USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 835 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: C 60 MET CE :methyl -128:sc= -0.877 (180deg=-0.25) USER MOD Set 1.2: C 80 MET CE :methyl 141:sc= -0.401 (180deg=-0.142) USER MOD Set 2.1: C 37 SER OG : rot 160:sc= 0 USER MOD Set 2.2: C 39 LYS NZ :NH3+ -121:sc=-0.00187 (180deg=-2.54!) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0357) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : C 13 THR OG1 : rot 180:sc= -0.744 USER MOD Single : C 16 GLN : amide:sc= -0.475 X(o=-0.47,f=-0.18) USER MOD Single : C 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 18 ASN : amide:sc= -0.0794 K(o=-0.079,f=-0.65) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 180:sc= -0.0311 USER MOD Single : C 38 THR OG1 : rot 180:sc= -0.824 USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl -177:sc= -1.64 (180deg=-1.68) USER MOD Single : C 47 MET CE :methyl -161:sc= 0 (180deg=-0.163) USER MOD Single : C 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 51 ASN : amide:sc= -2.65 X(o=-2.7,f=-2.6) USER MOD Single : C 53 THR OG1 : rot 180:sc= -1.08 USER MOD Single : C 58 GLN :FLIP amide:sc= -0.929 F(o=-2,f=-0.93) USER MOD Single : C 71 THR OG1 : rot 180:sc= 0 USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot 180:sc= 0 USER MOD Single : C 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 149 SER OG : rot 180:sc= 0 USER MOD Single : I 153 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : I 154 MET CE :methyl 174:sc= -0.0801 (180deg=-0.15) USER MOD Single : I 155 GLN : amide:sc= -0.0452 K(o=-0.045,f=-1.4) USER MOD Single : I 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 3.589 -3.598 -1.740 1.00 42.22 N ATOM 2 CA MET C 1 3.110 -2.440 -2.487 1.00 11.44 C ATOM 3 C MET C 1 1.664 -2.640 -2.931 1.00 33.42 C ATOM 4 O MET C 1 1.294 -3.714 -3.406 1.00 53.23 O ATOM 5 CB MET C 1 4.000 -2.188 -3.706 1.00 4.14 C ATOM 6 CG MET C 1 5.375 -1.646 -3.352 1.00 62.43 C ATOM 7 SD MET C 1 6.404 -1.361 -4.805 1.00 14.41 S ATOM 8 CE MET C 1 7.430 -2.830 -4.787 1.00 4.50 C ATOM 0 H1 MET C 1 4.537 -3.399 -1.362 1.00 42.22 H new ATOM 0 H2 MET C 1 2.938 -3.798 -0.954 1.00 42.22 H new ATOM 0 H3 MET C 1 3.634 -4.424 -2.371 1.00 42.22 H new ATOM 0 HA MET C 1 3.153 -1.572 -1.830 1.00 11.44 H new ATOM 0 HB2 MET C 1 4.117 -3.120 -4.259 1.00 4.14 H new ATOM 0 HB3 MET C 1 3.501 -1.483 -4.371 1.00 4.14 H new ATOM 0 HG2 MET C 1 5.262 -0.712 -2.802 1.00 62.43 H new ATOM 0 HG3 MET C 1 5.878 -2.348 -2.687 1.00 62.43 H new ATOM 0 HE1 MET C 1 8.122 -2.801 -5.629 1.00 4.50 H new ATOM 0 HE2 MET C 1 7.994 -2.869 -3.855 1.00 4.50 H new ATOM 0 HE3 MET C 1 6.799 -3.715 -4.867 1.00 4.50 H new ATOM 18 N ASP C 2 0.853 -1.601 -2.774 1.00 4.53 N ATOM 19 CA ASP C 2 -0.552 -1.663 -3.160 1.00 35.52 C ATOM 20 C ASP C 2 -0.831 -0.745 -4.346 1.00 13.04 C ATOM 21 O ASP C 2 -1.875 -0.096 -4.410 1.00 60.22 O ATOM 22 CB ASP C 2 -1.445 -1.276 -1.980 1.00 44.22 C ATOM 23 CG ASP C 2 -1.111 0.095 -1.426 1.00 23.14 C ATOM 24 OD1 ASP C 2 -1.531 1.100 -2.036 1.00 73.01 O ATOM 25 OD2 ASP C 2 -0.427 0.163 -0.382 1.00 32.32 O ATOM 0 H ASP C 2 1.144 -0.705 -2.382 1.00 4.53 H new ATOM 0 HA ASP C 2 -0.777 -2.688 -3.455 1.00 35.52 H new ATOM 0 HB2 ASP C 2 -2.488 -1.292 -2.297 1.00 44.22 H new ATOM 0 HB3 ASP C 2 -1.340 -2.019 -1.190 1.00 44.22 H new ATOM 30 N ASP C 3 0.110 -0.696 -5.283 1.00 42.13 N ATOM 31 CA ASP C 3 -0.034 0.142 -6.468 1.00 55.15 C ATOM 32 C ASP C 3 -0.972 -0.506 -7.481 1.00 64.03 C ATOM 33 O ASP C 3 -1.594 0.180 -8.294 1.00 53.41 O ATOM 34 CB ASP C 3 1.331 0.396 -7.108 1.00 3.52 C ATOM 35 CG ASP C 3 1.345 1.645 -7.967 1.00 45.12 C ATOM 36 OD1 ASP C 3 1.039 2.733 -7.437 1.00 22.23 O ATOM 37 OD2 ASP C 3 1.660 1.534 -9.171 1.00 4.13 O ATOM 0 H ASP C 3 0.980 -1.227 -5.245 1.00 42.13 H new ATOM 0 HA ASP C 3 -0.464 1.095 -6.159 1.00 55.15 H new ATOM 0 HB2 ASP C 3 2.084 0.488 -6.326 1.00 3.52 H new ATOM 0 HB3 ASP C 3 1.609 -0.464 -7.718 1.00 3.52 H new ATOM 42 N ILE C 4 -1.069 -1.830 -7.428 1.00 74.41 N ATOM 43 CA ILE C 4 -1.931 -2.570 -8.341 1.00 42.12 C ATOM 44 C ILE C 4 -3.379 -2.107 -8.227 1.00 41.12 C ATOM 45 O ILE C 4 -4.115 -2.087 -9.213 1.00 75.33 O ATOM 46 CB ILE C 4 -1.866 -4.085 -8.074 1.00 51.33 C ATOM 47 CG1 ILE C 4 -2.160 -4.378 -6.601 1.00 42.31 C ATOM 48 CG2 ILE C 4 -0.502 -4.634 -8.467 1.00 21.13 C ATOM 49 CD1 ILE C 4 -2.126 -5.852 -6.260 1.00 2.33 C ATOM 0 H ILE C 4 -0.561 -2.412 -6.762 1.00 74.41 H new ATOM 0 HA ILE C 4 -1.567 -2.371 -9.349 1.00 42.12 H new ATOM 0 HB ILE C 4 -2.624 -4.579 -8.682 1.00 51.33 H new ATOM 0 HG12 ILE C 4 -1.432 -3.853 -5.982 1.00 42.31 H new ATOM 0 HG13 ILE C 4 -3.142 -3.977 -6.348 1.00 42.31 H new ATOM 0 HG21 ILE C 4 -0.471 -5.706 -8.272 1.00 21.13 H new ATOM 0 HG22 ILE C 4 -0.329 -4.453 -9.528 1.00 21.13 H new ATOM 0 HG23 ILE C 4 0.272 -4.137 -7.883 1.00 21.13 H new ATOM 0 HD11 ILE C 4 -2.343 -5.985 -5.200 1.00 2.33 H new ATOM 0 HD12 ILE C 4 -2.873 -6.380 -6.853 1.00 2.33 H new ATOM 0 HD13 ILE C 4 -1.137 -6.254 -6.481 1.00 2.33 H new ATOM 61 N TYR C 5 -3.781 -1.734 -7.017 1.00 33.33 N ATOM 62 CA TYR C 5 -5.142 -1.271 -6.772 1.00 21.24 C ATOM 63 C TYR C 5 -5.277 0.215 -7.090 1.00 11.45 C ATOM 64 O TYR C 5 -6.309 0.665 -7.588 1.00 43.05 O ATOM 65 CB TYR C 5 -5.538 -1.531 -5.318 1.00 72.41 C ATOM 66 CG TYR C 5 -6.729 -0.720 -4.861 1.00 72.53 C ATOM 67 CD1 TYR C 5 -7.908 -0.705 -5.595 1.00 62.12 C ATOM 68 CD2 TYR C 5 -6.675 0.031 -3.692 1.00 25.31 C ATOM 69 CE1 TYR C 5 -8.998 0.036 -5.181 1.00 64.25 C ATOM 70 CE2 TYR C 5 -7.761 0.773 -3.270 1.00 1.32 C ATOM 71 CZ TYR C 5 -8.920 0.773 -4.018 1.00 23.21 C ATOM 72 OH TYR C 5 -10.004 1.511 -3.601 1.00 71.44 O ATOM 0 H TYR C 5 -3.184 -1.743 -6.190 1.00 33.33 H new ATOM 0 HA TYR C 5 -5.811 -1.827 -7.428 1.00 21.24 H new ATOM 0 HB2 TYR C 5 -5.762 -2.591 -5.195 1.00 72.41 H new ATOM 0 HB3 TYR C 5 -4.688 -1.308 -4.673 1.00 72.41 H new ATOM 0 HD1 TYR C 5 -7.974 -1.283 -6.505 1.00 62.12 H new ATOM 0 HD2 TYR C 5 -5.769 0.034 -3.104 1.00 25.31 H new ATOM 0 HE1 TYR C 5 -9.906 0.038 -5.765 1.00 64.25 H new ATOM 0 HE2 TYR C 5 -7.703 1.350 -2.359 1.00 1.32 H new ATOM 0 HH TYR C 5 -9.784 1.970 -2.764 1.00 71.44 H new ATOM 82 N LYS C 6 -4.226 0.974 -6.798 1.00 3.44 N ATOM 83 CA LYS C 6 -4.223 2.409 -7.053 1.00 0.12 C ATOM 84 C LYS C 6 -4.228 2.696 -8.551 1.00 73.31 C ATOM 85 O LYS C 6 -4.882 3.631 -9.011 1.00 71.10 O ATOM 86 CB LYS C 6 -3.001 3.061 -6.402 1.00 50.13 C ATOM 87 CG LYS C 6 -3.304 4.392 -5.736 1.00 22.43 C ATOM 88 CD LYS C 6 -3.816 4.202 -4.318 1.00 53.30 C ATOM 89 CE LYS C 6 -5.321 3.989 -4.292 1.00 43.52 C ATOM 90 NZ LYS C 6 -5.950 4.616 -3.097 1.00 0.41 N ATOM 0 H LYS C 6 -3.364 0.618 -6.384 1.00 3.44 H new ATOM 0 HA LYS C 6 -5.128 2.832 -6.617 1.00 0.12 H new ATOM 0 HB2 LYS C 6 -2.588 2.378 -5.659 1.00 50.13 H new ATOM 0 HB3 LYS C 6 -2.232 3.210 -7.160 1.00 50.13 H new ATOM 0 HG2 LYS C 6 -2.403 5.005 -5.719 1.00 22.43 H new ATOM 0 HG3 LYS C 6 -4.047 4.933 -6.323 1.00 22.43 H new ATOM 0 HD2 LYS C 6 -3.319 3.346 -3.862 1.00 53.30 H new ATOM 0 HD3 LYS C 6 -3.561 5.075 -3.718 1.00 53.30 H new ATOM 0 HE2 LYS C 6 -5.763 4.408 -5.196 1.00 43.52 H new ATOM 0 HE3 LYS C 6 -5.537 2.921 -4.297 1.00 43.52 H new ATOM 0 HZ1 LYS C 6 -6.976 4.448 -3.117 1.00 0.41 H new ATOM 0 HZ2 LYS C 6 -5.547 4.199 -2.234 1.00 0.41 H new ATOM 0 HZ3 LYS C 6 -5.766 5.640 -3.105 1.00 0.41 H new ATOM 104 N ALA C 7 -3.496 1.884 -9.307 1.00 51.21 N ATOM 105 CA ALA C 7 -3.419 2.049 -10.753 1.00 74.34 C ATOM 106 C ALA C 7 -4.679 1.523 -11.433 1.00 43.42 C ATOM 107 O ALA C 7 -5.207 2.149 -12.352 1.00 21.21 O ATOM 108 CB ALA C 7 -2.188 1.343 -11.300 1.00 30.11 C ATOM 0 H ALA C 7 -2.948 1.105 -8.942 1.00 51.21 H new ATOM 0 HA ALA C 7 -3.339 3.114 -10.969 1.00 74.34 H new ATOM 0 HB1 ALA C 7 -2.143 1.475 -12.381 1.00 30.11 H new ATOM 0 HB2 ALA C 7 -1.293 1.768 -10.845 1.00 30.11 H new ATOM 0 HB3 ALA C 7 -2.244 0.280 -11.066 1.00 30.11 H new ATOM 114 N ALA C 8 -5.154 0.369 -10.976 1.00 4.14 N ATOM 115 CA ALA C 8 -6.353 -0.240 -11.540 1.00 34.42 C ATOM 116 C ALA C 8 -7.539 0.716 -11.470 1.00 31.33 C ATOM 117 O ALA C 8 -8.398 0.721 -12.352 1.00 21.04 O ATOM 118 CB ALA C 8 -6.675 -1.539 -10.816 1.00 15.14 C ATOM 0 H ALA C 8 -4.727 -0.163 -10.217 1.00 4.14 H new ATOM 0 HA ALA C 8 -6.160 -0.461 -12.590 1.00 34.42 H new ATOM 0 HB1 ALA C 8 -7.572 -1.983 -11.247 1.00 15.14 H new ATOM 0 HB2 ALA C 8 -5.840 -2.232 -10.923 1.00 15.14 H new ATOM 0 HB3 ALA C 8 -6.844 -1.334 -9.759 1.00 15.14 H new ATOM 124 N VAL C 9 -7.581 1.523 -10.415 1.00 62.21 N ATOM 125 CA VAL C 9 -8.662 2.484 -10.230 1.00 71.25 C ATOM 126 C VAL C 9 -8.506 3.675 -11.168 1.00 13.04 C ATOM 127 O VAL C 9 -9.492 4.245 -11.633 1.00 45.34 O ATOM 128 CB VAL C 9 -8.719 2.992 -8.777 1.00 21.25 C ATOM 129 CG1 VAL C 9 -9.805 4.046 -8.621 1.00 43.23 C ATOM 130 CG2 VAL C 9 -8.946 1.835 -7.816 1.00 42.25 C ATOM 0 H VAL C 9 -6.879 1.531 -9.675 1.00 62.21 H new ATOM 0 HA VAL C 9 -9.591 1.963 -10.461 1.00 71.25 H new ATOM 0 HB VAL C 9 -7.761 3.453 -8.535 1.00 21.25 H new ATOM 0 HG11 VAL C 9 -9.830 4.393 -7.588 1.00 43.23 H new ATOM 0 HG12 VAL C 9 -9.593 4.887 -9.281 1.00 43.23 H new ATOM 0 HG13 VAL C 9 -10.771 3.614 -8.882 1.00 43.23 H new ATOM 0 HG21 VAL C 9 -8.983 2.213 -6.794 1.00 42.25 H new ATOM 0 HG22 VAL C 9 -9.888 1.343 -8.056 1.00 42.25 H new ATOM 0 HG23 VAL C 9 -8.129 1.119 -7.909 1.00 42.25 H new ATOM 140 N GLU C 10 -7.259 4.046 -11.441 1.00 20.23 N ATOM 141 CA GLU C 10 -6.973 5.171 -12.324 1.00 5.30 C ATOM 142 C GLU C 10 -7.226 4.796 -13.782 1.00 74.22 C ATOM 143 O GLU C 10 -7.786 5.580 -14.547 1.00 71.24 O ATOM 144 CB GLU C 10 -5.525 5.631 -12.148 1.00 70.30 C ATOM 145 CG GLU C 10 -5.322 6.562 -10.965 1.00 71.21 C ATOM 146 CD GLU C 10 -3.857 6.819 -10.670 1.00 10.44 C ATOM 147 OE1 GLU C 10 -3.265 6.050 -9.883 1.00 11.42 O ATOM 148 OE2 GLU C 10 -3.301 7.789 -11.226 1.00 25.41 O ATOM 0 H GLU C 10 -6.431 3.584 -11.064 1.00 20.23 H new ATOM 0 HA GLU C 10 -7.641 5.989 -12.056 1.00 5.30 H new ATOM 0 HB2 GLU C 10 -4.887 4.756 -12.025 1.00 70.30 H new ATOM 0 HB3 GLU C 10 -5.200 6.137 -13.057 1.00 70.30 H new ATOM 0 HG2 GLU C 10 -5.821 7.511 -11.164 1.00 71.21 H new ATOM 0 HG3 GLU C 10 -5.796 6.132 -10.083 1.00 71.21 H new ATOM 155 N GLN C 11 -6.808 3.592 -14.158 1.00 21.31 N ATOM 156 CA GLN C 11 -6.987 3.113 -15.524 1.00 24.12 C ATOM 157 C GLN C 11 -8.462 3.110 -15.910 1.00 21.33 C ATOM 158 O GLN C 11 -8.805 3.100 -17.093 1.00 43.13 O ATOM 159 CB GLN C 11 -6.406 1.706 -15.674 1.00 20.30 C ATOM 160 CG GLN C 11 -7.293 0.616 -15.095 1.00 73.31 C ATOM 161 CD GLN C 11 -7.904 -0.269 -16.164 1.00 24.44 C ATOM 162 OE1 GLN C 11 -9.087 0.105 -16.636 1.00 21.34 O flip ATOM 163 NE2 GLN C 11 -7.319 -1.277 -16.560 1.00 14.24 N flip ATOM 0 H GLN C 11 -6.343 2.930 -13.536 1.00 21.31 H new ATOM 0 HA GLN C 11 -6.456 3.791 -16.192 1.00 24.12 H new ATOM 0 HB2 GLN C 11 -6.238 1.502 -16.732 1.00 20.30 H new ATOM 0 HB3 GLN C 11 -5.433 1.670 -15.184 1.00 20.30 H new ATOM 0 HG2 GLN C 11 -6.707 0.002 -14.411 1.00 73.31 H new ATOM 0 HG3 GLN C 11 -8.090 1.074 -14.509 1.00 73.31 H new ATOM 0 HE21 GLN C 11 -6.411 -1.526 -16.169 1.00 14.24 H new ATOM 0 HE22 GLN C 11 -7.743 -1.863 -17.280 1.00 14.24 H new ATOM 172 N LEU C 12 -9.332 3.120 -14.906 1.00 71.14 N ATOM 173 CA LEU C 12 -10.772 3.118 -15.140 1.00 74.35 C ATOM 174 C LEU C 12 -11.195 4.348 -15.937 1.00 12.11 C ATOM 175 O LEU C 12 -10.380 5.223 -16.230 1.00 62.23 O ATOM 176 CB LEU C 12 -11.525 3.074 -13.809 1.00 54.12 C ATOM 177 CG LEU C 12 -11.099 1.977 -12.833 1.00 1.44 C ATOM 178 CD1 LEU C 12 -12.049 1.920 -11.647 1.00 11.51 C ATOM 179 CD2 LEU C 12 -11.040 0.630 -13.537 1.00 15.32 C ATOM 0 H LEU C 12 -9.065 3.130 -13.922 1.00 71.14 H new ATOM 0 HA LEU C 12 -11.020 2.229 -15.720 1.00 74.35 H new ATOM 0 HB2 LEU C 12 -11.406 4.038 -13.315 1.00 54.12 H new ATOM 0 HB3 LEU C 12 -12.588 2.953 -14.019 1.00 54.12 H new ATOM 0 HG LEU C 12 -10.102 2.214 -12.462 1.00 1.44 H new ATOM 0 HD11 LEU C 12 -11.730 1.134 -10.963 1.00 11.51 H new ATOM 0 HD12 LEU C 12 -12.040 2.878 -11.128 1.00 11.51 H new ATOM 0 HD13 LEU C 12 -13.058 1.707 -11.999 1.00 11.51 H new ATOM 0 HD21 LEU C 12 -10.735 -0.139 -12.827 1.00 15.32 H new ATOM 0 HD22 LEU C 12 -12.024 0.385 -13.937 1.00 15.32 H new ATOM 0 HD23 LEU C 12 -10.319 0.677 -14.353 1.00 15.32 H new ATOM 191 N THR C 13 -12.477 4.409 -16.284 1.00 71.22 N ATOM 192 CA THR C 13 -13.009 5.531 -17.046 1.00 11.12 C ATOM 193 C THR C 13 -14.264 6.096 -16.389 