USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 920 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 27 TYR OH : rot 30:sc= 0.705 USER MOD Set 1.2: A 120 SER OG : rot -179:sc= 0.806 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0162) USER MOD Single : A 4 THR OG1 : rot 107:sc= 1.31 USER MOD Single : A 11 SER OG : rot 180:sc= 0.328 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 HIS : no HD1:sc= -2.88! K(o=-2.9!,f=-0.8) USER MOD Single : A 21 THR OG1 : rot -160:sc= -1.03 USER MOD Single : A 24 GLN : amide:sc= -0.464 K(o=-0.46,f=-2.8) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 110:sc= -0.31 USER MOD Single : A 54 GLN : amide:sc= -1.53 X(o=-1.5,f=-1.9) USER MOD Single : A 55 ASN : amide:sc= -1.13 K(o=-1.1,f=-1.8) USER MOD Single : A 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= -0.175 USER MOD Single : A 70 GLN : amide:sc= -0.377 X(o=-0.38,f=-0.11) USER MOD Single : A 72 SER OG : rot -53:sc= 0.164 USER MOD Single : A 74 TYR OH : rot 172:sc= 0.634 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot -120:sc= -0.123 USER MOD Single : A 84 THR OG1 : rot 90:sc= -0.212 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot -150:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -147:sc= -2.57! (180deg=-4.87!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= 0.044 K(o=0.044,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.957 0.321 -1.711 1.00 35.51 N ATOM 2 CA MET A 1 2.092 0.866 -2.446 1.00 72.43 C ATOM 3 C MET A 1 3.407 0.493 -1.770 1.00 2.12 C ATOM 4 O MET A 1 3.688 0.933 -0.655 1.00 5.14 O ATOM 5 CB MET A 1 1.974 2.387 -2.555 1.00 15.02 C ATOM 6 CG MET A 1 0.971 2.846 -3.601 1.00 62.45 C ATOM 7 SD MET A 1 1.684 2.932 -5.255 1.00 63.23 S ATOM 8 CE MET A 1 0.214 3.190 -6.245 1.00 11.21 C ATOM 0 H1 MET A 1 0.085 0.470 -2.258 1.00 35.51 H new ATOM 0 H2 MET A 1 1.100 -0.698 -1.557 1.00 35.51 H new ATOM 0 H3 MET A 1 0.875 0.802 -0.792 1.00 35.51 H new ATOM 0 HA MET A 1 2.084 0.436 -3.448 1.00 72.43 H new ATOM 0 HB2 MET A 1 1.685 2.791 -1.585 1.00 15.02 H new ATOM 0 HB3 MET A 1 2.953 2.803 -2.795 1.00 15.02 H new ATOM 0 HG2 MET A 1 0.123 2.162 -3.610 1.00 62.45 H new ATOM 0 HG3 MET A 1 0.586 3.827 -3.324 1.00 62.45 H new ATOM 0 HE1 MET A 1 0.492 3.264 -7.296 1.00 11.21 H new ATOM 0 HE2 MET