USER MOD reduce.3.24.130724 H: found=0, std=0, add=1400, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1408 hydrogens (8 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: C 36 GLN :FLIP amide:sc= -1.41 F(o=-5!,f=-2.8) USER MOD Set 1.2: D 36 GLN :FLIP amide:sc= -1.34 F(o=-5.2!,f=-2.8) USER MOD Set 2.1: A 36 GLN :FLIP amide:sc= -1.34 F(o=-5.7!,f=-3.6) USER MOD Set 2.2: B 36 GLN :FLIP amide:sc= -2.27 F(o=-5.6!,f=-3.6) USER MOD Single : A 1 LYS N :NH3+ -134:sc= 0.098 (180deg=-0.272) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -166:sc= -0.0166 (180deg=-0.23) USER MOD Single : A 3 LYS NZ :NH3+ 163:sc= -0.0428 (180deg=-0.363) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.944 K(o=-0.94,f=-2.3) USER MOD Single : A 22 MET CE :methyl 165:sc= -0.0152 (180deg=-0.274) USER MOD Single : A 27 ASN : amide:sc= -0.294 K(o=-0.29,f=-2!) USER MOD Single : A 33 LYS NZ :NH3+ -155:sc= -2.7! (180deg=-3.33!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 LYS N :NH3+ -128:sc= 0.0777 (180deg=-0.32) USER MOD Single : B 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ -164:sc= -0.0242 (180deg=-0.26) USER MOD Single : B 3 LYS NZ :NH3+ 161:sc= -0.0355 (180deg=-0.42) USER MOD Single : B 9 TYR OH : rot 180:sc= 0 USER MOD Single : B 11 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 GLN : amide:sc= -1.15 K(o=-1.2,f=-2.5!) USER MOD Single : B 22 MET CE :methyl 165:sc= -0.0268 (180deg=-0.315) USER MOD Single : B 27 ASN : amide:sc= -0.2 K(o=-0.2,f=-1.8!) USER MOD Single : B 33 LYS NZ :NH3+ -140:sc= -4.24! (180deg=-4.86!) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 1 LYS N :NH3+ -141:sc= 0.0832 (180deg=-0.249) USER MOD Single : C 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 2 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.204) USER MOD Single : C 3 LYS NZ :NH3+ 165:sc= -0.0265 (180deg=-0.439) USER MOD Single : C 9 TYR OH : rot 180:sc= 0 USER MOD Single : C 11 THR OG1 : rot 180:sc= 0 USER MOD Single : C 13 GLN : amide:sc= -1.02 K(o=-1,f=-2.4!) USER MOD Single : C 22 MET CE :methyl 165:sc= -0.0354 (180deg=-0.336) USER MOD Single : C 27 ASN : amide:sc= -0.231 K(o=-0.23,f=-1.8!) USER MOD Single : C 33 LYS NZ :NH3+ 175:sc= -4.62! (180deg=-4.68!) USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 1 LYS N :NH3+ -142:sc= 0.115 (180deg=-0.238) USER MOD Single : D 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 2 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.205) USER MOD Single : D 3 LYS NZ :NH3+ 164:sc= -0.0212 (180deg=-0.351) USER MOD Single : D 9 TYR OH : rot 180:sc= 0 USER MOD Single : D 11 THR OG1 : rot 180:sc= 0 USER MOD Single : D 13 GLN : amide:sc= -0.908 K(o=-0.91,f=-1.7) USER MOD Single : D 22 MET CE :methyl 166:sc= -0.0429 (180deg=-0.314) USER MOD Single : D 27 ASN : amide:sc= -0.0624 K(o=-0.062,f=-1.4!) USER MOD Single : D 33 LYS NZ :NH3+ -151:sc= -3.05! (180deg=-4.57!) USER MOD Single : D 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 13.942 25.913 16.173 1.00 4.81 N ATOM 2 CA LYS A 1 13.574 25.641 14.756 1.00 4.32 C ATOM 3 C LYS A 1 14.792 25.090 14.014 1.00 3.74 C ATOM 4 O LYS A 1 15.773 24.699 14.616 1.00 3.67 O ATOM 5 CB LYS A 1 13.111 26.938 14.088 1.00 4.67 C ATOM 6 CG LYS A 1 11.759 27.355 14.672 1.00 5.15 C ATOM 7 CD LYS A 1 11.288 28.650 14.010 1.00 5.90 C ATOM 8 CE LYS A 1 9.938 29.060 14.598 1.00 6.51 C ATOM 9 NZ LYS A 1 9.578 30.420 14.111 1.00 7.33 N ATOM 0 H1 LYS A 1 13.204 25.537 16.802 1.00 4.81 H new ATOM 0 H2 LYS A 1 14.849 25.454 16.390 1.00 4.81 H new ATOM 0 H3 LYS A 1 14.030 26.939 16.318 1.00 4.81 H new ATOM 0 HA LYS A 1 12.766 24.911 14.723 1.00 4.32 H new ATOM 0 HB2 LYS A 1 13.847 27.726 14.248 1.00 4.67 H new ATOM 0 HB3 LYS A 1 13.026 26.795 13.011 1.00 4.67 H new ATOM 0 HG2 LYS A 1 11.024 26.566 14.512 1.00 5.15 H new ATOM 0 HG3 LYS A 1 11.846 27.497 15.749 1.00 5.15 H new ATOM 0 HD2 LYS A 1 12.021 29.440 14.169 1.00 5.90 H new ATOM 0 HD3 LYS A 1 11.200 28.509 12.933 1.00 5.90 H new ATOM 0 HE2 LYS A 1 9.170 28.343 14.308 1.00 6.51 H new ATOM 0 HE3 LYS A 1 9.986 29.053 15.687 1.00 6.51 H new ATOM 0 HZ1 LYS A 1 8.660 30.700 14.511 1.00 7.33 H new ATOM 0 HZ2 LYS A 1 10.307 31.100 14.409 1.00 7.33 H new ATOM 0 HZ3 LYS A 1 9.516 30.412 13.073 1.00 7.33 H new ATOM 25 N LYS A 2 14.737 25.056 12.712 1.00 3.85 N ATOM 26 CA LYS A 2 15.889 24.529 11.929 1.00 3.82 C ATOM 27 C LYS A 2 16.305 23.168 12.497 1.00 3.38 C ATOM 28 O LYS A 2 15.697 22.657 13.417 1.00 3.69 O ATOM 29 CB LYS A 2 17.067 25.506 12.024 1.00 4.21 C ATOM 30 CG LYS A 2 16.716 26.812 11.303 1.00 5.00 C ATOM 31 CD LYS A 2 17.896 27.784 11.401 1.00 5.81 C ATOM 32 CE LYS A 2 17.545 29.090 10.687 1.00 6.54 C ATOM 33 NZ LYS A 2 17.491 28.858 9.216 1.00 7.21 N ATOM 0 H LYS A 2 13.942 25.371 12.155 1.00 3.85 H new ATOM 0 HA LYS A 2 15.599 24.417 10.884 1.00 3.82 H new ATOM 0 HB2 LYS A 2 17.301 25.708 13.069 1.00 4.21 H new ATOM 0 HB3 LYS A 2 17.957 25.062 11.579 1.00 4.21 H new ATOM 0 HG2 LYS A 2 16.483 26.611 10.257 1.00 5.00 H new ATOM 0 HG3 LYS A 2 15.826 27.258 11.748 1.00 5.00 H new ATOM 0 HD2 LYS A 2 18.132 27.981 12.447 1.00 5.81 H new ATOM 0 HD3 LYS A 2 18.784 27.340 10.952 1.00 5.81 H new ATOM 0 HE2 LYS A 2 16.584 29.463 11.042 1.00 6.54 H new ATOM 0 HE3 LYS A 2 18.288 29.853 10.918 1.00 6.54 H new ATOM 0 HZ1 LYS A 2 17.490 29.772 8.720 1.00 7.21 H new ATOM 0 HZ2 LYS A 2 18.321 28.305 8.921 1.00 7.21 H new ATOM 0 HZ3 LYS A 2 16.624 28.334 8.979 1.00 7.21 H new ATOM 47 N LYS A 3 17.333 22.574 11.953 1.00 3.05 N ATOM 48 CA LYS A 3 17.785 21.245 12.456 1.00 2.81 C ATOM 49 C LYS A 3 16.589 20.284 12.575 1.00 2.50 C ATOM 50 O LYS A 3 16.307 19.803 13.653 1.00 2.62 O ATOM 51 CB LYS A 3 18.426 21.413 13.838 1.00 3.34 C ATOM 52 CG LYS A 3 19.652 22.325 13.735 1.00 4.02 C ATOM 53 CD LYS A 3 20.204 22.605 15.136 1.00 4.77 C ATOM 54 CE LYS A 3 21.488 23.428 15.021 1.00 5.69 C ATOM 55 NZ LYS A 3 21.175 24.759 14.429 1.00 6.47 N ATOM 0 H LYS A 3 17.880 22.953 11.180 1.00 3.05 H new ATOM 0 HA LYS A 3 18.510 20.833 11.754 1.00 2.81 H new ATOM 0 HB2 LYS A 3 17.703 21.838 14.535 1.00 3.34 H new ATOM 0 HB3 LYS A 3 18.717 20.440 14.234 1.00 3.34 H new ATOM 0 HG2 LYS A 3 20.418 21.853 13.119 1.00 4.02 H new ATOM 0 HG3 LYS A 3 19.381 23.261 13.246 1.00 4.02 H new ATOM 0 HD2 LYS A 3 19.465 23.144 15.729 1.00 4.77 H new ATOM 0 HD3 LYS A 3 20.405 21.667 15.654 1.00 4.77 H new ATOM 0 HE2 LYS A 3 21.941 23.553 16.004 1.00 5.69 H new ATOM 0 HE3 LYS A 3 22.214 22.904 14.400 1.00 5.69 H new ATOM 0 HZ1 LYS A 3 21.962 25.414 14.611 1.00 6.47 H new ATOM 0 HZ2 LYS A 3 21.038 24.659 13.403 1.00 6.47 H new ATOM 0 HZ3 LYS A 3 20.306 25.135 14.859 1.00 6.47 H new ATOM 69 N PRO A 4 15.917 20.023 11.474 1.00 2.87 N ATOM 70 CA PRO A 4 14.757 19.110 11.485 1.00 3.30 C ATOM 71 C PRO A 4 15.208 17.709 11.932 1.00 2.78 C ATOM 72 O PRO A 4 16.354 17.337 11.767 1.00 2.72 O ATOM 73 CB PRO A 4 14.245 19.102 10.023 1.00 4.33 C ATOM 74 CG PRO A 4 15.227 19.967 9.177 1.00 4.53 C ATOM 75 CD PRO A 4 16.249 20.595 10.150 1.00 3.61 C ATOM 0 HA PRO A 4 13.974 19.421 12.176 1.00 3.30 H new ATOM 0 HB2 PRO A 4 14.202 18.083 9.638 1.00 4.33 H new ATOM 0 HB3 PRO A 4 13.234 19.506 9.969 1.00 4.33 H new ATOM 0 HG2 PRO A 4 15.734 19.354 8.432 1.00 4.53 H new ATOM 0 HG3 PRO A 4 14.686 20.743 8.636 1.00 4.53 H new ATOM 0 HD2 PRO A 4 17.271 20.352 9.860 1.00 3.61 H new ATOM 0 HD3 PRO A 4 16.170 21.682 10.158 1.00 3.61 H new ATOM 83 N LEU A 5 14.321 16.932 12.494 1.00 2.70 N ATOM 84 CA LEU A 5 14.708 15.562 12.942 1.00 2.39 C ATOM 85 C LEU A 5 14.689 14.625 11.735 1.00 1.78 C ATOM 86 O LEU A 5 13.705 14.533 11.026 1.00 1.89 O ATOM 87 CB LEU A 5 13.699 15.065 13.980 1.00 2.93 C ATOM 88 CG LEU A 5 13.672 16.006 15.189 1.00 3.65 C ATOM 89 CD1 LEU A 5 12.545 15.570 16.129 1.00 4.35 C ATOM 90 CD2 LEU A 5 15.018 15.958 15.932 1.00 3.83 C ATOM 0 H LEU A 5 13.347 17.186 12.662 1.00 2.70 H new ATOM 0 HA LEU A 5 15.705 15.583 13.383 1.00 2.39 H new ATOM 0 HB2 LEU A 5 12.706 15.007 13.533 1.00 2.93 H new ATOM 0 HB3 LEU A 5 13.963 14.057 14.301 1.00 2.93 H new ATOM 0 HG LEU A 5 13.500 17.028 14.851 1.00 3.65 H new ATOM 0 HD11 LEU A 5 12.516 16.233 16.994 1.00 4.35 H new ATOM 0 HD12 LEU A 5 11.592 15.619 15.602 1.00 4.35 H new ATOM 0 HD13 LEU A 5 12.724 14.547 16.461 1.00 4.35 H new ATOM 0 HD21 LEU A 5 14.985 16.631 16.789 1.00 3.83 H new ATOM 0 HD22 LEU A 5 15.207 14.941 16.276 1.00 3.83 H new ATOM 0 HD23 LEU A 5 15.817 16.267 15.258 1.00 3.83 H new ATOM 102 N ASP A 6 15.766 13.927 11.490 1.00 1.51 N ATOM 103 CA ASP A 6 15.799 12.997 10.324 1.00 1.33 C ATOM 104 C ASP A 6 15.127 11.678 10.703 1.00 1.07 C ATOM 105 O ASP A 6 15.558 10.987 11.605 1.00 1.04 O ATOM 106 CB ASP A 6 17.252 12.733 9.928 1.00 1.76 C ATOM 107 CG ASP A 6 17.848 14.000 9.317 1.00 2.08 C ATOM 108 OD1 ASP A 6 17.079 14.850 8.900 1.00 2.42 O ATOM 109 OD2 ASP A 6 19.063 14.099 9.274 1.00 2.48 O ATOM 0 H ASP A 6 16.621 13.960 12.045 1.00 1.51 H new ATOM 0 HA ASP A 6 15.267 13.446 9.485 1.00 1.33 H new ATOM 0 HB2 ASP A 6 17.830 12.430 10.801 1.00 1.76 H new ATOM 0 HB3 ASP A 6 17.302 11.912 9.213 1.00 1.76 H new ATOM 114 N GLY A 7 14.078 11.320 10.019 1.00 0.98 N ATOM 115 CA GLY A 7 13.383 10.042 10.334 1.00 0.84 C ATOM 116 C GLY A 7 14.265 8.873 9.895 1.00 0.70 C ATOM 117 O GLY A 7 14.995 8.966 8.931 1.00 0.68 O ATOM 0 H GLY A 7 13.671 11.858 9.254 1.00 0.98 H new ATOM 0 HA2 GLY A 7 13.179 9.978 11.403 1.00 0.84 H new ATOM 0 HA3 GLY A 7 12.421 10.001 9.822 1.00 0.84 H new ATOM 121 N GLU A 8 14.205 7.769 10.587 1.00 0.65 N ATOM 122 CA GLU A 8 15.046 6.607 10.188 1.00 0.58 C ATOM 123 C GLU A 8 14.653 6.168 8.776 1.00 0.52 C ATOM 124 O GLU A 8 13.488 6.018 8.466 1.00 0.51 O ATOM 125 CB GLU A 8 14.816 5.453 11.165 1.00 0.64 C ATOM 126 CG GLU A 8 15.395 5.823 12.532 1.00 0.75 C ATOM 127 CD GLU A 8 15.125 4.692 13.527 1.00 1.06 C ATOM 128 OE1 GLU A 8 14.089 4.731 14.170 1.00 1.64 O ATOM 129 OE2 GLU A 8 15.962 3.811 13.635 1.00 1.70 O ATOM 0 H GLU A 8 13.614 7.622 11.406 1.00 0.65 H new ATOM 0 HA GLU A 8 16.099 6.890 10.205 1.00 0.58 H new ATOM 0 HB2 GLU A 8 13.750 5.244 11.254 1.00 0.64 H new ATOM 0 HB3 GLU A 8 15.289 4.545 10.791 1.00 0.64 H new ATOM 0 HG2 GLU A 8 16.467 5.999 12.448 1.00 0.75 H new ATOM 0 HG3 GLU A 8 14.947 6.750 12.889 1.00 0.75 H new ATOM 136 N TYR A 9 15.620 5.959 7.917 1.00 0.49 N ATOM 137 CA TYR A 9 15.321 5.528 6.512 1.00 0.45 C ATOM 138 C TYR A 9 15.742 4.069 6.321 1.00 0.43 C ATOM 139 O TYR A 9 16.731 3.626 6.870 1.00 0.48 O ATOM 140 CB TYR A 9 16.108 6.409 5.541 1.00 0.47 C ATOM 141 CG TYR A 9 15.647 7.839 5.673 1.00 0.49 C ATOM 142 CD1 TYR A 9 14.577 8.309 4.889 1.00 0.49 C ATOM 143 CD2 TYR A 9 16.289 8.704 6.580 1.00 0.54 C ATOM 144 CE1 TYR A 9 14.147 9.643 5.009 1.00 0.52 C ATOM 145 CE2 TYR A 9 15.861 10.040 6.701 1.00 0.58 C ATOM 146 CZ TYR A 9 14.789 10.510 5.915 1.00 0.56 C ATOM 147 OH TYR A 9 14.372 11.820 6.031 1.00 0.61 O ATOM 0 H TYR A 9 16.612 6.069 8.129 1.00 0.49 H new ATOM 0 HA TYR A 9 14.252 5.625 6.321 1.00 0.45 H new ATOM 0 HB2 TYR A 9 17.175 6.339 5.753 1.00 0.47 H new ATOM 0 HB3 TYR A 9 15.962 6.062 4.518 1.00 0.47 H new ATOM 0 HD1 TYR A 9 14.085 7.644 4.194 1.00 0.49 H new ATOM 0 HD2 TYR A 9 17.109 8.343 7.183 1.00 0.54 H new ATOM 0 HE1 TYR A 9 13.325 10.002 4.407 1.00 0.52 H new ATOM 0 HE2 TYR A 9 16.354 10.704 7.396 1.00 0.58 H new ATOM 0 HH TYR A 9 14.920 12.280 6.701 1.00 0.61 H new ATOM 157 N PHE A 10 14.999 3.317 5.543 1.00 0.39 N ATOM 158 CA PHE A 10 15.355 1.880 5.306 1.00 0.39 C ATOM 159 C PHE A 10 15.217 1.560 3.818 1.00 0.36 C ATOM 160 O PHE A 10 14.288 1.989 3.161 1.00 0.37 O ATOM 161 CB PHE A 10 14.406 0.982 6.100 1.00 0.40 C ATOM 162 CG PHE A 10 14.644 1.184 7.574 1.00 0.44 C ATOM 163 CD1 PHE A 10 13.922 2.170 8.271 1.00 0.47 C ATOM 164 CD2 PHE A 10 15.584 0.385 8.253 1.00 0.51 C ATOM 165 CE1 PHE A 10 14.140 2.359 9.647 1.00 0.54 C ATOM 166 CE2 PHE A 10 15.804 0.575 9.632 1.00 0.57 C ATOM 167 CZ PHE A 10 15.081 1.562 10.330 1.00 0.58 C ATOM 0 H PHE A 10 14.159 3.637 5.061 1.00 0.39 H new ATOM 0 HA PHE A 10 16.382 1.705 5.627 1.00 0.39 H new ATOM 0 HB2 PHE A 10 13.371 1.218 5.852 1.00 0.40 H new ATOM 0 HB3 PHE A 10 14.568 -0.063 5.834 1.00 0.40 H new ATOM 0 HD1 PHE A 10 13.201 2.781 7.749 1.00 0.47 H new ATOM 0 HD2 PHE A 10 16.136 -0.373 7.717 1.00 0.51 H new ATOM 0 HE1 PHE A 10 13.586 3.116 10.182 1.00 0.54 H new ATOM 0 HE2 PHE A 10 16.526 -0.036 10.153 1.00 0.57 H new ATOM 0 HZ PHE A 10 15.247 1.708 11.387 1.00 0.58 H new ATOM 177 N THR A 11 16.133 0.797 3.281 1.00 0.35 N ATOM 178 CA THR A 11 16.057 0.434 1.836 1.00 0.34 C ATOM 179 C THR A 11 15.222 -0.838 1.691 1.00 0.33 C ATOM 180 O THR A 11 15.186 -1.665 2.579 1.00 0.37 O ATOM 181 CB THR A 11 17.469 0.193 1.296 1.00 0.37 C ATOM 182 OG1 THR A 11 18.077 -0.868 2.020 1.00 0.39 O ATOM 183 CG2 THR A 11 18.306 1.466 1.452 1.00 0.42 C ATOM 0 H THR A 11 16.932 0.409 3.783 1.00 0.35 H new ATOM 0 HA THR A 11 15.594 1.243 1.271 1.00 0.34 H new ATOM 0 HB THR A 11 17.412 -0.072 0.240 1.00 0.37 H new ATOM 0 HG1 THR A 11 18.980 -1.024 1.674 1.00 0.39 H new ATOM 0 HG21 THR A 11 19.310 1.291 1.067 1.00 0.42 H new ATOM 0 HG22 THR A 11 17.840 2.278 0.894 1.00 0.42 H new ATOM 0 HG23 THR A 11 18.364 1.736 2.506 1.00 0.42 H new ATOM 191 N LEU A 12 14.548 -1.007 0.584 1.00 0.29 N ATOM 192 CA LEU A 12 13.710 -2.231 0.396 1.00 0.29 C ATOM 193 C LEU A 12 13.728 -2.650 -1.075 1.00 0.27 C ATOM 194 O LEU A 12 13.514 -1.850 -1.965 1.00 0.25 O ATOM 195 CB LEU A 12 12.271 -1.924 0.829 1.00 0.29 C ATOM 196 CG LEU A 12 11.376 -3.159 0.647 1.00 0.30 C ATOM 197 CD1 LEU A 12 11.875 -4.313 1.535 1.00 0.36 C ATOM 198 CD2 LEU A 12 9.938 -2.790 1.034 1.00 0.32 C ATOM 0 H LEU A 12 14.541 -0.352 -0.198 1.00 0.29 H new ATOM 0 HA LEU A 12 14.110 -3.045 1.001 1.00 0.29 H new ATOM 0 HB2 LEU A 12 12.259 -1.610 1.873 1.00 0.29 H new ATOM 0 HB3 LEU A 12 11.878 -1.094 0.242 1.00 0.29 H new ATOM 0 HG LEU A 12 11.409 -3.483 -0.393 1.00 0.30 H new ATOM 0 HD11 LEU A 12 11.232 -5.182 1.397 1.00 0.36 H new ATOM 0 HD12 LEU A 12 12.897 -4.570 1.258 1.00 0.36 H new ATOM 0 HD13 LEU A 12 11.849 -4.005 2.580 1.00 0.36 H new ATOM 0 HD21 LEU A 12 9.293 -3.660 0.909 1.00 0.32 H new ATOM 0 HD22 LEU A 12 9.913 -2.466 2.075 1.00 0.32 H new ATOM 0 HD23 LEU A 12 9.585 -1.981 0.394 1.00 0.32 H new ATOM 210 N GLN A 13 13.971 -3.906 -1.331 1.00 0.29 N ATOM 211 CA GLN A 13 13.993 -4.394 -2.738 1.00 0.29 C ATOM 212 C GLN A 13 12.557 -4.685 -3.176 1.00 0.28 C ATOM 213 O GLN A 13 11.818 -5.356 -2.485 1.00 0.31 O ATOM 214 CB GLN A 13 14.829 -5.673 -2.814 1.00 0.34 C ATOM 215 CG GLN A 13 15.014 -6.068 -4.276 1.00 0.40 C ATOM 216 CD GLN A 13 15.949 -7.275 -4.367 1.00 0.64 C ATOM 217 OE1 GLN A 13 16.648 -7.444 -5.347 1.00 1.37 O ATOM 218 NE2 GLN A 13 16.000 -8.122 -3.376 1.00 0.62 N ATOM 0 H GLN A 13 14.156 -4.617 -0.624 1.00 0.29 H new ATOM 0 HA GLN A 13 14.432 -3.642 -3.393 1.00 0.29 H new ATOM 0 HB2 GLN A 13 15.799 -5.516 -2.342 1.00 0.34 H new ATOM 0 HB3 GLN A 13 14.335 -6.477 -2.268 1.00 0.34 H new ATOM 0 HG2 GLN A 13 14.049 -6.308 -4.723 1.00 0.40 H new ATOM 0 HG3 GLN A 13 15.427 -5.232 -4.840 1.00 0.40 H new ATOM 0 HE21 GLN A 13 15.414 -7.981 -2.553 1.00 0.62 H new ATOM 0 HE22 GLN A 13 16.626 -8.926 -3.424 1.00 0.62 H new ATOM 227 N ILE A 14 12.149 -4.167 -4.312 1.00 0.29 N ATOM 228 CA ILE A 14 10.747 -4.390 -4.798 1.00 0.31 C ATOM 229 C ILE A 14 10.769 -5.094 -6.157 1.00 0.32 C ATOM 230 O ILE A 14 11.329 -4.604 -7.116 1.00 0.33 O ATOM 231 CB ILE A 14 10.057 -3.032 -4.925 1.00 0.35 C ATOM 232 CG1 ILE A 14 10.050 -2.361 -3.545 1.00 0.34 C ATOM 233 CG2 ILE A 14 8.614 -3.225 -5.405 1.00 0.47 C ATOM 234 CD1 ILE A 14 9.593 -0.902 -3.659 1.00 0.39 C ATOM 0 H ILE A 14 12.730 -3.596 -4.927 1.00 0.29 H new ATOM 0 HA ILE A 14 10.205 -5.019 -4.092 1.00 0.31 H new ATOM 0 HB ILE A 14 10.589 -2.411 -5.645 1.00 0.35 H new ATOM 0 HG12 ILE A 14 9.386 -2.905 -2.873 1.00 0.34 H new ATOM 0 HG13 ILE A 14 11.048 -2.403 -3.109 1.00 0.34 H new ATOM 0 HG21 ILE A 14 8.127 -2.254 -5.494 1.00 0.47 H new ATOM 0 HG22 ILE A 14 8.617 -3.720 -6.376 1.00 0.47 H new ATOM 0 HG23 ILE A 14 8.071 -3.839 -4.687 1.00 0.47 H new ATOM 0 HD11 ILE A 14 9.594 -0.442 -2.671 1.00 0.39 H new ATOM 0 HD12 ILE A 14 10.274 -0.358 -4.313 1.00 0.39 H new ATOM 0 HD13 ILE A 14 8.586 -0.868 -4.074 1.00 0.39 H new ATOM 246 N ARG A 15 10.158 -6.243 -6.239 1.00 0.33 N ATOM 247 CA ARG A 15 10.130 -7.000 -7.525 1.00 0.36 C ATOM 248 C ARG A 15 9.136 -6.357 -8.504 1.00 0.38 C ATOM 249 O ARG A 15 8.077 -5.903 -8.122 1.00 0.42 O ATOM 250 CB ARG A 15 9.716 -8.445 -7.237 1.00 0.40 C ATOM 251 CG ARG A 15 9.721 -9.264 -8.530 1.00 0.43 C ATOM 252 CD ARG A 15 9.304 -10.701 -8.210 1.00 0.91 C ATOM 253 NE ARG A 15 9.502 -11.571 -9.416 1.00 1.05 N ATOM 254 CZ ARG A 15 8.894 -11.329 -10.545 1.00 1.50 C ATOM 255 NH1 ARG A 15 7.975 -10.405 -10.617 1.00 2.10 N ATOM 256 NH2 ARG A 15 9.176 -12.051 -11.595 1.00 2.10 N ATOM 0 H ARG A 15 9.672 -6.695 -5.464 1.00 0.33 H new ATOM 0 HA ARG A 15 11.120 -6.980 -7.980 1.00 0.36 H new ATOM 0 HB2 ARG A 15 10.400 -8.890 -6.514 1.00 0.40 H new ATOM 0 HB3 ARG A 15 8.722 -8.464 -6.790 1.00 0.40 H new ATOM 0 HG2 ARG A 15 9.036 -8.826 -9.256 1.00 0.43 H new ATOM 0 HG3 ARG A 15 10.714 -9.251 -8.980 1.00 0.43 H new ATOM 0 HD2 ARG A 15 9.892 -11.082 -7.375 1.00 0.91 H new ATOM 0 HD3 ARG A 15 8.259 -10.725 -7.901 1.00 0.91 H new ATOM 0 HE ARG A 15 10.129 -12.373 -9.352 1.00 1.05 H new ATOM 0 HH11 ARG A 15 7.728 -9.866 -9.787 1.00 2.10 H new ATOM 0 HH12 ARG A 15 7.504 -10.222 -11.503 1.00 2.10 H new ATOM 0 HH21 ARG A 15 9.867 -12.798 -11.529 1.00 2.10 H new ATOM 0 HH22 ARG A 15 8.705 -11.868 -12.481 1.00 2.10 H new ATOM 270 N GLY A 16 9.468 -6.337 -9.770 1.00 0.39 N ATOM 271 CA GLY A 16 8.543 -5.748 -10.789 1.00 0.42 C ATOM 272 C GLY A 16 8.792 -4.244 -10.921 1.00 0.40 C ATOM 273 O GLY A 16 8.645 -3.495 -9.976 1.00 0.39 O ATOM 0 H GLY A 16 10.343 -6.704 -10.144 1.00 0.39 H new ATOM 0 HA2 GLY A 16 8.694 -6.235 -11.752 1.00 0.42 H new ATOM 0 HA3 GLY A 16 7.508 -5.929 -10.499 1.00 0.42 H new ATOM 277 N ARG A 17 9.160 -3.794 -12.094 1.00 0.43 N ATOM 278 CA ARG A 17 9.407 -2.337 -12.290 1.00 0.45 C ATOM 279 C ARG A 17 8.108 -1.566 -12.039 1.00 0.45 C ATOM 280 O ARG A 17 8.100 -0.533 -11.401 1.00 0.44 O ATOM 281 CB ARG A 17 9.883 -2.088 -13.729 1.00 0.50 C ATOM 282 CG ARG A 17 10.221 -0.604 -13.917 1.00 0.58 C ATOM 283 CD ARG A 17 10.702 -0.374 -15.354 1.00 0.91 C ATOM 284 NE ARG A 17 11.185 1.040 -15.518 1.00 1.36 N ATOM 285 CZ ARG A 17 10.412 2.066 -15.280 1.00 1.83 C ATOM 286 NH1 ARG A 17 9.138 1.897 -15.055 1.00 2.18 N ATOM 287 NH2 ARG A 17 10.908 3.272 -15.325 1.00 2.68 N ATOM 0 H ARG A 17 9.299 -4.373 -12.922 1.00 0.43 H new ATOM 0 HA ARG A 17 10.173 -1.998 -11.592 1.00 0.45 H new ATOM 0 HB2 ARG A 17 10.760 -2.700 -13.942 1.00 0.50 H new ATOM 0 HB3 ARG A 17 9.107 -2.386 -14.435 1.00 0.50 H new ATOM 0 HG2 ARG A 17 9.344 0.010 -13.712 1.00 0.58 H new ATOM 0 HG3 ARG A 17 10.994 -0.302 -13.210 1.00 0.58 H new ATOM 0 HD2 ARG A 17 11.506 -1.071 -15.592 1.00 0.91 H new ATOM 0 HD3 ARG A 17 9.890 -0.572 -16.054 1.00 0.91 H new ATOM 0 HE ARG A 17 12.144 1.203 -15.824 1.00 1.36 H new ATOM 0 HH11 ARG A 17 8.739 0.958 -15.064 1.00 2.18 H new ATOM 0 HH12 ARG A 17 8.541 2.703 -14.870 1.00 2.18 H new ATOM 0 HH21 ARG A 17 11.894 3.410 -15.545 1.00 2.68 H new ATOM 0 HH22 ARG A 17 10.309 4.077 -15.140 1.00 2.68 H new ATOM 301 N GLU A 18 7.006 -2.063 -12.536 1.00 0.50 N ATOM 302 CA GLU A 18 5.709 -1.357 -12.326 1.00 0.54 C ATOM 303 C GLU A 18 5.431 -1.258 -10.824 1.00 0.48 C ATOM 304 O GLU A 18 4.990 -0.241 -10.329 1.00 0.44 O ATOM 305 CB GLU A 18 4.587 -2.146 -13.014 1.00 0.62 C ATOM 306 CG GLU A 18 3.248 -1.423 -12.831 1.00 1.19 C ATOM 307 CD GLU A 18 2.145 -2.219 -13.527 1.00 1.58 C ATOM 308 OE1 GLU A 18 2.477 -3.145 -14.249 1.00 2.22 O ATOM 309 OE2 GLU A 18 0.988 -1.890 -13.327 1.00 2.04 O ATOM 0 H GLU A 18 6.948 -2.926 -13.077 1.00 0.50 H new ATOM 0 HA GLU A 18 5.756 -0.355 -12.752 1.00 0.54 H new ATOM 0 HB2 GLU A 18 4.808 -2.257 -14.076 1.00 0.62 H new ATOM 0 HB3 GLU A 18 4.528 -3.150 -12.594 1.00 0.62 H new ATOM 0 HG2 GLU A 18 3.021 -1.316 -11.770 1.00 1.19 H new ATOM 0 HG3 GLU A 18 3.305 -0.417 -13.248 1.00 1.19 H new ATOM 316 N ARG A 19 5.696 -2.308 -10.098 1.00 0.48 N ATOM 317 CA ARG A 19 5.461 -2.286 -8.627 1.00 0.46 C ATOM 318 C ARG A 19 6.309 -1.178 -7.997 1.00 0.39 C ATOM 319 O ARG A 19 5.878 -0.485 -7.098 1.00 0.36 O ATOM 320 CB ARG A 19 5.848 -3.640 -8.027 1.00 0.51 C ATOM 321 CG ARG A 19 5.392 -3.703 -6.567 1.00 0.63 C ATOM 322 CD ARG A 19 5.782 -5.057 -5.968 1.00 1.16 C ATOM 323 NE ARG A 19 4.981 -6.137 -6.608 1.00 1.43 N ATOM 324 CZ ARG A 19 5.352 -7.381 -6.486 1.00 2.15 C ATOM 325 NH1 ARG A 19 6.428 -7.679 -5.808 1.00 2.74 N ATOM 326 NH2 ARG A 19 4.653 -8.327 -7.049 1.00 2.77 N ATOM 0 H ARG A 19 6.067 -3.185 -10.462 1.00 0.48 H new ATOM 0 HA ARG A 19 4.407 -2.094 -8.426 1.00 0.46 H new ATOM 0 HB2 ARG A 19 5.388 -4.447 -8.597 1.00 0.51 H new ATOM 0 HB3 ARG A 19 6.927 -3.781 -8.088 1.00 0.51 H new ATOM 0 HG2 ARG A 19 5.851 -2.895 -5.997 1.00 0.63 H new ATOM 0 HG3 ARG A 19 4.313 -3.564 -6.506 1.00 0.63 H new ATOM 0 HD2 ARG A 19 6.846 -5.240 -6.121 1.00 1.16 H new ATOM 0 HD3 ARG A 19 5.610 -5.053 -4.892 1.00 1.16 H new ATOM 0 HE ARG A 19 4.143 -5.904 -7.141 1.00 1.43 H new ATOM 0 HH11 ARG A 19 6.979 -6.938 -5.374 1.00 2.74 H new ATOM 0 HH12 ARG A 19 6.718 -8.652 -5.713 1.00 2.74 H new ATOM 0 HH21 ARG A 19 3.817 -8.094 -7.584 1.00 2.77 H new ATOM 0 HH22 ARG A 19 4.943 -9.300 -6.954 1.00 2.77 H new ATOM 340 N PHE A 20 7.521 -1.018 -8.457 1.00 0.39 N ATOM 341 CA PHE A 20 8.407 0.033 -7.882 1.00 0.35 C ATOM 342 C PHE A 20 7.748 1.405 -8.041 1.00 0.33 C ATOM 343 O PHE A 20 7.654 2.167 -7.099 1.00 0.29 O ATOM 344 CB PHE A 20 9.756 0.017 -8.615 1.00 0.39 C ATOM 345 CG PHE A 20 10.573 1.221 -8.210 1.00 0.37 C ATOM 346 CD1 PHE A 20 11.438 1.144 -7.104 1.00 0.38 C ATOM 347 CD2 PHE A 20 10.469 2.422 -8.941 1.00 0.42 C ATOM 348 CE1 PHE A 20 12.197 2.266 -6.727 1.00 0.40 C ATOM 349 CE2 PHE A 20 11.230 3.544 -8.563 1.00 0.43 C ATOM 350 CZ PHE A 20 12.095 3.466 -7.456 1.00 0.41 C ATOM 0 H PHE A 20 7.935 -1.571 -9.207 1.00 0.39 H new ATOM 0 HA PHE A 20 8.568 -0.165 -6.822 1.00 0.35 H new ATOM 0 HB2 PHE A 20 10.298 -0.898 -8.378 1.00 0.39 H new ATOM 0 HB3 PHE A 20 9.595 0.022 -9.693 1.00 0.39 H new ATOM 0 HD1 PHE A 20 11.519 0.224 -6.545 1.00 0.38 H new ATOM 0 HD2 PHE A 20 9.805 2.481 -9.791 1.00 0.42 H new ATOM 0 HE1 PHE A 20 12.860 2.207 -5.876 1.00 0.40 H new ATOM 0 HE2 PHE A 20 11.150 4.464 -9.122 1.00 0.43 H new ATOM 0 HZ PHE A 20 12.680 4.326 -7.166 1.00 0.41 H new ATOM 360 N GLU A 21 7.293 1.732 -9.218 1.00 0.37 N ATOM 361 CA GLU A 21 6.652 3.062 -9.407 1.00 0.38 C ATOM 362 C GLU A 21 5.444 3.161 -8.481 1.00 0.33 C ATOM 363 O GLU A 21 5.191 4.184 -7.875 1.00 0.30 O ATOM 364 CB GLU A 21 6.181 3.202 -10.855 1.00 0.45 C ATOM 365 CG GLU A 21 7.393 3.325 -11.776 1.00 0.58 C ATOM 366 CD GLU A 21 6.920 3.464 -13.224 1.00 0.98 C ATOM 367 OE1 GLU A 21 5.736 3.285 -13.459 1.00 1.66 O ATOM 368 OE2 GLU A 21 7.749 3.745 -14.072 1.00 1.53 O ATOM 0 H GLU A 21 7.336 1.143 -10.049 1.00 0.37 H new ATOM 0 HA GLU A 21 7.369 3.851 -9.179 1.00 0.38 H new ATOM 0 HB2 GLU A 21 5.582 2.337 -11.139 1.00 0.45 H new ATOM 0 HB3 GLU A 21 5.543 4.079 -10.958 1.00 0.45 H new ATOM 0 HG2 GLU A 21 7.992 4.191 -11.493 1.00 0.58 H new ATOM 0 HG3 GLU A 21 8.032 2.448 -11.673 1.00 0.58 H new ATOM 375 N MET A 22 4.699 2.101 -8.363 1.00 0.33 N ATOM 376 CA MET A 22 3.509 2.117 -7.473 1.00 0.30 C ATOM 377 C MET A 22 3.953 2.355 -6.027 1.00 0.26 C ATOM 378 O MET A 22 3.435 3.211 -5.339 1.00 0.25 O ATOM 379 CB MET A 22 2.795 0.771 -7.579 1.00 0.34 C ATOM 380 CG MET A 22 1.540 0.799 -6.716 1.00 0.34 C ATOM 381 SD MET A 22 0.602 -0.726 -6.977 1.00 0.43 S ATOM 382 CE MET A 22 1.633 -1.825 -5.973 1.00 0.44 C ATOM 0 H MET A 22 4.864 1.219 -8.848 1.00 0.33 H new ATOM 0 HA MET A 22 2.832 2.917 -7.773 1.00 0.30 H new ATOM 0 HB2 MET A 22 2.532 0.566 -8.617 1.00 0.34 H new ATOM 0 HB3 MET A 22 3.457 -0.032 -7.253 1.00 0.34 H new ATOM 0 HG2 MET A 22 1.810 0.898 -5.665 1.00 0.34 H new ATOM 0 HG3 MET A 22 0.928 1.664 -6.971 1.00 0.34 H new ATOM 0 HE1 MET A 22 1.094 -2.752 -5.778 1.00 0.44 H new ATOM 0 HE2 MET A 22 2.556 -2.047 -6.508 1.00 0.44 H new ATOM 0 HE3 MET A 22 1.870 -1.338 -5.027 1.00 0.44 H new ATOM 392 N PHE A 23 4.915 1.604 -5.565 1.00 0.24 N ATOM 393 CA PHE A 23 5.401 1.786 -4.168 1.00 0.22 C ATOM 394 C PHE A 23 5.981 3.194 -4.013 1.00 0.22 C ATOM 395 O PHE A 23 5.791 3.848 -3.006 1.00 0.22 O ATOM 396 CB PHE A 23 6.490 0.744 -3.871 1.00 0.22 C ATOM 397 CG PHE A 23 5.865 -0.569 -3.438 1.00 0.23 C ATOM 398 CD1 PHE A 23 4.876 -1.182 -4.233 1.00 0.26 C ATOM 399 CD2 PHE A 23 6.278 -1.181 -2.236 1.00 0.26 C ATOM 400 CE1 PHE A 23 4.303 -2.402 -3.826 1.00 0.29 C ATOM 401 CE2 PHE A 23 5.704 -2.400 -1.831 1.00 0.29 C ATOM 402 CZ PHE A 23 4.716 -3.010 -2.626 1.00 0.29 C ATOM 0 H PHE A 23 5.386 0.871 -6.096 1.00 0.24 H new ATOM 0 HA PHE A 23 4.574 1.656 -3.470 1.00 0.22 H new ATOM 0 HB2 PHE A 23 7.103 0.587 -4.759 1.00 0.22 H new ATOM 0 HB3 PHE A 23 7.152 1.114 -3.088 1.00 0.22 H new ATOM 0 HD1 PHE A 23 4.558 -0.716 -5.154 1.00 0.26 H new ATOM 0 HD2 PHE A 23 7.036 -0.713 -1.626 1.00 0.26 H new ATOM 0 HE1 PHE A 23 3.545 -2.872 -4.436 1.00 0.29 H new ATOM 0 HE2 PHE A 23 6.021 -2.867 -0.911 1.00 0.29 H new ATOM 0 HZ PHE A 23 4.274 -3.945 -2.315 1.00 0.29 H new ATOM 412 N ARG A 24 6.690 3.665 -5.001 1.00 0.25 N ATOM 413 CA ARG A 24 7.281 5.028 -4.907 1.00 0.27 C ATOM 414 C ARG A 24 6.155 6.043 -4.728 1.00 0.25 C ATOM 415 O ARG A 24 6.247 6.957 -3.933 1.00 0.26 O ATOM 416 CB ARG A 24 8.060 5.330 -6.191 1.00 0.33 C ATOM 417 CG ARG A 24 8.675 6.730 -6.113 1.00 0.43 C ATOM 418 CD ARG A 24 9.552 6.965 -7.345 1.00 0.88 C ATOM 419 NE ARG A 24 8.713 6.878 -8.573 1.00 1.25 N ATOM 420 CZ ARG A 24 9.168 7.318 -9.716 1.00 1.72 C ATOM 421 NH1 ARG A 24 10.369 7.823 -9.797 1.00 2.19 N ATOM 422 NH2 ARG A 24 8.419 7.246 -10.783 1.00 2.44 N ATOM 0 H ARG A 24 6.885 3.165 -5.868 1.00 0.25 H new ATOM 0 HA ARG A 24 7.960 5.086 -4.056 1.00 0.27 H new ATOM 0 HB2 ARG A 24 8.844 4.587 -6.334 1.00 0.33 H new ATOM 0 HB3 ARG A 24 7.396 5.263 -7.053 1.00 0.33 H new ATOM 0 HG2 ARG A 24 7.889 7.483 -6.063 1.00 0.43 H new ATOM 0 HG3 ARG A 24 9.269 6.829 -5.205 1.00 0.43 H new ATOM 0 HD2 ARG A 24 10.028 7.944 -7.285 1.00 0.88 H new ATOM 0 HD3 ARG A 24 10.350 6.224 -7.383 1.00 0.88 H new ATOM 0 HE ARG A 24 7.778 6.473 -8.521 1.00 1.25 H new ATOM 0 HH11 ARG A 24 10.957 7.876 -8.965 1.00 2.19 H new ATOM 0 HH12 ARG A 24 10.719 8.165 -10.692 1.00 2.19 H new ATOM 0 HH21 ARG A 24 7.482 6.847 -10.722 1.00 2.44 H new ATOM 0 HH22 ARG A 24 8.771 7.588 -11.677 1.00 2.44 H new ATOM 436 N GLU A 25 5.089 5.880 -5.461 1.00 0.25 N ATOM 437 CA GLU A 25 3.945 6.822 -5.334 1.00 0.25 C ATOM 438 C GLU A 25 3.424 6.778 -3.894 1.00 0.21 C ATOM 439 O GLU A 25 3.206 7.799 -3.270 1.00 0.22 O ATOM 440 CB GLU A 25 2.838 6.405 -6.314 1.00 0.28 C ATOM 441 CG GLU A 25 1.670 7.395 -6.247 1.00 0.33 C ATOM 442 CD GLU A 25 2.128 8.765 -6.747 1.00 1.05 C ATOM 443 OE1 GLU A 25 3.171 8.829 -7.379 1.00 1.74 O ATOM 444 OE2 GLU A 25 1.426 9.727 -6.494 1.00 1.74 O ATOM 0 H GLU A 25 4.962 5.133 -6.144 1.00 0.25 H new ATOM 0 HA GLU A 25 4.262 7.838 -5.570 1.00 0.25 H new ATOM 0 HB2 GLU A 25 3.235 6.368 -7.328 1.00 0.28 H new ATOM 0 HB3 GLU A 25 2.488 5.401 -6.072 1.00 0.28 H new ATOM 0 HG2 GLU A 25 0.840 7.034 -6.854 1.00 0.33 H new ATOM 0 HG3 GLU A 25 1.306 7.474 -5.223 1.00 0.33 H new ATOM 451 N LEU A 26 3.228 5.598 -3.361 1.00 0.20 N ATOM 452 CA LEU A 26 2.727 5.485 -1.962 1.00 0.19 C ATOM 453 C LEU A 26 3.733 6.123 -1.002 1.00 0.20 C ATOM 454 O LEU A 26 3.373 6.874 -0.118 1.00 0.23 O ATOM 455 CB LEU A 26 2.557 4.005 -1.597 1.00 0.20 C ATOM 456 CG LEU A 26 1.533 3.345 -2.529 1.00 0.24 C ATOM 457 CD1 LEU A 26 1.456 1.848 -2.205 1.00 0.29 C ATOM 458 CD2 LEU A 26 0.148 3.994 -2.340 1.00 0.30 C ATOM 0 H LEU A 26 3.394 4.710 -3.836 1.00 0.20 H new ATOM 0 HA LEU A 26 1.768 5.998 -1.882 1.00 0.19 H new ATOM 0 HB2 LEU A 26 3.515 3.491 -1.675 1.00 0.20 H new ATOM 0 HB3 LEU A 26 2.229 3.913 -0.561 1.00 0.20 H new ATOM 0 HG LEU A 26 1.843 3.482 -3.565 1.00 0.24 H new ATOM 0 HD11 LEU A 26 0.730 1.370 -2.863 1.00 0.29 H new ATOM 0 HD12 LEU A 26 2.435 1.393 -2.354 1.00 0.29 H new ATOM 0 HD13 LEU A 26 1.148 1.716 -1.168 1.00 0.29 H new ATOM 0 HD21 LEU A 26 -0.571 3.518 -3.007 1.00 0.30 H new ATOM 0 HD22 LEU A 26 -0.175 3.867 -1.307 1.00 0.30 H new ATOM 0 HD23 LEU A 26 0.210 5.057 -2.573 1.00 0.30 H new ATOM 470 N ASN A 27 4.994 5.829 -1.167 1.00 0.24 N ATOM 471 CA ASN A 27 6.015 6.420 -0.261 1.00 0.29 C ATOM 472 C ASN A 27 5.967 7.945 -0.372 1.00 0.25 C ATOM 473 O ASN A 27 5.909 8.649 0.617 1.00 0.25 O ATOM 474 CB ASN A 27 7.407 5.923 -0.663 1.00 0.38 C ATOM 475 CG ASN A 27 8.449 6.486 0.305 1.00 0.49 C ATOM 476 OD1 ASN A 27 8.108 6.952 1.374 1.00 1.22 O ATOM 477 ND2 ASN A 27 9.712 6.463 -0.024 1.00 0.58 N ATOM 0 H ASN A 27 5.359 5.207 -1.888 1.00 0.24 H new ATOM 0 HA ASN A 27 5.807 6.121 0.766 1.00 0.29 H new ATOM 0 HB2 ASN A 27 7.434 4.833 -0.649 1.00 0.38 H new ATOM 0 HB3 ASN A 27 7.636 6.235 -1.682 1.00 0.38 H new ATOM 0 HD21 ASN A 27 10.413 6.836 0.616 1.00 0.58 H new ATOM 0 HD22 ASN A 27 9.998 6.072 -0.921 1.00 0.58 H new ATOM 484 N GLU A 28 5.994 8.463 -1.571 1.00 0.27 N ATOM 485 CA GLU A 28 5.955 9.944 -1.749 1.00 0.28 C ATOM 486 C GLU A 28 4.663 10.510 -1.154 1.00 0.23 C ATOM 487 O GLU A 28 4.661 11.557 -0.538 1.00 0.25 O ATOM 488 CB GLU A 28 6.017 10.277 -3.243 1.00 0.34 C ATOM 489 CG GLU A 28 6.073 11.794 -3.429 1.00 0.40 C ATOM 490 CD GLU A 28 6.226 12.120 -4.914 1.00 1.00 C ATOM 491 OE1 GLU A 28 6.433 11.198 -5.684 1.00 1.70 O ATOM 492 OE2 GLU A 28 6.132 13.287 -5.257 1.00 1.72 O ATOM 0 H GLU A 28 6.041 7.924 -2.436 1.00 0.27 H new ATOM 0 HA GLU A 28 6.808 10.389 -1.236 1.00 0.28 H new ATOM 0 HB2 GLU A 28 6.894 9.813 -3.693 1.00 0.34 H new ATOM 0 HB3 GLU A 28 5.144 9.870 -3.753 1.00 0.34 H new ATOM 0 HG2 GLU A 28 5.166 12.253 -3.037 1.00 0.40 H new ATOM 0 HG3 GLU A 28 6.909 12.209 -2.867 1.00 0.40 H new ATOM 499 N ALA A 29 3.563 9.834 -1.336 1.00 0.22 N ATOM 500 CA ALA A 29 2.276 10.343 -0.783 1.00 0.23 C ATOM 501 C ALA A 29 2.374 10.471 0.742 1.00 0.22 C ATOM 502 O ALA A 29 2.046 11.495 1.308 1.00 0.24 O ATOM 503 CB ALA A 29 1.149 9.374 -1.146 1.00 0.27 C ATOM 0 H ALA A 29 3.499 8.951 -1.843 1.00 0.22 H new ATOM 0 HA ALA A 29 2.066 11.324 -1.208 1.00 0.23 H new ATOM 0 HB1 ALA A 29 0.207 9.744 -0.742 1.00 0.27 H new ATOM 0 HB2 ALA A 29 1.073 9.294 -2.230 1.00 0.27 H new ATOM 0 HB3 ALA A 29 1.363 8.392 -0.724 1.00 0.27 H new ATOM 509 N LEU A 30 2.819 9.444 1.412 1.00 0.22 N ATOM 510 CA LEU A 30 2.929 9.519 2.897 1.00 0.24 C ATOM 511 C LEU A 30 3.910 10.632 3.271 1.00 0.27 C ATOM 512 O LEU A 30 3.678 11.395 4.186 1.00 0.29 O ATOM 513 CB LEU A 30 3.444 8.181 3.433 1.00 0.25 C ATOM 514 CG LEU A 30 2.399 7.083 3.188 1.00 0.24 C ATOM 515 CD1 LEU A 30 3.028 5.721 3.498 1.00 0.29 C ATOM 516 CD2 LEU A 30 1.162 7.301 4.084 1.00 0.24 C ATOM 0 H LEU A 30 3.110 8.559 0.998 1.00 0.22 H new ATOM 0 HA LEU A 30 1.952 9.732 3.331 1.00 0.24 H new ATOM 0 HB2 LEU A 30 4.381 7.919 2.942 1.00 0.25 H new ATOM 0 HB3 LEU A 30 3.655 8.263 4.499 1.00 0.25 H new ATOM 0 HG LEU A 30 2.079 7.119 2.147 1.00 0.24 H new ATOM 0 HD11 LEU A 30 2.294 4.934 3.327 1.00 0.29 H new ATOM 0 HD12 LEU A 30 3.889 5.561 2.849 1.00 0.29 H new ATOM 0 HD13 LEU A 30 3.350 5.697 4.539 1.00 0.29 H new ATOM 0 HD21 LEU A 30 0.433 6.513 3.896 1.00 0.24 H new ATOM 0 HD22 LEU A 30 1.462 7.275 5.131 1.00 0.24 H new ATOM 0 HD23 LEU A 30 0.716 8.270 3.859 1.00 0.24 H new ATOM 528 N GLU A 31 4.996 10.741 2.559 1.00 0.30 N ATOM 529 CA GLU A 31 5.979 11.818 2.862 1.00 0.35 C ATOM 530 C GLU A 31 5.305 13.174 2.678 1.00 0.32 C ATOM 531 O GLU A 31 5.520 14.096 3.439 1.00 0.34 O ATOM 532 CB GLU A 31 7.179 11.706 1.920 1.00 0.40 C ATOM 533 CG GLU A 31 7.993 10.460 2.278 1.00 0.48 C ATOM 534 CD GLU A 31 9.117 10.271 1.257 1.00 1.13 C ATOM 535 OE1 GLU A 31 9.214 11.084 0.353 1.00 1.91 O ATOM 536 OE2 GLU A 31 9.865 9.317 1.401 1.00 1.68 O ATOM 0 H GLU A 31 5.246 10.131 1.780 1.00 0.30 H new ATOM 0 HA GLU A 31 6.326 11.717 3.890 1.00 0.35 H new ATOM 0 HB2 GLU A 31 6.839 11.647 0.886 1.00 0.40 H new ATOM 0 HB3 GLU A 31 7.802 12.596 2.000 1.00 0.40 H new ATOM 0 HG2 GLU A 31 8.411 10.562 3.280 1.00 0.48 H new ATOM 0 HG3 GLU A 31 7.347 9.582 2.290 1.00 0.48 H new ATOM 543 N LEU A 32 4.497 13.306 1.665 1.00 0.29 N ATOM 544 CA LEU A 32 3.817 14.603 1.422 1.00 0.29 C ATOM 545 C LEU A 32 2.960 14.945 2.646 1.00 0.28 C ATOM 546 O LEU A 32 3.030 16.034 3.178 1.00 0.32 O ATOM 547 CB LEU A 32 2.933 14.466 0.172 1.00 0.29 C ATOM 548 CG LEU A 32 2.202 15.785 -0.127 1.00 0.34 C ATOM 549 CD1 LEU A 32 3.216 16.881 -0.492 1.00 0.41 C ATOM 550 CD2 LEU A 32 1.242 15.567 -1.303 1.00 0.38 C ATOM 0 H LEU A 32 4.279 12.569 0.994 1.00 0.29 H new ATOM 0 HA LEU A 32 4.544 15.399 1.262 1.00 0.29 H new ATOM 0 HB2 LEU A 32 3.546 14.183 -0.683 1.00 0.29 H new ATOM 0 HB3 LEU A 32 2.206 13.668 0.321 1.00 0.29 H new ATOM 0 HG LEU A 32 1.646 16.098 0.757 1.00 0.34 H new ATOM 0 HD11 LEU A 32 2.687 17.811 -0.702 1.00 0.41 H new ATOM 0 HD12 LEU A 32 3.902 17.034 0.341 1.00 0.41 H new ATOM 0 HD13 LEU A 32 3.779 16.577 -1.374 1.00 0.41 H new ATOM 0 HD21 LEU A 32 0.719 16.498 -1.523 1.00 0.38 H new ATOM 0 HD22 LEU A 32 1.807 15.253 -2.180 1.00 0.38 H new ATOM 0 HD23 LEU A 32 0.517 14.796 -1.043 1.00 0.38 H new ATOM 562 N LYS A 33 2.153 14.023 3.100 1.00 0.27 N ATOM 563 CA LYS A 33 1.300 14.301 4.294 1.00 0.31 C ATOM 564 C LYS A 33 2.188 14.637 5.496 1.00 0.38 C ATOM 565 O LYS A 33 1.884 15.515 6.279 1.00 0.44 O ATOM 566 CB LYS A 33 0.461 13.063 4.618 1.00 0.33 C ATOM 567 CG LYS A 33 -0.555 13.405 5.713 1.00 0.40 C ATOM 568 CD LYS A 33 -1.323 12.145 6.127 1.00 0.45 C ATOM 569 CE LYS A 33 -2.194 11.648 4.965 1.00 0.77 C ATOM 570 NZ LYS A 33 -3.281 10.780 5.500 1.00 1.56 N ATOM 0 H LYS A 33 2.047 13.092 2.698 1.00 0.27 H new ATOM 0 HA LYS A 33 0.644 15.145 4.080 1.00 0.31 H new ATOM 0 HB2 LYS A 33 -0.056 12.717 3.723 1.00 0.33 H new ATOM 0 HB3 LYS A 33 1.107 12.249 4.948 1.00 0.33 H new ATOM 0 HG2 LYS A 33 -0.043 13.829 6.577 1.00 0.40 H new ATOM 0 HG3 LYS A 33 -1.250 14.163 5.352 1.00 0.40 H new ATOM 0 HD2 LYS A 33 -0.622 11.365 6.425 1.00 0.45 H new ATOM 0 HD3 LYS A 33 -1.948 12.360 6.994 1.00 0.45 H new ATOM 0 HE2 LYS A 33 -2.621 12.495 4.427 1.00 0.77 H new ATOM 0 HE3 LYS A 33 -1.586 11.091 4.252 1.00 0.77 H new ATOM 0 HZ1 LYS A 33 -3.597 10.122 4.759 1.00 1.56 H new ATOM 0 HZ2 LYS A 33 -2.925 10.239 6.314 1.00 1.56 H new ATOM 0 HZ3 LYS A 33 -4.081 11.372 5.801 1.00 1.56 H new ATOM 584 N ASP A 34 3.282 13.941 5.649 1.00 0.42 N ATOM 585 CA ASP A 34 4.191 14.212 6.800 1.00 0.51 C ATOM 586 C ASP A 34 4.689 15.657 6.728 1.00 0.51 C ATOM 587 O ASP A 34 4.802 16.341 7.728 1.00 0.59 O ATOM 588 CB ASP A 34 5.381 13.252 6.744 1.00 0.58 C ATOM 589 CG ASP A 34 4.904 11.835 7.071 1.00 0.67 C ATOM 590 OD1 ASP A 34 3.815 11.709 7.605 1.00 1.43 O ATOM 591 OD2 ASP A 34 5.636 10.903 6.783 1.00 1.14 O ATOM 0 H ASP A 34 3.586 13.194 5.025 1.00 0.42 H new ATOM 0 HA ASP A 34 3.651 14.064 7.735 1.00 0.51 H new ATOM 0 HB2 ASP A 34 5.836 13.275 5.754 1.00 0.58 H new ATOM 0 HB3 ASP A 34 6.147 13.563 7.454 1.00 0.58 H new ATOM 596 N ALA A 35 4.988 16.127 5.549 1.00 0.49 N ATOM 597 CA ALA A 35 5.483 17.524 5.399 1.00 0.56 C ATOM 598 C ALA A 35 4.422 18.501 5.904 1.00 0.56 C ATOM 599 O ALA A 35 4.729 19.499 6.526 1.00 0.66 O ATOM 600 CB ALA A 35 5.771 17.802 3.924 1.00 0.64 C ATOM 0 H ALA A 35 4.910 15.601 4.679 1.00 0.49 H new ATOM 0 HA ALA A 35 6.396 17.651 5.981 1.00 0.56 H new ATOM 0 HB1 ALA A 35 6.133 18.824 3.810 1.00 0.64 H new ATOM 0 HB2 ALA A 35 6.529 17.106 3.564 1.00 0.64 H new ATOM 0 HB3 ALA A 35 4.857 17.675 3.345 1.00 0.64 H new ATOM 606 N GLN A 36 3.174 18.225 5.645 1.00 0.53 N ATOM 607 CA GLN A 36 2.099 19.141 6.117 1.00 0.62 C ATOM 608 C GLN A 36 1.820 18.879 7.600 1.00 0.68 C ATOM 609 O GLN A 36 1.131 19.634 8.255 1.00 0.88 O ATOM 610 CB GLN A 36 0.822 18.894 5.306 1.00 0.64 C ATOM 611 CG GLN A 36 1.019 19.390 3.871 1.00 0.97 C ATOM 612 CD GLN A 36 -0.257 19.143 3.061 1.00 0.84 C ATOM 613 OE1 GLN A 36 -0.161 18.715 1.833 1.00 1.18 O flip ATOM 614 NE2 GLN A 36 -1.352 19.330 3.556 1.00 0.68 N flip ATOM 0 H GLN A 36 2.853 17.407 5.128 1.00 0.53 H new ATOM 0 HA GLN A 36 2.419 20.174 5.984 1.00 0.62 H new ATOM 0 HB2 GLN A 36 0.581 17.831 5.304 1.00 0.64 H new ATOM 0 HB3 GLN A 36 -0.019 19.411 5.768 1.00 0.64 H new ATOM 0 HG2 GLN A 36 1.260 20.453 3.873 1.00 0.97 H new ATOM 0 HG3 GLN A 36 1.860 18.873 3.409 1.00 0.97 H new ATOM 0 HE21 GLN A 36 -1.427 19.665 4.517 1.00 0.68 H new ATOM 0 HE22 GLN A 36 -2.195 19.152 3.011 1.00 0.68 H new ATOM 623 N ALA A 37 2.355 17.816 8.136 1.00 0.70 N ATOM 624 CA ALA A 37 2.125 17.507 9.575 1.00 0.83 C ATOM 625 C ALA A 37 2.866 18.523 10.446 1.00 0.91 C ATOM 626 O ALA A 37 2.581 18.681 11.617 1.00 1.23 O ATOM 627 CB ALA A 37 2.638 16.099 9.878 1.00 1.02 C ATOM 0 H ALA A 37 2.943 17.147 7.638 1.00 0.70 H new ATOM 0 HA ALA A 37 1.058 17.561 9.792 1.00 0.83 H new ATOM 0 HB1 ALA A 37 2.471 15.870 10.930 1.00 1.02 H new ATOM 0 HB2 ALA A 37 2.105 15.377 9.260 1.00 1.02 H new ATOM 0 HB3 ALA A 37 3.705 16.046 9.660 1.00 1.02 H new ATOM 633 N GLY A 38 3.816 19.215 9.881 1.00 1.03 N ATOM 634 CA GLY A 38 4.577 20.223 10.673 1.00 1.23 C ATOM 635 C GLY A 38 3.702 21.454 10.912 1.00 1.19 C ATOM 636 O GLY A 38 4.182 22.569 10.959 1.00 1.54 O ATOM 0 H GLY A 38 4.099 19.127 8.905 1.00 1.03 H new ATOM 0 HA2 GLY A 38 4.886 19.794 11.626 1.00 1.23 H new ATOM 0 HA3 GLY A 38 5.485 20.507 10.142 1.00 1.23 H new ATOM 640 N LYS A 39 2.417 21.265 11.058 1.00 1.33 N ATOM 641 CA LYS A 39 1.510 22.426 11.288 1.00 1.54 C ATOM 642 C LYS A 39 1.463 22.740 12.786 1.00 1.98 C ATOM 643 O LYS A 39 2.046 23.700 13.248 1.00 2.51 O ATOM 644 CB LYS A 39 0.104 22.059 10.790 1.00 1.88 C ATOM 645 CG LYS A 39 -0.878 23.229 10.986 1.00 2.25 C ATOM 646 CD LYS A 39 -0.492 24.403 10.073 1.00 2.96 C ATOM 647 CE LYS A 39 -1.689 25.342 9.903 1.00 3.50 C ATOM 648 NZ LYS A 39 -1.329 26.433 8.954 1.00 4.18 N ATOM 0 H LYS A 39 1.957 20.355 11.028 1.00 1.33 H new ATOM 0 HA LYS A 39 1.874 23.301 10.750 1.00 1.54 H new ATOM 0 HB2 LYS A 39 0.148 21.790 9.735 1.00 1.88 H new ATOM 0 HB3 LYS A 39 -0.258 21.183 11.328 1.00 1.88 H new ATOM 0 HG2 LYS A 39 -1.894 22.903 10.762 1.00 2.25 H new ATOM 0 HG3 LYS A 39 -0.869 23.550 12.028 1.00 2.25 H new ATOM 0 HD2 LYS A 39 0.351 24.947 10.501 1.00 2.96 H new ATOM 0 HD3 LYS A 39 -0.170 24.029 9.101 1.00 2.96 H new ATOM 0 HE2 LYS A 39 -2.550 24.788 9.528 1.00 3.50 H new ATOM 0 HE3 LYS A 39 -1.975 25.763 10.867 1.00 3.50 H new ATOM 0 HZ1 LYS A 39 -2.141 27.073 8.836 1.00 4.18 H new ATOM 0 HZ2 LYS A 39 -0.519 26.967 9.329 1.00 4.18 H new ATOM 0 HZ3 LYS A 39 -1.076 26.022 8.033 1.00 4.18 H new ATOM 662 N GLU A 40 0.770 21.938 13.548 1.00 2.43 N ATOM 663 CA GLU A 40 0.680 22.195 15.014 1.00 3.19 C ATOM 664 C GLU A 40 2.104 22.188 15.618 1.00 3.44 C ATOM 665 O GLU A 40 2.952 21.465 15.137 1.00 3.47 O ATOM 666 CB GLU A 40 -0.160 21.089 15.660 1.00 3.91 C ATOM 667 CG GLU A 40 -1.505 20.987 14.940 1.00 4.53 C ATOM 668 CD GLU A 40 -2.390 19.963 15.652 1.00 5.25 C ATOM 669 OE1 GLU A 40 -3.006 20.328 16.639 1.00 5.65 O ATOM 670 OE2 GLU A 40 -2.434 18.830 15.200 1.00 5.71 O ATOM 0 H GLU A 40 0.263 21.117 13.219 1.00 2.43 H new ATOM 0 HA GLU A 40 0.214 23.163 15.198 1.00 3.19 H new ATOM 0 HB2 GLU A 40 0.368 20.137 15.605 1.00 3.91 H new ATOM 0 HB3 GLU A 40 -0.316 21.306 16.717 1.00 