968 11.771 -8.754 1.00 0.00 O ATOM 0 H GLU A 15 4.112 14.169 -5.688 1.00 0.00 H new ATOM 0 HA GLU A 15 4.426 16.554 -7.395 1.00 0.00 H new ATOM 0 HB2 GLU A 15 5.569 15.306 -8.995 1.00 0.00 H new ATOM 0 HB3 GLU A 15 6.329 14.981 -7.449 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.273 12.810 -7.287 1.00 0.00 H new ATOM 0 HG3 GLU A 15 4.224 13.147 -8.649 1.00 0.00 H new ATOM 225 N LYS A 16 2.469 14.006 -7.601 1.00 0.00 N ATOM 226 CA LYS A 16 1.308 13.481 -8.264 1.00 0.00 C ATOM 227 C LYS A 16 0.262 14.469 -8.205 1.00 0.00 C ATOM 228 O LYS A 16 -0.559 14.624 -9.074 1.00 0.00 O ATOM 229 CB LYS A 16 0.719 12.354 -7.491 1.00 0.00 C ATOM 230 CG LYS A 16 1.676 11.314 -7.053 1.00 0.00 C ATOM 231 CD LYS A 16 0.980 10.398 -6.101 1.00 0.00 C ATOM 232 CE LYS A 16 1.101 8.937 -6.496 1.00 0.00 C ATOM 233 NZ LYS A 16 -0.082 8.163 -6.048 1.00 0.00 N ATOM 0 H LYS A 16 2.836 13.425 -6.847 1.00 0.00 H new ATOM 0 HA LYS A 16 1.617 13.192 -9.269 1.00 0.00 H new ATOM 0 HB2 LYS A 16 0.223 12.761 -6.610 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -0.051 11.881 -8.101 1.00 0.00 H new ATOM 0 HG2 LYS A 16 2.048 10.756 -7.912 1.00 0.00 H new ATOM 0 HG3 LYS A 16 2.540 11.773 -6.573 1.00 0.00 H new ATOM 0 HD2 LYS A 16 1.395 10.535 -5.103 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -0.074 10.669 -6.048 1.00 0.00 H new ATOM 0 HE2 LYS A 16 1.203 8.857 -7.578 1.00 0.00 H new ATOM 0 HE3 LYS A 16 2.004 8.512 -6.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -0.219 7.344 -6.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 0.068 7.832 -5.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -0.926 8.769 -6.081 1.00 0.00 H new ATOM 243 N PHE A 17 0.105 14.925 -7.043 1.00 0.00 N ATOM 244 CA PHE A 17 -0.994 15.753 -6.850 1.00 0.00 C ATOM 245 C PHE A 17 -0.529 17.117 -7.070 1.00 0.00 C ATOM 246 O PHE A 17 -1.308 18.034 -7.220 1.00 0.00 O ATOM 247 CB PHE A 17 -1.610 15.647 -5.493 1.00 0.00 C ATOM 248 CG PHE A 17 -1.935 14.230 -5.048 1.00 0.00 C ATOM 249 CD1 PHE A 17 -1.007 13.200 -5.135 1.00 0.00 C ATOM 250 CD2 PHE A 17 -3.213 13.910 -4.599 1.00 0.00 C ATOM 251 CE1 PHE A 17 -1.337 11.939 -4.802 1.00 0.00 C ATOM 252 CE2 PHE A 17 -3.540 12.610 -4.252 1.00 0.00 C ATOM 253 CZ PHE A 17 -2.589 11.619 -4.366 1.00 0.00 C ATOM 0 H PHE A 17 0.700 14.749 -6.233 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.778 15.451 -7.545 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.932 16.094 -4.766 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.527 16.236 -5.479 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.005 13.415 -5.475 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -3.960 14.686 -4.520 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -0.592 11.161 -4.882 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -4.532 12.375 -3.895 1.00 0.00 H new ATOM 0 HZ PHE A 17 -2.833 10.598 -4.112 1.00 0.00 H new ATOM 262 N MET A 18 0.768 17.227 -7.007 1.00 0.00 N ATOM 263 CA MET A 18 1.417 18.476 -7.152 1.00 0.00 C ATOM 264 C MET A 18 1.370 18.943 -8.573 1.00 0.00 C ATOM 265 O MET A 18 1.313 20.133 -8.866 1.00 0.00 O ATOM 266 CB MET A 18 2.837 18.296 -6.758 1.00 0.00 C ATOM 267 CG MET A 18 3.756 19.340 -7.379 1.00 0.00 C ATOM 268 SD MET A 18 5.506 19.165 -6.968 1.00 0.00 S ATOM 269 CE MET A 18 6.226 20.432 -8.007 1.00 0.00 C ATOM 0 H MET A 18 1.399 16.441 -6.852 1.00 0.00 H new ATOM 0 HA MET A 18 0.917 19.217 -6.529 1.00 0.00 H new ATOM 0 HB2 MET A 18 2.918 18.347 -5.672 1.00 0.00 H new ATOM 0 HB3 MET A 18 3.169 17.302 -7.056 1.00 0.00 H new ATOM 0 HG2 MET A 18 3.648 19.298 -8.463 1.00 0.00 H new ATOM 0 HG3 MET A 18 3.422 20.329 -7.064 1.00 0.00 H new ATOM 0 HE1 MET A 18 7.307 20.448 -7.865 1.00 0.00 H new ATOM 0 HE2 MET A 18 6.000 20.218 -9.052 1.00 0.00 H new ATOM 0 HE3 MET A 18 5.810 21.403 -7.738 1.00 0.00 H new ATOM 277 N GLU A 19 1.668 18.013 -9.423 1.00 0.00 N ATOM 278 CA GLU A 19 1.872 18.317 -10.794 1.00 0.00 C ATOM 279 C GLU A 19 0.574 18.280 -11.525 1.00 0.00 C ATOM 280 O GLU A 19 0.526 18.597 -12.715 1.00 0.00 O ATOM 281 CB GLU A 19 2.765 17.292 -11.449 1.00 0.00 C ATOM 282 CG GLU A 19 4.082 17.051 -10.721 1.00 0.00 C ATOM 283 CD GLU A 19 5.036 16.197 -11.522 1.00 0.00 C ATOM 284 OE1 GLU A 19 4.578 15.468 -12.429 1.00 0.00 O ATOM 285 OE2 GLU A 19 6.253 16.264 -11.260 1.00 0.00 O ATOM 0 H GLU A 19 1.775 17.027 -9.183 1.00 0.00 H new ATOM 0 HA GLU A 19 2.328 19.306 -10.839 1.00 0.00 H new ATOM 0 HB2 GLU A 19 2.224 16.348 -11.519 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.980 17.613 -12.468 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.553 18.009 -10.502 1.00 0.00 H new ATOM 0 HG3 GLU A 19 3.882 16.568 -9.765 1.00 0.00 H new ATOM 290 N LYS A 20 -0.373 17.556 -10.947 1.00 0.00 N ATOM 291 CA LYS A 20 -1.450 17.099 -11.793 1.00 0.00 C ATOM 292 C LYS A 20 -2.778 16.918 -11.070 1.00 0.00 C ATOM 293 O LYS A 20 -3.816 17.329 -11.584 1.00 0.00 O ATOM 294 CB LYS A 20 -1.023 15.816 -12.525 1.00 0.00 C ATOM 295 CG LYS A 20 -0.272 14.812 -11.660 1.00 0.00 C ATOM 296 CD LYS A 20 0.389 13.708 -12.480 1.00 0.00 C ATOM 297 CE LYS A 20 1.466 14.240 -13.421 1.00 0.00 C ATOM 298 NZ LYS A 20 0.923 14.587 -14.762 1.00 0.00 N ATOM 0 H LYS A 20 -0.417 17.289 -9.963 1.00 0.00 H new ATOM 0 HA LYS A 20 -1.638 17.890 -12.519 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -1.911 15.333 -12.931 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.393 16.089 -13.372 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.489 15.335 -11.081 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -0.964 14.364 -10.946 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.831 12.975 -11.805 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.372 13.188 -13.062 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.928 15.123 -12.979 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.251 13.492 -13.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.338 13.957 -15.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.111 14.473 -14.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 1.162 15.574 -14.988 1.00 0.00 H new ATOM 308 N MET A 21 -2.751 16.259 -9.918 1.00 0.00 N ATOM 309 CA MET A 21 -3.968 15.981 -9.154 1.00 0.00 C ATOM 310 C MET A 21 -4.845 17.210 -9.011 1.00 0.00 C ATOM 311 O MET A 21 -5.969 17.266 -9.506 1.00 0.00 O ATOM 312 CB MET A 21 -3.598 15.523 -7.764 1.00 0.00 C ATOM 313 CG MET A 21 -4.709 15.500 -6.770 1.00 0.00 C ATOM 314 SD MET A 21 -6.088 14.439 -7.232 1.00 0.00 S ATOM 315 CE MET A 21 -7.315 14.963 -6.039 1.00 0.00 C ATOM 0 H MET A 21 -1.897 15.904 -9.488 1.00 0.00 H new ATOM 0 HA MET A 21 -4.518 15.213 -9.698 1.00 0.00 H new ATOM 0 HB2 MET A 21 -3.177 14.520 -7.833 1.00 0.00 H new ATOM 0 HB3 MET A 21 -2.810 16.174 -7.385 1.00 0.00 H new ATOM 0 HG2 MET A 21 -4.316 15.168 -5.809 1.00 0.00 H new ATOM 0 HG3 MET A 21 -5.078 16.516 -6.630 1.00 0.00 H new ATOM 0 HE1 MET A 21 -8.307 14.897 -6.485 1.00 0.00 H new ATOM 0 HE2 MET A 21 -7.268 14.318 -5.162 1.00 0.00 H new ATOM 0 HE3 MET A 21 -7.118 15.993 -5.743 1.00 0.00 H new ATOM 323 N GLY A 22 -4.351 18.128 -8.210 1.00 0.00 N ATOM 324 CA GLY A 22 -5.127 19.308 -7.861 1.00 0.00 C ATOM 325 C GLY A 22 -4.300 20.266 -7.052 1.00 0.00 C ATOM 326 O GLY A 22 -4.487 21.477 -7.118 1.00 0.00 O ATOM 0 H GLY A 22 -3.423 18.086 -7.788 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -5.479 19.800 -8.768 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -6.011 19.014 -7.294 1.00 0.00 H new ATOM 330 N ILE A 23 -3.310 19.685 -6.378 1.00 0.00 N ATOM 331 CA ILE A 23 -2.263 20.389 -5.640 1.00 0.00 C ATOM 332 C ILE A 23 -2.789 21.090 -4.379 1.00 0.00 C ATOM 333 O ILE A 23 -2.304 20.796 -3.290 1.00 0.00 O ATOM 334 CB ILE A 23 -1.418 21.338 -6.549 1.00 0.00 C ATOM 335 CG1 ILE A 23 -1.962 22.772 -6.583 1.00 0.00 C ATOM 336 CG2 ILE A 23 -1.332 20.764 -7.971 1.00 0.00 C ATOM 337 CD1 ILE A 23 -1.086 23.735 -7.355 1.00 0.00 C ATOM 0 H ILE A 23 -3.211 18.671 -6.329 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.577 19.618 -5.288 1.00 0.00 H new ATOM 0 HB ILE A 23 -0.420 21.393 -6.114 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -2.957 22.764 -7.027 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -2.072 23.134 -5.561 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -0.741 21.432 -8.598 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.858 19.783 -7.939 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.335 20.669 -8.386 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -1.533 24.729 -7.336 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.097 23.773 -6.898 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.996 23.397 -8.387 1.00 0.00 H new ATOM 348 N ASN A 24 -3.862 21.870 -4.512 1.00 0.00 N ATOM 349 CA ASN A 24 -4.533 22.526 -3.387 1.00 0.00 C ATOM 350 C ASN A 24 -3.530 23.163 -2.427 1.00 0.00 C ATOM 351 O ASN A 24 -2.453 23.604 -2.834 1.00 0.00 O ATOM 352 CB ASN A 24 -5.418 21.522 -2.631 1.00 0.00 C ATOM 353 CG ASN A 24 -6.575 21.006 -3.466 1.00 0.00 C ATOM 354 OD1 ASN A 24 -6.378 20.389 -4.514 1.00 0.00 O ATOM 355 ND2 ASN A 24 -7.790 21.233 -2.997 1.00 0.00 N ATOM 0 H ASN A 24 -4.296 22.067 -5.414 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.158 23.320 -3.796 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.807 20.680 -2.307 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.810 21.997 -1.731 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -8.605 20.893 -3.507 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -7.912 21.748 -2.125 1.00 0.00 H new ATOM 361 N VAL A 25 -3.820 23.058 -1.142 1.00 0.00 N ATOM 362 CA VAL A 25 -2.874 23.450 -0.109 1.00 0.00 C ATOM 363 C VAL A 25 -1.951 22.275 0.206 1.00 0.00 C ATOM 364 O VAL A 25 -2.059 21.655 1.263 1.00 0.00 O ATOM 365 CB VAL A 25 -3.583 23.945 1.172 1.00 0.00 C ATOM 366 CG1 VAL A 25 -4.088 25.367 0.980 1.00 0.00 C ATOM 367 CG2 VAL A 25 -4.737 23.024 1.552 1.00 0.00 C ATOM 0 H VAL A 25 -4.708 22.703 -0.787 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.287 24.287 -0.487 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.857 23.933 1.985 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.585 25.703 1.890 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.247 26.025 0.762 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -4.794 25.393 0.150 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.217 23.397 2.457 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.464 22.997 0.740 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.356 22.019 1.731 1.00 0.00 H new ATOM 377 N VAL A 26 -1.200 21.867 -0.827 1.00 0.00 N ATOM 378 CA VAL A 26 -0.349 20.660 -0.839 1.00 0.00 C ATOM 379 C VAL A 26 -1.187 19.377 -0.898 1.00 0.00 C ATOM 380 O VAL A 26 -0.768 18.396 -1.507 1.00 0.00 O ATOM 381 CB VAL A 26 0.695 20.577 0.321 1.00 0.00 C ATOM 382 CG1 VAL A 26 1.194 21.956 0.730 1.00 0.00 C ATOM 383 CG2 VAL A 26 0.172 19.796 1.520 1.00 0.00 C ATOM 0 H VAL A 26 -1.164 22.382 -1.707 1.00 0.00 H new ATOM 0 HA VAL A 26 0.236 20.753 -1.754 1.00 0.00 H new ATOM 0 HB VAL A 26 1.547 20.021 -0.070 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.918 21.856 1.539 1.00 0.00 H new ATOM 0 HG12 VAL A 26 1.669 22.439 -0.124 1.00 0.00 H new ATOM 0 HG13 VAL A 26 0.353 22.562 1.069 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.936 19.768 2.297 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.723 20.282 1.908 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -0.071 18.779 1.214 1.00 0.00 H new ATOM 393 N LYS A 27 -2.416 19.443 -0.402 1.00 0.00 N ATOM 394 CA LYS A 27 -3.359 18.323 -0.446 1.00 0.00 C ATOM 395 C LYS A 27 -2.713 17.013 0.023 1.00 0.00 C ATOM 396 O LYS A 27 -2.793 16.666 1.198 1.00 0.00 O ATOM 397 CB LYS A 27 -3.953 18.164 -1.853 1.00 0.00 C ATOM 398 CG LYS A 27 -5.298 17.440 -1.881 1.00 0.00 C ATOM 399 CD LYS A 27 -5.152 15.929 -1.770 1.00 0.00 C ATOM 400 CE LYS A 27 -6.501 15.229 -1.706 1.00 0.00 C ATOM 401 NZ LYS A 27 -7.195 15.450 -0.409 1.00 0.00 N ATOM 0 H LYS A 27 -2.793 20.278 0.046 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.168 18.553 0.247 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -4.074 19.151 -2.299 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -3.245 17.618 -2.476 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.919 17.802 -1.062 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -5.819 17.684 -2.807 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -4.590 15.555 -2.626 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -4.574 15.685 -0.878 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.132 15.589 -2.518 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.360 14.159 -1.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.149 14.582 0.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.732 16.227 0.