USER MOD reduce.3.24.130724 H: found=0, std=0, add=1458, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1458 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 123 ASN : amide:sc= -0.818! X(o=0.036!,f=-0.42) USER MOD Set 1.2: A 199 TYR OH : rot 180:sc= 0.854 USER MOD Set 2.1: A 116 CYS SG : rot -30:sc= -3.04! USER MOD Set 2.2: A 124 HIS : no HD1:sc= -0.271 X(o=-3.3,f=-3) USER MOD Set 3.1: A 109 THR OG1 : rot -46:sc= 1.25 USER MOD Set 3.2: A 176 HIS : no HD1:sc= -5.79! C(o=-4.5!,f=-15!) USER MOD Set 4.1: A 84 LYS NZ :NH3+ 177:sc= 0.52 (180deg=0.0143) USER MOD Set 4.2: A 105 SER OG : rot -52:sc= 1.66 USER MOD Set 5.1: A 29 CYS SG : rot 180:sc= 1.68 USER MOD Set 5.2: A 81 TYR OH : rot 2:sc= 1.35 USER MOD Set 6.1: A 5 SER OG : rot 94:sc= 1.24 USER MOD Set 6.2: A 75 ASN : amide:sc= 1.29 K(o=2.5,f=-3.5) USER MOD Single : A 0 THR OG1 : rot 180:sc= 0.146 USER MOD Single : A 1 MET CE :methyl -117:sc= -2.52! (180deg=-4.32!) USER MOD Single : A 7 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00314) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -5 GLY N :NH3+ 173:sc= 1.25 (180deg=1.05) USER MOD Single : A 12 ASN : amide:sc= -0.0528 K(o=-0.053,f=-4.2!) USER MOD Single : A 15 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.051) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 169:sc= -4.18! (180deg=-4.39!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -150:sc= -2.26! USER MOD Single : A 24 MET CE :methyl -104:sc= -0.0891 (180deg=-3.57!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl 172:sc= -3.46! (180deg=-3.58) USER MOD Single : A 45 ASN :FLIP amide:sc= -0.374 F(o=-0.9,f=-0.37) USER MOD Single : A 52 SER OG : rot 180:sc= -0.0814 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -169:sc= 1.24 (180deg=1.16) USER MOD Single : A 66 LYS NZ :NH3+ -152:sc= -0.572 (180deg=-4.07!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -155:sc= -0.319 (180deg=-1.25!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 146:sc= -2.27 (180deg=-5.9!) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -0.0419 X(o=-0.042,f=-0.12) USER MOD Single : A 89 LYS NZ :NH3+ -167:sc= -0.0224 (180deg=-0.206) USER MOD Single : A 92 MET CE :methyl 148:sc= -2.33 (180deg=-4.6!) USER MOD Single : A 96 THR OG1 : rot 81:sc= 1.22 USER MOD Single : A 98 LYS NZ :NH3+ 171:sc= -7.35! (180deg=-7.59!) USER MOD Single : A 99 THR OG1 : rot 1:sc= -0.835 USER MOD Single : A 101 MET CE :methyl -152:sc= -3.67! (180deg=-4.8!) USER MOD Single : A 106 LYS NZ :NH3+ -158:sc= 0.939 (180deg=0.101) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.0401 USER MOD Single : A 111 MET CE :methyl 152:sc= -5.84! (180deg=-8.12!) USER MOD Single : A 113 MET CE :methyl 158:sc= -0.193 (180deg=-0.787) USER MOD Single : A 114 THR OG1 : rot 77:sc= 0.0371 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 165:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= -0.631 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ -152:sc= 1.21 (180deg=0.608) USER MOD Single : A 138 LYS NZ :NH3+ -165:sc= -0.0137 (180deg=-0.207) USER MOD Single : A 172 ASN : amide:sc= -5.69! C(o=-5.7!,f=-9.1!) USER MOD Single : A 179 THR OG1 : rot 180:sc= -0.212 USER MOD Single : A 183 GLN : amide:sc= -7.55! C(o=-7.5!,f=-12!) USER MOD Single : A 188 HIS : no HD1:sc= -0.376 X(o=-0.38,f=-0.084) USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0579) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 202 GLN : amide:sc= -0.425 X(o=-0.43,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -34.854 -5.051 -3.229 1.00 10.08 N ATOM 2 CA GLY A -5 -35.703 -6.213 -2.879 1.00 9.65 C ATOM 3 C GLY A -5 -35.390 -6.726 -1.493 1.00 8.52 C ATOM 4 O GLY A -5 -35.464 -5.977 -0.516 1.00 8.35 O ATOM 0 H1 GLY A -5 -35.008 -4.796 -4.226 1.00 10.08 H new ATOM 0 H2 GLY A -5 -35.104 -4.244 -2.623 1.00 10.08 H new ATOM 0 H3 GLY A -5 -33.854 -5.296 -3.085 1.00 10.08 H new ATOM 0 HA2 GLY A -5 -36.754 -5.928 -2.935 1.00 9.65 H new ATOM 0 HA3 GLY A -5 -35.550 -7.010 -3.607 1.00 9.65 H new ATOM 10 N ILE A -4 -35.012 -7.994 -1.406 1.00 7.94 N ATOM 11 CA ILE A -4 -34.631 -8.585 -0.135 1.00 6.97 C ATOM 12 C ILE A -4 -33.170 -8.257 0.151 1.00 6.09 C ATOM 13 O ILE A -4 -32.279 -9.097 -0.006 1.00 5.96 O ATOM 14 CB ILE A -4 -34.838 -10.117 -0.121 1.00 7.12 C ATOM 15 CG1 ILE A -4 -36.237 -10.473 -0.637 1.00 7.77 C ATOM 16 CG2 ILE A -4 -34.641 -10.663 1.291 1.00 7.21 C ATOM 17 CD1 ILE A -4 -36.481 -11.962 -0.755 1.00 8.21 C ATOM 0 H ILE A -4 -34.962 -8.631 -2.201 1.00 7.94 H new ATOM 0 HA ILE A -4 -35.273 -8.164 0.639 1.00 6.97 H new ATOM 0 HB ILE A -4 -34.099 -10.573 -0.780 1.00 7.12 H new ATOM 0 HG12 ILE A -4 -36.982 -10.044 0.033 1.00 7.77 H new ATOM 0 HG13 ILE A -4 -36.383 -10.011 -1.614 1.00 7.77 H new ATOM 0 HG21 ILE A -4 -34.789 -11.743 1.288 1.00 7.21 H new ATOM 0 HG22 ILE A -4 -33.630 -10.437 1.631 1.00 7.21 H new ATOM 0 HG23 ILE A -4 -35.362 -10.200 1.964 1.00 7.21 H new ATOM 0 HD11 ILE A -4 -37.491 -12.137 -1.126 1.00 8.21 H new ATOM 0 HD12 ILE A -4 -35.760 -12.395 -1.448 1.00 8.21 H new ATOM 0 HD13 ILE A -4 -36.368 -12.428 0.224 1.00 8.21 H new ATOM 29 N ASP A -3 -32.929 -7.012 0.519 1.00 5.76 N ATOM 30 CA ASP A -3 -31.581 -6.532 0.758 1.00 5.11 C ATOM 31 C ASP A -3 -31.392 -6.197 2.225 1.00 4.13 C ATOM 32 O ASP A -3 -32.148 -5.404 2.787 1.00 4.11 O ATOM 33 CB ASP A -3 -31.286 -5.284 -0.082 1.00 5.67 C ATOM 34 CG ASP A -3 -31.372 -5.533 -1.573 1.00 6.72 C ATOM 35 OD1 ASP A -3 -30.401 -6.067 -2.150 1.00 7.08 O ATOM 36 OD2 ASP A -3 -32.416 -5.209 -2.175 1.00 7.33 O ATOM 0 H ASP A -3 -33.656 -6.310 0.660 1.00 5.76 H new ATOM 0 HA ASP A -3 -30.891 -7.326 0.471 1.00 5.11 H new ATOM 0 HB2 ASP A -3 -31.990 -4.497 0.189 1.00 5.67 H new ATOM 0 HB3 ASP A -3 -30.289 -4.918 0.161 1.00 5.67 H new ATOM 41 N PRO A -2 -30.374 -6.784 2.867 1.00 3.75 N ATOM 42 CA PRO A -2 -30.028 -6.480 4.256 1.00 3.21 C ATOM 43 C PRO A -2 -29.270 -5.164 4.366 1.00 2.50 C ATOM 44 O PRO A -2 -28.364 -5.005 5.182 1.00 2.81 O ATOM 45 CB PRO A -2 -29.136 -7.659 4.683 1.00 3.86 C ATOM 46 CG PRO A -2 -29.114 -8.606 3.521 1.00 4.50 C ATOM 47 CD PRO A -2 -29.488 -7.806 2.309 1.00 4.43 C ATOM 0 HA PRO A -2 -30.911 -6.365 4.885 1.00 3.21 H new ATOM 0 HB2 PRO A -2 -28.130 -7.318 4.927 1.00 3.86 H new ATOM 0 HB3 PRO A -2 -29.533 -8.145 5.574 1.00 3.86 H new ATOM 0 HG2 PRO A -2 -28.126 -9.050 3.402 1.00 4.50 H new ATOM 0 HG3 PRO A -2 -29.816 -9.426 3.676 1.00 4.50 H new ATOM 0 HD2 PRO A -2 -28.615 -7.367 1.827 1.00 4.43 H new ATOM 0 HD3 PRO A -2 -29.993 -8.416 1.560 1.00 4.43 H new ATOM 55 N PHE A -1 -29.686 -4.220 3.552 1.00 2.13 N ATOM 56 CA PHE A -1 -29.038 -2.931 3.448 1.00 1.78 C ATOM 57 C PHE A -1 -30.065 -1.823 3.583 1.00 1.73 C ATOM 58 O PHE A -1 -29.935 -0.762 2.972 1.00 2.21 O ATOM 59 CB PHE A -1 -28.327 -2.816 2.102 1.00 2.13 C ATOM 60 CG PHE A -1 -27.213 -3.802 1.910 1.00 2.45 C ATOM 61 CD1 PHE A -1 -25.961 -3.566 2.452 1.00 2.78 C ATOM 62 CD2 PHE A -1 -27.418 -4.960 1.183 1.00 2.89 C ATOM 63 CE1 PHE A -1 -24.932 -4.471 2.272 1.00 3.51 C ATOM 64 CE2 PHE A -1 -26.395 -5.870 0.998 1.00 3.47 C ATOM 65 CZ PHE A -1 -25.149 -5.625 1.544 1.00 3.78 C ATOM 0 H PHE A -1 -30.493 -4.326 2.937 1.00 2.13 H new ATOM 0 HA PHE A -1 -28.305 -2.836 4.249 1.00 1.78 H new ATOM 0 HB2 PHE A -1 -29.058 -2.951 1.305 1.00 2.13 H new ATOM 0 HB3 PHE A -1 -27.926 -1.807 2.000 1.00 2.13 H new ATOM 0 HD1 PHE A -1 -25.787 -2.665 3.022 1.00 2.78 H new ATOM 0 HD2 PHE A -1 -28.390 -5.156 0.754 1.00 2.89 H new ATOM 0 HE1 PHE A -1 -23.960 -4.276 2.700 1.00 3.51 H new ATOM 0 HE2 PHE A -1 -26.568 -6.771 0.428 1.00 3.47 H new ATOM 0 HZ PHE A -1 -24.347 -6.334 1.402 1.00 3.78 H new ATOM 75 N THR A 0 -31.074 -2.083 4.393 1.00 1.54 N ATOM 76 CA THR A 0 -32.168 -1.151 4.599 1.00 1.59 C ATOM 77 C THR A 0 -31.678 0.178 5.155 1.00 1.40 C ATOM 78 O THR A 0 -31.514 1.152 4.418 1.00 1.49 O ATOM 79 CB THR A 0 -33.229 -1.768 5.523 1.00 1.75 C ATOM 80 OG1 THR A 0 -32.722 -2.991 6.084 1.00 1.70 O ATOM 81 CG2 THR A 0 -34.510 -2.051 4.755 1.00 2.11 C ATOM 0 H THR A 0 -31.159 -2.947 4.928 1.00 1.54 H new ATOM 0 HA THR A 0 -32.621 -0.951 3.628 1.00 1.59 H new ATOM 0 HB THR A 0 -33.452 -1.060 6.321 1.00 1.75 H new ATOM 0 HG1 THR A 0 -33.397 -3.385 6.675 1.00 1.70 H new ATOM 0 HG21 THR A 0 -35.248 -2.488 5.427 1.00 2.11 H new ATOM 0 HG22 THR A 0 -34.900 -1.120 4.343 1.00 2.11 H new ATOM 0 HG23 THR A 0 -34.301 -2.748 3.943 1.00 2.11 H new ATOM 89 N MET A 1 -31.451 0.210 6.444 1.00 1.38 N ATOM 90 CA MET A 1 -30.850 1.370 7.074 1.00 1.36 C ATOM 91 C MET A 1 -29.755 0.938 8.035 1.00 1.21 C ATOM 92 O MET A 1 -29.687 1.350 9.194 1.00 1.42 O ATOM 93 CB MET A 1 -31.912 2.241 7.746 1.00 1.66 C ATOM 94 CG MET A 1 -31.389 3.567 8.303 1.00 1.86 C ATOM 95 SD MET A 1 -29.799 4.088 7.600 1.00 2.09 S ATOM 96 CE MET A 1 -30.163 4.229 5.849 1.00 1.64 C ATOM 0 H MET A 1 -31.672 -0.553 7.083 1.00 1.38 H new ATOM 0 HA MET A 1 -30.383 1.989 6.307 1.00 1.36 H new ATOM 0 HB2 MET A 1 -32.701 2.451 7.024 1.00 1.66 H new ATOM 0 HB3 MET A 1 -32.367 1.675 8.559 1.00 1.66 H new ATOM 0 HG2 MET A 1 -32.129 4.345 8.116 1.00 1.86 H new ATOM 0 HG3 MET A 1 -31.285 3.479 9.384 1.00 1.86 H new ATOM 0 HE1 MET A 1 -29.561 3.510 5.293 1.00 1.64 H new ATOM 0 HE2 MET A 1 -31.220 4.026 5.680 1.00 1.64 H new ATOM 0 HE3 MET A 1 -29.929 5.238 5.509 1.00 1.64 H new ATOM 106 N VAL A 2 -28.917 0.074 7.507 1.00 1.00 N ATOM 107 CA VAL A 2 -27.649 -0.289 8.103 1.00 0.98 C ATOM 108 C VAL A 2 -26.680 -0.512 6.957 1.00 0.79 C ATOM 109 O VAL A 2 -26.068 -1.569 6.816 1.00 0.92 O ATOM 110 CB VAL A 2 -27.719 -1.555 9.001 1.00 1.21 C ATOM 111 CG1 VAL A 2 -28.517 -1.291 10.269 1.00 1.56 C ATOM 112 CG2 VAL A 2 -28.311 -2.729 8.242 1.00 1.32 C ATOM 0 H VAL A 2 -29.103 -0.409 6.628 1.00 1.00 H new ATOM 0 HA VAL A 2 -27.330 0.514 8.768 1.00 0.98 H new ATOM 0 HB VAL A 2 -26.698 -1.807 9.288 1.00 1.21 H new ATOM 0 HG11 VAL A 2 -28.547 -2.196 10.875 1.00 1.56 H new ATOM 0 HG12 VAL A 2 -28.044 -0.490 10.837 1.00 1.56 H new ATOM 0 HG13 VAL A 2 -29.533 -0.997 10.005 1.00 1.56 H new ATOM 0 HG21 VAL A 2 -28.348 -3.602 8.894 1.00 1.32 H new ATOM 0 HG22 VAL A 2 -29.319 -2.478 7.913 1.00 1.32 H new ATOM 0 HG23 VAL A 2 -27.691 -2.951 7.374 1.00 1.32 H new ATOM 122 N ALA A 3 -26.589 0.490 6.101 1.00 0.66 N ATOM 123 CA ALA A 3 -25.779 0.388 4.906 1.00 0.55 C ATOM 124 C ALA A 3 -25.080 1.695 4.624 1.00 0.60 C ATOM 125 O ALA A 3 -25.650 2.772 4.799 1.00 1.10 O ATOM 126 CB ALA A 3 -26.630 -0.025 3.716 1.00 0.63 C ATOM 0 H ALA A 3 -27.068 1.384 6.214 1.00 0.66 H new ATOM 0 HA ALA A 3 -25.022 -0.379 5.072 1.00 0.55 H new ATOM 0 HB1 ALA A 3 -26.003 -0.096 2.827 1.00 0.63 H new ATOM 0 HB2 ALA A 3 -27.088 -0.994 3.915 1.00 0.63 H new ATOM 0 HB3 ALA A 3 -27.410 0.718 3.551 1.00 0.63 H new ATOM 132 N LEU A 4 -23.853 1.586 4.168 1.00 0.45 N ATOM 133 CA LEU A 4 -23.022 2.742 3.906 1.00 0.41 C ATOM 134 C LEU A 4 -22.850 2.911 2.410 1.00 0.39 C ATOM 135 O LEU A 4 -22.493 1.966 1.711 1.00 0.38 O ATOM 136 CB LEU A 4 -21.654 2.589 4.578 1.00 0.41 C ATOM 137 CG LEU A 4 -21.597 2.916 6.078 1.00 0.56 C ATOM 138 CD1 LEU A 4 -22.605 2.108 6.870 1.00 1.16 C ATOM 139 CD2 LEU A 4 -20.202 2.663 6.609 1.00 1.46 C ATOM 0 H LEU A 4 -23.401 0.694 3.968 1.00 0.45 H new ATOM 0 HA LEU A 4 -23.508 3.626 4.319 1.00 0.41 H new ATOM 0 HB2 LEU A 4 -21.316 1.562 4.438 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -20.943 3.232 4.059 1.00 0.41 H new ATOM 0 HG LEU A 4 -21.850 3.970 6.197 1.00 0.56 H new ATOM 0 HD11 LEU A 4 -22.532 2.369 7.926 1.00 1.16 H new ATOM 0 HD12 LEU A 4 -23.610 2.328 6.511 1.00 1.16 H new ATOM 0 HD13 LEU A 4 -22.399 1.045 6.744 1.00 1.16 H new ATOM 0 HD21 LEU A 4 -20.170 2.897 7.673 1.00 1.46 H new ATOM 0 HD22 LEU A 4 -19.940 1.615 6.460 1.00 1.46 H new ATOM 0 HD23 LEU A 4 -19.490 3.294 6.077 1.00 1.46 H new ATOM 151 N SER A 5 -23.089 4.114 1.929 1.00 0.41 N ATOM 152 CA SER A 5 -22.985 4.388 0.509 1.00 0.42 C ATOM 153 C SER A 5 -21.578 4.872 0.195 1.00 0.37 C ATOM 154 O SER A 5 -21.228 6.027 0.454 1.00 0.42 O ATOM 155 CB SER A 5 -24.039 5.406 0.067 1.00 0.51 C ATOM 156 OG SER A 5 -25.347 4.928 0.338 1.00 1.28 O ATOM 0 H SER A 5 -23.356 4.917 2.499 1.00 0.41 H new ATOM 0 HA SER A 5 -23.175 3.471 -0.049 1.00 0.42 H new ATOM 0 HB2 SER A 5 -23.878 6.351 0.585 1.00 0.51 H new ATOM 0 HB3 SER A 5 -23.934 5.605 -0.999 1.00 0.51 H new ATOM 0 HG SER A 5 -25.645 5.265 1.209 1.00 1.28 H new ATOM 162 N LEU A 6 -20.775 3.968 -0.338 1.00 0.31 N ATOM 163 CA LEU A 6 -19.359 4.210 -0.550 1.00 0.28 C ATOM 164 C LEU A 6 -19.041 4.278 -2.037 1.00 0.28 C ATOM 165 O LEU A 6 -19.332 3.345 -2.790 1.00 0.31 O ATOM 166 CB LEU A 6 -18.538 3.090 0.110 1.00 0.26 C ATOM 167 CG LEU A 6 -17.976 3.389 1.510 1.00 0.33 C ATOM 168 CD1 LEU A 6 -18.980 4.136 2.367 1.00 0.61 C ATOM 169 CD2 LEU A 6 -17.576 2.093 2.203 1.00 0.62 C ATOM 0 H LEU A 6 -21.087 3.044 -0.636 1.00 0.31 H new ATOM 0 HA LEU A 6 -19.098 5.167 -0.098 1.00 0.28 H new ATOM 0 HB2 LEU A 6 -19.165 2.201 0.176 1.00 0.26 H new ATOM 0 HB3 LEU A 6 -17.704 2.844 -0.548 1.00 0.26 H new ATOM 0 HG LEU A 6 -17.099 4.023 1.384 1.00 0.33 H new ATOM 0 HD11 LEU A 6 -18.548 4.330 3.349 1.00 0.61 H new ATOM 0 HD12 LEU A 6 -19.234 5.082 1.889 1.00 0.61 H new ATOM 0 HD13 LEU A 6 -19.881 3.534 2.480 1.00 0.61 H new ATOM 0 HD21 LEU A 6 -17.180 2.317 3.193 1.00 0.62 H new ATOM 0 HD22 LEU A 6 -18.449 1.447 2.299 1.00 0.62 H new ATOM 0 HD23 LEU A 6 -16.813 1.585 1.613 1.00 0.62 H new ATOM 181 N LYS A 7 -18.478 5.399 -2.462 1.00 0.29 N ATOM 182 CA LYS A 7 -17.983 5.527 -3.820 1.00 0.31 C ATOM 183 C LYS A 7 -16.719 4.710 -3.988 1.00 0.29 C ATOM 184 O LYS A 7 -15.695 5.005 -3.374 1.00 0.31 O ATOM 185 CB LYS A 7 -17.694 6.983 -4.179 1.00 0.39 C ATOM 186 CG LYS A 7 -18.921 7.776 -4.577 1.00 0.52 C ATOM 187 CD LYS A 7 -18.526 9.115 -5.172 1.00 0.63 C ATOM 188 CE LYS A 7 -19.718 9.830 -5.777 1.00 0.94 C ATOM 189 NZ LYS A 7 -20.709 10.235 -4.743 1.00 1.72 N ATOM 0 H LYS A 7 -18.354 6.231 -1.885 1.00 0.29 H new ATOM 0 HA LYS A 7 -18.759 5.157 -4.490 1.00 0.31 H new ATOM 0 HB2 LYS A 7 -17.221 7.469 -3.326 1.00 0.39 H new ATOM 0 HB3 LYS A 7 -16.976 7.008 -4.999 1.00 0.39 H new ATOM 0 HG2 LYS A 7 -19.507 7.210 -5.301 1.00 0.52 H new ATOM 0 HG3 LYS A 7 -19.557 7.933 -3.706 1.00 0.52 H new ATOM 0 HD2 LYS A 7 -18.080 9.740 -4.398 1.00 0.63 H new ATOM 0 HD3 LYS A 7 -17.765 8.963 -5.937 1.00 0.63 H new ATOM 0 HE2 LYS A 7 -19.376 10.713 -6.316 1.00 0.94 H new ATOM 0 HE3 LYS A 7 -20.200 9.178 -6.506 1.00 0.94 H new ATOM 0 HZ1 LYS A 7 -21.500 10.735 -5.197 1.00 1.72 H new ATOM 0 HZ2 LYS A 7 -21.068 9.389 -4.256 1.00 1.72 H new ATOM 0 HZ3 LYS A 7 -20.252 10.864 -4.052 1.00 1.72 H new ATOM 203 N ILE A 8 -16.797 3.686 -4.810 1.00 0.28 N ATOM 204 CA ILE A 8 -15.658 2.838 -5.076 1.00 0.28 C ATOM 205 C ILE A 8 -14.890 3.359 -6.276 1.00 0.31 C ATOM 206 O ILE A 8 -15.313 3.192 -7.420 1.00 0.34 O ATOM 207 CB ILE A 8 -16.082 1.380 -5.338 1.00 0.33 C ATOM 208 CG1 ILE A 8 -16.841 0.811 -4.133 1.00 0.58 C ATOM 209 CG2 ILE A 8 -14.866 0.526 -5.663 1.00 0.32 C ATOM 210 CD1 ILE A 8 -16.046 0.823 -2.845 1.00 0.51 C ATOM 0 H ILE A 8 -17.646 3.420 -5.309 1.00 0.28 H new ATOM 0 HA ILE A 8 -15.023 2.856 -4.190 1.00 0.28 H new ATOM 0 HB ILE A 8 -16.753 1.364 -6.197 1.00 0.33 H new ATOM 0 HG12 ILE A 8 -17.756 1.385 -3.989 1.00 0.58 H new ATOM 0 HG13 ILE A 8 -17.139 -0.214 -4.355 1.00 0.58 H new ATOM 0 HG21 ILE A 8 -15.181 -0.501 -5.846 1.00 0.32 H new ATOM 0 HG22 ILE A 8 -14.373 0.918 -6.553 1.00 0.32 H new ATOM 0 HG23 ILE A 8 -14.171 0.548 -4.824 1.00 0.32 H new ATOM 0 HD11 ILE A 8 -16.651 0.405 -2.040 1.00 0.51 H new ATOM 0 HD12 ILE A 8 -15.143 0.224 -2.969 1.00 0.51 H new ATOM 0 HD13 ILE A 8 -15.770 1.848 -2.597 1.00 0.51 H new ATOM 222 N SER A 9 -13.782 4.017 -6.012 1.00 0.33 N ATOM 223 CA SER A 9 -12.927 4.501 -7.073 1.00 0.39 C ATOM 224 C SER A 9 -11.798 3.507 -7.290 1.00 0.37 C ATOM 225 O SER A 9 -11.129 3.105 -6.342 1.00 0.45 O ATOM 226 CB SER A 9 -12.378 5.888 -6.723 1.00 0.46 C ATOM 227 OG SER A 9 -11.651 6.452 -7.803 1.00 1.48 O ATOM 0 H SER A 9 -13.452 4.229 -5.070 1.00 0.33 H new ATOM 0 HA SER A 9 -13.501 4.595 -7.995 1.00 0.39 H new ATOM 0 HB2 SER A 9 -13.202 6.549 -6.455 1.00 0.46 H new ATOM 0 HB3 SER A 9 -11.732 5.814 -5.849 1.00 0.46 H new ATOM 0 HG SER A 9 -11.317 7.337 -7.546 1.00 1.48 H new ATOM 233 N ILE A 10 -11.620 3.071 -8.524 1.00 0.40 N ATOM 234 CA ILE A 10 -10.573 2.118 -8.850 1.00 0.42 C ATOM 235 C ILE A 10 -9.700 2.674 -9.967 1.00 0.50 C ATOM 236 O ILE A 10 -9.983 2.483 -11.153 1.00 0.53 O ATOM 237 CB ILE A 10 -11.159 0.746 -9.265 1.00 0.40 C ATOM 238 CG1 ILE A 10 -12.101 0.220 -8.171 1.00 0.38 C ATOM 239 CG2 ILE A 10 -10.039 -0.256 -9.533 1.00 0.45 C ATOM 240 CD1 ILE A 10 -12.785 -1.087 -8.516 1.00 0.43 C ATOM 0 H ILE A 10 -12.188 3.362 -9.319 1.00 0.40 H new ATOM 0 HA ILE A 10 -9.968 1.963 -7.956 1.00 0.42 H new ATOM 0 HB ILE A 10 -11.730 0.875 -10.185 1.00 0.40 H new ATOM 0 HG12 ILE A 10 -11.532 0.088 -7.251 1.00 0.38 H new ATOM 0 HG13 ILE A 10 -12.862 0.974 -7.970 1.00 0.38 H new ATOM 0 HG21 ILE A 10 -10.470 -1.214 -9.823 1.00 0.45 H new ATOM 0 HG22 ILE A 10 -9.404 0.115 -10.337 1.00 0.45 H new ATOM 0 HG23 ILE A 10 -9.443 -0.385 -8.630 1.00 0.45 H new ATOM 0 HD11 ILE A 10 -13.431 -1.388 -7.692 1.00 0.43 H new ATOM 0 HD12 ILE A 10 -13.384 -0.957 -9.418 1.00 0.43 H new ATOM 0 HD13 ILE A 10 -12.033 -1.857 -8.687 1.00 0.43 H new ATOM 252 N GLY A 11 -8.662 3.400 -9.580 1.00 0.59 N ATOM 253 CA GLY A 11 -7.787 4.027 -10.550 1.00 0.68 C ATOM 254 C GLY A 11 -8.400 5.282 -11.138 1.00 0.75 C ATOM 255 O GLY A 11 -8.033 6.396 -10.767 1.00 0.96 O ATOM 0 H GLY A 11 -8.409 3.567 -8.606 1.00 0.59 H new ATOM 0 HA2 GLY A 11 -6.838 4.275 -10.075 1.00 0.68 H new ATOM 0 HA3 GLY A 11 -7.568 3.321 -11.351 1.00 0.68 H new ATOM 259 N ASN A 12 -9.347 5.098 -12.047 1.00 0.75 N ATOM 260 CA ASN A 12 -10.026 6.217 -12.690 1.00 0.90 C ATOM 261 C ASN A 12 -11.541 6.028 -12.663 1.00 0.84 C ATOM 262 O ASN A 12 -12.300 6.991 -12.766 1.00 1.09 O ATOM 263 CB ASN A 12 -9.550 6.381 -14.140 1.00 1.09 C ATOM 264 CG ASN A 12 -9.913 5.199 -15.027 1.00 1.77 C ATOM 265 OD1 ASN A 12 -9.973 4.052 -14.574 1.00 2.62 O ATOM 266 ND2 ASN A 12 -10.165 5.469 -16.297 1.00 2.17 N ATOM 0 H ASN A 12 -9.665 4.180 -12.358 1.00 0.75 H new ATOM 0 HA ASN A 12 -9.777 7.119 -12.131 1.00 0.90 H new ATOM 0 HB2 ASN A 12 -9.986 7.288 -14.558 1.00 1.09 H new ATOM 0 HB3 ASN A 12 -8.468 6.514 -14.148 1.00 1.09 H new ATOM 0 HD21 ASN A 12 -10.419 4.717 -16.938 1.00 2.17 H new ATOM 0 HD22 ASN A 12 -10.106 6.429 -16.636 1.00 2.17 H new ATOM 273 N VAL A 13 -11.976 4.784 -12.517 1.00 0.65 N ATOM 274 CA VAL A 13 -13.395 4.464 -12.528 1.00 0.61 C ATOM 275 C VAL A 13 -13.993 4.651 -11.133 1.00 0.53 C ATOM 276 O VAL A 13 -13.294 4.513 -10.132 1.00 0.50 O ATOM 277 CB VAL A 13 -13.633 3.013 -13.026 1.00 0.61 C ATOM 278 CG1 VAL A 13 -13.028 1.995 -12.071 1.00 0.55 C ATOM 279 CG2 VAL A 13 -15.114 2.734 -13.237 1.00 0.65 C ATOM 0 H VAL A 13 -11.364 3.978 -12.389 1.00 0.65 H new ATOM 0 HA VAL A 13 -13.892 5.146 -13.218 1.00 0.61 H new ATOM 0 HB VAL A 13 -13.131 2.915 -13.989 1.00 0.61 H new ATOM 0 HG11 VAL A 13 -13.212 0.989 -12.448 1.00 0.55 H new ATOM 0 HG12 VAL A 13 -11.954 2.163 -11.993 1.00 0.55 H new ATOM 0 HG13 VAL A 13 -13.484 2.103 -11.087 1.00 0.55 H new ATOM 0 HG21 VAL A 13 -15.245 1.710 -13.586 1.00 0.65 H new ATOM 0 HG22 VAL A 13 -15.647 2.868 -12.296 1.00 0.65 H new ATOM 0 HG23 VAL A 13 -15.512 3.424 -13.981 1.00 0.65 H new ATOM 289 N VAL A 14 -15.277 4.979 -11.075 1.00 0.51 N ATOM 290 CA VAL A 14 -15.969 5.154 -9.804 1.00 0.46 C ATOM 291 C VAL A 14 -17.352 4.506 -9.861 1.00 0.41 C ATOM 292 O VAL A 14 -18.171 4.821 -10.724 1.00 0.45 O ATOM 293 CB VAL A 14 -16.078 6.649 -9.399 1.00 0.53 C ATOM 294 CG1 VAL A 14 -16.612 7.492 -10.544 1.00 0.62 C ATOM 295 CG2 VAL A 14 -16.946 6.821 -8.156 1.00 0.50 C ATOM 0 H VAL A 14 -15.863 5.130 -11.896 1.00 0.51 H new ATOM 0 HA VAL A 14 -15.376 4.658 -9.036 1.00 0.46 H new ATOM 0 HB VAL A 14 -15.073 6.998 -9.162 1.00 0.53 H new ATOM 0 HG11 VAL A 14 -16.677 8.534 -10.229 1.00 0.62 H new ATOM 0 HG12 VAL A 14 -15.940 7.412 -11.399 1.00 0.62 H new ATOM 0 HG13 VAL A 14 -17.603 7.136 -10.827 1.00 0.62 H new ATOM 0 HG21 VAL A 14 -17.004 7.878 -7.896 1.00 0.50 H new ATOM 0 HG22 VAL A 14 -17.948 6.441 -8.356 1.00 0.50 H new ATOM 0 HG23 VAL A 14 -16.507 6.267 -7.326 1.00 0.50 H new ATOM 305 N LYS A 15 -17.587 3.580 -8.949 1.00 0.39 N ATOM 306 CA LYS A 15 -18.838 2.839 -8.890 1.00 0.41 C ATOM 307 C LYS A 15 -19.447 2.964 -7.503 1.00 0.35 C ATOM 308 O LYS A 15 -18.729 3.088 -6.516 1.00 0.31 O ATOM 309 CB LYS A 15 -18.623 1.367 -9.250 1.00 0.50 C ATOM 310 CG LYS A 15 -18.210 1.145 -10.698 1.00 0.67 C ATOM 311 CD LYS A 15 -19.262 1.666 -11.667 1.00 0.80 C ATOM 312 CE LYS A 15 -18.861 1.421 -13.114 1.00 1.02 C ATOM 313 NZ LYS A 15 -18.889 -0.024 -13.471 1.00 1.28 N ATOM 0 H LYS A 15 -16.916 3.319 -8.226 1.00 0.39 H new ATOM 0 HA LYS A 15 -19.526 3.264 -9.621 1.00 0.41 H new ATOM 0 HB2 LYS A 15 -17.858 0.950 -8.595 1.00 0.50 H new ATOM 0 HB3 LYS A 15 -19.543 0.816 -9.056 1.00 0.50 H new ATOM 0 HG2 LYS A 15 -17.261 1.646 -10.887 1.00 0.67 H new ATOM 0 HG3 LYS A 15 -18.049 0.081 -10.872 1.00 0.67 H new ATOM 0 HD2 LYS A 15 -20.216 1.179 -11.466 1.00 0.80 H new ATOM 0 HD3 LYS A 15 -19.409 2.734 -11.505 1.00 0.80 H new ATOM 0 HE2 LYS A 15 -19.534 1.969 -13.773 1.00 1.02 H new ATOM 0 HE3 LYS A 15 -17.859 1.815 -13.283 1.00 1.02 H new ATOM 0 HZ1 LYS A 15 -18.725 -0.133 -14.492 1.00 1.28 H new ATOM 0 HZ2 LYS A 15 -18.145 -0.526 -12.946 1.00 1.28 H new ATOM 0 HZ3 LYS A 15 -19.817 -0.424 -13.225 1.00 1.28 H new ATOM 327 N THR A 16 -20.760 2.946 -7.429 1.00 0.38 N ATOM 328 CA THR A 16 -21.440 3.180 -6.169 1.00 0.37 C ATOM 329 C THR A 16 -21.840 1.857 -5.529 1.00 0.35 C ATOM 330 O THR A 16 -22.605 1.085 -6.110 1.00 0.39 O ATOM 331 CB THR A 16 -22.698 4.042 -6.373 1.00 0.45 C ATOM 332 OG1 THR A 16 -22.453 5.034 -7.380 1.00 0.50 O ATOM 333 CG2 THR A 16 -23.100 4.723 -5.073 1.00 0.45 C ATOM 0 H THR A 16 -21.378 2.773 -8.222 1.00 0.38 H new ATOM 0 HA THR A 16 -20.750 3.710 -5.513 1.00 0.37 H new ATOM 0 HB THR A 16 -23.512 3.392 -6.693 1.00 0.45 H new ATOM 0 HG1 THR A 16 -23.258 5.578 -7.506 1.00 0.50 H new ATOM 0 HG21 THR A 16 -23.992 5.327 -5.239 1.00 0.45 H new ATOM 0 HG22 THR A 16 -23.310 3.967 -4.316 1.00 0.45 H new ATOM 0 HG23 THR A 16 -22.287 5.363 -4.731 1.00 0.45 H new ATOM 341 N MET A 17 -21.323 1.592 -4.339 1.00 0.31 N ATOM 342 CA MET A 17 -21.639 0.363 -3.628 1.00 0.32 C ATOM 343 C MET A 17 -22.034 0.674 -2.203 1.00 0.32 C ATOM 344 O MET A 17 -21.595 1.670 -1.628 1.00 0.31 O ATOM 345 CB MET A 17 -20.465 -0.618 -3.614 1.00 0.34 C ATOM 346 CG MET A 17 -20.419 -1.558 -4.805 1.00 0.44 C ATOM 347 SD MET A 17 -19.355 -2.985 -4.501 1.00 1.04 S ATOM 348 CE MET A 17 -20.209 -3.758 -3.124 1.00 0.40 C ATOM 0 H MET A 17 -20.682 2.213 -3.845 1.00 0.31 H new ATOM 0 HA MET A 17 -22.467 -0.106 -4.159 1.00 0.32 H new ATOM 0 HB2 MET A 17 -19.534 -0.052 -3.578 1.00 0.34 H new ATOM 0 HB3 MET A 17 -20.513 -1.211 -2.700 1.00 0.34 H new ATOM 0 HG2 MET A 17 -21.428 -1.901 -5.035 1.00 0.44 H new ATOM 0 HG3 MET A 17 -20.059 -1.017 -5.680 1.00 0.44 H new ATOM 0 HE1 MET A 17 -19.791 -4.749 -2.947 1.00 0.40 H new ATOM 0 HE2 MET A 17 -20.086 -3.147 -2.230 1.00 0.40 H new ATOM 0 HE3 MET A 17 -21.270 -3.848 -3.358 1.00 0.40 H new ATOM 358 N GLN A 18 -22.875 -0.166 -1.644 1.00 0.36 N ATOM 359 CA GLN A 18 -23.260 -0.038 -0.257 1.00 0.37 C ATOM 360 C GLN A 18 -22.793 -1.247 0.528 1.00 0.35 C ATOM 361 O GLN A 18 -22.914 -2.385 0.073 1.00 0.38 O ATOM 362 CB GLN A 18 -24.766 0.159 -0.143 1.00 0.44 C ATOM 363 CG GLN A 18 -25.188 1.560 -0.544 1.00 0.49 C ATOM 364 CD GLN A 18 -26.583 1.629 -1.115 1.00 0.59 C ATOM 365 OE1 GLN A 18 -27.465 0.849 -0.753 1.00 0.92 O ATOM 366 NE2 GLN A 18 -26.784 2.569 -2.023 1.00 0.60 N ATOM 0 H GLN A 18 -23.308 -0.950 -2.132 1.00 0.36 H new ATOM 0 HA GLN A 18 -22.779 0.842 0.169 1.00 0.37 H new ATOM 0 HB2 GLN A 18 -25.276 -0.568 -0.775 1.00 0.44 H new ATOM 0 HB3 GLN A 18 -25.080 -0.035 0.883 1.00 0.44 H new ATOM 0 HG2 GLN A 18 -25.128 2.212 0.327 1.00 0.49 H new ATOM 0 HG3 GLN A 18 -24.483 1.946 -1.280 1.00 0.49 H new ATOM 0 HE21 GLN A 18 -26.021 3.192 -2.290 1.00 0.60 H new ATOM 0 HE22 GLN A 18 -27.702 2.672 -2.456 1.00 0.60 H new ATOM 375 N PHE A 19 -22.247 -0.990 1.703 1.00 0.34 N ATOM 376 CA PHE A 19 -21.688 -2.029 2.546 1.00 0.33 C ATOM 377 C PHE A 19 -22.322 -1.918 3.915 1.00 0.37 C ATOM 378 O PHE A 19 -22.853 -0.864 4.262 1.00 0.40 O ATOM 379 CB PHE A 19 -20.170 -1.866 2.690 1.00 0.29 C ATOM 380 CG PHE A 19 -19.399 -1.960 1.405 1.00 0.27 C ATOM 381 CD1 PHE A 19 -19.191 -0.835 0.629 1.00 0.30 C ATOM 382 CD2 PHE A 19 -18.899 -3.177 0.968 1.00 0.33 C ATOM 383 CE1 PHE A 19 -18.496 -0.918 -0.563 1.00 0.31 C ATOM 384 CE2 PHE A 19 -18.201 -3.265 -0.220 1.00 0.36 C ATOM 385 CZ PHE A 19 -17.948 -2.134 -0.956 1.00 0.31 C ATOM 0 H PHE A 19 -22.179 -0.053 2.099 1.00 0.34 H new ATOM 0 HA PHE A 19 -21.889 -3.000 2.094 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.965 -0.899 3.150 1.00 0.29 H new ATOM 0 HB3 PHE A 19 -19.801 -2.629 3.375 1.00 0.29 H new ATOM 0 HD1 PHE A 19 -19.576 0.119 0.958 1.00 0.30 H new ATOM 0 HD2 PHE A 19 -19.057 -4.065 1.563 1.00 0.33 H new ATOM 0 HE1 PHE A 19 -18.379 -0.043 -1.186 1.00 0.31 H new ATOM 0 HE2 PHE A 19 -17.853 -4.225 -0.571 1.00 0.36 H new ATOM 0 HZ PHE A 19 -17.326 -2.189 -1.837 1.00 0.31 H new ATOM 395 N GLU A 20 -22.284 -2.979 4.688 1.00 0.39 N ATOM 396 CA GLU A 20 -22.784 -2.914 6.046 1.00 0.43 C ATOM 397 C GLU A 20 -21.750 -2.228 6.932 1.00 0.44 C ATOM 398 O GLU A 20 -20.547 -2.346 6.701 1.00 0.47 O ATOM 399 CB GLU A 20 -23.090 -4.307 6.592 1.00 0.50 C ATOM 400 CG GLU A 20 -24.044 -5.117 5.731 1.00 0.61 C ATOM 401 CD GLU A 20 -24.199 -6.536 6.232 1.00 0.90 C ATOM 402 OE1 GLU A 20 -24.950 -6.748 7.209 1.00 1.42 O ATOM 403 OE2 GLU A 20 -23.569 -7.451 5.656 1.00 1.06 O ATOM 0 H GLU A 20 -21.917 -3.888 4.406 1.00 0.39 H new ATOM 0 HA GLU A 20 -23.712 -2.342 6.045 1.00 0.43 H new ATOM 0 HB2 GLU A 20 -22.155 -4.858 6.696 1.00 0.50 H new ATOM 0 HB3 GLU A 20 -23.515 -4.208 7.591 1.00 0.50 H new ATOM 0 HG2 GLU A 20 -25.019 -4.630 5.715 1.00 0.61 H new ATOM 0 HG3 GLU A 20 -23.679 -5.134 4.704 1.00 0.61 H new ATOM 410 N PRO A 21 -22.206 -1.487 7.945 1.00 0.50 N ATOM 411 CA PRO A 21 -21.322 -0.802 8.884 1.00 0.53 C ATOM 412 C PRO A 21 -20.394 -1.780 9.604 1.00 0.53 C ATOM 413 O PRO A 21 -19.255 -1.449 9.937 1.00 0.65 O ATOM 414 CB PRO A 21 -22.287 -0.119 9.868 1.00 0.57 C ATOM 415 CG PRO A 21 -23.617 -0.746 9.641 1.00 0.61 C ATOM 416 CD PRO A 21 -23.617 -1.241 8.232 1.00 0.62 C ATOM 0 HA PRO A 21 -20.657 -0.095 8.387 1.00 0.53 H new ATOM 0 HB2 PRO A 21 -21.959 -0.261 10.898 1.00 0.57 H new ATOM 0 HB3 PRO A 21 -22.327 0.956 9.692 1.00 0.57 H new ATOM 0 HG2 PRO A 21 -23.784 -1.565 10.340 1.00 0.61 H new ATOM 0 HG3 PRO A 21 -24.418 -0.024 9.799 1.00 0.61 H new ATOM 0 HD2 PRO A 21 -24.210 -2.150 8.128 1.00 0.62 H new ATOM 0 HD3 PRO A 21 -24.041 -0.504 7.550 1.00 0.62 H new ATOM 424 N SER A 22 -20.877 -3.000 9.801 1.00 0.50 N ATOM 425 CA SER A 22 -20.104 -4.028 10.476 1.00 0.61 C ATOM 426 C SER A 22 -19.326 -4.890 9.474 1.00 0.84 C ATOM 427 O SER A 22 -18.706 -5.888 9.851 1.00 1.64 O ATOM 428 CB SER A 22 -21.036 -4.906 11.307 1.00 0.68 C ATOM 429 OG SER A 22 -21.901 -4.117 12.110 1.00 1.32 O ATOM 0 H SER A 22 -21.804 -3.300 9.501 1.00 0.50 H new ATOM 0 HA SER A 22 -19.381 -3.539 11.129 1.00 0.61 H new ATOM 0 HB2 SER A 22 -21.627 -5.541 10.647 1.00 0.68 H new ATOM 0 HB3 SER A 22 -20.447 -5.567 11.943 1.00 0.68 H new ATOM 0 HG SER A 22 -22.489 -4.703 12.631 1.00 1.32 H new ATOM 435 N THR A 23 -19.355 -4.503 8.202 1.00 0.41 N ATOM 436 CA THR A 23 -18.617 -5.204 7.177 1.00 0.49 C ATOM 437 C THR A 23 -17.145 -4.890 7.302 1.00 0.63 C ATOM 438 O THR A 23 -16.698 -3.758 7.094 1.00 1.47 O ATOM 439 CB THR A 23 -19.095 -4.840 5.759 1.00 0.51 C ATOM 440 OG1 THR A 23 -20.469 -5.200 5.591 1.00 0.68 O ATOM 441 CG2 THR A 23 -18.266 -5.540 4.704 1.00 0.50 C ATOM 0 H THR A 23 -19.888 -3.702 7.863 1.00 0.41 H new ATOM 0 HA THR A 23 -18.793 -6.270 7.324 1.00 0.49 H new ATOM 0 HB THR A 23 -18.979 -3.763 5.639 1.00 0.51 H new ATOM 0 HG1 THR A 23 -20.636 -5.422 4.651 1.00 0.68 H new ATOM 0 HG21 THR A 23 -18.628 -5.263 3.714 1.00 0.50 H new ATOM 0 HG22 THR A 23 -17.222 -5.243 4.805 1.00 0.50 H new ATOM 0 HG23 THR A 23 -18.350 -6.619 4.832 1.00 0.50 H new ATOM 449 N MET A 24 -16.416 -5.893 7.705 1.00 0.54 N ATOM 450 CA MET A 24 -14.973 -5.822 7.757 1.00 0.48 C ATOM 451 C MET A 24 -14.405 -5.633 6.361 1.00 0.43 C ATOM 452 O MET A 24 -15.043 -5.995 5.374 1.00 0.47 O ATOM 453 CB MET A 24 -14.404 -7.105 8.337 1.00 0.60 C ATOM 454 CG MET A 24 -13.410 -6.881 9.449 1.00 0.57 C ATOM 455 SD MET A 24 -14.220 -6.631 11.035 1.00 0.83 S ATOM 456 CE MET A 24 -12.803 -6.573 12.115 1.00 0.71 C ATOM 0 H MET A 24 -16.802 -6.787 8.008 1.00 0.54 H new ATOM 0 HA MET A 24 -14.699 -4.976 8.387 1.00 0.48 H new ATOM 0 HB2 MET A 24 -15.223 -7.718 8.713 1.00 0.60 H new ATOM 0 HB3 MET A 24 -13.922 -7.671 7.540 1.00 0.60 H new ATOM 0 HG2 MET A 24 -12.740 -7.738 9.515 1.00 0.57 H new ATOM 0 HG3 MET A 24 -12.794 -6.013 9.215 1.00 0.57 H new ATOM 0 HE1 MET A 24 -12.720 -7.515 12.657 1.00 0.71 H new ATOM 0 HE2 MET A 24 -11.901 -6.414 11.524 1.00 0.71 H new ATOM 0 HE3 MET A 24 -12.920 -5.754 12.825 1.00 0.71 H new ATOM 466 N VAL A 25 -13.219 -5.048 6.284 1.00 0.40 N ATOM 467 CA VAL A 25 -12.483 -4.972 5.025 1.00 0.38 C ATOM 468 C VAL A 25 -12.487 -6.317 4.295 1.00 0.39 C ATOM 469 O VAL A 25 -12.718 -6.370 3.086 1.00 0.39 O ATOM 470 CB VAL A 25 -11.033 -4.505 5.249 1.00 0.41 C ATOM 471 CG1 VAL A 25 -10.180 -4.719 4.005 1.00 0.42 C ATOM 472 CG2 VAL A 25 -11.027 -3.045 5.645 1.00 0.40 C ATOM 0 H VAL A 25 -12.743 -4.618 7.077 1.00 0.40 H new ATOM 0 HA VAL A 25 -12.993 -4.236 4.403 1.00 0.38 H new ATOM 0 HB VAL A 25 -10.600 -5.102 6.051 1.00 0.41 H new ATOM 0 HG11 VAL A 25 -9.163 -4.378 4.198 1.00 0.42 H new ATOM 0 HG12 VAL A 25 -10.166 -5.779 3.751 1.00 0.42 H new ATOM 0 HG13 VAL A 25 -10.600 -4.153 3.174 1.00 0.42 H new ATOM 0 HG21 VAL A 25 -10.000 -2.715 5.803 1.00 0.40 H new ATOM 0 HG22 VAL A 25 -11.481 -2.451 4.852 1.00 0.40 H new ATOM 0 HG23 VAL A 25 -11.596 -2.915 6.566 1.00 0.40 H new ATOM 482 N TYR A 26 -12.263 -7.403 5.034 1.00 0.42 N ATOM 483 CA TYR A 26 -12.229 -8.720 4.416 1.00 0.45 C ATOM 484 C TYR A 26 -13.600 -9.119 3.854 1.00 0.43 C ATOM 485 O TYR A 26 -13.676 -9.822 2.842 1.00 0.42 O ATOM 486 CB TYR A 26 -11.652 -9.803 5.353 1.00 0.52 C ATOM 487 CG TYR A 26 -12.354 -10.016 6.684 1.00 0.56 C ATOM 488 CD1 TYR A 26 -13.626 -10.579 6.740 1.00 0.70 C ATOM 489 CD2 TYR A 26 -11.775 -9.609 7.878 1.00 0.58 C ATOM 490 CE1 TYR A 26 -14.291 -10.729 7.941 1.00 0.78 C ATOM 491 CE2 TYR A 26 -12.431 -9.766 9.084 1.00 0.65 C ATOM 492 CZ TYR A 26 -13.592 -10.491 9.134 1.00 0.72 C ATOM 493 OH TYR A 26 -14.350 -10.472 10.308 1.00 0.83 O ATOM 0 H TYR A 26 -12.106 -7.395 6.042 1.00 0.42 H new ATOM 0 HA TYR A 26 -11.541 -8.649 3.573 1.00 0.45 H new ATOM 0 HB2 TYR A 26 -11.654 -10.751 4.815 1.00 0.52 H new ATOM 0 HB3 TYR A 26 -10.611 -9.554 5.556 1.00 0.52 H new ATOM 0 HD1 TYR A 26 -14.102 -10.905 5.827 1.00 0.70 H new ATOM 0 HD2 TYR A 26 -10.792 -9.161 7.864 1.00 0.58 H new ATOM 0 HE1 TYR A 26 -15.330 -11.024 7.962 1.00 0.78 H new ATOM 0 HE2 TYR A 26 -12.031 -9.320 9.982 1.00 0.65 H new ATOM 0 HH TYR A 26 -13.763 -10.299 11.074 1.00 0.83 H new ATOM 503 N ASP A 27 -14.681 -8.643 4.476 1.00 0.43 N ATOM 504 CA ASP A 27 -16.022 -8.920 3.970 1.00 0.44 C ATOM 505 C ASP A 27 -16.309 -8.034 2.767 1.00 0.39 C ATOM 506 O ASP A 27 -16.852 -8.484 1.761 1.00 0.40 O ATOM 507 CB ASP A 27 -17.098 -8.687 5.037 1.00 0.50 C ATOM 508 CG ASP A 27 -17.003 -9.630 6.218 1.00 0.91 C ATOM 509 OD1 ASP A 27 -16.749 -10.836 5.995 1.00 1.24 O ATOM 510 OD2 ASP A 27 -17.155 -9.176 7.371 1.00 1.48 O ATOM 0 H ASP A 27 -14.653 -8.071 5.320 1.00 0.43 H new ATOM 0 HA ASP A 27 -16.054 -9.971 3.684 1.00 0.44 H new ATOM 0 HB2 ASP A 27 -17.023 -7.661 5.397 1.00 0.50 H new ATOM 0 HB3 ASP A 27 -18.081 -8.793 4.578 1.00 0.50 H new ATOM 515 N ALA A 28 -15.945 -6.763 2.882 1.00 0.37 N ATOM 516 CA ALA A 28 -16.143 -5.803 1.807 1.00 0.33 C ATOM 517 C ALA A 28 -15.453 -6.258 0.530 1.00 0.32 C ATOM 518 O ALA A 28 -16.066 -6.289 -0.535 1.00 0.31 O ATOM 519 CB ALA A 28 -15.629 -4.433 2.225 1.00 0.33 C ATOM 0 H ALA A 28 -15.508 -6.372 3.717 1.00 0.37 H new ATOM 0 HA ALA A 28 -17.212 -5.735 1.606 1.00 0.33 H new ATOM 0 HB1 ALA A 28 -15.783 -3.723 1.412 1.00 0.33 H new ATOM 0 HB2 ALA A 28 -16.170 -4.095 3.109 1.00 0.33 H new ATOM 0 HB3 ALA A 28 -14.565 -4.498 2.454 1.00 0.33 H new ATOM 525 N CYS A 29 -14.182 -6.624 0.657 1.00 0.35 N ATOM 526 CA CYS A 29 -13.379 -7.052 -0.482 1.00 0.37 C ATOM 527 C CYS A 29 -14.010 -8.234 -1.220 1.00 0.38 C ATOM 528 O CYS A 29 -13.899 -8.333 -2.440 1.00 0.40 O ATOM 529 CB CYS A 29 -11.963 -7.415 -0.031 1.00 0.45 C ATOM 530 SG CYS A 29 -10.877 -7.958 -1.372 1.00 1.37 S ATOM 0 H CYS A 29 -13.682 -6.632 1.546 1.00 0.35 H new ATOM 0 HA CYS A 29 -13.335 -6.213 -1.177 1.00 0.37 H new ATOM 0 HB2 CYS A 29 -11.515 -6.549 0.457 1.00 0.45 H new ATOM 0 HB3 CYS A 29 -12.023 -8.206 0.717 1.00 0.45 H new ATOM 0 HG CYS A 29 -9.702 -8.240 -0.892 1.00 1.37 H new ATOM 536 N ARG A 30 -14.688 -9.116 -0.495 1.00 0.40 N ATOM 537 CA ARG A 30 -15.250 -10.309 -1.122 1.00 0.44 C ATOM 538 C ARG A 30 -16.473 -9.944 -1.960 1.00 0.42 C ATOM 539 O ARG A 30 -16.691 -10.505 -3.034 1.00 0.45 O ATOM 540 CB ARG A 30 -15.600 -11.380 -0.076 1.00 0.49 C ATOM 541 CG ARG A 30 -16.925 -11.168 0.639 1.00 0.53 C ATOM 542 CD ARG A 30 -17.134 -12.200 1.733 1.00 0.71 C ATOM 543 NE ARG A 30 -18.428 -12.042 2.386 1.00 1.12 N ATOM 544 CZ ARG A 30 -18.749 -12.597 3.550 1.00 1.68 C ATOM 545 NH1 ARG A 30 -17.882 -13.388 4.170 1.00 1.94 N ATOM 546 NH2 ARG A 30 -19.937 -12.367 4.091 1.00 2.41 N ATOM 0 H ARG A 30 -14.860 -9.033 0.507 1.00 0.40 H new ATOM 0 HA ARG A 30 -14.493 -10.732 -1.782 1.00 0.44 H new ATOM 0 HB2 ARG A 30 -15.620 -12.353 -0.567 1.00 0.49 H new ATOM 0 HB3 ARG A 30 -14.804 -11.414 0.668 1.00 0.49 H new ATOM 0 HG2 ARG A 30 -16.952 -10.167 1.070 1.00 0.53 H new ATOM 0 HG3 ARG A 30 -17.742 -11.227 -0.080 1.00 0.53 H new ATOM 0 HD2 ARG A 30 -17.061 -13.201 1.307 1.00 0.71 H new ATOM 0 HD3 ARG A 30 -16.340 -12.110 2.474 1.00 0.71 H new ATOM 0 HE ARG A 30 -19.131 -11.469 1.920 1.00 1.12 H new ATOM 0 HH11 ARG A 30 -16.969 -13.570 3.753 1.00 1.94 H new ATOM 0 HH12 ARG A 30 -18.129 -13.814 5.063 1.00 1.94 H new ATOM 0 HH21 ARG A 30 -20.606 -11.763 3.614 1.00 2.41 H new ATOM 0 HH22 ARG A 30 -20.182 -12.794 4.984 1.00 2.41 H new ATOM 560 N MET A 31 -17.249 -8.980 -1.477 1.00 0.39 N ATOM 561 CA MET A 31 -18.462 -8.558 -2.156 1.00 0.40 C ATOM 562 C MET A 31 -18.155 -7.639 -3.328 1.00 0.38 C ATOM 563 O MET A 31 -18.676 -7.832 -4.414 1.00 0.44 O ATOM 564 CB MET A 31 -19.385 -7.850 -1.176 1.00 0.39 C ATOM 565 CG MET A 31 -19.746 -8.705 0.021 1.00 0.43 C ATOM 566 SD MET A 31 -20.789 -7.837 1.198 1.00 0.45 S ATOM 567 CE MET A 31 -19.674 -6.525 1.670 1.00 0.39 C ATOM 0 H MET A 31 -17.055 -8.475 -0.612 1.00 0.39 H new ATOM 0 HA MET A 31 -18.954 -9.449 -2.546 1.00 0.40 H new ATOM 0 HB2 MET A 31 -18.905 -6.935 -0.830 1.00 0.39 H new ATOM 0 HB3 MET A 31 -20.298 -7.555 -1.693 1.00 0.39 H new ATOM 0 HG2 MET A 31 -20.259 -9.604 -0.320 1.00 0.43 H new ATOM 0 HG3 MET A 31 -18.833 -9.030 0.520 1.00 0.43 H new ATOM 0 HE1 MET A 31 -20.204 -5.803 2.291 1.00 0.39 H new ATOM 0 HE2 MET A 31 -18.838 -6.942 2.231 1.00 0.39 H new ATOM 0 HE3 MET A 31 -19.298 -6.027 0.776 1.00 0.39 H new ATOM 577 N ILE A 32 -17.315 -6.638 -3.104 1.00 0.34 N ATOM 578 CA ILE A 32 -16.957 -5.683 -4.153 1.00 0.33 C ATOM 579 C ILE A 32 -16.386 -6.392 -5.386 1.00 0.36 C ATOM 580 O ILE A 32 -16.758 -6.075 -6.513 1.00 0.40 O ATOM 581 CB ILE A 32 -15.962 -4.616 -3.641 1.00 0.30 C ATOM 582 CG1 ILE A 32 -15.664 -3.599 -4.738 1.00 0.40 C ATOM 583 CG2 ILE A 32 -14.672 -5.251 -3.140 1.00 0.30 C ATOM 584 CD1 ILE A 32 -14.703 -2.522 -4.307 1.00 0.48 C ATOM 0 H ILE A 32 -16.866 -6.463 -2.205 1.00 0.34 H new ATOM 0 HA ILE A 32 -17.877 -5.176 -4.444 1.00 0.33 H new ATOM 0 HB ILE A 32 -16.427 -4.102 -2.800 1.00 0.30 H new ATOM 0 HG12 ILE A 32 -15.252 -4.118 -5.603 1.00 0.40 H new ATOM 0 HG13 ILE A 32 -16.598 -3.136 -5.058 1.00 0.40 H new ATOM 0 HG21 ILE A 32 -13.996 -4.472 -2.788 1.00 0.30 H new ATOM 0 HG22 ILE A 32 -14.897 -5.934 -2.321 1.00 0.30 H new ATOM 0 HG23 ILE A 32 -14.198 -5.802 -3.952 1.00 0.30 H new ATOM 0 HD11 ILE A 32 -14.535 -1.832 -5.134 1.00 0.48 H new ATOM 0 HD12 ILE A 32 -15.122 -1.978 -3.460 1.00 0.48 H new ATOM 0 HD13 ILE A 32 -13.756 -2.975 -4.014 1.00 0.48 H new ATOM 596 N ARG A 33 -15.499 -7.356 -5.161 1.00 0.36 N ATOM 597 CA ARG A 33 -14.965 -8.184 -6.243 1.00 0.41 C ATOM 598 C ARG A 33 -16.083 -8.941 -6.958 1.00 0.45 C ATOM 599 O ARG A 33 -15.986 -9.250 -8.143 1.00 0.49 O ATOM 600 CB ARG A 33 -13.927 -9.167 -5.706 1.00 0.45 C ATOM 601 CG ARG A 33 -12.596 -8.519 -5.352 1.00 1.01 C ATOM 602 CD ARG A 33 -11.577 -9.550 -4.894 1.00 0.94 C ATOM 603 NE ARG A 33 -11.934 -10.148 -3.606 1.00 0.64 N ATOM 604 CZ ARG A 33 -12.252 -11.433 -3.436 1.00 0.84 C ATOM 605 NH1 ARG A 33 -12.313 -12.251 -4.481 1.00 1.32 N ATOM 606 NH2 ARG A 33 -12.520 -11.896 -2.219 1.00 1.22 N ATOM 0 H ARG A 33 -15.132 -7.585 -4.237 1.00 0.36 H new ATOM 0 HA ARG A 33 -14.483 -7.522 -6.963 1.00 0.41 H new ATOM 0 HB2 ARG A 33 -14.329 -9.658 -4.820 1.00 0.45 H new ATOM 0 HB3 ARG A 33 -13.756 -9.944 -6.451 1.00 0.45 H new ATOM 0 HG2 ARG A 33 -12.209 -7.984 -6.219 1.00 1.01 H new ATOM 0 HG3 ARG A 33 -12.748 -7.781 -4.564 1.00 1.01 H new ATOM 0 HD2 ARG A 33 -11.494 -10.335 -5.646 1.00 0.94 H new ATOM 0 HD3 ARG A 33 -10.597 -9.079 -4.815 1.00 0.94 H new ATOM 0 HE ARG A 33 -11.940 -9.543 -2.785 1.00 0.64 H new ATOM 0 HH11 ARG A 33 -12.116 -11.898 -5.417 1.00 1.32 H new ATOM 0 HH12 ARG A 33 -12.556 -13.232 -4.347 1.00 1.32 H new ATOM 0 HH21 ARG A 33 -12.483 -11.269 -1.415 1.00 1.22 H new ATOM 0 HH22 ARG A 33 -12.763 -12.878 -2.089 1.00 1.22 H new ATOM 620 N GLU A 34 -17.137 -9.235 -6.221 1.00 0.46 N ATOM 621 CA GLU A 34 -18.280 -9.944 -6.771 1.00 0.51 C ATOM 622 C GLU A 34 -19.114 -9.001 -7.640 1.00 0.50 C ATOM 623 O GLU A 34 -19.537 -9.357 -8.741 1.00 0.54 O ATOM 624 CB GLU A 34 -19.136 -10.534 -5.648 1.00 0.55 C ATOM 625 CG GLU A 34 -20.254 -11.436 -6.140 1.00 0.90 C ATOM 626 CD GLU A 34 -19.735 -12.629 -6.909 1.00 1.51 C ATOM 627 OE1 GLU A 34 -19.219 -13.574 -6.279 1.00 1.50 O ATOM 628 OE2 GLU A 34 -19.851 -12.635 -8.152 1.00 2.40 O ATOM 0 H GLU A 34 -17.227 -8.993 -5.234 1.00 0.46 H new ATOM 0 HA GLU A 34 -17.917 -10.764 -7.391 1.00 0.51 H new ATOM 0 HB2 GLU A 34 -18.494 -11.101 -4.974 1.00 0.55 H new ATOM 0 HB3 GLU A 34 -19.568 -9.719 -5.067 1.00 0.55 H new ATOM 0 HG2 GLU A 34 -20.839 -11.783 -5.288 1.00 0.90 H new ATOM 0 HG3 GLU A 34 -20.927 -10.862 -6.776 1.00 0.90 H new ATOM 635 N ARG A 35 -19.331 -7.790 -7.137 1.00 0.51 N ATOM 636 CA ARG A 35 -20.192 -6.818 -7.804 1.00 0.55 C ATOM 637 C ARG A 35 -19.480 -6.176 -8.987 1.00 0.49 C ATOM 638 O ARG A 35 -19.983 -6.179 -10.111 1.00 0.54 O ATOM 639 CB ARG A 35 -20.581 -5.702 -6.832 1.00 0.72 C ATOM 640 CG ARG A 35 -20.834 -6.159 -5.408 1.00 0.77 C ATOM 641 CD ARG A 35 -22.187 -6.814 -5.236 1.00 0.79 C ATOM 642 NE ARG A 35 -23.271 -5.899 -5.582 1.00 1.02 N ATOM 643 CZ ARG A 35 -24.562 -6.225 -5.606 1.00 1.46 C ATOM 644 NH1 ARG A 35 -24.955 -7.462 -5.327 1.00 1.79 N ATOM 645 NH2 ARG A 35 -25.462 -5.301 -5.919 1.00 1.90 N ATOM 0 H ARG A 35 -18.920 -7.457 -6.265 1.00 0.51 H new ATOM 0 HA ARG A 35 -21.076 -7.352 -8.151 1.00 0.55 H new ATOM 0 HB2 ARG A 35 -19.788 -4.954 -6.823 1.00 0.72 H new ATOM 0 HB3 ARG A 35 -21.479 -5.210 -7.206 1.00 0.72 H new ATOM 0 HG2 ARG A 35 -20.055 -6.862 -5.112 1.00 0.77 H new ATOM 0 HG3 ARG A 35 -20.762 -5.302 -4.738 1.00 0.77 H new ATOM 0 HD2 ARG A 35 -22.245 -7.703 -5.864 1.00 0.79 H new ATOM 0 HD3 ARG A 35 -22.304 -7.145 -4.204 1.00 0.79 H new ATOM 0 HE ARG A 35 -23.021 -4.940 -5.823 1.00 1.02 H new ATOM 0 HH11 ARG A 35 -24.265 -8.175 -5.091 1.00 1.79 H new ATOM 0 HH12 ARG A 35 -25.947 -7.699 -5.349 1.00 1.79 H new ATOM 0 HH21 ARG A 35 -25.162 -4.351 -6.138 1.00 1.90 H new ATOM 0 HH22 ARG A 35 -26.453 -5.541 -5.940 1.00 1.90 H new ATOM 659 N ILE A 36 -18.301 -5.638 -8.717 1.00 0.45 N ATOM 660 CA ILE A 36 -17.573 -4.844 -9.694 1.00 0.43 C ATOM 661 C ILE A 36 -16.438 -5.651 -10.317 1.00 0.45 C ATOM 662 O ILE A 36 -15.454 -5.968 -9.649 1.00 0.44 O ATOM 663 CB ILE A 36 -16.994 -3.564 -9.043 1.00 0.43 C ATOM 664 CG1 ILE A 36 -18.065 -2.859 -8.207 1.00 0.43 C ATOM 665 CG2 ILE A 36 -16.457 -2.619 -10.109 1.00 0.44 C ATOM 666 CD1 ILE A 36 -17.554 -1.642 -7.466 1.00 0.44 C ATOM 0 H ILE A 36 -17.824 -5.738 -7.821 1.00 0.45 H new ATOM 0 HA ILE A 36 -18.278 -4.560 -10.475 1.00 0.43 H new ATOM 0 HB ILE A 36 -16.172 -3.854 -8.388 1.00 0.43 H new ATOM 0 HG12 ILE A 36 -18.884 -2.558 -8.860 1.00 0.43 H new ATOM 0 HG13 ILE A 36 -18.475 -3.567 -7.487 1.00 0.43 H new ATOM 0 HG21 ILE A 36 -16.054 -1.725 -9.633 1.00 0.44 H new ATOM 0 HG22 ILE A 36 -15.668 -3.117 -10.673 1.00 0.44 H new ATOM 0 HG23 ILE A 36 -17.264 -2.338 -10.786 1.00 0.44 H new ATOM 0 HD11 ILE A 36 -18.368 -1.195 -6.896 1.00 0.44 H new ATOM 0 HD12 ILE A 36 -16.755 -1.939 -6.786 1.00 0.44 H new ATOM 0 HD13 ILE A 36 -17.170 -0.915 -8.182 1.00 0.44 H new ATOM 678 N PRO A 37 -16.552 -5.984 -11.609 1.00 0.53 N ATOM 679 CA