3.91 H new ATOM 0 HG2 GLU A 40 -1.996 21.960 14.926 1.00 4.53 H new ATOM 0 HG3 GLU A 40 -1.352 20.692 13.902 1.00 4.53 H new ATOM 677 N PRO A 41 2.347 22.976 16.658 1.00 4.08 N ATOM 678 CA PRO A 41 3.684 23.014 17.292 1.00 4.74 C ATOM 679 C PRO A 41 4.028 21.643 17.904 1.00 4.92 C ATOM 680 O PRO A 41 4.995 21.509 18.626 1.00 4.94 O ATOM 681 CB PRO A 41 3.572 24.097 18.393 1.00 5.61 C ATOM 682 CG PRO A 41 2.074 24.499 18.494 1.00 5.57 C ATOM 683 CD PRO A 41 1.348 23.881 17.278 1.00 4.60 C ATOM 0 HA PRO A 41 4.475 23.241 16.577 1.00 4.74 H new ATOM 0 HB2 PRO A 41 3.932 23.713 19.348 1.00 5.61 H new ATOM 0 HB3 PRO A 41 4.186 24.962 18.145 1.00 5.61 H new ATOM 0 HG2 PRO A 41 1.641 24.135 19.426 1.00 5.57 H new ATOM 0 HG3 PRO A 41 1.967 25.584 18.495 1.00 5.57 H new ATOM 0 HD2 PRO A 41 0.457 23.334 17.586 1.00 4.60 H new ATOM 0 HD3 PRO A 41 1.024 24.651 16.578 1.00 4.60 H new ATOM 691 N GLY A 42 3.249 20.633 17.629 1.00 5.45 N ATOM 692 CA GLY A 42 3.547 19.290 18.207 1.00 5.95 C ATOM 693 C GLY A 42 4.767 18.689 17.506 1.00 6.77 C ATOM 694 O GLY A 42 5.094 19.153 16.426 1.00 7.24 O ATOM 695 OXT GLY A 42 5.356 17.776 18.063 1.00 7.15 O ATOM 0 H GLY A 42 2.423 20.678 17.032 1.00 5.45 H new ATOM 0 HA2 GLY A 42 3.736 19.377 19.277 1.00 5.95 H new ATOM 0 HA3 GLY A 42 2.686 18.632 18.088 1.00 5.95 H new TER 699 GLY A 42 ATOM 700 N LYS B 1 -13.371 27.648 -14.434 1.00 4.80 N ATOM 701 CA LYS B 1 -13.022 27.244 -13.042 1.00 4.31 C ATOM 702 C LYS B 1 -14.257 26.663 -12.353 1.00 3.72 C ATOM 703 O LYS B 1 -15.240 26.339 -12.989 1.00 3.65 O ATOM 704 CB LYS B 1 -12.535 28.467 -12.268 1.00 4.65 C ATOM 705 CG LYS B 1 -11.173 28.892 -12.813 1.00 5.14 C ATOM 706 CD LYS B 1 -10.671 30.117 -12.047 1.00 5.90 C ATOM 707 CE LYS B 1 -9.309 30.540 -12.599 1.00 6.52 C ATOM 708 NZ LYS B 1 -8.899 31.833 -11.980 1.00 7.34 N ATOM 0 H1 LYS B 1 -12.694 27.223 -15.099 1.00 4.80 H new ATOM 0 H2 LYS B 1 -14.332 27.320 -14.660 1.00 4.80 H new ATOM 0 H3 LYS B 1 -13.331 28.684 -14.515 1.00 4.80 H new ATOM 0 HA LYS B 1 -12.235 26.491 -13.068 1.00 4.31 H new ATOM 0 HB2 LYS B 1 -13.251 29.283 -12.365 1.00 4.65 H new ATOM 0 HB3 LYS B 1 -12.459 28.234 -11.206 1.00 4.65 H new ATOM 0 HG2 LYS B 1 -10.460 28.073 -12.716 1.00 5.14 H new ATOM 0 HG3 LYS B 1 -11.251 29.122 -13.875 1.00 5.14 H new ATOM 0 HD2 LYS B 1 -11.384 30.936 -12.142 1.00 5.90 H new ATOM 0 HD3 LYS B 1 -10.589 29.887 -10.985 1.00 5.90 H new ATOM 0 HE2 LYS B 1 -8.565 29.772 -12.388 1.00 6.52 H new ATOM 0 HE3 LYS B 1 -9.361 30.644 -13.683 1.00 6.52 H new ATOM 0 HZ1 LYS B 1 -7.973 32.120 -12.356 1.00 7.34 H new ATOM 0 HZ2 LYS B 1 -9.604 32.564 -12.203 1.00 7.34 H new ATOM 0 HZ3 LYS B 1 -8.833 31.719 -10.948 1.00 7.34 H new ATOM 724 N LYS B 2 -14.214 26.532 -11.055 1.00 3.81 N ATOM 725 CA LYS B 2 -15.383 25.970 -10.320 1.00 3.78 C ATOM 726 C LYS B 2 -15.845 24.679 -11.003 1.00 3.34 C ATOM 727 O LYS B 2 -15.255 24.228 -11.966 1.00 3.67 O ATOM 728 CB LYS B 2 -16.528 26.986 -10.327 1.00 4.17 C ATOM 729 CG LYS B 2 -16.136 28.208 -9.496 1.00 4.95 C ATOM 730 CD LYS B 2 -17.282 29.221 -9.505 1.00 5.76 C ATOM 731 CE LYS B 2 -16.887 30.442 -8.673 1.00 6.50 C ATOM 732 NZ LYS B 2 -16.851 30.070 -7.230 1.00 7.17 N ATOM 0 H LYS B 2 -13.419 26.790 -10.471 1.00 3.81 H new ATOM 0 HA LYS B 2 -15.094 25.754 -9.292 1.00 3.78 H new ATOM 0 HB2 LYS B 2 -16.754 27.287 -11.350 1.00 4.17 H new ATOM 0 HB3 LYS B 2 -17.432 26.533 -9.921 1.00 4.17 H new ATOM 0 HG2 LYS B 2 -15.910 27.908 -8.473 1.00 4.95 H new ATOM 0 HG3 LYS B 2 -15.232 28.662 -9.902 1.00 4.95 H new ATOM 0 HD2 LYS B 2 -17.508 29.522 -10.528 1.00 5.76 H new ATOM 0 HD3 LYS B 2 -18.186 28.767 -9.099 1.00 5.76 H new ATOM 0 HE2 LYS B 2 -15.911 30.810 -8.989 1.00 6.50 H new ATOM 0 HE3 LYS B 2 -17.600 31.251 -8.833 1.00 6.50 H new ATOM 0 HZ1 LYS B 2 -16.853 30.933 -6.649 1.00 7.17 H new ATOM 0 HZ2 LYS B 2 -17.686 29.495 -6.999 1.00 7.17 H new ATOM 0 HZ3 LYS B 2 -15.989 29.523 -7.034 1.00 7.17 H new ATOM 746 N LYS B 3 -16.893 24.077 -10.511 1.00 3.01 N ATOM 747 CA LYS B 3 -17.392 22.813 -11.128 1.00 2.79 C ATOM 748 C LYS B 3 -16.230 21.826 -11.328 1.00 2.47 C ATOM 749 O LYS B 3 -15.954 21.435 -12.445 1.00 2.58 O ATOM 750 CB LYS B 3 -18.021 23.120 -12.491 1.00 3.32 C ATOM 751 CG LYS B 3 -19.236 24.030 -12.307 1.00 3.99 C ATOM 752 CD LYS B 3 -19.762 24.452 -13.679 1.00 4.75 C ATOM 753 CE LYS B 3 -21.029 25.288 -13.500 1.00 5.66 C ATOM 754 NZ LYS B 3 -20.686 26.548 -12.782 1.00 6.44 N ATOM 0 H LYS B 3 -17.427 24.406 -9.707 1.00 3.01 H new ATOM 0 HA LYS B 3 -18.135 22.370 -10.465 1.00 2.79 H new ATOM 0 HB2 LYS B 3 -17.289 23.602 -13.139 1.00 3.32 H new ATOM 0 HB3 LYS B 3 -18.320 22.193 -12.981 1.00 3.32 H new ATOM 0 HG2 LYS B 3 -20.015 23.508 -11.751 1.00 3.99 H new ATOM 0 HG3 LYS B 3 -18.962 24.909 -11.724 1.00 3.99 H new ATOM 0 HD2 LYS B 3 -19.004 25.028 -14.210 1.00 4.75 H new ATOM 0 HD3 LYS B 3 -19.976 23.572 -14.285 1.00 4.75 H new ATOM 0 HE2 LYS B 3 -21.469 25.516 -14.471 1.00 5.66 H new ATOM 0 HE3 LYS B 3 -21.774 24.726 -12.937 1.00 5.66 H new ATOM 0 HZ1 LYS B 3 -21.438 27.250 -12.934 1.00 6.44 H new ATOM 0 HZ2 LYS B 3 -20.595 26.354 -11.764 1.00 6.44 H new ATOM 0 HZ3 LYS B 3 -19.786 26.921 -13.146 1.00 6.44 H new ATOM 768 N PRO B 4 -15.575 21.443 -10.251 1.00 2.86 N ATOM 769 CA PRO B 4 -14.446 20.496 -10.337 1.00 3.29 C ATOM 770 C PRO B 4 -14.937 19.155 -10.909 1.00 2.77 C ATOM 771 O PRO B 4 -16.092 18.804 -10.786 1.00 2.72 O ATOM 772 CB PRO B 4 -13.943 20.345 -8.880 1.00 4.33 C ATOM 773 CG PRO B 4 -14.899 21.167 -7.965 1.00 4.54 C ATOM 774 CD PRO B 4 -15.898 21.910 -8.883 1.00 3.60 C ATOM 0 HA PRO B 4 -13.649 20.840 -10.996 1.00 3.29 H new ATOM 0 HB2 PRO B 4 -13.937 19.296 -8.584 1.00 4.33 H new ATOM 0 HB3 PRO B 4 -12.919 20.708 -8.789 1.00 4.33 H new ATOM 0 HG2 PRO B 4 -15.428 20.510 -7.275 1.00 4.54 H new ATOM 0 HG3 PRO B 4 -14.334 21.876 -7.360 1.00 4.54 H new ATOM 0 HD2 PRO B 4 -16.929 21.675 -8.618 1.00 3.60 H new ATOM 0 HD3 PRO B 4 -15.785 22.991 -8.797 1.00 3.60 H new ATOM 782 N LEU B 5 -14.066 18.404 -11.533 1.00 2.68 N ATOM 783 CA LEU B 5 -14.493 17.091 -12.105 1.00 2.36 C ATOM 784 C LEU B 5 -14.506 16.049 -10.987 1.00 1.75 C ATOM 785 O LEU B 5 -13.522 15.849 -10.302 1.00 1.86 O ATOM 786 CB LEU B 5 -13.503 16.648 -13.190 1.00 2.90 C ATOM 787 CG LEU B 5 -13.440 17.690 -14.313 1.00 3.63 C ATOM 788 CD1 LEU B 5 -12.328 17.301 -15.292 1.00 4.32 C ATOM 789 CD2 LEU B 5 -14.784 17.754 -15.061 1.00 3.80 C ATOM 0 H LEU B 5 -13.083 18.641 -11.671 1.00 2.68 H new ATOM 0 HA LEU B 5 -15.486 17.190 -12.543 1.00 2.36 H new ATOM 0 HB2 LEU B 5 -12.513 16.513 -12.755 1.00 2.90 H new ATOM 0 HB3 LEU B 5 -13.807 15.683 -13.597 1.00 2.90 H new ATOM 0 HG LEU B 5 -13.233 18.670 -13.882 1.00 3.63 H new ATOM 0 HD11 LEU B 5 -12.276 18.037 -16.094 1.00 4.32 H new ATOM 0 HD12 LEU B 5 -11.374 17.270 -14.765 1.00 4.32 H new ATOM 0 HD13 LEU B 5 -12.542 16.319 -15.714 1.00 4.32 H new ATOM 0 HD21 LEU B 5 -14.723 18.498 -15.855 1.00 3.80 H new ATOM 0 HD22 LEU B 5 -15.006 16.779 -15.494 1.00 3.80 H new ATOM 0 HD23 LEU B 5 -15.575 18.031 -14.364 1.00 3.80 H new ATOM 801 N ASP B 6 -15.610 15.382 -10.794 1.00 1.48 N ATOM 802 CA ASP B 6 -15.678 14.357 -9.716 1.00 1.30 C ATOM 803 C ASP B 6 -15.048 13.051 -10.211 1.00 1.04 C ATOM 804 O ASP B 6 -15.476 12.480 -11.194 1.00 1.01 O ATOM 805 CB ASP B 6 -17.142 14.109 -9.350 1.00 1.74 C ATOM 806 CG ASP B 6 -17.707 15.335 -8.629 1.00 2.06 C ATOM 807 OD1 ASP B 6 -16.919 16.123 -8.132 1.00 2.39 O ATOM 808 OD2 ASP B 6 -18.919 15.462 -8.582 1.00 2.47 O ATOM 0 H ASP B 6 -16.466 15.502 -11.335 1.00 1.48 H new ATOM 0 HA ASP B 6 -15.135 14.711 -8.840 1.00 1.30 H new ATOM 0 HB2 ASP B 6 -17.722 13.904 -10.250 1.00 1.74 H new ATOM 0 HB3 ASP B 6 -17.223 13.230 -8.711 1.00 1.74 H new ATOM 813 N GLY B 7 -14.042 12.570 -9.534 1.00 0.95 N ATOM 814 CA GLY B 7 -13.397 11.297 -9.967 1.00 0.81 C ATOM 815 C GLY B 7 -14.315 10.126 -9.617 1.00 0.65 C ATOM 816 O GLY B 7 -15.026 10.158 -8.632 1.00 0.63 O ATOM 0 H GLY B 7 -13.639 13.001 -8.702 1.00 0.95 H new ATOM 0 HA2 GLY B 7 -13.207 11.318 -11.040 1.00 0.81 H new ATOM 0 HA3 GLY B 7 -12.432 11.178 -9.475 1.00 0.81 H new ATOM 820 N GLU B 8 -14.312 9.094 -10.414 1.00 0.61 N ATOM 821 CA GLU B 8 -15.192 7.929 -10.118 1.00 0.53 C ATOM 822 C GLU B 8 -14.814 7.351 -8.755 1.00 0.47 C ATOM 823 O GLU B 8 -13.655 7.122 -8.470 1.00 0.46 O ATOM 824 CB GLU B 8 -15.006 6.859 -11.197 1.00 0.61 C ATOM 825 CG GLU B 8 -15.579 7.366 -12.522 1.00 0.71 C ATOM 826 CD GLU B 8 -15.320 6.337 -13.625 1.00 0.97 C ATOM 827 OE1 GLU B 8 -14.284 6.430 -14.262 1.00 1.61 O ATOM 828 OE2 GLU B 8 -16.164 5.477 -13.817 1.00 1.58 O ATOM 0 H GLU B 8 -13.741 9.007 -11.254 1.00 0.61 H new ATOM 0 HA GLU B 8 -16.234 8.249 -10.106 1.00 0.53 H new ATOM 0 HB2 GLU B 8 -13.948 6.624 -11.312 1.00 0.61 H new ATOM 0 HB3 GLU B 8 -15.507 5.937 -10.901 1.00 0.61 H new ATOM 0 HG2 GLU B 8 -16.650 7.544 -12.422 1.00 0.71 H new ATOM 0 HG3 GLU B 8 -15.121 8.319 -12.786 1.00 0.71 H new ATOM 835 N TYR B 9 -15.786 7.116 -7.911 1.00 0.43 N ATOM 836 CA TYR B 9 -15.504 6.553 -6.553 1.00 0.39 C ATOM 837 C TYR B 9 -15.975 5.096 -6.495 1.00 0.37 C ATOM 838 O TYR B 9 -16.969 4.735 -7.092 1.00 0.41 O ATOM 839 CB TYR B 9 -16.261 7.372 -5.506 1.00 0.41 C ATOM 840 CG TYR B 9 -15.754 8.796 -5.513 1.00 0.44 C ATOM 841 CD1 TYR B 9 -14.668 9.161 -4.696 1.00 0.43 C ATOM 842 CD2 TYR B 9 -16.369 9.759 -6.339 1.00 0.49 C ATOM 843 CE1 TYR B 9 -14.194 10.486 -4.704 1.00 0.47 C ATOM 844 CE2 TYR B 9 -15.895 11.085 -6.346 1.00 0.53 C ATOM 845 CZ TYR B 9 -14.809 11.449 -5.528 1.00 0.52 C ATOM 846 OH TYR B 9 -14.343 12.748 -5.537 1.00 0.57 O ATOM 0 H TYR B 9 -16.772 7.291 -8.105 1.00 0.43 H new ATOM 0 HA TYR B 9 -14.433 6.596 -6.353 1.00 0.39 H new ATOM 0 HB2 TYR B 9 -17.330 7.355 -5.719 1.00 0.41 H new ATOM 0 HB3 TYR B 9 -16.126 6.932 -4.518 1.00 0.41 H new ATOM 0 HD1 TYR B 9 -14.198 8.424 -4.062 1.00 0.43 H new ATOM 0 HD2 TYR B 9 -17.203 9.480 -6.966 1.00 0.49 H new ATOM 0 HE1 TYR B 9 -13.359 10.765 -4.078 1.00 0.47 H new ATOM 0 HE2 TYR B 9 -16.365 11.823 -6.979 1.00 0.53 H new ATOM 0 HH TYR B 9 -14.877 13.283 -6.160 1.00 0.57 H new ATOM 856 N PHE B 10 -15.267 4.255 -5.775 1.00 0.34 N ATOM 857 CA PHE B 10 -15.671 2.816 -5.667 1.00 0.34 C ATOM 858 C PHE B 10 -15.553 2.360 -4.211 1.00 0.31 C ATOM 859 O PHE B 10 -14.608 2.689 -3.522 1.00 0.32 O ATOM 860 CB PHE B 10 -14.747 1.957 -6.536 1.00 0.35 C ATOM 861 CG PHE B 10 -14.964 2.298 -7.988 1.00 0.39 C ATOM 862 CD1 PHE B 10 -15.935 1.610 -8.740 1.00 0.46 C ATOM 863 CD2 PHE B 10 -14.198 3.314 -8.589 1.00 0.42 C ATOM 864 CE1 PHE B 10 -16.139 1.937 -10.094 1.00 0.52 C ATOM 865 CE2 PHE B 10 -14.402 3.642 -9.941 1.00 0.49 C ATOM 866 CZ PHE B 10 -15.372 2.954 -10.696 1.00 0.53 C ATOM 0 H PHE B 10 -14.425 4.505 -5.257 1.00 0.34 H new ATOM 0 HA PHE B 10 -16.701 2.706 -6.006 1.00 0.34 H new ATOM 0 HB2 PHE B 10 -13.706 2.131 -6.262 1.00 0.35 H new ATOM 0 HB3 PHE B 10 -14.949 0.900 -6.365 1.00 0.35 H new ATOM 0 HD1 PHE B 10 -16.524 0.831 -8.278 1.00 0.46 H new ATOM 0 HD2 PHE B 10 -13.453 3.842 -8.012 1.00 0.42 H new ATOM 0 HE1 PHE B 10 -16.883 1.408 -10.671 1.00 0.52 H new ATOM 0 HE2 PHE B 10 -13.814 4.422 -10.401 1.00 0.49 H new ATOM 0 HZ PHE B 10 -15.527 3.206 -11.735 1.00 0.53 H new ATOM 876 N THR B 11 -16.500 1.593 -3.740 1.00 0.31 N ATOM 877 CA THR B 11 -16.440 1.100 -2.333 1.00 0.31 C ATOM 878 C THR B 11 -15.653 -0.209 -2.303 1.00 0.32 C ATOM 879 O THR B 11 -15.640 -0.951 -3.263 1.00 0.36 O ATOM 880 CB THR B 11 -17.859 0.859 -1.815 1.00 0.34 C ATOM 881 OG1 THR B 11 -18.502 -0.106 -2.633 1.00 0.37 O ATOM 882 CG2 THR B 11 -18.646 2.171 -1.849 1.00 0.38 C ATOM 0 H THR B 11 -17.315 1.286 -4.271 1.00 0.31 H new ATOM 0 HA THR B 11 -15.950 1.840 -1.700 1.00 0.31 H new ATOM 0 HB THR B 11 -17.816 0.493 -0.789 1.00 0.34 H new ATOM 0 HG1 THR B 11 -19.411 -0.263 -2.301 1.00 0.37 H new ATOM 0 HG21 THR B 11 -19.657 1.999 -1.480 1.00 0.38 H new ATOM 0 HG22 THR B 11 -18.150 2.909 -1.218 1.00 0.38 H new ATOM 0 HG23 THR B 11 -18.692 2.541 -2.873 1.00 0.38 H new ATOM 890 N LEU B 12 -14.994 -0.501 -1.212 1.00 0.28 N ATOM 891 CA LEU B 12 -14.199 -1.765 -1.132 1.00 0.30 C ATOM 892 C LEU B 12 -14.244 -2.313 0.295 1.00 0.28 C ATOM 893 O LEU B 12 -14.014 -1.600 1.251 1.00 0.27 O ATOM 894 CB LEU B 12 -12.744 -1.467 -1.518 1.00 0.30 C ATOM 895 CG LEU B 12 -11.889 -2.744 -1.447 1.00 0.31 C ATOM 896 CD1 LEU B 12 -12.427 -3.799 -2.428 1.00 0.36 C ATOM 897 CD2 LEU B 12 -10.442 -2.391 -1.810 1.00 0.34 C ATOM 0 H LEU B 12 -14.971 0.079 -0.374 1.00 0.28 H new ATOM 0 HA LEU B 12 -14.619 -2.504 -1.814 1.00 0.30 H new ATOM 0 HB2 LEU B 12 -12.707 -1.055 -2.526 1.00 0.30 H new ATOM 0 HB3 LEU B 12 -12.333 -0.711 -0.849 1.00 0.30 H new ATOM 0 HG LEU B 12 -11.931 -3.154 -0.438 1.00 0.31 H new ATOM 0 HD11 LEU B 12 -11.813 -4.698 -2.368 1.00 0.36 H new ATOM 0 HD12 LEU B 12 -13.457 -4.045 -2.169 1.00 0.36 H new ATOM 0 HD13 LEU B 12 -12.393 -3.403 -3.443 1.00 0.36 H new ATOM 0 HD21 LEU B 12 -9.826 -3.289 -1.763 1.00 0.34 H new ATOM 0 HD22 LEU B 12 -10.410 -1.981 -2.819 1.00 0.34 H new ATOM 0 HD23 LEU B 12 -10.060 -1.652 -1.106 1.00 0.34 H new ATOM 909 N GLN B 13 -14.525 -3.579 0.441 1.00 0.31 N ATOM 910 CA GLN B 13 -14.570 -4.184 1.803 1.00 0.32 C ATOM 911 C GLN B 13 -13.145 -4.563 2.216 1.00 0.32 C ATOM 912 O GLN B 13 -12.428 -5.201 1.471 1.00 0.34 O ATOM 913 CB GLN B 13 -15.456 -5.431 1.770 1.00 0.36 C ATOM 914 CG GLN B 13 -15.662 -5.946 3.193 1.00 0.42 C ATOM 915 CD GLN B 13 -16.647 -7.114 3.174 1.00 0.62 C ATOM 916 OE1 GLN B 13 -17.367 -7.335 4.129 1.00 1.36 O ATOM 917 NE2 GLN B 13 -16.722 -7.870 2.113 1.00 0.59 N ATOM 0 H GLN B 13 -14.726 -4.222 -0.325 1.00 0.31 H new ATOM 0 HA GLN B 13 -14.982 -3.475 2.521 1.00 0.32 H new ATOM 0 HB2 GLN B 13 -16.418 -5.195 1.314 1.00 0.36 H new ATOM 0 HB3 GLN B 13 -14.993 -6.203 1.156 1.00 0.36 H new ATOM 0 HG2 GLN B 13 -14.710 -6.266 3.617 1.00 0.42 H new ATOM 0 HG3 GLN B 13 -16.042 -5.146 3.829 1.00 0.42 H new ATOM 0 HE21 GLN B 13 -16.119 -7.685 1.312 1.00 0.59 H new ATOM 0 HE22 GLN B 13 -17.384 -8.645 2.085 1.00 0.59 H new ATOM 926 N ILE B 14 -12.723 -4.154 3.391 1.00 0.32 N ATOM 927 CA ILE B 14 -11.331 -4.463 3.860 1.00 0.34 C ATOM 928 C ILE B 14 -11.384 -5.281 5.154 1.00 0.35 C ATOM 929 O ILE B 14 -11.925 -4.852 6.154 1.00 0.37 O ATOM 930 CB ILE B 14 -10.601 -3.143 4.107 1.00 0.36 C ATOM 931 CG1 ILE B 14 -10.564 -2.357 2.789 1.00 0.34 C ATOM 932 CG2 ILE B 14 -9.171 -3.420 4.583 1.00 0.49 C ATOM 933 CD1 ILE B 14 -10.068 -0.927 3.029 1.00 0.39 C ATOM 0 H ILE B 14 -13.286 -3.616 4.049 1.00 0.32 H new ATOM 0 HA ILE B 14 -10.804 -5.046 3.105 1.00 0.34 H new ATOM 0 HB ILE B 14 -11.119 -2.568 4.874 1.00 0.36 H new ATOM 0 HG12 ILE B 14 -9.910 -2.860 2.077 1.00 0.34 H new ATOM 0 HG13 ILE B 14 -11.559 -2.333 2.345 1.00 0.34 H new ATOM 0 HG21 ILE B 14 -8.656 -2.475 4.757 1.00 0.49 H new ATOM 0 HG22 ILE B 14 -9.201 -3.993 5.510 1.00 0.49 H new ATOM 0 HG23 ILE B 14 -8.638 -3.989 3.821 1.00 0.49 H new ATOM 0 HD11 ILE B 14 -10.048 -0.385 2.083 1.00 0.39 H new ATOM 0 HD12 ILE B 14 -10.739 -0.421 3.723 1.00 0.39 H new ATOM 0 HD13 ILE B 14 -9.063 -0.956 3.451 1.00 0.39 H new ATOM 945 N ARG B 15 -10.823 -6.459 5.136 1.00 0.36 N ATOM 946 CA ARG B 15 -10.829 -7.323 6.352 1.00 0.40 C ATOM 947 C ARG B 15 -9.816 -6.800 7.382 1.00 0.41 C ATOM 948 O ARG B 15 -8.740 -6.350 7.041 1.00 0.43 O ATOM 949 CB ARG B 15 -10.464 -8.753 5.940 1.00 0.44 C ATOM 950 CG ARG B 15 -10.498 -9.681 7.158 1.00 0.46 C ATOM 951 CD ARG B 15 -10.131 -11.096 6.717 1.00 0.93 C ATOM 952 NE ARG B 15 -10.378 -12.058 7.844 1.00 1.07 N ATOM 953 CZ ARG B 15 -9.764 -11.944 8.990 1.00 1.50 C ATOM 954 NH1 ARG B 15 -8.810 -11.069 9.147 1.00 2.10 N ATOM 955 NH2 ARG B 15 -10.073 -12.743 9.974 1.00 2.10 N ATOM 0 H ARG B 15 -10.357 -6.864 4.324 1.00 0.36 H new ATOM 0 HA ARG B 15 -11.820 -7.308 6.807 1.00 0.40 H new ATOM 0 HB2 ARG B 15 -11.162 -9.110 5.182 1.00 0.44 H new ATOM 0 HB3 ARG B 15 -9.471 -8.767 5.491 1.00 0.44 H new ATOM 0 HG2 ARG B 15 -9.799 -9.331 7.918 1.00 0.46 H new ATOM 0 HG3 ARG B 15 -11.490 -9.673 7.610 1.00 0.46 H new ATOM 0 HD2 ARG B 15 -10.722 -11.381 5.847 1.00 0.93 H new ATOM 0 HD3 ARG B 15 -9.084 -11.134 6.417 1.00 0.93 H new ATOM 0 HE ARG B 15 -11.043 -12.820 7.710 1.00 1.07 H new ATOM 0 HH11 ARG B 15 -8.538 -10.466 8.370 1.00 2.10 H new ATOM 0 HH12 ARG B 15 -8.336 -10.987 10.046 1.00 2.10 H new ATOM 0 HH21 ARG B 15 -10.793 -13.454 9.847 1.00 2.10 H new ATOM 0 HH22 ARG B 15 -9.595 -12.656 10.871 1.00 2.10 H new ATOM 969 N GLY B 16 -10.152 -6.876 8.645 1.00 0.42 N ATOM 970 CA GLY B 16 -9.216 -6.407 9.714 1.00 0.44 C ATOM 971 C GLY B 16 -9.416 -4.912 9.975 1.00 0.41 C ATOM 972 O GLY B 16 -9.234 -4.090 9.100 1.00 0.39 O ATOM 0 H GLY B 16 -11.040 -7.245 8.984 1.00 0.42 H new ATOM 0 HA2 GLY B 16 -9.389 -6.970 10.631 1.00 0.44 H new ATOM 0 HA3 GLY B 16 -8.185 -6.596 9.414 1.00 0.44 H new ATOM 976 N ARG B 17 -9.782 -4.552 11.179 1.00 0.45 N ATOM 977 CA ARG B 17 -9.978 -3.108 11.500 1.00 0.46 C ATOM 978 C ARG B 17 -8.649 -2.369 11.330 1.00 0.45 C ATOM 979 O ARG B 17 -8.595 -1.283 10.790 1.00 0.43 O ATOM 980 CB ARG B 17 -10.460 -2.965 12.950 1.00 0.52 C ATOM 981 CG ARG B 17 -10.752 -1.492 13.259 1.00 0.57 C ATOM 982 CD ARG B 17 -11.232 -1.367 14.710 1.00 0.93 C ATOM 983 NE ARG B 17 -11.657 0.048 14.990 1.00 1.39 N ATOM 984 CZ ARG B 17 -10.830 1.051 14.861 1.00 1.89 C ATOM 985 NH1 ARG B 17 -9.563 0.838 14.642 1.00 2.25 N ATOM 986 NH2 ARG B 17 -11.268 2.275 14.999 1.00 2.72 N ATOM 0 H ARG B 17 -9.953 -5.195 11.952 1.00 0.45 H new ATOM 0 HA ARG B 17 -10.723 -2.683 10.828 1.00 0.46 H new ATOM 0 HB2 ARG B 17 -11.358 -3.563 13.105 1.00 0.52 H new ATOM 0 HB3 ARG B 17 -9.702 -3.346 13.634 1.00 0.52 H new ATOM 0 HG2 ARG B 17 -9.855 -0.891 13.107 1.00 0.57 H new ATOM 0 HG3 ARG B 17 -11.512 -1.109 12.578 1.00 0.57 H new ATOM 0 HD2 ARG B 17 -12.065 -2.047 14.886 1.00 0.93 H new ATOM 0 HD3 ARG B 17 -10.433 -1.658 15.392 1.00 0.93 H new ATOM 0 HE ARG B 17 -12.615 0.229 15.288 1.00 1.39 H new ATOM 0 HH11 ARG B 17 -9.211 -0.117 14.570 1.00 2.25 H new ATOM 0 HH12 ARG B 17 -8.923 1.626 14.542 1.00 2.25 H new ATOM 0 HH21 ARG B 17 -12.252 2.444 15.207 1.00 2.72 H new ATOM 0 HH22 ARG B 17 -10.626 3.061 14.899 1.00 2.72 H new ATOM 1000 N GLU B 18 -7.571 -2.950 11.788 1.00 0.49 N ATOM 1001 CA GLU B 18 -6.249 -2.278 11.647 1.00 0.52 C ATOM 1002 C GLU B 18 -5.957 -2.059 10.164 1.00 0.46 C ATOM 1003 O GLU B 18 -5.473 -1.021 9.757 1.00 0.43 O ATOM 1004 CB GLU B 18 -5.160 -3.159 12.268 1.00 0.60 C ATOM 1005 CG GLU B 18 -3.801 -2.461 12.164 1.00 1.16 C ATOM 1006 CD GLU B 18 -2.727 -3.350 12.791 1.00 1.55 C ATOM 1007 OE1 GLU B 18 -3.088 -4.334 13.417 1.00 2.21 O ATOM 1008 OE2 GLU B 18 -1.561 -3.031 12.636 1.00 2.01 O ATOM 0 H GLU B 18 -7.550 -3.858 12.252 1.00 0.49 H new ATOM 0 HA GLU B 18 -6.265 -1.316 12.160 1.00 0.52 H new ATOM 0 HB2 GLU B 18 -5.396 -3.361 13.313 1.00 0.60 H new ATOM 0 HB3 GLU B 18 -5.124 -4.121 11.758 1.00 0.60 H new ATOM 0 HG2 GLU B 18 -3.560 -2.262 11.120 1.00 1.16 H new ATOM 0 HG3 GLU B 18 -3.834 -1.498 12.673 1.00 1.16 H new ATOM 1015 N ARG B 19 -6.257 -3.031 9.350 1.00 0.46 N ATOM 1016 CA ARG B 19 -6.010 -2.890 7.891 1.00 0.43 C ATOM 1017 C ARG B 19 -6.811 -1.701 7.356 1.00 0.37 C ATOM 1018 O ARG B 19 -6.347 -0.947 6.525 1.00 0.34 O ATOM 1019 CB ARG B 19 -6.446 -4.166 7.174 1.00 0.49 C ATOM 1020 CG ARG B 19 -5.967 -4.121 5.723 1.00 0.62 C ATOM 1021 CD ARG B 19 -6.401 -5.399 5.003 1.00 1.13 C ATOM 1022 NE ARG B 19 -5.636 -6.558 5.545 1.00 1.43 N ATOM 1023 CZ ARG B 19 -6.049 -7.773 5.311 1.00 2.16 C ATOM 1024 NH1 ARG B 19 -7.127 -7.968 4.604 1.00 2.75 N ATOM 1025 NH2 ARG B 19 -5.387 -8.792 5.785 1.00 2.79 N ATOM 0 H ARG B 19 -6.665 -3.921 9.635 1.00 0.46 H new ATOM 0 HA ARG B 19 -4.948 -2.723 7.714 1.00 0.43 H new ATOM 0 HB2 ARG B 19 -6.032 -5.039 7.678 1.00 0.49 H new ATOM 0 HB3 