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.190 15.696 -0.585 1.00 0.00 H new ATOM 411 N ARG A 28 -2.176 16.238 -0.922 1.00 0.00 N ATOM 412 CA ARG A 28 -1.670 14.909 -0.613 1.00 0.00 C ATOM 413 C ARG A 28 -0.159 14.802 -0.713 1.00 0.00 C ATOM 414 O ARG A 28 0.321 13.687 -0.832 1.00 0.00 O ATOM 415 CB ARG A 28 -2.245 13.870 -1.585 1.00 0.00 C ATOM 416 CG ARG A 28 -2.875 12.619 -0.966 1.00 0.00 C ATOM 417 CD ARG A 28 -1.997 11.911 0.065 1.00 0.00 C ATOM 418 NE ARG A 28 -1.649 12.755 1.215 1.00 0.00 N ATOM 419 CZ ARG A 28 -2.530 13.370 2.013 1.00 0.00 C ATOM 420 NH1 ARG A 28 -3.837 13.196 1.855 1.00 0.00 N ATOM 421 NH2 ARG A 28 -2.087 14.172 2.968 1.00 0.00 N ATOM 0 H ARG A 28 -2.083 16.510 -1.901 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.978 14.722 0.416 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -2.999 14.361 -2.200 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -1.446 13.552 -2.254 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -3.816 12.898 -0.493 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -3.115 11.916 -1.764 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -2.515 11.020 0.421 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.080 11.575 -0.420 1.00 0.00 H new ATOM 0 HE ARG A 28 -0.658 12.883 1.422 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -4.184 12.585 1.116 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -4.493 13.673 2.473 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.084 14.316 3.089 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.748 14.647 3.583 1.00 0.00 H new ATOM 432 N LYS A 29 0.597 15.897 -0.809 1.00 0.00 N ATOM 433 CA LYS A 29 2.032 15.726 -1.009 1.00 0.00 C ATOM 434 C LYS A 29 2.655 14.989 0.165 1.00 0.00 C ATOM 435 O LYS A 29 3.164 15.591 1.108 1.00 0.00 O ATOM 436 CB LYS A 29 2.827 17.010 -1.237 1.00 0.00 C ATOM 437 CG LYS A 29 2.098 18.180 -1.879 1.00 0.00 C ATOM 438 CD LYS A 29 2.124 18.195 -3.396 1.00 0.00 C ATOM 439 CE LYS A 29 0.911 17.528 -3.969 1.00 0.00 C ATOM 440 NZ LYS A 29 -0.208 18.497 -4.107 1.00 0.00 N ATOM 0 H LYS A 29 0.263 16.859 -0.755 1.00 0.00 H new ATOM 0 HA LYS A 29 2.097 15.151 -1.933 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.214 17.342 -0.274 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.688 16.767 -1.860 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.059 18.168 -1.548 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.538 19.108 -1.514 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.177 19.224 -3.751 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.022 17.689 -3.751 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.151 17.101 -4.943 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.606 16.703 -3.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.908 18.125 -4.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.660 18.640 -3.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 0.160 19.405 -4.456 1.00 0.00 H new ATOM 450 N LEU A 30 2.774 13.693 -0.014 1.00 0.00 N ATOM 451 CA LEU A 30 3.545 12.854 0.877 1.00 0.00 C ATOM 452 C LEU A 30 4.893 12.693 0.237 1.00 0.00 C ATOM 453 O LEU A 30 5.706 11.870 0.644 1.00 0.00 O ATOM 454 CB LEU A 30 2.896 11.479 1.033 1.00 0.00 C ATOM 455 CG LEU A 30 1.446 11.480 1.499 1.00 0.00 C ATOM 456 CD1 LEU A 30 0.823 10.118 1.250 1.00 0.00 C ATOM 457 CD2 LEU A 30 1.357 11.849 2.972 1.00 0.00 C ATOM 0 H LEU A 30 2.337 13.188 -0.785 1.00 0.00 H new ATOM 0 HA LEU A 30 3.608 13.304 1.868 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.950 10.962 0.075 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.486 10.898 1.742 1.00 0.00 H new ATOM 0 HG LEU A 30 0.894 12.228 0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.214 10.125 1.586 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.858 9.891 0.184 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.377 9.358 1.801 1.00 0.00 H new ATOM 0 HD21 LEU A 30 0.313 11.844 3.286 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.917 11.124 3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.777 12.843 3.124 1.00 0.00 H new ATOM 468 N GLY A 31 5.006 13.369 -0.895 1.00 0.00 N ATOM 469 CA GLY A 31 6.134 13.209 -1.764 1.00 0.00 C ATOM 470 C GLY A 31 7.485 13.318 -1.085 1.00 0.00 C ATOM 471 O GLY A 31 8.350 12.466 -1.262 1.00 0.00 O ATOM 0 H GLY A 31 4.313 14.040 -1.227 1.00 0.00 H new ATOM 0 HA2 GLY A 31 6.065 12.235 -2.249 1.00 0.00 H new ATOM 0 HA3 GLY A 31 6.078 13.961 -2.551 1.00 0.00 H new ATOM 475 N ALA A 32 7.689 14.425 -0.397 1.00 0.00 N ATOM 476 CA ALA A 32 8.979 14.730 0.214 1.00 0.00 C ATOM 477 C ALA A 32 9.101 14.125 1.613 1.00 0.00 C ATOM 478 O ALA A 32 9.492 12.970 1.757 1.00 0.00 O ATOM 479 CB ALA A 32 9.197 16.235 0.249 1.00 0.00 C ATOM 0 H ALA A 32 6.975 15.137 -0.244 1.00 0.00 H new ATOM 0 HA ALA A 32 9.758 14.276 -0.398 1.00 0.00 H new ATOM 0 HB1 ALA A 32 10.162 16.452 0.707 1.00 0.00 H new ATOM 0 HB2 ALA A 32 9.180 16.629 -0.767 1.00 0.00 H new ATOM 0 HB3 ALA A 32 8.405 16.704 0.833 1.00 0.00 H new ATOM 485 N HIS A 33 8.808 14.932 2.638 1.00 0.00 N ATOM 486 CA HIS A 33 8.940 14.515 4.039 1.00 0.00 C ATOM 487 C HIS A 33 10.364 14.130 4.347 1.00 0.00 C ATOM 488 O HIS A 33 11.242 14.996 4.367 1.00 0.00 O ATOM 489 CB HIS A 33 7.979 13.375 4.392 1.00 0.00 C ATOM 490 CG HIS A 33 6.571 13.842 4.431 1.00 0.00 C ATOM 491 ND1 HIS A 33 6.067 14.646 3.457 1.00 0.00 N ATOM 492 CD2 HIS A 33 5.578 13.654 5.328 1.00 0.00 C ATOM 493 CE1 HIS A 33 4.813 14.948 3.740 1.00 0.00 C ATOM 494 NE2 HIS A 33 4.486 14.357 4.877 1.00 0.00 N ATOM 0 H HIS A 33 8.474 15.889 2.521 1.00 0.00 H new ATOM 0 HA HIS A 33 8.668 15.369 4.659 1.00 0.00 H new ATOM 0 HB2 HIS A 33 8.078 12.575 3.659 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.251 12.955 5.360 1.00 0.00 H new ATOM 0 HD2 HIS A 33 5.632 13.062 6.230 1.00 0.00 H new ATOM 0 HE1 HIS A 33 4.164 15.572 3.144 1.00 0.00 H new ATOM 0 HE2 HIS A 33 3.579 14.413 5.340 1.00 0.00 H new ATOM 502 N ALA A 34 10.619 12.833 4.455 1.00 0.00 N ATOM 503 CA ALA A 34 11.980 12.375 4.641 1.00 0.00 C ATOM 504 C ALA A 34 12.116 10.844 4.620 1.00 0.00 C ATOM 505 O ALA A 34 11.480 10.163 3.813 1.00 0.00 O ATOM 506 CB ALA A 34 12.552 12.934 5.939 1.00 0.00 C ATOM 0 H ALA A 34 9.914 12.096 4.418 1.00 0.00 H new ATOM 0 HA ALA A 34 12.551 12.750 3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 34 13.576 12.582 6.067 1.00 0.00 H new ATOM 0 HB2 ALA A 34 12.545 14.023 5.900 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.945 12.597 6.779 1.00 0.00 H new ATOM 512 N ASN A 35 13.020 10.332 5.468 1.00 0.00 N ATOM 513 CA ASN A 35 13.382 8.910 5.497 1.00 0.00 C ATOM 514 C ASN A 35 12.259 8.036 6.052 1.00 0.00 C ATOM 515 O ASN A 35 11.278 8.535 6.616 1.00 0.00 O ATOM 516 CB ASN A 35 14.650 8.708 6.331 1.00 0.00 C ATOM 517 CG ASN A 35 15.537 7.594 5.797 1.00 0.00 C ATOM 518 OD1 ASN A 35 15.105 6.453 5.628 1.00 0.00 O ATOM 519 ND2 ASN A 35 16.791 7.922 5.538 1.00 0.00 N ATOM 0 H ASN A 35 13.521 10.896 6.155 1.00 0.00 H new ATOM 0 HA ASN A 35 13.560 8.603 4.466 1.00 0.00 H new ATOM 0 HB2 ASN A 35 15.217 9.639 6.352 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.370 8.481 7.360 1.00 0.00 H new ATOM 0 HD21 ASN A 35 17.440 7.219 5.185 1.00 0.00 H new ATOM 0 HD22 ASN A 35 17.110 8.879 5.691 1.00 0.00 H new ATOM 525 N LEU A 36 12.397 6.727 5.851 1.00 0.00 N ATOM 526 CA LEU A 36 11.398 5.761 6.224 1.00 0.00 C ATOM 527 C LEU A 36 12.025 4.399 6.125 1.00 0.00 C ATOM 528 O LEU A 36 13.014 4.249 5.410 1.00 0.00 O ATOM 529 CB LEU A 36 10.215 5.865 5.263 1.00 0.00 C ATOM 530 CG LEU A 36 10.614 6.057 3.799 1.00 0.00 C ATOM 531 CD1 LEU A 36 11.167 4.775 3.200 1.00 0.00 C ATOM 532 CD2 LEU A 36 9.439 6.575 2.987 1.00 0.00 C ATOM 0 H LEU A 36 13.223 6.314 5.417 1.00 0.00 H new ATOM 0 HA LEU A 36 11.040 5.938 7.238 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.611 4.962 5.348 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.585 6.700 5.569 1.00 0.00 H new ATOM 0 HG LEU A 36 11.409 6.802 3.765 1.00 0.00 H new ATOM 0 HD11 LEU A 36 11.440 4.948 2.159 1.00 0.00 H new ATOM 0 HD12 LEU A 36 12.049 4.463 3.760 1.00 0.00 H new ATOM 0 HD13 LEU A 36 10.409 3.993 3.251 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.743 6.705 1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.618 5.860 3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.111 7.533 3.391 1.00 0.00 H new ATOM 543 N LYS A 37 11.455 3.381 6.741 1.00 0.00 N ATOM 544 CA LYS A 37 11.979 2.083 6.472 1.00 0.00 C ATOM 545 C LYS A 37 10.882 1.150 5.996 1.00 0.00 C ATOM 546 O LYS A 37 9.751 1.259 6.454 1.00 0.00 O ATOM 547 CB LYS A 37 12.733 1.505 7.656 1.00 0.00 C ATOM 548 CG LYS A 37 11.871 1.083 8.817 1.00 0.00 C ATOM 549 CD LYS A 37 12.739 0.950 10.047 1.00 0.00 C ATOM 550 CE LYS A 37 12.017 0.264 11.191 1.00 0.00 C ATOM 551 NZ LYS A 37 12.902 0.061 12.364 1.00 0.00 N ATOM 0 H LYS A 37 10.673 3.431 7.394 1.00 0.00 H new ATOM 0 HA LYS A 37 12.708 2.188 5.669 1.00 0.00 H new ATOM 0 HB2 LYS A 37 13.306 0.642 7.316 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.451 2.246 8.007 1.00 0.00 H new ATOM 0 HG2 LYS A 37 11.084 1.817 8.989 1.00 0.00 H new ATOM 0 HG3 LYS A 37 11.380 0.135 8.597 1.00 0.00 H new ATOM 0 HD2 LYS A 37 13.636 0.385 9.796 1.00 0.00 H new ATOM 0 HD3 LYS A 37 13.065 1.940 10.368 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.155 0.862 11.486 1.00 0.00 H new ATOM 0 HE3 LYS A 37 11.636 -0.700 10.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 12.370 -0.411 13.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 13.712 -0.531 12.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 13.246 0.982 12.703 1.00 0.00 H new ATOM 561 N LEU A 38 11.189 0.311 5.007 1.00 0.00 N ATOM 562 CA LEU A 38 10.214 -0.587 4.431 1.00 0.00 C ATOM 563 C LEU A 38 10.666 -2.016 4.674 1.00 0.00 C ATOM 564 O LEU A 38 11.819 -2.326 4.432 1.00 0.00 O ATOM 565 CB LEU A 38 10.135 -0.327 2.925 1.00 0.00 C ATOM 566 CG LEU A 38 9.094 0.693 2.427 1.00 0.00 C ATOM 567 CD1 LEU A 38 7.861 -0.017 1.905 1.00 0.00 C ATOM 568 CD2 LEU A 38 8.706 1.687 3.509 1.00 0.00 C ATOM 0 H LEU A 38 12.118 0.242 4.591 1.00 0.00 H new ATOM 0 HA LEU A 38 9.235 -0.428 4.883 1.00 0.00 H new ATOM 0 HB2 LEU A 38 11.117 0.006 2.590 1.00 0.00 H new ATOM 0 HB3 LEU A 38 9.936 -1.278 2.431 1.00 0.00 H new ATOM 0 HG LEU A 38 9.556 1.254 1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.137 0.720 1.558 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.140 -0.670 1.078 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.418 -0.612 2.704 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.970 2.387 3.113 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.279 1.153 4.358 1.00 0.00 H new ATOM 0 HD23 LEU A 38 9.590 2.235 3.833 1.00 0.00 H new ATOM 579 N THR A 39 9.821 -2.831 5.271 1.00 0.00 N ATOM 580 CA THR A 39 10.184 -4.194 5.651 1.00 0.00 C ATOM 581 C THR A 39 8.950 -5.091 5.345 1.00 0.00 C ATOM 582 O THR A 39 7.915 -4.521 4.991 1.00 0.00 O ATOM 583 CB THR A 39 10.537 -4.198 7.140 1.00 0.00 C ATOM 584 OG1 THR A 39 11.487 -3.160 7.437 1.00 0.00 O ATOM 585 CG2 THR A 39 11.096 -5.547 7.587 1.00 0.00 C ATOM 0 H THR A 39 8.863 -2.574 5.509 1.00 0.00 H new ATOM 0 HA THR A 39 11.047 -4.571 5.102 1.00 0.00 H new ATOM 0 HB THR A 39 9.614 -4.014 7.689 1.00 0.00 H new ATOM 0 HG1 THR A 39 12.149 -3.107 6.717 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.334 -5.508 8.650 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.354 -6.325 7.410 1.00 0.00 H new ATOM 0 HG23 THR A 39 12.000 -5.772 7.021 1.00 0.00 H new ATOM 593 N ILE A 40 8.980 -6.445 5.454 1.00 0.00 N ATOM 594 CA ILE A 40 7.779 -7.219 5.173 1.00 0.00 C ATOM 595 C ILE A 40 7.938 -8.620 5.760 1.00 0.00 C ATOM 596 O ILE A 40 8.842 -9.354 5.373 1.00 0.00 O ATOM 597 CB ILE A 40 7.467 -7.399 3.644 1.00 0.00 C ATOM 598 CG1 ILE A 40 8.424 -8.367 2.965 1.00 0.00 C ATOM 599 CG2 ILE A 40 7.388 -6.104 2.857 1.00 0.00 C ATOM 600 CD1 ILE A 40 9.881 -7.956 2.976 1.00 0.00 C ATOM 0 H ILE A 40 9.798 -6.991 5.725 1.00 0.00 H new ATOM 0 HA ILE A 40 6.958 -6.657 5.618 1.00 0.00 H new ATOM 0 HB ILE A 40 6.465 -7.827 3.633 1.00 0.00 H new ATOM 0 HG12 ILE A 40 8.335 -9.339 3.450 1.00 0.00 H new ATOM 0 HG13 ILE A 40 8.109 -8.497 1.930 1.00 0.00 H new ATOM 0 HG21 ILE A 40 7.169 -6.326 1.812 1.00 0.00 H new ATOM 0 HG22 ILE A 40 6.598 -5.476 3.268 1.00 0.00 H new ATOM 0 HG23 ILE A 40 8.341 -5.579 2.924 1.00 0.00 H new ATOM 0 HD11 ILE A 40 10.477 -8.714 2.467 1.00 0.00 H new ATOM 0 HD12 ILE A 40 9.994 -7.001 2.463 1.00 0.00 H new ATOM 0 HD13 ILE A 40 10.223 -7.857 4.006 1.00 0.00 H new ATOM 611 N THR A 41 7.214 -8.949 6.804 1.00 0.00 N ATOM 612 CA THR A 41 7.446 -10.262 7.387 1.00 0.00 C ATOM 613 C THR A 41 6.408 -10.659 8.462 1.00 0.00 C ATOM 614 O THR A 41 6.250 -9.963 9.470 1.00 0.00 O ATOM 615 CB THR A 41 8.924 -10.323 7.873 1.00 0.00 C ATOM 616 OG1 THR A 41 9.351 -11.675 8.074 1.00 0.00 O ATOM 617 CG2 THR A 41 9.185 -9.504 9.115 1.00 0.00 C ATOM 0 H THR A 41 6.501 -8.372 7.250 1.00 0.00 H new ATOM 0 HA THR A 41 7.297 -11.025 6.623 1.00 0.00 H new ATOM 0 HB THR A 41 9.513 -9.876 7.072 1.00 0.00 H new ATOM 0 HG1 THR A 41 9.790 -12.004 7.262 1.00 0.00 H new ATOM 0 HG21 THR A 41 10.234 -9.593 9.396 1.00 0.00 H new ATOM 0 HG22 THR A 41 8.950 -8.458 8.917 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.559 -9.869 9.929 1.00 0.00 H new ATOM 625 N GLN A 42 5.729 -11.813 8.259 1.00 0.00 N ATOM 626 CA GLN A 42 4.780 -12.341 9.248 1.00 0.00 C ATOM 627 C GLN A 42 4.220 -13.717 8.851 1.00 0.00 C ATOM 628 O GLN A 42 4.440 -14.701 9.563 1.00 0.00 O ATOM 629 CB GLN A 42 3.638 -11.354 9.527 1.00 0.00 C ATOM 630 CG GLN A 42 2.817 -10.977 8.308 1.00 0.00 C ATOM 631 CD GLN A 42 1.812 -9.880 8.596 1.00 0.00 C ATOM 632 OE1 GLN A 42 1.114 -9.418 7.696 1.00 0.00 O ATOM 633 NE2 GLN A 42 1.721 -9.466 9.850 1.00 0.00 N ATOM 0 H GLN A 42 5.825 -12.388 7.422 1.00 0.00 H new ATOM 0 HA GLN A 42 5.348 -12.473 10.169 1.00 0.00 H new ATOM 0 HB2 GLN A 42 2.975 -11.788 10.275 1.00 0.00 H new ATOM 0 HB3 GLN A 42 4.058 -10.446 9.961 1.00 0.00 H new ATOM 0 HG2 GLN A 42 3.486 -10.651 7.511 1.00 0.00 H new ATOM 0 HG3 GLN A 42 2.291 -11.859 7.942 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.319 -9.876 10.567 1.00 0.00 H new ATOM 0 HE22 GLN A 42 1.053 -8.737 10.099 1.00 0.00 H new ATOM 640 N GLU A 43 3.537 -13.808 7.711 1.00 0.00 N ATOM 641 CA GLU A 43 2.995 -15.080 7.245 1.00 0.00 C ATOM 642 C GLU A 43 3.272 -15.194 5.766 1.00 0.00 C ATOM 643 O GLU A 43 3.663 -14.195 5.160 1.00 0.00 O ATOM 644 CB GLU A 43 1.496 -15.177 7.533 1.00 0.00 C ATOM 645 CG GLU A 43 1.159 -15.018 9.007 1.00 0.00 C ATOM 646 CD GLU A 43 -0.318 -15.159 9.300 1.00 0.00 C ATOM 647 OE1 GLU A 43 -1.106 -14.319 8.825 1.00 0.00 O ATOM 648 OE2 GLU A 43 -0.693 -16.106 10.023 1.00 0.00 O ATOM 0 H GLU A 43 3.347 -13.017 7.095 1.00 0.00 H new ATOM 0 HA GLU A 43 3.473 -15.903 7.776 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.972 -14.410 6.962 1.00 0.00 H new ATOM 0 HB3 GLU A 43 1.127 -16.142 7.184 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.709 -15.763 9.581 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.498 -14.040 9.347 1.00 0.00 H new ATOM 653 N GLY A 44 3.130 -16.368 5.148 1.00 0.00 N ATOM 654 CA GLY A 44 3.513 -16.384 3.772 1.00 0.00 C ATOM 655 C GLY A 44 2.351 -16.381 2.826 1.00 0.00 C ATOM 656 O GLY A 44 2.289 -17.194 1.906 1.00 0.00 O ATOM 0 H GLY A 44 2.783 -17.239 5.550 1.00 0.00 H new ATOM 0 HA2 GLY A 44 4.139 -15.516 3.568 1.00 0.00 H new ATOM 0 HA3 GLY A 44 4.122 -17.268 3.583 1.00 0.00 H new ATOM 660 N ASN A 45 1.903 -15.160 2.726 1.00 0.00 N ATOM 661 CA ASN A 45 1.262 -14.572 1.574 1.00 0.00 C ATOM 662 C ASN A 45 1.096 -13.151 2.006 1.00 0.00 C ATOM 663 O ASN A 45 0.104 -12.793 2.631 1.00 0.00 O ATOM 664 CB ASN A 45 -0.106 -15.191 1.230 1.00 0.00 C ATOM 665 CG ASN A 45 -1.031 -15.398 2.438 1.00 0.00 C ATOM 666 OD1 ASN A 45 -2.194 -15.003 2.404 1.00 0.00 O ATOM 667 ND2 ASN A 45 -0.542 -16.035 3.506 1.00 0.00 N ATOM 0 H ASN A 45 1.980 -14.500 3.500 1.00 0.00 H new ATOM 0 HA ASN A 45 1.846 -14.721 0.666 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -0.610 -14.549 0.508 1.00 0.00 H new ATOM 0 HB3 ASN A 45 0.056 -16.153 0.743 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -1.138 -16.203 4.317 1.00 0.00 H new ATOM 0 HD22 ASN A 45 0.427 -16.353 3.510 1.00 0.00 H new ATOM 673 N LYS A 46 2.151 -12.408 1.858 1.00 0.00 N ATOM 674 CA LYS A 46 2.235 -11.144 2.539 1.00 0.00 C ATOM 675 C LYS A 46 3.430 -10.368 2.078 1.00 0.00 C ATOM 676 O LYS A 46 4.434 -10.938 1.656 1.00 0.00 O ATOM 677 CB LYS A 46 2.367 -11.329 4.069 1.00 0.00 C ATOM 678 CG LYS A 46 1.081 -11.145 4.860 1.00 0.00 C ATOM 679 CD LYS A 46 0.619 -12.463 5.459 1.00 0.00 C ATOM 680 CE LYS A 46 -0.173 -12.257 6.734 1.00 0.00 C ATOM 681 NZ LYS A 46 -1.432 -11.490 6.509 1.00 0.00 N ATOM 0 H LYS A 46 2.957 -12.647 1.281 1.00 0.00 H new ATOM 0 HA LYS A 46 1.315 -10.608 2.307 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.755 -12.329 4.265 1.00 0.00 H new ATOM 0 HB3 LYS A 46 3.107 -10.621 4.441 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.239 -10.416 5.654 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.304 -10.744 4.210 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.006 -12.997 4.733 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.485 -13.091 5.667 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.415 -13.227 7.168 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.445 -11.729 7.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.952 -11.406 7.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.201 -10.541 6.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.022 -11.988 5.812 1.00 0.00 H new ATOM 691 N PHE A 47 3.415 -9.126 2.466 1.00 0.00 N ATOM 692 CA PHE A 47 4.581 -8.287 2.423 1.00 0.00 C ATOM 693 C PHE A 47 4.296 -7.208 3.422 1.00 0.00 C ATOM 694 O PHE A 47 3.464 -6.354 3.170 1.00 0.00 O ATOM 695 CB PHE A 47 4.784 -7.708 1.008 1.00 0.00 C ATOM 696 CG PHE A 47 3.670 -8.056 0.052 1.00 0.00 C ATOM 697 CD1 PHE A 47 2.391 -7.552 0.244 1.00 0.00 C ATOM 698 CD2 PHE A 47 3.894 -8.911 -1.017 1.00 0.00 C ATOM 699 CE1 PHE A 47 1.363 -7.891 -0.608 1.00 0.00 C ATOM 700 CE2 PHE A 47 2.865 -9.256 -1.871 1.00 0.00 C ATOM 701 CZ PHE A 47 1.597 -8.747 -1.666 1.00 0.00 C ATOM 0 H PHE A 47 2.582 -8.660 2.826 1.00 0.00 H new ATOM 0 HA PHE A 47 5.499 -8.827 2.656 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.869 -6.623 1.076 1.00 0.00 H new ATOM 0 HB3 PHE A 47 5.727 -8.077 0.605 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.199 -6.886 1.072 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.883 -9.311 -1.183 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.374 -7.487 -0.449 1.00 0.00 H new ATOM 0 HE2 PHE A 47 3.051 -9.924 -2.699 1.00 0.00 H new ATOM 0 HZ PHE A 47 0.791 -9.018 -2.332 1.00 0.00 H new ATOM 710 N THR A 48 4.829 -7.344 4.630 1.00 0.00 N ATOM 711 CA THR A 48 4.336 -6.512 5.704 1.00 0.00 C ATOM 712 C THR A 48 5.252 -6.393 6.856 1.00 0.00 C ATOM 713 O THR A 48 5.139 -7.195 7.772 1.00 0.00 O ATOM 714 CB THR A 48 3.051 -7.094 6.296 1.00 0.00 C ATOM 715 OG1 THR A 48 2.068 -7.152 5.318 1.00 0.00 O ATOM 716 CG2 THR A 48 2.585 -6.237 7.450 1.00 0.00 C ATOM 0 H THR A 48 5.572 -7.996 4.879 1.00 0.00 H new ATOM 0 HA THR A 48 4.201 -5.539 5.233 1.00 0.00 H new ATOM 0 HB THR A 48 3.248 -8.102 6.661 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.239 -6.464 4.641 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.670 -6.656 7.868 1.00 0.00 H new ATOM 0 HG22 THR A 48 3.357 -6.212 8.219 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.392 -5.224 7.096 1.00 0.00 H new ATOM 724 N VAL A 49 5.920 -5.259 6.930 1.00 0.00 N ATOM 725 CA VAL A 49 6.544 -4.812 8.144 1.00 0.00 C ATOM 726 C VAL A 49 7.132 -3.441 7.880 1.00 0.00 C ATOM 727 O VAL A 49 8.060 -3.404 7.159 1.00 0.00 O ATOM 728 CB VAL A 49 7.739 -5.702 8.558 1.00 0.00 C ATOM 729 CG1 VAL A 49 8.622 -4.987 9.556 1.00 0.00 C ATOM 730 CG2 VAL A 49 7.349 -7.031 9.107 1.00 0.00 C ATOM 0 H VAL A 49 6.042 -4.624 6.141 1.00 0.00 H new ATOM 0 HA VAL A 49 5.787 -4.831 8.928 1.00 0.00 H new ATOM 0 HB VAL A 49 8.286 -5.892 7.634 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.456 -5.633 9.832 1.00 0.00 H new ATOM 0 HG12 VAL A 49 9.006 -4.069 9.110 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.042 -4.743 10.446 1.00 0.00 H new ATOM 0 HG21 VAL A 49 8.245 -7.592 9.373 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.732 -6.891 9.995 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.784 -7.583 8.356 1.00 0.00 H new ATOM 740 N LYS A 50 6.819 -2.352 8.522 1.00 0.00 N ATOM 741 CA LYS A 50 7.722 -1.222 8.313 1.00 0.00 C ATOM 742 C LYS A 50 7.425 -0.064 9.221 1.00 0.00 C ATOM 743 O LYS A 50 6.627 0.799 8.881 1.00 0.00 O ATOM 744 CB LYS A 50 7.754 -0.777 6.849 1.00 0.00 C ATOM 745 CG LYS A 50 6.481 -1.031 6.080 1.00 0.00 C ATOM 746 CD LYS A 50 6.767 -1.431 4.646 1.00 0.00 C ATOM 747 CE LYS A 50 5.499 -1.807 3.895 1.00 0.00 C ATOM 748 NZ LYS A 50 4.750 -0.612 3.425 1.00 0.00 N ATOM 0 H LYS A 50 6.023 -2.209 9.144 1.00 0.00 H new ATOM 0 HA LYS A 50 8.717 -1.584 8.574 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.976 0.290 6.813 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.574 -1.290 6.346 1.00 0.00 H new ATOM 0 HG2 LYS A 50 5.909 -1.818 6.571 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.863 -0.133 6.092 1.00 0.00 H new ATOM 0 HD2 LYS A 50 7.262 -0.607 4.132 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.458 -2.274 4.636 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.757 -2.432 3.040 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.858 -2.404 4.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.362 -0.796 2.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.972 -0.409 4.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.391 0.206 3.384 1.00 0.00 H new ATOM 758 N GLU A 51 8.182 0.080 10.281 1.00 0.00 N ATOM 759 CA GLU A 51 7.972 1.219 11.131 1.00 0.00 C ATOM 760 C GLU A 51 9.161 2.176 11.066 1.00 0.00 C ATOM 761 O GLU A 51 9.934 2.262 12.020 1.00 0.00 O ATOM 762 CB GLU A 51 7.803 0.724 12.582 1.00 0.00 C ATOM 763 CG GLU A 51 6.771 -0.393 12.756 1.00 0.00 C ATOM 764 CD GLU A 51 7.354 -1.767 12.526 1.00 0.00 C ATOM 765 OE1 GLU A 51 8.269 -2.155 13.278 1.00 0.00 O ATOM 766 OE2 GLU A 51 6.903 -2.464 11.597 1.00 0.00 O ATOM 0 H GLU A 51 8.926 -0.556 10.568 1.00 0.00 H new ATOM 0 HA GLU A 51 7.082 1.751 10.796 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.767 0.370 12.946 1.00 0.00 H new ATOM 0 HB3 GLU A 51 7.515 1.568 13.209 1.00 0.00 H new ATOM 0 HG2 GLU A 51 6.354 -0.343 13.762 1.00 0.00 H new ATOM 0 HG3 GLU A 51 5.947 -0.232 12.061 1.00 0.00 H new ATOM 771 N SER A 52 9.107 3.105 10.108 1.00 0.00 N ATOM 772 CA SER A 52 9.946 4.292 10.133 1.00 0.00 C ATOM 773 C SER A 52 9.482 5.257 9.057 1.00 0.00 C ATOM 774 O SER A 52 9.340 4.855 7.907 1.00 0.00 O ATOM 775 CB SER A 52 11.414 3.907 10.012 1.00 0.00 C ATOM 776 OG SER A 52 12.104 4.598 8.997 1.00 0.00 O ATOM 0 H SER A 52 8.484 3.051 9.302 1.00 0.00 H new ATOM 0 HA SER A 52 9.849 4.807 11.089 1.00 0.00 H new ATOM 0 HB2 SER A 52 11.908 4.094 10.965 1.00 0.00 H new ATOM 0 HB3 SER A 52 11.484 2.836 9.821 1.00 0.00 H new ATOM 0 HG SER A 52 13.038 4.303 8.977 1.00 0.00 H new ATOM 781 N SER A 53 9.129 6.486 9.447 1.00 0.00 N ATOM 782 CA SER A 53 8.674 7.500 8.490 1.00 0.00 C ATOM 783 C SER A 53 8.625 8.896 9.114 1.00 0.00 C ATOM 784 O SER A 53 7.589 9.297 9.641 1.00 0.00 O ATOM 785 CB SER A 53 7.278 7.160 7.937 1.00 0.00 C ATOM 786 OG SER A 53 7.337 6.163 6.929 1.00 0.00 O ATOM 0 H SER A 53 9.149 6.802 10.416 1.00 0.00 H new ATOM 0 HA SER A 53 9.402 7.500 7.678 1.00 0.00 H new ATOM 0 HB2 SER A 53 6.639 6.817 8.750 1.00 0.00 H new ATOM 0 HB3 SER A 53 6.819 8.061 7.530 1.00 0.00 H new ATOM 0 HG SER A 53 8.180 5.670 7.006 1.00 0.00 H new ATOM 791 N ASN A 54 9.639 9.711 8.809 1.00 0.00 N ATOM 792 CA ASN A 54 9.638 11.149 9.137 1.00 0.00 C ATOM 793 C ASN A 54 9.590 11.458 10.650 1.00 0.00 C ATOM 794 O ASN A 54 10.363 12.288 11.128 1.00 0.00 O ATOM 795 CB ASN A 54 8.501 11.860 8.367 1.00 0.00 C ATOM 796 CG ASN A 54 7.724 12.879 9.188 1.00 0.00 C ATOM 797 OD1 ASN A 54 6.879 12.522 10.008 1.00 0.00 O ATOM 798 ND2 ASN A 54 7.992 14.154 8.961 1.00 0.00 N ATOM 0 H ASN A 54 10.483 9.399 8.329 1.00 0.00 H new ATOM 0 HA ASN A 54 10.600 11.545 8.812 1.00 0.00 H new ATOM 0 HB2 ASN A 54 8.926 12.361 7.497 1.00 0.00 H new ATOM 0 HB3 ASN A 54 7.806 11.108 7.993 1.00 0.00 H new ATOM 0 HD21 ASN A 54 7.491 14.880 9.474 1.00 0.00 H new ATOM 0 HD22 ASN A 54 8.700 14.412 8.273 1.00 0.00 H new ATOM 804 N PHE A 55 8.676 10.837 11.389 1.00 0.00 N ATOM 805 CA PHE A 55 8.507 11.130 12.812 1.00 0.00 C ATOM 806 C PHE A 55 7.687 10.032 13.485 1.00 0.00 C ATOM 807 O PHE A 55 8.076 9.498 14.523 1.00 0.00 O ATOM 808 CB PHE A 55 7.813 12.485 12.993 1.00 0.00 C ATOM 809 CG PHE A 55 7.752 12.961 14.417 1.00 0.00 C ATOM 810 CD1 PHE A 55 8.904 13.063 15.179 1.00 0.00 C ATOM 811 CD2 PHE A 55 6.540 13.309 14.992 1.00 0.00 C ATOM 812 CE1 PHE A 55 8.849 13.503 16.488 1.00 0.00 C ATOM 813 CE2 PHE A 55 6.480 13.749 16.300 1.00 0.00 C ATOM 814 CZ PHE A 55 7.635 13.847 17.049 1.00 0.00 C ATOM 0 H PHE A 55 8.039 10.127 11.028 1.00 0.00 H new ATOM 0 HA PHE A 55 9.491 11.170 13.278 1.00 0.00 H new ATOM 0 HB2 PHE A 55 8.336 13.231 12.395 1.00 0.00 H new ATOM 0 HB3 PHE A 55 6.798 12.416 12.601 1.00 0.00 H new ATOM 0 HD1 PHE A 55 9.856 12.796 14.745 1.00 0.00 H new ATOM 0 HD2 PHE A 55 5.633 13.235 14.411 1.00 0.00 H new ATOM 0 HE1 PHE A 55 9.755 13.578 17.072 1.00 0.00 H new ATOM 0 HE2 PHE A 55 5.529 14.016 16.737 1.00 0.00 H new ATOM 0 HZ PHE A 55 7.589 14.192 18.071 1.00 0.00 H new ATOM 823 N ARG A 56 6.651 9.588 12.793 1.00 0.00 N ATOM 824 CA ARG A 56 5.875 8.434 13.225 1.00 0.00 C ATOM 825 C ARG A 56 6.310 7.251 12.386 1.00 0.00 C ATOM 826 O ARG A 56 7.012 7.445 11.400 1.00 0.00 O ATOM 827 CB ARG A 56 4.364 8.677 13.093 1.00 0.00 C ATOM 828 CG ARG A 56 3.911 9.182 11.730 1.00 0.00 C ATOM 829 CD ARG A 56 4.079 10.689 11.600 1.00 0.00 C ATOM 830 NE ARG A 56 3.418 11.206 10.404 1.00 0.00 N ATOM 831 CZ ARG A 56 3.416 12.486 10.034 1.00 0.00 C ATOM 832 NH1 ARG A 56 4.112 13.387 10.712 1.00 0.00 N ATOM 833 NH2 ARG A 56 2.714 12.859 8.972 1.00 0.00 N ATOM 0 H ARG A 56 6.325 10.011 11.924 1.00 0.00 H new ATOM 0 HA ARG A 56 6.059 8.243 14.282 1.00 0.00 H new ATOM 0 HB2 ARG A 56 3.841 7.746 13.311 1.00 0.00 H new ATOM 0 HB3 ARG A 56 4.060 9.399 13.851 1.00 0.00 H new ATOM 0 HG2 ARG A 56 4.485 8.684 10.949 1.00 0.00 H new ATOM 0 HG3 ARG A 56 2.865 8.918 11.574 1.00 0.00 H new ATOM 0 HD2 ARG A 56 3.668 11.178 12.483 1.00 0.00 H new ATOM 0 HD3 ARG A 56 5.140 10.935 11.564 1.00 0.00 H new ATOM 0 HE ARG A 56 2.923 10.540 9.810 1.00 0.00 H new ATOM 0 HH11 ARG A 56 4.657 13.103 11.526 1.00 0.00 H new ATOM 0 HH12 ARG A 56 4.103 14.364 10.419 1.00 0.00 H new ATOM 0 HH21 ARG A 56 2.181 12.168 8.445 1.00 0.00 H new ATOM 0 HH22 ARG A 56 2.708 13.837 8.683 1.00 0.00 H new ATOM 844 N ASN A 57 6.072 6.028 12.836 1.00 0.00 N ATOM 845 CA ASN A 57 6.663 4.905 12.154 1.00 0.00 C ATOM 846 C ASN A 57 6.037 3.617 12.546 1.00 0.00 C ATOM 847 O ASN A 57 6.388 3.012 13.555 1.00 0.00 O ATOM 848 CB ASN A 57 8.171 4.859 12.398 1.00 0.00 C ATOM 849 CG ASN A 57 8.599 5.208 13.811 1.00 0.00 C ATOM 850 OD1 ASN A 57 9.317 6.309 13.932 1.00 0.00 O flip ATOM 851 ND2 ASN A 57 8.311 4.496 14.772 1.00 0.00 N flip ATOM 0 H ASN A 57 5.493 5.799 13.644 1.00 0.00 H new ATOM 0 HA ASN A 57 6.479 5.045 11.089 1.00 0.00 H new ATOM 0 HB2 ASN A 57 8.533 3.858 12.161 1.00 0.00 H new ATOM 0 HB3 ASN A 57 8.658 5.546 11.706 1.00 0.00 H new ATOM 0 HD21 ASN A 57 7.754 3.653 14.633 1.00 0.00 H new ATOM 0 HD22 ASN A 57 8.630 4.749 15.707 1.00 0.00 H new ATOM 857 N ILE A 58 5.215 3.136 11.645 1.00 0.00 N ATOM 858 CA ILE A 58 4.718 1.816 11.709 1.00 0.00 C ATOM 859 C ILE A 58 3.910 1.539 10.479 1.00 0.00 C ATOM 860 O ILE A 58 2.940 2.248 10.190 1.00 0.00 O ATOM 861 CB ILE A 58 3.910 1.546 12.969 1.00 0.00 C ATOM 862 CG1 ILE A 58 3.239 0.168 12.848 1.00 0.00 C ATOM 863 CG2 ILE A 58 2.921 2.678 13.220 1.00 0.00 C ATOM 864 CD1 ILE A 58 2.661 -0.331 14.145 1.00 0.00 C ATOM 0 H ILE A 58 4.879 3.670 10.844 1.00 0.00 H new ATOM 0 HA ILE A 58 5.570 1.138 11.754 1.00 0.00 H new ATOM 0 HB ILE A 58 4.562 1.518 13.842 1.00 0.00 H new ATOM 0 HG12 ILE A 58 2.446 0.223 12.102 1.00 0.00 H new ATOM 0 HG13 ILE A 58 3.970 -0.553 12.483 1.00 0.00 H new ATOM 0 HG21 ILE A 58 2.351 2.469 14.125 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.464 3.615 13.341 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.240 2.760 12.373 1.00 0.00 H new ATOM 0 HD11 ILE A 58 2.203 -1.308 13.988 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.454 -0.417 14.887 1.00 0.00 H new ATOM 0 HD13 ILE A 58 1.906 0.370 14.501 1.00 0.00 H new ATOM 875 N ASP A 59 4.221 0.469 9.817 1.00 0.00 N ATOM 876 CA ASP A 59 3.401 0.057 8.736 1.00 0.00 C ATOM 877 C ASP A 59 3.440 -1.444 8.655 1.00 0.00 C ATOM 878 O ASP A 59 4.222 -2.037 7.918 1.00 0.00 O ATOM 879 CB ASP A 59 3.899 0.685 7.433 1.00 0.00 C ATOM 880 CG ASP A 59 3.031 0.346 6.233 1.00 0.00 C ATOM 881 OD1 ASP A 59 1.984 -0.308 6.404 1.00 0.00 O ATOM 882 OD2 ASP A 59 3.401 0.738 5.108 1.00 0.00 O ATOM 0 H ASP A 59 5.028 -0.125 10.007 1.00 0.00 H new ATOM 0 HA ASP A 59 2.374 0.385 8.894 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.937 1.768 7.551 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.918 0.349 7.242 1.00 0.00 H new ATOM 886 N VAL A 60 2.487 -2.040 9.313 1.00 0.00 N ATOM 887 CA VAL A 60 2.305 -3.468 9.239 1.00 0.00 C ATOM 888 C VAL A 60 0.814 -3.785 9.046 1.00 0.00 C ATOM 889 O VAL A 60 0.103 -4.089 10.005 1.00 0.00 O ATOM 890 CB VAL A 60 2.835 -4.143 10.532 1.00 0.00 C ATOM 891 CG1 VAL A 60 4.338 -3.982 10.630 1.00 0.00 C ATOM 892 CG2 VAL A 60 2.188 -3.564 11.786 1.00 0.00 C ATOM 0 H VAL A 60 1.817 -1.558 9.912 1.00 0.00 H new ATOM 0 HA VAL A 60 2.867 -3.859 8.391 1.00 0.00 H new ATOM 0 HB VAL A 60 2.575 -5.200 10.470 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.696 -4.460 11.542 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.811 -4.448 9.766 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.590 -2.922 10.653 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.588 -4.066 12.667 1.00 0.00 H new ATOM 0 HG22 VAL A 60 2.403 -2.497 11.847 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.109 -3.715 11.742 1.00 0.00 H new ATOM 902 N VAL A 61 0.410 -3.933 7.787 1.00 0.00 N ATOM 903 CA VAL A 61 -0.950 -4.366 7.430 1.00 0.00 C ATOM 904 C VAL A 61 -0.973 -4.765 5.964 1.00 0.00 C ATOM 905 O VAL A 61 -1.190 -3.920 5.098 1.00 0.00 O ATOM 906 CB VAL A 61 -2.043 -3.252 7.594 1.00 0.00 C ATOM 907 CG1 VAL A 61 -3.417 -3.802 7.242 1.00 0.00 C ATOM 908 CG2 VAL A 61 -2.088 -2.642 8.986 1.00 0.00 C ATOM 0 H VAL A 61 1.011 -3.758 6.982 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.185 -5.184 8.111 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.762 -2.455 6.905 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.164 -3.017 7.361 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.416 -4.149 6.209 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.656 -4.634 7.904 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.867 -1.880 9.024 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.305 -3.420 9.717 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.124 -2.187 9.215 1.00 0.00 H new ATOM 918 N PHE A 62 -0.921 -6.054 5.693 1.00 0.00 N ATOM 919 CA PHE A 62 -1.092 -6.548 4.333 1.00 0.00 C ATOM 920 C PHE A 62 -1.594 -7.972 4.357 1.00 0.00 C ATOM 921 O PHE A 62 -1.665 -8.626 5.402 1.00 0.00 O ATOM 922 CB PHE A 62 0.171 -6.515 3.455 1.00 0.00 C ATOM 923 CG PHE A 62 0.832 -5.177 3.251 1.00 0.00 C ATOM 924 CD1 PHE A 62 1.524 -4.576 4.283 1.00 0.00 C ATOM 925 CD2 PHE A 62 0.837 -4.570 2.008 1.00 0.00 C ATOM 926 CE1 PHE A 62 2.193 -3.399 4.100 1.00 0.00 C ATOM 927 CE2 PHE A 62 1.523 -3.387 1.806 1.00 0.00 C ATOM 928 CZ PHE A 62 2.201 -2.799 2.856 1.00 0.00 C ATOM 0 H PHE A 62 -0.762 -6.780 6.392 1.00 0.00 H new ATOM 0 HA PHE A 62 -1.808 -5.859 3.885 1.00 0.00 H new ATOM 0 HB2 PHE A 62 0.905 -7.191 3.893 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -0.088 -6.917 2.475 1.00 0.00 H new ATOM 0 HD1 PHE A 62 1.537 -5.046 5.255 1.00 0.00 H new ATOM 0 HD2 PHE A 62 0.300 -5.024 1.188 1.00 0.00 H new ATOM 0 HE1 PHE A 62 2.714 -2.939 4.926 1.00 0.00 H new ATOM 0 HE2 PHE A 62 1.529 -2.924 0.830 1.00 0.00 H new ATOM 0 HZ PHE A 62 2.736 -1.873 2.705 1.00 0.00 H new ATOM 937 N GLU A 63 -2.018 -8.394 3.199 1.00 0.00 N ATOM 938 CA GLU A 63 -2.614 -9.674 2.987 1.00 0.00 C ATOM 939 C GLU A 63 -2.210 -10.095 1.623 1.00 0.00 C ATOM 940 O GLU A 63 -1.762 -9.258 0.839 1.00 0.00 O ATOM 941 CB GLU A 63 -4.135 -9.567 3.093 1.00 0.00 C ATOM 942 CG GLU A 63 -4.795 -10.892 3.403 1.00 0.00 C ATOM 943 CD GLU A 63 -4.306 -11.447 4.723 1.00 0.00 C ATOM 944 OE1 GLU A 63 -4.736 -10.940 5.776 1.00 0.00 O ATOM 945 OE2 GLU A 63 -3.438 -12.341 4.712 1.00 0.00 O ATOM 0 H GLU A 63 -1.954 -7.833 2.350 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.289 -10.400 3.733 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.391 -8.848 3.871 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -4.534 -9.178 2.156 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.877 -10.764 3.437 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.583 -11.603 2.605 1.00 0.00 H new ATOM 950 N LEU A 64 -2.428 -11.351 1.321 1.00 0.00 N ATOM 951 CA LEU A 64 -2.251 -11.834 -0.020 1.00 0.00 C ATOM 952 C LEU A 64 -2.994 -10.891 -0.979 1.00 0.00 C ATOM 953 O LEU A 64 -2.498 -10.576 -2.052 1.00 0.00 O ATOM 954 CB LEU A 64 -2.784 -13.248 -0.096 1.00 0.00 C ATOM 955 CG LEU A 64 -2.727 -13.895 -1.482 1.00 0.00 C ATOM 956 CD1 LEU A 64 -2.579 -15.403 -1.362 1.00 0.00 C ATOM 957 CD2 LEU A 64 -3.968 -13.564 -2.298 1.00 0.00 C ATOM 0 H LEU A 64 -2.730 -12.058 1.991 1.00 0.00 H new ATOM 0 HA LEU A 64 -1.199 -11.851 -0.304 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.220 -13.869 0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.820 -13.247 0.244 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.857 -13.490 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.540 -15.845 -2.358 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.660 -15.637 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.431 -15.810 -0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.897 -14.038 -3.277 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.853 -13.933 -1.780 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.044 -12.484 -2.423 1.00 0.00 H new ATOM 968 N GLY A 65 -4.037 -10.253 -0.427 1.00 0.00 N ATOM 969 CA GLY A 65 -4.682 -9.120 -1.073 1.00 0.00 C ATOM 970 C GLY A 65 -5.406 -8.257 -0.047 1.00 0.00 C ATOM 971 O GLY A 65 -6.507 -8.599 0.383 1.00 0.00 O ATOM 0 H GLY A 65 -4.447 -10.511 0.471 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.937 -8.522 -1.598 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.390 -9.476 -1.821 1.00 0.00 H new ATOM 975 N VAL A 66 -4.689 -7.284 0.515 1.00 0.00 N ATOM 976 CA VAL A 66 -5.181 -6.525 1.673 1.00 0.00 C ATOM 977 C VAL A 66 -5.723 -5.147 1.293 1.00 0.00 C ATOM 978 O VAL A 66 -5.183 -4.513 0.422 1.00 0.00 O ATOM 979 CB VAL A 66 -4.033 -6.295 2.664 1.00 0.00 C ATOM 980 CG1 VAL A 66 -3.219 -5.061 2.285 1.00 0.00 C ATOM 981 CG2 VAL A 66 -4.567 -6.217 4.083 1.00 0.00 C ATOM 0 H VAL A 66 -3.765 -7.000 0.190 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.988 -7.117 2.105 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.354 -7.146 2.616 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.412 -4.922 3.005 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.798 -5.195 1.289 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.865 -4.183 2.291 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.740 -6.054 4.774 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.274 -5.391 4.161 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.071 -7.150 4.334 1.00 0.00 H new ATOM 991 N ASP A 67 -6.633 -4.596 2.088 1.00 0.00 N ATOM 992 CA ASP A 67 -7.040 -3.208 1.879 1.00 0.00 C ATOM 993 C ASP A 67 -6.449 -2.246 2.896 1.00 0.00 C ATOM 994 O ASP A 67 -5.970 -2.623 3.966 1.00 0.00 O ATOM 995 CB ASP A 67 -8.562 -3.000 1.817 1.00 0.00 C ATOM 996 CG ASP A 67 -9.273 -3.200 3.151 1.00 0.00 C ATOM 997 OD1 ASP A 67 -9.033 -2.417 4.096 1.00 0.00 O ATOM 998 OD2 ASP A 67 -10.086 -4.143 3.260 1.00 0.00 O ATOM 0 H ASP A 67 -7.094 -5.072 2.864 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.629 -2.977 0.896 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.766 -1.992 1.457 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.983 -3.691 1.086 1.00 0.00 H new ATOM 1002 N PHE A 68 -6.543 -0.986 2.510 1.00 0.00 N ATOM 1003 CA PHE A 68 -6.122 0.165 3.272 1.00 0.00 C ATOM 1004 C PHE A 68 -7.200 1.195 3.125 1.00 0.00 C ATOM 1005 O PHE A 68 -7.705 1.376 2.030 1.00 0.00 O ATOM 1006 CB PHE A 68 -4.852 0.799 2.691 1.00 0.00 C ATOM 1007 CG PHE A 68 -3.562 0.090 3.006 1.00 0.00 C ATOM 1008 CD1 PHE A 68 -3.368 -1.238 2.669 1.00 0.00 C ATOM 1009 CD2 PHE A 68 -2.529 0.773 3.629 1.00 0.00 C ATOM 1010 CE1 PHE A 68 -2.175 -1.871 2.953 1.00 0.00 C ATOM 1011 CE2 PHE A 68 -1.333 0.145 3.913 1.00 0.00 C ATOM 1012 CZ PHE A 68 -1.155 -1.178 3.575 1.00 0.00 C ATOM 0 H PHE A 68 -6.938 -0.730 1.605 1.00 0.00 H new ATOM 0 HA PHE A 68 -5.935 -0.145 4.300 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.959 0.854 1.608 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.780 1.823 3.057 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -4.159 -1.785 2.178 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.662 1.811 3.896 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.039 -2.909 2.689 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.538 0.690 4.400 1.00 0.00 H new ATOM 0 HZ PHE A 68 -0.220 -1.672 3.796 1.00 0.00 H new ATOM 1021 N ALA A 69 -7.418 1.999 4.122 1.00 0.00 N ATOM 1022 CA ALA A 69 -8.196 3.182 3.891 1.00 0.00 C ATOM 1023 C ALA A 69 -8.120 4.139 5.071 1.00 0.00 C ATOM 1024 O ALA A 69 -8.882 4.048 6.033 1.00 0.00 O ATOM 1025 CB ALA A 69 -9.623 2.800 3.536 1.00 0.00 C ATOM 0 H ALA A 69 -7.081 1.866 5.076 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.777 3.722 3.042 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -10.209 3.703 3.362 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -9.622 2.188 2.634 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -10.063 2.235 4.357 1.00 0.00 H new ATOM 1031 N TYR A 70 -7.236 5.109 4.913 1.00 0.00 N ATOM 1032 CA TYR A 70 -7.021 6.188 5.840 1.00 0.00 C ATOM 1033 C TYR A 70 -6.147 7.180 5.142 1.00 0.00 C ATOM 1034 O TYR A 70 -5.505 6.839 4.171 1.00 0.00 O ATOM 1035 CB TYR A 70 -6.383 5.703 7.137 1.00 0.00 C ATOM 1036 CG TYR A 70 -5.282 4.670 6.992 1.00 0.00 C ATOM 1037 CD1 TYR A 70 -4.004 5.028 6.573 1.00 0.00 C ATOM 1038 CD2 TYR A 70 -5.510 3.341 7.325 1.00 0.00 C ATOM 1039 CE1 TYR A 70 -2.992 4.089 6.483 1.00 0.00 C ATOM 1040 CE2 TYR A 70 -4.502 2.400 7.246 1.00 0.00 C ATOM 1041 CZ TYR A 70 -3.247 2.777 6.824 1.00 0.00 C ATOM 1042 OH TYR A 70 -2.241 1.840 6.753 1.00 0.00 O ATOM 0 H TYR A 70 -6.626 5.161 4.097 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.971 6.638 6.130 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -5.976 6.566 7.663 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -7.166 5.284 7.769 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -3.799 6.056 6.314 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -6.494 3.038 7.652 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -2.008 4.382 6.148 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -4.698 1.372 7.514 1.00 0.00 H new ATOM 0 HH TYR A 70 -2.207 1.464 5.849 1.00 0.00 H new ATOM 1051 N SER A 71 -6.143 8.409 5.542 1.00 0.00 N ATOM 1052 CA SER A 71 -5.411 9.353 4.773 1.00 0.00 C ATOM 1053 C SER A 71 -4.092 9.582 5.433 1.00 0.00 C ATOM 1054 O SER A 71 -4.029 9.864 6.632 1.00 0.00 O ATOM 1055 CB SER A 71 -6.187 10.646 4.576 1.00 0.00 C ATOM 1056 OG SER A 71 -5.533 11.550 3.712 1.00 0.00 O ATOM 0 H SER A 71 -6.621 8.772 6.367 1.00 0.00 H new ATOM 0 HA SER A 71 -5.245 8.955 3.772 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.173 10.415 4.174 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.341 11.123 5.544 1.00 0.00 H new ATOM 0 HG SER A 71 -4.757 11.111 3.306 1.00 0.00 H new ATOM 1061 N LEU A 72 -3.071 9.163 4.708 1.00 0.00 N ATOM 1062 CA LEU A 72 -1.703 9.106 5.230 1.00 0.00 C ATOM 1063 C LEU A 72 -1.384 10.305 6.127 1.00 0.00 C ATOM 1064 O LEU A 72 -0.750 10.151 7.169 1.00 0.00 O ATOM 1065 CB LEU A 72 -0.684 9.028 4.089 1.00 0.00 C ATOM 1066 CG LEU A 72 -0.184 7.620 3.713 1.00 0.00 C ATOM 1067 CD1 LEU A 72 0.098 6.801 4.963 1.00 0.00 C ATOM 1068 CD2 LEU A 72 -1.162 6.891 2.796 1.00 0.00 C ATOM 0 H LEU A 72 -3.159 8.851 3.741 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.633 8.202 5.834 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.128 9.481 3.203 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.179 9.636 4.359 1.00 0.00 H new ATOM 0 HG LEU A 72 0.746 7.742 3.158 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.450 5.810 4.677 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.862 7.299 5.560 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.816 6.706 5.550 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.769 5.903 2.557 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.124 6.787 3.299 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.293 7.462 1.877 1.00 0.00 H new ATOM 1079 N ALA A 73 -1.921 11.471 5.779 1.00 0.00 N ATOM 1080 CA ALA A 73 -1.769 12.652 6.618 1.00 0.00 C ATOM 1081 C ALA A 73 -3.114 13.326 6.917 1.00 0.00 C ATOM 1082 O ALA A 73 -3.300 13.886 7.997 1.00 0.00 O ATOM 1083 CB ALA A 73 -0.816 13.644 5.968 1.00 0.00 C ATOM 0 H ALA A 73 -2.462 11.621 4.927 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.351 12.322 7.569 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.713 14.521 6.607 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.159 13.176 5.833 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -1.211 13.946 4.998 1.00 0.00 H new ATOM 1089 N ASP A 74 -3.994 13.386 5.920 1.00 0.00 N ATOM 1090 CA ASP A 74 -5.241 14.153 6.040 1.00 0.00 C ATOM 1091 C ASP A 74 -6.407 13.325 6.596 1.00 0.00 C ATOM 1092 O ASP A 74 -6.216 12.465 7.456 1.00 0.00 O ATOM 1093 CB ASP A 74 -5.622 14.748 4.682 1.00 0.00 C ATOM 1094 CG ASP A 74 -4.792 15.963 4.322 1.00 0.00 C ATOM 1095 OD1 ASP A 74 -3.548 15.867 4.335 1.00 0.00 