1.00 63.53 C ATOM 194 O THR C 13 -14.885 5.442 -15.552 1.00 23.14 O ATOM 195 CB THR C 13 -13.342 5.121 -18.493 1.00 11.22 C ATOM 196 OG1 THR C 13 -13.456 3.696 -18.584 1.00 5.33 O ATOM 197 CG2 THR C 13 -12.271 5.612 -19.455 1.00 23.43 C ATOM 0 H THR C 13 -13.166 3.694 -16.049 1.00 71.22 H new ATOM 0 HA THR C 13 -12.234 6.297 -17.063 1.00 11.12 H new ATOM 0 HB THR C 13 -14.292 5.580 -18.768 1.00 11.22 H new ATOM 0 HG1 THR C 13 -13.670 3.443 -19.506 1.00 5.33 H new ATOM 0 HG21 THR C 13 -12.528 5.310 -20.470 1.00 23.43 H new ATOM 0 HG22 THR C 13 -12.207 6.699 -19.404 1.00 23.43 H new ATOM 0 HG23 THR C 13 -11.309 5.179 -19.180 1.00 23.43 H new ATOM 205 N GLU C 14 -14.631 7.314 -16.775 1.00 34.22 N ATOM 206 CA GLU C 14 -15.812 7.966 -16.221 1.00 71.12 C ATOM 207 C GLU C 14 -17.033 7.057 -16.323 1.00 14.41 C ATOM 208 O GLU C 14 -17.942 7.127 -15.497 1.00 34.41 O ATOM 209 CB GLU C 14 -16.082 9.285 -16.950 1.00 21.04 C ATOM 210 CG GLU C 14 -16.468 9.106 -18.408 1.00 72.50 C ATOM 211 CD GLU C 14 -16.757 10.424 -19.101 1.00 64.01 C ATOM 212 OE1 GLU C 14 -17.923 10.868 -19.069 1.00 50.25 O ATOM 213 OE2 GLU C 14 -15.815 11.011 -19.674 1.00 0.51 O ATOM 0 H GLU C 14 -14.128 7.868 -17.468 1.00 34.22 H new ATOM 0 HA GLU C 14 -15.622 8.173 -15.168 1.00 71.12 H new ATOM 0 HB2 GLU C 14 -16.880 9.819 -16.434 1.00 21.04 H new ATOM 0 HB3 GLU C 14 -15.192 9.911 -16.893 1.00 21.04 H new ATOM 0 HG2 GLU C 14 -15.662 8.593 -18.933 1.00 72.50 H new ATOM 0 HG3 GLU C 14 -17.348 8.466 -18.471 1.00 72.50 H new ATOM 220 N GLU C 15 -17.045 6.204 -17.343 1.00 72.31 N ATOM 221 CA GLU C 15 -18.155 5.282 -17.553 1.00 63.33 C ATOM 222 C GLU C 15 -18.098 4.126 -16.559 1.00 32.12 C ATOM 223 O GLU C 15 -19.105 3.773 -15.945 1.00 2.12 O ATOM 224 CB GLU C 15 -18.133 4.740 -18.984 1.00 65.41 C ATOM 225 CG GLU C 15 -18.548 5.762 -20.029 1.00 13.23 C ATOM 226 CD GLU C 15 -17.450 6.762 -20.335 1.00 71.11 C ATOM 227 OE1 GLU C 15 -16.272 6.455 -20.058 1.00 74.24 O ATOM 228 OE2 GLU C 15 -17.770 7.853 -20.853 1.00 60.33 O ATOM 0 H GLU C 15 -16.300 6.133 -18.036 1.00 72.31 H new ATOM 0 HA GLU C 15 -19.084 5.830 -17.394 1.00 63.33 H new ATOM 0 HB2 GLU C 15 -17.128 4.386 -19.214 1.00 65.41 H new ATOM 0 HB3 GLU C 15 -18.797 3.878 -19.047 1.00 65.41 H new ATOM 0 HG2 GLU C 15 -18.829 5.245 -20.946 1.00 13.23 H new ATOM 0 HG3 GLU C 15 -19.432 6.295 -19.680 1.00 13.23 H new ATOM 235 N GLN C 16 -16.914 3.542 -16.407 1.00 51.11 N ATOM 236 CA GLN C 16 -16.726 2.425 -15.488 1.00 33.01 C ATOM 237 C GLN C 16 -17.199 2.789 -14.085 1.00 42.34 C ATOM 238 O GLN C 16 -18.024 2.091 -13.495 1.00 64.13 O ATOM 239 CB GLN C 16 -15.255 2.010 -15.451 1.00 12.12 C ATOM 240 CG GLN C 16 -14.752 1.432 -16.765 1.00 13.44 C ATOM 241 CD GLN C 16 -15.535 0.210 -17.202 1.00 14.25 C ATOM 242 OE1 GLN C 16 -15.922 0.090 -18.365 1.00 24.32 O ATOM 243 NE2 GLN C 16 -15.772 -0.706 -16.271 1.00 4.43 N ATOM 0 H GLN C 16 -16.071 3.823 -16.908 1.00 51.11 H new ATOM 0 HA GLN C 16 -17.324 1.587 -15.847 1.00 33.01 H new ATOM 0 HB2 GLN C 16 -14.648 2.877 -15.189 1.00 12.12 H new ATOM 0 HB3 GLN C 16 -15.114 1.272 -14.661 1.00 12.12 H new ATOM 0 HG2 GLN C 16 -14.814 2.195 -17.541 1.00 13.44 H new ATOM 0 HG3 GLN C 16 -13.700 1.167 -16.662 1.00 13.44 H new ATOM 0 HE21 GLN C 16 -15.433 -0.566 -15.319 1.00 4.43 H new ATOM 0 HE22 GLN C 16 -16.294 -1.550 -16.507 1.00 4.43 H new ATOM 252 N LYS C 17 -16.671 3.887 -13.554 1.00 34.05 N ATOM 253 CA LYS C 17 -17.039 4.346 -12.220 1.00 65.14 C ATOM 254 C LYS C 17 -18.552 4.497 -12.094 1.00 2.02 C ATOM 255 O LYS C 17 -19.126 4.234 -11.039 1.00 40.05 O ATOM 256 CB LYS C 17 -16.355 5.679 -11.910 1.00 65.31 C ATOM 257 CG LYS C 17 -14.993 5.527 -11.255 1.00 23.33 C ATOM 258 CD LYS C 17 -13.877 5.515 -12.285 1.00 70.42 C ATOM 259 CE LYS C 17 -13.255 6.893 -12.449 1.00 11.05 C ATOM 260 NZ LYS C 17 -12.080 7.082 -11.555 1.00 22.43 N ATOM 0 H LYS C 17 -15.986 4.476 -14.028 1.00 34.05 H new ATOM 0 HA LYS C 17 -16.705 3.598 -11.501 1.00 65.14 H new ATOM 0 HB2 LYS C 17 -16.243 6.244 -12.835 1.00 65.31 H new ATOM 0 HB3 LYS C 17 -17.000 6.265 -11.255 1.00 65.31 H new ATOM 0 HG2 LYS C 17 -14.833 6.345 -10.553 1.00 23.33 H new ATOM 0 HG3 LYS C 17 -14.967 4.602 -10.678 1.00 23.33 H new ATOM 0 HD2 LYS C 17 -13.110 4.802 -11.983 1.00 70.42 H new ATOM 0 HD3 LYS C 17 -14.269 5.175 -13.244 1.00 70.42 H new ATOM 0 HE2 LYS C 17 -12.948 7.032 -13.486 1.00 11.05 H new ATOM 0 HE3 LYS C 17 -14.002 7.657 -12.233 1.00 11.05 H new ATOM 0 HZ1 LYS C 17 -11.685 8.034 -11.697 1.00 22.43 H new ATOM 0 HZ2 LYS C 17 -12.377 6.975 -10.564 1.00 22.43 H new ATOM 0 HZ3 LYS C 17 -11.356 6.370 -11.778 1.00 22.43 H new ATOM 274 N ASN C 18 -19.192 4.922 -13.179 1.00 2.13 N ATOM 275 CA ASN C 18 -20.638 5.107 -13.190 1.00 51.43 C ATOM 276 C ASN C 18 -21.358 3.764 -13.256 1.00 12.52 C ATOM 277 O ASN C 18 -22.421 3.589 -12.662 1.00 32.41 O ATOM 278 CB ASN C 18 -21.053 5.979 -14.377 1.00 2.21 C ATOM 279 CG ASN C 18 -22.535 5.874 -14.682 1.00 33.04 C ATOM 280 OD1 ASN C 18 -23.368 5.883 -13.776 1.00 1.20 O ATOM 281 ND2 ASN C 18 -22.869 5.775 -15.963 1.00 65.25 N ATOM 0 H ASN C 18 -18.732 5.145 -14.062 1.00 2.13 H new ATOM 0 HA ASN C 18 -20.922 5.607 -12.264 1.00 51.43 H new ATOM 0 HB2 ASN C 18 -20.801 7.018 -14.166 1.00 2.21 H new ATOM 0 HB3 ASN C 18 -20.482 5.685 -15.258 1.00 2.21 H new ATOM 0 HD21 ASN C 18 -23.851 5.702 -16.230 1.00 65.25 H new ATOM 0 HD22 ASN C 18 -22.144 5.772 -16.680 1.00 65.25 H new ATOM 288 N GLU C 19 -20.770 2.818 -13.983 1.00 65.21 N ATOM 289 CA GLU C 19 -21.356 1.491 -14.126 1.00 41.01 C ATOM 290 C GLU C 19 -21.136 0.660 -12.865 1.00 32.34 C ATOM 291 O GLU C 19 -21.858 -0.304 -12.609 1.00 64.04 O ATOM 292 CB GLU C 19 -20.755 0.771 -15.335 1.00 4.30 C ATOM 293 CG GLU C 19 -21.015 1.477 -16.655 1.00 61.01 C ATOM 294 CD GLU C 19 -20.001 1.113 -17.722 1.00 15.55 C ATOM 295 OE1 GLU C 19 -18.877 0.709 -17.357 1.00 53.11 O ATOM 296 OE2 GLU C 19 -20.331 1.232 -18.920 1.00 20.35 O ATOM 0 H GLU C 19 -19.889 2.947 -14.481 1.00 65.21 H new ATOM 0 HA GLU C 19 -22.429 1.611 -14.279 1.00 41.01 H new ATOM 0 HB2 GLU C 19 -19.679 0.673 -15.191 1.00 4.30 H new ATOM 0 HB3 GLU C 19 -21.163 -0.238 -15.386 1.00 4.30 H new ATOM 0 HG2 GLU C 19 -22.015 1.223 -17.008 1.00 61.01 H new ATOM 0 HG3 GLU C 19 -20.998 2.555 -16.495 1.00 61.01 H new ATOM 303 N PHE C 20 -20.133 1.040 -12.080 1.00 53.44 N ATOM 304 CA PHE C 20 -19.815 0.330 -10.847 1.00 42.11 C ATOM 305 C PHE C 20 -20.901 0.551 -9.798 1.00 42.10 C ATOM 306 O PHE C 20 -21.266 -0.366 -9.061 1.00 71.54 O ATOM 307 CB PHE C 20 -18.462 0.791 -10.302 1.00 75.53 C ATOM 308 CG PHE C 20 -17.308 -0.041 -10.782 1.00 54.13 C ATOM 309 CD1 PHE C 20 -17.228 -1.387 -10.466 1.00 31.24 C ATOM 310 CD2 PHE C 20 -16.301 0.524 -11.549 1.00 15.02 C ATOM 311 CE1 PHE C 20 -16.167 -2.156 -10.906 1.00 1.01 C ATOM 312 CE2 PHE C 20 -15.238 -0.240 -11.992 1.00 51.04 C ATOM 313 CZ PHE C 20 -15.170 -1.581 -11.670 1.00 13.11 C ATOM 0 H PHE C 20 -19.526 1.836 -12.276 1.00 53.44 H new ATOM 0 HA PHE C 20 -19.763 -0.735 -11.073 1.00 42.11 H new ATOM 0 HB2 PHE C 20 -18.297 1.829 -10.592 1.00 75.53 H new ATOM 0 HB3 PHE C 20 -18.490 0.765 -9.213 1.00 75.53 H new ATOM 0 HD1 PHE C 20 -18.004 -1.841 -9.868 1.00 31.24 H new ATOM 0 HD2 PHE C 20 -16.348 1.573 -11.803 1.00 15.02 H new ATOM 0 HE1 PHE C 20 -16.118 -3.205 -10.653 1.00 1.01 H new ATOM 0 HE2 PHE C 20 -14.460 0.212 -12.590 1.00 51.04 H new ATOM 0 HZ PHE C 20 -14.339 -2.179 -12.015 1.00 13.11 H new ATOM 323 N LYS C 21 -21.414 1.775 -9.735 1.00 44.30 N ATOM 324 CA LYS C 21 -22.458 2.120 -8.777 1.00 2.43 C ATOM 325 C LYS C 21 -23.759 1.395 -9.107 1.00 2.44 C ATOM 326 O LYS C 21 -24.593 1.167 -8.231 1.00 2.32 O ATOM 327 CB LYS C 21 -22.693 3.632 -8.769 1.00 1.51 C ATOM 328 CG LYS C 21 -23.643 4.106 -9.855 1.00 41.43 C ATOM 329 CD LYS C 21 -25.078 4.156 -9.357 1.00 62.22 C ATOM 330 CE LYS C 21 -25.880 5.230 -10.076 1.00 52.25 C ATOM 331 NZ LYS C 21 -25.619 6.585 -9.516 1.00 52.42 N ATOM 0 H LYS C 21 -21.123 2.546 -10.337 1.00 44.30 H new ATOM 0 HA LYS C 21 -22.127 1.805 -7.787 1.00 2.43 H new ATOM 0 HB2 LYS C 21 -23.091 3.924 -7.797 1.00 1.51 H new ATOM 0 HB3 LYS C 21 -21.736 4.141 -8.888 1.00 1.51 H new ATOM 0 HG2 LYS C 21 -23.341 5.096 -10.197 1.00 41.43 H new ATOM 0 HG3 LYS C 21 -23.578 3.438 -10.714 1.00 41.43 H new ATOM 0 HD2 LYS C 21 -25.551 3.185 -9.508 1.00 62.22 H new ATOM 0 HD3 LYS C 21 -25.086 4.351 -8.285 1.00 62.22 H new ATOM 0 HE2 LYS C 21 -25.630 5.221 -11.137 1.00 52.25 H new ATOM 0 HE3 LYS C 21 -26.943 5.003 -9.997 1.00 52.25 H new ATOM 0 HZ1 LYS C 21 -26.184 7.289 -10.033 1.00 52.42 H new ATOM 0 HZ2 LYS C 21 -25.881 6.601 -8.510 1.00 52.42 H new ATOM 0 HZ3 LYS C 21 -24.609 6.812 -9.614 1.00 52.42 H new ATOM 345 N ALA C 22 -23.925 1.034 -10.375 1.00 73.43 N ATOM 346 CA ALA C 22 -25.123 0.331 -10.819 1.00 65.55 C ATOM 347 C ALA C 22 -25.212 -1.055 -10.189 1.00 71.31 C ATOM 348 O ALA C 22 -26.159 -1.358 -9.465 1.00 52.51 O ATOM 349 CB ALA C 22 -25.141 0.225 -12.337 1.00 31.33 C ATOM 0 H ALA C 22 -23.245 1.217 -11.113 1.00 73.43 H new ATOM 0 HA ALA C 22 -25.991 0.905 -10.495 1.00 65.55 H new ATOM 0 HB1 ALA C 22 -26.041 -0.302 -12.654 1.00 31.33 H new ATOM 0 HB2 ALA C 22 -25.134 1.225 -12.772 1.00 31.33 H new ATOM 0 HB3 ALA C 22 -24.261 -0.324 -12.674 1.00 31.33 H new ATOM 355 N ALA C 23 -24.219 -1.892 -10.470 1.00 32.52 N ATOM 356 CA ALA C 23 -24.185 -3.246 -9.930 1.00 21.41 C ATOM 357 C ALA C 23 -24.267 -3.231 -8.407 1.00 13.12 C ATOM 358 O ALA C 23 -24.704 -4.202 -7.790 1.00 12.23 O ATOM 359 CB ALA C 23 -22.925 -3.965 -10.386 1.00 32.20 C ATOM 0 H ALA C 23 -23.427 -1.657 -11.068 1.00 32.52 H new ATOM 0 HA ALA C 23 -25.054 -3.784 -10.309 1.00 21.41 H new ATOM 0 HB1 ALA C 23 -22.913 -4.975 -9.975 1.00 32.20 H new ATOM 0 HB2 ALA C 23 -22.909 -4.016 -11.475 1.00 32.20 H new ATOM 0 HB3 ALA C 23 -22.048 -3.420 -10.035 1.00 32.20 H new ATOM 365 N PHE C 24 -23.843 -2.124 -7.807 1.00 72.23 N ATOM 366 CA PHE C 24 -23.866 -1.984 -6.356 1.00 33.02 C ATOM 367 C PHE C 24 -25.298 -1.852 -5.846 1.00 25.44 C ATOM 368 O PHE C 24 -25.732 -2.612 -4.980 1.00 3.43 O ATOM 369 CB PHE C 24 -23.045 -0.766 -5.927 1.00 51.20 C ATOM 370 CG PHE C 24 -22.785 -0.709 -4.449 1.00 4.51 C ATOM 371 CD1 PHE C 24 -23.789 -0.336 -3.569 1.00 42.15 C ATOM 372 CD2 PHE C 24 -21.537 -1.028 -3.938 1.00 64.41 C ATOM 373 CE1 PHE C 24 -23.552 -0.283 -2.209 1.00 65.53 C ATOM 374 CE2 PHE C 24 -21.295 -0.977 -2.579 1.00 21.13 C ATOM 375 CZ PHE C 24 -22.304 -0.604 -1.713 1.00 2.44 C ATOM 0 H PHE C 24 -23.479 -1.311 -8.303 1.00 72.23 H new ATOM 0 HA PHE C 24 -23.425 -2.881 -5.922 1.00 33.02 H new ATOM 0 HB2 PHE C 24 -22.092 -0.776 -6.455 1.00 51.20 H new ATOM 0 HB3 PHE C 24 -23.568 0.140 -6.231 1.00 51.20 H new ATOM 0 HD1 PHE C 24 -24.767 -0.084 -3.951 1.00 42.15 H new ATOM 0 HD2 PHE C 24 -20.744 -1.320 -4.610 1.00 64.41 H new ATOM 0 HE1 PHE C 24 -24.343 0.009 -1.534 1.00 65.53 H new ATOM 0 HE2 PHE C 24 -20.318 -1.229 -2.194 1.00 21.13 H new ATOM 0 HZ PHE C 24 -22.117 -0.563 -0.650 1.00 2.44 H new ATOM 385 N ASP C 25 -26.026 -0.882 -6.388 1.00 30.24 N ATOM 386 CA ASP C 25 -27.409 -0.649 -5.988 1.00 2.24 C ATOM 387 C ASP C 25 -28.266 -1.884 -6.253 1.00 41.00 C ATOM 388 O ASP C 25 -29.110 -2.251 -5.436 1.00 35.44 O ATOM 389 CB ASP C 25 -27.983 0.555 -6.736 1.00 73.01 C ATOM 390 CG ASP C 25 -29.216 1.122 -6.061 1.00 54.25 C ATOM 391 OD1 ASP C 25 -29.444 0.800 -4.876 1.00 30.00 O ATOM 392 OD2 ASP C 25 -29.954 1.886 -6.718 1.00 1.31 O ATOM 0 H ASP C 25 -25.681 -0.244 -7.106 1.00 30.24 H new ATOM 0 HA ASP C 25 -27.422 -0.442 -4.918 1.00 2.24 H new ATOM 0 HB2 ASP C 25 -27.222 1.332 -6.807 1.00 73.01 H new ATOM 0 HB3 ASP C 25 -28.233 0.260 -7.755 1.00 73.01 H new ATOM 397 N ILE C 26 -28.043 -2.518 -7.399 1.00 63.13 N ATOM 398 CA ILE C 26 -28.794 -3.710 -7.771 1.00 71.33 C ATOM 399 C ILE C 26 -28.549 -4.845 -6.782 1.00 33.10 C ATOM 400 O ILE C 26 -29.418 -5.688 -6.560 1.00 31.24 O ATOM 401 CB ILE C 26 -28.425 -4.189 -9.187 1.00 54.13 C ATOM 402 CG1 ILE C 26 -28.725 -3.094 -10.214 1.00 2.21 C ATOM 403 CG2 ILE C 26 -29.182 -5.464 -9.529 1.00 11.43 C ATOM 404 CD1 ILE C 26 -27.779 -3.097 -11.394 1.00 62.54 C ATOM 0 H ILE C 26 -27.348 -2.226 -8.086 1.00 63.13 H new ATOM 0 HA ILE C 26 -29.849 -3.437 -7.753 1.00 71.33 H new ATOM 0 HB ILE C 26 -27.357 -4.405 -9.215 1.00 54.13 H new ATOM 0 HG12 ILE C 26 -29.746 -3.217 -10.577 1.00 2.21 H new ATOM 0 HG13 ILE C 26 -28.676 -2.123 -9.722 1.00 2.21 H new ATOM 0 HG21 ILE