A 1 -0.469 2.351 -6.108 1.00 11.21 H new ATOM 0 HE3 MET A 1 -0.277 4.112 -5.934 1.00 11.21 H new ATOM 18 N ILE A 2 4.208 -0.319 -2.451 1.00 23.43 N ATOM 19 CA ILE A 2 5.494 -0.750 -1.915 1.00 13.41 C ATOM 20 C ILE A 2 6.324 0.443 -1.453 1.00 13.41 C ATOM 21 O ILE A 2 6.253 1.525 -2.037 1.00 30.04 O ATOM 22 CB ILE A 2 6.299 -1.548 -2.957 1.00 21.34 C ATOM 23 CG1 ILE A 2 5.533 -2.807 -3.369 1.00 65.23 C ATOM 24 CG2 ILE A 2 7.668 -1.912 -2.402 1.00 62.41 C ATOM 25 CD1 ILE A 2 6.186 -3.566 -4.503 1.00 73.55 C ATOM 0 H ILE A 2 3.990 -0.692 -3.375 1.00 23.43 H new ATOM 0 HA ILE A 2 5.281 -1.394 -1.062 1.00 13.41 H new ATOM 0 HB ILE A 2 6.440 -0.926 -3.841 1.00 21.34 H new ATOM 0 HG12 ILE A 2 5.442 -3.466 -2.506 1.00 65.23 H new ATOM 0 HG13 ILE A 2 4.522 -2.527 -3.664 1.00 65.23 H new ATOM 0 HG21 ILE A 2 8.226 -2.476 -3.150 1.00 62.41 H new ATOM 0 HG22 ILE A 2 8.213 -1.002 -2.153 1.00 62.41 H new ATOM 0 HG23 ILE A 2 7.547 -2.520 -1.505 1.00 62.41 H new ATOM 0 HD11 ILE A 2 5.590 -4.446 -4.743 1.00 73.55 H new ATOM 0 HD12 ILE A 2 6.253 -2.923 -5.381 1.00 73.55 H new ATOM 0 HD13 ILE A 2 7.187 -3.877 -4.204 1.00 73.55 H new ATOM 37 N ARG A 3 7.111 0.238 -0.402 1.00 42.03 N ATOM 38 CA ARG A 3 7.956 1.296 0.138 1.00 52.51 C ATOM 39 C ARG A 3 9.422 0.872 0.144 1.00 14.51 C ATOM 40 O ARG A 3 10.317 1.688 -0.079 1.00 53.33 O ATOM 41 CB ARG A 3 7.512 1.658 1.557 1.00 64.13 C ATOM 42 CG ARG A 3 8.330 2.775 2.184 1.00 12.13 C ATOM 43 CD ARG A 3 7.684 4.133 1.957 1.00 43.13 C ATOM 44 NE ARG A 3 8.468 5.217 2.544 1.00 73.22 N ATOM 45 CZ ARG A 3 9.588 5.688 2.008 1.00 62.43 C ATOM 46 NH1 ARG A 3 10.054 5.173 0.878 1.00 31.42 N ATOM 47 NH2 ARG A 3 10.245 6.676 2.601 1.00 30.14 N ATOM 0 H ARG A 3 7.181 -0.651 0.093 1.00 42.03 H new ATOM 0 HA ARG A 3 7.852 2.172 -0.502 1.00 52.51 H new ATOM 0 HB2 ARG A 3 6.463 1.955 1.536 1.00 64.13 H new ATOM 0 HB3 ARG A 3 7.580 0.771 2.187 1.00 64.13 H new ATOM 0 HG2 ARG A 3 8.434 2.595 3.254 1.00 12.13 H new ATOM 0 HG3 ARG A 3 9.335 2.773 1.761 1.00 12.13 H new ATOM 0 HD2 ARG A 3 7.570 4.306 0.887 1.00 43.13 H new ATOM 0 HD3 ARG A 3 6.683 4.135 2.388 1.00 43.13 H new ATOM 0 HE ARG A 3 8.137 5.635 3.413 1.00 73.22 H new ATOM 0 HH11 ARG A 3 9.552 4.413 0.419 1.00 31.42 H new ATOM 0 HH12 ARG A 3 10.914 5.537 0.468 1.00 31.42 