O ATOM 1096 OD2 ASP A 74 -5.383 17.015 4.003 1.00 0.00 O ATOM 0 H ASP A 74 -3.872 12.917 5.023 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.052 14.950 6.759 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.500 13.988 3.910 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -6.676 15.024 4.694 1.00 0.00 H new ATOM 1100 N GLY A 75 -7.626 13.663 6.163 1.00 0.00 N ATOM 1101 CA GLY A 75 -8.830 13.031 6.691 1.00 0.00 C ATOM 1102 C GLY A 75 -9.285 11.834 5.875 1.00 0.00 C ATOM 1103 O GLY A 75 -10.235 11.933 5.105 1.00 0.00 O ATOM 0 H GLY A 75 -7.800 14.370 5.449 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -8.646 12.714 7.717 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -9.634 13.766 6.724 1.00 0.00 H new ATOM 1107 N THR A 76 -8.615 10.708 6.087 1.00 0.00 N ATOM 1108 CA THR A 76 -8.891 9.428 5.411 1.00 0.00 C ATOM 1109 C THR A 76 -9.019 9.529 3.889 1.00 0.00 C ATOM 1110 O THR A 76 -9.999 10.029 3.345 1.00 0.00 O ATOM 1111 CB THR A 76 -10.115 8.705 6.014 1.00 0.00 C ATOM 1112 OG1 THR A 76 -11.197 9.622 6.227 1.00 0.00 O ATOM 1113 CG2 THR A 76 -9.744 8.037 7.327 1.00 0.00 C ATOM 0 H THR A 76 -7.842 10.649 6.750 1.00 0.00 H new ATOM 0 HA THR A 76 -8.002 8.826 5.598 1.00 0.00 H new ATOM 0 HB THR A 76 -10.437 7.943 5.304 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.230 10.266 5.489 1.00 0.00 H new ATOM 0 HG21 THR A 76 -10.618 7.532 7.738 1.00 0.00 H new ATOM 0 HG22 THR A 76 -8.952 7.308 7.153 1.00 0.00 H new ATOM 0 HG23 THR A 76 -9.395 8.791 8.033 1.00 0.00 H new ATOM 1121 N GLU A 77 -8.045 8.910 3.219 1.00 0.00 N ATOM 1122 CA GLU A 77 -8.039 8.789 1.780 1.00 0.00 C ATOM 1123 C GLU A 77 -6.977 7.792 1.360 1.00 0.00 C ATOM 1124 O GLU A 77 -5.779 8.075 1.349 1.00 0.00 O ATOM 1125 CB GLU A 77 -7.874 10.164 1.164 1.00 0.00 C ATOM 1126 CG GLU A 77 -6.464 10.676 1.033 1.00 0.00 C ATOM 1127 CD GLU A 77 -6.398 12.038 0.375 1.00 0.00 C ATOM 1128 OE1 GLU A 77 -6.745 13.035 1.032 1.00 0.00 O ATOM 1129 OE2 GLU A 77 -6.013 12.107 -0.810 1.00 0.00 O ATOM 0 H GLU A 77 -7.239 8.480 3.672 1.00 0.00 H new ATOM 0 HA GLU A 77 -8.987 8.397 1.412 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.326 10.150 0.172 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.442 10.876 1.763 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -6.008 10.732 2.022 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -5.876 9.966 0.451 1.00 0.00 H new ATOM 1134 N LEU A 78 -7.422 6.570 1.133 1.00 0.00 N ATOM 1135 CA LEU A 78 -6.513 5.501 0.829 1.00 0.00 C ATOM 1136 C LEU A 78 -7.246 4.249 0.422 1.00 0.00 C ATOM 1137 O LEU A 78 -8.468 4.201 0.425 1.00 0.00 O ATOM 1138 CB LEU A 78 -5.564 5.267 1.997 1.00 0.00 C ATOM 1139 CG LEU A 78 -4.553 4.138 1.880 1.00 0.00 C ATOM 1140 CD1 LEU A 78 -3.648 4.338 0.672 1.00 0.00 C ATOM 1141 CD2 LEU A 78 -3.722 4.053 3.146 1.00 0.00 C ATOM 0 H LEU A 78 -8.406 6.302 1.155 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.910 5.792 -0.031 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -5.013 6.192 2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -6.167 5.084 2.886 1.00 0.00 H new ATOM 0 HG LEU A 78 -5.098 3.204 1.745 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.934 3.516 0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -4.252 4.361 -0.235 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.109 5.280 0.773 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -3.000 3.241 3.054 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.193 4.994 3.298 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.375 3.863 3.998 1.00 0.00 H new ATOM 1152 N THR A 79 -6.474 3.316 -0.067 1.00 0.00 N ATOM 1153 CA THR A 79 -6.975 2.146 -0.711 1.00 0.00 C ATOM 1154 C THR A 79 -6.269 0.975 -0.220 1.00 0.00 C ATOM 1155 O THR A 79 -5.051 1.019 -0.047 1.00 0.00 O ATOM 1156 CB THR A 79 -6.679 2.162 -2.209 1.00 0.00 C ATOM 1157 OG1 THR A 79 -5.472 1.436 -2.490 1.00 0.00 O ATOM 1158 CG2 THR A 79 -6.532 3.581 -2.688 1.00 0.00 C ATOM 0 H THR A 79 -5.456 3.356 -0.024 1.00 0.00 H new ATOM 0 HA THR A 79 -8.046 2.120 -0.512 1.00 0.00 H new ATOM 0 HB THR A 79 -7.509 1.686 -2.730 1.00 0.00 H new ATOM 0 HG1 THR A 79 -4.722 1.851 -2.014 1.00 0.00 H new ATOM 0 HG21 THR A 79 -6.321 3.584 -3.757 1.00 0.00 H new ATOM 0 HG22 THR A 79 -7.457 4.126 -2.499 1.00 0.00 H new ATOM 0 HG23 THR A 79 -5.712 4.062 -2.155 1.00 0.00 H new ATOM 1166 N GLY A 80 -6.902 -0.131 -0.376 1.00 0.00 N ATOM 1167 CA GLY A 80 -6.129 -1.254 -0.282 1.00 0.00 C ATOM 1168 C GLY A 80 -6.428 -2.375 -1.191 1.00 0.00 C ATOM 1169 O GLY A 80 -7.350 -3.148 -0.943 1.00 0.00 O ATOM 0 H GLY A 80 -7.898 -0.256 -0.558 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -5.092 -0.960 -0.443 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.200 -1.624 0.741 1.00 0.00 H new ATOM 1173 N THR A 81 -5.332 -2.734 -1.753 1.00 0.00 N ATOM 1174 CA THR A 81 -5.087 -4.082 -2.104 1.00 0.00 C ATOM 1175 C THR A 81 -3.651 -4.162 -2.412 1.00 0.00 C ATOM 1176 O THR A 81 -3.053 -3.194 -2.857 1.00 0.00 O ATOM 1177 CB THR A 81 -5.862 -4.694 -3.273 1.00 0.00 C ATOM 1178 OG1 THR A 81 -7.188 -4.180 -3.350 1.00 0.00 O ATOM 1179 CG2 THR A 81 -5.970 -6.187 -3.068 1.00 0.00 C ATOM 0 H THR A 81 -4.573 -2.093 -1.984 1.00 0.00 H new ATOM 0 HA THR A 81 -5.435 -4.667 -1.253 1.00 0.00 H new ATOM 0 HB THR A 81 -5.325 -4.448 -4.189 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.560 -4.099 -2.447 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.521 -6.629 -3.898 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.971 -6.621 -3.023 1.00 0.00 H new ATOM 0 HG23 THR A 81 -6.495 -6.389 -2.135 1.00 0.00 H new ATOM 1187 N TRP A 82 -3.095 -5.266 -2.099 1.00 0.00 N ATOM 1188 CA TRP A 82 -1.753 -5.557 -2.458 1.00 0.00 C ATOM 1189 C TRP A 82 -1.683 -7.038 -2.732 1.00 0.00 C ATOM 1190 O TRP A 82 -1.864 -7.830 -1.814 1.00 0.00 O ATOM 1191 CB TRP A 82 -0.782 -5.184 -1.337 1.00 0.00 C ATOM 1192 CG TRP A 82 -0.839 -3.739 -1.057 1.00 0.00 C ATOM 1193 CD1 TRP A 82 -1.746 -3.098 -0.285 1.00 0.00 C ATOM 1194 CD2 TRP A 82 -0.018 -2.750 -1.645 1.00 0.00 C ATOM 1195 NE1 TRP A 82 -1.573 -1.754 -0.389 1.00 0.00 N ATOM 1196 CE2 TRP A 82 -0.490 -1.504 -1.206 1.00 0.00 C ATOM 1197 CE3 TRP A 82 1.072 -2.807 -2.502 1.00 0.00 C ATOM 1198 CZ2 TRP A 82 0.097 -0.308 -1.619 1.00 0.00 C ATOM 1199 CZ3 TRP A 82 1.659 -1.635 -2.910 1.00 0.00 C ATOM 1200 CH2 TRP A 82 1.176 -0.398 -2.472 1.00 0.00 C ATOM 0 H TRP A 82 -3.561 -6.009 -1.578 1.00 0.00 H new ATOM 0 HA TRP A 82 -1.465 -4.976 -3.334 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -1.028 -5.744 -0.435 1.00 0.00 H new ATOM 0 HB3 TRP A 82 0.233 -5.465 -1.620 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -2.496 -3.582 0.323 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -2.150 -1.045 0.064 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.453 -3.759 -2.843 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -0.278 0.648 -1.285 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 2.506 -1.669 -3.579 1.00 0.00 H new ATOM 0 HH2 TRP A 82 1.659 0.507 -2.810 1.00 0.00 H new ATOM 1210 N THR A 83 -1.644 -7.413 -3.992 1.00 0.00 N ATOM 1211 CA THR A 83 -1.803 -8.814 -4.324 1.00 0.00 C ATOM 1212 C THR A 83 -0.667 -9.321 -5.191 1.00 0.00 C ATOM 1213 O THR A 83 -0.756 -9.328 -6.412 1.00 0.00 O ATOM 1214 CB THR A 83 -3.125 -9.041 -5.078 1.00 0.00 C ATOM 1215 OG1 THR A 83 -4.091 -8.052 -4.688 1.00 0.00 O ATOM 1216 CG2 THR A 83 -3.680 -10.429 -4.811 1.00 0.00 C ATOM 0 H THR A 83 -1.507 -6.787 -4.786 1.00 0.00 H new ATOM 0 HA THR A 83 -1.803 -9.363 -3.382 1.00 0.00 H new ATOM 0 HB THR A 83 -2.921 -8.952 -6.145 1.00 0.00 H new ATOM 0 HG1 THR A 83 -4.928 -8.203 -5.174 1.00 0.00 H new ATOM 0 HG21 THR A 83 -4.614 -10.559 -5.358 1.00 0.00 H new ATOM 0 HG22 THR A 83 -2.960 -11.178 -5.140 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.865 -10.548 -3.743 1.00 0.00 H new ATOM 1224 N MET A 84 0.285 -9.947 -4.558 1.00 0.00 N ATOM 1225 CA MET A 84 1.368 -10.599 -5.254 1.00 0.00 C ATOM 1226 C MET A 84 1.951 -11.688 -4.442 1.00 0.00 C ATOM 1227 O MET A 84 1.645 -11.866 -3.262 1.00 0.00 O ATOM 1228 CB MET A 84 2.518 -9.734 -5.684 1.00 0.00 C ATOM 1229 CG MET A 84 2.390 -9.264 -7.089 1.00 0.00 C ATOM 1230 SD MET A 84 1.446 -10.401 -8.163 1.00 0.00 S ATOM 1231 CE MET A 84 2.411 -11.907 -8.182 1.00 0.00 C ATOM 0 H MET A 84 0.336 -10.022 -3.542 1.00 0.00 H new ATOM 0 HA MET A 84 0.871 -10.952 -6.158 1.00 0.00 H new ATOM 0 HB2 MET A 84 2.586 -8.871 -5.022 1.00 0.00 H new ATOM 0 HB3 MET A 84 3.448 -10.293 -5.576 1.00 0.00 H new ATOM 0 HG2 MET A 84 1.905 -8.288 -7.093 1.00 0.00 H new ATOM 0 HG3 MET A 84 3.387 -9.126 -7.508 1.00 0.00 H new ATOM 0 HE1 MET A 84 1.758 -12.755 -8.386 1.00 0.00 H new ATOM 0 HE2 MET A 84 3.173 -11.841 -8.959 1.00 0.00 H new ATOM 0 HE3 MET A 84 2.892 -12.043 -7.213 1.00 0.00 H new ATOM 1239 N GLU A 85 2.963 -12.246 -5.030 1.00 0.00 N ATOM 1240 CA GLU A 85 3.799 -13.141 -4.324 1.00 0.00 C ATOM 1241 C GLU A 85 4.965 -12.328 -3.801 1.00 0.00 C ATOM 1242 O GLU A 85 5.035 -11.129 -4.060 1.00 0.00 O ATOM 1243 CB GLU A 85 4.279 -14.264 -5.242 1.00 0.00 C ATOM 1244 CG GLU A 85 3.149 -15.000 -5.943 1.00 0.00 C ATOM 1245 CD GLU A 85 2.199 -15.700 -4.989 1.00 0.00 C ATOM 1246 OE1 GLU A 85 2.563 -15.910 -3.812 1.00 0.00 O ATOM 1247 OE2 GLU A 85 1.084 -16.063 -5.424 1.00 0.00 O ATOM 0 H GLU A 85 3.224 -12.091 -6.004 1.00 0.00 H new ATOM 0 HA GLU A 85 3.263 -13.615 -3.502 1.00 0.00 H new ATOM 0 HB2 GLU A 85 4.951 -13.847 -5.992 1.00 0.00 H new ATOM 0 HB3 GLU A 85 4.859 -14.978 -4.657 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.585 -14.291 -6.549 1.00 0.00 H new ATOM 0 HG3 GLU A 85 3.574 -15.736 -6.626 1.00 0.00 H new ATOM 1252 N GLY A 86 5.760 -12.881 -2.923 1.00 0.00 N ATOM 1253 CA GLY A 86 6.693 -12.033 -2.230 1.00 0.00 C ATOM 1254 C GLY A 86 7.991 -11.972 -2.970 1.00 0.00 C ATOM 1255 O GLY A 86 8.758 -12.931 -3.010 1.00 0.00 O ATOM 0 H GLY A 86 5.783 -13.871 -2.678 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.277 -11.030 -2.129 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.859 -12.412 -1.222 1.00 0.00 H new ATOM 1259 N ASN A 87 8.104 -10.851 -3.674 1.00 0.00 N ATOM 1260 CA ASN A 87 9.156 -10.548 -4.638 1.00 0.00 C ATOM 1261 C ASN A 87 8.639 -9.463 -5.566 1.00 0.00 C ATOM 1262 O ASN A 87 9.377 -8.941 -6.395 1.00 0.00 O ATOM 1263 CB ASN A 87 9.569 -11.757 -5.497 1.00 0.00 C ATOM 1264 CG ASN A 87 10.825 -12.469 -5.013 1.00 0.00 C ATOM 1265 OD1 ASN A 87 11.483 -11.927 -3.997 1.00 0.00 O flip ATOM 1266 ND2 ASN A 87 11.203 -13.505 -5.563 1.00 0.00 N flip ATOM 0 H ASN A 87 7.430 -10.091 -3.583 1.00 0.00 H new ATOM 0 HA ASN A 87 10.036 -10.239 -4.074 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.746 -12.471 -5.518 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.727 -11.422 -6.522 1.00 0.00 H new ATOM 0 HD21 ASN A 87 10.671 -13.892 -6.342 1.00 0.00 H new ATOM 0 HD22 ASN A 87 12.048 -13.975 -5.239 1.00 0.00 H new ATOM 1272 N LYS A 88 7.327 -9.198 -5.498 1.00 0.00 N ATOM 1273 CA LYS A 88 6.707 -8.261 -6.390 1.00 0.00 C ATOM 1274 C LYS A 88 5.356 -7.901 -5.833 1.00 0.00 C ATOM 1275 O LYS A 88 4.903 -8.530 -4.887 1.00 0.00 O ATOM 1276 CB LYS A 88 6.570 -8.836 -7.808 1.00 0.00 C ATOM 1277 CG LYS A 88 5.315 -9.676 -8.065 1.00 0.00 C ATOM 1278 CD LYS A 88 5.183 -10.886 -7.141 1.00 0.00 C ATOM 1279 CE LYS A 88 6.491 -11.655 -6.956 1.00 0.00 C ATOM 1280 NZ LYS A 88 6.947 -12.337 -8.194 1.00 0.00 N ATOM 0 H LYS A 88 6.691 -9.629 -4.828 1.00 0.00 H new ATOM 0 HA LYS A 88 7.333 -7.372 -6.468 1.00 0.00 H new ATOM 0 HB2 LYS A 88 6.584 -8.009 -8.518 1.00 0.00 H new ATOM 0 HB3 LYS A 88 7.446 -9.451 -8.017 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.435 -9.043 -7.948 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.325 -10.020 -9.099 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.826 -10.552 -6.167 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.428 -11.561 -7.544 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.266 -10.966 -6.622 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.361 -12.396 -6.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.837 -12.840 -8.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 6.223 -13.017 -8.