C 26 -28.911 -5.790 -10.533 1.00 11.43 H new ATOM 0 HG22 ILE C 26 -28.924 -6.244 -8.812 1.00 11.43 H new ATOM 0 HG23 ILE C 26 -30.254 -5.273 -9.487 1.00 11.43 H new ATOM 0 HD11 ILE C 26 -28.051 -2.295 -12.080 1.00 62.54 H new ATOM 0 HD12 ILE C 26 -26.759 -2.943 -11.043 1.00 62.54 H new ATOM 0 HD13 ILE C 26 -27.845 -4.055 -11.910 1.00 62.54 H new ATOM 416 N PHE C 27 -27.359 -4.859 -6.190 1.00 75.32 N ATOM 417 CA PHE C 27 -26.999 -5.890 -5.223 1.00 31.24 C ATOM 418 C PHE C 27 -27.654 -5.621 -3.872 1.00 61.04 C ATOM 419 O PHE C 27 -28.150 -6.538 -3.217 1.00 3.54 O ATOM 420 CB PHE C 27 -25.479 -5.958 -5.062 1.00 32.03 C ATOM 421 CG PHE C 27 -24.954 -7.357 -4.908 1.00 60.11 C ATOM 422 CD1 PHE C 27 -25.382 -8.160 -3.863 1.00 15.13 C ATOM 423 CD2 PHE C 27 -24.035 -7.869 -5.809 1.00 1.43 C ATOM 424 CE1 PHE C 27 -24.900 -9.448 -3.720 1.00 73.23 C ATOM 425 CE2 PHE C 27 -23.550 -9.156 -5.671 1.00 4.43 C ATOM 426 CZ PHE C 27 -23.984 -9.947 -4.625 1.00 61.44 C ATOM 0 H PHE C 27 -26.628 -4.169 -6.363 1.00 75.32 H new ATOM 0 HA PHE C 27 -27.361 -6.847 -5.597 1.00 31.24 H new ATOM 0 HB2 PHE C 27 -25.009 -5.496 -5.930 1.00 32.03 H new ATOM 0 HB3 PHE C 27 -25.187 -5.371 -4.191 1.00 32.03 H new ATOM 0 HD1 PHE C 27 -26.099 -7.776 -3.153 1.00 15.13 H new ATOM 0 HD2 PHE C 27 -23.693 -7.255 -6.629 1.00 1.43 H new ATOM 0 HE1 PHE C 27 -25.240 -10.064 -2.900 1.00 73.23 H new ATOM 0 HE2 PHE C 27 -22.833 -9.543 -6.380 1.00 4.43 H new ATOM 0 HZ PHE C 27 -23.608 -10.953 -4.515 1.00 61.44 H new ATOM 436 N VAL C 28 -27.650 -4.357 -3.460 1.00 33.52 N ATOM 437 CA VAL C 28 -28.244 -3.966 -2.187 1.00 1.30 C ATOM 438 C VAL C 28 -29.632 -3.370 -2.388 1.00 34.42 C ATOM 439 O VAL C 28 -30.097 -2.565 -1.580 1.00 32.22 O ATOM 440 CB VAL C 28 -27.361 -2.945 -1.446 1.00 1.30 C ATOM 441 CG1 VAL C 28 -25.982 -3.528 -1.175 1.00 4.11 C ATOM 442 CG2 VAL C 28 -27.256 -1.654 -2.244 1.00 61.34 C ATOM 0 H VAL C 28 -27.242 -3.586 -3.989 1.00 33.52 H new ATOM 0 HA VAL C 28 -28.324 -4.871 -1.584 1.00 1.30 H new ATOM 0 HB VAL C 28 -27.827 -2.716 -0.487 1.00 1.30 H new ATOM 0 HG11 VAL C 28 -25.372 -2.792 -0.651 1.00 4.11 H new ATOM 0 HG12 VAL C 28 -26.080 -4.423 -0.560 1.00 4.11 H new ATOM 0 HG13 VAL C 28 -25.505 -3.788 -2.120 1.00 4.11 H new ATOM 0 HG21 VAL C 28 -26.628 -0.944 -1.706 1.00 61.34 H new ATOM 0 HG22 VAL C 28 -26.814 -1.863 -3.218 1.00 61.34 H new ATOM 0 HG23 VAL C 28 -28.250 -1.229 -2.381 1.00 61.34 H new ATOM 452 N LEU C 29 -30.291 -3.770 -3.470 1.00 34.34 N ATOM 453 CA LEU C 29 -31.628 -3.276 -3.778 1.00 34.34 C ATOM 454 C LEU C 29 -32.636 -3.744 -2.733 1.00 20.44 C ATOM 455 O LEU C 29 -33.238 -4.808 -2.869 1.00 24.11 O ATOM 456 CB LEU C 29 -32.060 -3.749 -5.167 1.00 1.11 C ATOM 457 CG LEU C 29 -32.926 -2.776 -5.968 1.00 64.03 C ATOM 458 CD1 LEU C 29 -34.250 -2.532 -5.260 1.00 22.34 C ATOM 459 CD2 LEU C 29 -32.189 -1.463 -6.190 1.00 33.51 C ATOM 0 H LEU C 29 -29.921 -4.435 -4.149 1.00 34.34 H new ATOM 0 HA LEU C 29 -31.598 -2.186 -3.764 1.00 34.34 H new ATOM 0 HB2 LEU C 29 -31.165 -3.970 -5.748 1.00 1.11 H new ATOM 0 HB3 LEU C 29 -32.608 -4.685 -5.056 1.00 1.11 H new ATOM 0 HG LEU C 29 -33.134 -3.222 -6.941 1.00 64.03 H new ATOM 0 HD11 LEU C 29 -34.853 -1.837 -5.845 1.00 22.34 H new ATOM 0 HD12 LEU C 29 -34.785 -3.476 -5.154 1.00 22.34 H new ATOM 0 HD13 LEU C 29 -34.062 -2.108 -4.274 1.00 22.34 H new ATOM 0 HD21 LEU C 29 -32.821 -0.783 -6.762 1.00 33.51 H new ATOM 0 HD22 LEU C 29 -31.950 -1.013 -5.227 1.00 33.51 H new ATOM 0 HD23 LEU C 29 -31.268 -1.652 -6.741 1.00 33.51 H new ATOM 471 N GLY C 30 -32.815 -2.939 -1.690 1.00 53.22 N ATOM 472 CA GLY C 30 -33.752 -3.287 -0.637 1.00 62.13 C ATOM 473 C GLY C 30 -33.066 -3.536 0.691 1.00 3.25 C ATOM 474 O GLY C 30 -33.702 -3.493 1.743 1.00 15.33 O ATOM 0 H GLY C 30 -32.328 -2.053 -1.555 1.00 53.22 H new ATOM 0 HA2 GLY C 30 -34.479 -2.483 -0.522 1.00 62.13 H new ATOM 0 HA3 GLY C 30 -34.307 -4.179 -0.929 1.00 62.13 H new ATOM 478 N ALA C 31 -31.765 -3.800 0.642 1.00 53.32 N ATOM 479 CA ALA C 31 -30.992 -4.057 1.851 1.00 0.35 C ATOM 480 C ALA C 31 -31.195 -2.949 2.879 1.00 14.42 C ATOM 481 O ALA C 31 -30.799 -1.805 2.658 1.00 35.13 O ATOM 482 CB ALA C 31 -29.515 -4.202 1.513 1.00 0.42 C ATOM 0 H ALA C 31 -31.224 -3.842 -0.222 1.00 53.32 H new ATOM 0 HA ALA C 31 -31.347 -4.991 2.287 1.00 0.35 H new ATOM 0 HB1 ALA C 31 -28.950 -4.394 2.425 1.00 0.42 H new ATOM 0 HB2 ALA C 31 -29.380 -5.033 0.821 1.00 0.42 H new ATOM 0 HB3 ALA C 31 -29.156 -3.283 1.050 1.00 0.42 H new ATOM 488 N GLU C 32 -31.815 -3.297 4.002 1.00 43.41 N ATOM 489 CA GLU C 32 -32.071 -2.329 5.063 1.00 44.24 C ATOM 490 C GLU C 32 -30.772 -1.688 5.541 1.00 72.42 C ATOM 491 O GLU C 32 -30.770 -0.564 6.042 1.00 73.13 O ATOM 492 CB GLU C 32 -32.782 -3.004 6.238 1.00 12.43 C ATOM 493 CG GLU C 32 -33.595 -2.045 7.091 1.00 53.13 C ATOM 494 CD GLU C 32 -33.703 -2.495 8.534 1.00 74.31 C ATOM 495 OE1 GLU C 32 -32.651 -2.666 9.184 1.00 34.12 O ATOM 496 OE2 GLU C 32 -34.842 -2.677 9.014 1.00 70.52 O ATOM 0 H GLU C 32 -32.149 -4.240 4.201 1.00 43.41 H new ATOM 0 HA GLU C 32 -32.714 -1.547 4.659 1.00 44.24 H new ATOM 0 HB2 GLU C 32 -33.441 -3.783 5.854 1.00 12.43 H new ATOM 0 HB3 GLU C 32 -32.040 -3.496 6.867 1.00 12.43 H new ATOM 0 HG2 GLU C 32 -33.137 -1.056 7.056 1.00 53.13 H new ATOM 0 HG3 GLU C 32 -34.595 -1.948 6.669 1.00 53.13 H new ATOM 503 N ASP C 33 -29.669 -2.411 5.382 1.00 2.31 N ATOM 504 CA ASP C 33 -28.362 -1.914 5.796 1.00 12.02 C ATOM 505 C ASP C 33 -27.556 -1.438 4.592 1.00 64.24 C ATOM 506 O ASP C 33 -26.676 -0.587 4.718 1.00 62.44 O ATOM 507 CB ASP C 33 -27.591 -3.003 6.543 1.00 22.14 C ATOM 508 CG ASP C 33 -28.101 -3.208 7.956 1.00 4.14 C ATOM 509 OD1 ASP C 33 -28.281 -2.202 8.673 1.00 64.44 O ATOM 510 OD2 ASP C 33 -28.320 -4.375 8.345 1.00 11.31 O ATOM 0 H ASP C 33 -29.654 -3.344 4.969 1.00 2.31 H new ATOM 0 HA ASP C 33 -28.518 -1.067 6.464 1.00 12.02 H new ATOM 0 HB2 ASP C 33 -27.668 -3.941 5.993 1.00 22.14 H new ATOM 0 HB3 ASP C 33 -26.534 -2.738 6.576 1.00 22.14 H new ATOM 515 N GLY C 34 -27.861 -1.994 3.423 1.00 3.35 N ATOM 516 CA GLY C 34 -27.155 -1.614 2.214 1.00 52.42 C ATOM 517 C GLY C 34 -25.742 -2.160 2.172 1.00 34.12 C ATOM 518 O GLY C 34 -24.774 -1.398 2.177 1.00 2.15 O ATOM 0 H GLY C 34 -28.585 -2.701 3.292 1.00 3.35 H new ATOM 0 HA2 GLY C 34 -27.707 -1.975 1.346 1.00 52.42 H new ATOM 0 HA3 GLY C 34 -27.123 -0.527 2.142 1.00 52.42 H new ATOM 522 N CYS C 35 -25.621 -3.483 2.132 1.00 41.14 N ATOM 523 CA CYS C 35 -24.315 -4.131 2.092 1.00 3.30 C ATOM 524 C CYS C 35 -24.400 -5.482 1.390 1.00 24.05 C ATOM 525 O CYS C 35 -25.453 -5.861 0.877 1.00 5.22 O ATOM 526 CB CYS C 35 -23.769 -4.312 3.509 1.00 31.21 C ATOM 527 SG CYS C 35 -24.943 -5.061 4.662 1.00 53.54 S ATOM 0 H CYS C 35 -26.412 -4.127 2.126 1.00 41.14 H new ATOM 0 HA CYS C 35 -23.636 -3.491 1.528 1.00 3.30 H new ATOM 0 HB2 CYS C 35 -22.873 -4.932 3.465 1.00 31.21 H new ATOM 0 HB3 CYS C 35 -23.465 -3.340 3.897 1.00 31.21 H new ATOM 0 HG CYS C 35 -24.389 -5.175 5.833 1.00 53.54 H new ATOM 533 N ILE C 36 -23.284 -6.203 1.369 1.00 3.43 N ATOM 534 CA ILE C 36 -23.232 -7.511 0.729 1.00 41.20 C ATOM 535 C ILE C 36 -22.478 -8.517 1.593 1.00 4.22 C ATOM 536 O ILE C 36 -21.485 -8.177 2.235 1.00 72.03 O ATOM 537 CB ILE C 36 -22.560 -7.435 -0.655 1.00 24.31 C ATOM 538 CG1 ILE C 36 -23.306 -6.447 -1.555 1.00 13.34 C ATOM 539 CG2 ILE C 36 -22.513 -8.813 -1.297 1.00 2.02 C ATOM 540 CD1 ILE C 36 -22.823 -5.021 -1.416 1.00 45.41 C ATOM 0 H ILE C 36 -22.404 -5.903 1.788 1.00 3.43 H new ATOM 0 HA ILE C 36 -24.263 -7.842 0.606 1.00 41.20 H new ATOM 0 HB ILE C 36 -21.537 -7.080 -0.527 1.00 24.31 H new ATOM 0 HG12 ILE C 36 -23.196 -6.760 -2.593 1.00 13.34 H new ATOM 0 HG13 ILE C 36 -24.370 -6.486 -1.321 1.00 13.34 H new ATOM 0 HG21 ILE C 36 -22.035 -8.743 -2.274 1.00 2.02 H new ATOM 0 HG22 ILE C 36 -21.943 -9.491 -0.662 1.00 2.02 H new ATOM 0 HG23 ILE C 36 -23.527 -9.194 -1.415 1.00 2.02 H new ATOM 0 HD11 ILE C 36 -23.396 -4.376 -2.083 1.00 45.41 H new ATOM 0 HD12 ILE C 36 -22.958 -4.690 -0.386 1.00 45.41 H new ATOM 0 HD13 ILE C 36 -21.766 -4.967 -1.679 1.00 45.41 H new ATOM 552 N SER C 37 -22.957 -9.757 1.602 1.00 22.14 N ATOM 553 CA SER C 37 -22.329 -10.812 2.388 1.00 11.32 C ATOM 554 C SER C 37 -21.659 -11.840 1.482 1.00 3.21 C ATOM 555 O SER C 37 -22.020 -11.985 0.313 1.00 1.30 O ATOM 556 CB SER C 37 -23.367 -11.500 3.278 1.00 13.51 C ATOM 557 OG SER C 37 -23.746 -10.665 4.358 1.00 54.25 O ATOM 0 H SER C 37 -23.777 -10.055 1.074 1.00 22.14 H new ATOM 0 HA SER C 37 -21.565 -10.356 3.017 1.00 11.32 H new ATOM 0 HB2 SER C 37 -24.246 -11.756 2.686 1.00 13.51 H new ATOM 0 HB3 SER C 37 -22.959 -12.435 3.663 1.00 13.51 H new ATOM 0 HG SER C 37 -24.608 -10.964 4.716 1.00 54.25 H new ATOM 563 N THR C 38 -20.679 -12.553 2.029 1.00 72.15 N ATOM 564 CA THR C 38 -19.956 -13.566 1.271 1.00 74.40 C ATOM 565 C THR C 38 -20.911 -14.602 0.689 1.00 73.11 C ATOM 566 O THR C 38 -20.607 -15.248 -0.315 1.00 65.22 O ATOM 567 CB THR C 38 -18.910 -14.282 2.146 1.00 61.51 C ATOM 568 OG1 THR C 38 -18.396 -15.428 1.457 1.00 40.32 O ATOM 569 CG2 THR C 38 -19.517 -14.713 3.472 1.00 35.34 C ATOM 0 H THR C 38 -20.368 -12.447 2.995 1.00 72.15 H new ATOM 0 HA THR C 38 -19.446 -13.049 0.458 1.00 74.40 H new ATOM 0 HB THR C 38 -18.097 -13.583 2.346 1.00 61.51 H new ATOM 0 HG1 THR C 38 -17.731 -15.877 2.019 1.00 40.32 H new ATOM 0 HG21 THR C 38 -18.759 -15.216 4.073 1.00 35.34 H new ATOM 0 HG22 THR C 38 -19.881 -13.836 4.008 1.00 35.34 H new ATOM 0 HG23 THR C 38 -20.346 -15.396 3.288 1.00 35.34 H new ATOM 577 N LYS C 39 -22.067 -14.757 1.324 1.00 21.04 N ATOM 578 CA LYS C 39 -23.069 -15.714 0.869 1.00 33.25 C ATOM 579 C LYS C 39 -23.769 -15.212 -0.389 1.00 42.31 C ATOM 580 O LYS C 39 -24.026 -15.980 -1.315 1.00 22.24 O ATOM 581 CB LYS C 39 -24.099 -15.969 1.972 1.00 43.23 C ATOM 582 CG LYS C 39 -24.816 -14.713 2.436 1.00 63.35 C ATOM 583 CD LYS C 39 -25.752 -15.002 3.598 1.00 61.22 C ATOM 584 CE LYS C 39 -25.034 -14.890 4.934 1.00 51.34 C ATOM 585 NZ LYS C 39 -24.877 -13.472 5.362 1.00 61.34 N ATOM 0 H LYS C 39 -22.334 -14.232 2.157 1.00 21.04 H new ATOM 0 HA LYS C 39 -22.561 -16.649 0.632 1.00 33.25 H new ATOM 0 HB2 LYS C 39 -24.836 -16.686 1.610 1.00 43.23 H new ATOM 0 HB3 LYS C 39 -23.599 -16.428 2.825 1.00 43.23 H new ATOM 0 HG2 LYS C 39 -24.083 -13.964 2.736 1.00 63.35 H new ATOM 0 HG3 LYS C 39 -25.383 -14.290 1.607 1.00 63.35 H new ATOM 0 HD2 LYS C 39 -26.589 -14.304 3.574 1.00 61.22 H new ATOM 0 HD3 LYS C 39 -26.168 -16.004 3.491 1.00 61.22 H new ATOM 0 HE2 LYS C 39 -25.591 -15.439 5.693 1.00 51.34 H new ATOM 0 HE3 LYS C 39 -24.052 -15.358 4.859 1.00 51.34 H new ATOM 0 HZ1 LYS C 39 -23.867 -13.255 5.481 1.00 61.34 H new ATOM 0 HZ2 LYS C 39 -25.283 -12.844 4.639 1.00 61.34 H new ATOM 0 HZ3 LYS C 39 -25.372 -13.325 6.265 1.00 61.34 H new ATOM 599 N GLU C 40 -24.074 -13.918 -0.415 1.00 31.44 N ATOM 600 CA GLU C 40 -24.744 -13.315 -1.560 1.00 51.13 C ATOM 601 C GLU C 40 -23.762 -13.083 -2.705 1.00 34.33 C ATOM 602 O GLU C 40 -24.121 -13.192 -3.878 1.00 51.35 O ATOM 603 CB GLU C 40 -25.398 -11.991 -1.158 1.00 4.41 C ATOM 604 CG GLU C 40 -26.180 -12.068 0.142 1.00 21.14 C ATOM 605 CD GLU C 40 -26.801 -10.740 0.530 1.00 21.20 C ATOM 606 OE1 GLU C 40 -27.082 -9.931 -0.378 1.00 23.03 O ATOM 607 OE2 GLU C 40 -27.004 -10.511 1.740 1.00 14.30 O ATOM 0 H GLU C 40 -23.868 -13.268 0.344 1.00 31.44 H new ATOM 0 HA GLU C 40 -25.516 -14.004 -1.901 1.00 51.13 H new ATOM 0 HB2 GLU C 40 -24.625 -11.228 -1.063 1.00 4.41 H new ATOM 0 HB3 GLU C 40 -26.067 -11.669 -1.956 1.00 4.41 H new ATOM 0 HG2 GLU C 40 -26.966 -12.817 0.045 1.00 21.14 H new ATOM 0 HG3 GLU C 40 -25.518 -12.402 0.941 1.00 21.14 H new ATOM 614 N LEU C 41 -22.521 -12.761 -2.356 1.00 51.23 N ATOM 615 CA LEU C 41 -21.486 -12.513 -3.353 1.00 43.33 C ATOM 616 C LEU C 41 -21.274 -13.739 -4.235 1.00 43.45 C ATOM 617 O LEU C 41 -21.155 -13.627 -5.454 1.00 54.45 O ATOM 618 CB LEU C 41 -20.172 -12.130 -2.668 1.00 23.11 C ATOM 619 CG LEU C 41 -19.272 -11.163 -3.438 1.00 54.44 C ATOM 620 CD1 LEU C 41 -18.797 -11.794 -4.737 1.00 54.40 C ATOM 621 CD2 LEU C 41 -20.004 -9.857 -3.713 1.00 31.11 C ATOM 0 H LEU C 41 -22.207 -12.666 -1.390 1.00 51.23 H new ATOM 0 HA LEU C 41 -21.814 -11.687 -3.984 1.00 43.33 H new ATOM 0 HB2 LEU C 41 -20.406 -11.685 -1.701 1.00 23.11 H new ATOM 0 HB3 LEU C 41 -19.608 -13.042 -2.472 1.00 23.11 H new ATOM 0 HG LEU C 41 -18.398 -10.944 -2.824 1.00 54.44 H new ATOM 