PRO A 37 -15.512 -6.723 -12.335 1.00 0.60 C ATOM 680 C PRO A 37 -14.252 -5.882 -12.538 1.00 0.61 C ATOM 681 O PRO A 37 -13.222 -6.382 -12.983 1.00 0.71 O ATOM 682 CB PRO A 37 -16.164 -7.050 -13.686 1.00 0.73 C ATOM 683 CG PRO A 37 -17.619 -6.768 -13.508 1.00 0.76 C ATOM 684 CD PRO A 37 -17.704 -5.688 -12.471 1.00 0.60 C ATOM 0 HA PRO A 37 -15.187 -7.609 -11.789 1.00 0.60 H new ATOM 0 HB2 PRO A 37 -15.741 -6.439 -14.483 1.00 0.73 H new ATOM 0 HB3 PRO A 37 -15.997 -8.092 -13.960 1.00 0.73 H new ATOM 0 HG2 PRO A 37 -18.072 -6.446 -14.446 1.00 0.76 H new ATOM 0 HG3 PRO A 37 -18.154 -7.662 -13.186 1.00 0.76 H new ATOM 0 HD2 PRO A 37 -17.635 -4.694 -12.913 1.00 0.60 H new ATOM 0 HD3 PRO A 37 -18.644 -5.727 -11.920 1.00 0.60 H new ATOM 692 N GLU A 38 -14.347 -4.602 -12.200 1.00 0.57 N ATOM 693 CA GLU A 38 -13.222 -3.685 -12.325 1.00 0.61 C ATOM 694 C GLU A 38 -12.312 -3.763 -11.107 1.00 0.54 C ATOM 695 O GLU A 38 -11.209 -3.214 -11.114 1.00 0.62 O ATOM 696 CB GLU A 38 -13.723 -2.251 -12.492 1.00 0.75 C ATOM 697 CG GLU A 38 -14.455 -2.013 -13.797 1.00 0.99 C ATOM 698 CD GLU A 38 -13.593 -2.335 -14.995 1.00 1.67 C ATOM 699 OE1 GLU A 38 -12.612 -1.605 -15.239 1.00 2.46 O ATOM 700 OE2 GLU A 38 -13.903 -3.311 -15.707 1.00 2.04 O ATOM 0 H GLU A 38 -15.198 -4.174 -11.835 1.00 0.57 H new ATOM 0 HA GLU A 38 -12.652 -3.978 -13.207 1.00 0.61 H new ATOM 0 HB2 GLU A 38 -14.387 -2.008 -11.663 1.00 0.75 H new ATOM 0 HB3 GLU A 38 -12.875 -1.569 -12.431 1.00 0.75 H new ATOM 0 HG2 GLU A 38 -15.357 -2.625 -13.824 1.00 0.99 H new ATOM 0 HG3 GLU A 38 -14.774 -0.972 -13.849 1.00 0.99 H new ATOM 707 N ALA A 39 -12.780 -4.439 -10.066 1.00 0.47 N ATOM 708 CA ALA A 39 -12.046 -4.513 -8.813 1.00 0.47 C ATOM 709 C ALA A 39 -10.833 -5.426 -8.930 1.00 0.49 C ATOM 710 O ALA A 39 -9.733 -5.071 -8.513 1.00 0.55 O ATOM 711 CB ALA A 39 -12.963 -4.986 -7.693 1.00 0.47 C ATOM 0 H ALA A 39 -13.666 -4.944 -10.066 1.00 0.47 H new ATOM 0 HA ALA A 39 -11.685 -3.512 -8.576 1.00 0.47 H new ATOM 0 HB1 ALA A 39 -12.401 -5.037 -6.760 1.00 0.47 H new ATOM 0 HB2 ALA A 39 -13.791 -4.286 -7.580 1.00 0.47 H new ATOM 0 HB3 ALA A 39 -13.354 -5.974 -7.936 1.00 0.47 H new ATOM 717 N LEU A 40 -11.029 -6.594 -9.518 1.00 0.50 N ATOM 718 CA LEU A 40 -9.969 -7.584 -9.584 1.00 0.59 C ATOM 719 C LEU A 40 -9.165 -7.478 -10.876 1.00 0.67 C ATOM 720 O LEU A 40 -9.201 -8.361 -11.729 1.00 0.99 O ATOM 721 CB LEU A 40 -10.493 -9.024 -9.364 1.00 0.65 C ATOM 722 CG LEU A 40 -11.871 -9.401 -9.958 1.00 0.62 C ATOM 723 CD1 LEU A 40 -13.000 -8.786 -9.156 1.00 1.29 C ATOM 724 CD2 LEU A 40 -11.988 -8.996 -11.418 1.00 1.19 C ATOM 0 H LEU A 40 -11.906 -6.878 -9.954 1.00 0.50 H new ATOM 0 HA LEU A 40 -9.292 -7.360 -8.760 1.00 0.59 H new ATOM 0 HB2 LEU A 40 -9.754 -9.713 -9.774 1.00 0.65 H new ATOM 0 HB3 LEU A 40 -10.534 -9.203 -8.290 1.00 0.65 H new ATOM 0 HG LEU A 40 -11.952 -10.487 -9.902 1.00 0.62 H new ATOM 0 HD11 LEU A 40 -13.956 -9.069 -9.597 1.00 1.29 H new ATOM 0 HD12 LEU A 40 -12.954 -9.146 -8.128 1.00 1.29 H new ATOM 0 HD13 LEU A 40 -12.903 -7.700 -9.165 1.00 1.29 H new ATOM 0 HD21 LEU A 40 -12.970 -9.279 -11.796 1.00 1.19 H new ATOM 0 HD22 LEU A 40 -11.861 -7.917 -11.508 1.00 1.19 H new ATOM 0 HD23 LEU A 40 -11.216 -9.501 -11.999 1.00 1.19 H new ATOM 736 N ALA A 41 -8.417 -6.395 -11.007 1.00 0.65 N ATOM 737 CA ALA A 41 -7.521 -6.218 -12.142 1.00 0.74 C ATOM 738 C ALA A 41 -6.240 -7.033 -11.940 1.00 0.81 C ATOM 739 O ALA A 41 -5.187 -6.728 -12.502 1.00 1.15 O ATOM 740 CB ALA A 41 -7.200 -4.744 -12.326 1.00 0.92 C ATOM 0 H ALA A 41 -8.411 -5.623 -10.341 1.00 0.65 H new ATOM 0 HA ALA A 41 -8.015 -6.579 -13.044 1.00 0.74 H new ATOM 0 HB1 ALA A 41 -6.530 -4.621 -13.177 1.00 0.92 H new ATOM 0 HB2 ALA A 41 -8.122 -4.191 -12.507 1.00 0.92 H new ATOM 0 HB3 ALA A 41 -6.718 -4.361 -11.426 1.00 0.92 H new ATOM 746 N GLY A 42 -6.362 -8.079 -11.138 1.00 0.75 N ATOM 747 CA GLY A 42 -5.246 -8.924 -10.788 1.00 0.86 C ATOM 748 C GLY A 42 -5.569 -9.728 -9.547 1.00 0.80 C ATOM 749 O GLY A 42 -6.747 -9.864 -9.201 1.00 0.82 O ATOM 0 H GLY A 42 -7.245 -8.362 -10.713 1.00 0.75 H new ATOM 0 HA2 GLY A 42 -5.015 -9.595 -11.615 1.00 0.86 H new ATOM 0 HA3 GLY A 42 -4.359 -8.315 -10.615 1.00 0.86 H new ATOM 753 N PRO A 43 -4.560 -10.276 -8.857 1.00 0.83 N ATOM 754 CA PRO A 43 -4.762 -11.021 -7.609 1.00 0.82 C ATOM 755 C PRO A 43 -5.529 -10.223 -6.561 1.00 0.72 C ATOM 756 O PRO A 43 -5.220 -9.061 -6.304 1.00 0.66 O ATOM 757 CB PRO A 43 -3.337 -11.274 -7.116 1.00 0.94 C ATOM 758 CG PRO A 43 -2.511 -11.270 -8.353 1.00 1.09 C ATOM 759 CD PRO A 43 -3.136 -10.232 -9.244 1.00 0.98 C ATOM 0 HA PRO A 43 -5.352 -11.922 -7.775 1.00 0.82 H new ATOM 0 HB2 PRO A 43 -3.014 -10.500 -6.420 1.00 0.94 H new ATOM 0 HB3 PRO A 43 -3.261 -12.226 -6.591 1.00 0.94 H new ATOM 0 HG2 PRO A 43 -1.472 -11.024 -8.132 1.00 1.09 H new ATOM 0 HG3 PRO A 43 -2.512 -12.250 -8.830 1.00 1.09 H new ATOM 0 HD2 PRO A 43 -2.703 -9.245 -9.079 1.00 0.98 H new ATOM 0 HD3 PRO A 43 -2.997 -10.469 -10.299 1.00 0.98 H new ATOM 767 N PRO A 44 -6.545 -10.836 -5.939 1.00 0.76 N ATOM 768 CA PRO A 44 -7.263 -10.240 -4.808 1.00 0.73 C ATOM 769 C PRO A 44 -6.324 -9.856 -3.663 1.00 0.69 C ATOM 770 O PRO A 44 -6.597 -8.924 -2.911 1.00 0.74 O ATOM 771 CB PRO A 44 -8.225 -11.352 -4.359 1.00 0.93 C ATOM 772 CG PRO A 44 -7.722 -12.592 -5.019 1.00 0.99 C ATOM 773 CD PRO A 44 -7.105 -12.142 -6.306 1.00 0.89 C ATOM 0 HA PRO A 44 -7.766 -9.315 -5.091 1.00 0.73 H new ATOM 0 HB2 PRO A 44 -8.228 -11.456 -3.274 1.00 0.93 H new ATOM 0 HB3 PRO A 44 -9.249 -11.133 -4.661 1.00 0.93 H new ATOM 0 HG2 PRO A 44 -6.991 -13.101 -4.391 1.00 0.99 H new ATOM 0 HG3 PRO A 44 -8.534 -13.297 -5.199 1.00 0.99 H new ATOM 0 HD2 PRO A 44 -6.336 -12.832 -6.652 1.00 0.89 H new ATOM 0 HD3 PRO A 44 -7.842 -12.059 -7.104 1.00 0.89 H new ATOM 781 N ASN A 45 -5.207 -10.572 -3.545 1.00 0.72 N ATOM 782 CA ASN A 45 -4.220 -10.296 -2.500 1.00 0.77 C ATOM 783 C ASN A 45 -3.397 -9.058 -2.850 1.00 0.71 C ATOM 784 O ASN A 45 -2.666 -8.523 -2.016 1.00 0.85 O ATOM 785 CB ASN A 45 -3.294 -11.506 -2.291 1.00 0.87 C ATOM 786 CG ASN A 45 -2.170 -11.600 -3.308 1.00 1.41 C ATOM 787 OD1 ASN A 45 -2.382 -12.393 -4.343 1.00 2.21 O flip ATOM 788 ND2 ASN A 45 -1.107 -11.000 -3.145 1.00 1.37 N flip ATOM 0 H ASN A 45 -4.962 -11.348 -4.160 1.00 0.72 H new ATOM 0 HA ASN A 45 -4.757 -10.106 -1.571 1.00 0.77 H new ATOM 0 HB2 ASN A 45 -2.863 -11.454 -1.291 1.00 0.87 H new ATOM 0 HB3 ASN A 45 -3.888 -12.419 -2.335 1.00 0.87 H new ATOM 0 HD21 ASN A 45 -0.982 -10.396 -2.332 1.00 1.37 H new ATOM 0 HD22 ASN A 45 -0.352 -11.107 -3.823 1.00 1.37 H new ATOM 795 N ASP A 46 -3.541 -8.607 -4.086 1.00 0.61 N ATOM 796 CA ASP A 46 -2.789 -7.468 -4.596 1.00 0.68 C ATOM 797 C ASP A 46 -3.625 -6.193 -4.497 1.00 0.57 C ATOM 798 O ASP A 46 -3.106 -5.086 -4.600 1.00 0.61 O ATOM 799 CB ASP A 46 -2.369 -7.759 -6.048 1.00 0.83 C ATOM 800 CG ASP A 46 -1.698 -6.600 -6.763 1.00 1.22 C ATOM 801 OD1 ASP A 46 -2.423 -5.727 -7.293 1.00 1.90 O ATOM 802 OD2 ASP A 46 -0.455 -6.521 -6.746 1.00 1.38 O ATOM 0 H ASP A 46 -4.182 -9.019 -4.765 1.00 0.61 H new ATOM 0 HA ASP A 46 -1.892 -7.313 -3.996 1.00 0.68 H new ATOM 0 HB2 ASP A 46 -1.689 -8.611 -6.051 1.00 0.83 H new ATOM 0 HB3 ASP A 46 -3.252 -8.054 -6.614 1.00 0.83 H new ATOM 807 N PHE A 47 -4.921 -6.356 -4.236 1.00 0.53 N ATOM 808 CA PHE A 47 -5.840 -5.223 -4.172 1.00 0.47 C ATOM 809 C PHE A 47 -6.562 -5.157 -2.825 1.00 0.44 C ATOM 810 O PHE A 47 -6.987 -6.176 -2.284 1.00 0.48 O ATOM 811 CB PHE A 47 -6.863 -5.301 -5.307 1.00 0.49 C ATOM 812 CG PHE A 47 -6.279 -5.075 -6.671 1.00 0.51 C ATOM 813 CD1 PHE A 47 -6.003 -3.797 -7.121 1.00 0.78 C ATOM 814 CD2 PHE A 47 -6.007 -6.148 -7.504 1.00 0.79 C ATOM 815 CE1 PHE A 47 -5.467 -3.591 -8.377 1.00 0.80 C ATOM 816 CE2 PHE A 47 -5.469 -5.949 -8.761 1.00 0.85 C ATOM 817 CZ PHE A 47 -5.194 -4.648 -9.192 1.00 0.63 C ATOM 0 H PHE A 47 -5.357 -7.262 -4.066 1.00 0.53 H new ATOM 0 HA PHE A 47 -5.247 -4.315 -4.282 1.00 0.47 H new ATOM 0 HB2 PHE A 47 -7.341 -6.280 -5.285 1.00 0.49 H new ATOM 0 HB3 PHE A 47 -7.644 -4.561 -5.130 1.00 0.49 H new ATOM 0 HD1 PHE A 47 -6.209 -2.950 -6.483 1.00 0.78 H new ATOM 0 HD2 PHE A 47 -6.218 -7.152 -7.167 1.00 0.79 H new ATOM 0 HE1 PHE A 47 -5.263 -2.586 -8.715 1.00 0.80 H new ATOM 0 HE2 PHE A 47 -5.263 -6.791 -9.405 1.00 0.85 H new ATOM 0 HZ PHE A 47 -4.766 -4.481 -10.169 1.00 0.63 H new ATOM 827 N GLY A 48 -6.693 -3.946 -2.297 1.00 0.42 N ATOM 828 CA GLY A 48 -7.352 -3.750 -1.019 1.00 0.41 C ATOM 829 C GLY A 48 -8.088 -2.427 -0.930 1.00 0.35 C ATOM 830 O GLY A 48 -8.336 -1.777 -1.947 1.00 0.34 O ATOM 0 H GLY A 48 -6.352 -3.090 -2.735 1.00 0.42 H new ATOM 0 HA2 GLY A 48 -8.057 -4.564 -0.851 1.00 0.41 H new ATOM 0 HA3 GLY A 48 -6.610 -3.801 -0.222 1.00 0.41 H new ATOM 834 N LEU A 49 -8.416 -2.018 0.291 1.00 0.31 N ATOM 835 CA LEU A 49 -9.252 -0.843 0.504 1.00 0.28 C ATOM 836 C LEU A 49 -8.440 0.351 0.998 1.00 0.29 C ATOM 837 O LEU A 49 -7.936 0.358 2.115 1.00 0.31 O ATOM 838 CB LEU A 49 -10.366 -1.158 1.506 1.00 0.26 C ATOM 839 CG LEU A 49 -11.278 -2.329 1.130 1.00 0.26 C ATOM 840 CD1 LEU A 49 -12.370 -2.508 2.171 1.00 0.27 C ATOM 841 CD2 LEU A 49 -11.885 -2.114 -0.247 1.00 0.25 C ATOM 0 H LEU A 49 -8.116 -2.483 1.148 1.00 0.31 H new ATOM 0 HA LEU A 49 -9.689 -0.578 -0.459 1.00 0.28 H new ATOM 0 HB2 LEU A 49 -9.911 -1.370 2.474 1.00 0.26 H new ATOM 0 HB3 LEU A 49 -10.981 -0.267 1.631 1.00 0.26 H new ATOM 0 HG LEU A 49 -10.676 -3.237 1.101 1.00 0.26 H new ATOM 0 HD11 LEU A 49 -13.009 -3.344 1.888 1.00 0.27 H new ATOM 0 HD12 LEU A 49 -11.918 -2.709 3.142 1.00 0.27 H new ATOM 0 HD13 LEU A 49 -12.968 -1.599 2.231 1.00 0.27 H new ATOM 0 HD21 LEU A 49 -12.530 -2.957 -0.496 1.00 0.25 H new ATOM 0 HD22 LEU A 49 -12.472 -1.196 -0.246 1.00 0.25 H new ATOM 0 HD23 LEU A 49 -11.089 -2.035 -0.987 1.00 0.25 H new ATOM 853 N PHE A 50 -8.299 1.337 0.137 1.00 0.29 N ATOM 854 CA PHE A 50 -7.691 2.604 0.512 1.00 0.30 C ATOM 855 C PHE A 50 -8.775 3.651 0.729 1.00 0.30 C ATOM 856 O PHE A 50 -9.652 3.834 -0.110 1.00 0.31 O ATOM 857 CB PHE A 50 -6.704 3.066 -0.560 1.00 0.34 C ATOM 858 CG PHE A 50 -5.957 4.323 -0.209 1.00 0.34 C ATOM 859 CD1 PHE A 50 -4.783 4.271 0.535 1.00 0.37 C ATOM 860 CD2 PHE A 50 -6.426 5.561 -0.624 1.00 0.36 C ATOM 861 CE1 PHE A 50 -4.101 5.425 0.854 1.00 0.38 C ATOM 862 CE2 PHE A 50 -5.744 6.718 -0.305 1.00 0.38 C ATOM 863 CZ PHE A 50 -4.580 6.650 0.435 1.00 0.37 C ATOM 0 H PHE A 50 -8.599 1.288 -0.837 1.00 0.29 H new ATOM 0 HA PHE A 50 -7.139 2.469 1.442 1.00 0.30 H new ATOM 0 HB2 PHE A 50 -5.984 2.268 -0.743 1.00 0.34 H new ATOM 0 HB3 PHE A 50 -7.246 3.227 -1.492 1.00 0.34 H new ATOM 0 HD1 PHE A 50 -4.402 3.316 0.866 1.00 0.37 H new ATOM 0 HD2 PHE A 50 -7.335 5.620 -1.203 1.00 0.36 H new ATOM 0 HE1 PHE A 50 -3.191 5.371 1.433 1.00 0.38 H new ATOM 0 HE2 PHE A 50 -6.120 7.675 -0.634 1.00 0.38 H new ATOM 0 HZ PHE A 50 -4.045 7.554 0.686 1.00 0.37 H new ATOM 873 N LEU A 51 -8.715 4.340 1.849 1.00 0.30 N ATOM 874 CA LEU A 51 -9.732 5.322 2.178 1.00 0.32 C ATOM 875 C LEU A 51 -9.290 6.696 1.696 1.00 0.36 C ATOM 876 O LEU A 51 -8.269 7.226 2.147 1.00 0.38 O ATOM 877 CB LEU A 51 -9.996 5.324 3.692 1.00 0.33 C ATOM 878 CG LEU A 51 -11.329 5.943 4.146 1.00 0.35 C ATOM 879 CD1 LEU A 51 -11.288 7.462 4.090 1.00 0.46 C ATOM 880 CD2 LEU A 51 -12.475 5.414 3.296 1.00 0.41 C ATOM 0 H LEU A 51 -7.977 4.241 2.546 1.00 0.30 H new ATOM 0 HA LEU A 51 -10.664 5.063 1.676 1.00 0.32 H new ATOM 0 HB2 LEU A 51 -9.957 4.295 4.048 1.00 0.33 H new ATOM 0 HB3 LEU A 51 -9.184 5.862 4.181 1.00 0.33 H new ATOM 0 HG LEU A 51 -11.493 5.653 5.184 1.00 0.35 H new ATOM 0 HD11 LEU A 51 -12.247 7.864 4.418 1.00 0.46 H new ATOM 0 HD12 LEU A 51 -10.498 7.829 4.745 1.00 0.46 H new ATOM 0 HD13 LEU A 51 -11.090 7.783 3.067 1.00 0.46 H new ATOM 0 HD21 LEU A 51 -13.412 5.861 3.629 1.00 0.41 H new ATOM 0 HD22 LEU A 51 -12.302 5.671 2.251 1.00 0.41 H new ATOM 0 HD23 LEU A 51 -12.534 4.330 3.398 1.00 0.41 H new ATOM 892 N SER A 52 -10.050 7.254 0.764 1.00 0.42 N ATOM 893 CA SER A 52 -9.753 8.567 0.219 1.00 0.53 C ATOM 894 C SER A 52 -10.209 9.656 1.187 1.00 0.61 C ATOM 895 O SER A 52 -11.295 10.224 1.044 1.00 0.93 O ATOM 896 CB SER A 52 -10.433 8.735 -1.140 1.00 0.67 C ATOM 897 OG SER A 52 -10.140 7.637 -1.991 1.00 1.28 O ATOM 0 H SER A 52 -10.881 6.813 0.369 1.00 0.42 H new ATOM 0 HA SER A 52 -8.676 8.659 0.082 1.00 0.53 H new ATOM 0 HB2 SER A 52 -11.511 8.818 -1.004 1.00 0.67 H new ATOM 0 HB3 SER A 52 -10.099 9.662 -1.607 1.00 0.67 H new ATOM 0 HG SER A 52 -10.586 7.764 -2.854 1.00 1.28 H new ATOM 903 N ASP A 53 -9.381 9.908 2.190 1.00 0.74 N ATOM 904 CA ASP A 53 -9.690 10.882 3.229 1.00 0.90 C ATOM 905 C ASP A 53 -9.770 12.287 2.648 1.00 1.04 C ATOM 906 O ASP A 53 -10.802 12.956 2.746 1.00 1.28 O ATOM 907 CB ASP A 53 -8.618 10.836 4.322 1.00 0.89 C ATOM 908 CG ASP A 53 -8.891 11.801 5.460 1.00 1.18 C ATOM 909 OD1 ASP A 53 -8.435 12.961 5.383 1.00 1.24 O ATOM 910 OD2 ASP A 53 -9.583 11.411 6.423 1.00 1.42 O ATOM 0 H ASP A 53 -8.479 9.446 2.307 1.00 0.74 H new ATOM 0 HA ASP A 53 -10.659 10.629 3.659 1.00 0.90 H new ATOM 0 HB2 ASP A 53 -8.555 9.823 4.719 1.00 0.89 H new ATOM 0 HB3 ASP A 53 -7.648 11.067 3.882 1.00 0.89 H new ATOM 915 N ASP A 54 -8.687 12.706 2.010 1.00 0.93 N ATOM 916 CA ASP A 54 -8.560 14.071 1.509 1.00 1.10 C ATOM 917 C ASP A 54 -7.269 14.215 0.724 1.00 1.02 C ATOM 918 O ASP A 54 -7.275 14.496 -0.473 1.00 1.22 O ATOM 919 CB ASP A 54 -8.575 15.066 2.677 1.00 1.26 C ATOM 920 CG ASP A 54 -8.196 16.472 2.260 1.00 1.47 C ATOM 921 OD1 ASP A 54 -9.046 17.169 1.666 1.00 1.73 O ATOM 922 OD2 ASP A 54 -7.045 16.884 2.511 1.00 1.45 O ATOM 0 H ASP A 54 -7.876 12.116 1.825 1.00 0.93 H new ATOM 0 HA ASP A 54 -9.403 14.286 0.852 1.00 1.10 H new ATOM 0 HB2 ASP A 54 -9.570 15.080 3.122 1.00 1.26 H new ATOM 0 HB3 ASP A 54 -7.885 14.723 3.448 1.00 1.26 H new ATOM 927 N ASP A 55 -6.168 13.995 1.412 1.00 0.87 N ATOM 928 CA ASP A 55 -4.845 14.062 0.815 1.00 0.94 C ATOM 929 C ASP A 55 -4.153 12.721 1.016 1.00 0.87 C ATOM 930 O ASP A 55 -4.410 12.056 2.015 1.00 0.71 O ATOM 931 CB ASP A 55 -4.043 15.192 1.474 1.00 0.99 C ATOM 932 CG ASP A 55 -2.674 15.391 0.859 1.00 1.39 C ATOM 933 OD1 ASP A 55 -1.709 14.750 1.322 1.00 1.79 O ATOM 934 OD2 ASP A 55 -2.554 16.182 -0.098 1.00 1.58 O ATOM 0 H ASP A 55 -6.163 13.764 2.405 1.00 0.87 H new ATOM 0 HA ASP A 55 -4.918 14.271 -0.252 1.00 0.94 H new ATOM 0 HB2 ASP A 55 -4.607 16.121 1.397 1.00 0.99 H new ATOM 0 HB3 ASP A 55 -3.929 14.976 2.536 1.00 0.99 H new ATOM 939 N PRO A 56 -3.312 12.278 0.063 1.00 1.06 N ATOM 940 CA PRO A 56 -2.551 11.024 0.174 1.00 1.08 C ATOM 941 C PRO A 56 -1.869 10.837 1.535 1.00 0.98 C ATOM 942 O PRO A 56 -1.704 9.708 1.999 1.00 0.97 O ATOM 943 CB PRO A 56 -1.495 11.130 -0.939 1.00 1.35 C ATOM 944 CG PRO A 56 -1.662 12.488 -1.545 1.00 1.48 C ATOM 945 CD PRO A 56 -3.059 12.929 -1.223 1.00 1.33 C ATOM 0 HA PRO A 56 -3.212 10.163 0.079 1.00 1.08 H new ATOM 0 HB2 PRO A 56 -0.490 11.005 -0.535 1.00 1.35 H new ATOM 0 HB3 PRO A 56 -1.638 10.350 -1.687 1.00 1.35 H new ATOM 0 HG2 PRO A 56 -0.931 13.187 -1.138 1.00 1.48 H new ATOM 0 HG3 PRO A 56 -1.505 12.454 -2.623 1.00 1.48 H new ATOM 0 HD2 PRO A 56 -3.135 14.014 -1.150 1.00 1.33 H new ATOM 0 HD3 PRO A 56 -3.770 12.611 -1.985 1.00 1.33 H new ATOM 953 N LYS A 57 -1.479 11.939 2.174 1.00 0.99 N ATOM 954 CA LYS A 57 -0.852 11.873 3.494 1.00 1.02 C ATOM 955 C LYS A 57 -1.877 11.500 4.564 1.00 0.82 C ATOM 956 O LYS A 57 -1.564 10.801 5.530 1.00 0.87 O ATOM 957 CB LYS A 57 -0.203 13.214 3.842 1.00 1.25 C ATOM 958 CG LYS A 57 0.856 13.643 2.861 1.00 1.51 C ATOM 959 CD LYS A 57 2.054 12.730 2.933 1.00 1.62 C ATOM 960 CE LYS A 57 2.958 12.957 1.753 1.00 2.08 C ATOM 961 NZ LYS A 57 3.604 14.296 1.775 1.00 2.93 N ATOM 0 H LYS A 57 -1.585 12.883 1.802 1.00 0.99 H new ATOM 0 HA LYS A 57 -0.083 11.101 3.465 1.00 1.02 H new ATOM 0 HB2 LYS A 57 -0.976 13.981 3.888 1.00 1.25 H new ATOM 0 HB3 LYS A 57 0.240 13.147 4.836 1.00 1.25 H new ATOM 0 HG2 LYS A 57 0.447 13.635 1.851 1.00 1.51 H new ATOM 0 HG3 LYS A 57 1.161 14.668 3.073 1.00 1.51 H new ATOM 0 HD2 LYS A 57 2.601 12.910 3.858 1.00 1.62 H new ATOM 0 HD3 LYS A 57 1.726 11.691 2.954 1.00 1.62 H new ATOM 0 HE2 LYS A 57 3.729 12.186 1.737 1.00 2.08 H new ATOM 0 HE3 LYS A 57 2.382 12.851 0.834 1.00 2.08 H new ATOM 0 HZ1 LYS A 57 4.216 14.400 0.940 1.00 2.93 H new ATOM 0 HZ2 LYS A 57 2.872 15.035 1.762 1.00 2.93 H new ATOM 0 HZ3 LYS A 57 4.177 14.391 2.638 1.00 2.93 H new ATOM 975 N LYS A 58 -3.104 11.962 4.373 1.00 0.69 N ATOM 976 CA LYS A 58 -4.188 11.695 5.306 1.00 0.65 C ATOM 977 C LYS A 58 -4.855 10.365 4.981 1.00 0.56 C ATOM 978 O LYS A 58 -5.505 9.759 5.837 1.00 0.63 O ATOM 979 CB LYS A 58 -5.224 12.810 5.230 1.00 0.73 C ATOM 980 CG LYS A 58 -4.654 14.198 5.452 1.00 0.94 C ATOM 981 CD LYS A 58 -5.680 15.261 5.116 1.00 1.24 C ATOM 982 CE LYS A 58 -5.130 16.663 5.303 1.00 1.55 C ATOM 983 NZ LYS A 58 -6.143 17.697 4.964 1.00 2.16 N ATOM 0 H LYS A 58 -3.375 12.530 3.570 1.00 0.69 H new ATOM 0 HA LYS A 58 -3.773 11.648 6.313 1.00 0.65 H new ATOM 0 HB2 LYS A 58 -5.706 12.778 4.253 1.00 0.73 H new ATOM 0 HB3 LYS A 58 -5.999 12.623 5.974 1.00 0.73 H new ATOM 0 HG2 LYS A 58 -4.339 14.305 6.490 1.00 0.94 H new ATOM 0 HG3 LYS A 58 -3.766 14.335 4.834 1.00 0.94 H new ATOM 0 HD2 LYS A 58 -6.008 15.135 4.084 1.00 1.24 H new ATOM 0 HD3 LYS A 58 -6.558 15.129 5.748 1.00 1.24 H new ATOM 0 HE2 LYS A 58 -4.808 16.793 6.336 1.00 1.55 H new ATOM 0 HE3 LYS A 58 -4.249 16.796 4.675 1.00 1.55 H new ATOM 0 HZ1 LYS A 58 -5.686 18.630 4.922 1.00 2.16 H new ATOM 0 HZ2 LYS A 58 -6.568 17.477 4.040 1.00 2.16 H new ATOM 0 HZ3 LYS A 58 -6.885 17.708 5.692 1.00 2.16 H new ATOM 997 N GLY A 59 -4.698 9.933 3.735 1.00 0.54 N ATOM 998 CA GLY A 59 -5.268 8.674 3.294 1.00 0.59 C ATOM 999 C GLY A 59 -4.709 7.495 4.057 1.00 0.54 C ATOM 1000 O GLY A 59 -3.576 7.540 4.541 1.00 0.58 O ATOM 0 H GLY A 59 -4.181 10.438 3.016 1.00 0.54 H new ATOM 0 HA2 GLY A 59 -6.351 8.704 3.418 1.00 0.59 H new ATOM 0 HA3 GLY A 59 -5.072 8.542 2.230 1.00 0.59 H new ATOM 1004 N ILE A 60 -5.485 6.429 4.153 1.00 0.49 N ATOM 1005 CA ILE A 60 -5.101 5.281 4.960 1.00 0.47 C ATOM 1006 C ILE A 60 -5.465 3.981 4.264 1.00 0.42 C ATOM 1007 O ILE A 60 -6.362 3.947 3.417 1.00 0.41 O ATOM 1008 CB ILE A 60 -5.775 5.301 6.351 1.00 0.51 C ATOM 1009 CG1 ILE A 60 -7.289 5.493 6.209 1.00 0.55 C ATOM 1010 CG2 ILE A 60 -5.168 6.387 7.229 1.00 0.60 C ATOM 1011 CD1 ILE A 60 -8.039 5.436 7.522 1.00 0.65 C ATOM 0 H ILE A 60 -6.385 6.333 3.683 1.00 0.49 H new ATOM 0 HA ILE A 60 -4.021 5.343 5.090 1.00 0.47 H new ATOM 0 HB ILE A 60 -5.597 4.341 6.835 1.00 0.51 H new ATOM 0 HG12 ILE A 60 -7.481 6.455 5.734 1.00 0.55 H new ATOM 0 HG13 ILE A 60 -7.682 4.725 5.543 1.00 0.55 H new ATOM 0 HG21 ILE A 60 -5.657 6.383 8.203 1.00 0.60 H new ATOM 0 HG22 ILE A 60 -4.102 6.198 7.357 1.00 0.60 H new ATOM 0 HG23 ILE A 60 -5.309 7.359 6.756 1.00 0.60 H new ATOM 0 HD11 ILE A 60 -9.104 5.580 7.339 1.00 0.65 H new ATOM 0 HD12 ILE A 60 -7.879 4.465 7.990 1.00 0.65 H new ATOM 0 HD13 ILE A 60 -7.675 6.222 8.184 1.00 0.65 H new ATOM 1023 N TRP A 61 -4.762 2.922 4.626 1.00 0.42 N ATOM 1024 CA TRP A 61 -5.075 1.595 4.139 1.00 0.40 C ATOM 1025 C TRP A 61 -5.980 0.892 5.130 1.00 0.40 C ATOM 1026 O TRP A 61 -5.651 0.772 6.312 1.00 0.48 O ATOM 1027 CB TRP A 61 -3.806 0.769 3.920 1.00 0.44 C ATOM 1028 CG TRP A 61 -3.040 1.167 2.699 1.00 0.43 C ATOM 1029 CD1 TRP A 61 -1.857 1.839 2.652 1.00 0.48 C ATOM 1030 CD2 TRP A 61 -3.404 0.907 1.343 1.00 0.41 C ATOM 1031 NE1 TRP A 61 -1.474 2.030 1.352 1.00 0.49 N ATOM 1032 CE2 TRP A 61 -2.405 1.462 0.527 1.00 0.45 C ATOM 1033 CE3 TRP A 61 -4.483 0.258 0.742 1.00 0.41 C ATOM 1034 CZ2 TRP A 61 -2.451 1.389 -0.859 1.00 0.48 C ATOM 1035 CZ3 TRP A 61 -4.529 0.185 -0.634 1.00 0.45 C ATOM 1036 CH2 TRP A 61 -3.519 0.748 -1.421 1.00 0.48 C ATOM 0 H TRP A 61 -3.965 2.959 5.261 1.00 0.42 H new ATOM 0 HA TRP A 61 -5.583 1.694 3.180 1.00 0.40 H new ATOM 0 HB2 TRP A 61 -3.161 0.870 4.793 1.00 0.44 H new ATOM 0 HB3 TRP A 61 -4.076 -0.284 3.843 1.00 0.44 H new ATOM 0 HD1 TRP A 61 -1.301 2.173 3.516 1.00 0.48 H new ATOM 0 HE1 TRP A 61 -0.631 2.517 1.048 1.00 0.49 H new ATOM 0 HE3 TRP A 61 -5.267 -0.179 1.343 1.00 0.41 H new ATOM 0 HZ2 TRP A 61 -1.672 1.822 -1.469 1.00 0.48 H new ATOM 0 HZ3 TRP A 61 -5.358 -0.315 -1.112 1.00 0.45 H new ATOM 0 HH2 TRP A 61 -3.585 0.674 -2.496 1.00 0.48 H new ATOM 1047 N LEU A 62 -7.123 0.453 4.650 1.00 0.36 N ATOM 1048 CA LEU A 62 -8.083 -0.237 5.479 1.00 0.37 C ATOM 1049 C LEU A 62 -7.709 -1.707 5.577 1.00 0.42 C ATOM 1050 O LEU A 62 -7.845 -2.456 4.609 1.00 0.43 O ATOM 1051 CB LEU A 62 -9.490 -0.080 4.896 1.00 0.33 C ATOM 1052 CG LEU A 62 -9.944 1.365 4.675 1.00 0.31 C ATOM 