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.100 -11.632 -8.943 1.00 0.00 H new ATOM 1290 N LEU A 89 4.860 -6.757 -6.217 1.00 0.00 N ATOM 1291 CA LEU A 89 3.634 -6.265 -5.668 1.00 0.00 C ATOM 1292 C LEU A 89 2.643 -5.977 -6.776 1.00 0.00 C ATOM 1293 O LEU A 89 3.003 -5.322 -7.748 1.00 0.00 O ATOM 1294 CB LEU A 89 3.881 -4.950 -4.941 1.00 0.00 C ATOM 1295 CG LEU A 89 4.366 -4.999 -3.518 1.00 0.00 C ATOM 1296 CD1 LEU A 89 4.294 -3.595 -2.919 1.00 0.00 C ATOM 1297 CD2 LEU A 89 3.550 -5.993 -2.712 1.00 0.00 C ATOM 0 H LEU A 89 5.291 -6.148 -6.912 1.00 0.00 H new ATOM 0 HA LEU A 89 3.245 -7.022 -4.987 1.00 0.00 H new ATOM 0 HB2 LEU A 89 4.609 -4.382 -5.520 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.950 -4.383 -4.955 1.00 0.00 H new ATOM 0 HG LEU A 89 5.402 -5.337 -3.492 1.00 0.00 H new ATOM 0 HD11 LEU A 89 4.644 -3.621 -1.887 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.923 -2.920 -3.498 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.263 -3.241 -2.944 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.915 -6.015 -1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.502 -5.693 -2.718 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.646 -6.985 -3.153 1.00 0.00 H new ATOM 1308 N VAL A 90 1.371 -6.270 -6.565 1.00 0.00 N ATOM 1309 CA VAL A 90 0.381 -5.728 -7.474 1.00 0.00 C ATOM 1310 C VAL A 90 -1.022 -5.906 -6.914 1.00 0.00 C ATOM 1311 O VAL A 90 -1.568 -6.992 -6.844 1.00 0.00 O ATOM 1312 CB VAL A 90 0.504 -6.334 -8.889 1.00 0.00 C ATOM 1313 CG1 VAL A 90 0.142 -7.810 -8.917 1.00 0.00 C ATOM 1314 CG2 VAL A 90 -0.332 -5.534 -9.871 1.00 0.00 C ATOM 0 H VAL A 90 1.012 -6.853 -5.809 1.00 0.00 H new ATOM 0 HA VAL A 90 0.574 -4.659 -7.570 1.00 0.00 H new ATOM 0 HB VAL A 90 1.550 -6.272 -9.191 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.244 -8.190 -9.933 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.810 -8.361 -8.255 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.888 -7.939 -8.583 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.239 -5.969 -10.866 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.377 -5.556 -9.562 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.019 -4.502 -9.891 1.00 0.00 H new ATOM 1324 N GLY A 91 -1.545 -4.849 -6.393 1.00 0.00 N ATOM 1325 CA GLY A 91 -2.795 -4.920 -5.694 1.00 0.00 C ATOM 1326 C GLY A 91 -3.287 -3.563 -5.449 1.00 0.00 C ATOM 1327 O GLY A 91 -2.476 -2.651 -5.377 1.00 0.00 O ATOM 0 H GLY A 91 -1.129 -3.919 -6.435 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -3.522 -5.483 -6.280 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.668 -5.450 -4.750 1.00 0.00 H new ATOM 1331 N LYS A 92 -4.590 -3.375 -5.409 1.00 0.00 N ATOM 1332 CA LYS A 92 -5.071 -2.039 -5.316 1.00 0.00 C ATOM 1333 C LYS A 92 -6.524 -1.888 -4.938 1.00 0.00 C ATOM 1334 O LYS A 92 -7.385 -2.659 -5.365 1.00 0.00 O ATOM 1335 CB LYS A 92 -4.825 -1.416 -6.640 1.00 0.00 C ATOM 1336 CG LYS A 92 -5.584 -0.138 -6.864 1.00 0.00 C ATOM 1337 CD LYS A 92 -6.814 -0.359 -7.706 1.00 0.00 C ATOM 1338 CE LYS A 92 -6.449 -0.135 -9.130 1.00 0.00 C ATOM 1339 NZ LYS A 92 -5.697 -1.274 -9.724 1.00 0.00 N ATOM 0 H LYS A 92 -5.300 -4.107 -5.439 1.00 0.00 H new ATOM 0 HA LYS A 92 -4.539 -1.554 -4.497 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.758 -1.216 -6.744 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.093 -2.128 -7.421 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -5.873 0.287 -5.903 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -4.935 0.590 -7.352 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -7.194 -1.371 -7.566 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.608 0.324 -7.405 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -7.356 0.036 -9.709 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -5.847 0.770 -9.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -5.691 -1.183 -10.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -4.719 -1.267 -9.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -6.155 -2.169 -9.458 1.00 0.00 H new ATOM 1349 N PHE A 93 -6.789 -0.727 -4.370 1.00 0.00 N ATOM 1350 CA PHE A 93 -8.117 -0.279 -4.068 1.00 0.00 C ATOM 1351 C PHE A 93 -8.240 1.148 -4.384 1.00 0.00 C ATOM 1352 O PHE A 93 -7.306 1.774 -4.880 1.00 0.00 O ATOM 1353 CB PHE A 93 -8.518 -0.476 -2.635 1.00 0.00 C ATOM 1354 CG PHE A 93 -9.646 -1.439 -2.514 1.00 0.00 C ATOM 1355 CD1 PHE A 93 -9.641 -2.576 -3.284 1.00 0.00 C ATOM 1356 CD2 PHE A 93 -10.709 -1.203 -1.666 1.00 0.00 C ATOM 1357 CE1 PHE A 93 -10.677 -3.480 -3.215 1.00 0.00 C ATOM 1358 CE2 PHE A 93 -11.757 -2.098 -1.589 1.00 0.00 C ATOM 1359 CZ PHE A 93 -11.741 -3.241 -2.364 1.00 0.00 C ATOM 0 H PHE A 93 -6.064 -0.061 -4.103 1.00 0.00 H new ATOM 0 HA PHE A 93 -8.782 -0.890 -4.679 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -7.664 -0.840 -2.063 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -8.807 0.481 -2.202 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -8.814 -2.763 -3.952 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -10.721 -0.311 -1.058 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -10.659 -4.372 -3.823 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -12.587 -1.905 -0.925 1.00 0.00 H new ATOM 0 HZ PHE A 93 -12.557 -3.946 -2.306 1.00 0.00 H new ATOM 1368 N LYS A 94 -9.419 1.637 -4.165 1.00 0.00 N ATOM 1369 CA LYS A 94 -9.688 2.992 -4.358 1.00 0.00 C ATOM 1370 C LYS A 94 -9.660 3.718 -3.039 1.00 0.00 C ATOM 1371 O LYS A 94 -9.730 3.103 -1.977 1.00 0.00 O ATOM 1372 CB LYS A 94 -11.027 3.186 -4.978 1.00 0.00 C ATOM 1373 CG LYS A 94 -12.118 3.360 -3.952 1.00 0.00 C ATOM 1374 CD LYS A 94 -12.457 2.042 -3.246 1.00 0.00 C ATOM 1375 CE LYS A 94 -13.040 2.260 -1.853 1.00 0.00 C ATOM 1376 NZ LYS A 94 -11.987 2.405 -0.803 1.00 0.00 N ATOM 0 H LYS A 94 -10.216 1.087 -3.845 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.922 3.391 -5.023 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -11.000 4.061 -5.627 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.259 2.328 -5.609 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.806 4.098 -3.213 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -13.012 3.752 -4.436 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.170 1.482 -3.851 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.557 1.433 -3.168 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.665 3.153 -1.861 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -13.687 1.421 -1.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -12.101 1.655 -0.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -11.047 2.327 -1.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -12.079 3.334 -0.345 1.00 0.00 H new ATOM 1386 N ARG A 95 -9.324 4.974 -3.116 1.00 0.00 N ATOM 1387 CA ARG A 95 -9.078 5.748 -1.918 1.00 0.00 C ATOM 1388 C ARG A 95 -10.307 5.967 -1.058 1.00 0.00 C ATOM 1389 O ARG A 95 -11.413 5.533 -1.374 1.00 0.00 O ATOM 1390 CB ARG A 95 -8.511 7.107 -2.237 1.00 0.00 C ATOM 1391 CG ARG A 95 -9.534 8.162 -2.601 1.00 0.00 C ATOM 1392 CD ARG A 95 -8.988 9.544 -2.271 1.00 0.00 C ATOM 1393 NE ARG A 95 -7.726 9.878 -2.948 1.00 0.00 N ATOM 1394 CZ ARG A 95 -6.498 9.498 -2.554 1.00 0.00 C ATOM 1395 NH1 ARG A 95 -6.324 8.792 -1.445 1.00 0.00 N ATOM 1396 NH2 ARG A 95 -5.439 9.872 -3.257 1.00 0.00 N ATOM 0 H ARG A 95 -9.213 5.489 -3.990 1.00 0.00 H new ATOM 0 HA ARG A 95 -8.363 5.143 -1.360 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.942 7.457 -1.376 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.808 7.005 -3.064 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -9.773 8.099 -3.663 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -10.461 7.987 -2.055 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -9.737 10.290 -2.537 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -8.837 9.614 -1.194 1.00 0.00 H new ATOM 0 HE ARG A 95 -7.788 10.449 -3.791 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -7.129 8.529 -0.876 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -5.385 8.512 -1.161 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -5.558 10.445 -4.092 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.505 9.587 -2.963 1.00 0.00 H new ATOM 1407 N VAL A 96 -10.079 6.751 -0.012 1.00 0.00 N ATOM 1408 CA VAL A 96 -11.139 7.128 0.925 1.00 0.00 C ATOM 1409 C VAL A 96 -11.742 8.482 0.601 1.00 0.00 C ATOM 1410 O VAL A 96 -12.927 8.693 0.840 1.00 0.00 O ATOM 1411 CB VAL A 96 -10.644 7.198 2.380 1.00 0.00 C ATOM 1412 CG1 VAL A 96 -11.811 7.411 3.336 1.00 0.00 C ATOM 1413 CG2 VAL A 96 -9.886 5.948 2.762 1.00 0.00 C ATOM 0 H VAL A 96 -9.164 7.142 0.213 1.00 0.00 H new ATOM 0 HA VAL A 96 -11.887 6.343 0.819 1.00 0.00 H new ATOM 0 HB VAL A 96 -9.965 8.047 2.456 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -11.439 7.458 4.360 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -12.316 8.345 3.091 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -12.514 6.583 3.243 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.549 6.028 3.796 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -10.539 5.081 2.659 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -9.022 5.832 2.107 1.00 0.00 H new ATOM 1423 N ASP A 97 -10.902 9.438 0.187 1.00 0.00 N ATOM 1424 CA ASP A 97 -11.384 10.822 0.006 1.00 0.00 C ATOM 1425 C ASP A 97 -12.623 10.830 -0.866 1.00 0.00 C ATOM 1426 O ASP A 97 -13.646 11.407 -0.493 1.00 0.00 O ATOM 1427 CB ASP A 97 -10.292 11.746 -0.550 1.00 0.00 C ATOM 1428 CG ASP A 97 -10.837 12.914 -1.356 1.00 0.00 C ATOM 1429 OD1 ASP A 97 -11.222 12.707 -2.531 1.00 0.00 O ATOM 1430 OD2 ASP A 97 -10.866 14.046 -0.833 1.00 0.00 O ATOM 0 H ASP A 97 -9.915 9.292 -0.025 1.00 0.00 H new ATOM 0 HA ASP A 97 -11.649 11.219 0.986 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -9.698 12.132 0.278 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -9.620 11.163 -1.180 1.00 0.00 H new ATOM 1434 N ASN A 98 -12.614 9.966 -1.866 1.00 0.00 N ATOM 1435 CA ASN A 98 -13.839 9.646 -2.568 1.00 0.00 C ATOM 1436 C ASN A 98 -13.721 8.226 -3.069 1.00 0.00 C ATOM 1437 O ASN A 98 -14.042 7.279 -2.354 1.00 0.00 O ATOM 1438 CB ASN A 98 -14.093 10.623 -3.724 1.00 0.00 C ATOM 1439 CG ASN A 98 -15.487 10.496 -4.313 1.00 0.00 C ATOM 1440 OD1 ASN A 98 -15.858 9.459 -4.866 1.00 0.00 O ATOM 1441 ND2 ASN A 98 -16.272 11.555 -4.198 1.00 0.00 N ATOM 0 H ASN A 98 -11.783 9.481 -2.205 1.00 0.00 H new ATOM 0 HA ASN A 98 -14.691 9.739 -1.894 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -13.946 11.643 -3.369 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -13.356 10.449 -4.508 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -17.220 11.530 -4.574 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -15.929 12.396 -3.733 1.00 0.00 H new ATOM 1447 N GLY A 99 -13.035 8.080 -4.177 1.00 0.00 N ATOM 1448 CA GLY A 99 -12.655 6.774 -4.633 1.00 0.00 C ATOM 1449 C GLY A 99 -11.718 6.848 -5.781 1.00 0.00 C ATOM 1450 O GLY A 99 -12.131 7.010 -6.928 1.00 0.00 O ATOM 0 H GLY A 99 -12.732 8.849 -4.774 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.188 6.224 -3.816 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -13.545 6.216 -4.924 1.00 0.00 H new ATOM 1454 N LYS A 100 -10.470 6.583 -5.495 1.00 0.00 N ATOM 1455 CA LYS A 100 -9.509 6.440 -6.564 1.00 0.00 C ATOM 1456 C LYS A 100 -8.753 5.161 -6.405 1.00 0.00 C ATOM 1457 O LYS A 100 -7.914 5.032 -5.517 1.00 0.00 O ATOM 1458 CB LYS A 100 -8.531 7.579 -6.636 1.00 0.00 C ATOM 1459 CG LYS A 100 -9.168 8.945 -6.516 1.00 0.00 C ATOM 1460 CD LYS A 100 -8.181 9.917 -5.962 1.00 0.00 C ATOM 1461 CE LYS A 100 -8.720 11.339 -5.927 1.00 0.00 C ATOM 1462 NZ LYS A 100 -8.783 11.956 -7.280 1.00 0.00 N ATOM 0 H LYS A 100 -10.098 6.463 -4.553 1.00 0.00 H new ATOM 0 HA LYS A 100 -10.080 6.439 -7.492 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.794 7.462 -5.842 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -7.992 7.523 -7.582 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -9.514 9.282 -7.493 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -10.043 8.892 -5.868 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -7.903 9.612 -4.953 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -7.273 9.891 -6.564 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -9.717 11.336 -5.485 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -8.087 11.949 -5.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -9.188 12.911 -7.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -7.825 12.016 -7.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -9.381 11.373 -7.900 1.00 0.00 H new ATOM 1472 N GLU A 101 -9.101 4.203 -7.221 1.00 0.00 N ATOM 1473 CA GLU A 101 -8.521 2.903 -7.128 1.00 0.00 C ATOM 1474 C GLU A 101 -7.427 2.783 -8.175 1.00 0.00 C ATOM 1475 O GLU A 101 -7.706 2.693 -9.361 1.00 0.00 O ATOM 1476 CB GLU A 101 -9.582 1.802 -7.316 1.00 0.00 C ATOM 1477 CG GLU A 101 -10.146 1.700 -8.712 1.00 0.00 C ATOM 1478 CD GLU A 101 -11.205 0.629 -8.847 1.00 0.00 C ATOM 1479 OE1 GLU A 101 -12.168 0.632 -8.052 1.00 0.00 O ATOM 1480 OE2 GLU A 101 -11.081 -0.222 -9.754 1.00 0.00 O ATOM 0 H GLU A 101 -9.792 4.307 -7.964 1.00 0.00 H new ATOM 0 HA GLU A 101 -8.095 2.770 -6.133 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.141 0.842 -7.046 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.401 1.984 -6.620 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -10.572 2.662 -8.996 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.336 1.491 -9.411 1.00 0.00 H new ATOM 1485 N LEU A 102 -6.188 2.797 -7.717 1.00 0.00 N ATOM 1486 CA LEU A 102 -5.018 2.622 -8.563 1.00 0.00 C ATOM 1487 C LEU A 102 -3.784 2.481 -7.710 1.00 0.00 C ATOM 1488 O LEU A 102 -3.475 3.345 -6.932 1.00 0.00 O ATOM 1489 CB LEU A 102 -4.853 3.746 -9.570 1.00 0.00 C ATOM 1490 CG LEU A 102 -5.617 3.523 -10.861 1.00 0.00 C ATOM 1491 CD1 LEU A 102 -5.057 4.367 -11.982 1.00 0.00 C ATOM 1492 CD2 LEU A 102 -5.574 2.048 -11.233 1.00 0.00 C ATOM 0 H LEU A 102 -5.962 2.932 -6.732 1.00 0.00 H new ATOM 0 HA LEU A 102 -5.165 1.709 -9.140 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -5.186 4.680 -9.117 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -3.794 3.864 -9.800 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.653 3.825 -10.706 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.626 4.185 -12.894 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.129 5.421 -11.714 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.012 4.105 -12.148 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.124 1.891 -12.161 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -4.538 1.737 -11.368 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.029 1.459 -10.437 1.00 0.00 H new ATOM 1503 N ILE A 103 -3.139 1.359 -7.809 1.00 0.00 N ATOM 1504 CA ILE A 103 -1.906 1.105 -7.089 1.00 0.00 C ATOM 1505 C ILE A 103 -1.359 -0.238 -7.559 1.00 0.00 C ATOM 1506 O ILE A 103 -2.079 -1.223 -7.470 1.00 0.00 O ATOM 1507 CB ILE A 103 -2.129 1.085 -5.536 1.00 0.00 C ATOM 1508 CG1 ILE A 103 -1.772 2.440 -4.904 1.00 0.00 C ATOM 1509 CG2 ILE A 103 -1.283 0.006 -4.873 1.00 0.00 C ATOM 1510 CD1 ILE A 103 -2.492 2.691 -3.603 1.00 0.00 C ATOM 0 H ILE A 103 -3.447 0.582 -8.393 1.00 0.00 H new ATOM 0 HA ILE A 103 -1.198 1.908 -7.296 1.00 0.00 H new ATOM 0 HB ILE A 103 -3.186 0.874 -5.373 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.697 2.482 -4.732 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -2.014 3.237 -5.607 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.458 0.016 -3.797 