0 HD11 LEU C 41 -18.158 -11.091 -5.271 1.00 54.40 H new ATOM 0 HD12 LEU C 41 -18.234 -12.701 -4.516 1.00 54.40 H new ATOM 0 HD13 LEU C 41 -19.658 -12.044 -5.357 1.00 54.40 H new ATOM 0 HD21 LEU C 41 -19.348 -9.181 -4.262 1.00 31.11 H new ATOM 0 HD22 LEU C 41 -20.896 -10.058 -4.306 1.00 31.11 H new ATOM 0 HD23 LEU C 41 -20.292 -9.396 -2.768 1.00 31.11 H new ATOM 633 N GLY C 42 -21.230 -14.912 -3.609 1.00 45.03 N ATOM 634 CA GLY C 42 -21.034 -16.143 -4.352 1.00 55.32 C ATOM 635 C GLY C 42 -22.276 -16.564 -5.112 1.00 33.24 C ATOM 636 O GLY C 42 -22.198 -17.344 -6.062 1.00 10.12 O ATOM 0 H GLY C 42 -21.327 -15.031 -2.601 1.00 45.03 H new ATOM 0 HA2 GLY C 42 -20.209 -16.014 -5.053 1.00 55.32 H new ATOM 0 HA3 GLY C 42 -20.746 -16.938 -3.664 1.00 55.32 H new ATOM 640 N LYS C 43 -23.427 -16.049 -4.694 1.00 43.04 N ATOM 641 CA LYS C 43 -24.692 -16.376 -5.341 1.00 13.34 C ATOM 642 C LYS C 43 -24.767 -15.760 -6.734 1.00 54.10 C ATOM 643 O LYS C 43 -25.374 -16.326 -7.643 1.00 45.32 O ATOM 644 CB LYS C 43 -25.866 -15.884 -4.490 1.00 62.12 C ATOM 645 CG LYS C 43 -26.128 -16.739 -3.262 1.00 14.43 C ATOM 646 CD LYS C 43 -27.206 -17.777 -3.525 1.00 71.54 C ATOM 647 CE LYS C 43 -28.588 -17.143 -3.579 1.00 63.45 C ATOM 648 NZ LYS C 43 -29.661 -18.165 -3.728 1.00 61.40 N ATOM 0 H LYS C 43 -23.510 -15.403 -3.909 1.00 43.04 H new ATOM 0 HA LYS C 43 -24.751 -17.460 -5.439 1.00 13.34 H new ATOM 0 HB2 LYS C 43 -25.670 -14.859 -4.174 1.00 62.12 H new ATOM 0 HB3 LYS C 43 -26.765 -15.861 -5.105 1.00 62.12 H new ATOM 0 HG2 LYS C 43 -25.207 -17.238 -2.962 1.00 14.43 H new ATOM 0 HG3 LYS C 43 -26.431 -16.101 -2.431 1.00 14.43 H new ATOM 0 HD2 LYS C 43 -27.001 -18.286 -4.467 1.00 71.54 H new ATOM 0 HD3 LYS C 43 -27.182 -18.535 -2.742 1.00 71.54 H new ATOM 0 HE2 LYS C 43 -28.759 -16.567 -2.670 1.00 63.45 H new ATOM 0 HE3 LYS C 43 -28.634 -16.443 -4.413 1.00 63.45 H new ATOM 0 HZ1 LYS C 43 -30.587 -17.693 -3.761 1.00 61.40 H new ATOM 0 HZ2 LYS C 43 -29.513 -18.698 -4.608 1.00 61.40 H new ATOM 0 HZ3 LYS C 43 -29.633 -18.818 -2.919 1.00 61.40 H new ATOM 662 N VAL C 44 -24.144 -14.596 -6.895 1.00 51.54 N ATOM 663 CA VAL C 44 -24.138 -13.904 -8.179 1.00 1.04 C ATOM 664 C VAL C 44 -23.171 -14.565 -9.154 1.00 22.04 C ATOM 665 O VAL C 44 -23.385 -14.543 -10.366 1.00 13.31 O ATOM 666 CB VAL C 44 -23.753 -12.422 -8.015 1.00 23.34 C ATOM 667 CG1 VAL C 44 -22.246 -12.247 -8.118 1.00 13.03 C ATOM 668 CG2 VAL C 44 -24.469 -11.569 -9.051 1.00 33.02 C ATOM 0 H VAL C 44 -23.637 -14.113 -6.153 1.00 51.54 H new ATOM 0 HA VAL C 44 -25.150 -13.966 -8.578 1.00 1.04 H new ATOM 0 HB VAL C 44 -24.066 -12.090 -7.025 1.00 23.34 H new ATOM 0 HG11 VAL C 44 -21.993 -11.193 -8.000 1.00 13.03 H new ATOM 0 HG12 VAL C 44 -21.758 -12.827 -7.335 1.00 13.03 H new ATOM 0 HG13 VAL C 44 -21.905 -12.595 -9.093 1.00 13.03 H new ATOM 0 HG21 VAL C 44 -24.186 -10.525 -8.921 1.00 33.02 H new ATOM 0 HG22 VAL C 44 -24.188 -11.899 -10.051 1.00 33.02 H new ATOM 0 HG23 VAL C 44 -25.547 -11.671 -8.924 1.00 33.02 H new ATOM 678 N MET C 45 -22.106 -15.152 -8.618 1.00 13.13 N ATOM 679 CA MET C 45 -21.106 -15.821 -9.442 1.00 43.22 C ATOM 680 C MET C 45 -21.670 -17.101 -10.049 1.00 54.05 C ATOM 681 O MET C 45 -21.374 -17.438 -11.196 1.00 33.40 O ATOM 682 CB MET C 45 -19.862 -16.142 -8.611 1.00 64.41 C ATOM 683 CG MET C 45 -19.306 -14.943 -7.861 1.00 55.45 C ATOM 684 SD MET C 45 -18.576 -13.713 -8.959 1.00 15.50 S ATOM 685 CE MET C 45 -17.309 -14.689 -9.765 1.00 33.03 C ATOM 0 H MET C 45 -21.913 -15.178 -7.617 1.00 13.13 H new ATOM 0 HA MET C 45 -20.829 -15.147 -10.253 1.00 43.22 H new ATOM 0 HB2 MET C 45 -20.106 -16.927 -7.895 1.00 64.41 H new ATOM 0 HB3 MET C 45 -19.089 -16.540 -9.268 1.00 64.41 H new ATOM 0 HG2 MET C 45 -20.105 -14.479 -7.282 1.00 55.45 H new ATOM 0 HG3 MET C 45 -18.553 -15.282 -7.150 1.00 55.45 H new ATOM 0 HE1 MET C 45 -16.733 -14.053 -10.438 1.00 33.03 H new ATOM 0 HE2 MET C 45 -16.646 -15.117 -9.013 1.00 33.03 H new ATOM 0 HE3 MET C 45 -17.776 -15.492 -10.336 1.00 33.03 H new ATOM 695 N ARG C 46 -22.484 -17.810 -9.274 1.00 43.23 N ATOM 696 CA ARG C 46 -23.088 -19.054 -9.736 1.00 74.10 C ATOM 697 C ARG C 46 -23.924 -18.820 -10.990 1.00 21.01 C ATOM 698 O ARG C 46 -23.921 -19.635 -11.912 1.00 34.35 O ATOM 699 CB ARG C 46 -23.960 -19.662 -8.635 1.00 13.00 C ATOM 700 CG ARG C 46 -23.343 -20.884 -7.975 1.00 22.43 C ATOM 701 CD ARG C 46 -22.346 -20.491 -6.896 1.00 61.00 C ATOM 702 NE ARG C 46 -22.954 -20.480 -5.568 1.00 71.34 N ATOM 703 CZ ARG C 46 -23.288 -21.581 -4.903 1.00 3.22 C ATOM 704 NH1 ARG C 46 -23.073 -22.774 -5.440 1.00 0.23 N ATOM 705 NH2 ARG C 46 -23.837 -21.489 -3.699 1.00 51.22 N ATOM 0 H ARG C 46 -22.740 -17.544 -8.323 1.00 43.23 H new ATOM 0 HA ARG C 46 -22.285 -19.749 -9.980 1.00 74.10 H new ATOM 0 HB2 ARG C 46 -24.150 -18.905 -7.874 1.00 13.00 H new ATOM 0 HB3 ARG C 46 -24.926 -19.937 -9.059 1.00 13.00 H new ATOM 0 HG2 ARG C 46 -24.130 -21.499 -7.538 1.00 22.43 H new ATOM 0 HG3 ARG C 46 -22.844 -21.493 -8.729 1.00 22.43 H new ATOM 0 HD2 ARG C 46 -21.508 -21.188 -6.905 1.00 61.00 H new ATOM 0 HD3 ARG C 46 -21.942 -19.503 -7.118 1.00 61.00 H new ATOM 0 HE ARG C 46 -23.132 -19.578 -5.127 1.00 71.34 H new ATOM 0 HH11 ARG C 46 -22.650 -22.848 -6.365 1.00 0.23 H new ATOM 0 HH12 ARG C 46 -23.330 -23.618 -4.928 1.00 0.23 H new ATOM 0 HH21 ARG C 46 -24.003 -20.573 -3.283 1.00 51.22 H new ATOM 0 HH22 ARG C 46 -24.093 -22.335 -3.189 1.00 51.22 H new ATOM 719 N MET C 47 -24.641 -17.700 -11.017 1.00 42.40 N ATOM 720 CA MET C 47 -25.481 -17.358 -12.159 1.00 43.31 C ATOM 721 C MET C 47 -24.654 -16.720 -13.271 1.00 51.51 C ATOM 722 O MET C 47 -25.055 -16.722 -14.435 1.00 73.34 O ATOM 723 CB MET C 47 -26.600 -16.408 -11.729 1.00 61.01 C ATOM 724 CG MET C 47 -26.096 -15.063 -11.229 1.00 11.51 C ATOM 725 SD MET C 47 -27.282 -13.732 -11.502 1.00 63.45 S ATOM 726 CE MET C 47 -26.282 -12.575 -12.435 1.00 14.40 C ATOM 0 H MET C 47 -24.657 -17.015 -10.261 1.00 42.40 H new ATOM 0 HA MET C 47 -25.923 -18.278 -12.542 1.00 43.31 H new ATOM 0 HB2 MET C 47 -27.271 -16.245 -12.572 1.00 61.01 H new ATOM 0 HB3 MET C 47 -27.186 -16.883 -10.942 1.00 61.01 H new ATOM 0 HG2 MET C 47 -25.875 -15.135 -10.164 1.00 11.51 H new ATOM 0 HG3 MET C 47 -25.160 -14.820 -11.733 1.00 11.51 H new ATOM 0 HE1 MET C 47 -26.736 -11.585 -12.392 1.00 14.40 H new ATOM 0 HE2 MET C 47 -25.280 -12.534 -12.008 1.00 14.40 H new ATOM 0 HE3 MET C 47 -26.221 -12.901 -13.473 1.00 14.40 H new ATOM 736 N LEU C 48 -23.500 -16.174 -12.904 1.00 4.02 N ATOM 737 CA LEU C 48 -22.617 -15.531 -13.871 1.00 2.21 C ATOM 738 C LEU C 48 -22.076 -16.546 -14.873 1.00 41.40 C ATOM 739 O LEU C 48 -22.079 -16.305 -16.079 1.00 30.30 O ATOM 740 CB LEU C 48 -21.458 -14.840 -13.152 1.00 31.13 C ATOM 741 CG LEU C 48 -21.381 -13.321 -13.309 1.00 33.53 C ATOM 742 CD1 LEU C 48 -21.267 -12.648 -11.950 1.00 74.20 C ATOM 743 CD2 LEU C 48 -20.206 -12.935 -14.197 1.00 10.50 C ATOM 0 H LEU C 48 -23.154 -16.164 -11.945 1.00 4.02 H new ATOM 0 HA LEU C 48 -23.196 -14.784 -14.414 1.00 2.21 H new ATOM 0 HB2 LEU C 48 -21.526 -15.072 -12.089 1.00 31.13 H new ATOM 0 HB3 LEU C 48 -20.524 -15.270 -13.513 1.00 31.13 H new ATOM 0 HG LEU C 48 -22.299 -12.978 -13.785 1.00 33.53 H new ATOM 0 HD11 LEU C 48 -21.213 -11.567 -12.082 1.00 74.20 H new ATOM 0 HD12 LEU C 48 -22.140 -12.897 -11.346 1.00 74.20 H new ATOM 0 HD13 LEU C 48 -20.366 -12.997 -11.446 1.00 74.20 H new ATOM 0 HD21 LEU C 48 -20.167 -11.850 -14.298 1.00 10.50 H new ATOM 0 HD22 LEU C 48 -19.279 -13.292 -13.749 1.00 10.50 H new ATOM 0 HD23 LEU C 48 -20.330 -13.386 -15.181 1.00 10.50 H new ATOM 755 N GLY C 49 -21.612 -17.684 -14.364 1.00 40.00 N ATOM 756 CA GLY C 49 -21.076 -18.719 -15.227 1.00 4.45 C ATOM 757 C GLY C 49 -20.041 -19.579 -14.529 1.00 21.21 C ATOM 758 O GLY C 49 -19.725 -20.676 -14.988 1.00 32.02 O ATOM 0 H GLY C 49 -21.598 -17.907 -13.369 1.00 40.00 H new ATOM 0 HA2 GLY C 49 -21.891 -19.351 -15.580 1.00 4.45 H new ATOM 0 HA3 GLY C 49 -20.627 -18.258 -16.106 1.00 4.45 H new ATOM 762 N GLN C 50 -19.512 -19.079 -13.417 1.00 42.14 N ATOM 763 CA GLN C 50 -18.505 -19.808 -12.656 1.00 70.20 C ATOM 764 C GLN C 50 -19.068 -20.280 -11.320 1.00 21.54 C ATOM 765 O GLN C 50 -20.273 -20.204 -11.081 1.00 23.15 O ATOM 766 CB GLN C 50 -17.275 -18.929 -12.423 1.00 74.15 C ATOM 767 CG GLN C 50 -16.801 -18.203 -13.671 1.00 74.41 C ATOM 768 CD GLN C 50 -15.337 -18.456 -13.972 1.00 23.21 C ATOM 769 OE1 GLN C 50 -14.980 -19.472 -14.569 1.00 73.52 O ATOM 770 NE2 GLN C 50 -14.479 -17.530 -13.560 1.00 45.14 N ATOM 0 H GLN C 50 -19.764 -18.172 -13.023 1.00 42.14 H new ATOM 0 HA GLN C 50 -18.212 -20.683 -13.235 1.00 70.20 H new ATOM 0 HB2 GLN C 50 -17.504 -18.195 -11.651 1.00 74.15 H new ATOM 0 HB3 GLN C 50 -16.463 -19.548 -12.043 1.00 74.15 H new ATOM 0 HG2 GLN C 50 -17.403 -18.520 -14.522 1.00 74.41 H new ATOM 0 HG3 GLN C 50 -16.963 -17.132 -13.548 1.00 74.41 H new ATOM 0 HE21 GLN C 50 -14.818 -16.703 -13.069 1.00 45.14 H new ATOM 0 HE22 GLN C 50 -13.481 -17.646 -13.735 1.00 45.14 H new ATOM 779 N ASN C 51 -18.188 -20.768 -10.451 1.00 21.41 N ATOM 780 CA ASN C 51 -18.599 -21.252 -9.138 1.00 22.53 C ATOM 781 C ASN C 51 -17.464 -21.112 -8.127 1.00 61.25 C ATOM 782 O ASN C 51 -16.859 -22.093 -7.696 1.00 50.12 O ATOM 783 CB ASN C 51 -19.040 -22.715 -9.227 1.00 33.14 C ATOM 784 CG ASN C 51 -20.059 -22.946 -10.326 1.00 4.41 C ATOM 785 OD1 ASN C 51 -19.707 -23.062 -11.500 1.00 53.41 O ATOM 786 ND2 ASN C 51 -21.330 -23.014 -9.949 1.00 43.42 N ATOM 0 H ASN C 51 -17.187 -20.839 -10.632 1.00 21.41 H new ATOM 0 HA ASN C 51 -19.439 -20.645 -8.801 1.00 22.53 H new ATOM 0 HB2 ASN C 51 -18.168 -23.344 -9.406 1.00 33.14 H new ATOM 0 HB3 ASN C 51 -19.464 -23.022 -8.271 1.00 33.14 H new ATOM 0 HD21 ASN C 51 -22.061 -23.168 -10.644 1.00 43.42 H new ATOM 0 HD22 ASN C 51 -21.576 -22.912 -8.964 1.00 43.42 H new ATOM 793 N PRO C 52 -17.169 -19.862 -7.740 1.00 72.33 N ATOM 794 CA PRO C 52 -16.107 -19.563 -6.775 1.00 61.25 C ATOM 795 C PRO C 52 -16.459 -20.022 -5.364 1.00 71.54 C ATOM 796 O PRO C 52 -17.480 -19.620 -4.805 1.00 52.25 O ATOM 797 CB PRO C 52 -15.997 -18.038 -6.829 1.00 12.40 C ATOM 798 CG PRO C 52 -17.339 -17.578 -7.285 1.00 24.01 C ATOM 799 CD PRO C 52 -17.849 -18.645 -8.213 1.00 63.12 C ATOM 0 HA PRO C 52 -15.179 -20.080 -7.018 1.00 61.25 H new ATOM 0 HB2 PRO C 52 -15.747 -17.624 -5.852 1.00 12.40 H new ATOM 0 HB3 PRO C 52 -15.214 -17.722 -7.519 1.00 12.40 H new ATOM 0 HG2 PRO C 52 -18.013 -17.442 -6.439 1.00 24.01 H new ATOM 0 HG3 PRO C 52 -17.270 -16.617 -7.795 1.00 24.01 H new ATOM 0 HD2 PRO C 52 -18.933 -18.743 -8.156 1.00 63.12 H new ATOM 0 HD3 PRO C 52 -17.603 -18.425 -9.252 1.00 63.12 H new ATOM 807 N THR C 53 -15.607 -20.868 -4.791 1.00 41.11 N ATOM 808 CA THR C 53 -15.829 -21.382 -3.446 1.00 65.11 C ATOM 809 C THR C 53 -16.193 -20.259 -2.481 1.00 54.33 C ATOM 810 O THR C 53 -15.764 -19.115 -2.633 1.00 22.44 O ATOM 811 CB THR C 53 -14.586 -22.119 -2.914 1.00 10.43 C ATOM 812 OG1 THR C 53 -14.663 -22.245 -1.490 1.00 12.13 O ATOM 813 CG2 THR C 53 -13.313 -21.376 -3.293 1.00 52.42 C ATOM 0 H THR C 53 -14.757 -21.211 -5.239 1.00 41.11 H new ATOM 0 HA THR C 53 -16.659 -22.085 -3.510 1.00 65.11 H new ATOM 0 HB THR C 53 -14.558 -23.111 -3.366 1.00 10.43 H new ATOM 0 HG1 THR C 53 -13.870 -22.716 -1.160 1.00 12.13 H new ATOM 0 HG21 THR C 53 -12.448 -21.915 -2.906 1.00 52.42 H new ATOM 0 HG22 THR C 53 -13.242 -21.306 -4.378 1.00 52.42 H new ATOM 0 HG23 THR C 53 -13.336 -20.373 -2.866 1.00 52.42 H new ATOM 821 N PRO C 54 -17.002 -20.591 -1.464 1.00 35.23 N ATOM 822 CA PRO C 54 -17.439 -19.623 -0.453 1.00 4.44 C ATOM 823 C PRO C 54 -16.301 -19.189 0.464 1.00 62.11 C ATOM 824 O PRO C 54 -16.421 -18.204 1.192 1.00 72.03 O ATOM 825 CB PRO C 54 -18.500 -20.393 0.338 1.00 64.21 C ATOM 826 CG PRO C 54 -18.141 -21.827 0.157 1.00 2.14 C ATOM 827 CD PRO C 54 -17.551 -21.935 -1.222 1.00 52.44 C ATOM 0 HA PRO C 54 -17.808 -18.701 -0.903 1.00 4.44 H new ATOM 0 HB2 PRO C 54 -18.490 -20.112 1.391 1.00 64.21 H new ATOM 0 HB3 PRO C 54 -19.502 -20.185 -0.038 1.00 64.21 H new ATOM 0 HG2 PRO C 54 -17.426 -22.149 0.914 1.00 2.14 H new ATOM 0 HG3 PRO C 54 -19.019 -22.465 0.257 1.00 2.14 H new ATOM 0 HD2 PRO C 54 -16.776 -22.700 -1.269 1.00 52.44 H new ATOM 0 HD3 PRO C 54 -18.306 -22.200 -1.962 1.00 52.44 H new ATOM 835 N GLU C 55 -15.198 -19.930 0.424 1.00 42.21 N ATOM 836 CA GLU C 55 -14.039 -19.619 1.252 1.00 71.50 C ATOM 837 C GLU C 55 -13.258 -18.443 