1053 CD1 LEU A 62 -11.324 1.400 4.046 1.00 0.29 C ATOM 1054 CD2 LEU A 62 -9.948 2.126 5.986 1.00 0.35 C ATOM 0 H LEU A 62 -7.411 0.564 3.678 1.00 0.36 H new ATOM 0 HA LEU A 62 -8.074 0.197 6.479 1.00 0.37 H new ATOM 0 HB2 LEU A 62 -9.533 -0.608 3.943 1.00 0.33 H new ATOM 0 HB3 LEU A 62 -10.200 -0.569 5.563 1.00 0.33 H new ATOM 0 HG LEU A 62 -9.240 1.844 3.995 1.00 0.31 H new ATOM 0 HD11 LEU A 62 -11.630 2.436 3.897 1.00 0.29 H new ATOM 0 HD12 LEU A 62 -11.299 0.887 3.085 1.00 0.29 H new ATOM 0 HD13 LEU A 62 -12.037 0.903 4.704 1.00 0.29 H new ATOM 0 HD21 LEU A 62 -10.273 3.151 5.810 1.00 0.35 H new ATOM 0 HD22 LEU A 62 -10.631 1.643 6.685 1.00 0.35 H new ATOM 0 HD23 LEU A 62 -8.942 2.131 6.407 1.00 0.35 H new ATOM 1066 N GLU A 63 -7.218 -2.111 6.738 1.00 0.48 N ATOM 1067 CA GLU A 63 -6.794 -3.485 6.948 1.00 0.55 C ATOM 1068 C GLU A 63 -7.984 -4.370 7.299 1.00 0.52 C ATOM 1069 O GLU A 63 -9.009 -3.889 7.786 1.00 0.48 O ATOM 1070 CB GLU A 63 -5.746 -3.551 8.063 1.00 0.65 C ATOM 1071 CG GLU A 63 -6.224 -2.973 9.385 1.00 0.68 C ATOM 1072 CD GLU A 63 -5.168 -3.045 10.465 1.00 1.07 C ATOM 1073 OE1 GLU A 63 -4.265 -2.182 10.477 1.00 1.30 O ATOM 1074 OE2 GLU A 63 -5.231 -3.967 11.307 1.00 1.42 O ATOM 0 H GLU A 63 -7.103 -1.505 7.550 1.00 0.48 H new ATOM 0 HA GLU A 63 -6.352 -3.851 6.021 1.00 0.55 H new ATOM 0 HB2 GLU A 63 -5.455 -4.590 8.215 1.00 0.65 H new ATOM 0 HB3 GLU A 63 -4.853 -3.013 7.743 1.00 0.65 H new ATOM 0 HG2 GLU A 63 -6.518 -1.934 9.238 1.00 0.68 H new ATOM 0 HG3 GLU A 63 -7.112 -3.513 9.714 1.00 0.68 H new ATOM 1081 N ALA A 64 -7.839 -5.665 7.064 1.00 0.58 N ATOM 1082 CA ALA A 64 -8.891 -6.628 7.363 1.00 0.58 C ATOM 1083 C ALA A 64 -9.119 -6.748 8.868 1.00 0.60 C ATOM 1084 O ALA A 64 -10.111 -7.323 9.311 1.00 0.65 O ATOM 1085 CB ALA A 64 -8.548 -7.984 6.767 1.00 0.64 C ATOM 0 H ALA A 64 -6.996 -6.077 6.664 1.00 0.58 H new ATOM 0 HA ALA A 64 -9.816 -6.269 6.913 1.00 0.58 H new ATOM 0 HB1 ALA A 64 -9.342 -8.694 6.998 1.00 0.64 H new ATOM 0 HB2 ALA A 64 -8.447 -7.891 5.686 1.00 0.64 H new ATOM 0 HB3 ALA A 64 -7.609 -8.340 7.190 1.00 0.64 H new ATOM 1091 N GLY A 65 -8.210 -6.171 9.643 1.00 0.64 N ATOM 1092 CA GLY A 65 -8.287 -6.267 11.087 1.00 0.70 C ATOM 1093 C GLY A 65 -9.212 -5.237 11.712 1.00 0.70 C ATOM 1094 O GLY A 65 -9.148 -5.000 12.919 1.00 0.84 O ATOM 0 H GLY A 65 -7.416 -5.635 9.294 1.00 0.64 H new ATOM 0 HA2 GLY A 65 -8.630 -7.265 11.359 1.00 0.70 H new ATOM 0 HA3 GLY A 65 -7.288 -6.148 11.505 1.00 0.70 H new ATOM 1098 N LYS A 66 -10.068 -4.615 10.904 1.00 0.60 N ATOM 1099 CA LYS A 66 -11.053 -3.680 11.426 1.00 0.61 C ATOM 1100 C LYS A 66 -12.219 -3.527 10.450 1.00 0.54 C ATOM 1101 O LYS A 66 -12.086 -3.790 9.246 1.00 0.47 O ATOM 1102 CB LYS A 66 -10.417 -2.311 11.737 1.00 0.66 C ATOM 1103 CG LYS A 66 -10.661 -1.235 10.687 1.00 0.60 C ATOM 1104 CD LYS A 66 -9.882 -1.478 9.407 1.00 0.56 C ATOM 1105 CE LYS A 66 -10.428 -0.638 8.263 1.00 0.61 C ATOM 1106 NZ LYS A 66 -11.821 -1.013 7.920 1.00 1.29 N ATOM 0 H LYS A 66 -10.097 -4.742 9.892 1.00 0.60 H new ATOM 0 HA LYS A 66 -11.437 -4.087 12.362 1.00 0.61 H new ATOM 0 HB2 LYS A 66 -10.801 -1.958 12.694 1.00 0.66 H new ATOM 0 HB3 LYS A 66 -9.342 -2.445 11.855 1.00 0.66 H new ATOM 0 HG2 LYS A 66 -11.726 -1.192 10.457 1.00 0.60 H new ATOM 0 HG3 LYS A 66 -10.384 -0.264 11.097 1.00 0.60 H new ATOM 0 HD2 LYS A 66 -8.831 -1.239 9.567 1.00 0.56 H new ATOM 0 HD3 LYS A 66 -9.932 -2.534 9.142 1.00 0.56 H new ATOM 0 HE2 LYS A 66 -10.393 0.416 8.537 1.00 0.61 H new ATOM 0 HE3 LYS A 66 -9.792 -0.761 7.386 1.00 0.61 H new ATOM 0 HZ1 LYS A 66 -11.999 -0.807 6.916 1.00 1.29 H new ATOM 0 HZ2 LYS A 66 -11.960 -2.029 8.095 1.00 1.29 H new ATOM 0 HZ3 LYS A 66 -12.482 -0.466 8.508 1.00 1.29 H new ATOM 1120 N ALA A 67 -13.354 -3.096 10.968 1.00 0.57 N ATOM 1121 CA ALA A 67 -14.540 -2.893 10.158 1.00 0.52 C ATOM 1122 C ALA A 67 -14.513 -1.507 9.529 1.00 0.47 C ATOM 1123 O ALA A 67 -13.656 -0.685 9.862 1.00 0.47 O ATOM 1124 CB ALA A 67 -15.786 -3.093 11.004 1.00 0.59 C ATOM 0 H ALA A 67 -13.479 -2.878 11.956 1.00 0.57 H new ATOM 0 HA ALA A 67 -14.558 -3.627 9.352 1.00 0.52 H new ATOM 0 HB1 ALA A 67 -16.672 -2.939 10.389 1.00 0.59 H new ATOM 0 HB2 ALA A 67 -15.795 -4.106 11.405 1.00 0.59 H new ATOM 0 HB3 ALA A 67 -15.786 -2.377 11.826 1.00 0.59 H new ATOM 1130 N LEU A 68 -15.413 -1.251 8.599 1.00 0.45 N ATOM 1131 CA LEU A 68 -15.424 0.023 7.891 1.00 0.40 C ATOM 1132 C LEU A 68 -15.883 1.161 8.801 1.00 0.43 C ATOM 1133 O LEU A 68 -15.166 2.144 8.992 1.00 0.44 O ATOM 1134 CB LEU A 68 -16.325 -0.062 6.667 1.00 0.37 C ATOM 1135 CG LEU A 68 -15.927 -1.123 5.642 1.00 0.36 C ATOM 1136 CD1 LEU A 68 -16.930 -1.167 4.502 1.00 0.36 C ATOM 1137 CD2 LEU A 68 -14.529 -0.851 5.115 1.00 0.37 C ATOM 0 H LEU A 68 -16.145 -1.902 8.314 1.00 0.45 H new ATOM 0 HA LEU A 68 -14.404 0.236 7.571 1.00 0.40 H new ATOM 0 HB2 LEU A 68 -17.344 -0.263 6.998 1.00 0.37 H new ATOM 0 HB3 LEU A 68 -16.336 0.910 6.175 1.00 0.37 H new ATOM 0 HG LEU A 68 -15.927 -2.096 6.134 1.00 0.36 H new ATOM 0 HD11 LEU A 68 -16.630 -1.928 3.782 1.00 0.36 H new ATOM 0 HD12 LEU A 68 -17.917 -1.409 4.895 1.00 0.36 H new ATOM 0 HD13 LEU A 68 -16.964 -0.195 4.009 1.00 0.36 H new ATOM 0 HD21 LEU A 68 -14.260 -1.615 4.386 1.00 0.37 H new ATOM 0 HD22 LEU A 68 -14.504 0.129 4.639 1.00 0.37 H new ATOM 0 HD23 LEU A 68 -13.818 -0.872 5.941 1.00 0.37 H new ATOM 1149 N ASP A 69 -17.060 0.991 9.390 1.00 0.47 N ATOM 1150 CA ASP A 69 -17.678 2.021 10.235 1.00 0.52 C ATOM 1151 C ASP A 69 -16.912 2.186 11.544 1.00 0.58 C ATOM 1152 O ASP A 69 -17.151 3.117 12.312 1.00 0.65 O ATOM 1153 CB ASP A 69 -19.148 1.662 10.498 1.00 0.58 C ATOM 1154 CG ASP A 69 -19.796 2.482 11.601 1.00 0.86 C ATOM 1155 OD1 ASP A 69 -20.056 3.689 11.393 1.00 1.14 O ATOM 1156 OD2 ASP A 69 -20.064 1.914 12.680 1.00 1.16 O ATOM 0 H ASP A 69 -17.616 0.141 9.300 1.00 0.47 H new ATOM 0 HA ASP A 69 -17.639 2.976 9.711 1.00 0.52 H new ATOM 0 HB2 ASP A 69 -19.715 1.798 9.577 1.00 0.58 H new ATOM 0 HB3 ASP A 69 -19.212 0.606 10.759 1.00 0.58 H new ATOM 1161 N TYR A 70 -15.986 1.273 11.786 1.00 0.59 N ATOM 1162 CA TYR A 70 -15.073 1.386 12.900 1.00 0.65 C ATOM 1163 C TYR A 70 -14.343 2.728 12.847 1.00 0.62 C ATOM 1164 O TYR A 70 -14.125 3.374 13.870 1.00 0.67 O ATOM 1165 CB TYR A 70 -14.081 0.230 12.854 1.00 0.69 C ATOM 1166 CG TYR A 70 -13.018 0.320 13.904 1.00 0.81 C ATOM 1167 CD1 TYR A 70 -13.339 0.184 15.241 1.00 1.02 C ATOM 1168 CD2 TYR A 70 -11.698 0.533 13.557 1.00 0.84 C ATOM 1169 CE1 TYR A 70 -12.368 0.258 16.214 1.00 1.21 C ATOM 1170 CE2 TYR A 70 -10.715 0.606 14.519 1.00 1.05 C ATOM 1171 CZ TYR A 70 -11.050 0.503 15.842 1.00 1.22 C ATOM 1172 OH TYR A 70 -10.076 0.540 16.817 1.00 1.45 O ATOM 0 H TYR A 70 -15.850 0.438 11.216 1.00 0.59 H new ATOM 0 HA TYR A 70 -15.629 1.340 13.836 1.00 0.65 H new ATOM 0 HB2 TYR A 70 -14.622 -0.709 12.974 1.00 0.69 H new ATOM 0 HB3 TYR A 70 -13.610 0.203 11.871 1.00 0.69 H new ATOM 0 HD1 TYR A 70 -14.367 0.017 15.527 1.00 1.02 H new ATOM 0 HD2 TYR A 70 -11.433 0.644 12.516 1.00 0.84 H new ATOM 0 HE1 TYR A 70 -12.626 0.127 17.254 1.00 1.21 H new ATOM 0 HE2 TYR A 70 -9.683 0.744 14.230 1.00 1.05 H new ATOM 0 HH TYR A 70 -9.206 0.720 16.404 1.00 1.45 H new ATOM 1182 N TYR A 71 -13.956 3.127 11.640 1.00 0.57 N ATOM 1183 CA TYR A 71 -13.380 4.444 11.409 1.00 0.58 C ATOM 1184 C TYR A 71 -14.482 5.505 11.319 1.00 0.60 C ATOM 1185 O TYR A 71 -15.429 5.501 12.104 1.00 0.69 O ATOM 1186 CB TYR A 71 -12.522 4.434 10.140 1.00 0.56 C ATOM 1187 CG TYR A 71 -11.144 3.848 10.352 1.00 0.56 C ATOM 1188 CD1 TYR A 71 -10.079 4.655 10.735 1.00 0.58 C ATOM 1189 CD2 TYR A 71 -10.907 2.493 10.171 1.00 0.62 C ATOM 1190 CE1 TYR A 71 -8.816 4.125 10.931 1.00 0.63 C ATOM 1191 CE2 TYR A 71 -9.650 1.960 10.367 1.00 0.66 C ATOM 1192 CZ TYR A 71 -8.609 2.775 10.746 1.00 0.65 C ATOM 1193 OH TYR A 71 -7.358 2.235 10.930 1.00 0.72 O ATOM 0 H TYR A 71 -14.032 2.551 10.802 1.00 0.57 H new ATOM 0 HA TYR A 71 -12.738 4.697 12.252 1.00 0.58 H new ATOM 0 HB2 TYR A 71 -13.036 3.863 9.367 1.00 0.56 H new ATOM 0 HB3 TYR A 71 -12.422 5.454 9.770 1.00 0.56 H new ATOM 0 HD1 TYR A 71 -10.240 5.713 10.882 1.00 0.58 H new ATOM 0 HD2 TYR A 71 -11.719 1.846 9.872 1.00 0.62 H new ATOM 0 HE1 TYR A 71 -7.998 4.765 11.227 1.00 0.63 H new ATOM 0 HE2 TYR A 71 -9.483 0.903 10.223 1.00 0.66 H new ATOM 0 HH TYR A 71 -7.390 1.271 10.759 1.00 0.72 H new ATOM 1203 N MET A 72 -14.351 6.420 10.368 1.00 0.60 N ATOM 1204 CA MET A 72 -15.321 7.500 10.211 1.00 0.69 C ATOM 1205 C MET A 72 -16.152 7.316 8.946 1.00 0.63 C ATOM 1206 O MET A 72 -16.863 8.229 8.530 1.00 0.75 O ATOM 1207 CB MET A 72 -14.602 8.849 10.148 1.00 0.83 C ATOM 1208 CG MET A 72 -13.779 9.170 11.384 1.00 1.02 C ATOM 1209 SD MET A 72 -12.796 10.671 11.188 1.00 1.73 S ATOM 1210 CE MET A 72 -11.789 10.225 9.774 1.00 2.38 C ATOM 0 H MET A 72 -13.585 6.438 9.694 1.00 0.60 H new ATOM 0 HA MET A 72 -15.987 7.476 11.074 1.00 0.69 H new ATOM 0 HB2 MET A 72 -13.948 8.860 9.276 1.00 0.83 H new ATOM 0 HB3 MET A 72 -15.341 9.636 10.002 1.00 0.83 H new ATOM 0 HG2 MET A 72 -14.444 9.284 12.240 1.00 1.02 H new ATOM 0 HG3 MET A 72 -13.117 8.332 11.604 1.00 1.02 H new ATOM 0 HE1 MET A 72 -10.865 10.803 9.789 1.00 2.38 H new ATOM 0 HE2 MET A 72 -11.553 9.162 9.817 1.00 2.38 H new ATOM 0 HE3 MET A 72 -12.336 10.439 8.856 1.00 2.38 H new ATOM 1220 N LEU A 73 -16.073 6.134 8.339 1.00 0.56 N ATOM 1221 CA LEU A 73 -16.721 5.914 7.050 1.00 0.54 C ATOM 1222 C LEU A 73 -18.204 5.700 7.230 1.00 0.50 C ATOM 1223 O LEU A 73 -18.652 5.126 8.225 1.00 0.60 O ATOM 1224 CB LEU A 73 -16.141 4.716 6.287 1.00 0.71 C ATOM 1225 CG LEU A 73 -14.764 4.214 6.728 1.00 0.43 C ATOM 1226 CD1 LEU A 73 -14.337 3.056 5.847 1.00 0.88 C ATOM 1227 CD2 LEU A 73 -13.732 5.325 6.675 1.00 0.88 C ATOM 0 H LEU A 73 -15.575 5.326 8.712 1.00 0.56 H new ATOM 0 HA LEU A 73 -16.534 6.813 6.462 1.00 0.54 H new ATOM 0 HB2 LEU A 73 -16.846 3.889 6.369 1.00 0.71 H new ATOM 0 HB3 LEU A 73 -16.083 4.982 5.232 1.00 0.71 H new ATOM 0 HG LEU A 73 -14.835 3.875 7.762 1.00 0.43 H new ATOM 0 HD11 LEU A 73 -13.356 2.701 6.163 1.00 0.88 H new ATOM 0 HD12 LEU A 73 -15.062 2.246 5.934 1.00 0.88 H new ATOM 0 HD13 LEU A 73 -14.286 3.387 4.810 1.00 0.88 H new ATOM 0 HD21 LEU A 73 -12.764 4.938 6.994 1.00 0.88 H new ATOM 0 HD22 LEU A 73 -13.654 5.701 5.655 1.00 0.88 H new ATOM 0 HD23 LEU A 73 -14.035 6.135 7.338 1.00 0.88 H new ATOM 1239 N ARG A 74 -18.947 6.158 6.246 1.00 0.48 N ATOM 1240 CA ARG A 74 -20.390 6.114 6.271 1.00 0.52 C ATOM 1241 C ARG A 74 -20.935 6.616 4.946 1.00 0.46 C ATOM 1242 O ARG A 74 -20.210 6.678 3.953 1.00 0.45 O ATOM 1243 CB ARG A 74 -20.912 6.952 7.441 1.00 0.65 C ATOM 1244 CG ARG A 74 -20.373 8.356 7.489 1.00 1.17 C ATOM 1245 CD ARG A 74 -20.698 8.987 8.818 1.00 1.64 C ATOM 1246 NE ARG A 74 -19.924 8.384 9.902 1.00 2.05 N ATOM 1247 CZ ARG A 74 -19.461 9.050 10.957 1.00 2.72 C ATOM 1248 NH1 ARG A 74 -19.681 10.353 11.080 1.00 2.96 N ATOM 1249 NH2 ARG A 74 -18.770 8.408 11.889 1.00 3.29 N ATOM 0 H ARG A 74 -18.561 6.575 5.399 1.00 0.48 H new ATOM 0 HA ARG A 74 -20.728 5.088 6.413 1.00 0.52 H new ATOM 0 HB2 ARG A 74 -22.000 6.995 7.384 1.00 0.65 H new ATOM 0 HB3 ARG A 74 -20.661 6.447 8.374 1.00 0.65 H new ATOM 0 HG2 ARG A 74 -19.294 8.346 7.336 1.00 1.17 H new ATOM 0 HG3 ARG A 74 -20.804 8.948 6.681 1.00 1.17 H new ATOM 0 HD2 ARG A 74 -20.492 10.056 8.774 1.00 1.64 H new ATOM 0 HD3 ARG A 74 -21.763 8.875 9.024 1.00 1.64 H new ATOM 0 HE ARG A 74 -19.725 7.385 9.846 1.00 2.05 H new ATOM 0 HH11 ARG A 74 -20.208 10.851 10.363 1.00 2.96 H new ATOM 0 HH12 ARG A 74 -19.323 10.856 11.892 1.00 2.96 H new ATOM 0 HH21 ARG A 74 -18.595 7.407 11.796 1.00 3.29 H new ATOM 0 HH22 ARG A 74 -18.413 8.915 12.699 1.00 3.29 H new ATOM 1263 N ASN A 75 -22.203 6.960 4.935 1.00 0.49 N ATOM 1264 CA ASN A 75 -22.861 7.423 3.723 1.00 0.47 C ATOM 1265 C ASN A 75 -22.295 8.756 3.267 1.00 0.48 C ATOM 1266 O ASN A 75 -22.637 9.810 3.805 1.00 0.56 O ATOM 1267 CB ASN A 75 -24.370 7.528 3.939 1.00 0.52 C ATOM 1268 CG ASN A 75 -25.055 6.186 3.811 1.00 0.52 C ATOM 1269 OD1 ASN A 75 -25.550 5.833 2.748 1.00 0.72 O ATOM 1270 ND2 ASN A 75 -25.075 5.418 4.883 1.00 0.51 N ATOM 0 H ASN A 75 -22.808 6.929 5.756 1.00 0.49 H new ATOM 0 HA ASN A 75 -22.672 6.691 2.938 1.00 0.47 H new ATOM 0 HB2 ASN A 75 -24.567 7.943 4.928 1.00 0.52 H new ATOM 0 HB3 ASN A 75 -24.793 8.222 3.212 1.00 0.52 H new ATOM 0 HD21 ASN A 75 -25.513 4.498 4.843 1.00 0.51 H new ATOM 0 HD22 ASN A 75 -24.653 5.744 5.752 1.00 0.51 H new ATOM 1277 N GLY A 76 -21.409 8.699 2.284 1.00 0.45 N ATOM 1278 CA GLY A 76 -20.820 9.903 1.749 1.00 0.51 C ATOM 1279 C GLY A 76 -19.326 9.786 1.550 1.00 0.47 C ATOM 1280 O GLY A 76 -18.740 10.546 0.776 1.00 0.55 O ATOM 0 H GLY A 76 -21.088 7.835 1.847 1.00 0.45 H new ATOM 0 HA2 GLY A 76 -21.291 10.140 0.795 1.00 0.51 H new ATOM 0 HA3 GLY A 76 -21.028 10.734 2.423 1.00 0.51 H new ATOM 1284 N ASP A 77 -18.703 8.837 2.239 1.00 0.42 N ATOM 1285 CA ASP A 77 -17.259 8.663 2.154 1.00 0.42 C ATOM 1286 C ASP A 77 -16.878 7.900 0.894 1.00 0.38 C ATOM 1287 O ASP A 77 -17.583 6.979 0.473 1.00 0.40 O ATOM 1288 CB ASP A 77 -16.732 7.925 3.388 1.00 0.44 C ATOM 1289 CG ASP A 77 -16.982 8.692 4.669 1.00 0.74 C ATOM 1290 OD1 ASP A 77 -18.118 8.645 5.190 1.00 1.00 O ATOM 1291 OD2 ASP A 77 -16.038 9.335 5.171 1.00 1.05 O ATOM 0 H ASP A 77 -19.173 8.179 2.860 1.00 0.42 H new ATOM 0 HA ASP A 77 -16.805 9.653 2.113 1.00 0.42 H new ATOM 0 HB2 ASP A 77 -17.209 6.947 3.454 1.00 0.44 H new ATOM 0 HB3 ASP A 77 -15.662 7.751 3.275 1.00 0.44 H new ATOM 1296 N THR A 78 -15.775 8.301 0.284 1.00 0.36 N ATOM 1297 CA THR A 78 -15.259 7.619 -0.888 1.00 0.35 C ATOM 1298 C THR A 78 -14.220 6.584 -0.469 1.00 0.31 C ATOM 1299 O THR A 78 -13.324 6.879 0.326 1.00 0.34 O ATOM 1300 CB THR A 78 -14.619 8.616 -1.877 1.00 0.42 C ATOM 1301 OG1 THR A 78 -15.580 9.606 -2.269 1.00 0.50 O ATOM 1302 CG2 THR A 78 -14.096 7.899 -3.113 1.00 0.42 C ATOM 0 H THR A 78 -15.218 9.101 0.585 1.00 0.36 H new ATOM 0 HA THR A 78 -16.094 7.126 -1.386 1.00 0.35 H new ATOM 0 HB THR A 78 -13.781 9.099 -1.374 1.00 0.42 H new ATOM 0 HG1 THR A 78 -15.165 10.235 -2.895 1.00 0.50 H new ATOM 0 HG21 THR A 78 -13.650 8.625 -3.793 1.00 0.42 H new ATOM 0 HG22 THR A 78 -13.343 7.168 -2.818 1.00 0.42 H new ATOM 0 HG23 THR A 78 -14.919 7.390 -3.614 1.00 0.42 H new ATOM 1310 N MET A 79 -14.326 5.379 -1.007 1.00 0.27 N ATOM 1311 CA MET A 79 -13.411 4.318 -0.648 1.00 0.27 C ATOM 1312 C MET A 79 -12.787 3.749 -1.912 1.00 0.28 C ATOM 1313 O MET A 79 -13.464 3.138 -2.736 1.00 0.27 O ATOM 1314 CB MET A 79 -14.131 3.221 0.137 1.00 0.23 C ATOM 1315 CG MET A 79 -13.203 2.416 1.029 1.00 0.27 C ATOM 1316 SD MET A 79 -14.043 1.071 1.886 1.00 0.65 S ATOM 1317 CE MET A 79 -14.497 0.033 0.504 1.00 0.24 C ATOM 0 H MET A 79 -15.035 5.116 -1.691 1.00 0.27 H new ATOM 0 HA MET A 79 -12.627 4.723 -0.008 1.00 0.27 H new ATOM 0 HB2 MET A 79 -14.911 3.674 0.750 1.00 0.23 H new ATOM 0 HB3 MET A 79 -14.626 2.548 -0.563 1.00 0.23 H new ATOM 0 HG2 MET A 79 -12.393 2.006 0.426 1.00 0.27 H new ATOM 0 HG3 MET A 79 -12.748 3.080 1.764 1.00 0.27 H new ATOM 0 HE1 MET A 79 -14.454 -1.014 0.805 1.00 0.24 H new ATOM 0 HE2 MET A 79 -15.510 0.277 0.183 1.00 0.24 H new ATOM 0 HE3 MET A 79 -13.805 0.202 -0.321 1.00 0.24 H new ATOM 1327 N GLU A 80 -11.500 3.976 -2.062 1.00 0.32 N ATOM 1328 CA GLU A 80 -10.789 3.570 -3.256 1.00 0.35 C ATOM 1329 C GLU A 80 -10.397 2.103 -3.143 1.00 0.33 C ATOM 1330 O GLU A 80 -9.753 1.702 -2.173 1.00 0.33 O ATOM 1331 CB GLU A 80 -9.537 4.446 -3.413 1.00 0.40 C ATOM 1332 CG GLU A 80 -8.931 4.435 -4.806 1.00 0.53 C ATOM 1333 CD GLU A 80 -7.873 5.507 -4.995 1.00 0.69 C ATOM 1334 OE1 GLU A 80 -8.234 6.692 -5.135 1.00 1.04 O ATOM 1335 OE2 GLU A 80 -6.670 5.169 -4.985 1.00 1.04 O ATOM 0 H GLU A 80 -10.920 4.444 -1.365 1.00 0.32 H new ATOM 0 HA GLU A 80 -11.427 3.694 -4.131 1.00 0.35 H new ATOM 0 HB2 GLU A 80 -9.792 5.473 -3.150 1.00 0.40 H new ATOM 0 HB3 GLU A 80 -8.783 4.112 -2.700 1.00 0.40 H new ATOM 0 HG2 GLU A 80 -8.489 3.457 -4.998 1.00 0.53 H new ATOM 0 HG3 GLU A 80 -9.722 4.577 -5.543 1.00 0.53 H new ATOM 1342 N TYR A 81 -10.774 1.292 -4.121 1.00 0.33 N ATOM 1343 CA TYR A 81 -10.319 -0.081 -4.155 1.00 0.33 C ATOM 1344 C TYR A 81 -9.117 -0.138 -5.059 1.00 0.36 C ATOM 1345 O TYR A 81 -9.239 -0.113 -6.283 1.00 0.39 O ATOM 1346 CB TYR A 81 -11.407 -1.031 -4.662 1.00 0.33 C ATOM 1347 CG TYR A 81 -11.054 -2.501 -4.514 1.00 0.33 C ATOM 1348 CD1 TYR A 81 -11.370 -3.186 -3.350 1.00 0.34 C ATOM 1349 CD2 TYR A 81 -10.415 -3.204 -5.532 1.00 0.37 C ATOM 1350 CE1 TYR A 81 -11.060 -4.523 -3.197 1.00 0.36 C ATOM 1351 CE2 TYR A 81 -10.104 -4.545 -5.386 1.00 0.39 C ATOM 1352 CZ TYR A 81 -10.428 -5.197 -4.216 1.00 0.38 C ATOM 1353 OH TYR A 81 -10.118 -6.529 -4.063 1.00 0.42 O ATOM 0 H TYR A 81 -11.387 1.561 -4.891 1.00 0.33 H new ATOM 0 HA TYR A 81 -10.067 -0.404 -3.145 1.00 0.33 H new ATOM 0 HB2 TYR A 81 -12.331 -0.832 -4.120 1.00 0.33 H new ATOM 0 HB3 TYR A 81 -11.602 -0.818 -5.713 1.00 0.33 H new ATOM 0 HD1 TYR A 81 -11.869 -2.663 -2.547 1.00 0.34 H new ATOM 0 HD2 TYR A 81 -10.158 -2.695 -6.449 1.00 0.37 H new ATOM 0 HE1 TYR A 81 -11.313 -5.037 -2.281 1.00 0.36 H new ATOM 0 HE2 TYR A 81 -9.610 -5.078 -6.185 1.00 0.39 H new ATOM 0 HH TYR A 81 -10.442 -6.842 -3.193 1.00 0.42 H new ATOM 1363 N ARG A 82 -7.960 -0.184 -4.457 1.00 0.37 N ATOM 1364 CA ARG A 82 -6.742 -0.061 -5.215 1.00 0.39 C ATOM 1365 C ARG A 82 -5.736 -1.112 -4.808 1.00 0.40 C ATOM 1366 O ARG A 82 -5.989 -1.938 -3.931 1.00 0.42 O ATOM 1367 CB ARG A 82 -6.143 1.339 -5.075 1.00 0.42 C ATOM 1368 CG ARG A 82 -5.802 1.720 -3.651 1.00 0.44 C ATOM 1369 CD ARG A 82 -5.095 3.062 -3.592 1.00 0.56 C ATOM 1370 NE ARG A 82 -3.781 3.040 -4.233 1.00 0.65 N ATOM 1371 CZ ARG A 82 -3.209 4.120 -4.769 1.00 0.88 C ATOM 1372 NH1 ARG A 82 -3.910 5.243 -4.885 1.00 1.08 N ATOM 1373 NH2 ARG A 82 -1.964 4.063 -5.229 1.00 1.03 N ATOM 0 H ARG A 82 -7.833 -0.305 -3.452 1.00 0.37 H new ATOM 0 HA ARG A 82 -6.992 -0.220 -6.264 1.00 0.39 H new ATOM 0 HB2 ARG A 82 -5.240 1.400 -5.683 1.00 0.42 H new ATOM 0 HB3 ARG A 82 -6.848 2.067 -5.477 1.00 0.42 H new ATOM 0 HG2 ARG A 82 -6.714 1.761 -3.055 1.00 0.44 H new ATOM 0 HG3 ARG A 82 -5.167 0.952 -3.209 1.00 0.44 H new ATOM 0 HD2 ARG A 82 -5.717 3.816 -4.074 1.00 0.56 H new ATOM 0 HD3 ARG A 82 -4.981 3.362 -2.550 1.00 0.56 H new ATOM 0 HE ARG A 82 -3.276 2.155 -4.272 1.00 0.65 H new ATOM 0 HH11 ARG A 82 -4.878 5.275 -4.565 1.00 1.08 H new ATOM 0 HH12 ARG A 82 -3.480 6.073 -5.294 1.00 1.08 H new ATOM 0 HH21 ARG A 82 -1.439 3.190 -5.174 1.00 1.03 H new ATOM 0 HH22 ARG A 82 -1.533 4.892 -5.638 1.00 1.03 H new ATOM 1387 N LYS A 83 -4.594 -1.049 -5.444 1.00 0.43 N ATOM 1388 CA LYS A 83 -3.539 -2.017 -5.264 1.00 0.45 C ATOM 1389 C LYS A 83 -2.891 -1.868 -3.889 1.00 0.42 C ATOM 1390 O LYS A 83 -2.311 -0.828 -3.588 1.00 0.42 O ATOM 1391 CB LYS A 83 -2.527 -1.785 -6.377 1.00 0.53 C ATOM 1392 CG LYS A 83 -1.456 -2.845 -6.515 1.00 0.60 C ATOM 1393 CD LYS A 83 -0.735 -2.699 -7.842 1.00 0.70 C ATOM 1394 CE LYS A 83 -0.005 -1.368 -7.922 1.00 1.25 C ATOM 1395 NZ LYS A 83 0.089 -0.860 -9.317 1.00 1.74 N ATOM 0 H LYS A 83 -4.366 -0.313 -6.112 1.00 0.43 H new ATOM 0 HA LYS A 83 -3.934 -3.032 -5.313 1.00 0.45 H new ATOM 0 HB2 LYS A 83 -3.064 -1.710 -7.323 1.00 0.53 H new ATOM 0 HB3 LYS A 83 -2.042 -0.823 -6.209 1.00 0.53 H new ATOM 0 HG2 LYS A 83 -0.743 -2.759 -5.695 1.00 0.60 H new ATOM 0 HG3 LYS A 83 -1.905 -3.836 -6.445 1.00 0.60 H new ATOM 0 HD2 LYS A 83 -0.024 -3.516 -7.965 1.00 0.70 H new ATOM 0 HD3 LYS A 83 -1.452 -2.774 -8.660 1.00 0.70 H new ATOM 0 HE2 LYS A 83 -0.523 -0.634 -7.304 1.00 1.25 H new ATOM 0 HE3 LYS A 83 0.998 -1.481 -7.510 1.00 1.25 H new ATOM 0 HZ1 LYS A 83 0.594 0.049 -9.322 1.00 1.74 H new ATOM 0 HZ2 LYS A 83 0.606 -1.547 -9.902 1.00 1.74 H new ATOM 0 HZ3 LYS A 83 -0.867 -0.727 -9.703 1.00 1.74 H new ATOM 1409 N LYS A 84 -3.015 -2.906 -3.059 1.00 0.44 N ATOM 1410 CA LYS A 84 -2.359 -2.940 -1.750 1.00 0.46 C ATOM 1411 C LYS A 84 -0.863 -2.890 -1.935 1.00 0.46 C ATOM 1412 O LYS A 84 -0.139 -2.310 -1.131 1.00 0.52 O ATOM 1413 CB LYS A 84 -2.712 -4.217 -0.986 1.00 0.54 C ATOM 1414 CG LYS A 84 -4.101 -4.226 -0.388 1.00 0.55 C ATOM 1415 CD LYS A 84 -4.231 -3.254 0.772 1.00 0.66 C ATOM 1416 CE LYS A 84 -4.058 -3.956 2.111 1.00 0.67 C ATOM 1417 NZ LYS A 84 -2.683 -4.493 2.298 1.00 1.32 N ATOM 0 H LYS A 84 -3.566 -3.738 -3.272 1.00 0.44 H new ATOM 0 HA LYS A 84 -2.705 -2.079 -1.178 1.00 0.46 H new ATOM 0 HB2 LYS A 84 -2.615 -5.068 -1.661 1.00 0.54 H new ATOM 0 HB3 LYS A 84 -1.985 -4.360 -0.187 1.00 0.54 H new ATOM 0 HG2 LYS A 84 -4.828 -3.970 -1.158 1.00 0.55 H new ATOM 0 HG3 LYS A 84 -4.341 -5.233 -0.045 1.00 0.55 H new ATOM 