ARG B 19 -7.531 -4.263 7.208 1.00 0.49 H new ATOM 0 HG2 ARG B 19 -6.382 -3.248 5.219 1.00 0.62 H new ATOM 0 HG3 ARG B 19 -4.882 -4.023 5.690 1.00 0.62 H new ATOM 0 HD2 ARG B 19 -7.471 -5.560 5.138 1.00 1.13 H new ATOM 0 HD3 ARG B 19 -6.226 -5.303 3.931 1.00 1.13 H new ATOM 0 HE ARG B 19 -4.793 -6.402 6.097 1.00 1.43 H new ATOM 0 HH11 ARG B 19 -7.646 -7.171 4.235 1.00 2.75 H new ATOM 0 HH12 ARG B 19 -7.451 -8.917 4.420 1.00 2.75 H new ATOM 0 HH21 ARG B 19 -4.545 -8.640 6.340 1.00 2.79 H new ATOM 0 HH22 ARG B 19 -5.712 -9.741 5.601 1.00 2.79 H new ATOM 1039 N PHE B 20 -8.020 -1.540 7.822 1.00 0.37 N ATOM 1040 CA PHE B 20 -8.866 -0.412 7.340 1.00 0.34 C ATOM 1041 C PHE B 20 -8.158 0.917 7.618 1.00 0.32 C ATOM 1042 O PHE B 20 -8.039 1.755 6.747 1.00 0.29 O ATOM 1043 CB PHE B 20 -10.216 -0.444 8.069 1.00 0.38 C ATOM 1044 CG PHE B 20 -10.994 0.813 7.761 1.00 0.37 C ATOM 1045 CD1 PHE B 20 -11.863 0.854 6.655 1.00 0.38 C ATOM 1046 CD2 PHE B 20 -10.844 1.947 8.583 1.00 0.42 C ATOM 1047 CE1 PHE B 20 -12.581 2.029 6.370 1.00 0.40 C ATOM 1048 CE2 PHE B 20 -11.562 3.123 8.298 1.00 0.45 C ATOM 1049 CZ PHE B 20 -12.431 3.164 7.191 1.00 0.42 C ATOM 0 H PHE B 20 -8.459 -2.143 8.518 1.00 0.37 H new ATOM 0 HA PHE B 20 -9.031 -0.511 6.267 1.00 0.34 H new ATOM 0 HB2 PHE B 20 -10.786 -1.320 7.760 1.00 0.38 H new ATOM 0 HB3 PHE B 20 -10.057 -0.530 9.144 1.00 0.38 H new ATOM 0 HD1 PHE B 20 -11.978 -0.016 6.026 1.00 0.38 H new ATOM 0 HD2 PHE B 20 -10.178 1.914 9.432 1.00 0.42 H new ATOM 0 HE1 PHE B 20 -13.248 2.061 5.521 1.00 0.40 H new ATOM 0 HE2 PHE B 20 -11.447 3.993 8.927 1.00 0.45 H new ATOM 0 HZ PHE B 20 -12.983 4.066 6.971 1.00 0.42 H new ATOM 1059 N GLU B 21 -7.692 1.123 8.817 1.00 0.37 N ATOM 1060 CA GLU B 21 -7.002 2.406 9.120 1.00 0.39 C ATOM 1061 C GLU B 21 -5.791 2.544 8.202 1.00 0.34 C ATOM 1062 O GLU B 21 -5.505 3.605 7.687 1.00 0.33 O ATOM 1063 CB GLU B 21 -6.531 2.407 10.574 1.00 0.46 C ATOM 1064 CG GLU B 21 -7.743 2.476 11.502 1.00 0.60 C ATOM 1065 CD GLU B 21 -7.276 2.476 12.958 1.00 1.00 C ATOM 1066 OE1 GLU B 21 -6.099 2.248 13.182 1.00 1.68 O ATOM 1067 OE2 GLU B 21 -8.103 2.708 13.824 1.00 1.56 O ATOM 0 H GLU B 21 -7.758 0.465 9.594 1.00 0.37 H new ATOM 0 HA GLU B 21 -7.690 3.237 8.963 1.00 0.39 H new ATOM 0 HB2 GLU B 21 -5.952 1.507 10.781 1.00 0.46 H new ATOM 0 HB3 GLU B 21 -5.873 3.257 10.754 1.00 0.46 H new ATOM 0 HG2 GLU B 21 -8.321 3.377 11.295 1.00 0.60 H new ATOM 0 HG3 GLU B 21 -8.401 1.626 11.321 1.00 0.60 H new ATOM 1074 N MET B 22 -5.077 1.473 7.995 1.00 0.33 N ATOM 1075 CA MET B 22 -3.883 1.531 7.111 1.00 0.31 C ATOM 1076 C MET B 22 -4.313 1.914 5.692 1.00 0.27 C ATOM 1077 O MET B 22 -3.761 2.811 5.085 1.00 0.27 O ATOM 1078 CB MET B 22 -3.211 0.158 7.092 1.00 0.34 C ATOM 1079 CG MET B 22 -1.951 0.221 6.232 1.00 0.34 C ATOM 1080 SD MET B 22 -1.062 -1.352 6.349 1.00 0.43 S ATOM 1081 CE MET B 22 -2.147 -2.330 5.280 1.00 0.43 C ATOM 0 H MET B 22 -5.271 0.558 8.402 1.00 0.33 H new ATOM 0 HA MET B 22 -3.183 2.278 7.485 1.00 0.31 H new ATOM 0 HB2 MET B 22 -2.957 -0.149 8.107 1.00 0.34 H new ATOM 0 HB3 MET B 22 -3.898 -0.590 6.696 1.00 0.34 H new ATOM 0 HG2 MET B 22 -2.216 0.425 5.195 1.00 0.34 H new ATOM 0 HG3 MET B 22 -1.311 1.038 6.565 1.00 0.34 H new ATOM 0 HE1 MET B 22 -1.644 -3.255 5.000 1.00 0.43 H new ATOM 0 HE2 MET B 22 -3.068 -2.565 5.814 1.00 0.43 H new ATOM 0 HE3 MET B 22 -2.383 -1.759 4.382 1.00 0.43 H new ATOM 1091 N PHE B 23 -5.297 1.238 5.161 1.00 0.25 N ATOM 1092 CA PHE B 23 -5.775 1.558 3.785 1.00 0.22 C ATOM 1093 C PHE B 23 -6.303 2.993 3.751 1.00 0.22 C ATOM 1094 O PHE B 23 -6.062 3.734 2.818 1.00 0.22 O ATOM 1095 CB PHE B 23 -6.900 0.580 3.402 1.00 0.22 C ATOM 1096 CG PHE B 23 -6.317 -0.712 2.858 1.00 0.22 C ATOM 1097 CD1 PHE B 23 -5.360 -1.430 3.604 1.00 0.25 C ATOM 1098 CD2 PHE B 23 -6.733 -1.198 1.600 1.00 0.26 C ATOM 1099 CE1 PHE B 23 -4.819 -2.628 3.090 1.00 0.28 C ATOM 1100 CE2 PHE B 23 -6.194 -2.394 1.091 1.00 0.28 C ATOM 1101 CZ PHE B 23 -5.237 -3.108 1.835 1.00 0.28 C ATOM 0 H PHE B 23 -5.792 0.475 5.623 1.00 0.25 H new ATOM 0 HA PHE B 23 -4.953 1.462 3.076 1.00 0.22 H new ATOM 0 HB2 PHE B 23 -7.519 0.368 4.274 1.00 0.22 H new ATOM 0 HB3 PHE B 23 -7.549 1.037 2.654 1.00 0.22 H new ATOM 0 HD1 PHE B 23 -5.041 -1.063 4.568 1.00 0.25 H new ATOM 0 HD2 PHE B 23 -7.467 -0.651 1.027 1.00 0.26 H new ATOM 0 HE1 PHE B 23 -4.084 -3.177 3.660 1.00 0.28 H new ATOM 0 HE2 PHE B 23 -6.515 -2.764 0.129 1.00 0.28 H new ATOM 0 HZ PHE B 23 -4.823 -4.025 1.443 1.00 0.28 H new ATOM 1111 N ARG B 24 -7.018 3.396 4.764 1.00 0.25 N ATOM 1112 CA ARG B 24 -7.554 4.782 4.783 1.00 0.28 C ATOM 1113 C ARG B 24 -6.388 5.765 4.700 1.00 0.27 C ATOM 1114 O ARG B 24 -6.437 6.747 3.986 1.00 0.27 O ATOM 1115 CB ARG B 24 -8.328 5.005 6.085 1.00 0.34 C ATOM 1116 CG ARG B 24 -8.888 6.429 6.127 1.00 0.42 C ATOM 1117 CD ARG B 24 -9.760 6.586 7.376 1.00 0.91 C ATOM 1118 NE ARG B 24 -8.927 6.371 8.592 1.00 1.33 N ATOM 1119 CZ ARG B 24 -9.376 6.729 9.762 1.00 1.80 C ATOM 1120 NH1 ARG B 24 -10.559 7.272 9.872 1.00 2.22 N ATOM 1121 NH2 ARG B 24 -8.641 6.546 10.823 1.00 2.52 N ATOM 0 H ARG B 24 -7.253 2.826 5.577 1.00 0.25 H new ATOM 0 HA ARG B 24 -8.223 4.937 3.936 1.00 0.28 H new ATOM 0 HB2 ARG B 24 -9.142 4.284 6.162 1.00 0.34 H new ATOM 0 HB3 ARG B 24 -7.673 4.838 6.940 1.00 0.34 H new ATOM 0 HG2 ARG B 24 -8.074 7.153 6.143 1.00 0.42 H new ATOM 0 HG3 ARG B 24 -9.475 6.629 5.231 1.00 0.42 H new ATOM 0 HD2 ARG B 24 -10.206 7.580 7.399 1.00 0.91 H new ATOM 0 HD3 ARG B 24 -10.581 5.869 7.352 1.00 0.91 H new ATOM 0 HE ARG B 24 -8.005 5.943 8.509 1.00 1.33 H new ATOM 0 HH11 ARG B 24 -11.133 7.416 9.041 1.00 2.22 H new ATOM 0 HH12 ARG B 24 -10.909 7.551 10.789 1.00 2.22 H new ATOM 0 HH21 ARG B 24 -7.717 6.123 10.736 1.00 2.52 H new ATOM 0 HH22 ARG B 24 -8.990 6.825 11.740 1.00 2.52 H new ATOM 1135 N GLU B 25 -5.333 5.502 5.418 1.00 0.27 N ATOM 1136 CA GLU B 25 -4.162 6.415 5.371 1.00 0.27 C ATOM 1137 C GLU B 25 -3.640 6.472 3.936 1.00 0.23 C ATOM 1138 O GLU B 25 -3.381 7.534 3.399 1.00 0.24 O ATOM 1139 CB GLU B 25 -3.069 5.880 6.305 1.00 0.31 C ATOM 1140 CG GLU B 25 -1.875 6.839 6.324 1.00 0.35 C ATOM 1141 CD GLU B 25 -2.300 8.169 6.948 1.00 1.03 C ATOM 1142 OE1 GLU B 25 -3.339 8.195 7.589 1.00 1.71 O ATOM 1143 OE2 GLU B 25 -1.578 9.138 6.781 1.00 1.75 O ATOM 0 H GLU B 25 -5.232 4.695 6.034 1.00 0.27 H new ATOM 0 HA GLU B 25 -4.449 7.416 5.694 1.00 0.27 H new ATOM 0 HB2 GLU B 25 -3.467 5.763 7.313 1.00 0.31 H new ATOM 0 HB3 GLU B 25 -2.747 4.893 5.973 1.00 0.31 H new ATOM 0 HG2 GLU B 25 -1.054 6.404 6.894 1.00 0.35 H new ATOM 0 HG3 GLU B 25 -1.509 7.001 5.310 1.00 0.35 H new ATOM 1150 N LEU B 26 -3.486 5.340 3.307 1.00 0.21 N ATOM 1151 CA LEU B 26 -2.982 5.333 1.907 1.00 0.20 C ATOM 1152 C LEU B 26 -3.961 6.089 1.007 1.00 0.21 C ATOM 1153 O LEU B 26 -3.570 6.903 0.194 1.00 0.23 O ATOM 1154 CB LEU B 26 -2.856 3.888 1.412 1.00 0.22 C ATOM 1155 CG LEU B 26 -1.861 3.109 2.286 1.00 0.25 C ATOM 1156 CD1 LEU B 26 -1.834 1.643 1.834 1.00 0.31 C ATOM 1157 CD2 LEU B 26 -0.453 3.720 2.156 1.00 0.30 C ATOM 0 H LEU B 26 -3.687 4.421 3.702 1.00 0.21 H new ATOM 0 HA LEU B 26 -2.006 5.816 1.875 1.00 0.20 H new ATOM 0 HB2 LEU B 26 -3.831 3.402 1.437 1.00 0.22 H new ATOM 0 HB3 LEU B 26 -2.523 3.880 0.374 1.00 0.22 H new ATOM 0 HG LEU B 26 -2.174 3.166 3.329 1.00 0.25 H new ATOM 0 HD11 LEU B 26 -1.129 1.085 2.451 1.00 0.31 H new ATOM 0 HD12 LEU B 26 -2.829 1.211 1.939 1.00 0.31 H new ATOM 0 HD13 LEU B 26 -1.524 1.590 0.790 1.00 0.31 H new ATOM 0 HD21 LEU B 26 0.245 3.161 2.779 1.00 0.30 H new ATOM 0 HD22 LEU B 26 -0.130 3.672 1.116 1.00 0.30 H new ATOM 0 HD23 LEU B 26 -0.476 4.760 2.481 1.00 0.30 H new ATOM 1169 N ASN B 27 -5.234 5.829 1.141 1.00 0.26 N ATOM 1170 CA ASN B 27 -6.229 6.533 0.283 1.00 0.30 C ATOM 1171 C ASN B 27 -6.130 8.042 0.520 1.00 0.26 C ATOM 1172 O ASN B 27 -6.055 8.823 -0.408 1.00 0.25 O ATOM 1173 CB ASN B 27 -7.639 6.053 0.639 1.00 0.38 C ATOM 1174 CG ASN B 27 -8.659 6.730 -0.277 1.00 0.48 C ATOM 1175 OD1 ASN B 27 -8.305 7.269 -1.305 1.00 1.21 O ATOM 1176 ND2 ASN B 27 -9.923 6.719 0.053 1.00 0.58 N ATOM 0 H ASN B 27 -5.626 5.162 1.805 1.00 0.26 H new ATOM 0 HA ASN B 27 -6.024 6.315 -0.765 1.00 0.30 H new ATOM 0 HB2 ASN B 27 -7.703 4.970 0.533 1.00 0.38 H new ATOM 0 HB3 ASN B 27 -7.861 6.285 1.681 1.00 0.38 H new ATOM 0 HD21 ASN B 27 -10.612 7.163 -0.553 1.00 0.58 H new ATOM 0 HD22 ASN B 27 -10.221 6.266 0.917 1.00 0.58 H new ATOM 1183 N GLU B 28 -6.134 8.455 1.758 1.00 0.28 N ATOM 1184 CA GLU B 28 -6.044 9.910 2.067 1.00 0.29 C ATOM 1185 C GLU B 28 -4.727 10.478 1.525 1.00 0.25 C ATOM 1186 O GLU B 28 -4.682 11.579 1.008 1.00 0.26 O ATOM 1187 CB GLU B 28 -6.102 10.112 3.581 1.00 0.37 C ATOM 1188 CG GLU B 28 -6.143 11.607 3.900 1.00 0.43 C ATOM 1189 CD GLU B 28 -6.276 11.806 5.410 1.00 0.95 C ATOM 1190 OE1 GLU B 28 -6.494 10.825 6.100 1.00 1.63 O ATOM 1191 OE2 GLU B 28 -6.160 12.938 5.851 1.00 1.69 O ATOM 0 H GLU B 28 -6.196 7.844 2.572 1.00 0.28 H new ATOM 0 HA GLU B 28 -6.878 10.430 1.596 1.00 0.29 H new ATOM 0 HB2 GLU B 28 -6.984 9.619 3.990 1.00 0.37 H new ATOM 0 HB3 GLU B 28 -5.233 9.653 4.052 1.00 0.37 H new ATOM 0 HG2 GLU B 28 -5.236 12.091 3.538 1.00 0.43 H new ATOM 0 HG3 GLU B 28 -6.982 12.076 3.386 1.00 0.43 H new ATOM 1198 N ALA B 29 -3.653 9.746 1.652 1.00 0.23 N ATOM 1199 CA ALA B 29 -2.343 10.254 1.153 1.00 0.24 C ATOM 1200 C ALA B 29 -2.429 10.522 -0.351 1.00 0.23 C ATOM 1201 O ALA B 29 -2.059 11.578 -0.826 1.00 0.25 O ATOM 1202 CB ALA B 29 -1.250 9.216 1.432 1.00 0.27 C ATOM 0 H ALA B 29 -3.626 8.820 2.079 1.00 0.23 H new ATOM 0 HA ALA B 29 -2.098 11.183 1.667 1.00 0.24 H new ATOM 0 HB1 ALA B 29 -0.293 9.588 1.067 1.00 0.27 H new ATOM 0 HB2 ALA B 29 -1.184 9.037 2.505 1.00 0.27 H new ATOM 0 HB3 ALA B 29 -1.495 8.284 0.923 1.00 0.27 H new ATOM 1208 N LEU B 30 -2.912 9.574 -1.108 1.00 0.22 N ATOM 1209 CA LEU B 30 -3.016 9.783 -2.579 1.00 0.24 C ATOM 1210 C LEU B 30 -3.953 10.961 -2.857 1.00 0.28 C ATOM 1211 O LEU B 30 -3.686 11.794 -3.703 1.00 0.30 O ATOM 1212 CB LEU B 30 -3.570 8.514 -3.240 1.00 0.25 C ATOM 1213 CG LEU B 30 -2.564 7.360 -3.098 1.00 0.25 C ATOM 1214 CD1 LEU B 30 -3.233 6.058 -3.543 1.00 0.30 C ATOM 1215 CD2 LEU B 30 -1.317 7.619 -3.968 1.00 0.26 C ATOM 0 H LEU B 30 -3.238 8.668 -0.772 1.00 0.22 H new ATOM 0 HA LEU B 30 -2.029 9.999 -2.989 1.00 0.24 H new ATOM 0 HB2 LEU B 30 -4.518 8.239 -2.778 1.00 0.25 H new ATOM 0 HB3 LEU B 30 -3.772 8.703 -4.294 1.00 0.25 H new ATOM 0 HG LEU B 30 -2.253 7.286 -2.056 1.00 0.25 H new ATOM 0 HD11 LEU B 30 -2.526 5.234 -3.446 1.00 0.30 H new ATOM 0 HD12 LEU B 30 -4.104 5.864 -2.918 1.00 0.30 H new ATOM 0 HD13 LEU B 30 -3.546 6.147 -4.583 1.00 0.30 H new ATOM 0 HD21 LEU B 30 -0.616 6.792 -3.855 1.00 0.26 H new ATOM 0 HD22 LEU B 30 -1.614 7.703 -5.013 1.00 0.26 H new ATOM 0 HD23 LEU B 30 -0.839 8.546 -3.651 1.00 0.26 H new ATOM 1227 N GLU B 31 -5.041 11.045 -2.144 1.00 0.31 N ATOM 1228 CA GLU B 31 -5.985 12.178 -2.358 1.00 0.36 C ATOM 1229 C GLU B 31 -5.264 13.493 -2.060 1.00 0.33 C ATOM 1230 O GLU B 31 -5.455 14.485 -2.731 1.00 0.35 O ATOM 1231 CB GLU B 31 -7.193 12.034 -1.434 1.00 0.41 C ATOM 1232 CG GLU B 31 -8.046 10.852 -1.898 1.00 0.49 C ATOM 1233 CD GLU B 31 -9.174 10.609 -0.896 1.00 1.14 C ATOM 1234 OE1 GLU B 31 -9.240 11.340 0.077 1.00 1.93 O ATOM 1235 OE2 GLU B 31 -9.952 9.697 -1.121 1.00 1.68 O ATOM 0 H GLU B 31 -5.318 10.379 -1.423 1.00 0.31 H new ATOM 0 HA GLU B 31 -6.330 12.172 -3.392 1.00 0.36 H new ATOM 0 HB2 GLU B 31 -6.863 11.878 -0.407 1.00 0.41 H new ATOM 0 HB3 GLU B 31 -7.784 12.950 -1.444 1.00 0.41 H new ATOM 0 HG2 GLU B 31 -8.461 11.055 -2.885 1.00 0.49 H new ATOM 0 HG3 GLU B 31 -7.428 9.959 -1.989 1.00 0.49 H new ATOM 1242 N LEU B 32 -4.449 13.504 -1.042 1.00 0.30 N ATOM 1243 CA LEU B 32 -3.718 14.749 -0.682 1.00 0.29 C ATOM 1244 C LEU B 32 -2.848 15.177 -1.864 1.00 0.28 C ATOM 1245 O LEU B 32 -2.871 16.319 -2.289 1.00 0.32 O ATOM 1246 CB LEU B 32 -2.848 14.477 0.553 1.00 0.28 C ATOM 1247 CG LEU B 32 -2.074 15.741 0.967 1.00 0.32 C ATOM 1248 CD1 LEU B 32 -3.049 16.838 1.422 1.00 0.40 C ATOM 1249 CD2 LEU B 32 -1.133 15.387 2.124 1.00 0.35 C ATOM 0 H LEU B 32 -4.258 12.701 -0.443 1.00 0.30 H new ATOM 0 HA LEU B 32 -4.421 15.550 -0.452 1.00 0.29 H new ATOM 0 HB2 LEU B 32 -3.476 14.143 1.379 1.00 0.28 H new ATOM 0 HB3 LEU B 32 -2.147 13.670 0.339 1.00 0.28 H new ATOM 0 HG LEU B 32 -1.503 16.110 0.115 1.00 0.32 H new ATOM 0 HD11 LEU B 32 -2.488 17.726 1.712 1.00 0.40 H new ATOM 0 HD12 LEU B 32 -3.725 17.087 0.604 1.00 0.40 H new ATOM 0 HD13 LEU B 32 -3.627 16.480 2.274 1.00 0.40 H new ATOM 0 HD21 LEU B 32 -0.578 16.275 2.427 1.00 0.35 H new ATOM 0 HD22 LEU B 32 -1.716 15.018 2.968 1.00 0.35 H new ATOM 0 HD23 LEU B 32 -0.434 14.615 1.801 1.00 0.35 H new ATOM 1261 N LYS B 33 -2.079 14.268 -2.401 1.00 0.27 N ATOM 1262 CA LYS B 33 -1.210 14.616 -3.559 1.00 0.31 C ATOM 1263 C LYS B 33 -2.083 15.081 -4.726 1.00 0.37 C ATOM 1264 O LYS B 33 -1.752 16.016 -5.426 1.00 0.42 O ATOM 1265 CB LYS B 33 -0.394 13.387 -3.981 1.00 0.34 C ATOM 1266 CG LYS B 33 0.631 13.793 -5.045 1.00 0.44 C ATOM 1267 CD LYS B 33 1.354 12.548 -5.567 1.00 0.50 C ATOM 1268 CE LYS B 33 2.198 11.915 -4.452 1.00 0.81 C ATOM 1269 NZ LYS B 33 3.265 11.072 -5.063 1.00 1.59 N ATOM 0 H LYS B 33 -2.016 13.300 -2.087 1.00 0.27 H new ATOM 0 HA LYS B 33 -0.528 15.417 -3.274 1.00 0.31 H new ATOM 0 HB2 LYS B 33 0.114 12.960 -3.116 1.00 0.34 H new ATOM 0 HB3 LYS B 33 -1.056 12.616 -4.375 1.00 0.34 H new ATOM 0 HG2 LYS B 33 0.132 14.307 -5.867 1.00 0.44 H new ATOM 0 HG3 LYS B 33 1.351 14.493 -4.621 1.00 0.44 H new ATOM 0 HD2 LYS B 33 0.627 11.825 -5.937 1.00 0.50 H new ATOM 0 HD3 LYS B 33 1.993 12.816 -6.408 1.00 0.50 H new ATOM 0 HE2 LYS B 33 2.643 12.692 -3.831 1.00 0.81 H new ATOM 0 HE3 LYS B 33 1.567 11.309 -3.801 1.00 0.81 H new ATOM 0 HZ1 LYS B 33 3.377 10.198 -4.510 1.00 1.59 H new ATOM 0 HZ2 LYS B 33 3.001 10.832 -6.040 1.00 1.59 H new ATOM 0 HZ3 LYS B 33 4.163 11.597 -5.066 1.00 1.59 H new ATOM 1283 N ASP B 34 -3.196 14.433 -4.942 1.00 0.42 N ATOM 1284 CA ASP B 34 -4.089 14.835 -6.067 1.00 0.50 C ATOM 1285 C ASP B 34 -4.537 16.284 -5.865 1.00 0.50 C ATOM 1286 O ASP B 34 -4.616 17.056 -6.800 1.00 0.58 O ATOM 1287 CB ASP B 34 -5.313 13.918 -6.106 1.00 0.59 C ATOM 1288 CG ASP B 34 -4.876 12.523 -6.557 1.00 0.68 C ATOM 1289 OD1 ASP B 34 -3.778 12.408 -7.075 1.00 1.43 O ATOM 1290 OD2 ASP B 34 -5.645 11.594 -6.374 1.00 1.15 O ATOM 0 H ASP B 34 -3.526 13.643 -4.388 1.00 0.42 H new ATOM 0 HA ASP B 34 -3.548 14.749 -7.009 1.00 0.50 H new ATOM 0 HB2 ASP B 34 -5.777 13.867 -5.121 1.00 0.59 H new ATOM 0 HB3 ASP B 34 -6.061 14.318 -6.790 1.00 0.59 H new ATOM 1295 N ALA B 35 -4.833 16.655 -4.650 1.00 0.49 N ATOM 1296 CA ALA B 35 -5.277 18.051 -4.378 1.00 0.56 C ATOM 1297 C ALA B 35 -4.176 19.031 -4.800 1.00 0.54 C ATOM 1298 O ALA B 35 -4.447 20.082 -5.345 1.00 0.65 O ATOM 1299 CB ALA B 35 -5.561 18.210 -2.881 1.00 0.64 C ATOM 0 H ALA B 35 -4.786 16.049 -3.831 1.00 0.49 H new ATOM 0 HA ALA B 35 -6.184 18.263 -4.945 1.00 0.56 H new ATOM 0 HB1 ALA B 35 -5.886 19.231 -2.679 1.00 0.64 H new ATOM 0 HB2 ALA B 35 -6.345 17.514 -2.583 1.00 0.64 H new ATOM 0 HB3 ALA B 35 -4.654 17.999 -2.314 1.00 0.64 H new ATOM 1305 N GLN B 36 -2.937 18.696 -4.555 1.00 0.51 N ATOM 1306 CA GLN B 36 -1.826 19.615 -4.944 1.00 0.59 C ATOM 1307 C GLN B 36 -1.535 19.462 -6.440 1.00 0.66 C ATOM 1308 O GLN B 36 -0.807 20.243 -7.023 1.00 0.86 O ATOM 1309 CB GLN B 36 -0.568 19.254 -4.149 1.00 0.61 C ATOM 1310 CG GLN B 36 -0.764 19.632 -2.681 1.00 0.94 C ATOM 1311 CD GLN B 36 0.495 19.269 -1.892 1.00 0.83 C ATOM 1312 OE1 GLN B 36 0.374 18.746 -0.703 1.00 1.19 O flip ATOM 1313 NE2 GLN B 36 1.600 19.457 -2.364 1.00 0.67 N flip ATOM 0 H GLN B 36 -2.646 17.829 -4.104 1.00 0.51 H new ATOM 0 HA GLN B 36 -2.115 20.644 -4.731 1.00 0.59 H new ATOM 0 HB2 GLN B 36 -0.364 18.187 -4.236 1.00 0.61 H new ATOM 0 HB3 GLN B 36 0.296 19.778 -4.558 1.00 0.61 H new ATOM 0 HG2 GLN B 36 -0.967 20.699 -2.593 1.00 0.94 H new ATOM 0 HG3 GLN B 36 -1.627 19.108 -2.271 1.00 0.94 H new ATOM 0 HE21 GLN B 36 1.695 19.866 -3.294 1.00 0.67 H new ATOM 0 HE22 GLN B 36 2.432 19.206 -1.830 1.00 0.67 H new ATOM 1322 N ALA B 37 -2.101 18.465 -7.069 1.00 0.67 N ATOM 1323 CA ALA B 37 -1.859 18.270 -8.527 1.00 0.82 C ATOM 1324 C ALA B 37 -2.555 19.384 -9.316 1.00 0.89 C ATOM 1325 O ALA B 37 -2.248 19.629 -10.466 1.00 1.22 O ATOM 1326 CB ALA B 37 -2.422 16.915 -8.962 1.00 1.02 C ATOM 0 H ALA B 37 -2.719 17.779 -6.636 1.00 0.67 H new ATOM 0 HA ALA B 37 -0.787 18.300 -8.722 1.00 0.82 H new ATOM 0 HB1 ALA B 37 -2.245 16.773 -10.028 1.00 1.02 H new ATOM 0 HB2 ALA B 37 -1.929 16.120 -8.403 1.00 1.02 H new ATOM 0 HB3 ALA B 37 -3.494 16.886 -8.765 1.00 1.02 H new ATOM 1332 N GLY B 38 -3.495 20.054 -8.707 1.00 1.01 N ATOM 1333 CA GLY B 38 -4.219 21.149 -9.418 1.00 1.22 C ATOM 1334 C GLY B 38 -3.308 22.370 -9.549 1.00 1.17 C ATOM 1335 O GLY B 38 -3.757 23.499 -9.523 1.00 1.53 O ATOM 0 H GLY B 38 -3.794 19.891 -7.746 1.00 1.01 H new ATOM 0 HA2 GLY B 38 -4.532 20.810 -10.405 1.00 1.22 H new ATOM 0 HA3 GLY B 38 -5.123 21.415 -8.871 1.00 1.22 H new ATOM 1339 N LYS B 39 -2.029 22.152 -9.683 1.00 1.30 N ATOM 1340 CA LYS B 39 -1.082 23.295 -9.810 1.00 1.51 C ATOM 1341 C LYS B 39 -1.015 23.728 -11.277 1.00 1.94 C ATOM 1342 O LYS B 39 -1.572 24.736 -11.663 1.00 2.47 O ATOM 1343 CB LYS B 39 0.306 22.840 -9.333 1.00 1.85 C ATOM 1344 CG LYS B 39 1.324 23.990 -9.419 1.00 2.23 C ATOM 1345 CD LYS B 39 0.962 25.093 -8.413 1.00 2.95 C ATOM 1346 CE LYS B 39 2.186 25.973 -8.148 1.00 3.51 C ATOM 1347 NZ LYS B 39 1.846 27.001 -7.123 1.00 4.21 N ATOM 0 H LYS B 39 -1.598 21.228 -9.710 1.00 1.30 H new ATOM 0 HA LYS B 39 -1.418 24.136 -9.204 1.00 1.51 H new ATOM 0 HB2 LYS B 39 0.242 22.483 -8.305 1.00 1.85 H new ATOM 0 HB3 LYS B 39 0.647 22.002 -9.941 1.00 1.85 H new ATOM 0 HG2 LYS B 39 2.326 23.615 -9.213 1.00 2.23 H new ATOM 0 HG3 LYS B 39 1.338 24.399 -10.429 1.00 2.23 H new ATOM 0 HD2 LYS B 39 0.144 25.699 -8.802 1.00 2.95 H new ATOM 0 HD3 LYS B 39 0.614 24.648 -7.481 1.00 2.95 H new ATOM 0 HE2 LYS B 39 3.019 25.361 -7.802 1.00 3.51 H new ATOM 0 HE3 LYS B 39 2.507 26.456 -9.071 1.00 3.51 H new ATOM 0 HZ1 LYS B 39 2.677 27.599 -6.942 1.00 4.21 H new ATOM 0 HZ2 LYS B 39 1.063 27.591 -7.470 1.00 4.21 H new ATOM 0 HZ3 LYS B 39 1.560 26.530 -6.241 1.00 4.21 H new ATOM 1361 N GLU B 40 -0.336 22.975 -12.095 1.00 2.39 N ATOM 1362 CA GLU B 40 -0.230 23.346 -13.535 1.00 3.15 C ATOM 1363 C GLU B 40 -1.649 23.451 -14.141 1.00 3.39 C ATOM 1364 O GLU B 40 -2.528 22.723 -13.722 1.00 3.42 O ATOM 1365 CB GLU B 40 0.561 22.258 -14.265 1.00 3.87 C ATOM 1366 CG GLU B 40 1.886 22.020 -13.537 1.00 4.49 C ATOM 1367 CD GLU B 40 2.756 21.064 -14.355 1.00 5.22 C ATOM 1368 OE1 GLU B 40 3.327 21.509 -15.337 1.00 5.62 O ATOM 1369 OE2 GLU B 40 2.831 19.903 -13.989 1.00 5.68 O ATOM 0 H GLU B 40 0.151 22.119 -11.830 1.00 2.39 H new ATOM 0 HA GLU B 40 0.277 24.305 -13.639 1.00 3.15 H new ATOM 0 HB2 GLU B 40 -0.017 21.335 -14.302 1.00 3.87 H new ATOM 0 HB3 GLU B 40 0.748 22.558 -15.296 1.00 3.87 H new ATOM 0 HG2 GLU B 40 2.407 22.966 -13.390 1.00 4.49 H new ATOM 0 HG3 GLU B 40 1.699 21.602 -12.548 1.00 4.49 H new ATOM 1376 N PRO B 41 -1.852 24.330 -15.113 1.00 4.03 N ATOM 1377 CA PRO B 41 -3.180 24.476 -15.747 1.00 4.70 C ATOM 1378 C PRO B 41 -3.571 23.178 -16.483 1.00 4.87 C ATOM 1379 O PRO B 41 -4.536 23.145 -17.221 1.00 4.90 O ATOM 1380 CB PRO B 41 -3.019 25.651 -16.741 1.00 5.57 C ATOM 1381 CG PRO B 41 -1.506 26.003 -16.799 1.00 5.54 C ATOM 1382 CD PRO B 41 -0.812 25.241 -15.648 1.00 4.57 C ATOM 0 HA PRO B 41 -3.969 24.667 -15.019 1.00 4.70 H new ATOM 0 HB2 PRO B 41 -3.387 25.372 -17.728 1.00 5.57 H new ATOM 0 HB3 PRO B 41 -3.602 26.513 -16.415 1.00 5.57 H new ATOM 0 HG2 PRO B 41 -1.081 25.716 -17.761 1.00 5.54 H new ATOM 0 HG3 PRO B 41 -1.357 27.078 -16.693 1.00 5.54 H new ATOM 0 HD2 PRO B 41 0.054 24.685 -16.008 1.00 4.57 H new ATOM 0 HD3 PRO B 41 -0.454 25.926 -14.880 1.00 4.57 H new ATOM 1390 N GLY B 42 -2.833 22.117 -16.294 1.00 5.39 N ATOM 1391 CA GLY B 42 -3.177 20.842 -16.991 1.00 5.90 C ATOM 1392 C GLY B 42 -4.427 20.229 -16.356 1.00 6.72 C ATOM 1393 O GLY B 42 -4.721 20.572 -15.223 1.00 7.20 O ATOM 1394 OXT GLY B 42 -5.069 19.428 -17.015 1.00 7.11 O ATOM 0 H GLY B 42 -2.011 22.077 -15.691 1.00 5.39 H new ATOM 0 HA2 GLY B 42 -3.351 21.031 -18.050 1.00 5.90 H new ATOM 0 HA3 GLY B 42 -2.343 20.143 -16.924 1.00 5.90 H new TER 1398 GLY B 42 ATOM 1399 N LYS C 1 11.216 -26.074 -18.126 1.00 6.27 N ATOM 1400 CA LYS C 1 11.035 -25.808 -16.667 1.00 5.90 C ATOM 1401 C LYS C 1 12.348 -25.288 -16.073 1.00 5.22 C ATOM 1402 O LYS C 1 13.259 -24.919 -16.788 1.00 5.00 O ATOM 1403 CB LYS C 1 10.626 -27.099 -15.950 1.00 6.41 C ATOM 1404 CG LYS C 1 9.203 -27.480 -16.363 1.00 7.00 C ATOM 1405 CD LYS C 1 8.783 -28.770 -15.652 1.00 7.69 C ATOM 1406 CE LYS C 1 7.359 -29.141 -16.072 1.00 8.33 C ATOM 1407 NZ LYS C 1 7.026 -30.502 -15.562 1.00 8.96 N ATOM 0 H1 LYS C 1 10.360 -25.783 -18.641 1.00 6.27 H new ATOM 0 H2 LYS C 1 12.032 -25.535 -18.479 1.00 6.27 H new ATOM 0 H3 LYS C 1 11.382 -27.090 -18.276 1.00 6.27 H new ATOM 0 HA LYS C 1 10.254 -25.060 -16.534 1.00 5.90 H new ATOM 0 HB2 LYS C 1 11.317 -27.903 -16.202 1.00 6.41 H new ATOM 0 HB3 LYS C 1 10.678 -26.961 -14.870 1.00 6.41 H new ATOM 0 HG2 LYS C 1 8.514 -26.674 -16.111 1.00 7.00 H new ATOM 0 HG3 LYS C 1 9.152 -27.617 -17.443 1.00 7.00 H new ATOM 0 HD2 LYS C 1 9.470 -29.578 -15.904 1.00 7.69 H new ATOM 0 HD3 LYS C 1 8.832 -28.635 -14.571 1.00 7.69 H new ATOM 0 HE2 LYS C 1 6.651 -28.411 -15.679 1.00 8.33 H new ATOM 0 HE3 LYS C 1 7.271 -29.117 -17.158 1.00 8.33 H new ATOM 0 HZ1 LYS C 1 6.058 -30.753 -15.848 1.00 8.96 H new ATOM 0 HZ2 LYS C 1 7.694 -31.194 -15.957 1.00 8.96 H new ATOM 0 HZ3 LYS C 1 7.093 -30.510 -14.524 1.00 8.96 H new ATOM 1423 N LYS C 2 12.448 -25.252 -14.770 1.00 5.24 N ATOM 1424 CA LYS C 2 13.696 -24.750 -14.127 1.00 4.93 C ATOM 1425 C LYS C 2 14.078 -23.405 -14.752 1.00 4.31 C ATOM 1426 O LYS C 2 13.383 -22.884 -15.602 1.00 4.51 O ATOM 1427 CB LYS C 2 14.828 -25.760 -14.347 1.00 5.31 C ATOM 1428 CG LYS C 2 14.521 -27.057 -13.591 1.00 6.01 C ATOM 1429 CD LYS C 2 15.652 -28.065 -13.820 1.00 6.69 C ATOM 1430 CE LYS C 2 15.349 -29.363 -13.067 1.00 7.46 C ATOM 1431 NZ LYS C 2 15.466 -29.133 -11.601 1.00 8.15 N ATOM 0 H LYS C 2 11.717 -25.549 -14.123 1.00 5.24 H new ATOM 0 HA LYS C 2 13.532 -24.622 -13.057 1.00 4.93 H new ATOM 0 HB2 LYS C 2 14.941 -25.967 -15.411 1.00 5.31 H new ATOM 0 HB3 LYS C 2 15.773 -25.342 -14.001 1.00 5.31 H new ATOM 0 HG2 LYS C 2 14.413 -26.852 -12.526 1.00 6.01 H new ATOM 0 HG3 LYS C 2 13.574 -27.474 -13.933 1.00 6.01 H new ATOM 0 HD2 LYS C 2 15.760 -28.268 -14.885 1.00 6.69 H new ATOM 0 HD3 LYS C 2 16.599 -27.647 -13.477 1.00 6.69 H new ATOM 0 HE2 LYS C 2 14.345 -29.710 -13.311 1.00 7.46 H new ATOM 0 HE3 LYS C 2 16.041 -30.145 -13.378 1.00 7.46 H new ATOM 0 HZ1 LYS C 2 15.496 -30.048 -11.107 1.00 8.15 H new ATOM 0 HZ2 LYS C 2 16.338 -28.603 -11.401 1.00 8.15 H new ATOM 0 HZ3 LYS C 2 14.645 -28.587 -11.269 1.00 8.15 H new ATOM 1445 N LYS C 3 15.173 -22.839 -14.332 1.00 3.98 N ATOM 1446 CA LYS C 3 15.600 -21.528 -14.891 1.00 3.74 C ATOM 1447 C LYS C 3 14.427 -20.535 -14.871 1.00 3.33 C ATOM 1448 O LYS C 3 14.033 -20.046 -15.910 1.00 3.47 O ATOM 1449 CB LYS C 3 16.072 -21.716 -16.334 1.00 4.29 C ATOM 1450 CG LYS C 3 17.286 -22.641 -16.361 1.00 4.88 C ATOM 1451 CD LYS C 3 17.682 -22.907 -17.813 1.00 5.72 C ATOM 1452 CE LYS C 3 18.958 -23.746 -17.850 1.00 6.54 C ATOM 1453 NZ LYS C 3 18.702 -25.066 -17.209 1.00 7.15 N ATOM 0 H LYS C 3 15.793 -23.230 -13.623 1.00 3.98 H new ATOM 0 HA LYS C 3 16.414 -21.135 -14.282 1.00 3.74 H new ATOM 0 HB2 LYS C 3 15.268 -22.137 -16.938 1.00 4.29 H new ATOM 0 HB3 LYS C 3 16.328 -20.751 -16.772 1.00 4.29 H new ATOM 0 HG2 LYS C 3 18.117 -22.186 -15.822 1.00 4.88 H new ATOM 0 HG3 LYS C 3 17.055 -23.579 -15.857 1.00 4.88 H new ATOM 0 HD2 LYS C 3 16.877 -23.428 -18.331 1.00 5.72 H new ATOM 0 HD3 LYS C 3 17.839 -21.964 -18.336 1.00 5.72 H new ATOM 0 HE2 LYS C 3 19.284 -23.887 -18.881 1.00 6.54 H new ATOM 0 HE3 LYS C 3 19.763 -23.227 -17.330 1.00 6.54 H new ATOM 0 HZ1 LYS C 3 19.469 -25.725 -17.452 1.00 7.15 H new ATOM 0 HZ2 LYS C 3 18.661 -24.948 -16.176 1.00 7.15 H new ATOM 0 HZ3 LYS C 3 17.797 -25.448 -17.550 1.00 7.15 H new ATOM 1467 N PRO C 4 13.900 -20.252 -13.698 1.00 3.32 N ATOM 1468 CA PRO C 4 12.776 -19.304 -13.574 1.00 3.43 C ATOM 1469 C PRO C 4 13.215 -17.918 -14.077 1.00 2.69 C ATOM 1470 O PRO C 4 14.382 -17.575 -14.034 1.00 2.47 O ATOM 1471 CB PRO C 4 12.440 -19.280 -12.062 1.00 4.12 C ATOM 1472 CG PRO C 4 13.487 -20.177 -11.336 1.00 4.35 C ATOM 1473 CD PRO C 4 14.368 -20.838 -12.421 1.00 3.79 C ATOM 0 HA PRO C 4 11.907 -19.591 -14.166 1.00 3.43 H new ATOM 0 HB2 PRO C 4 12.476 -18.261 -11.677 1.00 4.12 H new ATOM 0 HB3 PRO C 4 11.430 -19.651 -11.888 1.00 4.12 H new ATOM 0 HG2 PRO C 4 14.097 -19.581 -10.658 1.00 4.35 H new ATOM 0 HG3 PRO C 4 12.989 -20.936 -10.733 1.00 4.35 H new ATOM 0 HD2 PRO C 4 15.425 -20.629 -12.254 1.00 3.79 H new ATOM 0 HD3 PRO C 4 14.253 -21.922 -12.418 1.00 3.79 H new ATOM 1481 N LEU C 5 12.294 -17.120 -14.547 1.00 2.71 N ATOM 1482 CA LEU C 5 12.666 -15.762 -15.044 1.00 2.32 C ATOM 1483 C LEU C 5 12.812 -14.819 -13.847 1.00 1.85 C ATOM 1484 O LEU C 5 11.920 -14.700 -13.032 1.00 2.13 O ATOM 1485 CB LEU C 5 11.561 -15.236 -15.967 1.00 3.06 C ATOM 1486 CG LEU C 5 11.359 -16.192 -17.152 1.00 3.73 C ATOM 1487 CD1 LEU C 5 10.137 -15.742 -17.958 1.00 4.63 C ATOM 1488 CD2 LEU C 5 12.602 -16.187 -18.058 1.00 3.78 C ATOM 0 H LEU C 5 11.302 -17.348 -14.609 1.00 2.71 H new ATOM 0 HA LEU C 5 13.605 -15.815 -15.595 1.00 2.32 H new ATOM 0 HB2 LEU C 5 10.630 -15.134 -15.410 1.00 3.06 H new ATOM 0 HB3 LEU C 5 11.824 -14.243 -16.332 1.00 3.06 H new ATOM 0 HG LEU C 5 11.203 -17.203 -16.774 1.00 3.73 H new ATOM 0 HD11 LEU C 5 9.988 -16.417 -18.801 1.00 4.63 H new ATOM 0 HD12 LEU C 5 9.254 -15.759 -17.320 1.00 4.63 H new ATOM 0 HD13 LEU C 5 10.298 -14.729 -18.328 1.00 4.63 H new ATOM 0 HD21 LEU C 5 12.446 -16.869 -18.894 1.00 3.78 H new ATOM 0 HD22 LEU C 5 12.771 -15.180 -18.438 1.00 3.78 H new ATOM 0 HD23 LEU C 5 13.471 -16.509 -17.485 1.00 3.78 H new ATOM 1500 N ASP C 6 13.927 -14.149 -13.728 1.00 1.52 N ATOM 1501 CA ASP C 6 14.114 -13.220 -12.576 1.00 1.53 C ATOM 1502 C ASP C 6 13.440 -11.881 -12.880 1.00 1.21 C ATOM 1503 O ASP C 6 13.788 -11.199 -13.822 1.00 1.15 O ATOM 1504 CB ASP C 6 15.610 -12.997 -12.337 1.00 1.97 C ATOM 1505 CG ASP C 6 16.233 -14.280 -11.782 1.00 2.39 C ATOM 1506 OD1 ASP C 6 15.494 -15.097 -11.260 1.00 2.85 O ATOM 1507 OD2 ASP C 6 17.439 -14.426 -11.894 1.00 2.70 O ATOM 0 H ASP C 6 14.713 -14.204 -14.376 1.00 1.52 H new ATOM 0 HA ASP C 6 13.664 -13.656 -11.684 1.00 1.53 H new ATOM 0 HB2 ASP C 6 16.100 -12.715 -13.269 1.00 1.97 H new ATOM 0 HB3 ASP C 6 15.759 -12.175 -11.637 1.00 1.97 H new ATOM 1512 N GLY C 7 12.479 -11.498 -12.081 1.00 1.12 N ATOM 1513 CA GLY C 7 11.783 -10.199 -12.319 1.00 0.94 C ATOM 1514 C GLY C 7 12.734 -9.047 -11.988 1.00 0.75 C ATOM 1515 O GLY C 7 13.554 -9.148 -11.099 1.00 0.72 O ATOM 0 H GLY C 7 12.146 -12.027 -11.275 1.00 1.12 H new ATOM 0 HA2 GLY C 7 11.460 -10.132 -13.358 1.00 0.94 H new ATOM 0 HA3 GLY C 7 10.887 -10.135 -11.701 1.00 0.94 H new ATOM 1519 N GLU C 8 12.634 -7.952 -12.689 1.00 0.70 N ATOM 1520 CA GLU C 8 13.541 -6.806 -12.395 1.00 0.60 C ATOM 1521 C GLU C 8 13.324 -6.354 -10.947 1.00 0.51 C ATOM 1522 O GLU C 8 12.204 -6.185 -10.506 1.00 0.50 O ATOM 1523 CB GLU C 8 13.232 -5.649 -13.352 1.00 0.71 C ATOM 1524 CG GLU C 8 13.655 -6.034 -14.772 1.00 0.88 C ATOM 1525 CD GLU C 8 13.309 -4.898 -15.736 1.00 1.40 C ATOM 1526 OE1 GLU C 8 12.198 -4.894 -16.242 1.00 2.11 O ATOM 1527 OE2 GLU C 8 14.159 -4.051 -15.953 1.00 2.03 O ATOM 0 H GLU C 8 11.969 -7.801 -13.447 1.00 0.70 H new ATOM 0 HA GLU C 8 14.578 -7.112 -12.530 1.00 0.60 H new ATOM 0 HB2 GLU C 8 12.167 -5.418 -13.328 1.00 0.71 H new ATOM 0 HB3 GLU C 8 13.760 -4.750 -13.035 1.00 0.71 H new ATOM 0 HG2 GLU C 8 14.726 -6.236 -14.801 1.00 0.88 H new ATOM 0 HG3 GLU C 8 13.149 -6.950 -15.077 1.00 0.88 H new ATOM 1534 N TYR C 9 14.387 -6.165 -10.205 1.00 0.47 N ATOM 1535 CA TYR C 9 14.260 -5.730 -8.775 1.00 0.41 C ATOM 1536 C TYR C 9 14.738 -4.283 -8.635 1.00 0.38 C ATOM 1537 O TYR C 9 15.664 -3.862 -9.300 1.00 0.43 O ATOM 1538 CB TYR C 9 15.128 -6.632 -7.892 1.00 0.43 C ATOM 1539 CG TYR C 9 14.623 -8.053 -7.958 1.00 0.47 C ATOM 1540 CD1 TYR C 9 13.639 -8.495 -7.053 1.00 0.47 C ATOM 1541 CD2 TYR C 9 15.134 -8.934 -8.929 1.00 0.53 C ATOM 1542 CE1 TYR C 9 13.167 -9.819 -7.119 1.00 0.52 C ATOM 1543 CE2 TYR C 9 14.661 -10.257 -8.995 1.00 0.58 C ATOM 1544 CZ TYR C 9 13.677 -10.700 -8.090 1.00 0.57 C ATOM 1545 OH TYR C 9 13.212 -11.997 -8.157 1.00 0.64 O ATOM 0 H TYR C 9 15.345 -6.294 -10.529 1.00 0.47 H new ATOM 0 HA TYR C 9 13.217 -5.802 -8.466 1.00 0.41 H new ATOM 0 HB2 TYR C 9 16.166 -6.590 -8.223 1.00 0.43 H new ATOM 0 HB3 TYR C 9 15.107 -6.277 -6.862 1.00 0.43 H new ATOM 0 HD1 TYR C 9 13.247 -7.818 -6.308 1.00 0.47 H new ATOM 0 HD2 TYR C 9 15.889 -8.595 -9.623 1.00 0.53 H new ATOM 0 HE1 TYR C 9 12.413 -10.159 -6.424 1.00 0.52 H new ATOM 0 HE2 TYR C 9 15.053 -10.934 -9.740 1.00 0.58 H new ATOM 0 HH TYR C 9 13.667 -12.471 -8.884 1.00 0.64 H new ATOM 1555 N PHE C 10 14.117 -3.518 -7.769 1.00 0.35 N ATOM 1556 CA PHE C 10 14.535 -2.091 -7.576 1.00 0.34 C ATOM 1557 C PHE C 10 14.573 -1.767 -6.082 1.00 0.31 C ATOM 1558 O PHE C 10 13.705 -2.159 -5.329 1.00 0.32 O ATOM 1559 CB PHE C 10 13.527 -1.172 -8.266 1.00 0.36 C ATOM 1560 CG PHE C 10 13.588 -1.393 -9.756 1.00 0.37 C ATOM 1561 CD1 PHE C 10 12.763 -2.362 -10.352 1.00 0.43 C ATOM 1562 CD2 PHE C 10 14.465 -0.628 -10.548 1.00 0.43 C ATOM 1563 CE1 PHE C 10 12.811 -2.570 -11.742 1.00 0.48 C ATOM 1564 CE2 PHE C 10 14.514 -0.835 -11.941 1.00 0.49 C ATOM 1565 CZ PHE C 10 13.687 -1.807 -12.538 1.00 0.48 C ATOM 0 H PHE C 10 13.337 -3.820 -7.186 1.00 0.35 H new ATOM 0 HA PHE C 10 15.525 -1.941 -8.006 1.00 0.34 H new ATOM 0 HB2 PHE C 10 12.521 -1.375 -7.898 1.00 0.36 H new ATOM 0 HB3 PHE C 10 13.748 -0.131 -8.032 1.00 0.36 H new ATOM 0 HD1 PHE C 10 12.091 -2.948 -9.742 1.00 0.43 H new ATOM 0 HD2 PHE C 10 15.099 0.116 -10.089 1.00 0.43 H new ATOM 0 HE1 PHE C 10 12.176 -3.315 -12.199 1.00 0.48 H new ATOM 0 HE2 PHE C 10 15.185 -0.249 -12.551 1.00 0.49 H new ATOM 0 HZ PHE C 10 13.725 -1.967 -13.605 1.00 0.48 H new ATOM 1575 N THR C 11 15.570 -1.041 -5.652 1.00 0.31 N ATOM 1576 CA THR C 11 15.666 -0.675 -4.208 1.00 0.32 C ATOM 1577 C THR C 11 14.892 0.623 -3.977 1.00 0.32 C ATOM 1578 O THR C 11 14.787 1.450 -4.857 1.00 0.38 O ATOM 1579 CB THR C 11 17.136 -0.477 -3.833 1.00 0.35 C ATOM 1580 OG1 THR C 11 17.695 0.551 -4.639 1.00 0.47 O ATOM 1581 CG2 THR C 11 17.899 -1.783 -4.062 1.00 0.38 C ATOM 0 H THR C 11 16.324 -0.685 -6.239 1.00 0.31 H new ATOM 0 HA THR C 11 15.244 -1.468 -3.590 1.00 0.32 H new ATOM 0 HB THR C 11 17.211 -0.194 -2.783 1.00 0.35 H new ATOM 0 HG1 THR C 11 18.636 0.680 -4.398 1.00 0.47 H new ATOM 0 HG21 THR C 11 18.947 -1.644 -3.795 1.00 0.38 H new ATOM 0 HG22 THR C 11 17.468 -2.570 -3.442 1.00 0.38 H new ATOM 0 HG23 THR C 11 17.826 -2.067 -5.112 1.00 0.38 H new ATOM 1589 N LEU C 12 14.347 0.811 -2.802 1.00 0.29 N ATOM 1590 CA LEU C 12 13.572 2.062 -2.528 1.00 0.29 C ATOM 1591 C LEU C 12 13.773 2.484 -1.072 1.00 0.28 C ATOM 1592 O LEU C 12 13.639 1.692 -0.161 1.00 0.27 O ATOM 1593 CB LEU C 12 12.082 1.790 -2.776 1.00 0.30 C ATOM 1594 CG LEU C 12 11.248 3.053 -2.504 1.00 0.33 C ATOM 1595 CD1 LEU C 12 11.678 4.193 -3.446 1.00 0.42 C ATOM 1596 CD2 LEU C 12 9.767 2.726 -2.730 1.00 0.37 C ATOM 0 H LEU C 12 14.404 0.156 -2.022 1.00 0.29 H new ATOM 0 HA LEU C 12 13.920 2.859 -3.185 1.00 0.29 H new ATOM 0 HB2 LEU C 12 11.933 1.464 -3.805 1.00 0.30 H new ATOM 0 HB3 LEU C 12 11.743 0.978 -2.132 1.00 0.30 H new ATOM 0 HG LEU C 12 11.407 3.377 -1.475 1.00 0.33 H new ATOM 0 HD11 LEU C 12 11.078 5.080 -3.241 1.00 0.42 H new ATOM 0 HD12 LEU C 12 12.731 4.421 -3.284 1.00 0.42 H new ATOM 0 HD13 LEU C 12 11.529 3.885 -4.481 1.00 0.42 H new ATOM 0 HD21 LEU C 12 9.165 3.615 -2.540 1.00 0.37 H new ATOM 0 HD22 LEU C 12 9.619 2.401 -3.760 1.00 0.37 H new ATOM 0 HD23 LEU C 12 9.463 1.930 -2.051 1.00 0.37 H new ATOM 1608 N GLN C 13 14.081 3.733 -0.846 1.00 0.32 N ATOM 1609 CA GLN C 13 14.278 4.213 0.549 1.00 0.33 C ATOM 1610 C GLN C 13 12.907 4.547 1.148 1.00 0.31 C ATOM 1611 O GLN C 13 12.118 5.249 0.548 1.00 0.33 O ATOM 1612 CB GLN C 13 15.159 5.463 0.528 1.00 0.42 C ATOM 1613 CG GLN C 13 15.509 5.867 1.956 1.00 0.50 C ATOM 1614 CD GLN C 13 16.474 7.050 1.923 1.00 0.86 C ATOM 1615 OE1 GLN C 13 17.291 7.208 2.809 1.00 1.81 O ATOM 1616 NE2 GLN C 13 16.423 7.887 0.925 1.00 0.86 N ATOM 0 H GLN C 13 14.204 4.441 -1.570 1.00 0.32 H new ATOM 0 HA GLN C 13 14.763 3.446 1.152 1.00 0.33 H new ATOM 0 HB2 GLN C 13 16.069 5.269 -0.039 1.00 0.42 H new ATOM 0 HB3 GLN C 13 14.638 6.279 0.026 1.00 0.42 H new ATOM 0 HG2 GLN C 13 14.605 6.135 2.502 1.00 0.50 H new ATOM 0 HG3 GLN C 13 15.962 5.027 2.483 1.00 0.50 H new ATOM 0 HE21 GLN C 13 15.737 7.754 0.182 1.00 0.86 H new ATOM 0 HE22 GLN C 13 17.069 8.675 0.887 1.00 0.86 H new ATOM 1625 N ILE C 14 12.609 4.032 2.320 1.00 0.29 N ATOM 1626 CA ILE C 14 11.276 4.295 2.958 1.00 0.29 C ATOM 1627 C ILE C 14 11.474 4.991 4.308 1.00 0.30 C ATOM 1628 O ILE C 14 12.131 4.484 5.195 1.00 0.31 O ATOM 1629 CB ILE C 14 10.570 2.951 3.160 1.00 0.32 C ATOM 1630 CG1 ILE C 14 10.388 2.279 1.790 1.00 0.33 C ATOM 1631 CG2 ILE C 14 9.198 3.176 3.808 1.00 0.42 C ATOM 1632 CD1 ILE C 14 9.914 0.829 1.963 1.00 0.29 C ATOM 0 H ILE C 14 13.235 3.438 2.864 1.00 0.29 H new ATOM 0 HA ILE C 14 10.674 4.943 2.321 1.00 0.29 H new ATOM 0 HB ILE C 14 11.169 2.314 3.812 1.00 0.32 H new ATOM 0 HG12 ILE C 14 9.663 2.837 1.198 1.00 0.33 H new ATOM 0 HG13 ILE C 14 11.329 2.297 1.241 1.00 0.33 H new ATOM 0 HG21 ILE C 14 8.701 2.216 3.949 1.00 0.42 H new ATOM 0 HG22 ILE C 14 9.328 3.663 4.774 1.00 0.42 H new ATOM 0 HG23 ILE C 14 8.590 3.808 3.161 1.00 0.42 H new ATOM 0 HD11 ILE C 14 9.790 0.367 0.983 1.00 0.29 H new ATOM 0 HD12 ILE C 14 10.654 0.270 2.536 1.00 0.29 H new ATOM 0 HD13 ILE C 14 8.961 0.818 2.492 1.00 0.29 H new ATOM 1644 N ARG C 15 10.907 6.157 4.459 1.00 0.33 N ATOM 1645 CA ARG C 15 11.047 6.914 5.736 1.00 0.37 C ATOM 1646 C ARG C 15 10.162 6.293 6.820 1.00 0.37 C ATOM 1647 O ARG C 15 9.062 5.850 6.560 1.00 0.40 O ATOM 1648 CB ARG C 15 10.629 8.368 5.497 1.00 0.43 C ATOM 1649 CG ARG C 15 10.812 9.191 6.776 1.00 0.46 C ATOM 1650 CD ARG C 15 10.387 10.634 6.500 1.00 0.91 C ATOM 1651 NE ARG C 15 10.754 11.506 7.666 1.00 1.25 N ATOM 1652 CZ ARG C 15 10.279 11.286 8.863 1.00 1.59 C ATOM 1653 NH1 ARG C 15 9.353 10.389 9.053 1.00 2.00 N ATOM 1654 NH2 ARG C 15 10.702 12.000 9.871 1.00 2.35 N ATOM 0 H ARG C 15 10.347 6.622 3.745 1.00 0.33 H new ATOM 0 HA ARG C 15 12.084 6.874 6.070 1.00 0.37 H new ATOM 0 HB2 ARG C 15 11.225 8.797 4.692 1.00 0.43 H new ATOM 0 HB3 ARG C 15 9.588 8.406 5.178 1.00 0.43 H new ATOM 0 HG2 ARG C 15 10.214 8.770 7.584 1.00 0.46 H new ATOM 0 HG3 ARG C 15 11.853 9.159 7.099 1.00 0.46 H new ATOM 0 HD2 ARG C 15 10.873 10.999 5.595 1.00 0.91 H new ATOM 0 HD3 ARG C 15 9.312 10.679 6.325 1.00 0.91 H new ATOM 0 HE ARG C 15 11.390 12.290 7.520 1.00 1.25 H new ATOM 0 HH11 ARG C 15 8.993 9.852 8.264 1.00 2.00 H new ATOM 0 HH12 ARG C 15 8.988 10.224 9.991 1.00 2.00 H new ATOM 0 HH21 ARG C 15 11.402 12.727 9.723 1.00 2.35 H new ATOM 0 HH22 ARG C 15 10.333 11.830 10.807 1.00 2.35 H new ATOM 1668 N GLY C 16 10.627 6.277 8.041 1.00 0.40 N ATOM 1669 CA GLY C 16 9.809 5.707 9.154 1.00 0.41 C ATOM 1670 C GLY C 16 10.038 4.198 9.265 1.00 0.37 C ATOM 1671 O GLY C 16 9.767 3.450 8.347 1.00 0.35 O ATOM 0 H GLY C 16 11.541 6.635 8.317 1.00 0.40 H new ATOM 0 HA2 GLY C 16 10.074 6.192 10.094 1.00 0.41 H new ATOM 0 HA3 GLY C 16 8.752 5.909 8.978 1.00 0.41 H new ATOM 1675 N ARG C 17 10.520 3.745 10.392 1.00 0.41 N ATOM 1676 CA ARG C 17 10.750 2.282 10.571 1.00 0.42 C ATOM 1677 C ARG C 17 9.412 1.547 10.474 1.00 0.40 C ATOM 1678 O ARG C 17 9.303 0.515 9.845 1.00 0.39 O ATOM 1679 CB ARG C 17 11.377 2.028 11.947 1.00 0.50 C ATOM 1680 CG ARG C 17 11.707 0.539 12.097 1.00 0.62 C ATOM 1681 CD ARG C 17 12.339 0.300 13.471 1.00 1.14 C ATOM 1682 NE ARG C 17 12.815 -1.121 13.578 1.00 1.44 N ATOM 1683 CZ ARG C 17 11.999 -2.132 13.442 1.00 1.88 C ATOM 1684 NH1 ARG C 17 10.711 -1.936 13.370 1.00 2.34 N ATOM 1685 NH2 ARG C 17 12.472 -3.350 13.427 1.00 2.59 N ATOM 0 H ARG C 17 10.764 4.324 11.195 1.00 0.41 H new ATOM 0 HA ARG C 17 11.424 1.918 9.795 1.00 0.42 H new ATOM 0 HB2 ARG C 17 12.282 2.624 12.061 1.00 0.50 H new ATOM 0 HB3 ARG C 17 10.690 2.339 12.734 1.00 0.50 H new ATOM 0 HG2 ARG C 17 10.802 -0.059 11.991 1.00 0.62 H new ATOM 0 HG3 ARG C 17 12.391 0.225 11.309 1.00 0.62 H new ATOM 0 HD2 ARG C 17 13.174 0.984 13.620 1.00 1.14 H new ATOM 0 HD3 ARG C 17 11.612 0.509 14.256 1.00 1.14 H new ATOM 0 HE ARG C 17 13.802 -1.301 13.762 1.00 1.44 H new ATOM 0 HH11 ARG C 17 10.336 -0.989 13.420 1.00 2.34 H new ATOM 0 HH12 ARG C 17 10.079 -2.730 13.264 1.00 2.34 H new ATOM 0 HH21 ARG C 17 13.475 -3.509 13.521 1.00 2.59 H new ATOM 0 HH22 ARG C 17 11.838 -4.142 13.321 1.00 2.59 H new ATOM 1699 N GLU C 18 8.389 2.070 11.096 1.00 0.44 N ATOM 1700 CA GLU C 18 7.059 1.398 11.038 1.00 0.46 C ATOM 1701 C GLU C 18 6.606 1.306 9.579 1.00 0.40 C ATOM 1702 O GLU C 18 6.084 0.302 9.139 1.00 0.38 O ATOM 1703 CB GLU C 18 6.045 2.216 11.843 1.00 0.53 C ATOM 1704 CG GLU C 18 4.680 1.524 11.816 1.00 1.19 C ATOM 1705 CD GLU C 18 3.687 2.334 12.651 1.00 1.86 C ATOM 1706 OE1 GLU C 18 4.118 3.270 13.305 1.00 2.54 O ATOM 1707 OE2 GLU C 18 2.512 2.006 12.624 1.00 2.39 O ATOM 0 H GLU C 18 8.417 2.932 11.641 1.00 0.44 H new ATOM 0 HA GLU C 18 7.131 0.395 11.460 1.00 0.46 H new ATOM 0 HB2 GLU C 18 6.387 2.325 12.872 1.00 0.53 H new ATOM 0 HB3 GLU C 18 5.962 3.220 11.427 1.00 0.53 H new ATOM 0 HG2 GLU C 18 4.324 1.437 10.790 1.00 1.19 H new ATOM 0 HG3 GLU C 18 4.765 0.512 12.211 1.00 1.19 H new ATOM 1714 N ARG C 19 6.814 2.351 8.827 1.00 0.41 N ATOM 1715 CA ARG C 19 6.411 2.339 7.393 1.00 0.39 C ATOM 1716 C ARG C 19 7.152 1.213 6.666 1.00 0.33 C ATOM 1717 O ARG C 19 6.601 0.533 5.823 1.00 0.30 O ATOM 1718 CB ARG C 19 6.761 3.681 6.752 1.00 0.47 C ATOM 1719 CG ARG C 19 6.142 3.751 5.354 1.00 0.67 C ATOM 1720 CD ARG C 19 6.490 5.092 4.707 1.00 1.24 C ATOM 1721 NE ARG C 19 5.796 6.194 5.429 1.00 1.75 N ATOM 1722 CZ ARG C 19 6.188 7.425 5.260 1.00 2.56 C ATOM 1723 NH1 ARG C 19 7.162 7.689 4.433 1.00 2.94 N ATOM 1724 NH2 ARG C 19 5.599 8.393 5.906 1.00 3.39 N ATOM 0 H ARG C 19 7.248 3.217 9.146 1.00 0.41 H new ATOM 0 HA ARG C 19 5.336 2.174 7.318 1.00 0.39 H new ATOM 0 HB2 ARG C 19 6.389 4.499 7.368 1.00 0.47 H new ATOM 0 HB3 ARG C 19 7.843 3.796 6.689 1.00 0.47 H new ATOM 0 HG2 ARG C 19 6.514 2.931 4.739 1.00 0.67 H new ATOM 0 HG3 ARG C 19 5.060 3.636 5.418 1.00 0.67 H new ATOM 0 HD2 ARG C 19 7.568 5.250 4.733 1.00 1.24 H new ATOM 0 HD3 ARG C 19 6.193 5.088 3.658 1.00 1.24 H new ATOM 0 HE ARG C 19 5.017 5.986 6.053 1.00 1.75 H new ATOM 0 HH11 ARG C 19 7.615 6.932 3.920 1.00 2.94 H new ATOM 0 HH12 ARG C 19 7.470 8.652 4.299 1.00 2.94 H new ATOM 0 HH21 ARG C 19 4.831 8.187 6.544 1.00 3.39 H new ATOM 0 HH22 ARG C 19 5.907 9.356 5.773 1.00 3.39 H new ATOM 1738 N PHE C 20 8.402 1.019 6.984 1.00 0.33 N ATOM 1739 CA PHE C 20 9.188 -0.054 6.313 1.00 0.31 C ATOM 1740 C PHE C 20 8.517 -1.408 6.547 1.00 0.29 C ATOM 1741 O PHE C 20 8.302 -2.168 5.623 1.00 0.28 O ATOM 1742 