H new ATOM 0 HH21 ARG A 3 9.890 7.075 3.470 1.00 30.14 H new ATOM 0 HH22 ARG A 3 11.105 7.037 2.188 1.00 30.14 H new ATOM 61 N THR A 4 9.661 -0.410 0.402 1.00 14.32 N ATOM 62 CA THR A 4 11.017 -0.942 0.439 1.00 33.03 C ATOM 63 C THR A 4 11.069 -2.354 -0.132 1.00 71.22 C ATOM 64 O THR A 4 10.059 -3.057 -0.167 1.00 33.52 O ATOM 65 CB THR A 4 11.574 -0.961 1.875 1.00 13.33 C ATOM 66 OG1 THR A 4 10.840 -1.896 2.673 1.00 30.33 O ATOM 67 CG2 THR A 4 11.494 0.422 2.505 1.00 44.15 C ATOM 0 H THR A 4 8.932 -1.099 0.588 1.00 14.32 H new ATOM 0 HA THR A 4 11.632 -0.282 -0.173 1.00 33.03 H new ATOM 0 HB THR A 4 12.620 -1.264 1.831 1.00 13.33 H new ATOM 0 HG1 THR A 4 11.391 -2.690 2.836 1.00 30.33 H new ATOM 0 HG21 THR A 4 11.893 0.384 3.519 1.00 44.15 H new ATOM 0 HG22 THR A 4 12.077 1.126 1.912 1.00 44.15 H new ATOM 0 HG23 THR A 4 10.454 0.748 2.536 1.00 44.15 H new ATOM 75 N ILE A 5 12.252 -2.763 -0.579 1.00 34.43 N ATOM 76 CA ILE A 5 12.435 -4.093 -1.147 1.00 74.10 C ATOM 77 C ILE A 5 13.813 -4.651 -0.808 1.00 51.33 C ATOM 78 O ILE A 5 14.783 -3.903 -0.681 1.00 3.34 O ATOM 79 CB ILE A 5 12.260 -4.080 -2.677 1.00 63.22 C ATOM 80 CG1 ILE A 5 10.936 -3.414 -3.056 1.00 32.41 C ATOM 81 CG2 ILE A 5 12.324 -5.496 -3.229 1.00 64.45 C ATOM 82 CD1 ILE A 5 10.733 -3.278 -4.549 1.00 21.13 C ATOM 0 H ILE A 5 13.097 -2.193 -0.559 1.00 34.43 H new ATOM 0 HA ILE A 5 11.669 -4.732 -0.707 1.00 74.10 H new ATOM 0 HB ILE A 5 13.074 -3.502 -3.116 1.00 63.22 H new ATOM 0 HG12 ILE A 5 10.114 -3.994 -2.637 1.00 32.41 H new ATOM 0 HG13 ILE A 5 10.893 -2.425 -2.600 1.00 32.41 H new ATOM 0 HG21 ILE A 5 12.199 -5.471 -4.311 1.00 64.45 H new ATOM 0 HG22 ILE A 5 13.290 -5.938 -2.986 1.00 64.45 H new ATOM 0 HG23 ILE A 5 11.529 -6.096 -2.786 1.00 64.45 H new ATOM 0 HD11 ILE A 5 9.774 -2.798 -4.744 1.00 21.13 H new ATOM 0 HD12 ILE A 5 11.535 -2.672 -4.972 1.00 21.13 H new ATOM 0 HD13 ILE A 5 10.744 -4.266 -5.009 1.00 21.13 H new ATOM 94 N LEU A 6 13.893 -5.969 -0.666 1.00 12.04 N ATOM 95 CA LEU A 6 15.154 -6.629 -0.344 1.00 15.35 C ATOM 96 C LEU A 6 15.388 -7.830 -1.254 1.00 52.31 C ATOM 97 O LEU A 6 14.482 -8.629 -1.489 1.00 21.11 O ATOM 98 CB LEU A 6 15.159 -7.075 1.120 1.00 42.24 C ATOM 99 CG LEU A 6 16.511 -7.020 1.833 1.00 73.33 C ATOM 100 CD1 LEU A 6 16.357 -7.400 3.297 