0 HD2 LYS A 84 -3.484 -2.467 0.674 1.00 0.66 H new ATOM 0 HD3 LYS A 84 -5.208 -2.772 0.736 1.00 0.66 H new ATOM 0 HE2 LYS A 84 -4.284 -3.257 2.916 1.00 0.67 H new ATOM 0 HE3 LYS A 84 -4.777 -4.772 2.186 1.00 0.67 H new ATOM 0 HZ1 LYS A 84 -2.601 -4.917 3.244 1.00 1.32 H new ATOM 0 HZ2 LYS A 84 -2.492 -5.218 1.577 1.00 1.32 H new ATOM 0 HZ3 LYS A 84 -1.993 -3.721 2.204 1.00 1.32 H new ATOM 1431 N GLN A 85 -0.412 -3.518 -3.007 1.00 0.44 N ATOM 1432 CA GLN A 85 0.982 -3.531 -3.381 1.00 0.47 C ATOM 1433 C GLN A 85 1.346 -2.190 -4.001 1.00 0.52 C ATOM 1434 O GLN A 85 0.567 -1.240 -3.946 1.00 0.83 O ATOM 1435 CB GLN A 85 1.225 -4.646 -4.405 1.00 0.53 C ATOM 1436 CG GLN A 85 0.615 -5.980 -4.014 1.00 0.50 C ATOM 1437 CD GLN A 85 1.528 -6.828 -3.162 1.00 0.64 C ATOM 1438 OE1 GLN A 85 2.307 -7.625 -3.679 1.00 1.10 O ATOM 1439 NE2 GLN A 85 1.441 -6.667 -1.855 1.00 0.72 N ATOM 0 H GLN A 85 -1.014 -4.037 -3.646 1.00 0.44 H new ATOM 0 HA GLN A 85 1.596 -3.707 -2.498 1.00 0.47 H new ATOM 0 HB2 GLN A 85 0.816 -4.338 -5.367 1.00 0.53 H new ATOM 0 HB3 GLN A 85 2.299 -4.774 -4.541 1.00 0.53 H new ATOM 0 HG2 GLN A 85 -0.314 -5.802 -3.472 1.00 0.50 H new ATOM 0 HG3 GLN A 85 0.356 -6.532 -4.918 1.00 0.50 H new ATOM 0 HE21 GLN A 85 0.780 -5.994 -1.467 1.00 0.72 H new ATOM 0 HE22 GLN A 85 2.035 -7.216 -1.233 1.00 0.72 H new ATOM 1448 N ARG A 86 2.500 -2.142 -4.643 1.00 0.50 N ATOM 1449 CA ARG A 86 3.005 -0.923 -5.248 1.00 0.52 C ATOM 1450 C ARG A 86 4.375 -1.184 -5.852 1.00 0.50 C ATOM 1451 O ARG A 86 5.205 -1.866 -5.250 1.00 0.53 O ATOM 1452 CB ARG A 86 3.033 0.253 -4.248 1.00 0.67 C ATOM 1453 CG ARG A 86 3.469 -0.093 -2.823 1.00 0.85 C ATOM 1454 CD ARG A 86 4.980 -0.126 -2.666 1.00 0.98 C ATOM 1455 NE ARG A 86 5.619 1.015 -3.319 1.00 1.13 N ATOM 1456 CZ ARG A 86 5.451 2.290 -2.959 1.00 1.24 C ATOM 1457 NH1 ARG A 86 4.719 2.615 -1.898 1.00 1.62 N ATOM 1458 NH2 ARG A 86 6.033 3.251 -3.661 1.00 1.85 N ATOM 0 H ARG A 86 3.114 -2.948 -4.759 1.00 0.50 H new ATOM 0 HA ARG A 86 2.323 -0.625 -6.044 1.00 0.52 H new ATOM 0 HB2 ARG A 86 3.704 1.019 -4.637 1.00 0.67 H new ATOM 0 HB3 ARG A 86 2.037 0.693 -4.206 1.00 0.67 H new ATOM 0 HG2 ARG A 86 3.051 0.639 -2.131 1.00 0.85 H new ATOM 0 HG3 ARG A 86 3.057 -1.064 -2.547 1.00 0.85 H new ATOM 0 HD2 ARG A 86 5.235 -0.128 -1.606 1.00 0.98 H new ATOM 0 HD3 ARG A 86 5.369 -1.052 -3.089 1.00 0.98 H new ATOM 0 HE ARG A 86 6.238 0.824 -4.107 1.00 1.13 H new ATOM 0 HH11 ARG A 86 4.274 1.885 -1.343 1.00 1.62 H new ATOM 0 HH12 ARG A 86 4.603 3.595 -1.639 1.00 1.62 H new ATOM 0 HH21 ARG A 86 6.606 3.015 -4.471 1.00 1.85 H new ATOM 0 HH22 ARG A 86 5.908 4.227 -3.391 1.00 1.85 H new ATOM 1472 N PRO A 87 4.606 -0.689 -7.075 1.00 0.52 N ATOM 1473 CA PRO A 87 5.871 -0.889 -7.776 1.00 0.52 C ATOM 1474 C PRO A 87 7.028 -0.225 -7.045 1.00 0.53 C ATOM 1475 O PRO A 87 7.048 0.990 -6.849 1.00 0.62 O ATOM 1476 CB PRO A 87 5.650 -0.227 -9.143 1.00 0.57 C ATOM 1477 CG PRO A 87 4.172 -0.097 -9.278 1.00 0.86 C ATOM 1478 CD PRO A 87 3.647 0.076 -7.884 1.00 0.60 C ATOM 0 HA PRO A 87 6.133 -1.944 -7.850 1.00 0.52 H new ATOM 0 HB2 PRO A 87 6.137 0.747 -9.193 1.00 0.57 H new ATOM 0 HB3 PRO A 87 6.067 -0.834 -9.947 1.00 0.57 H new ATOM 0 HG2 PRO A 87 3.910 0.757 -9.903 1.00 0.86 H new ATOM 0 HG3 PRO A 87 3.743 -0.981 -9.750 1.00 0.86 H new ATOM 0 HD2 PRO A 87 3.618 1.125 -7.591 1.00 0.60 H new ATOM 0 HD3 PRO A 87 2.633 -0.312 -7.783 1.00 0.60 H new ATOM 1486 N LEU A 88 7.958 -1.042 -6.594 1.00 0.50 N ATOM 1487 CA LEU A 88 9.135 -0.549 -5.914 1.00 0.53 C ATOM 1488 C LEU A 88 10.323 -0.492 -6.859 1.00 0.44 C ATOM 1489 O LEU A 88 10.780 -1.524 -7.352 1.00 0.42 O ATOM 1490 CB LEU A 88 9.454 -1.427 -4.705 1.00 0.63 C ATOM 1491 CG LEU A 88 8.555 -1.196 -3.496 1.00 0.88 C ATOM 1492 CD1 LEU A 88 8.864 -2.208 -2.416 1.00 1.19 C ATOM 1493 CD2 LEU A 88 8.734 0.215 -2.966 1.00 1.51 C ATOM 0 H LEU A 88 7.919 -2.057 -6.688 1.00 0.50 H new ATOM 0 HA LEU A 88 8.931 0.464 -5.567 1.00 0.53 H new ATOM 0 HB2 LEU A 88 9.378 -2.473 -5.002 1.00 0.63 H new ATOM 0 HB3 LEU A 88 10.489 -1.253 -4.410 1.00 0.63 H new ATOM 0 HG LEU A 88 7.517 -1.320 -3.804 1.00 0.88 H new ATOM 0 HD11 LEU A 88 8.216 -2.033 -1.557 1.00 1.19 H new ATOM 0 HD12 LEU A 88 8.694 -3.214 -2.800 1.00 1.19 H new ATOM 0 HD13 LEU A 88 9.906 -2.108 -2.111 1.00 1.19 H new ATOM 0 HD21 LEU A 88 8.085 0.364 -2.103 1.00 1.51 H new ATOM 0 HD22 LEU A 88 9.772 0.363 -2.670 1.00 1.51 H new ATOM 0 HD23 LEU A 88 8.473 0.932 -3.744 1.00 1.51 H new ATOM 1505 N LYS A 89 10.809 0.713 -7.110 1.00 0.44 N ATOM 1506 CA LYS A 89 12.004 0.904 -7.914 1.00 0.42 C ATOM 1507 C LYS A 89 13.220 0.767 -7.014 1.00 0.39 C ATOM 1508 O LYS A 89 13.534 1.674 -6.255 1.00 0.42 O ATOM 1509 CB LYS A 89 12.000 2.284 -8.579 1.00 0.51 C ATOM 1510 CG LYS A 89 10.842 2.512 -9.540 1.00 0.69 C ATOM 1511 CD LYS A 89 10.906 1.583 -10.742 1.00 0.93 C ATOM 1512 CE LYS A 89 12.148 1.829 -11.586 1.00 1.49 C ATOM 1513 NZ LYS A 89 12.197 3.214 -12.122 1.00 2.11 N ATOM 0 H LYS A 89 10.391 1.578 -6.766 1.00 0.44 H new ATOM 0 HA LYS A 89 12.031 0.152 -8.702 1.00 0.42 H new ATOM 0 HB2 LYS A 89 11.969 3.049 -7.803 1.00 0.51 H new ATOM 0 HB3 LYS A 89 12.937 2.417 -9.120 1.00 0.51 H new ATOM 0 HG2 LYS A 89 9.899 2.360 -9.014 1.00 0.69 H new ATOM 0 HG3 LYS A 89 10.853 3.547 -9.881 1.00 0.69 H new ATOM 0 HD2 LYS A 89 10.898 0.548 -10.401 1.00 0.93 H new ATOM 0 HD3 LYS A 89 10.016 1.723 -11.356 1.00 0.93 H new ATOM 0 HE2 LYS A 89 13.037 1.643 -10.984 1.00 1.49 H new ATOM 0 HE3 LYS A 89 12.169 1.120 -12.414 1.00 1.49 H new ATOM 0 HZ1 LYS A 89 12.928 3.275 -12.859 1.00 2.11 H new ATOM 0 HZ2 LYS A 89 11.273 3.461 -12.530 1.00 2.11 H new ATOM 0 HZ3 LYS A 89 12.424 3.876 -11.353 1.00 2.11 H new ATOM 1527 N ILE A 90 13.900 -0.358 -7.104 1.00 0.36 N ATOM 1528 CA ILE A 90 14.966 -0.673 -6.165 1.00 0.33 C ATOM 1529 C ILE A 90 16.271 -0.921 -6.907 1.00 0.35 C ATOM 1530 O ILE A 90 16.296 -1.685 -7.872 1.00 0.36 O ATOM 1531 CB ILE A 90 14.621 -1.927 -5.325 1.00 0.32 C ATOM 1532 CG1 ILE A 90 13.292 -1.744 -4.583 1.00 0.35 C ATOM 1533 CG2 ILE A 90 15.739 -2.238 -4.339 1.00 0.33 C ATOM 1534 CD1 ILE A 90 13.313 -0.637 -3.549 1.00 0.36 C ATOM 0 H ILE A 90 13.737 -1.071 -7.815 1.00 0.36 H new ATOM 0 HA ILE A 90 15.076 0.182 -5.498 1.00 0.33 H new ATOM 0 HB ILE A 90 14.516 -2.769 -6.009 1.00 0.32 H new ATOM 0 HG12 ILE A 90 12.507 -1.534 -5.310 1.00 0.35 H new ATOM 0 HG13 ILE A 90 13.029 -2.681 -4.092 1.00 0.35 H new ATOM 0 HG21 ILE A 90 15.477 -3.123 -3.759 1.00 0.33 H new ATOM 0 HG22 ILE A 90 16.664 -2.423 -4.885 1.00 0.33 H new ATOM 0 HG23 ILE A 90 15.877 -1.391 -3.667 1.00 0.33 H new ATOM 0 HD11 ILE A 90 12.337 -0.570 -3.068 1.00 0.36 H new ATOM 0 HD12 ILE A 90 14.073 -0.854 -2.799 1.00 0.36 H new ATOM 0 HD13 ILE A 90 13.543 0.311 -4.035 1.00 0.36 H new ATOM 1546 N ARG A 91 17.354 -0.285 -6.468 1.00 0.38 N ATOM 1547 CA ARG A 91 18.663 -0.548 -7.036 1.00 0.43 C ATOM 1548 C ARG A 91 19.483 -1.370 -6.045 1.00 0.42 C ATOM 1549 O ARG A 91 19.678 -0.961 -4.897 1.00 0.44 O ATOM 1550 CB ARG A 91 19.394 0.756 -7.365 1.00 0.52 C ATOM 1551 CG ARG A 91 20.684 0.540 -8.141 1.00 0.57 C ATOM 1552 CD ARG A 91 21.447 1.838 -8.348 1.00 0.74 C ATOM 1553 NE ARG A 91 20.786 2.739 -9.294 1.00 0.72 N ATOM 1554 CZ ARG A 91 21.400 3.755 -9.902 1.00 1.09 C ATOM 1555 NH1 ARG A 91 22.686 4.001 -9.665 1.00 1.82 N ATOM 1556 NH2 ARG A 91 20.729 4.522 -10.750 1.00 1.12 N ATOM 0 H ARG A 91 17.346 0.412 -5.724 1.00 0.38 H new ATOM 0 HA ARG A 91 18.536 -1.104 -7.965 1.00 0.43 H new ATOM 0 HB2 ARG A 91 18.732 1.400 -7.945 1.00 0.52 H new ATOM 0 HB3 ARG A 91 19.619 1.283 -6.438 1.00 0.52 H new ATOM 0 HG2 ARG A 91 21.315 -0.170 -7.606 1.00 0.57 H new ATOM 0 HG3 ARG A 91 20.455 0.096 -9.110 1.00 0.57 H new ATOM 0 HD2 ARG A 91 21.561 2.344 -7.389 1.00 0.74 H new ATOM 0 HD3 ARG A 91 22.450 1.611 -8.709 1.00 0.74 H new ATOM 0 HE ARG A 91 19.800 2.581 -9.500 1.00 0.72 H new ATOM 0 HH11 ARG A 91 23.207 3.411 -9.016 1.00 1.82 H new ATOM 0 HH12 ARG A 91 23.151 4.779 -10.133 1.00 1.82 H new ATOM 0 HH21 ARG A 91 19.744 4.335 -10.937 1.00 1.12 H new ATOM 0 HH22 ARG A 91 21.198 5.299 -11.215 1.00 1.12 H new ATOM 1570 N MET A 92 19.946 -2.524 -6.491 1.00 0.42 N ATOM 1571 CA MET A 92 20.682 -3.455 -5.644 1.00 0.44 C ATOM 1572 C MET A 92 22.148 -3.063 -5.543 1.00 0.48 C ATOM 1573 O MET A 92 22.605 -2.180 -6.270 1.00 0.51 O ATOM 1574 CB MET A 92 20.556 -4.866 -6.215 1.00 0.46 C ATOM 1575 CG MET A 92 19.535 -5.737 -5.503 1.00 0.57 C ATOM 1576 SD MET A 92 17.993 -4.885 -5.131 1.00 1.04 S ATOM 1577 CE MET A 92 17.394 -4.551 -6.779 1.00 0.34 C ATOM 0 H MET A 92 19.824 -2.846 -7.451 1.00 0.42 H new ATOM 0 HA MET A 92 20.257 -3.424 -4.641 1.00 0.44 H new ATOM 0 HB2 MET A 92 20.286 -4.797 -7.269 1.00 0.46 H new ATOM 0 HB3 MET A 92 21.530 -5.354 -6.167 1.00 0.46 H new ATOM 0 HG2 MET A 92 19.319 -6.608 -6.122 1.00 0.57 H new ATOM 0 HG3 MET A 92 19.970 -6.106 -4.574 1.00 0.57 H new ATOM 0 HE1 MET A 92 16.304 -4.571 -6.781 1.00 0.34 H new ATOM 0 HE2 MET A 92 17.740 -3.568 -7.100 1.00 0.34 H new ATOM 0 HE3 MET A 92 17.772 -5.310 -7.464 1.00 0.34 H new ATOM 1587 N LEU A 93 22.881 -3.770 -4.677 1.00 0.49 N ATOM 1588 CA LEU A 93 24.248 -3.398 -4.302 1.00 0.55 C ATOM 1589 C LEU A 93 25.157 -3.288 -5.519 1.00 0.61 C ATOM 1590 O LEU A 93 25.974 -2.371 -5.618 1.00 0.69 O ATOM 1591 CB LEU A 93 24.855 -4.417 -3.320 1.00 0.57 C ATOM 1592 CG LEU A 93 24.130 -4.610 -1.977 1.00 0.57 C ATOM 1593 CD1 LEU A 93 23.622 -3.287 -1.429 1.00 0.68 C ATOM 1594 CD2 LEU A 93 22.996 -5.617 -2.102 1.00 0.79 C ATOM 0 H LEU A 93 22.543 -4.615 -4.217 1.00 0.49 H new ATOM 0 HA LEU A 93 24.181 -2.423 -3.820 1.00 0.55 H new ATOM 0 HB2 LEU A 93 24.902 -5.384 -3.821 1.00 0.57 H new ATOM 0 HB3 LEU A 93 25.881 -4.116 -3.111 1.00 0.57 H new ATOM 0 HG LEU A 93 24.855 -5.009 -1.268 1.00 0.57 H new ATOM 0 HD11 LEU A 93 23.115 -3.457 -0.479 1.00 0.68 H new ATOM 0 HD12 LEU A 93 24.462 -2.610 -1.275 1.00 0.68 H new ATOM 0 HD13 LEU A 93 22.924 -2.843 -2.139 1.00 0.68 H new ATOM 0 HD21 LEU A 93 22.503 -5.732 -1.137 1.00 0.79 H new ATOM 0 HD22 LEU A 93 22.274 -5.263 -2.838 1.00 0.79 H new ATOM 0 HD23 LEU A 93 23.397 -6.579 -2.421 1.00 0.79 H new ATOM 1606 N ASP A 94 25.015 -4.228 -6.443 1.00 0.61 N ATOM 1607 CA ASP A 94 25.848 -4.260 -7.642 1.00 0.69 C ATOM 1608 C ASP A 94 25.385 -3.225 -8.664 1.00 0.66 C ATOM 1609 O ASP A 94 25.990 -3.067 -9.727 1.00 0.70 O ATOM 1610 CB ASP A 94 25.850 -5.665 -8.255 1.00 0.76 C ATOM 1611 CG ASP A 94 24.457 -6.187 -8.536 1.00 1.47 C ATOM 1612 OD1 ASP A 94 23.730 -6.505 -7.580 1.00 2.26 O ATOM 1613 OD2 ASP A 94 24.070 -6.262 -9.722 1.00 1.93 O ATOM 0 H ASP A 94 24.330 -4.981 -6.387 1.00 0.61 H new ATOM 0 HA ASP A 94 26.868 -4.007 -7.352 1.00 0.69 H new ATOM 0 HB2 ASP A 94 26.421 -5.650 -9.183 1.00 0.76 H new ATOM 0 HB3 ASP A 94 26.360 -6.351 -7.578 1.00 0.76 H new ATOM 1618 N GLY A 95 24.308 -2.523 -8.338 1.00 0.61 N ATOM 1619 CA GLY A 95 23.858 -1.422 -9.166 1.00 0.61 C ATOM 1620 C GLY A 95 22.710 -1.810 -10.066 1.00 0.58 C ATOM 1621 O GLY A 95 22.333 -1.057 -10.964 1.00 0.64 O ATOM 0 H GLY A 95 23.736 -2.697 -7.512 1.00 0.61 H new ATOM 0 HA2 GLY A 95 23.552 -0.593 -8.528 1.00 0.61 H new ATOM 0 HA3 GLY A 95 24.689 -1.066 -9.775 1.00 0.61 H new ATOM 1625 N THR A 96 22.138 -2.975 -9.820 1.00 0.54 N ATOM 1626 CA THR A 96 21.072 -3.488 -10.669 1.00 0.54 C ATOM 1627 C THR A 96 19.713 -3.056 -10.139 1.00 0.47 C ATOM 1628 O THR A 96 19.420 -3.225 -8.961 1.00 0.47 O ATOM 1629 CB THR A 96 21.137 -5.028 -10.762 1.00 0.62 C ATOM 1630 OG1 THR A 96 22.364 -5.420 -11.389 1.00 0.81 O ATOM 1631 CG2 THR A 96 19.966 -5.590 -11.552 1.00 0.61 C ATOM 0 H THR A 96 22.391 -3.584 -9.042 1.00 0.54 H new ATOM 0 HA THR A 96 21.209 -3.074 -11.668 1.00 0.54 H new ATOM 0 HB THR A 96 21.087 -5.428 -9.749 1.00 0.62 H new ATOM 0 HG1 THR A 96 23.089 -5.398 -10.730 1.00 0.81 H new ATOM 0 HG21 THR A 96 20.045 -6.676 -11.597 1.00 0.61 H new ATOM 0 HG22 THR A 96 19.032 -5.314 -11.063 1.00 0.61 H new ATOM 0 HG23 THR A 96 19.981 -5.183 -12.563 1.00 0.61 H new ATOM 1639 N VAL A 97 18.885 -2.503 -11.009 1.00 0.45 N ATOM 1640 CA VAL A 97 17.601 -1.974 -10.589 1.00 0.41 C ATOM 1641 C VAL A 97 16.457 -2.860 -11.081 1.00 0.38 C ATOM 1642 O VAL A 97 16.403 -3.246 -12.248 1.00 0.41 O ATOM 1643 CB VAL A 97 17.409 -0.509 -11.058 1.00 0.50 C ATOM 1644 CG1 VAL A 97 17.578 -0.387 -12.560 1.00 1.07 C ATOM 1645 CG2 VAL A 97 16.054 0.034 -10.623 1.00 1.11 C ATOM 0 H VAL A 97 19.079 -2.409 -12.006 1.00 0.45 H new ATOM 0 HA VAL A 97 17.586 -1.975 -9.499 1.00 0.41 H new ATOM 0 HB VAL A 97 18.183 0.092 -10.582 1.00 0.50 H new ATOM 0 HG11 VAL A 97 17.438 0.652 -12.859 1.00 1.07 H new ATOM 0 HG12 VAL A 97 18.579 -0.713 -12.841 1.00 1.07 H new ATOM 0 HG13 VAL A 97 16.839 -1.012 -13.061 1.00 1.07 H new ATOM 0 HG21 VAL A 97 15.947 1.063 -10.966 1.00 1.11 H new ATOM 0 HG22 VAL A 97 15.261 -0.577 -11.056 1.00 1.11 H new ATOM 0 HG23 VAL A 97 15.982 0.005 -9.536 1.00 1.11 H new ATOM 1655 N LYS A 98 15.567 -3.195 -10.165 1.00 0.35 N ATOM 1656 CA LYS A 98 14.409 -4.015 -10.491 1.00 0.35 C ATOM 1657 C LYS A 98 13.178 -3.522 -9.749 1.00 0.36 C ATOM 1658 O LYS A 98 13.291 -2.833 -8.735 1.00 0.37 O ATOM 1659 CB LYS A 98 14.649 -5.497 -10.182 1.00 0.38 C ATOM 1660 CG LYS A 98 14.869 -5.801 -8.710 1.00 0.41 C ATOM 1661 CD LYS A 98 14.519 -7.244 -8.393 1.00 0.43 C ATOM 1662 CE LYS A 98 13.027 -7.476 -8.528 1.00 0.43 C ATOM 1663 NZ LYS A 98 12.260 -6.614 -7.604 1.00 0.94 N ATOM 0 H LYS A 98 15.622 -2.912 -9.186 1.00 0.35 H new ATOM 0 HA LYS A 98 14.242 -3.922 -11.564 1.00 0.35 H new ATOM 0 HB2 LYS A 98 13.794 -6.073 -10.536 1.00 0.38 H new ATOM 0 HB3 LYS A 98 15.518 -5.837 -10.745 1.00 0.38 H new ATOM 0 HG2 LYS A 98 15.909 -5.609 -8.447 1.00 0.41 H new ATOM 0 HG3 LYS A 98 14.259 -5.133 -8.102 1.00 0.41 H new ATOM 0 HD2 LYS A 98 15.058 -7.910 -9.066 1.00 0.43 H new ATOM 0 HD3 LYS A 98 14.840 -7.487 -7.380 1.00 0.43 H new ATOM 0 HE2 LYS A 98 12.718 -7.277 -9.554 1.00 0.43 H new ATOM 0 HE3 LYS A 98 12.800 -8.522 -8.324 1.00 0.43 H new ATOM 0 HZ1 LYS A 98 11.246 -6.684 -7.825 1.00 0.94 H new ATOM 0 HZ2 LYS A 98 12.423 -6.924 -6.625 1.00 0.94 H new ATOM 0 HZ3 LYS A 98 12.571 -5.627 -7.711 1.00 0.94 H new ATOM 1677 N THR A 99 12.008 -3.889 -10.244 1.00 0.40 N ATOM 1678 CA THR A 99 10.755 -3.534 -9.607 1.00 0.44 C ATOM 1679 C THR A 99 10.055 -4.789 -9.095 1.00 0.47 C ATOM 1680 O THR A 99 10.055 -5.818 -9.765 1.00 0.58 O ATOM 1681 CB THR A 99 9.826 -2.804 -10.593 1.00 0.48 C ATOM 1682 OG1 THR A 99 10.427 -1.573 -11.018 1.00 0.50 O ATOM 1683 CG2 THR A 99 8.473 -2.530 -9.960 1.00 0.57 C ATOM 0 H THR A 99 11.902 -4.440 -11.096 1.00 0.40 H new ATOM 0 HA THR A 99 10.977 -2.869 -8.772 1.00 0.44 H new ATOM 0 HB THR A 99 9.676 -3.447 -11.460 1.00 0.48 H new ATOM 0 HG1 THR A 99 11.306 -1.475 -10.596 1.00 0.50 H new ATOM 0 HG21 THR A 99 7.834 -2.013 -10.676 1.00 0.57 H new ATOM 0 HG22 THR A 99 8.008 -3.473 -9.673 1.00 0.57 H new ATOM 0 HG23 THR A 99 8.605 -1.907 -9.076 1.00 0.57 H new ATOM 1691 N ILE A 100 9.519 -4.727 -7.884 1.00 0.42 N ATOM 1692 CA ILE A 100 8.744 -5.830 -7.335 1.00 0.44 C ATOM 1693 C ILE A 100 7.497 -5.277 -6.643 1.00 0.45 C ATOM 1694 O ILE A 100 7.519 -4.149 -6.143 1.00 0.45 O ATOM 1695 CB ILE A 100 9.602 -6.682 -6.362 1.00 0.48 C ATOM 1696 CG1 ILE A 100 8.927 -8.029 -6.042 1.00 0.61 C ATOM 1697 CG2 ILE A 100 9.922 -5.906 -5.089 1.00 0.48 C ATOM 1698 CD1 ILE A 100 8.021 -8.024 -4.831 1.00 0.50 C ATOM 0 H ILE A 100 9.607 -3.923 -7.262 1.00 0.42 H new ATOM 0 HA ILE A 100 8.432 -6.489 -8.146 1.00 0.44 H new ATOM 0 HB ILE A 100 10.544 -6.903 -6.863 1.00 0.48 H new ATOM 0 HG12 ILE A 100 8.345 -8.341 -6.910 1.00 0.61 H new ATOM 0 HG13 ILE A 100 9.703 -8.779 -5.892 1.00 0.61 H new ATOM 0 HG21 ILE A 100 10.524 -6.527 -4.426 1.00 0.48 H new ATOM 0 HG22 ILE A 100 10.477 -5.003 -5.343 1.00 0.48 H new ATOM 0 HG23 ILE A 100 8.994 -5.632 -4.587 1.00 0.48 H new ATOM 0 HD11 ILE A 100 7.595 -9.018 -4.691 1.00 0.50 H new ATOM 0 HD12 ILE A 100 8.596 -7.748 -3.947 1.00 0.50 H new ATOM 0 HD13 ILE A 100 7.218 -7.303 -4.981 1.00 0.50 H new ATOM 1710 N MET A 101 6.412 -6.041 -6.646 1.00 0.47 N ATOM 1711 CA MET A 101 5.176 -5.586 -6.025 1.00 0.50 C ATOM 1712 C MET A 101 5.139 -5.987 -4.563 1.00 0.50 C ATOM 1713 O MET A 101 5.065 -7.165 -4.217 1.00 0.52 O ATOM 1714 CB MET A 101 3.970 -6.195 -6.744 1.00 0.56 C ATOM 1715 CG MET A 101 3.962 -5.942 -8.242 1.00 0.64 C ATOM 1716 SD MET A 101 4.029 -4.189 -8.646 1.00 0.98 S ATOM 1717 CE MET A 101 2.568 -3.616 -7.791 1.00 0.59 C ATOM 0 H MET A 101 6.363 -6.969 -7.067 1.00 0.47 H new ATOM 0 HA MET A 101 5.135 -4.499 -6.101 1.00 0.50 H new ATOM 0 HB2 MET A 101 3.956 -7.270 -6.566 1.00 0.56 H new ATOM 0 HB3 MET A 101 3.056 -5.789 -6.311 1.00 0.56 H new ATOM 0 HG2 MET A 101 4.813 -6.449 -8.697 1.00 0.64 H new ATOM 0 HG3 MET A 101 3.062 -6.377 -8.676 1.00 0.64 H new ATOM 0 HE1 MET A 101 2.173 -2.735 -8.296 1.00 0.59 H new ATOM 0 HE2 MET A 101 1.814 -4.403 -7.791 1.00 0.59 H new ATOM 0 HE3 MET A 101 2.825 -3.360 -6.763 1.00 0.59 H new ATOM 1727 N VAL A 102 5.203 -4.974 -3.711 1.00 0.50 N ATOM 1728 CA VAL A 102 5.175 -5.169 -2.274 1.00 0.53 C ATOM 1729 C VAL A 102 4.078 -4.310 -1.661 1.00 0.49 C ATOM 1730 O VAL A 102 3.782 -3.231 -2.166 1.00 0.50 O ATOM 1731 CB VAL A 102 6.530 -4.813 -1.631 1.00 0.61 C ATOM 1732 CG1 VAL A 102 6.620 -5.370 -0.225 1.00 0.73 C ATOM 1733 CG2 VAL A 102 7.684 -5.320 -2.478 1.00 0.90 C ATOM 0 H VAL A 102 5.276 -3.998 -3.998 1.00 0.50 H new ATOM 0 HA VAL A 102 4.974 -6.223 -2.080 1.00 0.53 H new ATOM 0 HB VAL A 102 6.600 -3.727 -1.576 1.00 0.61 H new ATOM 0 HG11 VAL A 102 7.584 -5.107 0.210 1.00 0.73 H new ATOM 0 HG12 VAL A 102 5.820 -4.950 0.385 1.00 0.73 H new ATOM 0 HG13 VAL A 102 6.520 -6.455 -0.256 1.00 0.73 H new ATOM 0 HG21 VAL A 102 8.628 -5.056 -2.002 1.00 0.90 H new ATOM 0 HG22 VAL A 102 7.617 -6.404 -2.573 1.00 0.90 H new ATOM 0 HG23 VAL A 102 7.637 -4.865 -3.467 1.00 0.90 H new ATOM 1743 N ASP A 103 3.480 -4.799 -0.585 1.00 0.48 N ATOM 1744 CA ASP A 103 2.333 -4.138 0.031 1.00 0.47 C ATOM 1745 C ASP A 103 2.736 -2.819 0.688 1.00 0.46 C ATOM 1746 O ASP A 103 3.756 -2.742 1.372 1.00 0.51 O ATOM 1747 CB ASP A 103 1.700 -5.064 1.067 1.00 0.51 C ATOM 1748 CG ASP A 103 0.233 -4.772 1.286 1.00 1.22 C ATOM 1749 OD1 ASP A 103 -0.087 -3.666 1.772 1.00 1.56 O ATOM 1750 OD2 ASP A 103 -0.607 -5.635 0.970 1.00 1.96 O ATOM 0 H ASP A 103 3.770 -5.657 -0.116 1.00 0.48 H new ATOM 0 HA ASP A 103 1.609 -3.915 -0.752 1.00 0.47 H new ATOM 0 HB2 ASP A 103 1.817 -6.099 0.744 1.00 0.51 H new ATOM 0 HB3 ASP A 103 2.232 -4.963 2.013 1.00 0.51 H new ATOM 1755 N ASP A 104 1.927 -1.788 0.474 1.00 0.46 N ATOM 1756 CA ASP A 104 2.185 -0.469 1.045 1.00 0.47 C ATOM 1757 C ASP A 104 1.607 -0.373 2.451 1.00 0.46 C ATOM 1758 O ASP A 104 1.994 0.493 3.236 1.00 0.54 O ATOM 1759 CB ASP A 104 1.568 0.631 0.172 1.00 0.54 C ATOM 1760 CG ASP A 104 1.941 2.030 0.641 1.00 0.66 C ATOM 1761 OD1 ASP A 104 3.075 2.485 0.349 1.00 1.08 O ATOM 1762 OD2 ASP A 104 1.104 2.671 1.315 1.00 0.64 O ATOM 0 H ASP A 104 1.082 -1.840 -0.094 1.00 0.46 H new ATOM 0 HA ASP A 104 3.265 -0.330 1.087 1.00 0.47 H new ATOM 0 HB2 ASP A 104 1.896 0.498 -0.859 1.00 0.54 H new ATOM 0 HB3 ASP A 104 0.483 0.528 0.177 1.00 0.54 H new ATOM 1767 N SER A 105 0.688 -1.276 2.780 1.00 0.43 N ATOM 1768 CA SER A 105 -0.004 -1.205 4.065 1.00 0.49 C ATOM 1769 C SER A 105 0.859 -1.705 5.233 1.00 0.57 C ATOM 1770 O SER A 105 0.358 -1.867 6.346 1.00 0.96 O ATOM 1771 CB SER A 105 -1.292 -2.015 3.998 1.00 0.52 C ATOM 1772 OG SER A 105 -2.009 -1.726 2.812 1.00 1.27 O ATOM 0 H SER A 105 0.407 -2.055 2.185 1.00 0.43 H new ATOM 0 HA SER A 105 -0.224 -0.154 4.254 1.00 0.49 H new ATOM 0 HB2 SER A 105 -1.060 -3.079 4.037 1.00 0.52 H new ATOM 0 HB3 SER A 105 -1.912 -1.792 4.866 1.00 0.52 H new ATOM 0 HG SER A 105 -2.127 -0.757 2.729 1.00 1.27 H new ATOM 1778 N LYS A 106 2.145 -1.937 5.002 1.00 0.45 N ATOM 1779 CA LYS A 106 3.012 -2.430 6.058 1.00 0.49 C ATOM 1780 C LYS A 106 4.330 -1.656 6.116 1.00 0.52 C ATOM 1781 O LYS A 106 4.528 -0.690 5.377 1.00 0.65 O ATOM 1782 CB LYS A 106 3.240 -3.935 5.896 1.00 0.58 C ATOM 1783 CG LYS A 106 3.578 -4.380 4.484 1.00 0.69 C ATOM 1784 CD LYS A 106 5.047 -4.216 4.162 1.00 0.58 C ATOM 1785 CE LYS A 106 5.381 -4.887 2.848 1.00 1.00 C ATOM 1786 NZ LYS A 106 4.997 -6.324 2.846 1.00 2.02 N ATOM 0 H LYS A 106 2.604 -1.793 4.103 1.00 0.45 H new ATOM 0 HA LYS A 106 2.515 -2.264 7.014 1.00 0.49 H new ATOM 0 HB2 LYS A 106 4.048 -4.239 6.561 1.00 0.58 H new ATOM 0 HB3 LYS A 106 2.343 -4.461 6.223 1.00 0.58 H new ATOM 0 HG2 LYS A 106 3.296 -5.425 4.359 1.00 0.69 H new ATOM 0 HG3 LYS A 106 2.987 -3.803 3.773 1.00 0.69 H new ATOM 0 HD2 LYS A 106 5.298 -3.156 4.110 1.00 0.58 H new ATOM 0 HD3 