0.676 1.00 15.45 C ATOM 838 O GLU C 55 -12.725 -17.616 1.416 1.00 62.42 O ATOM 839 CB GLU C 55 -13.128 -20.842 1.372 1.00 14.22 C ATOM 840 CG GLU C 55 -13.685 -21.932 2.272 1.00 1.13 C ATOM 841 CD GLU C 55 -14.123 -21.403 3.625 1.00 5.32 C ATOM 842 OE1 GLU C 55 -13.295 -20.764 4.307 1.00 55.24 O ATOM 843 OE2 GLU C 55 -15.292 -21.630 4.001 1.00 43.53 O ATOM 0 H GLU C 55 -15.083 -20.749 -0.173 1.00 42.21 H new ATOM 0 HA GLU C 55 -14.397 -19.343 2.244 1.00 71.50 H new ATOM 0 HB2 GLU C 55 -12.957 -21.256 0.378 1.00 14.22 H new ATOM 0 HB3 GLU C 55 -12.158 -20.526 1.757 1.00 14.22 H new ATOM 0 HG2 GLU C 55 -14.534 -22.407 1.779 1.00 1.13 H new ATOM 0 HG3 GLU C 55 -12.927 -22.703 2.415 1.00 1.13 H new ATOM 850 N GLU C 56 -13.193 -18.375 -0.650 1.00 34.52 N ATOM 851 CA GLU C 56 -12.475 -17.301 -1.326 1.00 4.23 C ATOM 852 C GLU C 56 -13.168 -15.959 -1.103 1.00 24.22 C ATOM 853 O GLU C 56 -12.519 -14.913 -1.056 1.00 75.33 O ATOM 854 CB GLU C 56 -12.372 -17.591 -2.825 1.00 34.42 C ATOM 855 CG GLU C 56 -13.504 -16.990 -3.641 1.00 12.14 C ATOM 856 CD GLU C 56 -13.426 -17.361 -5.109 1.00 43.01 C ATOM 857 OE1 GLU C 56 -13.241 -18.559 -5.410 1.00 53.05 O ATOM 858 OE2 GLU C 56 -13.551 -16.453 -5.957 1.00 63.53 O ATOM 0 H GLU C 56 -13.629 -19.051 -1.277 1.00 34.52 H new ATOM 0 HA GLU C 56 -11.472 -17.247 -0.904 1.00 4.23 H new ATOM 0 HB2 GLU C 56 -11.423 -17.205 -3.197 1.00 34.42 H new ATOM 0 HB3 GLU C 56 -12.359 -18.670 -2.978 1.00 34.42 H new ATOM 0 HG2 GLU C 56 -14.458 -17.327 -3.235 1.00 12.14 H new ATOM 0 HG3 GLU C 56 -13.481 -15.905 -3.543 1.00 12.14 H new ATOM 865 N LEU C 57 -14.489 -15.998 -0.967 1.00 34.11 N ATOM 866 CA LEU C 57 -15.271 -14.786 -0.749 1.00 13.12 C ATOM 867 C LEU C 57 -15.074 -14.258 0.668 1.00 45.52 C ATOM 868 O LEU C 57 -14.766 -13.083 0.865 1.00 11.24 O ATOM 869 CB LEU C 57 -16.754 -15.060 -1.002 1.00 61.35 C ATOM 870 CG LEU C 57 -17.133 -15.438 -2.434 1.00 54.42 C ATOM 871 CD1 LEU C 57 -18.450 -16.197 -2.456 1.00 45.11 C ATOM 872 CD2 LEU C 57 -17.216 -14.195 -3.309 1.00 44.33 C ATOM 0 H LEU C 57 -15.041 -16.855 -1.004 1.00 34.11 H new ATOM 0 HA LEU C 57 -14.923 -14.028 -1.451 1.00 13.12 H new ATOM 0 HB2 LEU C 57 -17.072 -15.865 -0.339 1.00 61.35 H new ATOM 0 HB3 LEU C 57 -17.320 -14.172 -0.720 1.00 61.35 H new ATOM 0 HG LEU C 57 -16.356 -16.089 -2.835 1.00 54.42 H new ATOM 0 HD11 LEU C 57 -18.703 -16.457 -3.484 1.00 45.11 H new ATOM 0 HD12 LEU C 57 -18.355 -17.107 -1.864 1.00 45.11 H new ATOM 0 HD13 LEU C 57 -19.238 -15.571 -2.036 1.00 45.11 H new ATOM 0 HD21 LEU C 57 -17.487 -14.483 -4.325 1.00 44.33 H new ATOM 0 HD22 LEU C 57 -17.972 -13.519 -2.910 1.00 44.33 H new ATOM 0 HD23 LEU C 57 -16.249 -13.692 -3.320 1.00 44.33 H new ATOM 884 N GLN C 58 -15.252 -15.135 1.651 1.00 10.43 N ATOM 885 CA GLN C 58 -15.092 -14.757 3.050 1.00 72.31 C ATOM 886 C GLN C 58 -13.747 -14.074 3.279 1.00 62.02 C ATOM 887 O GLN C 58 -13.646 -13.131 4.063 1.00 71.31 O ATOM 888 CB GLN C 58 -15.212 -15.988 3.950 1.00 32.41 C ATOM 889 CG GLN C 58 -14.955 -15.695 5.419 1.00 32.43 C ATOM 890 CD GLN C 58 -15.636 -14.424 5.888 1.00 32.13 C ATOM 891 OE1 GLN C 58 -16.948 -14.351 5.700 1.00 51.35 O flip ATOM 892 NE2 GLN C 58 -14.990 -13.517 6.414 1.00 52.20 N flip ATOM 0 H GLN C 58 -15.507 -16.112 1.504 1.00 10.43 H new ATOM 0 HA GLN C 58 -15.884 -14.053 3.303 1.00 72.31 H new ATOM 0 HB2 GLN C 58 -16.211 -16.411 3.842 1.00 32.41 H new ATOM 0 HB3 GLN C 58 -14.506 -16.746 3.610 1.00 32.41 H new ATOM 0 HG2 GLN C 58 -15.306 -16.534 6.020 1.00 32.43 H new ATOM 0 HG3 GLN C 58 -13.881 -15.610 5.586 1.00 32.43 H new ATOM 0 HE21 GLN C 58 -13.982 -13.615 6.539 1.00 52.20 H new ATOM 0 HE22 GLN C 58 -15.463 -12.668 6.724 1.00 52.20 H new ATOM 901 N GLU C 59 -12.719 -14.557 2.590 1.00 64.24 N ATOM 902 CA GLU C 59 -11.380 -13.993 2.720 1.00 31.44 C ATOM 903 C GLU C 59 -11.253 -12.704 1.913 1.00 33.43 C ATOM 904 O GLU C 59 -10.455 -11.828 2.245 1.00 73.41 O ATOM 905 CB GLU C 59 -10.329 -15.003 2.257 1.00 13.40 C ATOM 906 CG GLU C 59 -8.975 -14.820 2.920 1.00 2.21 C ATOM 907 CD GLU C 59 -9.051 -14.892 4.433 1.00 31.30 C ATOM 908 OE1 GLU C 59 -9.589 -15.892 4.953 1.00 30.12 O ATOM 909 OE2 GLU C 59 -8.572 -13.949 5.096 1.00 44.33 O ATOM 0 H GLU C 59 -12.787 -15.337 1.936 1.00 64.24 H new ATOM 0 HA GLU C 59 -11.211 -13.762 3.772 1.00 31.44 H new ATOM 0 HB2 GLU C 59 -10.691 -16.011 2.461 1.00 13.40 H new ATOM 0 HB3 GLU C 59 -10.209 -14.920 1.177 1.00 13.40 H new ATOM 0 HG2 GLU C 59 -8.291 -15.587 2.558 1.00 2.21 H new ATOM 0 HG3 GLU C 59 -8.558 -13.857 2.626 1.00 2.21 H new ATOM 916 N MET C 60 -12.044 -12.597 0.851 1.00 31.22 N ATOM 917 CA MET C 60 -12.021 -11.415 -0.004 1.00 51.52 C ATOM 918 C MET C 60 -12.618 -10.211 0.717 1.00 52.25 C ATOM 919 O MET C 60 -12.094 -9.100 0.629 1.00 51.13 O ATOM 920 CB MET C 60 -12.789 -11.681 -1.300 1.00 1.15 C ATOM 921 CG MET C 60 -11.909 -12.169 -2.439 1.00 3.44 C ATOM 922 SD MET C 60 -12.825 -13.121 -3.665 1.00 25.50 S ATOM 923 CE MET C 60 -13.571 -11.807 -4.626 1.00 70.44 C ATOM 0 H MET C 60 -12.709 -13.314 0.561 1.00 31.22 H new ATOM 0 HA MET C 60 -10.982 -11.193 -0.246 1.00 51.52 H new ATOM 0 HB2 MET C 60 -13.564 -12.423 -1.107 1.00 1.15 H new ATOM 0 HB3 MET C 60 -13.293 -10.765 -1.608 1.00 1.15 H new ATOM 0 HG2 MET C 60 -11.442 -11.312 -2.925 1.00 3.44 H new ATOM 0 HG3 MET C 60 -11.105 -12.783 -2.034 1.00 3.44 H new ATOM 0 HE1 MET C 60 -14.645 -11.978 -4.705 1.00 70.44 H new ATOM 0 HE2 MET C 60 -13.391 -10.850 -4.135 1.00 70.44 H new ATOM 0 HE3 MET C 60 -13.132 -11.791 -5.623 1.00 70.44 H new ATOM 933 N ILE C 61 -13.716 -10.438 1.430 1.00 23.11 N ATOM 934 CA ILE C 61 -14.383 -9.371 2.166 1.00 51.35 C ATOM 935 C ILE C 61 -13.549 -8.924 3.362 1.00 31.44 C ATOM 936 O ILE C 61 -13.432 -7.730 3.639 1.00 10.23 O ATOM 937 CB ILE C 61 -15.773 -9.812 2.661 1.00 42.01 C ATOM 938 CG1 ILE C 61 -16.648 -10.235 1.479 1.00 34.01 C ATOM 939 CG2 ILE C 61 -16.437 -8.690 3.444 1.00 21.32 C ATOM 940 CD1 ILE C 61 -17.860 -11.045 1.883 1.00 70.13 C ATOM 0 H ILE C 61 -14.163 -11.351 1.514 1.00 23.11 H new ATOM 0 HA ILE C 61 -14.500 -8.536 1.475 1.00 51.35 H new ATOM 0 HB ILE C 61 -15.652 -10.668 3.324 1.00 42.01 H new ATOM 0 HG12 ILE C 61 -16.978 -9.344 0.945 1.00 34.01 H new ATOM 0 HG13 ILE C 61 -16.046 -10.819 0.783 1.00 34.01 H new ATOM 0 HG21 ILE C 61 -17.419 -9.017 3.787 1.00 21.32 H new ATOM 0 HG22 ILE C 61 -15.819 -8.432 4.304 1.00 21.32 H new ATOM 0 HG23 ILE C 61 -16.550 -7.816 2.803 1.00 21.32 H new ATOM 0 HD11 ILE C 61 -18.433 -11.310 0.995 1.00 70.13 H new ATOM 0 HD12 ILE C 61 -17.537 -11.954 2.391 1.00 70.13 H new ATOM 0 HD13 ILE C 61 -18.484 -10.456 2.555 1.00 70.13 H new ATOM 952 N ASP C 62 -12.970 -9.890 4.067 1.00 61.23 N ATOM 953 CA ASP C 62 -12.143 -9.596 5.232 1.00 71.22 C ATOM 954 C ASP C 62 -10.870 -8.862 4.823 1.00 72.43 C ATOM 955 O ASP C 62 -10.284 -8.127 5.618 1.00 72.40 O ATOM 956 CB ASP C 62 -11.787 -10.887 5.970 1.00 34.01 C ATOM 957 CG ASP C 62 -12.947 -11.427 6.785 1.00 24.22 C ATOM 958 OD1 ASP C 62 -14.010 -10.772 6.809 1.00 22.45 O ATOM 959 OD2 ASP C 62 -12.791 -12.503 7.399 1.00 61.55 O ATOM 0 H ASP C 62 -13.058 -10.883 3.852 1.00 61.23 H new ATOM 0 HA ASP C 62 -12.715 -8.951 5.899 1.00 71.22 H new ATOM 0 HB2 ASP C 62 -11.473 -11.640 5.248 1.00 34.01 H new ATOM 0 HB3 ASP C 62 -10.938 -10.703 6.629 1.00 34.01 H new ATOM 964 N GLU C 63 -10.447 -9.068 3.580 1.00 34.03 N ATOM 965 CA GLU C 63 -9.241 -8.427 3.068 1.00 54.41 C ATOM 966 C GLU C 63 -9.532 -6.996 2.625 1.00 32.42 C ATOM 967 O GLU C 63 -8.895 -6.049 3.088 1.00 12.13 O ATOM 968 CB GLU C 63 -8.669 -9.228 1.896 1.00 74.32 C ATOM 969 CG GLU C 63 -7.609 -10.235 2.308 1.00 51.24 C ATOM 970 CD GLU C 63 -7.402 -11.322 1.270 1.00 1.15 C ATOM 971 OE1 GLU C 63 -7.678 -11.066 0.080 1.00 40.13 O ATOM 972 OE2 GLU C 63 -6.964 -12.428 1.650 1.00 24.31 O ATOM 0 H GLU C 63 -10.921 -9.673 2.909 1.00 34.03 H new ATOM 0 HA GLU C 63 -8.506 -8.398 3.873 1.00 54.41 H new ATOM 0 HB2 GLU C 63 -9.482 -9.753 1.395 1.00 74.32 H new ATOM 0 HB3 GLU C 63 -8.240 -8.538 1.170 1.00 74.32 H new ATOM 0 HG2 GLU C 63 -6.666 -9.715 2.478 1.00 51.24 H new ATOM 0 HG3 GLU C 63 -7.896 -10.692 3.255 1.00 51.24 H new ATOM 979 N VAL C 64 -10.499 -6.846 1.726 1.00 10.23 N ATOM 980 CA VAL C 64 -10.876 -5.531 1.221 1.00 63.34 C ATOM 981 C VAL C 64 -11.404 -4.642 2.341 1.00 63.23 C ATOM 982 O VAL C 64 -11.394 -3.416 2.232 1.00 65.43 O ATOM 983 CB VAL C 64 -11.947 -5.639 0.118 1.00 31.21 C ATOM 984 CG1 VAL C 64 -11.395 -6.379 -1.091 1.00 13.43 C ATOM 985 CG2 VAL C 64 -13.193 -6.327 0.652 1.00 64.34 C ATOM 0 H VAL C 64 -11.036 -7.619 1.332 1.00 10.23 H new ATOM 0 HA VAL C 64 -9.975 -5.084 0.801 1.00 63.34 H new ATOM 0 HB VAL C 64 -12.223 -4.633 -0.197 1.00 31.21 H new ATOM 0 HG11 VAL C 64 -12.165 -6.446 -1.860 1.00 13.43 H new ATOM 0 HG12 VAL C 64 -10.534 -5.840 -1.486 1.00 13.43 H new ATOM 0 HG13 VAL C 64 -11.090 -7.383 -0.795 1.00 13.43 H new ATOM 0 HG21 VAL C 64 -13.939 -6.395 -0.140 1.00 64.34 H new ATOM 0 HG22 VAL C 64 -12.936 -7.329 0.996 1.00 64.34 H new ATOM 0 HG23 VAL C 64 -13.598 -5.751 1.484 1.00 64.34 H new ATOM 995 N ASP C 65 -11.865 -5.269 3.418 1.00 63.42 N ATOM 996 CA ASP C 65 -12.397 -4.535 4.561 1.00 71.03 C ATOM 997 C ASP C 65 -11.410 -3.470 5.029 1.00 33.42 C ATOM 998 O ASP C 65 -10.380 -3.784 5.625 1.00 2.53 O ATOM 999 CB ASP C 65 -12.712 -5.495 5.709 1.00 21.00 C ATOM 1000 CG ASP C 65 -14.153 -5.967 5.689 1.00 13.21 C ATOM 1001 OD1 ASP C 65 -14.857 -5.685 4.697 1.00 32.44 O ATOM 1002 OD2 ASP C 65 -14.577 -6.619 6.666 1.00 14.33 O ATOM 0 H ASP C 65 -11.881 -6.283 3.524 1.00 63.42 H new ATOM 0 HA ASP C 65 -13.317 -4.041 4.248 1.00 71.03 H new ATOM 0 HB2 ASP C 65 -12.049 -6.358 5.650 1.00 21.00 H new ATOM 0 HB3 ASP C 65 -12.508 -5.001 6.659 1.00 21.00 H new ATOM 1007 N GLU C 66 -11.733 -2.210 4.754 1.00 74.41 N ATOM 1008 CA GLU C 66 -10.873 -1.099 5.146 1.00 12.01 C ATOM 1009 C GLU C 66 -11.109 -0.717 6.604 1.00 30.31 C ATOM 1010 O GLU C 66 -10.169 -0.397 7.333 1.00 44.54 O ATOM 1011 CB GLU C 66 -11.123 0.111 4.243 1.00 63.23 C ATOM 1012 CG GLU C 66 -12.555 0.618 4.287 1.00 53.54 C ATOM 1013 CD GLU C 66 -12.797 1.767 3.327 1.00 34.52 C ATOM 1014 OE1 GLU C 66 -12.127 1.812 2.274 1.00 12.34 O ATOM 1015 OE2 GLU C 66 -13.656 2.621 3.630 1.00 35.11 O ATOM 0 H GLU C 66 -12.583 -1.933 4.262 1.00 74.41 H new ATOM 0 HA GLU C 66 -9.837 -1.418 5.035 1.00 12.01 H new ATOM 0 HB2 GLU C 66 -10.452 0.918 4.537 1.00 63.23 H new ATOM 0 HB3 GLU C 66 -10.872 -0.155 3.216 1.00 63.23 H new ATOM 0 HG2 GLU C 66 -13.234 -0.200 4.047 1.00 53.54 H new ATOM 0 HG3 GLU C 66 -12.791 0.941 5.301 1.00 53.54 H new ATOM 1022 N ASP C 67 -12.369 -0.752 7.022 1.00 51.43 N ATOM 1023 CA ASP C 67 -12.730 -0.410 8.393 1.00 62.55 C ATOM 1024 C ASP C 67 -13.071 -1.662 9.194 1.00 3.51 C ATOM 1025 O ASP C 67 -13.240 -1.606 10.411 1.00 55.22 O ATOM 1026 CB ASP C 67 -13.915 0.557 8.406 1.00 11.22 C ATOM 1027 CG ASP C 67 -14.989 0.169 7.408 1.00 75.01 C ATOM 1028 OD1 ASP C 67 -15.104 -1.035 7.099 1.00 52.34 O ATOM 1029 OD2 ASP C 67 -15.714 1.070 6.938 1.00 14.54 O ATOM 0 H ASP C 67 -13.158 -1.014 6.431 1.00 51.43 H new ATOM 0 HA ASP C 67 -11.871 0.074 8.858 1.00 62.55 H new ATOM 0 HB2 ASP C 67 -14.346 0.586 9.407 1.00 11.22 H new ATOM 0 HB3 ASP C 67 -13.562 1.564 8.182 1.00 11.22 H new ATOM 1034 N GLY C 68 -13.171 -2.793 8.501 1.00 71.12 N ATOM 1035 CA GLY C 68 -13.493 -4.043 9.164 1.00 31.43 C ATOM 1036 C GLY C 68 -14.975 -4.182 9.452 1.00 71.42 C ATOM 1037 O GLY C 68 -15.366 -4.801 10.441 1.00 61.23 O ATOM 0 H GLY C 68 -13.035 -2.865 7.493 1.00 71.12 H new ATOM 0 HA2 GLY C 68 -13.168 -4.876 8.540 1.00 31.43 H new ATOM 0 HA3 GLY C 68 -12.937 -4.109 10.099 1.00 31.43 H new ATOM 1041 N SER C 69 -15.801 -3.602 8.587 1.00 63.15 N ATOM 1042 CA SER C 69 -17.248 -3.659 8.757 1.00 13.10 C ATOM 1043 C SER C 69 -17.769 -5.071 8.505 1.00 52.41 C ATOM 1044 O SER C 69 -18.902 -5.398 8.855 1.00 51.23 O ATOM 1045 CB SER C 69 -17.933 -2.673 7.809 1.00 31.14 C ATOM 1046 OG SER C 69 -17.812 -3.093 6.461 1.00 60.01 O ATOM 0 H SER C 69 -15.493 -3.088 7.762 1.00 63.15 H new ATOM 0 HA SER C 69 -17.480 -3.383 9.786 1.00 13.10 H new ATOM 0 HB2 SER C 69 -18.987 -2.584 8.072 1.00 31.14 H new ATOM 0 HB3 SER C 69 -17.490 -1.684 7.926 1.00 31.14 H new ATOM 1052 N GLY C 70 -16.933 -5.903 7.893 1.00 60.51 N ATOM 1053 CA GLY C 70 -17.326 -7.270 7.603 1.00 4.43 C ATOM 1054 C GLY C 70 -18.012 -7.403 6.258 1.00 15.13 C ATOM 1055 O GLY C 70 -18.203 -8.511 5.756 