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.556 -0.969 -5.276 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -0.228 0.198 -5.070 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -2.198 3.663 -3.206 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -3.568 2.679 -3.775 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -2.230 1.913 -2.886 1.00 0.00 H new ATOM 1521 N ALA A 104 -0.159 -0.319 -8.126 1.00 0.00 N ATOM 1522 CA ALA A 104 0.328 -1.640 -8.521 1.00 0.00 C ATOM 1523 C ALA A 104 1.773 -1.678 -8.960 1.00 0.00 C ATOM 1524 O ALA A 104 2.079 -1.433 -10.126 1.00 0.00 O ATOM 1525 CB ALA A 104 -0.554 -2.194 -9.602 1.00 0.00 C ATOM 0 H ALA A 104 0.466 0.465 -8.315 1.00 0.00 H new ATOM 0 HA ALA A 104 0.284 -2.257 -7.624 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -0.192 -3.179 -9.898 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -1.575 -2.279 -9.230 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -0.536 -1.527 -10.464 1.00 0.00 H new ATOM 1531 N VAL A 105 2.636 -2.137 -8.076 1.00 0.00 N ATOM 1532 CA VAL A 105 4.006 -2.414 -8.434 1.00 0.00 C ATOM 1533 C VAL A 105 4.671 -3.043 -7.240 1.00 0.00 C ATOM 1534 O VAL A 105 4.381 -2.604 -6.124 1.00 0.00 O ATOM 1535 CB VAL A 105 4.738 -1.116 -8.791 1.00 0.00 C ATOM 1536 CG1 VAL A 105 4.946 -0.332 -7.528 1.00 0.00 C ATOM 1537 CG2 VAL A 105 6.047 -1.385 -9.512 1.00 0.00 C ATOM 0 H VAL A 105 2.408 -2.326 -7.100 1.00 0.00 H new ATOM 0 HA VAL A 105 4.038 -3.078 -9.298 1.00 0.00 H new ATOM 0 HB VAL A 105 4.132 -0.534 -9.486 1.00 0.00 H new ATOM 0 HG11 VAL A 105 5.466 0.598 -7.758 1.00 0.00 H new ATOM 0 HG12 VAL A 105 3.980 -0.105 -7.077 1.00 0.00 H new ATOM 0 HG13 VAL A 105 5.543 -0.919 -6.830 1.00 0.00 H new ATOM 0 HG21 VAL A 105 6.534 -0.439 -9.747 1.00 0.00 H new ATOM 0 HG22 VAL A 105 6.699 -1.980 -8.872 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.849 -1.930 -10.435 1.00 0.00 H new ATOM 1547 N ARG A 106 5.771 -3.750 -7.421 1.00 0.00 N ATOM 1548 CA ARG A 106 6.590 -3.872 -6.264 1.00 0.00 C ATOM 1549 C ARG A 106 7.717 -2.930 -6.402 1.00 0.00 C ATOM 1550 O ARG A 106 8.256 -2.687 -7.481 1.00 0.00 O ATOM 1551 CB ARG A 106 7.170 -5.242 -5.894 1.00 0.00 C ATOM 1552 CG ARG A 106 7.854 -5.233 -4.533 1.00 0.00 C ATOM 1553 CD ARG A 106 7.362 -6.378 -3.678 1.00 0.00 C ATOM 1554 NE ARG A 106 7.665 -6.219 -2.224 1.00 0.00 N ATOM 1555 CZ ARG A 106 7.372 -5.124 -1.472 1.00 0.00 C ATOM 1556 NH1 ARG A 106 6.926 -4.032 -2.030 1.00 0.00 N ATOM 1557 NH2 ARG A 106 7.536 -5.105 -0.150 1.00 0.00 N ATOM 0 H ARG A 106 6.086 -4.205 -8.278 1.00 0.00 H new ATOM 0 HA ARG A 106 5.896 -3.665 -5.449 1.00 0.00 H new ATOM 0 HB2 ARG A 106 6.371 -5.983 -5.891 1.00 0.00 H new ATOM 0 HB3 ARG A 106 7.887 -5.548 -6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 106 8.934 -5.308 -4.663 1.00 0.00 H new ATOM 0 HG3 ARG A 106 7.659 -4.287 -4.029 1.00 0.00 H new ATOM 0 HD2 ARG A 106 6.284 -6.478 -3.806 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.812 -7.305 -4.034 1.00 0.00 H new ATOM 0 HE ARG A 106 8.131 -6.997 -1.756 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.794 -3.993 -3.041 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.710 -3.217 -1.456 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.892 -5.931 0.332 1.00 0.00 H new ATOM 0 HH22 ARG A 106 7.305 -4.265 0.381 1.00 0.00 H new ATOM 1568 N GLU A 107 8.193 -2.637 -5.273 1.00 0.00 N ATOM 1569 CA GLU A 107 9.378 -1.925 -5.123 1.00 0.00 C ATOM 1570 C GLU A 107 10.490 -2.933 -4.964 1.00 0.00 C ATOM 1571 O GLU A 107 10.624 -3.519 -3.907 1.00 0.00 O ATOM 1572 CB GLU A 107 9.230 -1.104 -3.844 1.00 0.00 C ATOM 1573 CG GLU A 107 7.971 -1.459 -3.088 1.00 0.00 C ATOM 1574 CD GLU A 107 8.016 -1.116 -1.608 1.00 0.00 C ATOM 1575 OE1 GLU A 107 8.783 -0.216 -1.224 1.00 0.00 O ATOM 1576 OE2 GLU A 107 7.272 -1.761 -0.831 1.00 0.00 O ATOM 0 H GLU A 107 7.751 -2.897 -4.391 1.00 0.00 H new ATOM 0 HA GLU A 107 9.593 -1.274 -5.970 1.00 0.00 H new ATOM 0 HB2 GLU A 107 10.097 -1.270 -3.204 1.00 0.00 H new ATOM 0 HB3 GLU A 107 9.217 -0.043 -4.093 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.128 -0.940 -3.544 1.00 0.00 H new ATOM 0 HG3 GLU A 107 7.784 -2.527 -3.196 1.00 0.00 H new ATOM 1581 N ILE A 108 11.207 -3.180 -6.064 1.00 0.00 N ATOM 1582 CA ILE A 108 12.322 -4.117 -6.122 1.00 0.00 C ATOM 1583 C ILE A 108 13.038 -3.940 -7.463 1.00 0.00 C ATOM 1584 O ILE A 108 12.393 -4.041 -8.507 1.00 0.00 O ATOM 1585 CB ILE A 108 11.900 -5.617 -6.035 1.00 0.00 C ATOM 1586 CG1 ILE A 108 11.195 -5.959 -4.719 1.00 0.00 C ATOM 1587 CG2 ILE A 108 13.118 -6.489 -6.222 1.00 0.00 C ATOM 1588 CD1 ILE A 108 11.104 -7.436 -4.409 1.00 0.00 C ATOM 0 H ILE A 108 11.021 -2.722 -6.956 1.00 0.00 H new ATOM 0 HA ILE A 108 12.949 -3.893 -5.259 1.00 0.00 H new ATOM 0 HB ILE A 108 11.178 -5.804 -6.830 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.721 -5.463 -3.903 1.00 0.00 H new ATOM 0 HG13 ILE A 108 10.187 -5.546 -4.746 1.00 0.00 H new ATOM 0 HG21 ILE A 108 12.827 -7.538 -6.162 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.561 -6.291 -7.198 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.846 -6.269 -5.441 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.589 -7.577 -3.459 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.550 -7.940 -5.200 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.107 -7.857 -4.344 1.00 0.00 H new ATOM 1599 N SER A 109 14.363 -3.817 -7.447 1.00 0.00 N ATOM 1600 CA SER A 109 15.157 -3.810 -8.686 1.00 0.00 C ATOM 1601 C SER A 109 16.618 -3.987 -8.322 1.00 0.00 C ATOM 1602 O SER A 109 17.196 -3.093 -7.714 1.00 0.00 O ATOM 1603 CB SER A 109 14.975 -2.499 -9.467 1.00 0.00 C ATOM 1604 OG SER A 109 13.642 -2.339 -9.923 1.00 0.00 O ATOM 0 H SER A 109 14.914 -3.721 -6.594 1.00 0.00 H new ATOM 0 HA SER A 109 14.817 -4.625 -9.325 1.00 0.00 H new ATOM 0 HB2 SER A 109 15.245 -1.656 -8.831 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.655 -2.486 -10.319 1.00 0.00 H new ATOM 0 HG SER A 109 13.129 -3.151 -9.726 1.00 0.00 H new ATOM 1609 N GLY A 110 17.153 -5.193 -8.526 1.00 0.00 N ATOM 1610 CA GLY A 110 18.450 -5.521 -7.953 1.00 0.00 C ATOM 1611 C GLY A 110 18.348 -5.423 -6.449 1.00 0.00 C ATOM 1612 O GLY A 110 17.590 -6.184 -5.840 1.00 0.00 O ATOM 0 H GLY A 110 16.718 -5.938 -9.070 1.00 0.00 H new ATOM 0 HA2 GLY A 110 18.751 -6.526 -8.248 1.00 0.00 H new ATOM 0 HA3 GLY A 110 19.213 -4.838 -8.326 1.00 0.00 H new ATOM 1616 N ASN A 111 18.709 -4.252 -5.955 1.00 0.00 N ATOM 1617 CA ASN A 111 18.195 -3.824 -4.674 1.00 0.00 C ATOM 1618 C ASN A 111 18.038 -2.307 -4.664 1.00 0.00 C ATOM 1619 O ASN A 111 18.965 -1.541 -4.392 1.00 0.00 O ATOM 1620 CB ASN A 111 19.074 -4.307 -3.507 1.00 0.00 C ATOM 1621 CG ASN A 111 20.537 -3.926 -3.657 1.00 0.00 C ATOM 1622 OD1 ASN A 111 21.233 -4.414 -4.545 1.00 0.00 O ATOM 1623 ND2 ASN A 111 21.019 -3.065 -2.779 1.00 0.00 N ATOM 0 H ASN A 111 19.342 -3.596 -6.412 1.00 0.00 H new ATOM 0 HA ASN A 111 17.216 -4.281 -4.530 1.00 0.00 H new ATOM 0 HB2 ASN A 111 18.691 -3.889 -2.576 1.00 0.00 H new ATOM 0 HB3 ASN A 111 18.995 -5.391 -3.426 1.00 0.00 H new ATOM 0 HD21 ASN A 111 21.999 -2.785 -2.825 1.00 0.00 H new ATOM 0 HD22 ASN A 111 20.412 -2.680 -2.055 1.00 0.00 H new ATOM 1629 N GLU A 112 16.809 -1.920 -4.924 1.00 0.00 N ATOM 1630 CA GLU A 112 16.336 -0.551 -4.897 1.00 0.00 C ATOM 1631 C GLU A 112 14.838 -0.671 -5.045 1.00 0.00 C ATOM 1632 O GLU A 112 14.384 -1.692 -5.561 1.00 0.00 O ATOM 1633 CB GLU A 112 16.945 0.287 -6.023 1.00 0.00 C ATOM 1634 CG GLU A 112 16.447 -0.088 -7.405 1.00 0.00 C ATOM 1635 CD GLU A 112 17.360 0.409 -8.505 1.00 0.00 C ATOM 1636 OE1 GLU A 112 18.405 1.014 -8.188 1.00 0.00 O ATOM 1637 OE2 GLU A 112 17.050 0.173 -9.689 1.00 0.00 O ATOM 0 H GLU A 112 16.075 -2.583 -5.172 1.00 0.00 H new ATOM 0 HA GLU A 112 16.624 -0.038 -3.979 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.724 1.339 -5.841 1.00 0.00 H new ATOM 0 HB3 GLU A 112 18.029 0.180 -5.997 1.00 0.00 H new ATOM 0 HG2 GLU A 112 16.358 -1.172 -7.474 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.449 0.324 -7.552 1.00 0.00 H new ATOM 1642 N LEU A 113 14.050 0.185 -4.438 1.00 0.00 N ATOM 1643 CA LEU A 113 12.642 -0.097 -4.424 1.00 0.00 C ATOM 1644 C LEU A 113 11.848 0.971 -5.120 1.00 0.00 C ATOM 1645 O LEU A 113 12.289 2.098 -5.244 1.00 0.00 O ATOM 1646 CB LEU A 113 12.172 -0.330 -3.009 1.00 0.00 C ATOM 1647 CG LEU A 113 12.179 -1.804 -2.620 1.00 0.00 C ATOM 1648 CD1 LEU A 113 13.580 -2.371 -2.517 1.00 0.00 C ATOM 1649 CD2 LEU A 113 11.355 -2.056 -1.373 1.00 0.00 C ATOM 0 H LEU A 113 14.344 1.042 -3.969 1.00 0.00 H new ATOM 0 HA LEU A 113 12.471 -1.013 -4.989 1.00 0.00 H new ATOM 0 HB2 LEU A 113 12.811 0.225 -2.323 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.163 0.066 -2.896 1.00 0.00 H new ATOM 0 HG LEU A 113 11.698 -2.349 -3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 113 13.527 -3.423 -2.237 1.00 0.00 H new ATOM 0 HD12 LEU A 113 14.083 -2.276 -3.480 1.00 0.00 H new ATOM 0 HD13 LEU A 113 14.140 -1.822 -1.760 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.383 -3.117 -1.126 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.765 -1.480 -0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 113 10.323 -1.752 -1.551 1.00 0.00 H new ATOM 1660 N ILE A 114 10.695 0.572 -5.614 1.00 0.00 N ATOM 1661 CA ILE A 114 9.839 1.410 -6.411 1.00 0.00 C ATOM 1662 C ILE A 114 8.437 1.175 -6.013 1.00 0.00 C ATOM 1663 O ILE A 114 7.808 0.189 -6.378 1.00 0.00 O ATOM 1664 CB ILE A 114 9.928 1.077 -7.892 1.00 0.00 C ATOM 1665 CG1 ILE A 114 11.377 0.891 -8.284 1.00 0.00 C ATOM 1666 CG2 ILE A 114 9.266 2.159 -8.738 1.00 0.00 C ATOM 1667 CD1 ILE A 114 12.226 2.145 -8.129 1.00 0.00 C ATOM 0 H ILE A 114 10.323 -0.366 -5.466 1.00 0.00 H new ATOM 0 HA ILE A 114 10.157 2.440 -6.250 1.00 0.00 H new ATOM 0 HB ILE A 114 9.391 0.147 -8.077 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.808 0.095 -7.676 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.422 0.560 -9.321 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.344 1.895 -9.793 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.215 2.244 -8.462 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.765 3.113 -8.565 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.251 1.930 -8.430 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.822 2.938 -8.758 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.213 2.466 -7.088 1.00 0.00 H new ATOM 1678 N GLN A 115 7.954 2.098 -5.301 1.00 0.00 N ATOM 1679 CA GLN A 115 6.633 2.024 -4.823 1.00 0.00 C ATOM 1680 C GLN A 115 5.809 2.978 -5.655 1.00 0.00 C ATOM 1681 O GLN A 115 5.931 4.192 -5.539 1.00 0.00 O ATOM 1682 CB GLN A 115 6.659 2.392 -3.352 1.00 0.00 C ATOM 1683 CG GLN A 115 8.031 2.159 -2.702 1.00 0.00 C ATOM 1684 CD GLN A 115 8.094 2.796 -1.326 1.00 0.00 C ATOM 1685 OE1 GLN A 115 8.842 3.866 -1.206 1.00 0.00 O flip ATOM 1686 NE2 GLN A 115 7.433 2.358 -0.390 1.00 0.00 N flip ATOM 0 H GLN A 115 8.462 2.939 -5.026 1.00 0.00 H new ATOM 0 HA GLN A 115 6.193 1.030 -4.908 1.00 0.00 H new ATOM 0 HB2 GLN A 115 6.383 3.440 -3.240 1.00 0.00 H new ATOM 0 HB3 GLN A 115 5.908 1.806 -2.823 1.00 0.00 H new ATOM 0 HG2 GLN A 115 8.222 1.089 -2.621 1.00 0.00 H new ATOM 0 HG3 GLN A 115 8.814 2.576 -3.336 1.00 0.00 H new ATOM 0 HE21 GLN A 115 6.861 1.523 -0.516 1.00 0.00 H new ATOM 0 HE22 GLN A 115 7.455 2.829 0.515 1.00 0.00 H new ATOM 1693 N THR A 116 5.109 2.405 -6.602 1.00 0.00 N ATOM 1694 CA THR A 116 4.394 3.146 -7.605 1.00 0.00 C ATOM 1695 C THR A 116 2.938 3.183 -7.222 1.00 0.00 C ATOM 1696 O THR A 116 2.241 2.170 -7.282 1.00 0.00 O ATOM 1697 CB THR A 116 4.532 2.464 -8.981 1.00 0.00 C ATOM 1698 OG1 THR A 116 5.909 2.172 -9.238 1.00 0.00 O ATOM 1699 CG2 THR A 116 3.982 3.342 -10.085 1.00 0.00 C ATOM 0 H THR A 116 5.020 1.393 -6.697 1.00 0.00 H new ATOM 0 HA THR A 116 4.804 4.154 -7.669 1.00 0.00 H new ATOM 0 HB THR A 116 3.956 1.539 -8.962 1.00 0.00 H new ATOM 0 HG1 THR A 116 5.994 1.737 -10.112 1.00 0.00 H new ATOM 0 HG21 THR A 116 4.093 2.834 -11.043 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.926 3.541 -9.900 1.00 0.00 H new ATOM 0 HG23 THR A 116 4.530 4.284 -10.108 1.00 0.00 H new ATOM 1707 N TYR A 117 2.509 4.319 -6.741 1.00 0.00 N ATOM 1708 CA TYR A 117 1.162 4.449 -6.276 1.00 0.00 C ATOM 1709 C TYR A 117 0.377 5.228 -7.305 1.00 0.00 C ATOM 1710 O TYR A 117 0.949 6.021 -8.042 1.00 0.00 O ATOM 1711 CB TYR A 117 1.084 5.180 -4.936 1.00 0.00 C ATOM 1712 CG TYR A 117 2.193 4.874 -3.922 1.00 0.00 C ATOM 1713 CD1 TYR A 117 3.518 5.319 -4.094 1.00 0.00 C ATOM 1714 CD2 TYR A 117 1.899 4.184 -2.749 1.00 0.00 C ATOM 1715 CE1 TYR A 117 4.487 5.071 -3.137 1.00 0.00 C ATOM 1716 CE2 TYR A 117 2.871 3.945 -1.790 1.00 0.00 C ATOM 1717 CZ TYR A 117 4.160 4.389 -1.991 1.00 0.00 C ATOM 1718 OH TYR A 117 5.123 4.163 -1.031 1.00 0.00 O ATOM 0 H TYR A 117 3.075 5.164 -6.663 1.00 0.00 H new ATOM 0 HA TYR A 117 0.752 3.449 -6.133 1.00 0.00 H new ATOM 0 HB2 TYR A 117 1.088 6.252 -5.132 1.00 0.00 H new ATOM 0 HB3 TYR A 117 0.125 4.944 -4.474 1.00 0.00 H new ATOM 0 HD1 TYR A 117 3.783 5.863 -4.988 1.00 0.00 H new ATOM 0 HD2 TYR A 117 0.893 3.828 -2.583 1.00 0.00 H new ATOM 0 HE1 TYR A 117 5.499 5.414 -3.292 1.00 0.00 H new ATOM 0 HE2 TYR A 117 2.618 3.411 -0.886 1.00 0.00 H new ATOM 0 HH TYR A 117 4.729 3.668 -0.282 1.00 0.00 H new ATOM 1727 N THR A 118 -0.897 4.947 -7.398 1.00 0.00 N ATOM 1728 CA THR A 118 -1.727 5.473 -8.459 1.00 0.00 C ATOM 1729 C THR A 118 -3.083 5.908 -7.873 1.00 0.00 C ATOM 1730 O THR A 118 -3.282 5.747 -6.668 1.00 0.00 O ATOM 1731 CB THR A 118 -1.853 4.370 -9.539 1.00 0.00 C ATOM 1732 OG1 THR A 118 -0.624 3.627 -9.597 1.00 0.00 O ATOM 1733 CG2 THR A 118 -2.089 5.015 -10.895 1.00 0.00 C ATOM 0 H THR A 118 -1.393 4.346 -6.740 1.00 0.00 H new ATOM 0 HA THR A 118 -1.294 6.358 -8.924 1.00 0.00 H new ATOM 0 HB THR A 118 -2.684 3.711 -9.289 1.00 0.00 H new ATOM 0 HG1 THR A 118 -0.697 2.926 -10.278 1.00 0.00 H new ATOM 0 HG21 THR A 118 -2.178 4.240 -11.656 1.00 0.00 H new ATOM 0 HG22 THR A 118 -3.008 5.601 -10.864 1.00 0.00 H new ATOM 0 HG23 THR A 118 -1.251 5.668 -11.138 1.00 0.00 H new ATOM 1741 N TYR A 119 -3.935 6.639 -8.612 1.00 0.00 N ATOM 1742 CA TYR A 119 -5.244 7.019 -8.061 1.00 0.00 C ATOM 1743 C TYR A 119 -6.086 7.644 -9.148 1.00 0.00 C ATOM 1744 O TYR A 119 -5.802 8.759 -9.579 1.00 0.00 O ATOM 1745 CB TYR A 119 -5.093 7.953 -6.851 1.00 0.00 C ATOM 1746 CG TYR A 119 -4.320 9.221 -7.126 1.00 0.00 C ATOM 1747 CD1 TYR A 119 -2.929 9.228 -7.130 1.00 0.00 C ATOM 1748 CD2 TYR A 119 -4.984 10.411 -7.384 1.00 0.00 C ATOM 1749 CE1 TYR A 119 -2.230 10.389 -7.388 1.00 0.00 C ATOM 1750 CE2 TYR A 119 -4.292 11.572 -7.641 1.00 0.00 C ATOM 1751 CZ TYR A 119 -2.919 11.559 -7.644 1.00 0.00 C ATOM 1752 OH TYR A 119 -2.230 12.720 -7.897 1.00 0.00 O ATOM 0 H TYR A 119 -3.750 6.968 -9.559 1.00 0.00 H new ATOM 0 HA TYR A 119 -5.750 6.123 -7.701 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -6.086 8.220 -6.489 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -4.597 7.408 -6.048 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -2.390 8.314 -6.929 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -6.064 10.427 -7.383 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -1.150 10.383 -7.390 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -4.826 12.489 -7.839 1.00 0.00 H new ATOM 0 HH TYR A 119 -1.973 13.139 -7.049 1.00 0.00 H new ATOM 1761 N GLU A 120 -7.021 6.858 -9.679 1.00 0.00 N ATOM 1762 CA GLU A 120 -7.773 7.223 -10.882 1.00 0.00 C ATOM 1763 C GLU A 120 -6.823 7.253 -12.074 1.00 0.00 C ATOM 1764 O GLU A 120 -6.869 6.363 -12.917 1.00 0.00 O ATOM 1765 CB GLU A 120 -8.497 8.555 -10.710 1.00 0.00 C ATOM 1766 CG GLU A 120 -9.477 8.537 -9.556 1.00 0.00 C ATOM 1767 CD GLU A 120 -10.400 9.738 -9.548 1.00 0.00 C ATOM 1768 OE1 GLU A 120 -9.910 10.865 -9.380 1.00 0.00 O ATOM 1769 OE2 GLU A 120 -11.627 9.557 -9.712 1.00 0.00 O ATOM 0 H GLU A 120 -7.280 5.951 -9.290 1.00 0.00 H new ATOM 0 HA GLU A 120 -8.544 6.473 -11.059 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -7.764 9.345 -10.548 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -9.029 8.798 -11.630 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -10.074 7.627 -9.607 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -8.924 8.503 -8.617 1.00 0.00 H new ATOM 1774 N GLY A 121 -5.790 8.077 -11.963 1.00 0.00 N ATOM 1775 CA GLY A 121 -4.618 7.871 -12.755 1.00 0.00 C ATOM 1776 C GLY A 121 -3.519 8.848 -12.411 1.00 0.00 C ATOM 1777 O GLY A 121 -3.375 9.859 -13.097 1.00 0.00 O ATOM 0 H GLY A 121 -5.753 8.881 -11.336 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -4.256 6.853 -12.608 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -4.873 7.970 -13.810 1.00 0.00 H new ATOM 1781 N VAL A 122 -2.589 8.398 -11.578 1.00 0.00 N ATOM 1782 CA VAL A 122 -1.322 9.079 -11.364 1.00 0.00 C ATOM 1783 C VAL A 122 -0.420 8.119 -10.663 1.00 0.00 C ATOM 1784 O VAL A 122 -0.533 7.943 -9.445 1.00 0.00 O ATOM 1785 CB VAL A 122 -1.351 10.360 -10.473 1.00 0.00 C ATOM 1786 CG1 VAL A 122 0.063 10.889 -10.296 1.00 0.00 C ATOM 1787 CG2 VAL A 122 -2.226 11.470 -11.010 1.00 0.00 C ATOM 0 H VAL A 122 -2.695 7.545 -11.029 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.005 9.402 -12.356 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.786 10.053 -9.522 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.042 11.784 -9.674 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.679 10.128 -9.817 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.484 11.135 -11.271 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.190 12.322 -10.332 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.866 11.773 -11.993 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -3.253 11.116 -11.093 1.00 0.00 H new ATOM 1797 N GLU A 123 0.558 7.615 -11.363 1.00 0.00 N ATOM 1798 CA GLU A 123 1.541 6.830 -10.695 1.00 0.00 C ATOM 1799 C GLU A 123 2.787 7.659 -10.510 1.00 0.00 C ATOM 1800 O GLU A 123 3.090 8.549 -11.305 1.00 0.00 O ATOM 1801 CB GLU A 123 1.861 5.522 -11.399 1.00 0.00 C ATOM 1802 CG GLU A 123 2.764 5.657 -12.604 1.00 0.00 C ATOM 1803 CD GLU A 123 2.058 6.250 -13.809 1.00 0.00 C ATOM 1804 OE1 GLU A 123 0.984 5.741 -14.187 1.00 0.00 O ATOM 1805 OE2 GLU A 123 2.580 7.226 -14.386 1.00 0.00 O ATOM 0 H GLU A 123 0.689 7.732 -12.368 1.00 0.00 H new ATOM 0 HA GLU A 123 1.127 6.543 -9.728 1.00 0.00 H new ATOM 0 HB2 GLU A 123 2.330 4.846 -10.684 1.00 0.00 H new ATOM 0 HB3 GLU A 123 0.927 5.056 -11.713 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.617 6.284 -12.344 1.00 0.00 H new ATOM 0 HG3 GLU A 123 3.159 4.676 -12.867 1.00 0.00 H new ATOM 1810 N ALA A 124 3.429 7.436 -9.400 1.00 0.00 N ATOM 1811 CA ALA A 124 4.594 8.195 -9.021 1.00 0.00 C ATOM 1812 C ALA A 124 5.305 7.452 -7.929 1.00 0.00 C ATOM 1813 O ALA A 124 4.689 6.621 -7.249 1.00 0.00 O ATOM 1814 CB ALA A 124 4.214 9.594 -8.562 1.00 0.00 C ATOM 0 H ALA A 124 3.161 6.719 -8.726 1.00 0.00 H new ATOM 0 HA ALA A 124 5.251 8.310 -9.883 1.00 0.00 H new ATOM 0 HB1 ALA A 124 5.114 10.142 -8.283 1.00 0.00 H new ATOM 0 HB2 ALA A 124 3.707 10.118 -9.372 1.00 0.00 H new ATOM 0 HB3 ALA A 124 3.549 9.526 -7.701 1.00 0.00 H new ATOM 1820 N LYS A 125 6.624 7.560 -7.941 1.00 0.00 N ATOM 1821 CA LYS A 125 7.488 6.757 -7.085 1.00 0.00 C ATOM 1822 C LYS A 125 8.874 7.365 -7.040 1.00 0.00 C ATOM 1823 O LYS A 125 9.457 7.662 -8.084 1.00 0.00 O ATOM 1824 CB LYS A 125 7.614 5.308 -7.582 1.00 0.00 C ATOM 1825 CG LYS A 125 6.860 4.950 -8.869 1.00 0.00 C ATOM 1826 CD LYS A 125 7.118 5.922 -10.019 1.00 0.00 C ATOM 1827 CE LYS A 125 6.209 5.653 -11.201 1.00 0.00 C ATOM 1828 NZ LYS A 125 6.568 6.491 -12.376 1.00 0.00 N ATOM 0 H LYS A 125 7.129 8.208 -8.546 1.00 0.00 H new ATOM 0 HA LYS A 125 7.033 6.746 -6.094 1.00 0.00 H new ATOM 0 HB2 LYS A 125 8.671 5.093 -7.737 1.00 0.00 H new ATOM 0 HB3 LYS A 125 7.266 4.646 -6.789 1.00 0.00 H new ATOM 0 HG2 LYS A 125 7.147 3.946 -9.181 1.00 0.00 H new ATOM 0 HG3 LYS A 125 5.791 4.924 -8.659 1.00 0.00 H new ATOM 0 HD2 LYS A 125 6.968 6.944 -9.671 1.00 0.00 H new ATOM 0 HD3 LYS A 125 8.158 5.842 -10.335 1.00 0.00 H new ATOM 0 HE2 LYS A 125 6.270 4.599 -11.474 1.00 0.00 H new ATOM 0 HE3 LYS A 125 5.175 5.850 -10.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.924 6.278 -13.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.486 7.497 -12.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 7.546 6.285 -12.663 1.00 0.00 H new ATOM 1838 N ARG A 126 9.466 7.384 -5.860 1.00 0.00 N ATOM 1839 CA ARG A 126 10.849 7.775 -5.743 1.00 0.00 C ATOM 1840 C ARG A 126 11.470 7.115 -4.550 1.00 0.00 C ATOM 1841 O ARG A 126 10.980 7.237 -3.444 1.00 0.00 O ATOM 1842 CB ARG A 126 11.008 9.274 -5.671 1.00 0.00 C ATOM 1843 CG ARG A 126 10.713 9.905 -4.335 1.00 0.00 C ATOM 1844 CD ARG A 126 11.945 10.424 -3.641 1.00 0.00 C ATOM 1845 NE ARG A 126 13.066 9.536 -3.832 1.00 0.00 N ATOM 1846 CZ ARG A 126 13.864 9.529 -4.896 1.00 0.00 C ATOM 1847 NH1 ARG A 126 13.881 10.556 -5.738 1.00 0.00 N ATOM 1848 NH2 ARG A 126 14.647 8.489 -5.111 1.00 0.00 N ATOM 0 H ARG A 126 9.013 7.135 -4.981 1.00 0.00 H new ATOM 0 HA ARG A 126 11.367 7.443 -6.643 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.031 9.525 -5.951 1.00 0.00 H new ATOM 0 HB3 ARG A 126 10.353 9.725 -6.416 1.00 0.00 H new ATOM 0 HG2 ARG A 126 10.009 10.726 -4.475 1.00 0.00 H new ATOM 0 HG3 ARG A 126 10.224 9.172 -3.694 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.192 11.414 -4.025 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.745 10.537 -2.576 1.00 0.00 H new ATOM 0 HE ARG A 126 13.262 8.861 -3.093 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.278 11.362 -5.572 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.497 10.539 -6.551 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.637 7.700 -4.464 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.263 8.474 -5.924 1.00 0.00 H new ATOM 1859 N ILE A 127 12.385 6.222 -4.813 1.00 0.00 N ATOM 1860 CA ILE A 127 12.925 5.363 -3.787 1.00 0.00 C ATOM 1861 C ILE A 127 14.181 4.711 -4.313 1.00 0.00 C ATOM 1862 O ILE A 127 14.117 4.022 -5.321 1.00 0.00 O ATOM 1863 CB ILE A 127 11.974 4.189 -3.395 1.00 0.00 C ATOM 1864 CG1 ILE A 127 10.482 4.477 -3.628 1.00 0.00 C ATOM 1865 CG2 ILE A 127 12.167 3.846 -1.944 1.00 0.00 C ATOM 1866 CD1 ILE A 127 10.036 4.352 -5.065 1.00 0.00 C ATOM 0 H ILE A 127 12.778 6.067 -5.741 1.00 0.00 H new ATOM 0 HA ILE A 127 13.088 5.997 -2.916 1.00 0.00 H new ATOM 0 HB ILE A 127 12.245 3.361 -4.050 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.893 3.792 -3.017 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.261 5.486 -3.279 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.502 3.026 -1.672 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.201 3.546 -1.776 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.938 4.717 -1.331 1.00 0.00 H new ATOM 0 HD11 ILE A 127 8.971 4.572 -5.136 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.594 5.056 -5.682 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.221 3.337 -5.416 1.00 0.00 H new ATOM 1877 N PHE A 128 15.225 4.676 -3.515 1.00 0.00 N ATOM 1878 CA PHE A 128 16.291 3.751 -3.817 1.00 0.00 C ATOM 1879 C PHE A 128 16.706 3.061 -2.569 1.00 0.00 C ATOM 1880 O PHE A 128 17.112 3.671 -1.593 1.00 0.00 O ATOM 1881 CB PHE A 128 17.454 4.376 -4.534 1.00 0.00 C ATOM 1882 CG PHE A 128 17.090 4.673 -5.947 1.00 0.00 C ATOM 1883 CD1 PHE A 128 16.700 3.635 -6.768 1.00 0.00 C ATOM 1884 CD2 PHE A 128 17.069 5.966 -6.434 1.00 0.00 C ATOM 1885 CE1 PHE A 128 16.307 3.874 -8.068 1.00 0.00 C ATOM 1886 CE2 PHE A 128 16.672 6.218 -7.732 1.00 0.00 C ATOM 1887 CZ PHE A 128 16.293 5.169 -8.553 1.00 0.00 C ATOM 0 H PHE A 128 15.357 5.253 -2.684 1.00 0.00 H new ATOM 0 HA PHE A 128 15.902 3.019 -4.524 1.00 0.00 H new ATOM 0 HB2 PHE A 128 17.752 5.294 -4.027 1.00 0.00 H new ATOM 0 HB3 PHE A 128 18.311 3.704 -4.506 1.00 0.00 H new ATOM 0 HD1 PHE A 128 16.703 2.624 -6.388 1.00 0.00 H new ATOM 0 HD2 PHE A 128 17.365 6.785 -5.795 1.00 0.00 H new ATOM 0 HE1 PHE A 128 16.011 3.053 -8.705 1.00 0.00 H new ATOM 0 HE2 PHE A 128 16.657 7.231 -8.106 1.00 0.00 H new ATOM 0 HZ PHE A 128 15.987 5.362 -9.571 1.00 0.00 H new ATOM 1896 N LYS A 129 16.238 1.859 -2.537 1.00 0.00 N ATOM 1897 CA LYS A 129 16.070 1.142 -1.291 1.00 0.00 C ATOM 1898 C LYS A 129 17.089 0.064 -1.045 1.00 0.00 C ATOM 1899 O LYS A 129 17.701 -0.474 -1.966 1.00 0.00 O ATOM 1900 CB LYS A 129 14.696 0.503 -1.206 1.00 0.00 C ATOM 1901 CG LYS A 129 13.562 1.421 -0.792 1.00 0.00 C ATOM 1902 CD LYS A 129 12.419 0.613 -0.202 1.00 0.00 C ATOM 1903 CE LYS A 129 11.073 1.327 -0.148 1.00 0.00 C ATOM 1904 NZ LYS A 129 11.078 2.530 0.719 1.00 0.00 N ATOM 0 H LYS A 129 15.958 1.335 -3.366 1.00 0.00 H new ATOM 0 HA LYS A 129 16.203 1.908 -0.527 1.00 0.00 H new ATOM 0 HB2 LYS A 129 14.455 0.076 -2.179 1.00 0.00 H new ATOM 0 HB3 LYS A 129 14.745 -0.324 -0.498 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.920 2.145 -0.060 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.209 1.987 -1.654 1.00 0.00 H new ATOM 0 HD2 LYS A 129 12.303 -0.301 -0.785 1.00 0.00 H new ATOM 0 HD3 LYS A 129 12.693 0.313 0.809 1.00 0.00 H new ATOM 0 HE2 LYS A 129 10.784 1.618 -1.158 1.00 0.00 H new ATOM 0 HE3 LYS A 129 10.315 0.631 0.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 10.218 3.087 0.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 11.105 2.239 1.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 11.915 3.109 0.505 1.00 0.00 H new ATOM 1914 N LYS A 130 17.052 -0.369 0.204 1.00 0.00 N ATOM 1915 CA LYS A 130 17.752 -1.526 0.687 1.00 0.00 C ATOM 1916 C LYS A 130 19.253 -1.291 0.680 1.00 0.00 C ATOM 1917 O LYS A 130 19.918 -1.393 -0.356 1.00 0.00 O ATOM 1918 CB LYS A 130 17.354 -2.733 -0.140 1.00 0.00 C ATOM 1919 CG LYS A 130 17.401 -4.057 0.602 1.00 0.00 C ATOM 1920 CD LYS A 130 18.730 -4.313 1.289 1.00 0.00 C ATOM 1921 CE LYS A 130 18.547 -5.197 2.509 1.00 0.00 C ATOM 1922 NZ LYS A 130 18.099 -6.570 2.155 1.00 0.00 N ATOM 0 H LYS A 130 16.510 0.100 0.930 1.00 0.00 H new ATOM 0 HA LYS A 130 17.474 -1.718 1.723 1.00 0.00 H new ATOM 0 HB2 LYS A 130 16.343 -2.580 -0.517 1.00 0.00 H new ATOM 0 HB3 LYS A 130 18.012 -2.795 -1.007 1.00 0.00 H new ATOM 0 HG2 LYS A 130 16.605 -4.077 1.347 1.00 0.00 H new ATOM 0 HG3 LYS A 130 17.201 -4.866 -0.100 1.00 0.00 H new ATOM 0 HD2 LYS A 130 19.419 -4.788 0.591 1.00 0.00 H new ATOM 0 HD3 LYS A 130 19.179 -3.365 1.586 1.00 0.00 H new ATOM 0 HE2 LYS A 130 19.488 -5.255 3.056 1.00 0.00 H new ATOM 0 HE3 LYS A 130 17.817 -4.741 3.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 18.021 -7.143 3.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 17.172 -6.523 1.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 18.790 -7.006 1.511 1.00 0.00 H new ATOM 1932 N GLU A 131 19.775 -1.006 1.856 1.00 0.00 N ATOM 1933 CA GLU A 131 21.192 -0.749 2.034 1.00 0.00 C ATOM 1934 C GLU A 131 21.524 -0.719 3.516 1.00 0.00 C ATOM 1935 O GLU A 131 22.506 -1.372 3.920 1.00 0.00 O ATOM 1936 CB GLU A 131 21.585 0.578 1.382 1.00 0.00 C ATOM 1937 CG GLU A 131 23.069 0.883 1.478 1.00 0.00 C ATOM 1938 CD GLU A 131 23.468 2.145 0.743 1.00 0.00 C ATOM 1939 OE1 GLU A 131 22.590 2.810 0.155 1.00 0.00 O ATOM 1940 OE2 GLU A 131 24.675 2.468 0.734 1.00 0.00 O ATOM 1941 OXT GLU A 131 20.784 -0.054 4.273 1.00 0.00 O ATOM 0 H GLU A 131 19.230 -0.946 2.716 1.00 0.00 H new ATOM 0 HA GLU A 131 21.756 -1.548 1.554 1.00 0.00 H new ATOM 0 HB2 GLU A 131 21.293 0.558 0.332 1.00 0.00 H new ATOM 0 HB3 GLU A 131 21.025 1.385 1.853 1.00 0.00 H new ATOM 0 HG2 GLU A 131 23.346 0.979 2.528 1.00 0.00 H new ATOM 0 HG3 GLU A 131 23.633 0.042 1.075 1.00 0.00 H new TER 1946 GLU A 131