LYS A 106 5.650 -4.647 4.961 1.00 0.58 H new ATOM 0 HE2 LYS A 106 4.866 -4.373 2.036 1.00 1.00 H new ATOM 0 HE3 LYS A 106 6.450 -4.797 2.656 1.00 1.00 H new ATOM 0 HZ1 LYS A 106 5.550 -6.830 2.125 1.00 2.02 H new ATOM 0 HZ2 LYS A 106 5.189 -6.736 3.782 1.00 2.02 H new ATOM 0 HZ3 LYS A 106 3.983 -6.412 2.630 1.00 2.02 H new ATOM 1800 N THR A 107 5.218 -2.085 7.006 1.00 0.53 N ATOM 1801 CA THR A 107 6.446 -1.354 7.283 1.00 0.57 C ATOM 1802 C THR A 107 7.611 -1.794 6.390 1.00 0.52 C ATOM 1803 O THR A 107 7.460 -2.645 5.513 1.00 0.54 O ATOM 1804 CB THR A 107 6.829 -1.498 8.768 1.00 0.69 C ATOM 1805 OG1 THR A 107 6.613 -2.849 9.196 1.00 0.76 O ATOM 1806 CG2 THR A 107 6.007 -0.551 9.628 1.00 0.74 C ATOM 0 H THR A 107 5.108 -2.941 7.550 1.00 0.53 H new ATOM 0 HA THR A 107 6.250 -0.306 7.056 1.00 0.57 H new ATOM 0 HB THR A 107 7.883 -1.244 8.880 1.00 0.69 H new ATOM 0 HG1 THR A 107 6.860 -2.936 10.140 1.00 0.76 H new ATOM 0 HG21 THR A 107 6.293 -0.668 10.673 1.00 0.74 H new ATOM 0 HG22 THR A 107 6.190 0.477 9.315 1.00 0.74 H new ATOM 0 HG23 THR A 107 4.948 -0.782 9.513 1.00 0.74 H new ATOM 1814 N VAL A 108 8.779 -1.209 6.638 1.00 0.49 N ATOM 1815 CA VAL A 108 9.929 -1.340 5.748 1.00 0.47 C ATOM 1816 C VAL A 108 10.532 -2.744 5.747 1.00 0.42 C ATOM 1817 O VAL A 108 10.646 -3.367 4.699 1.00 0.44 O ATOM 1818 CB VAL A 108 11.032 -0.342 6.135 1.00 0.55 C ATOM 1819 CG1 VAL A 108 12.167 -0.369 5.123 1.00 0.61 C ATOM 1820 CG2 VAL A 108 10.460 1.060 6.285 1.00 0.60 C ATOM 0 H VAL A 108 8.955 -0.632 7.460 1.00 0.49 H new ATOM 0 HA VAL A 108 9.551 -1.131 4.747 1.00 0.47 H new ATOM 0 HB VAL A 108 11.441 -0.642 7.100 1.00 0.55 H new ATOM 0 HG11 VAL A 108 12.935 0.346 5.419 1.00 0.61 H new ATOM 0 HG12 VAL A 108 12.597 -1.370 5.086 1.00 0.61 H new ATOM 0 HG13 VAL A 108 11.783 -0.102 4.138 1.00 0.61 H new ATOM 0 HG21 VAL A 108 11.257 1.751 6.559 1.00 0.60 H new ATOM 0 HG22 VAL A 108 10.016 1.375 5.341 1.00 0.60 H new ATOM 0 HG23 VAL A 108 9.696 1.060 7.063 1.00 0.60 H new ATOM 1830 N THR A 109 10.953 -3.208 6.917 1.00 0.43 N ATOM 1831 CA THR A 109 11.610 -4.509 7.066 1.00 0.43 C ATOM 1832 C THR A 109 10.863 -5.639 6.352 1.00 0.44 C ATOM 1833 O THR A 109 11.477 -6.437 5.636 1.00 0.45 O ATOM 1834 CB THR A 109 11.764 -4.857 8.552 1.00 0.51 C ATOM 1835 OG1 THR A 109 12.342 -3.737 9.234 1.00 0.56 O ATOM 1836 CG2 THR A 109 12.640 -6.088 8.742 1.00 0.56 C ATOM 0 H THR A 109 10.850 -2.695 7.793 1.00 0.43 H new ATOM 0 HA THR A 109 12.590 -4.419 6.596 1.00 0.43 H new ATOM 0 HB THR A 109 10.780 -5.081 8.964 1.00 0.51 H new ATOM 0 HG1 THR A 109 13.100 -3.394 8.716 1.00 0.56 H new ATOM 0 HG21 THR A 109 12.730 -6.310 9.805 1.00 0.56 H new ATOM 0 HG22 THR A 109 12.188 -6.938 8.231 1.00 0.56 H new ATOM 0 HG23 THR A 109 13.629 -5.898 8.326 1.00 0.56 H new ATOM 1844 N ASP A 110 9.546 -5.692 6.526 1.00 0.47 N ATOM 1845 CA ASP A 110 8.729 -6.728 5.899 1.00 0.51 C ATOM 1846 C ASP A 110 8.819 -6.614 4.380 1.00 0.49 C ATOM 1847 O ASP A 110 8.923 -7.609 3.665 1.00 0.54 O ATOM 1848 CB ASP A 110 7.268 -6.590 6.351 1.00 0.57 C ATOM 1849 CG ASP A 110 6.401 -7.749 5.901 1.00 0.65 C ATOM 1850 OD1 ASP A 110 6.008 -7.779 4.720 1.00 0.70 O ATOM 1851 OD2 ASP A 110 6.090 -8.625 6.736 1.00 0.76 O ATOM 0 H ASP A 110 9.020 -5.029 7.096 1.00 0.47 H new ATOM 0 HA ASP A 110 9.102 -7.706 6.203 1.00 0.51 H new ATOM 0 HB2 ASP A 110 7.234 -6.518 7.438 1.00 0.57 H new ATOM 0 HB3 ASP A 110 6.857 -5.661 5.957 1.00 0.57 H new ATOM 1856 N MET A 111 8.804 -5.375 3.908 1.00 0.46 N ATOM 1857 CA MET A 111 8.913 -5.074 2.488 1.00 0.46 C ATOM 1858 C MET A 111 10.300 -5.421 1.950 1.00 0.40 C ATOM 1859 O MET A 111 10.425 -5.991 0.867 1.00 0.43 O ATOM 1860 CB MET A 111 8.593 -3.593 2.275 1.00 0.51 C ATOM 1861 CG MET A 111 9.149 -2.989 0.997 1.00 0.50 C ATOM 1862 SD MET A 111 8.701 -1.251 0.833 1.00 0.75 S ATOM 1863 CE MET A 111 8.979 -0.702 2.512 1.00 0.67 C ATOM 0 H MET A 111 8.716 -4.549 4.500 1.00 0.46 H new ATOM 0 HA MET A 111 8.200 -5.685 1.934 1.00 0.46 H new ATOM 0 HB2 MET A 111 7.510 -3.468 2.276 1.00 0.51 H new ATOM 0 HB3 MET A 111 8.980 -3.028 3.123 1.00 0.51 H new ATOM 0 HG2 MET A 111 10.235 -3.087 0.990 1.00 0.50 H new ATOM 0 HG3 MET A 111 8.773 -3.545 0.138 1.00 0.50 H new ATOM 0 HE1 MET A 111 9.239 0.357 2.510 1.00 0.67 H new ATOM 0 HE2 MET A 111 8.073 -0.852 3.099 1.00 0.67 H new ATOM 0 HE3 MET A 111 9.795 -1.275 2.952 1.00 0.67 H new ATOM 1873 N LEU A 112 11.334 -5.093 2.719 1.00 0.36 N ATOM 1874 CA LEU A 112 12.713 -5.342 2.306 1.00 0.34 C ATOM 1875 C LEU A 112 12.952 -6.838 2.134 1.00 0.37 C ATOM 1876 O LEU A 112 13.664 -7.264 1.225 1.00 0.42 O ATOM 1877 CB LEU A 112 13.695 -4.780 3.336 1.00 0.35 C ATOM 1878 CG LEU A 112 15.115 -4.545 2.816 1.00 0.38 C ATOM 1879 CD1 LEU A 112 15.126 -3.379 1.843 1.00 0.39 C ATOM 1880 CD2 LEU A 112 16.067 -4.278 3.965 1.00 0.46 C ATOM 0 H LEU A 112 11.243 -4.653 3.635 1.00 0.36 H new ATOM 0 HA LEU A 112 12.877 -4.840 1.352 1.00 0.34 H new ATOM 0 HB2 LEU A 112 13.302 -3.836 3.713 1.00 0.35 H new ATOM 0 HB3 LEU A 112 13.743 -5.466 4.182 1.00 0.35 H new ATOM 0 HG LEU A 112 15.448 -5.444 2.296 1.00 0.38 H new ATOM 0 HD11 LEU A 112 16.141 -3.219 1.478 1.00 0.39 H new ATOM 0 HD12 LEU A 112 14.469 -3.601 1.002 1.00 0.39 H new ATOM 0 HD13 LEU A 112 14.777 -2.479 2.349 1.00 0.39 H new ATOM 0 HD21 LEU A 112 17.071 -4.113 3.575 1.00 0.46 H new ATOM 0 HD22 LEU A 112 15.740 -3.393 4.510 1.00 0.46 H new ATOM 0 HD23 LEU A 112 16.075 -5.136 4.638 1.00 0.46 H new ATOM 1892 N MET A 113 12.342 -7.622 3.016 1.00 0.39 N ATOM 1893 CA MET A 113 12.424 -9.078 2.954 1.00 0.46 C ATOM 1894 C MET A 113 11.881 -9.580 1.625 1.00 0.49 C ATOM 1895 O MET A 113 12.457 -10.462 0.988 1.00 0.56 O ATOM 1896 CB MET A 113 11.611 -9.682 4.098 1.00 0.55 C ATOM 1897 CG MET A 113 11.689 -11.198 4.180 1.00 0.61 C ATOM 1898 SD MET A 113 10.731 -11.864 5.555 1.00 0.98 S ATOM 1899 CE MET A 113 9.090 -11.271 5.146 1.00 1.34 C ATOM 0 H MET A 113 11.779 -7.269 3.790 1.00 0.39 H new ATOM 0 HA MET A 113 13.468 -9.378 3.045 1.00 0.46 H new ATOM 0 HB2 MET A 113 11.960 -9.259 5.040 1.00 0.55 H new ATOM 0 HB3 MET A 113 10.568 -9.388 3.983 1.00 0.55 H new ATOM 0 HG2 MET A 113 11.327 -11.628 3.246 1.00 0.61 H new ATOM 0 HG3 MET A 113 12.731 -11.500 4.287 1.00 0.61 H new ATOM 0 HE1 MET A 113 8.344 -11.891 5.643 1.00 1.34 H new ATOM 0 HE2 MET A 113 8.983 -10.238 5.478 1.00 1.34 H new ATOM 0 HE3 MET A 113 8.943 -11.322 4.067 1.00 1.34 H new ATOM 1909 N THR A 114 10.774 -8.991 1.216 1.00 0.47 N ATOM 1910 CA THR A 114 10.122 -9.346 -0.026 1.00 0.50 C ATOM 1911 C THR A 114 10.968 -8.930 -1.234 1.00 0.46 C ATOM 1912 O THR A 114 10.953 -9.594 -2.272 1.00 0.49 O ATOM 1913 CB THR A 114 8.729 -8.692 -0.094 1.00 0.54 C ATOM 1914 OG1 THR A 114 7.915 -9.181 0.980 1.00 0.62 O ATOM 1915 CG2 THR A 114 8.041 -8.973 -1.422 1.00 0.60 C ATOM 0 H THR A 114 10.302 -8.252 1.737 1.00 0.47 H new ATOM 0 HA THR A 114 10.009 -10.430 -0.056 1.00 0.50 H new ATOM 0 HB THR A 114 8.860 -7.614 -0.004 1.00 0.54 H new ATOM 0 HG1 THR A 114 8.177 -8.741 1.816 1.00 0.62 H new ATOM 0 HG21 THR A 114 7.061 -8.496 -1.432 1.00 0.60 H new ATOM 0 HG22 THR A 114 8.647 -8.576 -2.237 1.00 0.60 H new ATOM 0 HG23 THR A 114 7.922 -10.049 -1.549 1.00 0.60 H new ATOM 1923 N ILE A 115 11.732 -7.850 -1.093 1.00 0.43 N ATOM 1924 CA ILE A 115 12.554 -7.353 -2.188 1.00 0.41 C ATOM 1925 C ILE A 115 13.815 -8.195 -2.350 1.00 0.42 C ATOM 1926 O ILE A 115 14.140 -8.637 -3.454 1.00 0.43 O ATOM 1927 CB ILE A 115 12.968 -5.881 -1.970 1.00 0.40 C ATOM 1928 CG1 ILE A 115 11.734 -4.997 -1.779 1.00 0.42 C ATOM 1929 CG2 ILE A 115 13.798 -5.385 -3.148 1.00 0.42 C ATOM 1930 CD1 ILE A 115 12.067 -3.573 -1.392 1.00 0.44 C ATOM 0 H ILE A 115 11.798 -7.305 -0.233 1.00 0.43 H new ATOM 0 HA ILE A 115 11.946 -7.421 -3.090 1.00 0.41 H new ATOM 0 HB ILE A 115 13.575 -5.824 -1.066 1.00 0.40 H new ATOM 0 HG12 ILE A 115 11.156 -4.988 -2.703 1.00 0.42 H new ATOM 0 HG13 ILE A 115 11.098 -5.435 -1.010 1.00 0.42 H new ATOM 0 HG21 ILE A 115 14.083 -4.346 -2.981 1.00 0.42 H new ATOM 0 HG22 ILE A 115 14.695 -5.996 -3.244 1.00 0.42 H new ATOM 0 HG23 ILE A 115 13.210 -5.457 -4.063 1.00 0.42 H new ATOM 0 HD11 ILE A 115 11.145 -3.003 -1.273 1.00 0.44 H new ATOM 0 HD12 ILE A 115 12.619 -3.571 -0.452 1.00 0.44 H new ATOM 0 HD13 ILE A 115 12.677 -3.117 -2.172 1.00 0.44 H new ATOM 1942 N CYS A 116 14.512 -8.423 -1.243 1.00 0.43 N ATOM 1943 CA CYS A 116 15.778 -9.145 -1.268 1.00 0.47 C ATOM 1944 C CYS A 116 15.569 -10.590 -1.714 1.00 0.50 C ATOM 1945 O CYS A 116 16.445 -11.194 -2.340 1.00 0.53 O ATOM 1946 CB CYS A 116 16.440 -9.106 0.113 1.00 0.51 C ATOM 1947 SG CYS A 116 15.618 -10.124 1.362 1.00 1.56 S ATOM 0 H CYS A 116 14.221 -8.117 -0.315 1.00 0.43 H new ATOM 0 HA CYS A 116 16.436 -8.656 -1.987 1.00 0.47 H new ATOM 0 HB2 CYS A 116 17.475 -9.435 0.016 1.00 0.51 H new ATOM 0 HB3 CYS A 116 16.465 -8.074 0.462 1.00 0.51 H new ATOM 0 HG CYS A 116 14.345 -10.184 1.104 1.00 1.56 H new ATOM 1953 N ALA A 117 14.393 -11.128 -1.402 1.00 0.50 N ATOM 1954 CA ALA A 117 14.038 -12.492 -1.772 1.00 0.54 C ATOM 1955 C ALA A 117 13.965 -12.654 -3.286 1.00 0.54 C ATOM 1956 O ALA A 117 14.152 -13.752 -3.805 1.00 0.58 O ATOM 1957 CB ALA A 117 12.715 -12.885 -1.135 1.00 0.57 C ATOM 0 H ALA A 117 13.664 -10.633 -0.888 1.00 0.50 H new ATOM 0 HA ALA A 117 14.820 -13.154 -1.401 1.00 0.54 H new ATOM 0 HB1 ALA A 117 12.463 -13.906 -1.420 1.00 0.57 H new ATOM 0 HB2 ALA A 117 12.801 -12.822 -0.050 1.00 0.57 H new ATOM 0 HB3 ALA A 117 11.931 -12.209 -1.477 1.00 0.57 H new ATOM 1963 N ARG A 118 13.700 -11.558 -3.992 1.00 0.50 N ATOM 1964 CA ARG A 118 13.614 -11.602 -5.447 1.00 0.51 C ATOM 1965 C ARG A 118 14.994 -11.834 -6.040 1.00 0.52 C ATOM 1966 O ARG A 118 15.148 -12.540 -7.036 1.00 0.55 O ATOM 1967 CB ARG A 118 13.018 -10.307 -6.014 1.00 0.49 C ATOM 1968 CG ARG A 118 11.724 -9.883 -5.337 1.00 0.49 C ATOM 1969 CD ARG A 118 10.666 -10.977 -5.376 1.00 0.58 C ATOM 1970 NE ARG A 118 10.232 -11.288 -6.740 1.00 0.84 N ATOM 1971 CZ ARG A 118 9.187 -12.065 -7.033 1.00 1.16 C ATOM 1972 NH1 ARG A 118 8.416 -12.550 -6.067 1.00 1.23 N ATOM 1973 NH2 ARG A 118 8.894 -12.334 -8.299 1.00 1.75 N ATOM 0 H ARG A 118 13.542 -10.637 -3.584 1.00 0.50 H new ATOM 0 HA ARG A 118 12.954 -12.426 -5.719 1.00 0.51 H new ATOM 0 HB2 ARG A 118 13.750 -9.506 -5.913 1.00 0.49 H new ATOM 0 HB3 ARG A 118 12.834 -10.438 -7.080 1.00 0.49 H new ATOM 0 HG2 ARG A 118 11.929 -9.616 -4.300 1.00 0.49 H new ATOM 0 HG3 ARG A 118 11.337 -8.989 -5.826 1.00 0.49 H new ATOM 0 HD2 ARG A 118 11.063 -11.879 -4.910 1.00 0.58 H new ATOM 0 HD3 ARG A 118 9.804 -10.666 -4.786 1.00 0.58 H new ATOM 0 HE ARG A 118 10.761 -10.886 -7.514 1.00 0.84 H new ATOM 0 HH11 ARG A 118 8.620 -12.330 -5.092 1.00 1.23 H new ATOM 0 HH12 ARG A 118 7.619 -13.143 -6.300 1.00 1.23 H new ATOM 0 HH21 ARG A 118 9.467 -11.947 -9.049 1.00 1.75 H new ATOM 0 HH22 ARG A 118 8.095 -12.928 -8.523 1.00 1.75 H new ATOM 1987 N ILE A 119 16.003 -11.244 -5.415 1.00 0.52 N ATOM 1988 CA ILE A 119 17.374 -11.404 -5.868 1.00 0.54 C ATOM 1989 C ILE A 119 17.911 -12.747 -5.405 1.00 0.58 C ATOM 1990 O ILE A 119 18.609 -13.442 -6.139 1.00 0.66 O ATOM 1991 CB ILE A 119 18.292 -10.299 -5.303 1.00 0.51 C ATOM 1992 CG1 ILE A 119 17.547 -8.967 -5.211 1.00 0.49 C ATOM 1993 CG2 ILE A 119 19.532 -10.149 -6.170 1.00 0.56 C ATOM 1994 CD1 ILE A 119 17.108 -8.414 -6.549 1.00 0.69 C ATOM 0 H ILE A 119 15.896 -10.650 -4.593 1.00 0.52 H new ATOM 0 HA ILE A 119 17.369 -11.339 -6.956 1.00 0.54 H new ATOM 0 HB ILE A 119 18.598 -10.590 -4.298 1.00 0.51 H new ATOM 0 HG12 ILE A 119 16.670 -9.096 -4.577 1.00 0.49 H new ATOM 0 HG13 ILE A 119 18.190 -8.236 -4.720 1.00 0.49 H new ATOM 0 HG21 ILE A 119 20.170 -9.366 -5.760 1.00 0.56 H new ATOM 0 HG22 ILE A 119 20.079 -11.091 -6.188 1.00 0.56 H new ATOM 0 HG23 ILE A 119 19.236 -9.882 -7.185 1.00 0.56 H new ATOM 0 HD11 ILE A 119 16.587 -7.468 -6.399 1.00 0.69 H new ATOM 0 HD12 ILE A 119 17.982 -8.251 -7.180 1.00 0.69 H new ATOM 0 HD13 ILE A 119 16.438 -9.124 -7.034 1.00 0.69 H new ATOM 2006 N GLY A 120 17.562 -13.105 -4.178 1.00 0.57 N ATOM 2007 CA GLY A 120 18.059 -14.327 -3.593 1.00 0.62 C ATOM 2008 C GLY A 120 18.907 -14.060 -2.368 1.00 0.64 C ATOM 2009 O GLY A 120 19.708 -14.901 -1.958 1.00 0.70 O ATOM 0 H GLY A 120 16.940 -12.565 -3.576 1.00 0.57 H new ATOM 0 HA2 GLY A 120 17.220 -14.967 -3.321 1.00 0.62 H new ATOM 0 HA3 GLY A 120 18.648 -14.870 -4.332 1.00 0.62 H new ATOM 2013 N ILE A 121 18.733 -12.883 -1.785 1.00 0.66 N ATOM 2014 CA ILE A 121 19.482 -12.502 -0.600 1.00 0.71 C ATOM 2015 C ILE A 121 18.745 -12.961 0.653 1.00 0.82 C ATOM 2016 O ILE A 121 17.620 -12.527 0.916 1.00 1.54 O ATOM 2017 CB ILE A 121 19.702 -10.977 -0.533 1.00 0.63 C ATOM 2018 CG1 ILE A 121 20.362 -10.469 -1.819 1.00 0.59 C ATOM 2019 CG2 ILE A 121 20.553 -10.621 0.678 1.00 0.67 C ATOM 2020 CD1 ILE A 121 20.466 -8.958 -1.896 1.00 0.56 C ATOM 0 H ILE A 121 18.078 -12.175 -2.115 1.00 0.66 H new ATOM 0 HA ILE A 121 20.457 -12.986 -0.657 1.00 0.71 H new ATOM 0 HB ILE A 121 18.731 -10.492 -0.433 1.00 0.63 H new ATOM 0 HG12 ILE A 121 21.361 -10.897 -1.898 1.00 0.59 H new ATOM 0 HG13 ILE A 121 19.792 -10.829 -2.676 1.00 0.59 H new ATOM 0 HG21 ILE A 121 20.701 -9.542 0.714 1.00 0.67 H new ATOM 0 HG22 ILE A 121 20.048 -10.948 1.587 1.00 0.67 H new ATOM 0 HG23 ILE A 121 21.520 -11.118 0.602 1.00 0.67 H new ATOM 0 HD11 ILE A 121 20.943 -8.673 -2.834 1.00 0.56 H new ATOM 0 HD12 ILE A 121 19.468 -8.522 -1.850 1.00 0.56 H new ATOM 0 HD13 ILE A 121 21.061 -8.591 -1.060 1.00 0.56 H new ATOM 2032 N THR A 122 19.376 -13.842 1.411 1.00 0.96 N ATOM 2033 CA THR A 122 18.761 -14.405 2.599 1.00 1.00 C ATOM 2034 C THR A 122 18.830 -13.432 3.775 1.00 0.90 C ATOM 2035 O THR A 122 17.810 -13.127 4.399 1.00 1.04 O ATOM 2036 CB THR A 122 19.432 -15.737 2.986 1.00 1.18 C ATOM 2037 OG1 THR A 122 19.464 -16.614 1.851 1.00 1.55 O ATOM 2038 CG2 THR A 122 18.685 -16.414 4.126 1.00 1.65 C ATOM 0 H THR A 122 20.318 -14.184 1.223 1.00 0.96 H new ATOM 0 HA THR A 122 17.713 -14.591 2.365 1.00 1.00 H new ATOM 0 HB THR A 122 20.448 -15.521 3.316 1.00 1.18 H new ATOM 0 HG1 THR A 122 19.893 -17.459 2.102 1.00 1.55 H new ATOM 0 HG21 THR A 122 19.180 -17.352 4.379 1.00 1.65 H new ATOM 0 HG22 THR A 122 18.681 -15.759 4.998 1.00 1.65 H new ATOM 0 HG23 THR A 122 17.659 -16.616 3.819 1.00 1.65 H new ATOM 2046 N ASN A 123 20.025 -12.935 4.073 1.00 0.91 N ATOM 2047 CA ASN A 123 20.204 -12.024 5.196 1.00 0.87 C ATOM 2048 C ASN A 123 19.883 -10.598 4.771 1.00 0.77 C ATOM 2049 O ASN A 123 20.690 -9.931 4.127 1.00 1.05 O ATOM 2050 CB ASN A 123 21.630 -12.105 5.748 1.00 1.10 C ATOM 2051 CG ASN A 123 21.778 -11.381 7.070 1.00 1.31 C ATOM 2052 OD1 ASN A 123 20.824 -11.258 7.836 1.00 2.13 O ATOM 2053 ND2 ASN A 123 22.977 -10.904 7.354 1.00 1.50 N ATOM 0 H ASN A 123 20.879 -13.146 3.556 1.00 0.91 H new ATOM 0 HA ASN A 123 19.517 -12.321 5.988 1.00 0.87 H new ATOM 0 HB2 ASN A 123 21.908 -13.151 5.876 1.00 1.10 H new ATOM 0 HB3 ASN A 123 22.322 -11.677 5.023 1.00 1.10 H new ATOM 0 HD21 ASN A 123 23.136 -10.414 8.234 1.00 1.50 H new ATOM 0 HD22 ASN A 123 23.744 -11.026 6.693 1.00 1.50 H new ATOM 2060 N HIS A 124 18.696 -10.141 5.132 1.00 0.61 N ATOM 2061 CA HIS A 124 18.224 -8.827 4.713 1.00 0.59 C ATOM 2062 C HIS A 124 18.301 -7.830 5.855 1.00 0.57 C ATOM 2063 O HIS A 124 18.021 -6.645 5.671 1.00 0.66 O ATOM 2064 CB HIS A 124 16.785 -8.900 4.186 1.00 0.63 C ATOM 2065 CG HIS A 124 15.775 -9.391 5.183 1.00 0.58 C ATOM 2066 ND1 HIS A 124 14.953 -8.550 5.907 1.00 0.55 N ATOM 2067 CD2 HIS A 124 15.431 -10.647 5.546 1.00 0.66 C ATOM 2068 CE1 HIS A 124 14.150 -9.269 6.668 1.00 0.57 C ATOM 2069 NE2 HIS A 124 14.423 -10.544 6.468 1.00 0.66 N ATOM 0 H HIS A 124 18.039 -10.659 5.715 1.00 0.61 H new ATOM 0 HA HIS A 124 18.876 -8.489 3.907 1.00 0.59 H new ATOM 0 HB2 HIS A 124 16.487 -7.908 3.845 1.00 0.63 H new ATOM 0 HB3 HIS A 124 16.764 -9.556 3.315 1.00 0.63 H new ATOM 0 HD2 HIS A 124 15.870 -11.562 5.177 1.00 0.66 H new ATOM 0 HE1 HIS A 124 13.398 -8.880 7.339 1.00 0.57 H new ATOM 0 HE2 HIS A 124 13.958 -11.328 6.926 1.00 0.66 H new ATOM 2078 N ASP A 125 18.682 -8.308 7.029 1.00 0.62 N ATOM 2079 CA ASP A 125 18.750 -7.456 8.201 1.00 0.72 C ATOM 2080 C ASP A 125 19.919 -6.495 8.095 1.00 0.64 C ATOM 2081 O ASP A 125 19.931 -5.458 8.753 1.00 0.66 O ATOM 2082 CB ASP A 125 18.866 -8.287 9.480 1.00 0.97 C ATOM 2083 CG ASP A 125 17.543 -8.891 9.904 1.00 1.54 C ATOM 2084 OD1 ASP A 125 16.644 -8.134 10.324 1.00 2.14 O ATOM 2085 OD2 ASP A 125 17.398 -10.130 9.819 1.00 2.11 O ATOM 0 H ASP A 125 18.948 -9.279 7.193 1.00 0.62 H new ATOM 0 HA ASP A 125 17.825 -6.881 8.249 1.00 0.72 H new ATOM 0 HB2 ASP A 125 19.593 -9.085 9.326 1.00 0.97 H new ATOM 0 HB3 ASP A 125 19.249 -7.658 10.284 1.00 0.97 H new ATOM 2090 N GLU A 126 20.888 -6.828 7.240 1.00 0.62 N ATOM 2091 CA GLU A 126 22.056 -5.975 7.044 1.00 0.62 C ATOM 2092 C GLU A 126 21.674 -4.699 6.317 1.00 0.52 C ATOM 2093 O GLU A 126 22.408 -3.721 6.350 1.00 0.61 O ATOM 2094 CB GLU A 126 23.145 -6.674 6.223 1.00 0.76 C ATOM 2095 CG GLU A 126 23.669 -7.963 6.820 1.00 1.19 C ATOM 2096 CD GLU A 126 24.915 -8.460 6.107 1.00 1.84 C ATOM 2097 OE1 GLU A 126 25.949 -7.761 6.143 1.00 2.27 O ATOM 2098 OE2 GLU A 126 24.872 -9.555 5.507 1.00 2.30 O ATOM 0 H GLU A 126 20.885 -7.678 6.676 1.00 0.62 H new ATOM 0 HA GLU A 126 22.442 -5.750 8.038 1.00 0.62 H new ATOM 0 HB2 GLU A 126 22.750 -6.886 5.229 1.00 0.76 H new ATOM 0 HB3 GLU A 126 23.980 -5.985 6.094 1.00 0.76 H new ATOM 0 HG2 GLU A 126 23.894 -7.808 7.875 1.00 1.19 H new ATOM 0 HG3 GLU A 126 22.893 -8.727 6.768 1.00 1.19 H new ATOM 2105 N TYR A 127 20.526 -4.710 5.663 1.00 0.43 N ATOM 2106 CA TYR A 127 20.183 -3.648 4.740 1.00 0.38 C ATOM 2107 C TYR A 127 19.196 -2.659 5.326 1.00 0.39 C ATOM 2108 O TYR A 127 18.299 -3.017 6.092 1.00 0.42 O ATOM 2109 CB TYR A 127 19.608 -4.236 3.456 1.00 0.36 C ATOM 2110 CG TYR A 127 20.514 -5.248 2.814 1.00 0.36 C ATOM 2111 CD1 TYR A 127 21.740 -4.870 2.291 1.00 0.38 C ATOM 2112 CD2 TYR A 127 20.150 -6.580 2.742 1.00 0.40 C ATOM 2113 CE1 TYR A 127 22.579 -5.792 1.709 1.00 0.41 C ATOM 2114 CE2 TYR A 127 20.981 -7.512 2.165 1.00 0.43 C ATOM 2115 CZ TYR A 127 22.199 -7.116 1.645 1.00 0.43 C ATOM 2116 OH TYR A 127 23.038 -8.043 1.068 1.00 0.49 O ATOM 0 H TYR A 127 19.820 -5.440 5.755 1.00 0.43 H new ATOM 0 HA TYR A 127 21.104 -3.105 4.528 1.00 0.38 H new ATOM 0 HB2 TYR A 127 18.648 -4.704 3.676 1.00 0.36 H new ATOM 0 HB3 TYR A 127 19.415 -3.429 2.749 1.00 0.36 H new ATOM 0 HD1 TYR A 127 22.042 -3.834 2.341 1.00 0.38 H new ATOM 0 HD2 TYR A 127 19.198 -6.894 3.145 1.00 0.40 H new ATOM 0 HE1 TYR A 127 23.531 -5.480 1.304 1.00 0.41 H new ATOM 0 HE2 TYR A 127 20.683 -8.549 2.118 1.00 0.43 H new ATOM 0 HH TYR A 127 22.745 -8.946 1.311 1.00 0.49 H new ATOM 2126 N SER A 128 19.378 -1.410 4.959 1.00 0.40 N ATOM 2127 CA SER A 128 18.413 -0.375 5.229 1.00 0.42 C ATOM 2128 C SER A 128 17.789 0.044 3.912 1.00 0.41 C ATOM 2129 O SER A 128 18.279 -0.337 2.845 1.00 0.54 O ATOM 2130 CB SER A 128 19.091 0.817 5.899 1.00 0.47 C ATOM 2131 OG SER A 128 20.304 1.146 5.241 1.00 1.13 O ATOM 0 H SER A 128 20.207 -1.085 4.461 1.00 0.40 H new ATOM 0 HA SER A 128 17.643 -0.746 5.905 1.00 0.42 H new ATOM 0 HB2 SER A 128 18.421 1.676 5.885 1.00 0.47 H new ATOM 0 HB3 SER A 128 19.291 0.586 6.945 1.00 0.47 H new ATOM 0 HG SER A 128 20.720 1.913 5.686 1.00 1.13 H new ATOM 2137 N LEU A 129 16.721 0.813 3.959 1.00 0.42 N ATOM 2138 CA LEU A 129 16.121 1.272 2.723 1.00 0.42 C ATOM 2139 C LEU A 129 16.334 2.768 2.620 1.00 0.43 C ATOM 2140 O LEU A 129 16.360 3.451 3.629 1.00 0.48 O ATOM 2141 CB LEU A 129 14.633 0.903 2.676 1.00 0.43 C ATOM 2142 CG LEU A 129 14.100 0.456 1.306 1.00 0.45 C ATOM 2143 CD1 LEU A 129 12.745 -0.218 1.453 1.00 1.33 C ATOM 2144 CD2 LEU A 129 13.990 1.631 0.347 1.00 1.13 C ATOM 0 H LEU A 129 16.261 1.127 4.814 1.00 0.42 H new ATOM 0 HA LEU A 129 16.591 0.785 1.869 1.00 0.42 H new ATOM 0 HB2 LEU A 129 14.453 0.103 3.394 1.00 0.43 H new ATOM 0 HB3 LEU A 129 14.053 1.765 3.007 1.00 0.43 H new ATOM 0 HG LEU A 129 14.811 -0.260 0.893 1.00 0.45 H new ATOM 0 HD11 LEU A 129 12.384 -0.527 0.472 1.00 1.33 H new ATOM 0 HD12 LEU A 129 12.841 -1.092 2.097 1.00 1.33 H new ATOM 0 HD13 LEU A 129 12.037 0.482 1.896 1.00 1.33 H new ATOM 0 HD21 LEU A 129 13.610 1.282 -0.613 1.00 1.13 H new ATOM 0 HD22 LEU A 129 13.307 2.374 0.759 1.00 1.13 H new ATOM 0 HD23 LEU A 129 14.973 2.080 0.207 1.00 1.13 H new ATOM 2156 N VAL A 130 16.536 3.265 1.422 1.00 0.42 N ATOM 2157 CA VAL A 130 16.705 4.691 1.223 1.00 0.46 C ATOM 2158 C VAL A 130 15.996 5.105 -0.061 1.00 0.46 C ATOM 2159 O VAL A 130 16.187 4.498 -1.115 1.00 0.45 O ATOM 2160 CB VAL A 130 18.205 5.082 1.203 1.00 0.48 C