1.00 23.54 O ATOM 0 H GLY C 70 -15.990 -5.655 7.593 1.00 60.51 H new ATOM 0 HA2 GLY C 70 -16.444 -7.910 7.622 1.00 4.43 H new ATOM 0 HA3 GLY C 70 -17.996 -7.626 8.386 1.00 4.43 H new ATOM 1059 N THR C 71 -18.387 -6.270 5.672 1.00 74.51 N ATOM 1060 CA THR C 71 -19.059 -6.264 4.379 1.00 13.11 C ATOM 1061 C THR C 71 -18.271 -5.458 3.353 1.00 25.53 C ATOM 1062 O THR C 71 -17.281 -4.807 3.688 1.00 60.14 O ATOM 1063 CB THR C 71 -20.482 -5.684 4.488 1.00 73.13 C ATOM 1064 OG1 THR C 71 -20.427 -4.343 4.987 1.00 62.11 O ATOM 1065 CG2 THR C 71 -21.346 -6.537 5.404 1.00 22.15 C ATOM 0 H THR C 71 -18.236 -5.344 6.073 1.00 74.51 H new ATOM 0 HA THR C 71 -19.122 -7.302 4.051 1.00 13.11 H new ATOM 0 HB THR C 71 -20.927 -5.683 3.493 1.00 73.13 H new ATOM 0 HG1 THR C 71 -21.335 -3.981 5.052 1.00 62.11 H new ATOM 0 HG21 THR C 71 -22.346 -6.107 5.465 1.00 22.15 H new ATOM 0 HG22 THR C 71 -21.410 -7.549 5.005 1.00 22.15 H new ATOM 0 HG23 THR C 71 -20.902 -6.566 6.399 1.00 22.15 H new ATOM 1073 N VAL C 72 -18.715 -5.505 2.101 1.00 75.04 N ATOM 1074 CA VAL C 72 -18.052 -4.777 1.026 1.00 54.22 C ATOM 1075 C VAL C 72 -18.702 -3.417 0.801 1.00 23.14 C ATOM 1076 O VAL C 72 -19.822 -3.328 0.298 1.00 52.43 O ATOM 1077 CB VAL C 72 -18.082 -5.573 -0.292 1.00 64.14 C ATOM 1078 CG1 VAL C 72 -17.368 -4.807 -1.395 1.00 52.14 C ATOM 1079 CG2 VAL C 72 -17.461 -6.948 -0.098 1.00 21.21 C ATOM 0 H VAL C 72 -19.532 -6.040 1.806 1.00 75.04 H new ATOM 0 HA VAL C 72 -17.016 -4.634 1.332 1.00 54.22 H new ATOM 0 HB VAL C 72 -19.121 -5.708 -0.591 1.00 64.14 H new ATOM 0 HG11 VAL C 72 -17.399 -5.385 -2.319 1.00 52.14 H new ATOM 0 HG12 VAL C 72 -17.862 -3.848 -1.550 1.00 52.14 H new ATOM 0 HG13 VAL C 72 -16.330 -4.638 -1.108 1.00 52.14 H new ATOM 0 HG21 VAL C 72 -17.491 -7.497 -1.039 1.00 21.21 H new ATOM 0 HG22 VAL C 72 -16.426 -6.837 0.225 1.00 21.21 H new ATOM 0 HG23 VAL C 72 -18.021 -7.497 0.659 1.00 21.21 H new ATOM 1089 N ASP C 73 -17.992 -2.359 1.176 1.00 22.25 N ATOM 1090 CA ASP C 73 -18.498 -1.001 1.014 1.00 54.30 C ATOM 1091 C ASP C 73 -18.416 -0.561 -0.445 1.00 32.14 C ATOM 1092 O ASP C 73 -18.129 -1.366 -1.331 1.00 73.33 O ATOM 1093 CB ASP C 73 -17.712 -0.031 1.897 1.00 34.45 C ATOM 1094 CG ASP C 73 -17.695 -0.457 3.352 1.00 35.20 C ATOM 1095 OD1 ASP C 73 -18.452 -1.385 3.708 1.00 42.12 O ATOM 1096 OD2 ASP C 73 -16.924 0.137 4.134 1.00 11.44 O ATOM 0 H ASP C 73 -17.064 -2.416 1.595 1.00 22.25 H new ATOM 0 HA ASP C 73 -19.544 -0.991 1.320 1.00 54.30 H new ATOM 0 HB2 ASP C 73 -16.688 0.041 1.531 1.00 34.45 H new ATOM 0 HB3 ASP C 73 -18.150 0.964 1.818 1.00 34.45 H new ATOM 1101 N PHE C 74 -18.671 0.720 -0.686 1.00 63.21 N ATOM 1102 CA PHE C 74 -18.628 1.267 -2.037 1.00 13.25 C ATOM 1103 C PHE C 74 -17.204 1.251 -2.586 1.00 52.45 C ATOM 1104 O PHE C 74 -16.980 0.925 -3.752 1.00 65.14 O ATOM 1105 CB PHE C 74 -19.175 2.696 -2.050 1.00 24.44 C ATOM 1106 CG PHE C 74 -20.672 2.765 -1.941 1.00 14.40 C ATOM 1107 CD1 PHE C 74 -21.317 2.343 -0.790 1.00 24.40 C ATOM 1108 CD2 PHE C 74 -21.434 3.253 -2.991 1.00 32.30 C ATOM 1109 CE1 PHE C 74 -22.693 2.406 -0.686 1.00 74.20 C ATOM 1110 CE2 PHE C 74 -22.811 3.319 -2.893 1.00 41.42 C ATOM 1111 CZ PHE C 74 -23.442 2.894 -1.740 1.00 65.45 C ATOM 0 H PHE C 74 -18.910 1.399 0.037 1.00 63.21 H new ATOM 0 HA PHE C 74 -19.252 0.641 -2.675 1.00 13.25 H new ATOM 0 HB2 PHE C 74 -18.732 3.254 -1.225 1.00 24.44 H new ATOM 0 HB3 PHE C 74 -18.862 3.188 -2.971 1.00 24.44 H new ATOM 0 HD1 PHE C 74 -20.737 1.960 0.036 1.00 24.40 H new ATOM 0 HD2 PHE C 74 -20.946 3.585 -3.896 1.00 32.30 H new ATOM 0 HE1 PHE C 74 -23.183 2.074 0.218 1.00 74.20 H new ATOM 0 HE2 PHE C 74 -23.393 3.703 -3.718 1.00 41.42 H new ATOM 0 HZ PHE C 74 -24.518 2.943 -1.662 1.00 65.45 H new ATOM 1121 N ASP C 75 -16.246 1.605 -1.736 1.00 12.54 N ATOM 1122 CA ASP C 75 -14.843 1.631 -2.134 1.00 20.24 C ATOM 1123 C ASP C 75 -14.249 0.226 -2.122 1.00 65.51 C ATOM 1124 O ASP C 75 -13.438 -0.122 -2.980 1.00 34.13 O ATOM 1125 CB ASP C 75 -14.044 2.545 -1.204 1.00 54.21 C ATOM 1126 CG ASP C 75 -12.876 3.207 -1.906 1.00 60.43 C ATOM 1127 OD1 ASP C 75 -13.054 3.658 -3.057 1.00 51.45 O ATOM 1128 OD2 ASP C 75 -11.782 3.275 -1.306 1.00 44.32 O ATOM 0 H ASP C 75 -16.415 1.878 -0.768 1.00 12.54 H new ATOM 0 HA ASP C 75 -14.786 2.021 -3.150 1.00 20.24 H new ATOM 0 HB2 ASP C 75 -14.703 3.313 -0.800 1.00 54.21 H new ATOM 0 HB3 ASP C 75 -13.674 1.965 -0.359 1.00 54.21 H new ATOM 1133 N GLU C 76 -14.656 -0.575 -1.142 1.00 2.11 N ATOM 1134 CA GLU C 76 -14.161 -1.941 -1.018 1.00 54.35 C ATOM 1135 C GLU C 76 -14.534 -2.769 -2.244 1.00 73.43 C ATOM 1136 O GLU C 76 -13.916 -3.796 -2.524 1.00 72.12 O ATOM 1137 CB GLU C 76 -14.724 -2.598 0.245 1.00 61.51 C ATOM 1138 CG GLU C 76 -14.433 -1.820 1.517 1.00 61.32 C ATOM 1139 CD GLU C 76 -14.962 -2.513 2.758 1.00 42.14 C ATOM 1140 OE1 GLU C 76 -15.107 -3.753 2.730 1.00 41.32 O ATOM 1141 OE2 GLU C 76 -15.231 -1.814 3.758 1.00 15.04 O ATOM 0 H GLU C 76 -15.326 -0.302 -0.423 1.00 2.11 H new ATOM 0 HA GLU C 76 -13.074 -1.901 -0.945 1.00 54.35 H new ATOM 0 HB2 GLU C 76 -15.803 -2.710 0.136 1.00 61.51 H new ATOM 0 HB3 GLU C 76 -14.308 -3.601 0.339 1.00 61.51 H new ATOM 0 HG2 GLU C 76 -13.356 -1.680 1.615 1.00 61.32 H new ATOM 0 HG3 GLU C 76 -14.878 -0.828 1.442 1.00 61.32 H new ATOM 1148 N TRP C 77 -15.548 -2.314 -2.971 1.00 53.33 N ATOM 1149 CA TRP C 77 -16.004 -3.012 -4.168 1.00 41.02 C ATOM 1150 C TRP C 77 -15.043 -2.786 -5.330 1.00 4.14 C ATOM 1151 O TRP C 77 -14.780 -3.695 -6.118 1.00 50.24 O ATOM 1152 CB TRP C 77 -17.408 -2.544 -4.553 1.00 45.54 C ATOM 1153 CG TRP C 77 -18.079 -3.437 -5.552 1.00 3.01 C ATOM 1154 CD1 TRP C 77 -17.932 -3.404 -6.909 1.00 24.34 C ATOM 1155 CD2 TRP C 77 -19.004 -4.493 -5.272 1.00 23.04 C ATOM 1156 NE1 TRP C 77 -18.710 -4.377 -7.490 1.00 11.20 N ATOM 1157 CE2 TRP C 77 -19.377 -5.059 -6.507 1.00 14.05 C ATOM 1158 CE3 TRP C 77 -19.552 -5.017 -4.098 1.00 51.51 C ATOM 1159 CZ2 TRP C 77 -20.272 -6.121 -6.599 1.00 73.54 C ATOM 1160 CZ3 TRP C 77 -20.441 -6.071 -4.191 1.00 34.22 C ATOM 1161 CH2 TRP C 77 -20.794 -6.614 -5.434 1.00 33.14 C ATOM 0 H TRP C 77 -16.070 -1.465 -2.753 1.00 53.33 H new ATOM 0 HA TRP C 77 -16.032 -4.079 -3.947 1.00 41.02 H new ATOM 0 HB2 TRP C 77 -18.024 -2.488 -3.655 1.00 45.54 H new ATOM 0 HB3 TRP C 77 -17.348 -1.535 -4.961 1.00 45.54 H new ATOM 0 HD1 TRP C 77 -17.298 -2.715 -7.447 1.00 24.34 H new ATOM 0 HE1 TRP C 77 -18.779 -4.561 -8.491 1.00 11.20 H new ATOM 0 HE3 TRP C 77 -19.286 -4.606 -3.136 1.00 51.51 H new ATOM 0 HZ2 TRP C 77 -20.545 -6.541 -7.556 1.00 73.54 H new ATOM 0 HZ3 TRP C 77 -20.871 -6.483 -3.290 1.00 34.22 H new ATOM 0 HH2 TRP C 77 -21.492 -7.438 -5.473 1.00 33.14 H new ATOM 1172 N LEU C 78 -14.520 -1.569 -5.431 1.00 71.42 N ATOM 1173 CA LEU C 78 -13.586 -1.223 -6.497 1.00 34.31 C ATOM 1174 C LEU C 78 -12.275 -1.986 -6.341 1.00 72.12 C ATOM 1175 O LEU C 78 -11.663 -2.398 -7.327 1.00 2.43 O ATOM 1176 CB LEU C 78 -13.317 0.282 -6.498 1.00 65.13 C ATOM 1177 CG LEU C 78 -14.320 1.144 -7.266 1.00 65.20 C ATOM 1178 CD1 LEU C 78 -14.155 2.610 -6.899 1.00 31.23 C ATOM 1179 CD2 LEU C 78 -14.156 0.945 -8.765 1.00 42.01 C ATOM 0 H LEU C 78 -14.727 -0.805 -4.788 1.00 71.42 H new ATOM 0 HA LEU C 78 -14.038 -1.505 -7.448 1.00 34.31 H new ATOM 0 HB2 LEU C 78 -13.290 0.626 -5.464 1.00 65.13 H new ATOM 0 HB3 LEU C 78 -12.326 0.453 -6.917 1.00 65.13 H new ATOM 0 HG LEU C 78 -15.327 0.833 -6.987 1.00 65.20 H new ATOM 0 HD11 LEU C 78 -14.877 3.208 -7.455 1.00 31.23 H new ATOM 0 HD12 LEU C 78 -14.324 2.739 -5.830 1.00 31.23 H new ATOM 0 HD13 LEU C 78 -13.145 2.936 -7.148 1.00 31.23 H new ATOM 0 HD21 LEU C 78 -14.878 1.566 -9.296 1.00 42.01 H new ATOM 0 HD22 LEU C 78 -13.146 1.229 -9.061 1.00 42.01 H new ATOM 0 HD23 LEU C 78 -14.326 -0.102 -9.014 1.00 42.01 H new ATOM 1191 N VAL C 79 -11.849 -2.173 -5.096 1.00 25.40 N ATOM 1192 CA VAL C 79 -10.612 -2.889 -4.810 1.00 53.42 C ATOM 1193 C VAL C 79 -10.805 -4.396 -4.947 1.00 21.21 C ATOM 1194 O VAL C 79 -9.859 -5.129 -5.233 1.00 50.52 O ATOM 1195 CB VAL C 79 -10.096 -2.576 -3.393 1.00 24.14 C ATOM 1196 CG1 VAL C 79 -11.127 -2.978 -2.349 1.00 32.45 C ATOM 1197 CG2 VAL C 79 -8.770 -3.277 -3.142 1.00 2.44 C ATOM 0 H VAL C 79 -12.343 -1.838 -4.269 1.00 25.40 H new ATOM 0 HA VAL C 79 -9.876 -2.551 -5.539 1.00 53.42 H new ATOM 0 HB VAL C 79 -9.933 -1.501 -3.313 1.00 24.14 H new ATOM 0 HG11 VAL C 79 -10.745 -2.750 -1.354 1.00 32.45 H new ATOM 0 HG12 VAL C 79 -12.051 -2.426 -2.519 1.00 32.45 H new ATOM 0 HG13 VAL C 79 -11.324 -4.047 -2.425 1.00 32.45 H new ATOM 0 HG21 VAL C 79 -8.420 -3.045 -2.136 1.00 2.44 H new ATOM 0 HG22 VAL C 79 -8.904 -4.354 -3.240 1.00 2.44 H new ATOM 0 HG23 VAL C 79 -8.034 -2.935 -3.870 1.00 2.44 H new ATOM 1207 N MET C 80 -12.037 -4.850 -4.742 1.00 22.22 N ATOM 1208 CA MET C 80 -12.354 -6.270 -4.845 1.00 71.44 C ATOM 1209 C MET C 80 -12.068 -6.790 -6.250 1.00 32.52 C ATOM 1210 O MET C 80 -11.685 -7.946 -6.427 1.00 5.50 O ATOM 1211 CB MET C 80 -13.822 -6.513 -4.487 1.00 45.32 C ATOM 1212 CG MET C 80 -14.240 -7.971 -4.595 1.00 54.41 C ATOM 1213 SD MET C 80 -14.593 -8.712 -2.990 1.00 21.42 S ATOM 1214 CE MET C 80 -15.924 -9.831 -3.419 1.00 52.34 C ATOM 0 H MET C 80 -12.831 -4.256 -4.504 1.00 22.22 H new ATOM 0 HA MET C 80 -11.721 -6.811 -4.141 1.00 71.44 H new ATOM 0 HB2 MET C 80 -14.002 -6.166 -3.469 1.00 45.32 H new ATOM 0 HB3 MET C 80 -14.452 -5.913 -5.144 1.00 45.32 H new ATOM 0 HG2 MET C 80 -15.124 -8.046 -5.228 1.00 54.41 H new ATOM 0 HG3 MET C 80 -13.448 -8.537 -5.086 1.00 54.41 H new ATOM 0 HE1 MET C 80 -15.808 -10.763 -2.866 1.00 52.34 H new ATOM 0 HE2 MET C 80 -16.880 -9.374 -3.164 1.00 52.34 H new ATOM 0 HE3 MET C 80 -15.895 -10.038 -4.489 1.00 52.34 H new ATOM 1224 N MET C 81 -12.257 -5.930 -7.245 1.00 52.31 N ATOM 1225 CA MET C 81 -12.018 -6.304 -8.634 1.00 53.33 C ATOM 1226 C MET C 81 -10.549 -6.644 -8.860 1.00 51.12 C ATOM 1227 O MET C 81 -10.219 -7.728 -9.342 1.00 75.44 O ATOM 1228 CB MET C 81 -12.441 -5.170 -9.570 1.00 71.21 C ATOM 1229 CG MET C 81 -13.936 -4.894 -9.554 1.00 11.22 C ATOM 1230 SD MET C 81 -14.891 -6.198 -10.354 1.00 50.35 S ATOM 1231 CE MET C 81 -15.858 -6.805 -8.973 1.00 72.13 C ATOM 0 H MET C 81 -12.575 -4.969 -7.115 1.00 52.31 H new ATOM 0 HA MET C 81 -12.615 -7.189 -8.854 1.00 53.33 H new ATOM 0 HB2 MET C 81 -11.909 -4.261 -9.289 1.00 71.21 H new ATOM 0 HB3 MET C 81 -12.136 -5.417 -10.587 1.00 71.21 H new ATOM 0 HG2 MET C 81 -14.270 -4.785 -8.522 1.00 11.22 H new ATOM 0 HG3 MET C 81 -14.132 -3.946 -10.055 1.00 11.22 H new ATOM 0 HE1 MET C 81 -16.502 -7.618 -9.309 1.00 72.13 H new ATOM 0 HE2 MET C 81 -15.190 -7.170 -8.193 1.00 72.13 H new ATOM 0 HE3 MET C 81 -16.472 -5.997 -8.575 1.00 72.13 H new ATOM 1241 N VAL C 82 -9.669 -5.712 -8.510 1.00 72.43 N ATOM 1242 CA VAL C 82 -8.234 -5.914 -8.674 1.00 72.52 C ATOM 1243 C VAL C 82 -7.717 -6.984 -7.719 1.00 70.32 C ATOM 1244 O VAL C 82 -6.845 -7.777 -8.073 1.00 1.43 O ATOM 1245 CB VAL C 82 -7.453 -4.608 -8.436 1.00 50.44 C ATOM 1246 CG1 VAL C 82 -7.731 -4.065 -7.043 1.00 44.34 C ATOM 1247 CG2 VAL C 82 -5.963 -4.834 -8.641 1.00 22.13 C ATOM 0 H VAL C 82 -9.924 -4.809 -8.111 1.00 72.43 H new ATOM 0 HA VAL C 82 -8.076 -6.241 -9.702 1.00 72.52 H new ATOM 0 HB VAL C 82 -7.789 -3.867 -9.162 1.00 50.44 H new ATOM 0 HG11 VAL C 82 -7.170 -3.142 -6.894 1.00 44.34 H new ATOM 0 HG12 VAL C 82 -8.797 -3.863 -6.937 1.00 44.34 H new ATOM 0 HG13 VAL C 82 -7.425 -4.800 -6.298 1.00 44.34 H new ATOM 0 HG21 VAL C 82 -5.426 -3.901 -8.469 1.00 22.13 H new ATOM 0 HG22 VAL C 82 -5.610 -5.590 -7.940 1.00 22.13 H new ATOM 0 HG23 VAL C 82 -5.783 -5.173 -9.661 1.00 22.13 H new ATOM 1257 N ARG C 83 -8.261 -6.999 -6.506 1.00 52.35 N ATOM 1258 CA ARG C 83 -7.854 -7.972 -5.499 1.00 1.30 C ATOM 1259 C ARG C 83 -7.913 -9.390 -6.058 1.00 24.53 C ATOM 1260 O ARG C 83 -7.025 -10.206 -5.804 1.00 24.11 O ATOM 1261 CB ARG C 83 -8.747 -7.861 -4.263 1.00 52.41 C ATOM 1262 CG ARG C 83 -8.211 -6.909 -3.206 1.00 33.24 C ATOM 1263 CD ARG C 83 -7.063 -7.531 -2.427 1.00 62.24 C ATOM 1264 NE ARG C 83 -6.542 -6.626 -1.405 1.00 12.34 N ATOM 1265 CZ ARG C 83 -5.734 -5.606 -1.671 1.00 11.02 C ATOM 1266 NH1 ARG C 83 -5.358 -5.361 -2.918 1.00 42.14 N ATOM 1267 NH2 ARG C 83 -5.302 -4.827 -0.687 1.00 73.24 N ATOM 0 H ARG C 83 -8.984 -6.349 -6.197 1.00 52.35 H new ATOM 0 HA ARG C 83 -6.824 -7.755 -5.215 1.00 1.30 H new ATOM 0 HB2 ARG C 83 -9.738 -7.528 -4.570 1.00 52.41 H new ATOM 0 HB3 ARG C 83 -8.866 -8.850 -3.821 1.00 52.41 H new ATOM 0 HG2 ARG C 83 -7.873 -5.989 -3.682 1.00 33.24 H new ATOM 0 HG3 ARG C 83 -9.013 -6.637 -2.520 1.00 33.24 H new ATOM 0 HD2 ARG C 83 -7.402 -8.453 -1.956 1.00 62.24 H new ATOM 0 HD3 ARG C 83 -6.262 -7.801 -3.115 1.00 62.24 H new ATOM 0 HE ARG C 83 -6.813 -6.786 -0.435 1.00 12.34 H new ATOM 0 HH11 ARG C 83 -5.689 -5.957 -3.677 1.00 42.14 H new ATOM 0 HH12 ARG C 83 -4.737 -4.577 -3.119 1.00 42.14 H new ATOM 0 HH21 ARG C 83 -5.591 -5.012 0.274 1.00 73.24 H new ATOM 0 HH22 ARG C 83 -4.681 -4.044 -0.892 1.00 73.24 H new ATOM 1281 N CYS C 84 -8.963 -9.678 -6.818 1.00 15.42 N ATOM 1282 CA CYS C 84 -9.139 -10.998 -7.412 1.00 52.43 C ATOM 1283 C CYS C 84 -8.098 -11.249 -8.498 1.00 1.51 C ATOM 1284 O CYS C 84 -7.655 -12.380 -8.697 1.00 62.25 O ATOM 1285 CB CYS C 84 -10.546 -11.135 -7.996 1.00 24.32 C ATOM 1286 SG CYS C 84 -11.099 -12.844 -8.198 1.00 63.50 S ATOM 0 H CYS C 84 -9.706 -9.015 -7.038 1.00 15.42 H new ATOM 0 HA CYS C 84 -9.006 -11.742 -6.627 1.00 52.43 H new ATOM 0 HB2 CYS C 84 -11.249 -10.611 -7.348 1.00 24.32 H new ATOM 0 HB3 CYS C 84 -10.575 -10.638 -8.966 1.00 24.32 H new ATOM 0 HG CYS C 84 -12.300 -12.856 -8.696 1.00 63.50 H new ATOM 1292 N MET C 85 -7.713 -10.187 -9.198 1.00 33.34 N ATOM 1293 CA MET C 85 -6.724 -10.293 -10.265 1.00 73.12 C ATOM 1294 C MET C 85 -5.314 -10.385 -9.691 1.00 32.30 C ATOM 1295 O MET C 85 -4.398 -10.885 -10.345 1.00 62.35 O ATOM 1296 CB MET C 85 -6.827 -9.090 -11.205 1.00 22.01 C ATOM 1297 CG MET C 85 -8.256 -8.651 -11.477 1.00 74.32 C ATOM 1298 SD MET C 85 -8.522 -8.176 -13.196 1.00 74.21 S ATOM 1299 CE MET C 85 -8.256 -6.407 -13.103 1.00 23.40 C ATOM 0 H MET C 85 -8.070 -9.244 -9.046 1.00 33.34 H new ATOM 0 HA MET C 85 -6.928 -11.204 -10.828 1.00 73.12 H new ATOM 0 HB2 MET C 85 -6.275 -8.255 -10.774 1.00 22.01 H new ATOM 0 HB3 MET C 85 -6.345 -9.337 -12.151 1.00 22.01 H new ATOM 0 HG2 MET C 85 -8.936 -9.462 -11.219 1.00 74.32 H new ATOM 0 HG3 MET C 85 -8.503 -7.810 -10.829 1.00 74.32 H new ATOM 0 HE1 MET C 85 -8.386 -5.967 -14.092 1.00 23.40 H new ATOM 0 HE2 MET C 85 -8.976 -5.967 -12.413 1.00 23.40 H new ATOM 0 HE3 MET C 85 -7.245 -6.209 -12.748 1.00 23.40 H new ATOM 1309 N LYS C 86 -5.146 -9.901 -8.465 1.00 53.11 N ATOM 1310 CA LYS C 86 -3.847 -9.930 -7.802 1.00 51.42 C ATOM 1311 C LYS C 86 -3.940 -10.638 -6.454 1.00 75.41 C ATOM 1312 O LYS C 86 -3.294 -10.237 -5.486 1.00 11.15 O ATOM 1313 CB LYS C 86 -3.319 -8.507 -7.607 1.00 4.40 C ATOM 1314 CG LYS C 86 -3.524 -7.611 -8.817 1.00 12.34 C ATOM 1315 CD LYS C 86 -2.694 -8.076 -10.002 1.00 72.52 C ATOM 1316 CE LYS C 86 -2.572 -6.988 -11.058 1.00 22.31 C ATOM 1317 NZ LYS C 86 -2.397 -7.558 -12.423 1.00 21.32 N ATOM 0 H LYS C 86 -5.893 -9.484 -7.910 1.00 53.11 H new ATOM 0 HA LYS C 86 -3.155 -10.484 -8.437 1.00 51.42 H new ATOM 0 HB2 LYS C 86 -3.815 -8.059 -6.746 1.00 4.40 H new ATOM 0 HB3 LYS C 86 -2.255 -8.552 -7.375 1.00 4.40 H new ATOM 0 HG2 LYS C 86 -4.579 -7.604 -9.091 1.00 12.34 H new ATOM 0 HG3 LYS C 86 -3.254 -6.586 -8.562 1.00 12.34 H new ATOM 0 HD2 LYS C 86 -1.700 -8.366 -9.660 1.00 72.52 H new ATOM 0 HD3 LYS C 86 -3.151 -8.962 -10.442 1.00 72.52 H new ATOM 0 HE2 LYS C 86 -3.463 -6.361 -11.038 1.00 22.31 H new ATOM 0 HE3 LYS C 86 -1.724 -6.345 -10.821 1.00 22.31 H new ATOM 0 HZ1 LYS C 86 -2.318 -6.785 -13.114 1.00 21.32 H new ATOM 0 HZ2 LYS C 86 -1.533 -8.136 -12.450 1.00 21.32 H new ATOM 0 HZ3 LYS C 86 -3.218 -8.151 -12.659 1.00 21.32 H new ATOM 1331 N ASP C 87 -4.746 -11.693 -6.400 1.00 35.33 N ATOM 1332 CA ASP C 87 -4.921 -12.458 -5.171 1.00 31.25 C ATOM 1333 C ASP C 87 -3.573 -12.880 -4.597 1.00 51.33 C ATOM 1334 O ASP C 87 -2.679 -13.304 -5.330 1.00 54.12 O ATOM 1335 CB ASP C 87 -5.787 -13.692 -5.433 1.00 34.44 C ATOM 1336 CG ASP C 87 -5.016 -14.805 -6.116 1.00 62.14 C ATOM 1337 OD1 ASP C 87 -4.631 -14.626 -7.290 1.00 52.42 O ATOM 1338 OD2 ASP C 87 -4.798 -15.854 -5.475 1.00 74.33 O ATOM 0 H ASP C 87 -5.288 -12.038 -7.192 1.00 35.33 H new ATOM 0 HA ASP C 87 -5.422 -11.820 -4.443 1.00 31.25 H new ATOM 0 HB2 ASP C 87 -6.188 -14.058 -4.488 1.00 34.44 H new ATOM 0 HB3 ASP C 87 -6.638 -13.410 -6.053 1.00 34.44 H new ATOM 1343 N ASP C 88 -3.432 -12.760 -3.281 1.00 11.13 N ATOM 1344 CA ASP C 88 -2.192 -13.129 -2.608 1.00 72.42 C ATOM 1345 C ASP C 88 -2.441 -14.221 -1.572 1.00 72.12 C ATOM 1346 O ASP C 88 -1.815 -14.239 -0.512 1.00 10.03 O ATOM 1347 CB ASP C 88 -1.568 -11.905 -1.936 1.00 2.43 C ATOM 1348 CG ASP C 88 -1.346 -10.762 -2.907 1.00 44.43 C ATOM 1349 OD1 ASP C 88 -1.086 -11.037 -4.097 1.00 50.42 O ATOM 1350 OD2 ASP C 88 -1.430 -9.592 -2.477 1.00 31.14 O ATOM 0 H ASP C 88 -4.161 -12.410 -2.659 1.00 11.13 H new ATOM 0 HA ASP C 88 -1.501 -13.514 -3.358 1.00 72.42 H new ATOM 0 HB2 ASP C 88 -2.215 -11.569 -1.126 1.00 2.43 H new ATOM 0 HB3 ASP C 88 -0.616 -12.187 -1.487 1.00 2.43 H new ATOM 1355 N SER C 89 -3.358 -15.130 -1.887 1.00 14.12 N ATOM 1356 CA SER C 89 -3.693 -16.223 -0.982 1.00 32.23 C ATOM 1357 C SER C 89 -4.288 -15.690 0.318 1.00 71.13 C ATOM 1358 O SER C 89 -3.989 -16.227 1.383 1.00 0.24 O ATOM 1359 CB SER C 89 -2.450 -17.062 -0.680 1.00 1.32 C ATOM 1360 OG SER C 89 -1.668 -17.253 -1.846 1.00 31.14 O ATOM 0 H SER C 89 -3.882 -15.131 -2.762 1.00 14.12 H new ATOM 0 HA SER C 89 -4.437 -16.851 -1.471 1.00 32.23 H new ATOM 0 HB2 SER C 89 -1.852 -16.569 0.086 1.00 1.32 H new ATOM 0 HB3 SER C 89 -2.750 -18.029 -0.277 1.00 1.32 H new ATOM 0 HG SER C 89 -0.879 -17.791 -1.626 1.00 31.14 H new TER 1366 SER C 89 ATOM 1367 N ARG I 144 -10.105 -17.565 -10.117 1.00 0.24 N ATOM 1368 CA ARG I 144 -8.651 -17.646 -10.188 1.00 51.14 C ATOM 1369 C ARG I 144 -8.149 -17.233 -11.568 1.00 32.44 C ATOM 1370 O ARG I 144 -7.089 -17.674 -12.012 1.00 40.13 O ATOM 1371 CB ARG I 144 -8.182 -19.067 -9.868 1.00 41.11 C ATOM 1372 CG ARG I 144 -8.801 -20.129 -10.762 1.00 12.50 C ATOM 1373 CD ARG I 144 -7.901 -20.457 -11.942 1.00 1.20 C ATOM 1374 NE ARG I 144 -8.101 -21.823 -12.420 1.00 34.12 N ATOM 1375 CZ ARG I 144 -9.202 -22.230 -13.041 1.00 61.44 C ATOM 1376 NH1 ARG I 144 -10.197 -21.381 -13.258 1.00 32.33 N ATOM 1377 NH2 ARG I 144 -9.310 -23.489 -13.446 1.00 53.25 N ATOM 0 HA ARG I 144 -8.238 -16.959 -9.450 1.00 51.14 H new ATOM 0 HB2 ARG I 144 -7.097 -19.112 -9.962 1.00 41.11 H new ATOM 0 HB3 ARG I 144 -8.421 -19.294 -8.829 1.00 41.11 H new ATOM 0 HG2 ARG I 144 -8.985 -21.033 -10.181 1.00 12.50 H new ATOM 0 HG3 ARG I 144 -9.768 -19.781 -11.126 1.00 12.50 H new ATOM 0 HD2 ARG I 144 -8.098 -19.757 -12.754 1.00 1.20 H new ATOM 0 HD3 ARG I 144 -6.859 -20.324 -11.651 1.00 1.20 H new ATOM 0 HE ARG I 144 -7.354 -22.501 -12.268 1.00 34.12 H new ATOM 0 HH11 ARG I 144 -10.118 -20.413 -12.948 1.00 32.33 H new ATOM 0 HH12 ARG I 144 -11.042 -21.696 -13.735 1.00 32.33 H new ATOM 0 HH21 ARG I 144 -8.547 -24.145 -13.280 1.00 53.25 H new ATOM 0 HH22 ARG I 144 -10.156 -23.801 -13.923 1.00 53.25 H new ATOM 1391 N ARG I 145 -8.919 -16.384 -12.242 1.00 52.33 N ATOM 1392 CA ARG I 145 -8.554 -15.913 -13.572 1.00 14.21 C ATOM 1393 C ARG I 145 -8.066 -14.468 -13.522 1.00 0.54 C ATOM 1394 O ARG I 145 -8.441 -13.706 -12.631 1.00 72.42 O ATOM 1395 CB ARG I 145 -9.747 -16.026 -14.522 1.00 60.41 C ATOM 1396 CG ARG I 145 -9.834 -17.367 -15.233 1.00 75.30 C ATOM 1397 CD ARG I 145 -10.737 -17.292 -16.454 1.00 45.53 C ATOM 1398 NE ARG I 145 -10.028 -16.794 -17.630 1.00 22.32 N ATOM 1399 CZ ARG I 145 -10.639 -16.349 -18.723 1.00 2.14 C ATOM 1400 NH1 ARG I 145 -11.963 -16.341 -18.789 1.00 43.50 N ATOM 1401 NH2 ARG I 145 -9.924 -15.912 -19.752 1.00 52.53 N ATOM 0 H ARG I 145 -9.799 -16.009 -11.888 1.00 52.33 H new ATOM 0 HA ARG I 145 -7.743 -16.540 -13.942 1.00 14.21 H new ATOM 0 HB2 ARG I 145 -10.666 -15.862 -13.959 1.00 60.41 H new ATOM 0 HB3 ARG I 145 -9.684 -15.233 -15.267 1.00 60.41 H new ATOM 0 HG2 ARG I 145 -8.836 -17.685 -15.536 1.00 75.30 H new ATOM 0 HG3 ARG I 145 -10.214 -18.122 -14.544 1.00 75.30 H new ATOM 0 HD2 ARG I 145 -11.142 -18.281 -16.667 1.00 45.53 H new ATOM 0 HD3 ARG I 145 -11.584 -16.641 -16.239 1.00 45.53 H new ATOM 0 HE ARG I 145 -9.008 -16.787 -17.611 1.00 22.32 H new ATOM 0 HH11 ARG I 145 -12.515 -16.677 -18.000 1.00 43.50 H new ATOM 0 HH12 ARG I 145 -12.430 -15.999 -19.629 1.00 43.50 H new ATOM 0 HH21 ARG I 145 -8.905 -15.918 -19.704 1.00 52.53 H new ATOM 0 HH22 ARG I 145 -10.393 -15.571 -20.591 1.00 52.53 H new ATOM 1415 N VAL I 146 -7.227 -14.098 -14.484 1.00 24.35 N ATOM 1416 CA VAL I 146 -6.688 -12.745 -14.550 1.00 31.23 C ATOM 1417 C VAL I 146 -7.412 -11.916 -15.606 1.00 71.22 C ATOM 1418 O VAL I 146 -7.917 -12.452 -16.592 1.00 75.21 O ATOM 1419 CB VAL I 146 -5.181 -12.756 -14.867 1.00 22.15 C ATOM 1420 CG1 VAL I 146 -4.426 -13.590 -13.844 1.00 74.44 C ATOM 1421 CG2 VAL I 146 -4.937 -13.275 -16.276 1.00 74.24 C ATOM 0 H VAL I 146 -6.906 -14.717 -15.229 1.00 24.35 H new ATOM 0 HA VAL I 146 -6.842 -12.295 -13.569 1.00 31.23 H new ATOM 0 HB VAL I 146 -4.808 -11.733 -14.812 1.00 22.15 H new ATOM 0 HG11 VAL I 146 -3.363 -13.586 -14.085 1.00 74.44 H new ATOM 0 HG12 VAL I 146 -4.575 -13.169 -12.850 1.00 74.44 H new ATOM 0 HG13 VAL I 146 -4.798 -14.614 -13.863 1.00 74.44 H new ATOM 0 HG21 VAL I 146 -3.867 -13.276 -16.483 1.00 74.24 H new ATOM 0 HG22 VAL I 146 -5.324 -14.290 -16.362 1.00 74.24 H new ATOM 0 HG23 VAL I 146 -5.445 -12.631 -16.994 1.00 74.24 H new ATOM 1431 N ARG I 147 -7.459 -10.605 -15.391 1.00 45.34 N ATOM 1432 CA ARG I 147 -8.122 -9.701 -16.323 1.00 22.13 C ATOM 1433 C ARG I 147 -9.585 -10.091 -16.511 1.00 53.11 C ATOM 1434 O ARG I 147 -10.067 -10.206 -17.638 1.00 30.32 O ATOM 1435 CB ARG I 147 -7.403 -9.710 -17.674 1.00 63.45 C ATOM 1436 CG ARG I 147 -7.668 -8.471 -18.513 1.00 70.21 C ATOM 1437 CD ARG I 147 -6.821 -7.295 -18.052 1.00 42.11 C ATOM 1438 NE ARG I 147 -6.737 -6.250 -19.069 1.00 42.05 N ATOM 1439 CZ ARG I 147 -5.979 -6.341 -20.156 1.00 44.02 C ATOM 1440 NH1 ARG I 147 -5.244 -7.424 -20.367 1.00 63.54 N ATOM 1441 NH2 ARG I 147 -5.955 -5.347 -21.035 1.00 22.52 N ATOM 0 H ARG I 147 -7.046 -10.145 -14.580 1.00 45.34 H new ATOM 0 HA ARG I 147 -8.083 -8.695 -15.905 1.00 22.13 H new ATOM 0 HB2 ARG I 147 -6.330 -9.801 -17.504 1.00 63.45 H new ATOM 0 HB3 ARG I 147 -7.713 -10.592 -18.235 1.00 63.45 H new ATOM 0 HG2 ARG I 147 -7.454 -8.687 -19.560 1.00 70.21 H new ATOM 0 HG3 ARG I 147 -8.724 -8.207 -18.451 1.00 70.21 H new ATOM 0 HD2 ARG I 147 -7.245 -6.879 -17.138 1.00 42.11 H new ATOM 0 HD3 ARG I 147 -5.818 -7.644 -17.807 1.00 42.11 H new ATOM 0 HE ARG I 147 -7.291 -5.404 -18.937 1.00 42.05 H new ATOM 0 HH11 ARG I 147 -5.260 -8.190 -19.694 1.00 63.54 H new ATOM 0 HH12 ARG I 147 -4.663 -7.491 -21.203 1.00 63.54 H new ATOM 0 HH21 ARG I 147 -6.519 -4.512 -20.876 1.00 22.52 H new ATOM 0 HH22 ARG I 147 -5.373 -5.418 -21.869 1.00 22.52 H new ATOM 1455 N ILE I 148 -10.285 -10.294 -15.400 1.00 40.31 N ATOM 1456 CA ILE I 148 -11.693 -10.670 -15.443 1.00 4.12 C ATOM 1457 C ILE I 148 -12.505 -9.669 -16.257 1.00 74.13 C ATOM 1458 O ILE I 148 -12.275 -8.462 -16.185 1.00 0.32 O ATOM 1459 CB ILE I 148 -12.292 -10.770 -14.028 1.00 25.13 C ATOM 1460 CG1 ILE I 148 -12.175 -9.426 -13.305 1.00 65.23 C ATOM 1461 CG2 ILE I 148 -11.596 -11.866 -13.234 1.00 15.24 C ATOM 1462 CD1 ILE I 148 -12.850 -9.408 -11.951 1.00 54.11 C ATOM 0 H ILE I 148 -9.901 -10.205 -14.459 1.00 40.31 H new ATOM 0 HA ILE I 148 -11.744 -11.649 -15.920 1.00 4.12 H new ATOM 0 HB ILE I 148 -13.348 -11.025 -14.114 1.00 25.13 H new ATOM 0 HG12 ILE I 148 -11.120 -9.181 -13.180 1.00 65.23 H new ATOM 0 HG13 ILE I 148 -12.611 -8.647 -13.930 1.00 65.23 H new ATOM 0 HG21 ILE I 148 -12.031 -11.924 -12.236 1.00 15.24 H new ATOM 0 HG22 ILE I 148 -11.725 -12.822 -13.742 1.00 15.24 H new ATOM 0 HG23 ILE I 148 -10.533 -11.638 -13.154 1.00 15.24 H new ATOM 0 HD11 ILE I 148 -12.727 -8.425 -11.496 1.00 54.11 H new ATOM 0 HD12 ILE I 148 -13.912 -9.622 -12.071 1.00 54.11 H new ATOM 0 HD13 ILE I 148 -12.398 -10.164 -11.309 1.00 54.11 H new ATOM 1474 N SER I 149 -13.458 -10.179 -17.031 1.00 43.00 N ATOM 1475 CA SER I 149 -14.304 -9.330 -17.861 1.00 34.24 C ATOM 1476 C SER I 149 -15.425 -8.706 -17.035 1.00 62.13 C ATOM 1477 O SER I 149 -16.523 -9.254 -16.945 1.00 14.23 O ATOM 1478 CB SER I 149 -14.896 -10.138 -19.017 1.00 33.35 C ATOM 1479 OG SER I 149 -13.878 -10.782 -19.764 1.00 23.43 O ATOM 0 H SER I 149 -13.663 -11.176 -17.100 1.00 43.00 H new ATOM 0 HA SER I 149 -13.686 -8.529 -18.266 1.00 34.24 H new ATOM 0 HB2 SER I 149 -15.591 -10.882 -18.627 1.00 33.35 H new