CB PHE C 20 10.609 -0.077 6.885 1.00 0.36 C ATOM 1743 CG PHE C 20 11.343 -1.303 6.391 1.00 0.35 C ATOM 1744 CD1 PHE C 20 12.084 -1.250 5.197 1.00 0.36 C ATOM 1745 CD2 PHE C 20 11.286 -2.500 7.134 1.00 0.42 C ATOM 1746 CE1 PHE C 20 12.770 -2.392 4.745 1.00 0.41 C ATOM 1747 CE2 PHE C 20 11.970 -3.642 6.681 1.00 0.47 C ATOM 1748 CZ PHE C 20 12.714 -3.590 5.486 1.00 0.45 C ATOM 0 H PHE C 20 8.914 1.559 7.682 1.00 0.33 H new ATOM 0 HA PHE C 20 9.231 0.144 5.242 1.00 0.31 H new ATOM 0 HB2 PHE C 20 11.145 0.824 6.586 1.00 0.36 H new ATOM 0 HB3 PHE C 20 10.572 -0.079 7.974 1.00 0.36 H new ATOM 0 HD1 PHE C 20 12.126 -0.333 4.627 1.00 0.36 H new ATOM 0 HD2 PHE C 20 10.717 -2.540 8.051 1.00 0.42 H new ATOM 0 HE1 PHE C 20 13.340 -2.351 3.829 1.00 0.41 H new ATOM 0 HE2 PHE C 20 11.925 -4.559 7.249 1.00 0.47 H new ATOM 0 HZ PHE C 20 13.241 -4.466 5.138 1.00 0.45 H new ATOM 1758 N GLU C 21 8.189 -1.722 7.768 1.00 0.32 N ATOM 1759 CA GLU C 21 7.535 -3.029 8.036 1.00 0.34 C ATOM 1760 C GLU C 21 6.227 -3.091 7.252 1.00 0.31 C ATOM 1761 O GLU C 21 5.883 -4.102 6.673 1.00 0.32 O ATOM 1762 CB GLU C 21 7.234 -3.157 9.530 1.00 0.40 C ATOM 1763 CG GLU C 21 8.539 -3.321 10.311 1.00 0.53 C ATOM 1764 CD GLU C 21 8.224 -3.441 11.804 1.00 0.96 C ATOM 1765 OE1 GLU C 21 7.073 -3.249 12.162 1.00 1.66 O ATOM 1766 OE2 GLU C 21 9.134 -3.732 12.561 1.00 1.65 O ATOM 0 H GLU C 21 8.345 -1.134 8.587 1.00 0.32 H new ATOM 0 HA GLU C 21 8.195 -3.841 7.732 1.00 0.34 H new ATOM 0 HB2 GLU C 21 6.699 -2.274 9.879 1.00 0.40 H new ATOM 0 HB3 GLU C 21 6.584 -4.014 9.707 1.00 0.40 H new ATOM 0 HG2 GLU C 21 9.072 -4.207 9.968 1.00 0.53 H new ATOM 0 HG3 GLU C 21 9.192 -2.467 10.133 1.00 0.53 H new ATOM 1773 N MET C 22 5.496 -2.014 7.222 1.00 0.29 N ATOM 1774 CA MET C 22 4.216 -2.011 6.469 1.00 0.28 C ATOM 1775 C MET C 22 4.493 -2.266 4.985 1.00 0.26 C ATOM 1776 O MET C 22 3.884 -3.116 4.367 1.00 0.27 O ATOM 1777 CB MET C 22 3.545 -0.649 6.635 1.00 0.29 C ATOM 1778 CG MET C 22 2.199 -0.653 5.916 1.00 0.34 C ATOM 1779 SD MET C 22 1.330 0.900 6.256 1.00 0.47 S ATOM 1780 CE MET C 22 2.296 1.975 5.168 1.00 0.61 C ATOM 0 H MET C 22 5.730 -1.137 7.686 1.00 0.29 H new ATOM 0 HA MET C 22 3.562 -2.794 6.852 1.00 0.28 H new ATOM 0 HB2 MET C 22 3.403 -0.428 7.693 1.00 0.29 H new ATOM 0 HB3 MET C 22 4.184 0.135 6.229 1.00 0.29 H new ATOM 0 HG2 MET C 22 2.348 -0.772 4.843 1.00 0.34 H new ATOM 0 HG3 MET C 22 1.598 -1.499 6.250 1.00 0.34 H new ATOM 0 HE1 MET C 22 1.766 2.916 5.022 1.00 0.61 H new ATOM 0 HE2 MET C 22 3.268 2.172 5.621 1.00 0.61 H new ATOM 0 HE3 MET C 22 2.437 1.485 4.204 1.00 0.61 H new ATOM 1790 N PHE C 23 5.412 -1.538 4.410 1.00 0.23 N ATOM 1791 CA PHE C 23 5.733 -1.738 2.967 1.00 0.23 C ATOM 1792 C PHE C 23 6.251 -3.161 2.753 1.00 0.23 C ATOM 1793 O PHE C 23 5.917 -3.814 1.783 1.00 0.25 O ATOM 1794 CB PHE C 23 6.811 -0.727 2.544 1.00 0.22 C ATOM 1795 CG PHE C 23 6.175 0.606 2.185 1.00 0.23 C ATOM 1796 CD1 PHE C 23 5.310 1.251 3.092 1.00 0.22 C ATOM 1797 CD2 PHE C 23 6.453 1.202 0.937 1.00 0.30 C ATOM 1798 CE1 PHE C 23 4.725 2.487 2.750 1.00 0.26 C ATOM 1799 CE2 PHE C 23 5.868 2.436 0.599 1.00 0.33 C ATOM 1800 CZ PHE C 23 5.004 3.078 1.504 1.00 0.30 C ATOM 0 H PHE C 23 5.955 -0.812 4.878 1.00 0.23 H new ATOM 0 HA PHE C 23 4.836 -1.587 2.366 1.00 0.23 H new ATOM 0 HB2 PHE C 23 7.527 -0.589 3.354 1.00 0.22 H new ATOM 0 HB3 PHE C 23 7.367 -1.114 1.690 1.00 0.22 H new ATOM 0 HD1 PHE C 23 5.096 0.798 4.049 1.00 0.22 H new ATOM 0 HD2 PHE C 23 7.116 0.710 0.240 1.00 0.30 H new ATOM 0 HE1 PHE C 23 4.062 2.981 3.445 1.00 0.26 H new ATOM 0 HE2 PHE C 23 6.083 2.891 -0.357 1.00 0.33 H new ATOM 0 HZ PHE C 23 4.555 4.025 1.243 1.00 0.30 H new ATOM 1810 N ARG C 24 7.062 -3.645 3.651 1.00 0.27 N ATOM 1811 CA ARG C 24 7.601 -5.022 3.502 1.00 0.30 C ATOM 1812 C ARG C 24 6.434 -6.007 3.459 1.00 0.28 C ATOM 1813 O ARG C 24 6.406 -6.922 2.659 1.00 0.28 O ATOM 1814 CB ARG C 24 8.511 -5.338 4.691 1.00 0.36 C ATOM 1815 CG ARG C 24 9.071 -6.754 4.549 1.00 0.42 C ATOM 1816 CD ARG C 24 10.070 -7.021 5.675 1.00 1.13 C ATOM 1817 NE ARG C 24 9.370 -6.924 6.988 1.00 1.77 N ATOM 1818 CZ ARG C 24 9.948 -7.369 8.068 1.00 2.41 C ATOM 1819 NH1 ARG C 24 11.137 -7.901 7.998 1.00 2.75 N ATOM 1820 NH2 ARG C 24 9.342 -7.283 9.219 1.00 3.28 N ATOM 0 H ARG C 24 7.375 -3.144 4.483 1.00 0.27 H new ATOM 0 HA ARG C 24 8.178 -5.104 2.581 1.00 0.30 H new ATOM 0 HB2 ARG C 24 9.327 -4.617 4.739 1.00 0.36 H new ATOM 0 HB3 ARG C 24 7.952 -5.249 5.623 1.00 0.36 H new ATOM 0 HG2 ARG C 24 8.261 -7.483 4.586 1.00 0.42 H new ATOM 0 HG3 ARG C 24 9.558 -6.869 3.581 1.00 0.42 H new ATOM 0 HD2 ARG C 24 10.512 -8.011 5.558 1.00 1.13 H new ATOM 0 HD3 ARG C 24 10.886 -6.300 5.631 1.00 1.13 H new ATOM 0 HE ARG C 24 8.439 -6.510 7.041 1.00 1.77 H new ATOM 0 HH11 ARG C 24 11.613 -7.968 7.099 1.00 2.75 H new ATOM 0 HH12 ARG C 24 11.590 -8.250 8.843 1.00 2.75 H new ATOM 0 HH21 ARG C 24 8.413 -6.866 9.276 1.00 3.28 H new ATOM 0 HH22 ARG C 24 9.797 -7.632 10.062 1.00 3.28 H new ATOM 1834 N GLU C 25 5.461 -5.817 4.306 1.00 0.28 N ATOM 1835 CA GLU C 25 4.287 -6.730 4.309 1.00 0.30 C ATOM 1836 C GLU C 25 3.609 -6.668 2.938 1.00 0.25 C ATOM 1837 O GLU C 25 3.292 -7.680 2.344 1.00 0.26 O ATOM 1838 CB GLU C 25 3.307 -6.283 5.402 1.00 0.34 C ATOM 1839 CG GLU C 25 2.111 -7.240 5.465 1.00 0.38 C ATOM 1840 CD GLU C 25 2.584 -8.626 5.908 1.00 1.05 C ATOM 1841 OE1 GLU C 25 3.682 -8.718 6.431 1.00 1.78 O ATOM 1842 OE2 GLU C 25 1.837 -9.573 5.720 1.00 1.70 O ATOM 0 H GLU C 25 5.429 -5.067 4.997 1.00 0.28 H new ATOM 0 HA GLU C 25 4.603 -7.754 4.510 1.00 0.30 H new ATOM 0 HB2 GLU C 25 3.814 -6.259 6.367 1.00 0.34 H new ATOM 0 HB3 GLU C 25 2.961 -5.270 5.198 1.00 0.34 H new ATOM 0 HG2 GLU C 25 1.365 -6.860 6.162 1.00 0.38 H new ATOM 0 HG3 GLU C 25 1.632 -7.304 4.488 1.00 0.38 H new ATOM 1849 N LEU C 26 3.385 -5.487 2.428 1.00 0.23 N ATOM 1850 CA LEU C 26 2.729 -5.364 1.097 1.00 0.24 C ATOM 1851 C LEU C 26 3.602 -6.028 0.031 1.00 0.23 C ATOM 1852 O LEU C 26 3.121 -6.764 -0.807 1.00 0.25 O ATOM 1853 CB LEU C 26 2.552 -3.885 0.746 1.00 0.26 C ATOM 1854 CG LEU C 26 1.658 -3.196 1.784 1.00 0.30 C ATOM 1855 CD1 LEU C 26 1.571 -1.703 1.452 1.00 0.36 C ATOM 1856 CD2 LEU C 26 0.247 -3.814 1.764 1.00 0.38 C ATOM 0 H LEU C 26 3.628 -4.603 2.876 1.00 0.23 H new ATOM 0 HA LEU C 26 1.755 -5.853 1.132 1.00 0.24 H new ATOM 0 HB2 LEU C 26 3.524 -3.394 0.710 1.00 0.26 H new ATOM 0 HB3 LEU C 26 2.110 -3.790 -0.246 1.00 0.26 H new ATOM 0 HG LEU C 26 2.085 -3.332 2.778 1.00 0.30 H new ATOM 0 HD11 LEU C 26 0.937 -1.204 2.185 1.00 0.36 H new ATOM 0 HD12 LEU C 26 2.569 -1.266 1.478 1.00 0.36 H new ATOM 0 HD13 LEU C 26 1.145 -1.576 0.457 1.00 0.36 H new ATOM 0 HD21 LEU C 26 -0.379 -3.317 2.505 1.00 0.38 H new ATOM 0 HD22 LEU C 26 -0.192 -3.687 0.774 1.00 0.38 H new ATOM 0 HD23 LEU C 26 0.312 -4.877 1.998 1.00 0.38 H new ATOM 1868 N ASN C 27 4.881 -5.774 0.054 1.00 0.28 N ATOM 1869 CA ASN C 27 5.778 -6.391 -0.963 1.00 0.31 C ATOM 1870 C ASN C 27 5.701 -7.914 -0.855 1.00 0.26 C ATOM 1871 O ASN C 27 5.514 -8.610 -1.835 1.00 0.25 O ATOM 1872 CB ASN C 27 7.218 -5.937 -0.719 1.00 0.41 C ATOM 1873 CG ASN C 27 8.125 -6.528 -1.800 1.00 0.50 C ATOM 1874 OD1 ASN C 27 7.651 -6.985 -2.821 1.00 1.20 O ATOM 1875 ND2 ASN C 27 9.418 -6.538 -1.619 1.00 0.55 N ATOM 0 H ASN C 27 5.343 -5.167 0.731 1.00 0.28 H new ATOM 0 HA ASN C 27 5.463 -6.080 -1.959 1.00 0.31 H new ATOM 0 HB2 ASN C 27 7.276 -4.849 -0.735 1.00 0.41 H new ATOM 0 HB3 ASN C 27 7.551 -6.260 0.267 1.00 0.41 H new ATOM 0 HD21 ASN C 27 10.030 -6.929 -2.335 1.00 0.55 H new ATOM 0 HD22 ASN C 27 9.816 -6.154 -0.762 1.00 0.55 H new ATOM 1882 N GLU C 28 5.850 -8.437 0.333 1.00 0.27 N ATOM 1883 CA GLU C 28 5.791 -9.914 0.518 1.00 0.28 C ATOM 1884 C GLU C 28 4.426 -10.442 0.071 1.00 0.24 C ATOM 1885 O GLU C 28 4.322 -11.486 -0.539 1.00 0.26 O ATOM 1886 CB GLU C 28 6.002 -10.248 1.995 1.00 0.35 C ATOM 1887 CG GLU C 28 6.082 -11.767 2.168 1.00 0.45 C ATOM 1888 CD GLU C 28 6.384 -12.105 3.628 1.00 1.36 C ATOM 1889 OE1 GLU C 28 6.671 -11.190 4.381 1.00 2.10 O ATOM 1890 OE2 GLU C 28 6.325 -13.276 3.969 1.00 2.12 O ATOM 0 H GLU C 28 6.011 -7.901 1.186 1.00 0.27 H new ATOM 0 HA GLU C 28 6.571 -10.382 -0.083 1.00 0.28 H new ATOM 0 HB2 GLU C 28 6.918 -9.781 2.357 1.00 0.35 H new ATOM 0 HB3 GLU C 28 5.182 -9.846 2.591 1.00 0.35 H new ATOM 0 HG2 GLU C 28 5.141 -12.227 1.865 1.00 0.45 H new ATOM 0 HG3 GLU C 28 6.859 -12.176 1.522 1.00 0.45 H new ATOM 1897 N ALA C 29 3.375 -9.736 0.381 1.00 0.22 N ATOM 1898 CA ALA C 29 2.021 -10.208 -0.017 1.00 0.23 C ATOM 1899 C ALA C 29 1.940 -10.335 -1.542 1.00 0.24 C ATOM 1900 O ALA C 29 1.515 -11.346 -2.065 1.00 0.26 O ATOM 1901 CB ALA C 29 0.970 -9.212 0.482 1.00 0.26 C ATOM 0 H ALA C 29 3.395 -8.854 0.892 1.00 0.22 H new ATOM 0 HA ALA C 29 1.832 -11.185 0.427 1.00 0.23 H new ATOM 0 HB1 ALA C 29 -0.023 -9.555 0.192 1.00 0.26 H new ATOM 0 HB2 ALA C 29 1.025 -9.138 1.568 1.00 0.26 H new ATOM 0 HB3 ALA C 29 1.159 -8.233 0.042 1.00 0.26 H new ATOM 1907 N LEU C 30 2.339 -9.320 -2.260 1.00 0.24 N ATOM 1908 CA LEU C 30 2.276 -9.400 -3.749 1.00 0.26 C ATOM 1909 C LEU C 30 3.177 -10.544 -4.226 1.00 0.29 C ATOM 1910 O LEU C 30 2.815 -11.314 -5.096 1.00 0.31 O ATOM 1911 CB LEU C 30 2.758 -8.072 -4.345 1.00 0.29 C ATOM 1912 CG LEU C 30 1.772 -6.947 -3.989 1.00 0.30 C ATOM 1913 CD1 LEU C 30 2.389 -5.599 -4.374 1.00 0.40 C ATOM 1914 CD2 LEU C 30 0.439 -7.132 -4.741 1.00 0.32 C ATOM 0 H LEU C 30 2.703 -8.445 -1.884 1.00 0.24 H new ATOM 0 HA LEU C 30 1.252 -9.588 -4.072 1.00 0.26 H new ATOM 0 HB2 LEU C 30 3.750 -7.831 -3.963 1.00 0.29 H new ATOM 0 HB3 LEU C 30 2.846 -8.161 -5.428 1.00 0.29 H new ATOM 0 HG LEU C 30 1.574 -6.978 -2.918 1.00 0.30 H new ATOM 0 HD11 LEU C 30 1.695 -4.797 -4.124 1.00 0.40 H new ATOM 0 HD12 LEU C 30 3.321 -5.456 -3.827 1.00 0.40 H new ATOM 0 HD13 LEU C 30 2.591 -5.584 -5.445 1.00 0.40 H new ATOM 0 HD21 LEU C 30 -0.244 -6.325 -4.475 1.00 0.32 H new ATOM 0 HD22 LEU C 30 0.622 -7.113 -5.815 1.00 0.32 H new ATOM 0 HD23 LEU C 30 -0.004 -8.089 -4.465 1.00 0.32 H new ATOM 1926 N GLU C 31 4.340 -10.673 -3.648 1.00 0.34 N ATOM 1927 CA GLU C 31 5.259 -11.778 -4.049 1.00 0.39 C ATOM 1928 C GLU C 31 4.577 -13.117 -3.784 1.00 0.34 C ATOM 1929 O GLU C 31 4.696 -14.051 -4.551 1.00 0.35 O ATOM 1930 CB GLU C 31 6.560 -11.692 -3.246 1.00 0.47 C ATOM 1931 CG GLU C 31 7.354 -10.469 -3.705 1.00 0.59 C ATOM 1932 CD GLU C 31 8.595 -10.308 -2.828 1.00 1.29 C ATOM 1933 OE1 GLU C 31 8.760 -11.105 -1.919 1.00 1.91 O ATOM 1934 OE2 GLU C 31 9.361 -9.393 -3.081 1.00 2.09 O ATOM 0 H GLU C 31 4.695 -10.060 -2.914 1.00 0.34 H new ATOM 0 HA GLU C 31 5.493 -11.689 -5.110 1.00 0.39 H new ATOM 0 HB2 GLU C 31 6.340 -11.619 -2.181 1.00 0.47 H new ATOM 0 HB3 GLU C 31 7.150 -12.598 -3.388 1.00 0.47 H new ATOM 0 HG2 GLU C 31 7.646 -10.583 -4.749 1.00 0.59 H new ATOM 0 HG3 GLU C 31 6.733 -9.575 -3.643 1.00 0.59 H new ATOM 1941 N LEU C 32 3.875 -13.222 -2.690 1.00 0.32 N ATOM 1942 CA LEU C 32 3.189 -14.501 -2.359 1.00 0.32 C ATOM 1943 C LEU C 32 2.188 -14.835 -3.467 1.00 0.30 C ATOM 1944 O LEU C 32 2.170 -15.929 -3.995 1.00 0.33 O ATOM 1945 CB LEU C 32 2.463 -14.338 -1.017 1.00 0.35 C ATOM 1946 CG LEU C 32 1.739 -15.634 -0.625 1.00 0.44 C ATOM 1947 CD1 LEU C 32 2.759 -16.757 -0.368 1.00 0.75 C ATOM 1948 CD2 LEU C 32 0.938 -15.381 0.655 1.00 0.72 C ATOM 0 H LEU C 32 3.747 -12.474 -2.009 1.00 0.32 H new ATOM 0 HA LEU C 32 3.913 -15.312 -2.281 1.00 0.32 H new ATOM 0 HB2 LEU C 32 3.180 -14.068 -0.241 1.00 0.35 H new ATOM 0 HB3 LEU C 32 1.744 -13.521 -1.085 1.00 0.35 H new ATOM 0 HG LEU C 32 1.076 -15.937 -1.436 1.00 0.44 H new ATOM 0 HD11 LEU C 32 2.233 -17.670 -0.091 1.00 0.75 H new ATOM 0 HD12 LEU C 32 3.341 -16.934 -1.272 1.00 0.75 H new ATOM 0 HD13 LEU C 32 3.427 -16.463 0.442 1.00 0.75 H new ATOM 0 HD21 LEU C 32 0.418 -16.294 0.945 1.00 0.72 H new ATOM 0 HD22 LEU C 32 1.615 -15.079 1.454 1.00 0.72 H new ATOM 0 HD23 LEU C 32 0.210 -14.589 0.478 1.00 0.72 H new ATOM 1960 N LYS C 33 1.361 -13.891 -3.829 1.00 0.31 N ATOM 1961 CA LYS C 33 0.366 -14.144 -4.907 1.00 0.35 C ATOM 1962 C LYS C 33 1.100 -14.502 -6.199 1.00 0.39 C ATOM 1963 O LYS C 33 0.689 -15.377 -6.934 1.00 0.44 O ATOM 1964 CB LYS C 33 -0.477 -12.886 -5.131 1.00 0.40 C ATOM 1965 CG LYS C 33 -1.607 -13.199 -6.117 1.00 0.51 C ATOM 1966 CD LYS C 33 -2.382 -11.919 -6.444 1.00 0.82 C ATOM 1967 CE LYS C 33 -3.094 -11.393 -5.193 1.00 1.34 C ATOM 1968 NZ LYS C 33 -4.216 -10.502 -5.605 1.00 2.19 N ATOM 0 H LYS C 33 1.333 -12.955 -3.424 1.00 0.31 H new ATOM 0 HA LYS C 33 -0.285 -14.969 -4.616 1.00 0.35 H new ATOM 0 HB2 LYS C 33 -0.891 -12.539 -4.184 1.00 0.40 H new ATOM 0 HB3 LYS C 33 0.147 -12.081 -5.520 1.00 0.40 H new ATOM 0 HG2 LYS C 33 -1.196 -13.629 -7.030 1.00 0.51 H new ATOM 0 HG3 LYS C 33 -2.279 -13.943 -5.689 1.00 0.51 H new ATOM 0 HD2 LYS C 33 -1.699 -11.161 -6.828 1.00 0.82 H new ATOM 0 HD3 LYS C 33 -3.111 -12.118 -7.229 1.00 0.82 H new ATOM 0 HE2 LYS C 33 -3.474 -12.225 -4.599 1.00 1.34 H new ATOM 0 HE3 LYS C 33 -2.392 -10.846 -4.563 1.00 1.34 H new ATOM 0 HZ1 LYS C 33 -4.754 -10.210 -4.764 1.00 2.19 H new ATOM 0 HZ2 LYS C 33 -3.834 -9.660 -6.081 1.00 2.19 H new ATOM 0 HZ3 LYS C 33 -4.844 -11.013 -6.258 1.00 2.19 H new ATOM 1982 N ASP C 34 2.187 -13.832 -6.479 1.00 0.42 N ATOM 1983 CA ASP C 34 2.949 -14.132 -7.724 1.00 0.49 C ATOM 1984 C ASP C 34 3.413 -15.587 -7.701 1.00 0.50 C ATOM 1985 O ASP C 34 3.385 -16.274 -8.701 1.00 0.57 O ATOM 1986 CB ASP C 34 4.166 -13.209 -7.816 1.00 0.58 C ATOM 1987 CG ASP C 34 3.707 -11.780 -8.112 1.00 0.69 C ATOM 1988 OD1 ASP C 34 2.576 -11.621 -8.543 1.00 1.27 O ATOM 1989 OD2 ASP C 34 4.495 -10.871 -7.911 1.00 1.34 O ATOM 0 H ASP C 34 2.579 -13.090 -5.899 1.00 0.42 H new ATOM 0 HA ASP C 34 2.306 -13.970 -8.589 1.00 0.49 H new ATOM 0 HB2 ASP C 34 4.726 -13.235 -6.881 1.00 0.58 H new ATOM 0 HB3 ASP C 34 4.839 -13.555 -8.601 1.00 0.58 H new ATOM 1994 N ALA C 35 3.841 -16.064 -6.566 1.00 0.52 N ATOM 1995 CA ALA C 35 4.308 -17.476 -6.477 1.00 0.60 C ATOM 1996 C ALA C 35 3.166 -18.422 -6.857 1.00 0.60 C ATOM 1997 O ALA C 35 3.376 -19.428 -7.504 1.00 0.72 O ATOM 1998 CB ALA C 35 4.758 -17.772 -5.046 1.00 0.71 C ATOM 0 H ALA C 35 3.888 -15.536 -5.694 1.00 0.52 H new ATOM 0 HA ALA C 35 5.143 -17.625 -7.162 1.00 0.60 H new ATOM 0 HB1 ALA C 35 5.100 -18.805 -4.978 1.00 0.71 H new ATOM 0 HB2 ALA C 35 5.573 -17.101 -4.775 1.00 0.71 H new ATOM 0 HB3 ALA C 35 3.922 -17.621 -4.363 1.00 0.71 H new ATOM 2004 N GLN C 36 1.960 -18.116 -6.458 1.00 0.58 N ATOM 2005 CA GLN C 36 0.814 -19.007 -6.798 1.00 0.70 C ATOM 2006 C GLN C 36 0.364 -18.735 -8.235 1.00 0.73 C ATOM 2007 O GLN C 36 -0.423 -19.468 -8.799 1.00 0.96 O ATOM 2008 CB GLN C 36 -0.349 -18.728 -5.842 1.00 0.79 C ATOM 2009 CG GLN C 36 0.009 -19.226 -4.443 1.00 1.13 C ATOM 2010 CD GLN C 36 -1.152 -18.943 -3.492 1.00 1.20 C ATOM 2011 OE1 GLN C 36 -0.898 -18.524 -2.284 1.00 1.80 O flip ATOM 2012 NE2 GLN C 36 -2.302 -19.098 -3.851 1.00 1.12 N flip ATOM 0 H GLN C 36 1.720 -17.289 -5.912 1.00 0.58 H new ATOM 0 HA GLN C 36 1.124 -20.048 -6.704 1.00 0.70 H new ATOM 0 HB2 GLN C 36 -0.563 -17.660 -5.815 1.00 0.79 H new ATOM 0 HB3 GLN C 36 -1.252 -19.225 -6.196 1.00 0.79 H new ATOM 0 HG2 GLN C 36 0.221 -20.295 -4.468 1.00 1.13 H new ATOM 0 HG3 GLN C 36 0.913 -18.731 -4.089 1.00 1.13 H new ATOM 0 HE21 GLN C 36 -2.501 -19.426 -4.796 1.00 1.12 H new ATOM 0 HE22 GLN C 36 -3.068 -18.900 -3.207 1.00 1.12 H new ATOM 2021 N ALA C 37 0.861 -17.686 -8.829 1.00 0.66 N ATOM 2022 CA ALA C 37 0.467 -17.361 -10.230 1.00 0.81 C ATOM 2023 C ALA C 37 1.071 -18.392 -11.186 1.00 0.96 C ATOM 2024 O ALA C 37 0.619 -18.555 -12.303 1.00 1.39 O ATOM 2025 CB ALA C 37 0.982 -15.966 -10.589 1.00 0.92 C ATOM 0 H ALA C 37 1.524 -17.038 -8.404 1.00 0.66 H new ATOM 0 HA ALA C 37 -0.619 -17.383 -10.317 1.00 0.81 H new ATOM 0 HB1 ALA C 37 0.696 -15.725 -11.613 1.00 0.92 H new ATOM 0 HB2 ALA C 37 0.549 -15.232 -9.909 1.00 0.92 H new ATOM 0 HB3 ALA C 37 2.068 -15.946 -10.502 1.00 0.92 H new ATOM 2031 N GLY C 38 2.088 -19.089 -10.759 1.00 1.01 N ATOM 2032 CA GLY C 38 2.722 -20.109 -11.645 1.00 1.28 C ATOM 2033 C GLY C 38 1.798 -21.323 -11.775 1.00 1.31 C ATOM 2034 O GLY C 38 2.248 -22.444 -11.904 1.00 1.66 O ATOM 0 H GLY C 38 2.508 -18.997 -9.834 1.00 1.01 H new ATOM 0 HA2 GLY C 38 2.917 -19.681 -12.628 1.00 1.28 H new ATOM 0 HA3 GLY C 38 3.684 -20.414 -11.234 1.00 1.28 H new ATOM 2038 N LYS C 39 0.509 -21.111 -11.736 1.00 1.57 N ATOM 2039 CA LYS C 39 -0.443 -22.256 -11.849 1.00 1.88 C ATOM 2040 C LYS C 39 -0.672 -22.573 -13.331 1.00 2.17 C ATOM 2041 O LYS C 39 -0.178 -23.555 -13.847 1.00 2.57 O ATOM 2042 CB LYS C 39 -1.774 -21.869 -11.181 1.00 2.39 C ATOM 2043 CG LYS C 39 -2.792 -23.024 -11.266 1.00 2.87 C ATOM 2044 CD LYS C 39 -2.322 -24.209 -10.407 1.00 3.33 C ATOM 2045 CE LYS C 39 -3.509 -25.124 -10.091 1.00 4.10 C ATOM 2046 NZ LYS C 39 -3.060 -26.238 -9.206 1.00 4.45 N ATOM 0 H LYS C 39 0.074 -20.195 -11.631 1.00 1.57 H new ATOM 0 HA LYS C 39 -0.034 -23.136 -11.353 1.00 1.88 H new ATOM 0 HB2 LYS C 39 -1.599 -21.610 -10.137 1.00 2.39 H new ATOM 0 HB3 LYS C 39 -2.184 -20.982 -11.665 1.00 2.39 H new ATOM 0 HG2 LYS C 39 -3.769 -22.683 -10.925 1.00 2.87 H new ATOM 0 HG3 LYS C 39 -2.909 -23.340 -12.303 1.00 2.87 H new ATOM 0 HD2 LYS C 39 -1.550 -24.769 -10.935 1.00 3.33 H new ATOM 0 HD3 LYS C 39 -1.875 -23.845 -9.482 1.00 3.33 H new ATOM 0 HE2 LYS C 39 -4.300 -24.555 -9.603 1.00 4.10 H new ATOM 0 HE3 LYS C 39 -3.928 -25.525 -11.014 1.00 4.10 H new ATOM 0 HZ1 LYS C 39 -3.867 -26.858 -8.992 1.00 4.45 H new ATOM 0 HZ2 LYS C 39 -2.319 -26.787 -9.687 1.00 4.45 H new ATOM 0 HZ3 LYS C 39 -2.680 -25.846 -8.320 1.00 4.45 H new ATOM 2060 N GLU C 40 -1.421 -21.754 -14.019 1.00 2.67 N ATOM 2061 CA GLU C 40 -1.684 -22.018 -15.464 1.00 3.46 C ATOM 2062 C GLU C 40 -0.340 -22.059 -16.230 1.00 3.57 C ATOM 2063 O GLU C 40 0.580 -21.357 -15.854 1.00 3.59 O ATOM 2064 CB GLU C 40 -2.559 -20.892 -16.020 1.00 4.28 C ATOM 2065 CG GLU C 40 -3.824 -20.771 -15.169 1.00 4.94 C ATOM 2066 CD GLU C 40 -4.734 -19.696 -15.761 1.00 5.73 C ATOM 2067 OE1 GLU C 40 -5.408 -19.988 -16.734 1.00 6.15 O ATOM 2068 OE2 GLU C 40 -4.740 -18.596 -15.233 1.00 6.19 O ATOM 0 H GLU C 40 -1.862 -20.914 -13.644 1.00 2.67 H new ATOM 0 HA GLU C 40 -2.194 -22.974 -15.583 1.00 3.46 H new ATOM 0 HB2 GLU C 40 -2.010 -19.951 -16.012 1.00 4.28 H new ATOM 0 HB3 GLU C 40 -2.823 -21.098 -17.057 1.00 4.28 H new ATOM 0 HG2 GLU C 40 -4.346 -21.727 -15.136 1.00 4.94 H new ATOM 0 HG3 GLU C 40 -3.562 -20.516 -14.142 1.00 4.94 H new ATOM 2075 N PRO C 41 -0.244 -22.860 -17.284 1.00 4.12 N ATOM 2076 CA PRO C 41 1.006 -22.946 -18.070 1.00 4.64 C ATOM 2077 C PRO C 41 1.322 -21.588 -18.723 1.00 4.93 C ATOM 2078 O PRO C 41 2.210 -21.480 -19.545 1.00 5.28 O ATOM 2079 CB PRO C 41 0.727 -24.028 -19.143 1.00 5.52 C ATOM 2080 CG PRO C 41 -0.783 -24.386 -19.055 1.00 5.58 C ATOM 2081 CD PRO C 41 -1.338 -23.733 -17.773 1.00 4.67 C ATOM 0 HA PRO C 41 1.869 -23.200 -17.454 1.00 4.64 H new ATOM 0 HB2 PRO C 41 0.977 -23.657 -20.137 1.00 5.52 H new ATOM 0 HB3 PRO C 41 1.342 -24.911 -18.968 1.00 5.52 H new ATOM 0 HG2 PRO C 41 -1.316 -24.021 -19.933 1.00 5.58 H new ATOM 0 HG3 PRO C 41 -0.920 -25.467 -19.025 1.00 5.58 H new ATOM 0 HD2 PRO C 41 -2.240 -23.157 -17.982 1.00 4.67 H new ATOM 0 HD3 PRO C 41 -1.605 -24.485 -17.031 1.00 4.67 H new ATOM 2089 N GLY C 42 0.601 -20.558 -18.372 1.00 5.18 N ATOM 2090 CA GLY C 42 0.867 -19.223 -18.983 1.00 5.78 C ATOM 2091 C GLY C 42 2.183 -18.656 -18.444 1.00 6.47 C ATOM 2092 O GLY C 42 2.601 -19.082 -17.381 1.00 6.85 O ATOM 2093 OXT GLY C 42 2.749 -17.802 -19.106 1.00 6.90 O ATOM 0 H GLY C 42 -0.158 -20.582 -17.691 1.00 5.18 H new ATOM 0 HA2 GLY C 42 0.917 -19.314 -20.068 1.00 5.78 H new ATOM 0 HA3 GLY C 42 0.048 -18.540 -18.758 1.00 5.78 H new TER 2097 GLY