ATOM 2161 CG1 VAL A 130 18.921 4.487 0.015 1.00 0.49 C ATOM 2162 CG2 VAL A 130 18.390 6.581 1.230 1.00 0.60 C ATOM 0 H VAL A 130 16.588 2.707 0.570 1.00 0.42 H new ATOM 0 HA VAL A 130 16.256 5.226 2.059 1.00 0.46 H new ATOM 0 HB VAL A 130 18.649 4.668 2.108 1.00 0.48 H new ATOM 0 HG11 VAL A 130 19.970 4.784 0.036 1.00 0.49 H new ATOM 0 HG12 VAL A 130 18.851 3.400 0.055 1.00 0.49 H new ATOM 0 HG13 VAL A 130 18.461 4.847 -0.905 1.00 0.49 H new ATOM 0 HG21 VAL A 130 19.454 6.817 1.215 1.00 0.60 H new ATOM 0 HG22 VAL A 130 17.908 7.023 0.358 1.00 0.60 H new ATOM 0 HG23 VAL A 130 17.941 6.987 2.137 1.00 0.60 H new ATOM 2172 N ARG A 131 15.138 6.102 0.036 1.00 0.48 N ATOM 2173 CA ARG A 131 14.309 6.489 -1.089 1.00 0.50 C ATOM 2174 C ARG A 131 14.655 7.892 -1.567 1.00 0.57 C ATOM 2175 O ARG A 131 14.277 8.892 -0.943 1.00 0.64 O ATOM 2176 CB ARG A 131 12.835 6.418 -0.685 1.00 0.54 C ATOM 2177 CG ARG A 131 12.453 5.093 -0.044 1.00 0.51 C ATOM 2178 CD ARG A 131 10.968 5.020 0.254 1.00 0.62 C ATOM 2179 NE ARG A 131 10.161 4.981 -0.967 1.00 0.96 N ATOM 2180 CZ ARG A 131 9.065 4.233 -1.115 1.00 1.65 C ATOM 2181 NH1 ARG A 131 8.659 3.442 -0.128 1.00 2.18 N ATOM 2182 NH2 ARG A 131 8.375 4.277 -2.250 1.00 2.01 N ATOM 0 H ARG A 131 14.997 6.657 0.880 1.00 0.48 H new ATOM 0 HA ARG A 131 14.495 5.799 -1.912 1.00 0.50 H new ATOM 0 HB2 ARG A 131 12.616 7.228 0.011 1.00 0.54 H new ATOM 0 HB3 ARG A 131 12.215 6.580 -1.567 1.00 0.54 H new ATOM 0 HG2 ARG A 131 12.731 4.274 -0.708 1.00 0.51 H new ATOM 0 HG3 ARG A 131 13.016 4.960 0.880 1.00 0.51 H new ATOM 0 HD2 ARG A 131 10.762 4.132 0.852 1.00 0.62 H new ATOM 0 HD3 ARG A 131 10.676 5.883 0.853 1.00 0.62 H new ATOM 0 HE ARG A 131 10.454 5.561 -1.753 1.00 0.96 H new ATOM 0 HH11 ARG A 131 9.185 3.405 0.745 1.00 2.18 H new ATOM 0 HH12 ARG A 131 7.821 2.871 -0.243 1.00 2.18 H new ATOM 0 HH21 ARG A 131 8.682 4.883 -3.011 1.00 2.01 H new ATOM 0 HH22 ARG A 131 7.538 3.705 -2.361 1.00 2.01 H new ATOM 2196 N GLU A 132 15.373 7.954 -2.677 1.00 0.58 N ATOM 2197 CA GLU A 132 15.716 9.222 -3.294 1.00 0.66 C ATOM 2198 C GLU A 132 14.534 9.750 -4.085 1.00 0.73 C ATOM 2199 O GLU A 132 14.155 9.178 -5.117 1.00 0.74 O ATOM 2200 CB GLU A 132 16.936 9.072 -4.204 1.00 0.68 C ATOM 2201 CG GLU A 132 18.223 8.775 -3.462 1.00 0.64 C ATOM 2202 CD GLU A 132 19.428 8.819 -4.375 1.00 0.72 C ATOM 2203 OE1 GLU A 132 19.430 8.100 -5.397 1.00 0.90 O ATOM 2204 OE2 GLU A 132 20.378 9.568 -4.078 1.00 1.05 O ATOM 0 H GLU A 132 15.730 7.136 -3.170 1.00 0.58 H new ATOM 0 HA GLU A 132 15.964 9.933 -2.506 1.00 0.66 H new ATOM 0 HB2 GLU A 132 16.747 8.271 -4.919 1.00 0.68 H new ATOM 0 HB3 GLU A 132 17.063 9.989 -4.779 1.00 0.68 H new ATOM 0 HG2 GLU A 132 18.352 9.498 -2.657 1.00 0.64 H new ATOM 0 HG3 GLU A 132 18.155 7.791 -2.999 1.00 0.64 H new ATOM 2211 N LEU A 133 13.935 10.826 -3.592 1.00 0.80 N ATOM 2212 CA LEU A 133 12.761 11.380 -4.242 1.00 0.87 C ATOM 2213 C LEU A 133 13.089 12.640 -5.023 1.00 0.97 C ATOM 2214 O LEU A 133 14.233 13.090 -5.081 1.00 1.02 O ATOM 2215 CB LEU A 133 11.661 11.717 -3.235 1.00 0.92 C ATOM 2216 CG LEU A 133 11.335 10.642 -2.202 1.00 0.87 C ATOM 2217 CD1 LEU A 133 10.126 11.069 -1.387 1.00 0.97 C ATOM 2218 CD2 LEU A 133 11.080 9.301 -2.872 1.00 0.80 C ATOM 0 H LEU A 133 14.239 11.325 -2.756 1.00 0.80 H new ATOM 0 HA LEU A 133 12.408 10.608 -4.926 1.00 0.87 H new ATOM 0 HB2 LEU A 133 11.950 12.624 -2.705 1.00 0.92 H new ATOM 0 HB3 LEU A 133 10.750 11.947 -3.788 1.00 0.92 H new ATOM 0 HG LEU A 133 12.191 10.524 -1.538 1.00 0.87 H new ATOM 0 HD11 LEU A 133 9.894 10.300 -0.650 1.00 0.97 H new ATOM 0 HD12 LEU A 133 10.344 12.007 -0.877 1.00 0.97 H new ATOM 0 HD13 LEU A 133 9.271 11.206 -2.049 1.00 0.97 H new ATOM 0 HD21 LEU A 133 10.850 8.553 -2.113 1.00 0.80 H new ATOM 0 HD22 LEU A 133 10.239 9.392 -3.559 1.00 0.80 H new ATOM 0 HD23 LEU A 133 11.968 8.996 -3.425 1.00 0.80 H new ATOM 2230 N MET A 134 12.046 13.195 -5.601 1.00 1.04 N ATOM 2231 CA MET A 134 12.114 14.432 -6.362 1.00 1.15 C ATOM 2232 C MET A 134 11.397 15.540 -5.610 1.00 1.22 C ATOM 2233 O MET A 134 11.379 16.692 -6.047 1.00 1.29 O ATOM 2234 CB MET A 134 11.447 14.216 -7.717 1.00 1.27 C ATOM 2235 CG MET A 134 10.035 13.667 -7.586 1.00 1.36 C ATOM 2236 SD MET A 134 8.798 14.934 -7.255 1.00 1.80 S ATOM 2237 CE MET A 134 7.394 13.904 -6.841 1.00 2.03 C ATOM 0 H MET A 134 11.109 12.795 -5.557 1.00 1.04 H new ATOM 0 HA MET A 134 13.156 14.719 -6.504 1.00 1.15 H new ATOM 0 HB2 MET A 134 11.418 15.161 -8.259 1.00 1.27 H new ATOM 0 HB3 MET A 134 12.049 13.527 -8.310 1.00 1.27 H new ATOM 0 HG2 MET A 134 9.771 13.144 -8.505 1.00 1.36 H new ATOM 0 HG3 MET A 134 10.013 12.931 -6.783 1.00 1.36 H new ATOM 0 HE1 MET A 134 6.536 14.535 -6.608 1.00 2.03 H new ATOM 0 HE2 MET A 134 7.152 13.261 -7.687 1.00 2.03 H new ATOM 0 HE3 MET A 134 7.637 13.288 -5.975 1.00 2.03 H new ATOM 2247 N GLU A 135 10.794 15.164 -4.484 1.00 1.27 N ATOM 2248 CA GLU A 135 10.010 16.076 -3.664 1.00 1.39 C ATOM 2249 C GLU A 135 10.759 17.368 -3.399 1.00 1.41 C ATOM 2250 O GLU A 135 11.848 17.358 -2.831 1.00 1.45 O ATOM 2251 CB GLU A 135 9.652 15.395 -2.347 1.00 1.48 C ATOM 2252 CG GLU A 135 8.460 14.462 -2.454 1.00 1.58 C ATOM 2253 CD GLU A 135 7.191 15.204 -2.817 1.00 1.83 C ATOM 2254 OE1 GLU A 135 6.484 15.676 -1.908 1.00 2.04 O ATOM 2255 OE2 GLU A 135 6.879 15.290 -4.023 1.00 2.29 O ATOM 0 H GLU A 135 10.838 14.214 -4.116 1.00 1.27 H new ATOM 0 HA GLU A 135 9.099 16.329 -4.206 1.00 1.39 H new ATOM 0 HB2 GLU A 135 10.515 14.831 -1.992 1.00 1.48 H new ATOM 0 HB3 GLU A 135 9.440 16.158 -1.598 1.00 1.48 H new ATOM 0 HG2 GLU A 135 8.662 13.700 -3.206 1.00 1.58 H new ATOM 0 HG3 GLU A 135 8.319 13.944 -1.505 1.00 1.58 H new ATOM 2262 N GLU A 136 10.176 18.474 -3.832 1.00 1.46 N ATOM 2263 CA GLU A 136 10.786 19.777 -3.650 1.00 1.52 C ATOM 2264 C GLU A 136 10.740 20.193 -2.186 1.00 1.52 C ATOM 2265 O GLU A 136 11.616 20.911 -1.705 1.00 1.59 O ATOM 2266 CB GLU A 136 10.078 20.814 -4.520 1.00 1.67 C ATOM 2267 CG GLU A 136 8.610 20.999 -4.176 1.00 1.73 C ATOM 2268 CD GLU A 136 7.976 22.147 -4.925 1.00 1.93 C ATOM 2269 OE1 GLU A 136 8.033 23.290 -4.428 1.00 2.12 O ATOM 2270 OE2 GLU A 136 7.421 21.912 -6.021 1.00 1.99 O ATOM 0 H GLU A 136 9.277 18.493 -4.314 1.00 1.46 H new ATOM 0 HA GLU A 136 11.831 19.716 -3.954 1.00 1.52 H new ATOM 0 HB2 GLU A 136 10.589 21.771 -4.418 1.00 1.67 H new ATOM 0 HB3 GLU A 136 10.163 20.517 -5.565 1.00 1.67 H new ATOM 0 HG2 GLU A 136 8.069 20.080 -4.403 1.00 1.73 H new ATOM 0 HG3 GLU A 136 8.511 21.171 -3.104 1.00 1.73 H new ATOM 2277 N LYS A 137 9.722 19.720 -1.479 1.00 1.53 N ATOM 2278 CA LYS A 137 9.545 20.074 -0.077 1.00 1.61 C ATOM 2279 C LYS A 137 10.525 19.300 0.797 1.00 1.55 C ATOM 2280 O LYS A 137 11.325 19.891 1.522 1.00 1.63 O ATOM 2281 CB LYS A 137 8.113 19.817 0.382 1.00 1.72 C ATOM 2282 CG LYS A 137 7.064 20.508 -0.472 1.00 1.83 C ATOM 2283 CD LYS A 137 7.415 21.956 -0.759 1.00 2.14 C ATOM 2284 CE LYS A 137 6.335 22.608 -1.599 1.00 2.31 C ATOM 2285 NZ LYS A 137 6.720 23.970 -2.051 1.00 2.98 N ATOM 0 H LYS A 137 9.009 19.093 -1.851 1.00 1.53 H new ATOM 0 HA LYS A 137 9.747 21.140 0.025 1.00 1.61 H new ATOM 0 HB2 LYS A 137 7.926 18.743 0.374 1.00 1.72 H new ATOM 0 HB3 LYS A 137 8.006 20.151 1.414 1.00 1.72 H new ATOM 0 HG2 LYS A 137 6.954 19.970 -1.414 1.00 1.83 H new ATOM 0 HG3 LYS A 137 6.100 20.464 0.035 1.00 1.83 H new ATOM 0 HD2 LYS A 137 7.533 22.500 0.178 1.00 2.14 H new ATOM 0 HD3 LYS A 137 8.371 22.008 -1.281 1.00 2.14 H new ATOM 0 HE2 LYS A 137 6.127 21.984 -2.468 1.00 2.31 H new ATOM 0 HE3 LYS A 137 5.413 22.666 -1.021 1.00 2.31 H new ATOM 0 HZ1 LYS A 137 5.864 24.545 -2.187 1.00 2.98 H new ATOM 0 HZ2 LYS A 137 7.326 24.416 -1.333 1.00 2.98 H new ATOM 0 HZ3 LYS A 137 7.239 23.904 -2.950 1.00 2.98 H new ATOM 2299 N LYS A 138 10.452 17.977 0.725 1.00 1.47 N ATOM 2300 CA LYS A 138 11.350 17.118 1.482 1.00 1.45 C ATOM 2301 C LYS A 138 12.762 17.150 0.897 1.00 1.34 C ATOM 2302 O LYS A 138 13.672 17.719 1.496 1.00 1.43 O ATOM 2303 CB LYS A 138 10.812 15.684 1.495 1.00 1.48 C ATOM 2304 CG LYS A 138 11.622 14.727 2.347 1.00 1.52 C ATOM 2305 CD LYS A 138 10.860 13.439 2.602 1.00 1.58 C ATOM 2306 CE LYS A 138 9.709 13.645 3.574 1.00 1.42 C ATOM 2307 NZ LYS A 138 10.187 13.980 4.944 1.00 1.76 N ATOM 0 H LYS A 138 9.777 17.475 0.148 1.00 1.47 H new ATOM 0 HA LYS A 138 11.401 17.490 2.505 1.00 1.45 H new ATOM 0 HB2 LYS A 138 9.784 15.696 1.858 1.00 1.48 H new ATOM 0 HB3 LYS A 138 10.784 15.308 0.472 1.00 1.48 H new ATOM 0 HG2 LYS A 138 12.565 14.502 1.849 1.00 1.52 H new ATOM 0 HG3 LYS A 138 11.868 15.201 3.297 1.00 1.52 H new ATOM 0 HD2 LYS A 138 10.474 13.053 1.659 1.00 1.58 H new ATOM 0 HD3 LYS A 138 11.541 12.687 3.000 1.00 1.58 H new ATOM 0 HE2 LYS A 138 9.066 14.446 3.209 1.00 1.42 H new ATOM 0 HE3 LYS A 138 9.102 12.741 3.613 1.00 1.42 H new ATOM 0 HZ1 LYS A 138 9.407 13.863 5.622 1.00 1.76 H new ATOM 0 HZ2 LYS A 138 10.969 13.346 5.204 1.00 1.76 H new ATOM 0 HZ3 LYS A 138 10.519 14.965 4.965 1.00 1.76 H new ATOM 2321 N ASP A 169 12.918 16.549 -0.284 1.00 1.23 N ATOM 2322 CA ASP A 169 14.214 16.436 -0.959 1.00 1.18 C ATOM 2323 C ASP A 169 15.266 15.856 -0.032 1.00 1.11 C ATOM 2324 O ASP A 169 16.128 16.564 0.490 1.00 1.30 O ATOM 2325 CB ASP A 169 14.679 17.784 -1.520 1.00 1.35 C ATOM 2326 CG ASP A 169 15.934 17.654 -2.363 1.00 1.44 C ATOM 2327 OD1 ASP A 169 15.864 17.033 -3.443 1.00 1.48 O ATOM 2328 OD2 ASP A 169 16.993 18.182 -1.955 1.00 1.59 O ATOM 0 H ASP A 169 12.148 16.126 -0.801 1.00 1.23 H new ATOM 0 HA ASP A 169 14.080 15.753 -1.798 1.00 1.18 H new ATOM 0 HB2 ASP A 169 13.882 18.219 -2.123 1.00 1.35 H new ATOM 0 HB3 ASP A 169 14.867 18.473 -0.696 1.00 1.35 H new ATOM 2333 N GLU A 170 15.156 14.564 0.193 1.00 0.96 N ATOM 2334 CA GLU A 170 16.117 13.843 1.000 1.00 0.90 C ATOM 2335 C GLU A 170 16.373 12.479 0.386 1.00 0.78 C ATOM 2336 O GLU A 170 15.697 12.077 -0.579 1.00 0.77 O ATOM 2337 CB GLU A 170 15.620 13.672 2.442 1.00 0.98 C ATOM 2338 CG GLU A 170 15.474 14.976 3.209 1.00 1.24 C ATOM 2339 CD GLU A 170 15.175 14.754 4.677 1.00 1.90 C ATOM 2340 OE1 GLU A 170 16.129 14.611 5.468 1.00 2.27 O ATOM 2341 OE2 GLU A 170 13.980 14.722 5.043 1.00 2.57 O ATOM 0 H GLU A 170 14.401 13.986 -0.177 1.00 0.96 H new ATOM 0 HA GLU A 170 17.041 14.421 1.026 1.00 0.90 H new ATOM 0 HB2 GLU A 170 14.656 13.164 2.424 1.00 0.98 H new ATOM 0 HB3 GLU A 170 16.312 13.023 2.979 1.00 0.98 H new ATOM 0 HG2 GLU A 170 16.392 15.556 3.112 1.00 1.24 H new ATOM 0 HG3 GLU A 170 14.674 15.568 2.764 1.00 1.24 H new ATOM 2348 N LEU A 171 17.362 11.784 0.923 1.00 0.73 N ATOM 2349 CA LEU A 171 17.609 10.405 0.552 1.00 0.67 C ATOM 2350 C LEU A 171 16.537 9.533 1.154 1.00 0.62 C ATOM 2351 O LEU A 171 16.290 8.443 0.681 1.00 0.57 O ATOM 2352 CB LEU A 171 18.975 9.935 1.050 1.00 0.71 C ATOM 2353 CG LEU A 171 20.140 10.826 0.658 1.00 0.77 C ATOM 2354 CD1 LEU A 171 21.460 10.206 1.086 1.00 0.86 C ATOM 2355 CD2 LEU A 171 20.124 11.086 -0.838 1.00 0.74 C ATOM 0 H LEU A 171 18.008 12.156 1.620 1.00 0.73 H new ATOM 0 HA LEU A 171 17.595 10.332 -0.535 1.00 0.67 H new ATOM 0 HB2 LEU A 171 18.943 9.861 2.137 1.00 0.71 H new ATOM 0 HB3 LEU A 171 19.159 8.931 0.667 1.00 0.71 H new ATOM 0 HG LEU A 171 20.035 11.780 1.174 1.00 0.77 H new ATOM 0 HD11 LEU A 171 22.281 10.861 0.795 1.00 0.86 H new ATOM 0 HD12 LEU A 171 21.466 10.075 2.168 1.00 0.86 H new ATOM 0 HD13 LEU A 171 21.581 9.237 0.602 1.00 0.86 H new ATOM 0 HD21 LEU A 171 20.965 11.726 -1.105 1.00 0.74 H new ATOM 0 HD22 LEU A 171 20.204 10.140 -1.373 1.00 0.74 H new ATOM 0 HD23 LEU A 171 19.191 11.579 -1.112 1.00 0.74 H new ATOM 2367 N ASN A 172 15.923 10.034 2.216 1.00 0.65 N ATOM 2368 CA ASN A 172 14.883 9.318 2.933 1.00 0.63 C ATOM 2369 C ASN A 172 15.331 7.918 3.297 1.00 0.57 C ATOM 2370 O ASN A 172 14.974 6.945 2.632 1.00 0.53 O ATOM 2371 CB ASN A 172 13.592 9.272 2.117 1.00 0.65 C ATOM 2372 CG ASN A 172 12.857 10.591 2.148 1.00 0.75 C ATOM 2373 OD1 ASN A 172 12.878 11.298 3.156 1.00 0.90 O ATOM 2374 ND2 ASN A 172 12.220 10.947 1.044 1.00 0.80 N ATOM 0 H ASN A 172 16.135 10.953 2.605 1.00 0.65 H new ATOM 0 HA ASN A 172 14.687 9.860 3.858 1.00 0.63 H new ATOM 0 HB2 ASN A 172 13.825 9.011 1.085 1.00 0.65 H new ATOM 0 HB3 ASN A 172 12.944 8.487 2.507 1.00 0.65 H new ATOM 0 HD21 ASN A 172 11.722 11.836 1.007 1.00 0.80 H new ATOM 0 HD22 ASN A 172 12.227 10.332 0.230 1.00 0.80 H new ATOM 2381 N TRP A 173 16.108 7.806 4.361 1.00 0.58 N ATOM 2382 CA TRP A 173 16.569 6.510 4.811 1.00 0.55 C ATOM 2383 C TRP A 173 15.474 5.877 5.645 1.00 0.54 C ATOM 2384 O TRP A 173 15.176 6.351 6.742 1.00 0.61 O ATOM 2385 CB TRP A 173 17.831 6.643 5.667 1.00 0.60 C ATOM 2386 CG TRP A 173 19.035 7.142 4.933 1.00 0.63 C ATOM 2387 CD1 TRP A 173 19.337 8.437 4.636 1.00 0.72 C ATOM 2388 CD2 TRP A 173 20.110 6.350 4.419 1.00 0.64 C ATOM 2389 NE1 TRP A 173 20.535 8.503 3.974 1.00 0.78 N ATOM 2390 CE2 TRP A 173 21.030 7.232 3.823 1.00 0.73 C ATOM 2391 CE3 TRP A 173 20.384 4.981 4.406 1.00 0.65 C ATOM 2392 CZ2 TRP A 173 22.204 6.788 3.220 1.00 0.80 C ATOM 2393 CZ3 TRP A 173 21.547 4.540 3.807 1.00 0.73 C ATOM 2394 CH2 TRP A 173 22.445 5.441 3.221 1.00 0.79 C ATOM 0 H TRP A 173 16.430 8.593 4.924 1.00 0.58 H new ATOM 0 HA TRP A 173 16.805 5.896 3.942 1.00 0.55 H new ATOM 0 HB2 TRP A 173 17.622 7.319 6.496 1.00 0.60 H new ATOM 0 HB3 TRP A 173 18.064 5.670 6.100 1.00 0.60 H new ATOM 0 HD1 TRP A 173 18.721 9.288 4.886 1.00 0.72 H new ATOM 0 HE1 TRP A 173 20.985 9.358 3.647 1.00 0.78 H new ATOM 0 HE3 TRP A 173 19.698 4.279 4.857 1.00 0.65 H new ATOM 0 HZ2 TRP A 173 22.898 7.481 2.768 1.00 0.80 H new ATOM 0 HZ3 TRP A 173 21.768 3.483 3.790 1.00 0.73 H new ATOM 0 HH2 TRP A 173 23.346 5.065 2.760 1.00 0.79 H new ATOM 2405 N LEU A 174 14.853 4.838 5.125 1.00 0.49 N ATOM 2406 CA LEU A 174 13.803 4.158 5.843 1.00 0.49 C ATOM 2407 C LEU A 174 14.368 3.505 7.087 1.00 0.53 C ATOM 2408 O LEU A 174 15.190 2.575 7.004 1.00 0.56 O ATOM 2409 CB LEU A 174 13.108 3.116 4.975 1.00 0.48 C ATOM 2410 CG LEU A 174 12.445 3.649 3.708 1.00 0.50 C ATOM 2411 CD1 LEU A 174 11.412 2.652 3.212 1.00 0.52 C ATOM 2412 CD2 LEU A 174 11.811 5.004 3.964 1.00 0.54 C ATOM 0 H LEU A 174 15.060 4.448 4.206 1.00 0.49 H new ATOM 0 HA LEU A 174 13.058 4.901 6.127 1.00 0.49 H new ATOM 0 HB2 LEU A 174 13.840 2.360 4.690 1.00 0.48 H new ATOM 0 HB3 LEU A 174 12.350 2.615 5.577 1.00 0.48 H new ATOM 0 HG LEU A 174 13.205 3.778 2.938 1.00 0.50 H new ATOM 0 HD11 LEU A 174 10.941 3.036 2.307 1.00 0.52 H new ATOM 0 HD12 LEU A 174 11.899 1.702 2.992 1.00 0.52 H new ATOM 0 HD13 LEU A 174 10.654 2.501 3.980 1.00 0.52 H new ATOM 0 HD21 LEU A 174 11.344 5.366 3.048 1.00 0.54 H new ATOM 0 HD22 LEU A 174 11.056 4.911 4.744 1.00 0.54 H new ATOM 0 HD23 LEU A 174 12.578 5.710 4.284 1.00 0.54 H new ATOM 2424 N ASP A 175 13.894 4.008 8.224 1.00 0.61 N ATOM 2425 CA ASP A 175 14.379 3.627 9.549 1.00 0.72 C ATOM 2426 C ASP A 175 13.963 2.207 9.912 1.00 0.68 C ATOM 2427 O ASP A 175 14.292 1.717 10.992 1.00 0.75 O ATOM 2428 CB ASP A 175 13.807 4.587 10.602 1.00 0.93 C ATOM 2429 CG ASP A 175 13.791 6.038 10.155 1.00 1.83 C ATOM 2430 OD1 ASP A 175 12.889 6.407 9.371 1.00 2.37 O ATOM 2431 OD2 ASP A 175 14.659 6.821 10.598 1.00 2.56 O ATOM 0 H ASP A 175 13.149 4.704 8.251 1.00 0.61 H new ATOM 0 HA ASP A 175 15.468 3.678 9.530 1.00 0.72 H new ATOM 0 HB2 ASP A 175 12.790 4.280 10.848 1.00 0.93 H new ATOM 0 HB3 ASP A 175 14.395 4.503 11.516 1.00 0.93 H new ATOM 2436 N HIS A 176 13.235 1.560 9.005 1.00 0.66 N ATOM 2437 CA HIS A 176 12.683 0.226 9.238 1.00 0.71 C ATOM 2438 C HIS A 176 11.590 0.265 10.292 1.00 0.83 C ATOM 2439 O HIS A 176 11.420 -0.681 11.055 1.00 1.10 O ATOM 2440 CB HIS A 176 13.771 -0.780 9.635 1.00 0.71 C ATOM 2441 CG HIS A 176 14.544 -1.304 8.468 1.00 0.69 C ATOM 2442 ND1 HIS A 176 14.086 -2.320 7.670 1.00 0.77 N ATOM 2443 CD2 HIS A 176 15.734 -0.933 7.954 1.00 0.67 C ATOM 2444 CE1 HIS A 176 14.955 -2.546 6.707 1.00 0.76 C ATOM 2445 NE2 HIS A 176 15.974 -1.723 6.855 1.00 0.69 N ATOM 0 H HIS A 176 13.011 1.945 8.087 1.00 0.66 H new ATOM 0 HA HIS A 176 12.247 -0.109 8.297 1.00 0.71 H new ATOM 0 HB2 HIS A 176 14.459 -0.304 10.334 1.00 0.71 H new ATOM 0 HB3 HIS A 176 13.309 -1.616 10.161 1.00 0.71 H new ATOM 0 HD2 HIS A 176 16.381 -0.157 8.336 1.00 0.67 H new ATOM 0 HE1 HIS A 176 14.850 -3.284 5.925 1.00 0.76 H new ATOM 0 HE2 HIS A 176 16.799 -1.680 6.257 1.00 0.69 H new ATOM 2454 N GLY A 177 10.815 1.341 10.291 1.00 0.82 N ATOM 2455 CA GLY A 177 9.780 1.495 11.296 1.00 0.96 C ATOM 2456 C GLY A 177 8.598 2.317 10.821 1.00 1.00 C ATOM 2457 O GLY A 177 7.448 1.954 11.063 1.00 1.34 O ATOM 0 H GLY A 177 10.883 2.105 9.618 1.00 0.82 H new ATOM 0 HA2 GLY A 177 9.429 0.509 11.600 1.00 0.96 H new ATOM 0 HA3 GLY A 177 10.209 1.966 12.180 1.00 0.96 H new ATOM 2461 N ARG A 178 8.872 3.422 10.140 1.00 0.90 N ATOM 2462 CA ARG A 178 7.818 4.344 9.737 1.00 0.99 C ATOM 2463 C ARG A 178 7.037 3.808 8.541 1.00 0.87 C ATOM 2464 O ARG A 178 7.451 2.843 7.889 1.00 0.86 O ATOM 2465 CB ARG A 178 8.407 5.710 9.377 1.00 1.22 C ATOM 2466 CG ARG A 178 8.956 5.776 7.962 1.00 1.27 C ATOM 2467 CD ARG A 178 9.320 7.192 7.568 1.00 1.18 C ATOM 2468 NE ARG A 178 10.583 7.609 8.152 1.00 1.23 N ATOM 2469 CZ ARG A 178 11.148 8.794 7.948 1.00 1.74 C ATOM 2470 NH1 ARG A 178 10.500 9.747 7.287 1.00 2.16 N ATOM 2471 NH2 ARG A 178 12.353 9.028 8.438 1.00 2.18 N ATOM 0 H ARG A 178 9.811 3.701 9.856 1.00 0.90 H new ATOM 0 HA ARG A 178 7.139 4.448 10.583 1.00 0.99 H new ATOM 0 HB2 ARG A 178 7.637 6.472 9.496 1.00 1.22 H new ATOM 0 HB3 ARG A 178 9.205 5.950 10.080 1.00 1.22 H new ATOM 0 HG2 ARG A 178 9.837 5.139 7.883 1.00 1.27 H new ATOM 0 HG3 ARG A 178 8.215 5.383 7.266 1.00 1.27 H new ATOM 0 HD2 ARG A 178 9.381 7.262 6.482 1.00 1.18 H new ATOM 0 HD3 ARG A 178 8.530 7.872 7.887 1.00 1.18 H new ATOM 0 HE ARG A 178 11.068 6.948 8.759 1.00 1.23 H new ATOM 0 HH11 ARG A 178 9.560 9.572 6.931 1.00 2.16 H new ATOM 0 HH12 ARG A 178 10.942 10.654 7.135 1.00 2.16 H new ATOM 0 HH21 ARG A 178 12.839 8.303 8.966 1.00 2.18 H new ATOM 0 HH22 ARG A 178 12.797 9.934 8.288 1.00 2.18 H new ATOM 2485 N THR A 179 5.920 4.458 8.254 1.00 0.91 N ATOM 2486 CA THR A 179 5.129 4.152 7.078 1.00 0.89 C ATOM 2487 C THR A 179 5.705 4.865 5.859 1.00 0.86 C ATOM 2488 O THR A 179 6.536 5.766 5.985 1.00 0.91 O ATOM 2489 CB THR A 179 3.658 4.570 7.277 1.00 1.05 C ATOM 2490 OG1 THR A 179 2.894 4.348 6.083 1.00 1.20 O ATOM 2491 CG2 THR A 179 3.573 6.036 7.685 1.00 1.11 C ATOM 0 H THR A 179 5.539 5.210 8.829 1.00 0.91 H new ATOM 0 HA THR A 179 5.164 3.074 6.918 1.00 0.89 H new ATOM 0 HB THR A 179 3.238 3.955 8.073 1.00 1.05 H new ATOM 0 HG1 THR A 179 1.964 4.619 6.234 1.00 1.20 H new ATOM 0 HG21 THR A 179 2.528 6.316 7.822 1.00 1.11 H new ATOM 0 HG22 THR A 179 4.114 6.186 8.619 1.00 1.11 H new ATOM 0 HG23 THR A 179 4.016 6.657 6.906 1.00 1.11 H new ATOM 2499 N LEU A 180 5.263 4.459 4.687 1.00 0.84 N ATOM 2500 CA LEU A 180 5.767 5.009 3.442 1.00 0.84 C ATOM 2501 C LEU A 180 4.967 6.239 3.029 1.00 0.93 C ATOM 2502 O LEU A 180 5.490 7.151 2.388 1.00 0.97 O ATOM 2503 CB LEU A 180 5.695 3.929 2.372 1.00 0.85 C ATOM 2504 CG LEU A 180 6.281 2.589 2.816 1.00 0.83 C ATOM 2505 CD1 LEU A 180 5.903 1.486 1.851 1.00 1.08 C ATOM 2506 CD2 LEU A 180 7.791 2.692 2.957 1.00 0.90 C ATOM 0 H LEU A 180 4.547 3.742 4.569 1.00 0.84 H new ATOM 0 HA LEU A 180 6.802 5.326 3.573 1.00 0.84 H new ATOM 0 HB2 LEU A 180 4.654 3.783 2.084 1.00 0.85 H new ATOM 0 HB3 LEU A 180 6.226 4.272 1.484 1.00 0.85 H new ATOM 0 HG LEU A 180 5.861 2.338 3.790 1.00 0.83 H new ATOM 0 HD11 LEU A 180 6.332 0.543 2.190 1.00 1.08 H new ATOM 0 HD12 LEU A 180 4.818 1.396 1.809 1.00 1.08 H new ATOM 0 HD13 LEU A 180 6.286 1.723 0.859 1.00 1.08 H new ATOM 0 HD21 LEU A 180 8.193 1.730 3.274 1.00 0.90 H new ATOM 0 HD22 LEU A 180 8.228 2.970 1.998 1.00 0.90 H new ATOM 0 HD23 LEU A 180 8.036 3.450 3.701 1.00 0.90 H new ATOM 2518 N ARG A 181 3.706 6.270 3.435 1.00 1.02 N ATOM 2519 CA ARG A 181 2.795 7.352 3.074 1.00 1.13 C ATOM 2520 C ARG A 181 3.260 8.697 3.623 1.00 1.18 C ATOM 2521 O ARG A 181 3.106 9.729 2.974 1.00 1.36 O ATOM 2522 CB ARG A 181 1.394 7.041 3.591 1.00 1.22 C ATOM 2523 CG ARG A 181 0.431 6.586 2.509 1.00 1.15 C ATOM 2524 CD ARG A 181 -0.815 5.955 3.108 1.00 0.69 C ATOM 2525 NE ARG A 181 -0.556 4.601 3.603 1.00 1.10 N ATOM 2526 CZ ARG A 181 -0.674 4.231 4.881 1.00 2.02 C ATOM 2527 NH1 ARG A 181 -1.055 5.111 5.804 1.00 2.54 N ATOM 2528 NH2 ARG A 181 -0.404 2.977 5.237 1.00 2.64 N ATOM 0 H ARG A 181 3.285 5.550 4.022 1.00 1.02 H new ATOM 0 HA ARG A 181 2.783 7.425 1.986 1.00 1.13 H new ATOM 0 HB2 ARG A 181 1.462 6.266 4.354 1.00 1.22 H new ATOM 0 HB3 ARG A 181 0.989 7.930 4.075 1.00 1.22 H new ATOM 0 