ATOM 0 HB3 SER I 149 -15.468 -9.479 -19.670 1.00 33.35 H new ATOM 0 HG SER I 149 -14.283 -11.293 -20.496 1.00 23.43 H new ATOM 1485 N ALA I 150 -15.139 -7.557 -16.433 1.00 55.23 N ATOM 1486 CA ALA I 150 -16.122 -6.857 -15.616 1.00 52.33 C ATOM 1487 C ALA I 150 -17.407 -6.605 -16.398 1.00 14.35 C ATOM 1488 O ALA I 150 -18.486 -6.493 -15.817 1.00 11.22 O ATOM 1489 CB ALA I 150 -15.546 -5.543 -15.107 1.00 43.40 C ATOM 0 H ALA I 150 -14.234 -7.091 -16.496 1.00 55.23 H new ATOM 0 HA ALA I 150 -16.365 -7.490 -14.763 1.00 52.33 H new ATOM 0 HB1 ALA I 150 -16.291 -5.031 -14.498 1.00 43.40 H new ATOM 0 HB2 ALA I 150 -14.660 -5.743 -14.504 1.00 43.40 H new ATOM 0 HB3 ALA I 150 -15.274 -4.913 -15.954 1.00 43.40 H new ATOM 1495 N ASP I 151 -17.283 -6.518 -17.718 1.00 2.00 N ATOM 1496 CA ASP I 151 -18.435 -6.280 -18.579 1.00 30.22 C ATOM 1497 C ASP I 151 -19.549 -7.281 -18.287 1.00 11.20 C ATOM 1498 O ASP I 151 -20.729 -6.935 -18.310 1.00 72.22 O ATOM 1499 CB ASP I 151 -18.026 -6.369 -20.050 1.00 33.30 C ATOM 1500 CG ASP I 151 -17.517 -5.048 -20.591 1.00 23.15 C ATOM 1501 OD1 ASP I 151 -18.045 -3.994 -20.177 1.00 70.31 O ATOM 1502 OD2 ASP I 151 -16.591 -5.067 -21.428 1.00 12.23 O ATOM 0 H ASP I 151 -16.397 -6.609 -18.215 1.00 2.00 H new ATOM 0 HA ASP I 151 -18.809 -5.277 -18.373 1.00 30.22 H new ATOM 0 HB2 ASP I 151 -17.251 -7.127 -20.163 1.00 33.30 H new ATOM 0 HB3 ASP I 151 -18.881 -6.696 -20.642 1.00 33.30 H new ATOM 1507 N ALA I 152 -19.164 -8.523 -18.013 1.00 51.14 N ATOM 1508 CA ALA I 152 -20.129 -9.573 -17.715 1.00 71.23 C ATOM 1509 C ALA I 152 -21.080 -9.146 -16.601 1.00 71.43 C ATOM 1510 O ALA I 152 -22.246 -9.538 -16.584 1.00 60.31 O ATOM 1511 CB ALA I 152 -19.410 -10.858 -17.333 1.00 3.22 C ATOM 0 H ALA I 152 -18.190 -8.826 -17.991 1.00 51.14 H new ATOM 0 HA ALA I 152 -20.720 -9.753 -18.613 1.00 71.23 H new ATOM 0 HB1 ALA I 152 -20.143 -11.634 -17.113 1.00 3.22 H new ATOM 0 HB2 ALA I 152 -18.778 -11.181 -18.160 1.00 3.22 H new ATOM 0 HB3 ALA I 152 -18.793 -10.682 -16.452 1.00 3.22 H new ATOM 1517 N MET I 153 -20.573 -8.340 -15.674 1.00 62.25 N ATOM 1518 CA MET I 153 -21.378 -7.860 -14.557 1.00 11.42 C ATOM 1519 C MET I 153 -22.183 -6.627 -14.958 1.00 71.54 C ATOM 1520 O MET I 153 -23.246 -6.360 -14.398 1.00 35.34 O ATOM 1521 CB MET I 153 -20.484 -7.532 -13.360 1.00 65.44 C ATOM 1522 CG MET I 153 -20.337 -8.683 -12.378 1.00 60.12 C ATOM 1523 SD MET I 153 -21.827 -8.958 -11.401 1.00 65.03 S ATOM 1524 CE MET I 153 -21.242 -8.525 -9.764 1.00 1.52 C ATOM 0 H MET I 153 -19.609 -8.006 -15.674 1.00 62.25 H new ATOM 0 HA MET I 153 -22.073 -8.651 -14.276 1.00 11.42 H new ATOM 0 HB2 MET I 153 -19.497 -7.246 -13.722 1.00 65.44 H new ATOM 0 HB3 MET I 153 -20.894 -6.669 -12.836 1.00 65.44 H new ATOM 0 HG2 MET I 153 -20.093 -9.593 -12.925 1.00 60.12 H new ATOM 0 HG3 MET I 153 -19.501 -8.480 -11.709 1.00 60.12 H new ATOM 0 HE1 MET I 153 -22.052 -8.644 -9.045 1.00 1.52 H new ATOM 0 HE2 MET I 153 -20.414 -9.178 -9.489 1.00 1.52 H new ATOM 0 HE3 MET I 153 -20.904 -7.489 -9.761 1.00 1.52 H new ATOM 1534 N MET I 154 -21.669 -5.881 -15.930 1.00 73.51 N ATOM 1535 CA MET I 154 -22.341 -4.677 -16.405 1.00 34.42 C ATOM 1536 C MET I 154 -23.629 -5.029 -17.144 1.00 40.01 C ATOM 1537 O MET I 154 -24.568 -4.235 -17.184 1.00 52.13 O ATOM 1538 CB MET I 154 -21.415 -3.878 -17.323 1.00 45.31 C ATOM 1539 CG MET I 154 -20.028 -3.654 -16.741 1.00 24.43 C ATOM 1540 SD MET I 154 -20.072 -2.807 -15.150 1.00 71.02 S ATOM 1541 CE MET I 154 -18.610 -3.482 -14.366 1.00 74.53 C ATOM 0 H MET I 154 -20.790 -6.089 -16.404 1.00 73.51 H new ATOM 0 HA MET I 154 -22.595 -4.067 -15.538 1.00 34.42 H new ATOM 0 HB2 MET I 154 -21.321 -4.401 -18.275 1.00 45.31 H new ATOM 0 HB3 MET I 154 -21.872 -2.911 -17.534 1.00 45.31 H new ATOM 0 HG2 MET I 154 -19.528 -4.615 -16.623 1.00 24.43 H new ATOM 0 HG3 MET I 154 -19.433 -3.070 -17.443 1.00 24.43 H new ATOM 0 HE1 MET I 154 -18.440 -2.976 -13.416 1.00 74.53 H new ATOM 0 HE2 MET I 154 -18.751 -4.548 -14.189 1.00 74.53 H new ATOM 0 HE3 MET I 154 -17.747 -3.333 -15.015 1.00 74.53 H new ATOM 1551 N GLN I 155 -23.663 -6.223 -17.727 1.00 44.52 N ATOM 1552 CA GLN I 155 -24.835 -6.678 -18.466 1.00 51.21 C ATOM 1553 C GLN I 155 -25.845 -7.338 -17.532 1.00 33.15 C ATOM 1554 O GLN I 155 -26.929 -7.736 -17.956 1.00 63.24 O ATOM 1555 CB GLN I 155 -24.423 -7.659 -19.565 1.00 64.10 C ATOM 1556 CG GLN I 155 -25.559 -8.037 -20.501 1.00 44.03 C ATOM 1557 CD GLN I 155 -25.970 -9.489 -20.364 1.00 3.31 C ATOM 1558 OE1 GLN I 155 -25.970 -10.045 -19.265 1.00 24.04 O ATOM 1559 NE2 GLN I 155 -26.325 -10.113 -21.481 1.00 62.45 N ATOM 0 H GLN I 155 -22.893 -6.892 -17.702 1.00 44.52 H new ATOM 0 HA GLN I 155 -25.305 -5.807 -18.924 1.00 51.21 H new ATOM 0 HB2 GLN I 155 -23.614 -7.219 -20.148 1.00 64.10 H new ATOM 0 HB3 GLN I 155 -24.028 -8.564 -19.103 1.00 64.10 H new ATOM 0 HG2 GLN I 155 -26.419 -7.399 -20.298 1.00 44.03 H new ATOM 0 HG3 GLN I 155 -25.256 -7.845 -21.530 1.00 44.03 H new ATOM 0 HE21 GLN I 155 -26.310 -9.614 -22.371 1.00 62.45 H new ATOM 0 HE22 GLN I 155 -26.612 -11.091 -21.449 1.00 62.45 H new ATOM 1568 N ALA I 156 -25.480 -7.450 -16.259 1.00 43.53 N ATOM 1569 CA ALA I 156 -26.354 -8.060 -15.265 1.00 4.34 C ATOM 1570 C ALA I 156 -27.615 -7.227 -15.058 1.00 12.33 C ATOM 1571 O ALA I 156 -28.578 -7.684 -14.441 1.00 1.13 O ATOM 1572 CB ALA I 156 -25.614 -8.236 -13.947 1.00 24.24 C ATOM 0 H ALA I 156 -24.585 -7.126 -15.892 1.00 43.53 H new ATOM 0 HA ALA I 156 -26.654 -9.041 -15.634 1.00 4.34 H new ATOM 0 HB1 ALA I 156 -26.279 -8.693 -13.214 1.00 24.24 H new ATOM 0 HB2 ALA I 156 -24.747 -8.878 -14.100 1.00 24.24 H new ATOM 0 HB3 ALA I 156 -25.285 -7.263 -13.582 1.00 24.24 H new ATOM 1578 N LEU I 157 -27.602 -6.004 -15.576 1.00 20.34 N ATOM 1579 CA LEU I 157 -28.745 -5.107 -15.448 1.00 3.34 C ATOM 1580 C LEU I 157 -29.479 -4.966 -16.777 1.00 23.03 C ATOM 1581 O LEU I 157 -30.548 -5.545 -16.973 1.00 73.34 O ATOM 1582 CB LEU I 157 -28.286 -3.733 -14.957 1.00 33.22 C ATOM 1583 CG LEU I 157 -26.840 -3.353 -15.277 1.00 23.42 C ATOM 1584 CD1 LEU I 157 -26.700 -1.845 -15.405 1.00 11.43 C ATOM 1585 CD2 LEU I 157 -25.899 -3.890 -14.209 1.00 62.34 C ATOM 0 H LEU I 157 -26.813 -5.611 -16.089 1.00 20.34 H new ATOM 0 HA LEU I 157 -29.433 -5.536 -14.719 1.00 3.34 H new ATOM 0 HB2 LEU I 157 -28.943 -2.978 -15.388 1.00 33.22 H new ATOM 0 HB3 LEU I 157 -28.420 -3.692 -13.876 1.00 33.22 H new ATOM 0 HG LEU I 157 -26.569 -3.804 -16.232 1.00 23.42 H new ATOM 0 HD11 LEU I 157 -25.664 -1.594 -15.633 1.00 11.43 H new ATOM 0 HD12 LEU I 157 -27.345 -1.486 -16.207 1.00 11.43 H new ATOM 0 HD13 LEU I 157 -26.990 -1.372 -14.467 1.00 11.43 H new ATOM 0 HD21 LEU I 157 -24.874 -3.610 -14.453 1.00 62.34 H new ATOM 0 HD22 LEU I 157 -26.169 -3.469 -13.241 1.00 62.34 H new ATOM 0 HD23 LEU I 157 -25.978 -4.976 -14.167 1.00 62.34 H new ATOM 1597 N LEU I 158 -28.897 -4.194 -17.689 1.00 43.22 N ATOM 1598 CA LEU I 158 -29.494 -3.979 -19.002 1.00 1.14 C ATOM 1599 C LEU I 158 -28.523 -4.368 -20.113 1.00 43.30 C ATOM 1600 O LEU I 158 -28.927 -4.895 -21.148 1.00 11.44 O ATOM 1601 CB LEU I 158 -29.908 -2.515 -19.162 1.00 43.20 C ATOM 1602 CG LEU I 158 -28.775 -1.521 -19.422 1.00 70.34 C ATOM 1603 CD1 LEU I 158 -28.552 -1.346 -20.916 1.00 24.01 C ATOM 1604 CD2 LEU I 158 -29.079 -0.182 -18.766 1.00 41.41 C ATOM 0 H LEU I 158 -28.013 -3.707 -17.543 1.00 43.22 H new ATOM 0 HA LEU I 158 -30.378 -4.612 -19.079 1.00 1.14 H new ATOM 0 HB2 LEU I 158 -30.620 -2.447 -19.985 1.00 43.20 H new ATOM 0 HB3 LEU I 158 -30.435 -2.207 -18.259 1.00 43.20 H new ATOM 0 HG LEU I 158 -27.860 -1.919 -18.983 1.00 70.34 H new ATOM 0 HD11 LEU I 158 -27.742 -0.635 -21.082 1.00 24.01 H new ATOM 0 HD12 LEU I 158 -28.289 -2.306 -21.360 1.00 24.01 H new ATOM 0 HD13 LEU I 158 -29.465 -0.971 -21.379 1.00 24.01 H new ATOM 0 HD21 LEU I 158 -28.262 0.513 -18.961 1.00 41.41 H new ATOM 0 HD22 LEU I 158 -30.005 0.222 -19.176 1.00 41.41 H new ATOM 0 HD23 LEU I 158 -29.188 -0.320 -17.690 1.00 41.41 H new ATOM 1616 N GLY I 159 -27.239 -4.106 -19.888 1.00 40.24 N ATOM 1617 CA GLY I 159 -26.230 -4.438 -20.877 1.00 1.34 C ATOM 1618 C GLY I 159 -24.982 -3.590 -20.738 1.00 2.24 C ATOM 1619 O GLY I 159 -23.871 -4.115 -20.669 1.00 43.33 O ATOM 0 H GLY I 159 -26.880 -3.670 -19.039 1.00 40.24 H new ATOM 0 HA2 GLY I 159 -25.963 -5.490 -20.780 1.00 1.34 H new ATOM 0 HA3 GLY I 159 -26.647 -4.305 -21.875 1.00 1.34 H new ATOM 1623 N ALA I 160 -25.163 -2.274 -20.700 1.00 3.33 N ATOM 1624 CA ALA I 160 -24.043 -1.351 -20.569 1.00 65.51 C ATOM 1625 C ALA I 160 -23.119 -1.434 -21.779 1.00 2.31 C ATOM 1626 O ALA I 160 -21.898 -1.509 -21.636 1.00 72.13 O ATOM 1627 CB ALA I 160 -23.269 -1.639 -19.291 1.00 65.20 C ATOM 0 H ALA I 160 -26.076 -1.823 -20.758 1.00 3.33 H new ATOM 0 HA ALA I 160 -24.443 -0.338 -20.519 1.00 65.51 H new ATOM 0 HB1 ALA I 160 -22.435 -0.942 -19.206 1.00 65.20 H new ATOM 0 HB2 ALA I 160 -23.929 -1.522 -18.432 1.00 65.20 H new ATOM 0 HB3 ALA I 160 -22.888 -2.660 -19.319 1.00 65.20 H new ATOM 1633 N ARG I 161 -23.708 -1.422 -22.970 1.00 24.42 N ATOM 1634 CA ARG I 161 -22.938 -1.498 -24.205 1.00 64.05 C ATOM 1635 C ARG I 161 -21.995 -2.697 -24.184 1.00 20.34 C ATOM 1636 O ARG I 161 -20.885 -2.636 -24.713 1.00 4.10 O ATOM 1637 CB ARG I 161 -22.138 -0.210 -24.412 1.00 4.44 C ATOM 1638 CG ARG I 161 -22.986 1.050 -24.356 1.00 75.15 C ATOM 1639 CD ARG I 161 -22.195 2.274 -24.789 1.00 40.22 C ATOM 1640 NE ARG I 161 -20.953 2.418 -24.033 1.00 32.20 N ATOM 1641 CZ ARG I 161 -20.013 3.309 -24.328 1.00 44.43 C ATOM 1642 NH1 ARG I 161 -20.172 4.130 -25.357 1.00 12.14 N ATOM 1643 NH2 ARG I 161 -18.910 3.379 -23.593 1.00 51.24 N ATOM 0 H ARG I 161 -24.717 -1.360 -23.106 1.00 24.42 H new ATOM 0 HA ARG I 161 -23.636 -1.621 -25.033 1.00 64.05 H new ATOM 0 HB2 ARG I 161 -21.361 -0.149 -23.650 1.00 4.44 H new ATOM 0 HB3 ARG I 161 -21.635 -0.256 -25.378 1.00 4.44 H new ATOM 0 HG2 ARG I 161 -23.857 0.932 -25.000 1.00 75.15 H new ATOM 0 HG3 ARG I 161 -23.357 1.195 -23.341 1.00 75.15 H new ATOM 0 HD2 ARG I 161 -21.966 2.200 -25.852 1.00 40.22 H new ATOM 0 HD3 ARG I 161 -22.806 3.167 -24.656 1.00 40.22 H new ATOM 0 HE ARG I 161 -20.799 1.801 -23.235 1.00 32.20 H new ATOM 0 HH11 ARG I 161 -21.018 4.078 -25.925 1.00 12.14 H new ATOM 0 HH12 ARG I 161 -19.448 4.813 -25.581 1.00 12.14 H new ATOM 0 HH21 ARG I 161 -18.784 2.748 -22.801 1.00 51.24 H new ATOM 0 HH22 ARG I 161 -18.188 4.063 -23.820 1.00 51.24 H new ATOM 1657 N ALA I 162 -22.444 -3.786 -23.570 1.00 32.14 N ATOM 1658 CA ALA I 162 -21.642 -5.000 -23.481 1.00 33.22 C ATOM 1659 C ALA I 162 -21.868 -5.897 -24.694 1.00 64.40 C ATOM 1660 O ALA I 162 -23.006 -6.172 -25.073 1.00 14.21 O ATOM 1661 CB ALA I 162 -21.963 -5.753 -22.199 1.00 30.22 C ATOM 0 H ALA I 162 -23.360 -3.853 -23.126 1.00 32.14 H new ATOM 0 HA ALA I 162 -20.591 -4.711 -23.466 1.00 33.22 H new ATOM 0 HB1 ALA I 162 -21.357 -6.657 -22.147 1.00 30.22 H new ATOM 0 HB2 ALA I 162 -21.744 -5.119 -21.340 1.00 30.22 H new ATOM 0 HB3 ALA I 162 -23.019 -6.023 -22.191 1.00 30.22 H new ATOM 1667 N LYS I 163 -20.776 -6.349 -25.301 1.00 24.11 N ATOM 1668 CA LYS I 163 -20.853 -7.216 -26.471 1.00 24.03 C ATOM 1669 C LYS I 163 -21.440 -8.575 -26.104 1.00 45.54 C ATOM 1670 O LYS I 163 -20.975 -9.590 -26.620 1.00 35.22 O ATOM 1671 CB LYS I 163 -19.465 -7.398 -27.089 1.00 31.30 C ATOM 1672 CG LYS I 163 -18.482 -8.112 -26.178 1.00 21.23 C ATOM 1673 CD LYS I 163 -17.044 -7.782 -26.541 1.00 24.12 C ATOM 1674 CE LYS I 163 -16.700 -8.259 -27.944 1.00 24.42 C ATOM 1675 NZ LYS I 163 -15.240 -8.166 -28.219 1.00 55.10 N ATOM 0 H LYS I 163 -19.826 -6.129 -25.002 1.00 24.11 H new ATOM 0 HA LYS I 163 -21.509 -6.742 -27.201 1.00 24.03 H new ATOM 0 HB2 LYS I 163 -19.561 -7.960 -28.018 1.00 31.30 H new ATOM 0 HB3 LYS I 163 -19.061 -6.420 -27.349 1.00 31.30 H new ATOM 0 HG2 LYS I 163 -18.671 -7.828 -25.143 1.00 21.23 H new ATOM 0 HG3 LYS I 163 -18.637 -9.189 -26.246 1.00 21.23 H new ATOM 0 HD2 LYS I 163 -16.888 -6.705 -26.473 1.00 24.12 H new ATOM 0 HD3 LYS I 163 -16.370 -8.247 -25.822 1.00 24.12 H new ATOM 0 HE2 LYS I 163 -17.028 -9.291 -28.067 1.00 24.42 H new ATOM 0 HE3 LYS I 163 -17.246 -7.662 -28.675 1.00 24.42 H new ATOM 0 HZ1 LYS I 163 -15.047 -8.500 -29.185 1.00 55.10 H new ATOM 0 HZ2 LYS I 163 -14.932 -7.177 -28.127 1.00 55.10 H new ATOM 0 HZ3 LYS I 163 -14.720 -8.756 -27.538 1.00 55.10 H new TER 1689 LYS I 163 HETATM 1690 CA CA C 90 -15.796 -3.135 5.370 1.00 13.22 CA