C 42 ATOM 2098 N LYS D 1 -12.571 -27.264 15.210 1.00 4.83 N ATOM 2099 CA LYS D 1 -12.337 -26.864 13.792 1.00 4.34 C ATOM 2100 C LYS D 1 -13.623 -26.257 13.223 1.00 3.74 C ATOM 2101 O LYS D 1 -14.535 -25.925 13.953 1.00 3.68 O ATOM 2102 CB LYS D 1 -11.940 -28.093 12.969 1.00 4.69 C ATOM 2103 CG LYS D 1 -10.539 -28.556 13.380 1.00 5.18 C ATOM 2104 CD LYS D 1 -10.137 -29.785 12.561 1.00 5.93 C ATOM 2105 CE LYS D 1 -8.731 -30.232 12.964 1.00 6.53 C ATOM 2106 NZ LYS D 1 -8.426 -31.546 12.329 1.00 7.36 N ATOM 0 H1 LYS D 1 -11.720 -27.062 15.773 1.00 4.83 H new ATOM 0 H2 LYS D 1 -13.375 -26.728 15.594 1.00 4.83 H new ATOM 0 H3 LYS D 1 -12.781 -28.282 15.253 1.00 4.83 H new ATOM 0 HA LYS D 1 -11.533 -26.129 13.747 1.00 4.34 H new ATOM 0 HB2 LYS D 1 -12.660 -28.896 13.126 1.00 4.69 H new ATOM 0 HB3 LYS D 1 -11.957 -27.852 11.906 1.00 4.69 H new ATOM 0 HG2 LYS D 1 -9.820 -27.752 13.223 1.00 5.18 H new ATOM 0 HG3 LYS D 1 -10.523 -28.795 14.443 1.00 5.18 H new ATOM 0 HD2 LYS D 1 -10.848 -30.594 12.727 1.00 5.93 H new ATOM 0 HD3 LYS D 1 -10.164 -29.550 11.497 1.00 5.93 H new ATOM 0 HE2 LYS D 1 -7.998 -29.487 12.654 1.00 6.53 H new ATOM 0 HE3 LYS D 1 -8.661 -30.315 14.049 1.00 6.53 H new ATOM 0 HZ1 LYS D 1 -7.470 -31.850 12.603 1.00 7.36 H new ATOM 0 HZ2 LYS D 1 -9.119 -32.254 12.646 1.00 7.36 H new ATOM 0 HZ3 LYS D 1 -8.476 -31.452 11.295 1.00 7.36 H new ATOM 2122 N LYS D 2 -13.710 -26.110 11.927 1.00 3.83 N ATOM 2123 CA LYS D 2 -14.944 -25.522 11.326 1.00 3.79 C ATOM 2124 C LYS D 2 -15.303 -24.228 12.060 1.00 3.36 C ATOM 2125 O LYS D 2 -14.603 -23.793 12.953 1.00 3.69 O ATOM 2126 CB LYS D 2 -16.101 -26.517 11.458 1.00 4.16 C ATOM 2127 CG LYS D 2 -15.829 -27.736 10.577 1.00 4.94 C ATOM 2128 CD LYS D 2 -16.985 -28.730 10.707 1.00 5.75 C ATOM 2129 CE LYS D 2 -16.709 -29.949 9.825 1.00 6.48 C ATOM 2130 NZ LYS D 2 -16.830 -29.570 8.389 1.00 7.15 N ATOM 0 H LYS D 2 -12.983 -26.370 11.261 1.00 3.83 H new ATOM 0 HA LYS D 2 -14.766 -25.307 10.272 1.00 3.79 H new ATOM 0 HB2 LYS D 2 -16.213 -26.824 12.498 1.00 4.16 H new ATOM 0 HB3 LYS D 2 -17.037 -26.043 11.163 1.00 4.16 H new ATOM 0 HG2 LYS D 2 -15.716 -27.428 9.538 1.00 4.94 H new ATOM 0 HG3 LYS D 2 -14.893 -28.210 10.873 1.00 4.94 H new ATOM 0 HD2 LYS D 2 -17.099 -29.038 11.746 1.00 5.75 H new ATOM 0 HD3 LYS D 2 -17.921 -28.257 10.410 1.00 5.75 H new ATOM 0 HE2 LYS D 2 -15.710 -30.336 10.026 1.00 6.48 H new ATOM 0 HE3 LYS D 2 -17.413 -30.747 10.061 1.00 6.48 H new ATOM 0 HZ1 LYS D 2 -16.896 -30.430 7.807 1.00 7.15 H new ATOM 0 HZ2 LYS D 2 -17.685 -28.994 8.253 1.00 7.15 H new ATOM 0 HZ3 LYS D 2 -15.994 -29.022 8.103 1.00 7.15 H new ATOM 2144 N LYS D 3 -16.385 -23.606 11.688 1.00 3.02 N ATOM 2145 CA LYS D 3 -16.784 -22.340 12.361 1.00 2.81 C ATOM 2146 C LYS D 3 -15.583 -21.382 12.446 1.00 2.47 C ATOM 2147 O LYS D 3 -15.182 -21.014 13.532 1.00 2.60 O ATOM 2148 CB LYS D 3 -17.276 -22.653 13.775 1.00 3.35 C ATOM 2149 CG LYS D 3 -18.522 -23.537 13.708 1.00 4.03 C ATOM 2150 CD LYS D 3 -18.920 -23.960 15.123 1.00 4.79 C ATOM 2151 CE LYS D 3 -20.215 -24.771 15.068 1.00 5.71 C ATOM 2152 NZ LYS D 3 -19.973 -26.045 14.334 1.00 6.50 N ATOM 0 H LYS D 3 -17.011 -23.920 10.946 1.00 3.02 H new ATOM 0 HA LYS D 3 -17.579 -21.867 11.784 1.00 2.81 H new ATOM 0 HB2 LYS D 3 -16.491 -23.157 14.339 1.00 3.35 H new ATOM 0 HB3 LYS D 3 -17.504 -21.727 14.303 1.00 3.35 H new ATOM 0 HG2 LYS D 3 -19.341 -22.995 13.234 1.00 4.03 H new ATOM 0 HG3 LYS D 3 -18.325 -24.417 13.095 1.00 4.03 H new ATOM 0 HD2 LYS D 3 -18.125 -24.554 15.573 1.00 4.79 H new ATOM 0 HD3 LYS D 3 -19.056 -23.080 15.752 1.00 4.79 H new ATOM 0 HE2 LYS D 3 -20.568 -24.982 16.078 1.00 5.71 H new ATOM 0 HE3 LYS D 3 -20.996 -24.196 14.571 1.00 5.71 H new ATOM 0 HZ1 LYS D 3 -20.751 -26.708 14.524 1.00 6.50 H new ATOM 0 HZ2 LYS D 3 -19.922 -25.853 13.313 1.00 6.50 H new ATOM 0 HZ3 LYS D 3 -19.076 -26.464 14.652 1.00 6.50 H new ATOM 2166 N PRO D 4 -15.041 -20.995 11.309 1.00 2.84 N ATOM 2167 CA PRO D 4 -13.890 -20.069 11.282 1.00 3.26 C ATOM 2168 C PRO D 4 -14.293 -18.723 11.906 1.00 2.75 C ATOM 2169 O PRO D 4 -15.447 -18.346 11.890 1.00 2.71 O ATOM 2170 CB PRO D 4 -13.539 -19.913 9.781 1.00 4.29 C ATOM 2171 CG PRO D 4 -14.604 -20.707 8.967 1.00 4.50 C ATOM 2172 CD PRO D 4 -15.517 -21.437 9.978 1.00 3.58 C ATOM 0 HA PRO D 4 -13.037 -20.435 11.853 1.00 3.26 H new ATOM 0 HB2 PRO D 4 -13.542 -18.862 9.494 1.00 4.29 H new ATOM 0 HB3 PRO D 4 -12.538 -20.296 9.579 1.00 4.29 H new ATOM 0 HG2 PRO D 4 -15.188 -20.033 8.341 1.00 4.50 H new ATOM 0 HG3 PRO D 4 -14.122 -21.422 8.301 1.00 4.50 H new ATOM 0 HD2 PRO D 4 -16.564 -21.175 9.826 1.00 3.58 H new ATOM 0 HD3 PRO D 4 -15.440 -22.519 9.870 1.00 3.58 H new ATOM 2180 N LEU D 5 -13.353 -17.995 12.449 1.00 2.66 N ATOM 2181 CA LEU D 5 -13.701 -16.680 13.061 1.00 2.35 C ATOM 2182 C LEU D 5 -13.807 -15.633 11.950 1.00 1.75 C ATOM 2183 O LEU D 5 -12.903 -15.465 11.156 1.00 1.85 O ATOM 2184 CB LEU D 5 -12.600 -16.260 14.044 1.00 2.89 C ATOM 2185 CG LEU D 5 -12.447 -17.317 15.148 1.00 3.62 C ATOM 2186 CD1 LEU D 5 -11.237 -16.965 16.019 1.00 4.32 C ATOM 2187 CD2 LEU D 5 -13.713 -17.363 16.022 1.00 3.81 C ATOM 0 H LEU D 5 -12.367 -18.252 12.495 1.00 2.66 H new ATOM 0 HA LEU D 5 -14.648 -16.762 13.594 1.00 2.35 H new ATOM 0 HB2 LEU D 5 -11.656 -16.137 13.514 1.00 2.89 H new ATOM 0 HB3 LEU D 5 -12.845 -15.294 14.486 1.00 2.89 H new ATOM 0 HG LEU D 5 -12.301 -18.294 14.688 1.00 3.62 H new ATOM 0 HD11 LEU D 5 -11.124 -17.712 16.804 1.00 4.32 H new ATOM 0 HD12 LEU D 5 -10.338 -16.947 15.403 1.00 4.32 H new ATOM 0 HD13 LEU D 5 -11.387 -15.984 16.470 1.00 4.32 H new ATOM 0 HD21 LEU D 5 -13.591 -18.116 16.800 1.00 3.81 H new ATOM 0 HD22 LEU D 5 -13.873 -16.388 16.483 1.00 3.81 H new ATOM 0 HD23 LEU D 5 -14.573 -17.617 15.403 1.00 3.81 H new ATOM 2199 N ASP D 6 -14.903 -14.924 11.885 1.00 1.48 N ATOM 2200 CA ASP D 6 -15.053 -13.889 10.822 1.00 1.30 C ATOM 2201 C ASP D 6 -14.344 -12.604 11.252 1.00 1.05 C ATOM 2202 O ASP D 6 -14.680 -12.003 12.251 1.00 1.00 O ATOM 2203 CB ASP D 6 -16.538 -13.597 10.593 1.00 1.75 C ATOM 2204 CG ASP D 6 -17.199 -14.803 9.923 1.00 2.06 C ATOM 2205 OD1 ASP D 6 -16.482 -15.593 9.331 1.00 2.40 O ATOM 2206 OD2 ASP D 6 -18.409 -14.916 10.015 1.00 2.46 O ATOM 0 H ASP D 6 -15.697 -15.016 12.519 1.00 1.48 H new ATOM 0 HA ASP D 6 -14.609 -14.258 9.898 1.00 1.30 H new ATOM 0 HB2 ASP D 6 -17.028 -13.382 11.543 1.00 1.75 H new ATOM 0 HB3 ASP D 6 -16.653 -12.712 9.967 1.00 1.75 H new ATOM 2211 N GLY D 7 -13.369 -12.172 10.497 1.00 0.97 N ATOM 2212 CA GLY D 7 -12.647 -10.918 10.857 1.00 0.84 C ATOM 2213 C GLY D 7 -13.562 -9.720 10.611 1.00 0.68 C ATOM 2214 O GLY D 7 -14.373 -9.726 9.707 1.00 0.66 O ATOM 0 H GLY D 7 -13.042 -12.633 9.648 1.00 0.97 H new ATOM 0 HA2 GLY D 7 -12.342 -10.948 11.903 1.00 0.84 H new ATOM 0 HA3 GLY D 7 -11.738 -10.824 10.262 1.00 0.84 H new ATOM 2218 N GLU D 8 -13.443 -8.694 11.403 1.00 0.64 N ATOM 2219 CA GLU D 8 -14.315 -7.504 11.203 1.00 0.57 C ATOM 2220 C GLU D 8 -14.063 -6.930 9.807 1.00 0.51 C ATOM 2221 O GLU D 8 -12.935 -6.743 9.398 1.00 0.51 O ATOM 2222 CB GLU D 8 -13.987 -6.449 12.261 1.00 0.65 C ATOM 2223 CG GLU D 8 -14.435 -6.949 13.638 1.00 0.76 C ATOM 2224 CD GLU D 8 -14.056 -5.920 14.704 1.00 1.06 C ATOM 2225 OE1 GLU D 8 -12.954 -6.009 15.221 1.00 1.67 O ATOM 2226 OE2 GLU D 8 -14.872 -5.057 14.983 1.00 1.66 O ATOM 0 H GLU D 8 -12.783 -8.627 12.178 1.00 0.64 H new ATOM 0 HA GLU D 8 -15.362 -7.792 11.297 1.00 0.57 H new ATOM 0 HB2 GLU D 8 -12.916 -6.245 12.267 1.00 0.65 H new ATOM 0 HB3 GLU D 8 -14.488 -5.511 12.022 1.00 0.65 H new ATOM 0 HG2 GLU D 8 -15.512 -7.114 13.644 1.00 0.76 H new ATOM 0 HG3 GLU D 8 -13.965 -7.907 13.859 1.00 0.76 H new ATOM 2233 N TYR D 9 -15.110 -6.651 9.072 1.00 0.49 N ATOM 2234 CA TYR D 9 -14.952 -6.088 7.692 1.00 0.45 C ATOM 2235 C TYR D 9 -15.398 -4.625 7.678 1.00 0.43 C ATOM 2236 O TYR D 9 -16.332 -4.248 8.356 1.00 0.48 O ATOM 2237 CB TYR D 9 -15.827 -6.884 6.723 1.00 0.48 C ATOM 2238 CG TYR D 9 -15.357 -8.317 6.671 1.00 0.50 C ATOM 2239 CD1 TYR D 9 -14.372 -8.704 5.740 1.00 0.49 C ATOM 2240 CD2 TYR D 9 -15.905 -9.270 7.551 1.00 0.55 C ATOM 2241 CE1 TYR D 9 -13.936 -10.043 5.692 1.00 0.52 C ATOM 2242 CE2 TYR D 9 -15.467 -10.609 7.501 1.00 0.58 C ATOM 2243 CZ TYR D 9 -14.483 -10.995 6.572 1.00 0.56 C ATOM 2244 OH TYR D 9 -14.053 -12.306 6.527 1.00 0.61 O ATOM 0 H TYR D 9 -16.076 -6.790 9.369 1.00 0.49 H new ATOM 0 HA TYR D 9 -13.906 -6.153 7.392 1.00 0.45 H new ATOM 0 HB2 TYR D 9 -16.868 -6.844 7.042 1.00 0.48 H new ATOM 0 HB3 TYR D 9 -15.781 -6.440 5.729 1.00 0.48 H new ATOM 0 HD1 TYR D 9 -13.952 -7.974 5.064 1.00 0.49 H new ATOM 0 HD2 TYR D 9 -16.661 -8.975 8.264 1.00 0.55 H new ATOM 0 HE1 TYR D 9 -13.181 -10.339 4.979 1.00 0.52 H new ATOM 0 HE2 TYR D 9 -15.887 -11.339 8.176 1.00 0.58 H new ATOM 0 HH TYR D 9 -14.532 -12.831 7.202 1.00 0.61 H new ATOM 2254 N PHE D 10 -14.740 -3.798 6.903 1.00 0.39 N ATOM 2255 CA PHE D 10 -15.122 -2.351 6.831 1.00 0.39 C ATOM 2256 C PHE D 10 -15.133 -1.898 5.371 1.00 0.36 C ATOM 2257 O PHE D 10 -14.281 -2.268 4.588 1.00 0.37 O ATOM 2258 CB PHE D 10 -14.102 -1.520 7.607 1.00 0.39 C ATOM 2259 CG PHE D 10 -14.187 -1.872 9.069 1.00 0.43 C ATOM 2260 CD1 PHE D 10 -13.390 -2.909 9.587 1.00 0.46 C ATOM 2261 CD2 PHE D 10 -15.059 -1.162 9.915 1.00 0.49 C ATOM 2262 CE1 PHE D 10 -13.467 -3.240 10.952 1.00 0.53 C ATOM 2263 CE2 PHE D 10 -15.136 -1.492 11.281 1.00 0.56 C ATOM 2264 CZ PHE D 10 -14.340 -2.532 11.800 1.00 0.56 C ATOM 0 H PHE D 10 -13.951 -4.063 6.314 1.00 0.39 H new ATOM 0 HA PHE D 10 -16.113 -2.215 7.263 1.00 0.39 H new ATOM 0 HB2 PHE D 10 -13.097 -1.713 7.232 1.00 0.39 H new ATOM 0 HB3 PHE D 10 -14.297 -0.457 7.464 1.00 0.39 H new ATOM 0 HD1 PHE D 10 -12.719 -3.451 8.937 1.00 0.46 H new ATOM 0 HD2 PHE D 10 -15.669 -0.365 9.516 1.00 0.49 H new ATOM 0 HE1 PHE D 10 -12.856 -4.037 11.350 1.00 0.53 H new ATOM 0 HE2 PHE D 10 -15.805 -0.948 11.931 1.00 0.56 H new ATOM 0 HZ PHE D 10 -14.399 -2.786 12.848 1.00 0.56 H new ATOM 2274 N THR D 11 -16.090 -1.088 5.005 1.00 0.34 N ATOM 2275 CA THR D 11 -16.160 -0.590 3.601 1.00 0.34 C ATOM 2276 C THR D 11 -15.347 0.696 3.495 1.00 0.33 C ATOM 2277 O THR D 11 -15.212 1.429 4.450 1.00 0.37 O ATOM 2278 CB THR D 11 -17.620 -0.313 3.229 1.00 0.37 C ATOM 2279 OG1 THR D 11 -18.153 0.669 4.108 1.00 0.41 O ATOM 2280 CG2 THR D 11 -18.430 -1.603 3.349 1.00 0.43 C ATOM 0 H THR D 11 -16.829 -0.749 5.621 1.00 0.34 H new ATOM 0 HA THR D 11 -15.756 -1.338 2.919 1.00 0.34 H new ATOM 0 HB THR D 11 -17.672 0.052 2.203 1.00 0.37 H new ATOM 0 HG1 THR D 11 -19.087 0.849 3.870 1.00 0.41 H new ATOM 0 HG21 THR D 11 -19.469 -1.406 3.084 1.00 0.43 H new ATOM 0 HG22 THR D 11 -18.020 -2.354 2.674 1.00 0.43 H new ATOM 0 HG23 THR D 11 -18.380 -1.970 4.374 1.00 0.43 H new ATOM 2288 N LEU D 12 -14.799 0.980 2.343 1.00 0.29 N ATOM 2289 CA LEU D 12 -13.985 2.225 2.188 1.00 0.29 C ATOM 2290 C LEU D 12 -14.160 2.778 0.774 1.00 0.27 C ATOM 2291 O LEU D 12 -14.047 2.064 -0.202 1.00 0.26 O ATOM 2292 CB LEU D 12 -12.507 1.888 2.425 1.00 0.29 C ATOM 2293 CG LEU D 12 -11.633 3.143 2.272 1.00 0.29 C ATOM 2294 CD1 LEU D 12 -12.036 4.213 3.301 1.00 0.35 C ATOM 2295 CD2 LEU D 12 -10.167 2.751 2.490 1.00 0.31 C ATOM 0 H LEU D 12 -14.879 0.406 1.503 1.00 0.29 H new ATOM 0 HA LEU D 12 -14.315 2.972 2.910 1.00 0.29 H new ATOM 0 HB2 LEU D 12 -12.380 1.470 3.423 1.00 0.29 H new ATOM 0 HB3 LEU D 12 -12.184 1.125 1.716 1.00 0.29 H new ATOM 0 HG LEU D 12 -11.771 3.556 1.273 1.00 0.29 H new ATOM 0 HD11 LEU D 12 -11.406 5.093 3.176 1.00 0.35 H new ATOM 0 HD12 LEU D 12 -13.079 4.489 3.149 1.00 0.35 H new ATOM 0 HD13 LEU D 12 -11.909 3.816 4.308 1.00 0.35 H new ATOM 0 HD21 LEU D 12 -9.535 3.633 2.384 1.00 0.31 H new ATOM 0 HD22 LEU D 12 -10.046 2.336 3.491 1.00 0.31 H new ATOM 0 HD23 LEU D 12 -9.876 2.005 1.750 1.00 0.31 H new ATOM 2307 N GLN D 13 -14.422 4.051 0.659 1.00 0.29 N ATOM 2308 CA GLN D 13 -14.588 4.663 -0.691 1.00 0.29 C ATOM 2309 C GLN D 13 -13.204 5.011 -1.243 1.00 0.29 C ATOM 2310 O GLN D 13 -12.401 5.630 -0.571 1.00 0.31 O ATOM 2311 CB GLN D 13 -15.438 5.930 -0.570 1.00 0.34 C ATOM 2312 CG GLN D 13 -15.771 6.468 -1.963 1.00 0.38 C ATOM 2313 CD GLN D 13 -16.728 7.653 -1.831 1.00 0.63 C ATOM 2314 OE1 GLN D 13 -17.535 7.900 -2.707 1.00 1.37 O ATOM 2315 NE2 GLN D 13 -16.677 8.397 -0.761 1.00 0.61 N ATOM 0 H GLN D 13 -14.529 4.695 1.443 1.00 0.29 H new ATOM 0 HA GLN D 13 -15.086 3.966 -1.365 1.00 0.29 H new ATOM 0 HB2 GLN D 13 -16.357 5.712 -0.026 1.00 0.34 H new ATOM 0 HB3 GLN D 13 -14.900 6.686 0.002 1.00 0.34 H new ATOM 0 HG2 GLN D 13 -14.859 6.777 -2.474 1.00 0.38 H new ATOM 0 HG3 GLN D 13 -16.226 5.684 -2.569 1.00 0.38 H new ATOM 0 HE21 GLN D 13 -16.000 8.189 -0.027 1.00 0.61 H new ATOM 0 HE22 GLN D 13 -17.314 9.187 -0.658 1.00 0.61 H new ATOM 2324 N ILE D 14 -12.913 4.599 -2.454 1.00 0.29 N ATOM 2325 CA ILE D 14 -11.568 4.877 -3.059 1.00 0.32 C ATOM 2326 C ILE D 14 -11.735 5.703 -4.337 1.00 0.32 C ATOM 2327 O ILE D 14 -12.396 5.296 -5.273 1.00 0.33 O ATOM 2328 CB ILE D 14 -10.896 3.543 -3.387 1.00 0.35 C ATOM 2329 CG1 ILE D 14 -10.745 2.746 -2.084 1.00 0.34 C ATOM 2330 CG2 ILE D 14 -9.511 3.790 -3.995 1.00 0.48 C ATOM 2331 CD1 ILE D 14 -10.306 1.306 -2.377 1.00 0.40 C ATOM 0 H ILE D 14 -13.553 4.079 -3.054 1.00 0.29 H new ATOM 0 HA ILE D 14 -10.953 5.440 -2.357 1.00 0.32 H new ATOM 0 HB ILE D 14 -11.502 2.990 -4.105 1.00 0.35 H new ATOM 0 HG12 ILE D 14 -10.013 3.230 -1.438 1.00 0.34 H new ATOM 0 HG13 ILE D 14 -11.692 2.740 -1.544 1.00 0.34 H new ATOM 0 HG21 ILE D 14 -9.039 2.835 -4.226 1.00 0.48 H new ATOM 0 HG22 ILE D 14 -9.614 4.374 -4.910 1.00 0.48 H new ATOM 0 HG23 ILE D 14 -8.893 4.337 -3.283 1.00 0.48 H new ATOM 0 HD11 ILE D 14 -10.205 0.759 -1.440 1.00 0.40 H new ATOM 0 HD12 ILE D 14 -11.053 0.818 -3.003 1.00 0.40 H new ATOM 0 HD13 ILE D 14 -9.348 1.316 -2.896 1.00 0.40 H new ATOM 2343 N ARG D 15 -11.135 6.863 -4.376 1.00 0.33 N ATOM 2344 CA ARG D 15 -11.243 7.739 -5.580 1.00 0.36 C ATOM 2345 C ARG D 15 -10.361 7.193 -6.709 1.00 0.37 C ATOM 2346 O ARG D 15 -9.274 6.702 -6.480 1.00 0.40 O ATOM 2347 CB ARG D 15 -10.792 9.158 -5.204 1.00 0.39 C ATOM 2348 CG ARG D 15 -10.933 10.099 -6.407 1.00 0.41 C ATOM 2349 CD ARG D 15 -10.476 11.501 -5.998 1.00 0.89 C ATOM 2350 NE ARG D 15 -10.805 12.482 -7.083 1.00 1.04 N ATOM 2351 CZ ARG D 15 -10.329 12.356 -8.293 1.00 1.47 C ATOM 2352 NH1 ARG D 15 -9.424 11.455 -8.557 1.00 2.08 N ATOM 2353 NH2 ARG D 15 -10.721 13.173 -9.231 1.00 2.08 N ATOM 0 H ARG D 15 -10.569 7.245 -3.618 1.00 0.33 H new ATOM 0 HA ARG D 15 -12.276 7.760 -5.926 1.00 0.36 H new ATOM 0 HB2 ARG D 15 -11.391 9.529 -4.372 1.00 0.39 H new ATOM 0 HB3 ARG D 15 -9.755 9.140 -4.868 1.00 0.39 H new ATOM 0 HG2 ARG D 15 -10.333 9.736 -7.242 1.00 0.41 H new ATOM 0 HG3 ARG D 15 -11.969 10.124 -6.746 1.00 0.41 H new ATOM 0 HD2 ARG D 15 -10.964 11.796 -5.069 1.00 0.89 H new ATOM 0 HD3 ARG D 15 -9.403 11.502 -5.808 1.00 0.89 H new ATOM 0 HE ARG D 15 -11.417 13.270 -6.871 1.00 1.04 H new ATOM 0 HH11 ARG D 15 -9.083 10.842 -7.816 1.00 2.08 H new ATOM 0 HH12 ARG D 15 -9.057 11.363 -9.504 1.00 2.08 H new ATOM 0 HH21 ARG D 15 -11.397 13.907 -9.018 1.00 2.08 H new ATOM 0 HH22 ARG D 15 -10.352 13.078 -10.177 1.00 2.08 H new ATOM 2367 N GLY D 16 -10.817 7.294 -7.931 1.00 0.37 N ATOM 2368 CA GLY D 16 -10.006 6.801 -9.087 1.00 0.40 C ATOM 2369 C GLY D 16 -10.263 5.310 -9.328 1.00 0.38 C ATOM 2370 O GLY D 16 -10.017 4.482 -8.474 1.00 0.37 O ATOM 0 H GLY D 16 -11.720 7.698 -8.180 1.00 0.37 H new ATOM 0 HA2 GLY D 16 -10.257 7.369 -9.983 1.00 0.40 H new ATOM 0 HA3 GLY D 16 -8.946 6.966 -8.892 1.00 0.40 H new ATOM 2374 N ARG D 17 -10.746 4.964 -10.497 1.00 0.41 N ATOM 2375 CA ARG D 17 -11.005 3.528 -10.807 1.00 0.42 C ATOM 2376 C ARG D 17 -9.683 2.760 -10.770 1.00 0.42 C ATOM 2377 O ARG D 17 -9.599 1.671 -10.240 1.00 0.42 O ATOM 2378 CB ARG D 17 -11.621 3.409 -12.208 1.00 0.48 C ATOM 2379 CG ARG D 17 -11.981 1.947 -12.497 1.00 0.56 C ATOM 2380 CD ARG D 17 -12.599 1.844 -13.896 1.00 0.93 C ATOM 2381 NE ARG D 17 -13.082 0.442 -14.140 1.00 1.34 N ATOM 2382 CZ ARG D 17 -12.273 -0.580 -14.102 1.00 1.80 C ATOM 2383 NH1 ARG D 17 -10.986 -0.398 -14.007 1.00 2.16 N ATOM 2384 NH2 ARG D 17 -12.754 -1.792 -14.204 1.00 2.64 N ATOM 0 H ARG D 17 -10.971 5.616 -11.248 1.00 0.41 H new ATOM 0 HA ARG D 17 -11.694 3.114 -10.071 1.00 0.42 H new ATOM 0 HB2 ARG D 17 -12.512 4.033 -12.277 1.00 0.48 H new ATOM 0 HB3 ARG D 17 -10.918 3.774 -12.956 1.00 0.48 H new ATOM 0 HG2 ARG D 17 -11.090 1.322 -12.434 1.00 0.56 H new ATOM 0 HG3 ARG D 17 -12.683 1.579 -11.749 1.00 0.56 H new ATOM 0 HD2 ARG D 17 -13.428 2.545 -13.989 1.00 0.93 H new ATOM 0 HD3 ARG D 17 -11.862 2.120 -14.650 1.00 0.93 H new ATOM 0 HE ARG D 17 -14.070 0.286 -14.341 1.00 1.34 H new ATOM 0 HH11 ARG D 17 -10.607 0.548 -13.962 1.00 2.16 H new ATOM 0 HH12 ARG D 17 -10.358 -1.201 -13.978 1.00 2.16 H new ATOM 0 HH21 ARG D 17 -13.758 -1.935 -14.313 1.00 2.64 H new ATOM 0 HH22 ARG D 17 -12.125 -2.594 -14.175 1.00 2.64 H new ATOM 2398 N GLU D 18 -8.644 3.324 -11.331 1.00 0.46 N ATOM 2399 CA GLU D 18 -7.328 2.621 -11.329 1.00 0.49 C ATOM 2400 C GLU D 18 -6.893 2.386 -9.881 1.00 0.44 C ATOM 2401 O GLU D 18 -6.386 1.336 -9.536 1.00 0.40 O ATOM 2402 CB GLU D 18 -6.281 3.481 -12.056 1.00 0.56 C ATOM 2403 CG GLU D 18 -4.932 2.750 -12.082 1.00 1.17 C ATOM 2404 CD GLU D 18 -3.896 3.611 -12.809 1.00 1.55 C ATOM 2405 OE1 GLU D 18 -4.290 4.603 -13.400 1.00 2.22 O ATOM 2406 OE2 GLU D 18 -2.726 3.265 -12.760 1.00 1.98 O ATOM 0 H GLU D 18 -8.650 4.236 -11.788 1.00 0.46 H new ATOM 0 HA GLU D 18 -7.419 1.665 -11.844 1.00 0.49 H new ATOM 0 HB2 GLU D 18 -6.612 3.689 -13.074 1.00 0.56 H new ATOM 0 HB3 GLU D 18 -6.174 4.442 -11.553 1.00 0.56 H new ATOM 0 HG2 GLU D 18 -4.599 2.544 -11.065 1.00 1.17 H new ATOM 0 HG3 GLU D 18 -5.038 1.788 -12.584 1.00 1.17 H new ATOM 2413 N ARG D 19 -7.097 3.354 -9.030 1.00 0.45 N ATOM 2414 CA ARG D 19 -6.707 3.195 -7.601 1.00 0.43 C ATOM 2415 C ARG D 19 -7.482 2.025 -6.992 1.00 0.37 C ATOM 2416 O ARG D 19 -6.956 1.254 -6.215 1.00 0.35 O ATOM 2417 CB ARG D 19 -7.035 4.480 -6.835 1.00 0.49 C ATOM 2418 CG ARG D 19 -6.416 4.420 -5.437 1.00 0.60 C ATOM 2419 CD ARG D 19 -6.757 5.703 -4.676 1.00 1.13 C ATOM 2420 NE ARG D 19 -6.031 6.857 -5.282 1.00 1.40 N ATOM 2421 CZ ARG D 19 -6.400 8.079 -5.001 1.00 2.12 C ATOM 2422 NH1 ARG D 19 -7.397 8.286 -4.188 1.00 2.70 N ATOM 2423 NH2 ARG D 19 -5.769 9.093 -5.529 1.00 2.74 N ATOM 0 H ARG D 19 -7.519 4.252 -9.265 1.00 0.45 H new ATOM 0 HA ARG D 19 -5.637 2.998 -7.535 1.00 0.43 H new ATOM 0 HB2 ARG D 19 -6.652 5.345 -7.376 1.00 0.49 H new ATOM 0 HB3 ARG D 19 -8.115 4.604 -6.760 1.00 0.49 H new ATOM 0 HG2 ARG D 19 -6.794 3.552 -4.897 1.00 0.60 H new ATOM 0 HG3 ARG D 19 -5.335 4.304 -5.510 1.00 0.60 H new ATOM 0 HD2 ARG D 19 -7.832 5.881 -4.707 1.00 1.13 H new ATOM 0 HD3 ARG D 19 -6.482 5.599 -3.627 1.00 1.13 H new ATOM 0 HE ARG D 19 -5.248 6.693 -5.915 1.00 1.40 H new ATOM 0 HH11 ARG D 19 -7.888 7.495 -3.772 1.00 2.70 H new ATOM 0 HH12 ARG D 19 -7.686 9.239 -3.968 1.00 2.70 H new ATOM 0 HH21 ARG D 19 -4.986 8.933 -6.163 1.00 2.74 H new ATOM 0 HH22 ARG D 19 -6.059 10.046 -5.308 1.00 2.74 H new ATOM 2437 N PHE D 20 -8.734 1.898 -7.334 1.00 0.37 N ATOM 2438 CA PHE D 20 -9.555 0.790 -6.772 1.00 0.35 C ATOM 2439 C PHE D 20 -8.917 -0.555 -7.124 1.00 0.33 C ATOM 2440 O PHE D 20 -8.728 -1.400 -6.272 1.00 0.29 O ATOM 2441 CB PHE D 20 -10.968 0.866 -7.360 1.00 0.38 C ATOM 2442 CG PHE D 20 -11.743 -0.373 -6.983 1.00 0.36 C ATOM 2443 CD1 PHE D 20 -12.497 -0.403 -5.796 1.00 0.37 C ATOM 2444 CD2 PHE D 20 -11.702 -1.501 -7.823 1.00 0.41 C ATOM 2445 CE1 PHE D 20 -13.212 -1.564 -5.450 1.00 0.39 C ATOM 2446 CE2 PHE D 20 -12.417 -2.661 -7.476 1.00 0.43 C ATOM 2447 CZ PHE D 20 -13.172 -2.693 -6.289 1.00 0.40 C ATOM 0 H PHE D 20 -9.225 2.516 -7.980 1.00 0.37 H new ATOM 0 HA PHE D 20 -9.606 0.884 -5.687 1.00 0.35 H new ATOM 0 HB2 PHE D 20 -11.480 1.754 -6.988 1.00 0.38 H new ATOM 0 HB3 PHE D 20 -10.916 0.958 -8.445 1.00 0.38 H new ATOM 0 HD1 PHE D 20 -12.527 0.463 -5.152 1.00 0.37 H new ATOM 0 HD2 PHE D 20 -11.122 -1.476 -8.734 1.00 0.41 H new ATOM 0 HE1 PHE D 20 -13.792 -1.589 -4.539 1.00 0.39 H new ATOM 0 HE2 PHE D 20 -12.387 -3.527 -8.120 1.00 0.43 H new ATOM 0 HZ PHE D 20 -13.721 -3.584 -6.022 1.00 0.40 H new ATOM 2457 N GLU D 21 -8.581 -0.767 -8.363 1.00 0.37 N ATOM 2458 CA GLU D 21 -7.954 -2.063 -8.737 1.00 0.37 C ATOM 2459 C GLU D 21 -6.660 -2.230 -7.948 1.00 0.32 C ATOM 2460 O GLU D 21 -6.344 -3.302 -7.469 1.00 0.30 O ATOM 2461 CB GLU D 21 -7.632 -2.067 -10.233 1.00 0.44 C ATOM 2462 CG GLU D 21 -8.930 -2.128 -11.042 1.00 0.58 C ATOM 2463 CD GLU D 21 -8.599 -2.112 -12.535 1.00 0.97 C ATOM 2464 OE1 GLU D 21 -7.438 -1.935 -12.862 1.00 1.69 O ATOM 2465 OE2 GLU D 21 -9.514 -2.276 -13.326 1.00 1.50 O ATOM 0 H GLU D 21 -8.712 -0.105 -9.128 1.00 0.37 H new ATOM 0 HA GLU D 21 -8.640 -2.880 -8.512 1.00 0.37 H new ATOM 0 HB2 GLU D 21 -7.071 -1.171 -10.496 1.00 0.44 H new ATOM 0 HB3 GLU D 21 -7.000 -2.921 -10.476 1.00 0.44 H new ATOM 0 HG2 GLU D 21 -9.486 -3.031 -10.791 1.00 0.58 H new ATOM 0 HG3 GLU D 21 -9.568 -1.281 -10.791 1.00 0.58 H new ATOM 2472 N MET D 22 -5.907 -1.175 -7.808 1.00 0.32 N ATOM 2473 CA MET D 22 -4.634 -1.267 -7.050 1.00 0.29 C ATOM 2474 C MET D 22 -4.927 -1.646 -5.598 1.00 0.25 C ATOM 2475 O MET D 22 -4.341 -2.562 -5.053 1.00 0.25 O ATOM 2476 CB MET D 22 -3.932 0.089 -7.092 1.00 0.32 C ATOM 2477 CG MET D 22 -2.601 -0.014 -6.359 1.00 0.31 C ATOM 2478 SD MET D 22 -1.680 1.532 -6.556 1.00 0.42 S ATOM 2479 CE MET D 22 -2.622 2.531 -5.380 1.00 0.43 C ATOM 0 H MET D 22 -6.121 -0.253 -8.187 1.00 0.32 H new ATOM 0 HA MET D 22 -3.994 -2.028 -7.496 1.00 0.29 H new ATOM 0 HB2 MET D 22 -3.769 0.396 -8.125 1.00 0.32 H new ATOM 0 HB3 MET D 22 -4.558 0.851 -6.628 1.00 0.32 H new ATOM 0 HG2 MET D 22 -2.771 -0.216 -5.301 1.00 0.31 H new ATOM 0 HG3 MET D 22 -2.020 -0.848 -6.753 1.00 0.31 H new ATOM 0 HE1 MET D 22 -2.074 3.447 -5.160 1.00 0.43 H new ATOM 0 HE2 MET D 22 -3.591 2.783 -5.811 1.00 0.43 H new ATOM 0 HE3 MET D 22 -2.770 1.966 -4.459 1.00 0.43 H new ATOM 2489 N PHE D 23 -5.833 -0.950 -4.972 1.00 0.24 N ATOM 2490 CA PHE D 23 -6.176 -1.265 -3.558 1.00 0.22 C ATOM 2491 C PHE D 23 -6.734 -2.688 -3.479 1.00 0.23 C ATOM 2492 O PHE D 23 -6.437 -3.431 -2.566 1.00 0.23 O ATOM 2493 CB PHE D 23 -7.233 -0.263 -3.063 1.00 0.23 C ATOM 2494 CG PHE D 23 -6.567 1.013 -2.580 1.00 0.23 C ATOM 2495 CD1 PHE D 23 -5.670 1.710 -3.417 1.00 0.25 C ATOM 2496 CD2 PHE D 23 -6.846 1.505 -1.288 1.00 0.26 C ATOM 2497 CE1 PHE D 23 -5.057 2.893 -2.959 1.00 0.26 C ATOM 2498 CE2 PHE D 23 -6.230 2.687 -0.834 1.00 0.27 C ATOM 2499 CZ PHE D 23 -5.336 3.380 -1.669 1.00 0.26 C ATOM 0 H PHE D 23 -6.353 -0.173 -5.380 1.00 0.24 H new ATOM 0 HA PHE D 23 -5.286 -1.193 -2.933 1.00 0.22 H new ATOM 0 HB2 PHE D 23 -7.931 -0.034 -3.868 1.00 0.23 H new ATOM 0 HB3 PHE D 23 -7.813 -0.707 -2.254 1.00 0.23 H new ATOM 0 HD1 PHE D 23 -5.454 1.337 -4.407 1.00 0.25 H new ATOM 0 HD2 PHE D 23 -7.533 0.974 -0.646 1.00 0.26 H new ATOM 0 HE1 PHE D 23 -4.371 3.427 -3.600 1.00 0.26 H new ATOM 0 HE2 PHE D 23 -6.444 3.061 0.156 1.00 0.27 H new ATOM 0 HZ PHE D 23 -4.863 4.286 -1.320 1.00 0.26 H new ATOM 2509 N ARG D 24 -7.542 -3.070 -4.427 1.00 0.26 N ATOM 2510 CA ARG D 24 -8.117 -4.441 -4.403 1.00 0.28 C ATOM 2511 C ARG D 24 -6.976 -5.455 -4.430 1.00 0.26 C ATOM 2512 O ARG D 24 -6.982 -6.436 -3.714 1.00 0.27 O ATOM 2513 CB ARG D 24 -9.010 -4.636 -5.628 1.00 0.34 C ATOM 2514 CG ARG D 24 -9.612 -6.042 -5.609 1.00 0.43 C ATOM 2515 CD ARG D 24 -10.603 -6.186 -6.764 1.00 0.88 C ATOM 2516 NE ARG D 24 -9.897 -5.968 -8.059 1.00 1.26 N ATOM 2517 CZ ARG D 24 -10.474 -6.306 -9.180 1.00 1.74 C ATOM 2518 NH1 ARG D 24 -11.668 -6.834 -9.165 1.00 2.21 N ATOM 2519 NH2 ARG D 24 -9.859 -6.112 -10.315 1.00 2.45 N ATOM 0 H ARG D 24 -7.829 -2.492 -5.217 1.00 0.26 H new ATOM 0 HA ARG D 24 -8.711 -4.582 -3.500 1.00 0.28 H new ATOM 0 HB2 ARG D 24 -9.805 -3.890 -5.633 1.00 0.34 H new ATOM 0 HB3 ARG D 24 -8.430 -4.491 -6.539 1.00 0.34 H new ATOM 0 HG2 ARG D 24 -8.823 -6.789 -5.697 1.00 0.43 H new ATOM 0 HG3 ARG D 24 -10.115 -6.221 -4.659 1.00 0.43 H new ATOM 0 HD2 ARG D 24 -11.055 -7.178 -6.747 1.00 0.88 H new ATOM 0 HD3 ARG D 24 -11.413 -5.465 -6.654 1.00 0.88 H new ATOM 0 HE ARG D 24 -8.964 -5.555 -8.069 1.00 1.26 H new ATOM 0 HH11 ARG D 24 -12.149 -6.982 -8.278 1.00 2.21 H new ATOM 0 HH12 ARG D 24 -12.120 -7.098 -10.040 1.00 2.21 H new ATOM 0 HH21 ARG D 24 -8.928 -5.696 -10.326 1.00 2.45 H new ATOM 0 HH22 ARG D 24 -10.310 -6.376 -11.191 1.00 2.45 H new ATOM 2533 N GLU D 25 -5.988 -5.216 -5.247 1.00 0.26 N ATOM 2534 CA GLU D 25 -4.839 -6.156 -5.317 1.00 0.26 C ATOM 2535 C GLU D 25 -4.180 -6.233 -3.939 1.00 0.23 C ATOM 2536 O GLU D 25 -3.892 -7.301 -3.437 1.00 0.24 O ATOM 2537 CB GLU D 25 -3.828 -5.642 -6.350 1.00 0.29 C ATOM 2538 CG GLU D 25 -2.662 -6.628 -6.487 1.00 0.35 C ATOM 2539 CD GLU D 25 -3.172 -7.948 -7.070 1.00 1.06 C ATOM 2540 OE1 GLU D 25 -4.270 -7.954 -7.601 1.00 1.75 O ATOM 2541 OE2 GLU D 25 -2.452 -8.928 -6.981 1.00 1.75 O ATOM 0 H GLU D 25 -5.928 -4.410 -5.869 1.00 0.26 H new ATOM 0 HA GLU D 25 -5.181 -7.147 -5.614 1.00 0.26 H new ATOM 0 HB2 GLU D 25 -4.318 -5.511 -7.315 1.00 0.29 H new ATOM 0 HB3 GLU D 25 -3.453 -4.664 -6.047 1.00 0.29 H new ATOM 0 HG2 GLU D 25 -1.891 -6.208 -7.132 1.00 0.35 H new ATOM 0 HG3 GLU D 25 -2.203 -6.802 -5.514 1.00 0.35 H new ATOM 2548 N LEU D 26 -3.939 -5.106 -3.326 1.00 0.21 N ATOM 2549 CA LEU D 26 -3.296 -5.113 -1.983 1.00 0.21 C ATOM 2550 C LEU D 26 -4.191 -5.854 -0.988 1.00 0.22 C ATOM 2551 O LEU D 26 -3.732 -6.683 -0.227 1.00 0.25 O ATOM 2552 CB LEU D 26 -3.092 -3.673 -1.501 1.00 0.22 C ATOM 2553 CG LEU D 26 -2.176 -2.907 -2.467 1.00 0.26 C ATOM 2554 CD1 LEU D 26 -2.055 -1.455 -1.993 1.00 0.31 C ATOM 2555 CD2 LEU D 26 -0.781 -3.556 -2.504 1.00 0.31 C ATOM 0 H LEU D 26 -4.160 -4.182 -3.697 1.00 0.21 H new ATOM 0 HA LEU D 26 -2.331 -5.615 -2.052 1.00 0.21 H new ATOM 0 HB2 LEU D 26 -4.055 -3.168 -1.427 1.00 0.22 H new ATOM 0 HB3 LEU D 26 -2.656 -3.676 -0.502 1.00 0.22 H new ATOM 0 HG LEU D 26 -2.603 -2.937 -3.470 1.00 0.26 H new ATOM 0 HD11 LEU D 26 -1.406 -0.903 -2.673 1.00 0.31 H new ATOM 0 HD12 LEU D 26 -3.042 -0.993 -1.979 1.00 0.31 H new ATOM 0 HD13 LEU D 26 -1.630 -1.434 -0.989 1.00 0.31 H new ATOM 0 HD21 LEU D 26 -0.141 -3.004 -3.192 1.00 0.31 H new ATOM 0 HD22 LEU D 26 -0.343 -3.535 -1.506 1.00 0.31 H new ATOM 0 HD23 LEU D 26 -0.869 -4.589 -2.840 1.00 0.31 H new ATOM 2567 N ASN D 27 -5.466 -5.567 -0.984 1.00 0.25 N ATOM 2568 CA ASN D 27 -6.383 -6.261 -0.036 1.00 0.30 C ATOM 2569 C ASN D 27 -6.341 -7.766 -0.298 1.00 0.26 C ATOM 2570 O ASN D 27 -6.174 -8.562 0.604 1.00 0.26 O ATOM 2571 CB ASN D 27 -7.812 -5.754 -0.246 1.00 0.38 C ATOM 2572 CG ASN D 27 -8.753 -6.411 0.770 1.00 0.49 C ATOM 2573 OD1 ASN D 27 -8.314 -6.957 1.761 1.00 1.22 O ATOM 2574 ND2 ASN D 27 -10.044 -6.373 0.565 1.00 0.56 N ATOM 0 H ASN D 27 -5.911 -4.883 -1.596 1.00 0.25 H new ATOM 0 HA ASN D 27 -6.068 -6.057 0.987 1.00 0.30 H new ATOM 0 HB2 ASN D 27 -7.843 -4.670 -0.135 1.00 0.38 H new ATOM 0 HB3 ASN D 27 -8.142 -5.980 -1.260 1.00 0.38 H new ATOM 0 HD21 ASN D 27 -10.680 -6.802 1.237 1.00 0.56 H new ATOM 0 HD22 ASN D 27 -10.415 -5.915 -0.267 1.00 0.56 H new ATOM 2581 N GLU D 28 -6.498 -8.163 -1.531 1.00 0.28 N ATOM 2582 CA GLU D 28 -6.474 -9.618 -1.853 1.00 0.29 C ATOM 2583 C GLU D 28 -5.124 -10.217 -1.447 1.00 0.25 C ATOM 2584 O GLU D 28 -5.055 -11.315 -0.935 1.00 0.26 O ATOM 2585 CB GLU D 28 -6.691 -9.815 -3.355 1.00 0.36 C ATOM 2586 CG GLU D 28 -6.780 -11.311 -3.668 1.00 0.43 C ATOM 2587 CD GLU D 28 -7.061 -11.501 -5.159 1.00 1.02 C ATOM 2588 OE1 GLU D 28 -7.289 -10.508 -5.830 1.00 1.71 O ATOM 2589 OE2 GLU D 28 -7.041 -12.636 -5.606 1.00 1.73 O ATOM 0 H GLU D 28 -6.642 -7.544 -2.329 1.00 0.28 H new ATOM 0 HA GLU D 28 -7.270 -10.120 -1.303 1.00 0.29 H new ATOM 0 HB2 GLU D 28 -7.605 -9.312 -3.670 1.00 0.36 H new ATOM 0 HB3 GLU D 28 -5.871 -9.364 -3.914 1.00 0.36 H new ATOM 0 HG2 GLU D 28 -5.848 -11.807 -3.396 1.00 0.43 H new ATOM 0 HG3 GLU D 28 -7.571 -11.771 -3.076 1.00 0.43 H new ATOM 2596 N ALA D 29 -4.048 -9.510 -1.677 1.00 0.24 N ATOM 2597 CA ALA D 29 -2.711 -10.059 -1.309 1.00 0.25 C ATOM 2598 C ALA D 29 -2.656 -10.332 0.197 1.00 0.24 C ATOM 2599 O ALA D 29 -2.279 -11.403 0.627 1.00 0.25 O ATOM 2600 CB ALA D 29 -1.622 -9.045 -1.683 1.00 0.28 C ATOM 0 H ALA D 29 -4.038 -8.582 -2.101 1.00 0.24 H new ATOM 0 HA ALA D 29 -2.546 -10.991 -1.849 1.00 0.25 H new ATOM 0 HB1 ALA D 29 -0.644 -9.445 -1.414 1.00 0.28 H new ATOM 0 HB2 ALA D 29 -1.654 -8.856 -2.756 1.00 0.28 H new ATOM 0 HB3 ALA D 29 -1.793 -8.113 -1.145 1.00 0.28 H new ATOM 2606 N LEU D 30 -3.025 -9.373 1.002 1.00 0.24 N ATOM 2607 CA LEU D 30 -2.989 -9.588 2.478 1.00 0.26 C ATOM 2608 C LEU D 30 -3.922 -10.745 2.841 1.00 0.28 C ATOM 2609 O LEU D 30 -3.589 -11.601 3.636 1.00 0.31 O ATOM 2610 CB LEU D 30 -3.447 -8.308 3.188 1.00 0.26 C ATOM 2611 CG LEU D 30 -2.428 -7.180 2.954 1.00 0.26 C ATOM 2612 CD1 LEU D 30 -3.017 -5.858 3.459 1.00 0.29 C ATOM 2613 CD2 LEU D 30 -1.111 -7.474 3.701 1.00 0.26 C ATOM 0 H LEU D 30 -3.349 -8.453 0.704 1.00 0.24 H new ATOM 0 HA LEU D 30 -1.974 -9.830 2.793 1.00 0.26 H new ATOM 0 HB2 LEU D 30 -4.426 -8.007 2.816 1.00 0.26 H new ATOM 0 HB3 LEU D 30 -3.556 -8.495 4.256 1.00 0.26 H new ATOM 0 HG LEU D 30 -2.215 -7.112 1.887 1.00 0.26 H new ATOM 0 HD11 LEU D 30 -2.299 -5.054 3.296 1.00 0.29 H new ATOM 0 HD12 LEU D 30 -3.937 -5.639 2.917 1.00 0.29 H new ATOM 0 HD13 LEU D 30 -3.234 -5.940 4.524 1.00 0.29 H new ATOM 0 HD21 LEU D 30 -0.403 -6.664 3.523 1.00 0.26 H new ATOM 0 HD22 LEU D 30 -1.309 -7.554 4.770 1.00 0.26 H new ATOM 0 HD23 LEU D 30 -0.689 -8.411 3.339 1.00 0.26 H new ATOM 2625 N GLU D 31 -5.084 -10.789 2.252 1.00 0.31 N ATOM 2626 CA GLU D 31 -6.029 -11.900 2.553 1.00 0.35 C ATOM 2627 C GLU D 31 -5.374 -13.232 2.180 1.00 0.33 C ATOM 2628 O GLU D 31 -5.516 -14.221 2.870 1.00 0.35 O ATOM 2629 CB GLU D 31 -7.315 -11.718 1.746 1.00 0.40 C ATOM 2630 CG GLU D 31 -8.093 -10.519 2.289 1.00 0.47 C ATOM 2631 CD GLU D 31 -9.313 -10.266 1.403 1.00 1.12 C ATOM 2632 OE1 GLU D 31 -9.484 -10.998 0.443 1.00 1.91 O ATOM 2633 OE2 GLU D 31 -10.058 -9.347 1.700 1.00 1.66 O ATOM 0 H GLU D 31 -5.420 -10.104 1.575 1.00 0.31 H new ATOM 0 HA GLU D 31 -6.271 -11.894 3.616 1.00 0.35 H new ATOM 0 HB2 GLU D 31 -7.078 -11.564 0.693 1.00 0.40 H new ATOM 0 HB3 GLU D 31 -7.926 -12.619 1.807 1.00 0.40 H new ATOM 0 HG2 GLU D 31 -8.407 -10.709 3.315 1.00 0.47 H new ATOM 0 HG3 GLU D 31 -7.455 -9.636 2.310 1.00 0.47 H new ATOM 2640 N LEU D 32 -4.668 -13.266 1.081 1.00 0.30 N ATOM 2641 CA LEU D 32 -4.010 -14.533 0.650 1.00 0.30 C ATOM 2642 C LEU D 32 -3.033 -14.979 1.740 1.00 0.29 C ATOM 2643 O LEU D 32 -3.044 -16.114 2.172 1.00 0.33 O ATOM 2644 CB LEU D 32 -3.255 -14.277 -0.663 1.00 0.30 C ATOM 2645 CG LEU D 32 -2.554 -15.553 -1.158 1.00 0.36 C ATOM 2646 CD1 LEU D 32 -3.594 -16.625 -1.519 1.00 0.43 C ATOM 2647 CD2 LEU D 32 -1.725 -15.214 -2.403 1.00 0.40 C ATOM 0 H LEU D 32 -4.519 -12.469 0.462 1.00 0.30 H new ATOM 0 HA LEU D 32 -4.753 -15.315 0.492 1.00 0.30 H new ATOM 0 HB2 LEU D 32 -3.951 -13.923 -1.423 1.00 0.30 H new ATOM 0 HB3 LEU D 32 -2.518 -13.488 -0.514 1.00 0.30 H new ATOM 0 HG LEU D 32 -1.909 -15.938 -0.368 1.00 0.36 H new ATOM 0 HD11 LEU D 32 -3.085 -17.523 -1.868 1.00 0.43 H new ATOM 0 HD12 LEU D 32 -4.190 -16.865 -0.638 1.00 0.43 H new ATOM 0 HD13 LEU D 32 -4.246 -16.248 -2.307 1.00 0.43 H new ATOM 0 HD21 LEU D 32 -1.224 -16.113 -2.762 1.00 0.40 H new ATOM 0 HD22 LEU D 32 -2.381 -14.828 -3.183 1.00 0.40 H new ATOM 0 HD23 LEU D 32 -0.980 -14.460 -2.150 1.00 0.40 H new ATOM 2659 N LYS D 33 -2.190 -14.093 2.191 1.00 0.29 N ATOM 2660 CA LYS D 33 -1.222 -14.466 3.256 1.00 0.32 C ATOM 2661 C LYS D 33 -1.986 -14.918 4.501 1.00 0.38 C ATOM 2662 O LYS D 33 -1.609 -15.863 5.165 1.00 0.43 O ATOM 2663 CB LYS D 33 -0.355 -13.254 3.603 1.00 0.35 C ATOM 2664 CG LYS D 33 0.765 -13.691 4.551 1.00 0.44 C ATOM 2665 CD LYS D 33 1.580 -12.473 5.005 1.00 0.48 C ATOM 2666 CE LYS D 33 2.328 -11.860 3.817 1.00 0.81 C ATOM 2667 NZ LYS D 33 3.461 -11.038 4.326 1.00 1.57 N ATOM 0 H LYS D 33 -2.130 -13.127 1.868 1.00 0.29 H new ATOM 0 HA LYS D 33 -0.587 -15.279 2.903 1.00 0.32 H new ATOM 0 HB2 LYS D 33 0.068 -12.823 2.696 1.00 0.35 H new ATOM 0 HB3 LYS D 33 -0.962 -12.479 4.071 1.00 0.35 H new ATOM 0 HG2 LYS D 33 0.341 -14.197 5.418 1.00 0.44 H new ATOM 0 HG3 LYS D 33 1.416 -14.407 4.050 1.00 0.44 H new ATOM 0 HD2 LYS D 33 0.918 -11.730 5.449 1.00 0.48 H new ATOM 0 HD3 LYS D 33 2.290 -12.770 5.777 1.00 0.48 H new ATOM 0 HE2 LYS D 33 2.699 -12.647 3.160 1.00 0.81 H new ATOM 0 HE3 LYS D 33 1.652 -11.243 3.225 1.00 0.81 H new ATOM 0 HZ1 LYS D 33 3.658 -10.266 3.657 1.00 1.57 H new ATOM 0 HZ2 LYS D 33 3.211 -10.637 5.252 1.00 1.57 H new ATOM 0 HZ3 LYS D 33 4.307 -11.635 4.424 1.00 1.57 H new ATOM 2681 N ASP D 34 -3.056 -14.251 4.826 1.00 0.43 N ATOM 2682 CA ASP D 34 -3.839 -14.642 6.030 1.00 0.51 C ATOM 2683 C ASP D 34 -4.333 -16.082 5.872 1.00 0.51 C ATOM 2684 O ASP D 34 -4.336 -16.856 6.809 1.00 0.58 O ATOM 2685 CB ASP D 34 -5.031 -13.700 6.190 1.00 0.59 C ATOM 2686 CG ASP D 34 -4.534 -12.316 6.607 1.00 0.67 C ATOM 2687 OD1 ASP D 34 -3.392 -12.219 7.028 1.00 1.44 O ATOM 2688 OD2 ASP D 34 -5.305 -11.375 6.505 1.00 1.12 O ATOM 0 H ASP D 34 -3.423 -13.451 4.310 1.00 0.43 H new ATOM 0 HA ASP D 34 -3.206 -14.575 6.915 1.00 0.51 H new ATOM 0 HB2 ASP D 34 -5.583 -13.633 5.253 1.00 0.59 H new ATOM 0 HB3 ASP D 34 -5.720 -14.092 6.939 1.00 0.59 H new ATOM 2693 N ALA D 35 -4.756 -16.443 4.694 1.00 0.49 N ATOM 2694 CA ALA D 35 -5.255 -17.828 4.467 1.00 0.55 C ATOM 2695 C ALA D 35 -4.143 -18.833 4.774 1.00 0.54 C ATOM 2696 O ALA D 35 -4.380 -19.885 5.331 1.00 0.64 O ATOM 2697 CB ALA D 35 -5.671 -17.972 3.006 1.00 0.63 C ATOM 0 H ALA D 35 -4.778 -15.836 3.875 1.00 0.49 H new ATOM 0 HA ALA D 35 -6.107 -18.021 5.119 1.00 0.55 H new ATOM 0 HB1 ALA D 35 -6.038 -18.983 2.830 1.00 0.63 H new ATOM 0 HB2 ALA D 35 -6.460 -17.255 2.780 1.00 0.63 H new ATOM 0 HB3 ALA D 35 -4.812 -17.781 2.363 1.00 0.63 H new ATOM 2703 N GLN D 36 -2.929 -18.522 4.414 1.00 0.51 N ATOM 2704 CA GLN D 36 -1.811 -19.467 4.686 1.00 0.59 C ATOM 2705 C GLN D 36 -1.377 -19.336 6.148 1.00 0.66 C ATOM 2706 O GLN D 36 -0.618 -20.137 6.654 1.00 0.85 O ATOM 2707 CB GLN D 36 -0.628 -19.130 3.776 1.00 0.62 C ATOM 2708 CG GLN D 36 -0.969 -19.488 2.328 1.00 0.96 C ATOM 2709 CD GLN D 36 0.218 -19.147 1.426 1.00 0.86 C ATOM 2710 OE1 GLN D 36 -0.004 -18.620 0.255 1.00 1.21 O flip ATOM 2711 NE2 GLN D 36 1.358 -19.363 1.791 1.00 0.71 N flip ATOM 0 H GLN D 36 -2.663 -17.656 3.944 1.00 0.51 H new ATOM 0 HA GLN D 36 -2.143 -20.487 4.493 1.00 0.59 H new ATOM 0 HB2 GLN D 36 -0.390 -18.069 3.851 1.00 0.62 H new ATOM 0 HB3 GLN D 36 0.257 -19.679 4.097 1.00 0.62 H new ATOM 0 HG2 GLN D 36 -1.205 -20.549 2.250 1.00 0.96 H new ATOM 0 HG3 GLN D 36 -1.854 -18.940 2.005 1.00 0.96 H new ATOM 0 HE21 GLN D 36 1.530 -19.776 2.708 1.00 0.71 H new ATOM 0 HE22 GLN D 36 2.142 -19.132 1.180 1.00 0.71 H new ATOM 2720 N ALA D 37 -1.857 -18.333 6.832 1.00 0.68 N ATOM 2721 CA ALA D 37 -1.474 -18.150 8.261 1.00 0.82 C ATOM 2722 C ALA D 37 -2.111 -19.251 9.112 1.00 0.87 C ATOM 2723 O ALA D 37 -1.689 -19.514 10.221 1.00 1.22 O ATOM 2724 CB ALA D 37 -1.959 -16.783 8.746 1.00 1.01 C ATOM 0 H ALA D 37 -2.499 -17.632 6.462 1.00 0.68 H new ATOM 0 HA ALA D 37 -0.389 -18.207 8.355 1.00 0.82 H new ATOM 0 HB1 ALA D 37 -1.680 -16.648 9.791 1.00 1.01 H new ATOM 0 HB2 ALA D 37 -1.500 -15.999 8.143 1.00 1.01 H new ATOM 0 HB3 ALA D 37 -3.043 -16.727 8.650 1.00 1.01 H new ATOM 2730 N GLY D 38 -3.128 -19.895 8.602 1.00 0.98 N ATOM 2731 CA GLY D 38 -3.797 -20.978 9.377 1.00 1.18 C ATOM 2732 C GLY D 38 -2.901 -22.217 9.404 1.00 1.14 C ATOM 2733 O GLY D 38 -3.374 -23.337 9.405 1.00 1.50 O ATOM 0 H GLY D 38 -3.524 -19.716 7.679 1.00 0.98 H new ATOM 0 HA2 GLY D 38 -3.999 -20.640 10.394 1.00 1.18 H new ATOM 0 HA3 GLY D 38 -4.759 -21.222 8.925 1.00 1.18 H new ATOM 2737 N LYS D 39 -1.610 -22.024 9.420 1.00 1.30 N ATOM 2738 CA LYS D 39 -0.682 -23.191 9.439 1.00 1.52 C ATOM 2739 C LYS D 39 -0.478 -23.644 10.888 1.00 1.98 C ATOM 2740 O LYS D 39 -1.001 -24.655 11.310 1.00 2.51 O ATOM 2741 CB LYS D 39 0.663 -22.772 8.826 1.00 1.87 C ATOM 2742 CG LYS D 39 1.650 -23.953 8.804 1.00 2.24 C ATOM 2743 CD LYS D 39 1.161 -25.043 7.834 1.00 2.96 C ATOM 2744 CE LYS D 39 2.333 -25.948 7.437 1.00 3.50 C ATOM 2745 NZ LYS D 39 1.863 -26.986 6.472 1.00 4.18 N ATOM 0 H LYS D 39 -1.158 -21.110 9.421 1.00 1.30 H new ATOM 0 HA LYS D 39 -1.101 -24.014 8.860 1.00 1.52 H new ATOM 0 HB2 LYS D 39 0.506 -22.405 7.812 1.00 1.87 H new ATOM 0 HB3 LYS D 39 1.088 -21.949 9.400 1.00 1.87 H new ATOM 0 HG2 LYS D 39 2.637 -23.604 8.501 1.00 2.24 H new ATOM 0 HG3 LYS D 39 1.752 -24.369 9.806 1.00 2.24 H new ATOM 0 HD2 LYS D 39 0.375 -25.635 8.304 1.00 2.96 H new ATOM 0 HD3 LYS D 39 0.727 -24.584 6.946 1.00 2.96 H new ATOM 0 HE2 LYS D 39 3.128 -25.353 6.987 1.00 3.50 H new ATOM 0 HE3 LYS D 39 2.753 -26.425 8.323 1.00 3.50 H new ATOM 0 HZ1 LYS D 39 2.660 -27.598 6.205 1.00 4.18 H new ATOM 0 HZ2 LYS D 39 1.119 -27.561 6.916 1.00 4.18 H new ATOM 0 HZ3 LYS D 39 1.482 -26.523 5.622 1.00 4.18 H new ATOM 2759 N GLU D 40 0.276 -22.903 11.656 1.00 2.42 N ATOM 2760 CA GLU D 40 0.508 -23.300 13.074 1.00 3.19 C ATOM 2761 C GLU D 40 -0.843 -23.363 13.819 1.00 3.44 C ATOM 2762 O GLU D 40 -1.733 -22.599 13.503 1.00 3.47 O ATOM 2763 CB GLU D 40 1.412 -22.260 13.744 1.00 3.90 C ATOM 2764 CG GLU D 40 2.658 -22.039 12.881 1.00 4.50 C ATOM 2765 CD GLU D 40 3.616 -21.083 13.595 1.00 5.22 C ATOM 2766 OE1 GLU D 40 4.310 -21.533 14.492 1.00 5.62 O ATOM 2767 OE2 GLU D 40 3.639 -19.919 13.233 1.00 5.67 O ATOM 0 H GLU D 40 0.740 -22.043 11.363 1.00 2.42 H new ATOM 0 HA GLU D 40 0.985 -24.279 13.108 1.00 3.19 H new ATOM 0 HB2 GLU D 40 0.873 -21.321 13.871 1.00 3.90 H new ATOM 0 HB3 GLU D 40 1.700 -22.599 14.739 1.00 3.90 H new ATOM 0 HG2 GLU D 40 3.154 -22.991 12.690 1.00 4.50 H new ATOM 0 HG3 GLU D 40 2.373 -21.628 11.912 1.00 4.50 H new ATOM 2774 N PRO D 41 -0.979 -24.258 14.790 1.00 4.10 N ATOM 2775 CA PRO D 41 -2.243 -24.376 15.550 1.00 4.76 C ATOM 2776 C PRO D 41 -2.532 -23.073 16.318 1.00 4.95 C ATOM 2777 O PRO D 41 -3.424 -23.018 17.141 1.00 4.97 O ATOM 2778 CB PRO D 41 -2.010 -25.556 16.526 1.00 5.65 C ATOM 2779 CG PRO D 41 -0.510 -25.951 16.427 1.00 5.61 C ATOM 2780 CD PRO D 41 0.079 -25.211 15.207 1.00 4.63 C ATOM 0 HA PRO D 41 -3.103 -24.549 14.903 1.00 4.76 H new ATOM 0 HB2 PRO D 41 -2.264 -25.267 17.546 1.00 5.65 H new ATOM 0 HB3 PRO D 41 -2.648 -26.401 16.266 1.00 5.65 H new ATOM 0 HG2 PRO D 41 0.021 -25.674 17.338 1.00 5.61 H new ATOM 0 HG3 PRO D 41 -0.403 -27.030 16.311 1.00 5.61 H new ATOM 0 HD2 PRO D 41 1.000 -24.689 15.468 1.00 4.63 H new ATOM 0 HD3 PRO D 41 0.323 -25.906 14.404 1.00 4.63 H new ATOM 2788 N GLY D 42 -1.788 -22.030 16.061 1.00 5.47 N ATOM 2789 CA GLY D 42 -2.030 -20.749 16.785 1.00 5.98 C ATOM 2790 C GLY D 42 -3.345 -20.129 16.308 1.00 6.80 C ATOM 2791 O GLY D 42 -3.795 -20.492 15.235 1.00 7.27 O ATOM 2792 OXT GLY D 42 -3.881 -19.299 17.027 1.00 7.20 O ATOM 0 H GLY D 42 -1.026 -22.010 15.383 1.00 5.47 H new ATOM 0 HA2 GLY D 42 -2.070 -20.929 17.859 1.00 5.98 H new ATOM 0 HA3 GLY D 42 -1.206 -20.058 16.608 1.00 5.98 H new TER 2796 GLY D 42 HETATM 2797 O HOH A 501 11.329 -7.532 -4.093 1.00 0.00 O HETATM 2800 O HOH B 503 -11.916 -7.532 2.828 1.00 0.00 O HETATM 2803 O HOH C 502 11.806 7.402 2.174 1.00 0.00 O HETATM 2806 O HOH D 504 -12.016 7.947 -2.009 1.00 0.00 O