HG2 ARG A 181 0.148 7.437 1.890 1.00 1.15 H new ATOM 0 HG3 ARG A 181 0.927 5.868 1.856 1.00 1.15 H new ATOM 0 HD2 ARG A 181 -1.180 6.577 3.925 1.00 0.69 H new ATOM 0 HD3 ARG A 181 -1.603 5.922 2.356 1.00 0.69 H new ATOM 0 HE ARG A 181 -0.266 3.894 2.927 1.00 1.10 H new ATOM 0 HH11 ARG A 181 -1.259 6.074 5.537 1.00 2.54 H new ATOM 0 HH12 ARG A 181 -1.143 4.822 6.778 1.00 2.54 H new ATOM 0 HH21 ARG A 181 -0.107 2.300 4.534 1.00 2.64 H new ATOM 0 HH22 ARG A 181 -0.494 2.693 6.213 1.00 2.64 H new ATOM 2542 N GLU A 182 3.855 8.676 4.807 1.00 1.11 N ATOM 2543 CA GLU A 182 4.235 9.904 5.498 1.00 1.18 C ATOM 2544 C GLU A 182 5.433 10.570 4.820 1.00 1.16 C ATOM 2545 O GLU A 182 5.710 11.752 5.036 1.00 1.25 O ATOM 2546 CB GLU A 182 4.542 9.589 6.967 1.00 1.25 C ATOM 2547 CG GLU A 182 5.805 8.764 7.188 1.00 1.34 C ATOM 2548 CD GLU A 182 7.011 9.610 7.548 1.00 1.89 C ATOM 2549 OE1 GLU A 182 7.103 10.051 8.711 1.00 2.30 O ATOM 2550 OE2 GLU A 182 7.876 9.828 6.677 1.00 2.31 O ATOM 0 H GLU A 182 4.086 7.821 5.312 1.00 1.11 H new ATOM 0 HA GLU A 182 3.403 10.607 5.451 1.00 1.18 H new ATOM 0 HB2 GLU A 182 4.636 10.527 7.514 1.00 1.25 H new ATOM 0 HB3 GLU A 182 3.694 9.054 7.395 1.00 1.25 H new ATOM 0 HG2 GLU A 182 5.625 8.041 7.983 1.00 1.34 H new ATOM 0 HG3 GLU A 182 6.024 8.196 6.284 1.00 1.34 H new ATOM 2557 N GLN A 183 6.113 9.806 3.977 1.00 1.07 N ATOM 2558 CA GLN A 183 7.342 10.255 3.336 1.00 1.06 C ATOM 2559 C GLN A 183 7.044 11.078 2.093 1.00 1.13 C ATOM 2560 O GLN A 183 7.877 11.866 1.644 1.00 1.22 O ATOM 2561 CB GLN A 183 8.176 9.045 2.939 1.00 1.00 C ATOM 2562 CG GLN A 183 8.442 8.087 4.077 1.00 1.00 C ATOM 2563 CD GLN A 183 9.025 6.780 3.598 1.00 1.04 C ATOM 2564 OE1 GLN A 183 9.733 6.726 2.597 1.00 1.65 O ATOM 2565 NE2 GLN A 183 8.711 5.711 4.302 1.00 0.81 N ATOM 0 H GLN A 183 5.830 8.861 3.718 1.00 1.07 H new ATOM 0 HA GLN A 183 7.888 10.878 4.045 1.00 1.06 H new ATOM 0 HB2 GLN A 183 7.665 8.510 2.138 1.00 1.00 H new ATOM 0 HB3 GLN A 183 9.129 9.389 2.536 1.00 1.00 H new ATOM 0 HG2 GLN A 183 9.127 8.550 4.787 1.00 1.00 H new ATOM 0 HG3 GLN A 183 7.512 7.894 4.612 1.00 1.00 H new ATOM 0 HE21 GLN A 183 8.119 5.800 5.128 1.00 0.81 H new ATOM 0 HE22 GLN A 183 9.060 4.795 4.021 1.00 0.81 H new ATOM 2574 N GLY A 184 5.858 10.883 1.538 1.00 1.16 N ATOM 2575 CA GLY A 184 5.524 11.514 0.279 1.00 1.28 C ATOM 2576 C GLY A 184 6.216 10.843 -0.883 1.00 1.23 C ATOM 2577 O GLY A 184 6.387 11.438 -1.947 1.00 1.38 O ATOM 0 H GLY A 184 5.122 10.300 1.936 1.00 1.16 H new ATOM 0 HA2 GLY A 184 4.445 11.479 0.129 1.00 1.28 H new ATOM 0 HA3 GLY A 184 5.807 12.566 0.313 1.00 1.28 H new ATOM 2581 N VAL A 185 6.630 9.601 -0.669 1.00 1.10 N ATOM 2582 CA VAL A 185 7.299 8.830 -1.698 1.00 1.08 C ATOM 2583 C VAL A 185 6.323 8.360 -2.767 1.00 1.02 C ATOM 2584 O VAL A 185 5.137 8.161 -2.500 1.00 1.15 O ATOM 2585 CB VAL A 185 8.004 7.604 -1.088 1.00 1.13 C ATOM 2586 CG1 VAL A 185 9.128 8.043 -0.170 1.00 1.31 C ATOM 2587 CG2 VAL A 185 7.007 6.737 -0.333 1.00 1.14 C ATOM 0 H VAL A 185 6.511 9.107 0.215 1.00 1.10 H new ATOM 0 HA VAL A 185 8.037 9.486 -2.160 1.00 1.08 H new ATOM 0 HB VAL A 185 8.430 7.012 -1.898 1.00 1.13 H new ATOM 0 HG11 VAL A 185 9.616 7.165 0.253 1.00 1.31 H new ATOM 0 HG12 VAL A 185 9.855 8.624 -0.737 1.00 1.31 H new ATOM 0 HG13 VAL A 185 8.722 8.656 0.635 1.00 1.31 H new ATOM 0 HG21 VAL A 185 7.522 5.875 0.091 1.00 1.14 H new ATOM 0 HG22 VAL A 185 6.553 7.319 0.469 1.00 1.14 H new ATOM 0 HG23 VAL A 185 6.231 6.395 -1.018 1.00 1.14 H new ATOM 2597 N GLU A 186 6.830 8.187 -3.977 1.00 0.93 N ATOM 2598 CA GLU A 186 6.047 7.635 -5.062 1.00 0.92 C ATOM 2599 C GLU A 186 6.572 6.251 -5.408 1.00 0.83 C ATOM 2600 O GLU A 186 7.543 5.776 -4.807 1.00 0.82 O ATOM 2601 CB GLU A 186 6.108 8.544 -6.292 1.00 1.02 C ATOM 2602 CG GLU A 186 5.549 9.938 -6.059 1.00 1.46 C ATOM 2603 CD GLU A 186 4.072 9.931 -5.725 1.00 2.45 C ATOM 2604 OE1 GLU A 186 3.336 9.085 -6.275 1.00 2.97 O ATOM 2605 OE2 GLU A 186 3.636 10.778 -4.918 1.00 3.02 O ATOM 0 H GLU A 186 7.789 8.424 -4.230 1.00 0.93 H new ATOM 0 HA GLU A 186 5.006 7.562 -4.746 1.00 0.92 H new ATOM 0 HB2 GLU A 186 7.145 8.629 -6.617 1.00 1.02 H new ATOM 0 HB3 GLU A 186 5.556 8.074 -7.106 1.00 1.02 H new ATOM 0 HG2 GLU A 186 6.098 10.413 -5.246 1.00 1.46 H new ATOM 0 HG3 GLU A 186 5.712 10.543 -6.951 1.00 1.46 H new ATOM 2612 N GLU A 187 5.942 5.607 -6.371 1.00 0.89 N ATOM 2613 CA GLU A 187 6.343 4.274 -6.784 1.00 0.91 C ATOM 2614 C GLU A 187 7.488 4.337 -7.793 1.00 0.91 C ATOM 2615 O GLU A 187 8.389 3.506 -7.776 1.00 1.14 O ATOM 2616 CB GLU A 187 5.150 3.522 -7.379 1.00 1.05 C ATOM 2617 CG GLU A 187 4.122 3.059 -6.349 1.00 1.11 C ATOM 2618 CD GLU A 187 3.294 4.186 -5.768 1.00 1.36 C ATOM 2619 OE1 GLU A 187 2.231 4.507 -6.344 1.00 1.72 O ATOM 2620 OE2 GLU A 187 3.699 4.754 -4.738 1.00 1.86 O ATOM 0 H GLU A 187 5.147 5.986 -6.885 1.00 0.89 H new ATOM 0 HA GLU A 187 6.695 3.736 -5.904 1.00 0.91 H new ATOM 0 HB2 GLU A 187 4.655 4.167 -8.105 1.00 1.05 H new ATOM 0 HB3 GLU A 187 5.518 2.653 -7.924 1.00 1.05 H new ATOM 0 HG2 GLU A 187 3.456 2.333 -6.815 1.00 1.11 H new ATOM 0 HG3 GLU A 187 4.639 2.544 -5.539 1.00 1.11 H new ATOM 2627 N HIS A 188 7.452 5.348 -8.649 1.00 0.92 N ATOM 2628 CA HIS A 188 8.451 5.517 -9.707 1.00 0.95 C ATOM 2629 C HIS A 188 9.767 6.083 -9.173 1.00 0.92 C ATOM 2630 O HIS A 188 10.734 6.239 -9.921 1.00 1.01 O ATOM 2631 CB HIS A 188 7.903 6.451 -10.794 1.00 1.04 C ATOM 2632 CG HIS A 188 7.556 7.827 -10.294 1.00 1.03 C ATOM 2633 ND1 HIS A 188 6.262 8.261 -10.117 1.00 1.09 N ATOM 2634 CD2 HIS A 188 8.347 8.868 -9.935 1.00 1.08 C ATOM 2635 CE1 HIS A 188 6.272 9.503 -9.676 1.00 1.14 C ATOM 2636 NE2 HIS A 188 7.526 9.898 -9.558 1.00 1.15 N ATOM 0 H HIS A 188 6.735 6.074 -8.634 1.00 0.92 H new ATOM 0 HA HIS A 188 8.655 4.530 -10.122 1.00 0.95 H new ATOM 0 HB2 HIS A 188 8.642 6.540 -11.590 1.00 1.04 H new ATOM 0 HB3 HIS A 188 7.014 5.999 -11.233 1.00 1.04 H new ATOM 0 HD2 HIS A 188 9.427 8.883 -9.944 1.00 1.08 H new ATOM 0 HE1 HIS A 188 5.400 10.098 -9.449 1.00 1.14 H new ATOM 0 HE2 HIS A 188 7.833 10.817 -9.239 1.00 1.15 H new ATOM 2645 N GLU A 189 9.800 6.410 -7.894 1.00 0.89 N ATOM 2646 CA GLU A 189 10.971 7.044 -7.306 1.00 0.92 C ATOM 2647 C GLU A 189 12.075 6.026 -7.080 1.00 0.78 C ATOM 2648 O GLU A 189 11.801 4.898 -6.674 1.00 0.74 O ATOM 2649 CB GLU A 189 10.593 7.720 -5.997 1.00 1.10 C ATOM 2650 CG GLU A 189 9.629 8.875 -6.179 1.00 1.37 C ATOM 2651 CD GLU A 189 10.286 10.073 -6.827 1.00 1.82 C ATOM 2652 OE1 GLU A 189 10.731 9.964 -7.993 1.00 2.34 O ATOM 2653 OE2 GLU A 189 10.384 11.117 -6.163 1.00 2.38 O ATOM 0 H GLU A 189 9.032 6.249 -7.242 1.00 0.89 H new ATOM 0 HA GLU A 189 11.343 7.800 -7.998 1.00 0.92 H new ATOM 0 HB2 GLU A 189 10.145 6.983 -5.331 1.00 1.10 H new ATOM 0 HB3 GLU A 189 11.497 8.083 -5.509 1.00 1.10 H new ATOM 0 HG2 GLU A 189 8.787 8.550 -6.790 1.00 1.37 H new ATOM 0 HG3 GLU A 189 9.225 9.165 -5.209 1.00 1.37 H new ATOM 2660 N THR A 190 13.311 6.411 -7.373 1.00 0.74 N ATOM 2661 CA THR A 190 14.431 5.495 -7.233 1.00 0.66 C ATOM 2662 C THR A 190 14.763 5.249 -5.767 1.00 0.57 C ATOM 2663 O THR A 190 15.163 6.160 -5.039 1.00 0.61 O ATOM 2664 CB THR A 190 15.683 6.017 -7.961 1.00 0.70 C ATOM 2665 OG1 THR A 190 15.325 6.495 -9.269 1.00 0.81 O ATOM 2666 CG2 THR A 190 16.725 4.913 -8.094 1.00 0.66 C ATOM 0 H THR A 190 13.560 7.343 -7.706 1.00 0.74 H new ATOM 0 HA THR A 190 14.127 4.554 -7.691 1.00 0.66 H new ATOM 0 HB THR A 190 16.106 6.834 -7.376 1.00 0.70 H new ATOM 0 HG1 THR A 190 16.126 6.827 -9.726 1.00 0.81 H new ATOM 0 HG21 THR A 190 17.602 5.301 -8.611 1.00 0.66 H new ATOM 0 HG22 THR A 190 17.013 4.563 -7.103 1.00 0.66 H new ATOM 0 HG23 THR A 190 16.306 4.084 -8.664 1.00 0.66 H new ATOM 2674 N LEU A 191 14.586 4.012 -5.347 1.00 0.48 N ATOM 2675 CA LEU A 191 14.885 3.608 -3.987 1.00 0.42 C ATOM 2676 C LEU A 191 16.089 2.687 -4.026 1.00 0.39 C ATOM 2677 O LEU A 191 16.175 1.813 -4.886 1.00 0.38 O ATOM 2678 CB LEU A 191 13.685 2.885 -3.372 1.00 0.41 C ATOM 2679 CG LEU A 191 12.315 3.359 -3.863 1.00 0.51 C ATOM 2680 CD1 LEU A 191 11.214 2.523 -3.248 1.00 1.01 C ATOM 2681 CD2 LEU A 191 12.101 4.832 -3.556 1.00 0.82 C ATOM 0 H LEU A 191 14.232 3.260 -5.937 1.00 0.48 H new ATOM 0 HA LEU A 191 15.100 4.483 -3.374 1.00 0.42 H new ATOM 0 HB2 LEU A 191 13.778 1.819 -3.580 1.00 0.41 H new ATOM 0 HB3 LEU A 191 13.726 3.004 -2.289 1.00 0.41 H new ATOM 0 HG LEU A 191 12.284 3.234 -4.945 1.00 0.51 H new ATOM 0 HD11 LEU A 191 10.247 2.874 -3.608 1.00 1.01 H new ATOM 0 HD12 LEU A 191 11.349 1.479 -3.530 1.00 1.01 H new ATOM 0 HD13 LEU A 191 11.252 2.613 -2.162 1.00 1.01 H new ATOM 0 HD21 LEU A 191 11.120 5.140 -3.916 1.00 0.82 H new ATOM 0 HD22 LEU A 191 12.159 4.991 -2.479 1.00 0.82 H new ATOM 0 HD23 LEU A 191 12.871 5.423 -4.052 1.00 0.82 H new ATOM 2693 N LEU A 192 17.031 2.878 -3.131 1.00 0.39 N ATOM 2694 CA LEU A 192 18.278 2.146 -3.202 1.00 0.41 C ATOM 2695 C LEU A 192 18.402 1.202 -2.017 1.00 0.40 C ATOM 2696 O LEU A 192 18.187 1.601 -0.872 1.00 0.44 O ATOM 2697 CB LEU A 192 19.444 3.136 -3.203 1.00 0.44 C ATOM 2698 CG LEU A 192 19.147 4.477 -3.885 1.00 0.49 C ATOM 2699 CD1 LEU A 192 20.245 5.476 -3.592 1.00 0.56 C ATOM 2700 CD2 LEU A 192 18.983 4.308 -5.388 1.00 0.50 C ATOM 0 H LEU A 192 16.960 3.529 -2.349 1.00 0.39 H new ATOM 0 HA LEU A 192 18.297 1.557 -4.119 1.00 0.41 H new ATOM 0 HB2 LEU A 192 19.742 3.327 -2.172 1.00 0.44 H new ATOM 0 HB3 LEU A 192 20.296 2.672 -3.700 1.00 0.44 H new ATOM 0 HG LEU A 192 18.208 4.854 -3.480 1.00 0.49 H new ATOM 0 HD11 LEU A 192 20.017 6.422 -4.084 1.00 0.56 H new ATOM 0 HD12 LEU A 192 20.315 5.635 -2.516 1.00 0.56 H new ATOM 0 HD13 LEU A 192 21.195 5.093 -3.965 1.00 0.56 H new ATOM 0 HD21 LEU A 192 18.773 5.276 -5.842 1.00 0.50 H new ATOM 0 HD22 LEU A 192 19.901 3.900 -5.811 1.00 0.50 H new ATOM 0 HD23 LEU A 192 18.157 3.626 -5.589 1.00 0.50 H new ATOM 2712 N LEU A 193 18.716 -0.050 -2.290 1.00 0.43 N ATOM 2713 CA LEU A 193 18.978 -1.005 -1.231 1.00 0.50 C ATOM 2714 C LEU A 193 20.399 -0.798 -0.718 1.00 0.47 C ATOM 2715 O LEU A 193 21.363 -0.913 -1.475 1.00 0.49 O ATOM 2716 CB LEU A 193 18.763 -2.433 -1.751 1.00 0.68 C ATOM 2717 CG LEU A 193 18.862 -3.546 -0.704 1.00 0.44 C ATOM 2718 CD1 LEU A 193 17.971 -4.712 -1.088 1.00 1.09 C ATOM 2719 CD2 LEU A 193 20.293 -4.027 -0.568 1.00 1.03 C ATOM 0 H LEU A 193 18.796 -0.429 -3.234 1.00 0.43 H new ATOM 0 HA LEU A 193 18.287 -0.851 -0.402 1.00 0.50 H new ATOM 0 HB2 LEU A 193 17.779 -2.485 -2.217 1.00 0.68 H new ATOM 0 HB3 LEU A 193 19.497 -2.629 -2.533 1.00 0.68 H new ATOM 0 HG LEU A 193 18.532 -3.140 0.253 1.00 0.44 H new ATOM 0 HD11 LEU A 193 18.052 -5.495 -0.334 1.00 1.09 H new ATOM 0 HD12 LEU A 193 16.937 -4.374 -1.151 1.00 1.09 H new ATOM 0 HD13 LEU A 193 18.283 -5.105 -2.055 1.00 1.09 H new ATOM 0 HD21 LEU A 193 20.341 -4.818 0.181 1.00 1.03 H new ATOM 0 HD22 LEU A 193 20.640 -4.413 -1.527 1.00 1.03 H new ATOM 0 HD23 LEU A 193 20.928 -3.196 -0.260 1.00 1.03 H new ATOM 2731 N ARG A 194 20.522 -0.466 0.559 1.00 0.46 N ATOM 2732 CA ARG A 194 21.812 -0.110 1.135 1.00 0.46 C ATOM 2733 C ARG A 194 22.213 -1.115 2.188 1.00 0.44 C ATOM 2734 O ARG A 194 21.377 -1.580 2.958 1.00 0.49 O ATOM 2735 CB ARG A 194 21.748 1.272 1.787 1.00 0.53 C ATOM 2736 CG ARG A 194 21.202 2.356 0.884 1.00 0.60 C ATOM 2737 CD ARG A 194 22.049 2.543 -0.361 1.00 0.65 C ATOM 2738 NE ARG A 194 23.400 3.003 -0.049 1.00 0.69 N ATOM 2739 CZ ARG A 194 24.230 3.505 -0.960 1.00 0.95 C ATOM 2740 NH1 ARG A 194 23.863 3.542 -2.234 1.00 1.25 N ATOM 2741 NH2 ARG A 194 25.426 3.956 -0.602 1.00 1.06 N ATOM 0 H ARG A 194 19.743 -0.436 1.217 1.00 0.46 H new ATOM 0 HA ARG A 194 22.545 -0.103 0.328 1.00 0.46 H new ATOM 0 HB2 ARG A 194 21.127 1.212 2.681 1.00 0.53 H new ATOM 0 HB3 ARG A 194 22.749 1.555 2.113 1.00 0.53 H new ATOM 0 HG2 ARG A 194 20.182 2.105 0.593 1.00 0.60 H new ATOM 0 HG3 ARG A 194 21.155 3.296 1.434 1.00 0.60 H new ATOM 0 HD2 ARG A 194 22.105 1.600 -0.904 1.00 0.65 H new ATOM 0 HD3 ARG A 194 21.566 3.263 -1.022 1.00 0.65 H new ATOM 0 HE ARG A 194 23.723 2.936 0.916 1.00 0.69 H new ATOM 0 HH11 ARG A 194 22.948 3.187 -2.512 1.00 1.25 H new ATOM 0 HH12 ARG A 194 24.496 3.926 -2.936 1.00 1.25 H new ATOM 0 HH21 ARG A 194 25.713 3.919 0.376 1.00 1.06 H new ATOM 0 HH22 ARG A 194 26.058 4.340 -1.305 1.00 1.06 H new ATOM 2755 N ARG A 195 23.487 -1.445 2.237 1.00 0.45 N ATOM 2756 CA ARG A 195 23.974 -2.320 3.277 1.00 0.50 C ATOM 2757 C ARG A 195 24.313 -1.500 4.514 1.00 0.55 C ATOM 2758 O ARG A 195 25.409 -0.960 4.642 1.00 0.64 O ATOM 2759 CB ARG A 195 25.184 -3.127 2.811 1.00 0.59 C ATOM 2760 CG ARG A 195 25.336 -4.426 3.575 1.00 1.02 C ATOM 2761 CD ARG A 195 26.500 -5.257 3.076 1.00 1.07 C ATOM 2762 NE ARG A 195 26.400 -6.636 3.544 1.00 1.49 N ATOM 2763 CZ ARG A 195 26.615 -7.697 2.772 1.00 2.13 C ATOM 2764 NH1 ARG A 195 27.088 -7.544 1.540 1.00 2.34 N ATOM 2765 NH2 ARG A 195 26.369 -8.913 3.238 1.00 2.68 N ATOM 0 H ARG A 195 24.195 -1.124 1.576 1.00 0.45 H new ATOM 0 HA ARG A 195 23.189 -3.034 3.524 1.00 0.50 H new ATOM 0 HB2 ARG A 195 25.086 -3.343 1.747 1.00 0.59 H new ATOM 0 HB3 ARG A 195 26.087 -2.528 2.933 1.00 0.59 H new ATOM 0 HG2 ARG A 195 25.477 -4.207 4.634 1.00 1.02 H new ATOM 0 HG3 ARG A 195 24.416 -5.005 3.489 1.00 1.02 H new ATOM 0 HD2 ARG A 195 26.522 -5.240 1.986 1.00 1.07 H new ATOM 0 HD3 ARG A 195 27.437 -4.820 3.421 1.00 1.07 H new ATOM 0 HE ARG A 195 26.151 -6.795 4.520 1.00 1.49 H new ATOM 0 HH11 ARG A 195 27.288 -6.610 1.183 1.00 2.34 H new ATOM 0 HH12 ARG A 195 27.251 -8.361 0.951 1.00 2.34 H new ATOM 0 HH21 ARG A 195 26.015 -9.034 4.187 1.00 2.68 H new ATOM 0 HH22 ARG A 195 26.533 -9.728 2.648 1.00 2.68 H new ATOM 2779 N LYS A 196 23.334 -1.376 5.395 1.00 0.60 N ATOM 2780 CA LYS A 196 23.482 -0.636 6.640 1.00 0.69 C ATOM 2781 C LYS A 196 24.588 -1.249 7.495 1.00 0.76 C ATOM 2782 O LYS A 196 25.454 -0.543 8.016 1.00 0.88 O ATOM 2783 CB LYS A 196 22.146 -0.647 7.395 1.00 0.75 C ATOM 2784 CG LYS A 196 22.195 -0.040 8.788 1.00 0.88 C ATOM 2785 CD LYS A 196 22.641 1.410 8.765 1.00 1.28 C ATOM 2786 CE LYS A 196 22.547 2.038 10.146 1.00 1.65 C ATOM 2787 NZ LYS A 196 21.139 2.298 10.542 1.00 2.15 N ATOM 0 H LYS A 196 22.409 -1.787 5.267 1.00 0.60 H new ATOM 0 HA LYS A 196 23.760 0.394 6.419 1.00 0.69 H new ATOM 0 HB2 LYS A 196 21.407 -0.106 6.804 1.00 0.75 H new ATOM 0 HB3 LYS A 196 21.799 -1.677 7.475 1.00 0.75 H new ATOM 0 HG2 LYS A 196 21.209 -0.108 9.247 1.00 0.88 H new ATOM 0 HG3 LYS A 196 22.877 -0.619 9.411 1.00 0.88 H new ATOM 0 HD2 LYS A 196 23.668 1.471 8.404 1.00 1.28 H new ATOM 0 HD3 LYS A 196 22.023 1.972 8.065 1.00 1.28 H new ATOM 0 HE2 LYS A 196 23.014 1.378 10.877 1.00 1.65 H new ATOM 0 HE3 LYS A 196 23.106 2.974 10.158 1.00 1.65 H new ATOM 0 HZ1 LYS A 196 21.122 2.847 11.425 1.00 2.15 H new ATOM 0 HZ2 LYS A 196 20.661 2.836 9.791 1.00 2.15 H new ATOM 0 HZ3 LYS A 196 20.647 1.394 10.687 1.00 2.15 H new ATOM 2801 N PHE A 197 24.557 -2.564 7.626 1.00 0.77 N ATOM 2802 CA PHE A 197 25.571 -3.278 8.379 1.00 0.89 C ATOM 2803 C PHE A 197 26.588 -3.874 7.427 1.00 0.96 C ATOM 2804 O PHE A 197 26.233 -4.368 6.363 1.00 0.92 O ATOM 2805 CB PHE A 197 24.953 -4.387 9.225 1.00 0.95 C ATOM 2806 CG PHE A 197 23.819 -3.928 10.099 1.00 0.94 C ATOM 2807 CD1 PHE A 197 23.893 -2.730 10.795 1.00 1.14 C ATOM 2808 CD2 PHE A 197 22.674 -4.693 10.210 1.00 0.92 C ATOM 2809 CE1 PHE A 197 22.841 -2.310 11.587 1.00 1.19 C ATOM 2810 CE2 PHE A 197 21.621 -4.281 10.997 1.00 0.95 C ATOM 2811 CZ PHE A 197 21.702 -3.087 11.688 1.00 1.03 C ATOM 0 H PHE A 197 23.837 -3.160 7.218 1.00 0.77 H new ATOM 0 HA PHE A 197 26.059 -2.569 9.048 1.00 0.89 H new ATOM 0 HB2 PHE A 197 24.593 -5.176 8.565 1.00 0.95 H new ATOM 0 HB3 PHE A 197 25.728 -4.826 9.853 1.00 0.95 H new ATOM 0 HD1 PHE A 197 24.781 -2.120 10.717 1.00 1.14 H new ATOM 0 HD2 PHE A 197 22.603 -5.627 9.672 1.00 0.92 H new ATOM 0 HE1 PHE A 197 22.909 -1.377 12.126 1.00 1.19 H new ATOM 0 HE2 PHE A 197 20.733 -4.891 11.074 1.00 0.95 H new ATOM 0 HZ PHE A 197 20.878 -2.762 12.305 1.00 1.03 H new ATOM 2821 N PHE A 198 27.845 -3.842 7.815 1.00 1.16 N ATOM 2822 CA PHE A 198 28.914 -4.282 6.934 1.00 1.33 C ATOM 2823 C PHE A 198 29.677 -5.462 7.523 1.00 1.58 C ATOM 2824 O PHE A 198 30.909 -5.494 7.483 1.00 2.05 O ATOM 2825 CB PHE A 198 29.876 -3.127 6.646 1.00 1.51 C ATOM 2826 CG PHE A 198 29.324 -2.093 5.704 1.00 1.40 C ATOM 2827 CD1 PHE A 198 29.288 -2.333 4.340 1.00 1.61 C ATOM 2828 CD2 PHE A 198 28.848 -0.883 6.180 1.00 1.53 C ATOM 2829 CE1 PHE A 198 28.788 -1.385 3.470 1.00 1.95 C ATOM 2830 CE2 PHE A 198 28.348 0.070 5.314 1.00 1.78 C ATOM 2831 CZ PHE A 198 28.318 -0.182 3.957 1.00 2.00 C ATOM 0 H PHE A 198 28.155 -3.518 8.731 1.00 1.16 H new ATOM 0 HA PHE A 198 28.457 -4.610 6.000 1.00 1.33 H new ATOM 0 HB2 PHE A 198 30.139 -2.643 7.587 1.00 1.51 H new ATOM 0 HB3 PHE A 198 30.797 -3.531 6.227 1.00 1.51 H new ATOM 0 HD1 PHE A 198 29.655 -3.272 3.953 1.00 1.61 H new ATOM 0 HD2 PHE A 198 28.868 -0.682 7.241 1.00 1.53 H new ATOM 0 HE1 PHE A 198 28.765 -1.584 2.409 1.00 1.95 H new ATOM 0 HE2 PHE A 198 27.981 1.011 5.698 1.00 1.78 H new ATOM 0 HZ PHE A 198 27.927 0.561 3.277 1.00 2.00 H new ATOM 2841 N TYR A 199 28.954 -6.436 8.063 1.00 1.48 N ATOM 2842 CA TYR A 199 29.598 -7.651 8.539 1.00 1.79 C ATOM 2843 C TYR A 199 29.576 -8.719 7.453 1.00 2.06 C ATOM 2844 O TYR A 199 30.333 -9.684 7.508 1.00 2.27 O ATOM 2845 CB TYR A 199 28.979 -8.162 9.850 1.00 2.08 C ATOM 2846 CG TYR A 199 27.509 -8.531 9.803 1.00 2.04 C ATOM 2847 CD1 TYR A 199 27.102 -9.827 9.506 1.00 2.35 C ATOM 2848 CD2 TYR A 199 26.533 -7.594 10.109 1.00 2.05 C ATOM 2849 CE1 TYR A 199 25.766 -10.173 9.517 1.00 2.78 C ATOM 2850 CE2 TYR A 199 25.194 -7.932 10.113 1.00 2.47 C ATOM 2851 CZ TYR A 199 24.816 -9.224 9.820 1.00 2.89 C ATOM 2852 OH TYR A 199 23.485 -9.573 9.842 1.00 3.53 O ATOM 0 H TYR A 199 27.941 -6.410 8.180 1.00 1.48 H new ATOM 0 HA TYR A 199 30.637 -7.411 8.765 1.00 1.79 H new ATOM 0 HB2 TYR A 199 29.541 -9.038 10.174 1.00 2.08 H new ATOM 0 HB3 TYR A 199 29.115 -7.396 10.613 1.00 2.08 H new ATOM 0 HD1 TYR A 199 27.843 -10.574 9.263 1.00 2.35 H new ATOM 0 HD2 TYR A 199 26.825 -6.582 10.348 1.00 2.05 H new ATOM 0 HE1 TYR A 199 25.467 -11.185 9.289 1.00 2.78 H new ATOM 0 HE2 TYR A 199 24.447 -7.187 10.345 1.00 2.47 H new ATOM 0 HH TYR A 199 22.945 -8.789 10.074 1.00 3.53 H new ATOM 2862 N SER A 200 28.710 -8.523 6.461 1.00 2.43 N ATOM 2863 CA SER A 200 28.686 -9.364 5.267 1.00 3.08 C ATOM 2864 C SER A 200 28.411 -10.823 5.617 1.00 3.06 C ATOM 2865 O SER A 200 29.161 -11.716 5.219 1.00 3.33 O ATOM 2866 CB SER A 200 30.016 -9.242 4.520 1.00 3.56 C ATOM 2867 OG SER A 200 30.422 -7.886 4.428 1.00 4.12 O ATOM 0 H SER A 200 28.009 -7.782 6.462 1.00 2.43 H new ATOM 0 HA SER A 200 27.876 -9.018 4.625 1.00 3.08 H new ATOM 0 HB2 SER A 200 30.782 -9.821 5.036 1.00 3.56 H new ATOM 0 HB3 SER A 200 29.916 -9.665 3.520 1.00 3.56 H new ATOM 0 HG SER A 200 31.275 -7.832 3.948 1.00 4.12 H new ATOM 2873 N ASP A 201 27.337 -11.049 6.372 1.00 2.98 N ATOM 2874 CA ASP A 201 26.941 -12.395 6.798 1.00 3.19 C ATOM 2875 C ASP A 201 27.986 -13.005 7.744 1.00 3.05 C ATOM 2876 O ASP A 201 27.886 -14.164 8.146 1.00 3.25 O ATOM 2877 CB ASP A 201 26.713 -13.284 5.559 1.00 3.87 C ATOM 2878 CG ASP A 201 26.262 -14.698 5.882 1.00 4.29 C ATOM 2879 OD1 ASP A 201 25.071 -14.891 6.196 1.00 4.89 O ATOM 2880 OD2 ASP A 201 27.089 -15.632 5.785 1.00 4.31 O ATOM 0 H ASP A 201 26.718 -10.310 6.705 1.00 2.98 H new ATOM 0 HA ASP A 201 26.006 -12.330 7.355 1.00 3.19 H new ATOM 0 HB2 ASP A 201 25.966 -12.813 4.920 1.00 3.87 H new ATOM 0 HB3 ASP A 201 27.638 -13.332 4.985 1.00 3.87 H new ATOM 2885 N GLN A 202 28.980 -12.211 8.113 1.00 3.02 N ATOM 2886 CA GLN A 202 30.030 -12.665 9.003 1.00 3.45 C ATOM 2887 C GLN A 202 30.076 -11.794 10.254 1.00 3.85 C ATOM 2888 O GLN A 202 30.819 -10.792 10.262 1.00 4.18 O ATOM 2889 CB GLN A 202 31.382 -12.645 8.282 1.00 3.65 C ATOM 2890 CG GLN A 202 32.514 -13.254 9.092 1.00 4.42 C ATOM 2891 CD GLN A 202 32.232 -14.688 9.489 1.00 5.07 C ATOM 2892 OE1 GLN A 202 32.569 -15.625 8.764 1.00 5.73 O ATOM 2893 NE2 GLN A 202 31.606 -14.867 10.641 1.00 5.30 N ATOM 2894 OXT GLN A 202 29.361 -12.116 11.225 1.00 4.27 O ATOM 0 H GLN A 202 29.079 -11.243 7.806 1.00 3.02 H new ATOM 0 HA GLN A 202 29.815 -13.690 9.305 1.00 3.45 H new ATOM 0 HB2 GLN A 202 31.290 -13.185 7.340 1.00 3.65 H new ATOM 0 HB3 GLN A 202 31.637 -11.614 8.035 1.00 3.65 H new ATOM 0 HG2 GLN A 202 33.435 -13.215 8.511 1.00 4.42 H new ATOM 0 HG3 GLN A 202 32.678 -12.657 9.989 1.00 4.42 H new ATOM 0 HE21 GLN A 202 31.345 -14.062 11.210 1.00 5.30 H new ATOM 0 HE22 GLN A 202 31.384 -15.810 10.960 1.00 5.30 H new TER 2903 GLN A 202