1.00 22.23 C ATOM 101 CD2 LEU A 6 17.514 -7.935 1.145 1.00 52.21 C ATOM 0 H LEU A 6 13.100 -6.602 -0.769 1.00 12.04 H new ATOM 0 HA LEU A 6 15.961 -5.914 -0.503 1.00 15.35 H new ATOM 0 HB2 LEU A 6 14.454 -6.452 1.671 1.00 42.24 H new ATOM 0 HB3 LEU A 6 14.786 -8.098 1.169 1.00 42.24 H new ATOM 0 HG LEU A 6 16.887 -5.998 1.781 1.00 73.33 H new ATOM 0 HD11 LEU A 6 17.329 -7.355 3.789 1.00 22.23 H new ATOM 0 HD12 LEU A 6 15.672 -6.705 3.783 1.00 22.23 H new ATOM 0 HD13 LEU A 6 15.959 -8.412 3.370 1.00 22.23 H new ATOM 0 HD21 LEU A 6 18.470 -7.883 1.666 1.00 52.21 H new ATOM 0 HD22 LEU A 6 17.145 -8.960 1.165 1.00 52.21 H new ATOM 0 HD23 LEU A 6 17.646 -7.617 0.111 1.00 52.21 H new ATOM 113 N ALA A 7 16.610 -7.951 -1.762 1.00 53.14 N ATOM 114 CA ALA A 7 16.964 -9.057 -2.644 1.00 3.45 C ATOM 115 C ALA A 7 18.291 -9.684 -2.230 1.00 64.03 C ATOM 116 O ALA A 7 19.117 -9.041 -1.580 1.00 74.44 O ATOM 117 CB ALA A 7 17.030 -8.581 -4.087 1.00 42.22 C ATOM 0 H ALA A 7 17.371 -7.297 -1.578 1.00 53.14 H new ATOM 0 HA ALA A 7 16.189 -9.819 -2.560 1.00 3.45 H new ATOM 0 HB1 ALA A 7 17.295 -9.417 -4.734 1.00 42.22 H new ATOM 0 HB2 ALA A 7 16.059 -8.186 -4.385 1.00 42.22 H new ATOM 0 HB3 ALA A 7 17.783 -7.799 -4.178 1.00 42.22 H new ATOM 123 N ILE A 8 18.490 -10.942 -2.610 1.00 53.34 N ATOM 124 CA ILE A 8 19.717 -11.655 -2.279 1.00 51.21 C ATOM 125 C ILE A 8 20.180 -12.523 -3.444 1.00 50.23 C ATOM 126 O ILE A 8 19.564 -13.542 -3.755 1.00 71.34 O ATOM 127 CB ILE A 8 19.534 -12.542 -1.034 1.00 32.13 C ATOM 128 CG1 ILE A 8 18.870 -11.747 0.093 1.00 61.24 C ATOM 129 CG2 ILE A 8 20.874 -13.098 -0.578 1.00 24.50 C ATOM 130 CD1 ILE A 8 17.360 -11.828 0.080 1.00 34.15 C ATOM 0 H ILE A 8 17.817 -11.488 -3.147 1.00 53.34 H new ATOM 0 HA ILE A 8 20.474 -10.899 -2.069 1.00 51.21 H new ATOM 0 HB ILE A 8 18.885 -13.378 -1.295 1.00 32.13 H new ATOM 0 HG12 ILE A 8 19.237 -12.114 1.051 1.00 61.24 H new ATOM 0 HG13 ILE A 8 19.171 -10.702 0.016 1.00 61.24 H new ATOM 0 HG21 ILE A 8 20.728 -13.723 0.303 1.00 24.50 H new ATOM 0 HG22 ILE A 8 21.311 -13.695 -1.378 1.00 24.50 H new ATOM 0 HG23 ILE A 8 21.545 -12.275 -0.332 1.00 24.50 H new ATOM 0 HD11 ILE A 8 16.957 -11.242 0.906 1.00 34.15 H new ATOM 0 HD12 ILE A 8 16.983 -11.433 -0.863 1.00 34.15 H new ATOM 0 HD13 ILE A 8 17.050 -12.867 0.188 1.00 34.15 H new ATOM 142 N ASP A 9 21.270 -12.113 -4.084 1.00 13.42 N ATOM 143 CA ASP A 9 21.818 -12.854 -5.213 1.00 60.24 C ATOM 144 C ASP A 9 23.293 -13.172 -4.990 1.00 44.53 C ATOM 145 O ASP A 9 23.920 -12.643 -4.072 1.00 22.32 O ATOM 146 CB ASP A 9 21.645 -12.057 -6.507 1.00 0.41 C ATOM 147 CG ASP A 9 20.267 -12.229 -7.114 1.00 35.53 C ATOM 148 OD1 ASP A 9 20.152 -12.946 -8.129 1.00 74.45 O ATOM 149 OD2 ASP A 9 19.303 -11.647 -6.573 1.00 74.23 O ATOM 0 H ASP A 9 21.791 -11.271 -3.840 1.00 13.42 H new ATOM 0 HA ASP A 9 21.271 -13.793 -5.299 1.00 60.24 H new ATOM 0 HB2 ASP A 9 21.820 -11.000 -6.305 1.00 0.41 H new ATOM 0 HB3 ASP A 9 22.398 -12.373 -7.228 1.00 0.41 H new ATOM 154 N ASP A 10 23.841 -14.038 -5.835 1.00 41.25 N ATOM 155 CA ASP A 10 25.243 -14.426 -5.731 1.00 10.11 C ATOM 156 C ASP A 10 26.101 -13.632 -6.711 1.00 61.43 C ATOM 157 O ASP A 10 27.039 -12.942 -6.313 1.00 21.03 O ATOM 158 CB ASP A 10 25.400 -15.924 -5.993 1.00 63.54 C ATOM 159 CG ASP A 10 26.853 -16.359 -6.018 1.00 54.40 C ATOM 160 OD1 ASP A 10 27.261 -17.006 -7.004 1.00 61.42 O ATOM 161 OD2 ASP A 10 27.581 -16.051 -5.051 1.00 34.33 O ATOM 0 H ASP A 10 23.336 -14.485 -6.600 1.00 41.25 H new ATOM 0 HA ASP A 10 25.582 -14.205 -4.719 1.00 10.11 H new ATOM 0 HB2 ASP A 10 24.870 -16.482 -5.221 1.00 63.54 H new ATOM 0 HB3 ASP A 10 24.933 -16.174 -6.945 1.00 63.54 H new ATOM 166 N SER A 11 25.774 -13.737 -7.995 1.00 52.23 N ATOM 167 CA SER A 11 26.518 -13.033 -9.033 1.00 54.14 C ATOM 168 C SER A 11 26.583 -11.538 -8.736 1.00 10.10 C ATOM 169 O SER A 11 25.562 -10.899 -8.484 1.00 10.03 O ATOM 170 CB SER A 11 25.870 -13.265 -10.400 1.00 45.32 C ATOM 171 OG SER A 11 26.060 -12.147 -11.250 1.00 40.13 O ATOM 0 H SER A 11 24.999 -14.303 -8.341 1.00 52.23 H new ATOM 0 HA SER A 11 27.534 -13.427 -9.048 1.00 54.14 H new ATOM 0 HB2 SER A 11 26.298 -14.154 -10.863 1.00 45.32 H new ATOM 0 HB3 SER A 11 24.804 -13.453 -10.274 1.00 45.32 H new ATOM 0 HG SER A 11 25.638 -12.320 -12.118 1.00 40.13 H new ATOM 177 N ALA A 12 27.792 -10.987 -8.768 1.00 20.13 N ATOM 178 CA ALA A 12 27.992 -9.568 -8.504 1.00 11.42 C ATOM 179 C ALA A 12 27.187 -8.710 -9.474 1.00 75.10 C ATOM 180 O ALA A 12 26.554 -7.731 -9.077 1.00 31.04 O ATOM 181 CB ALA A 12 29.470 -9.218 -8.589 1.00 42.12 C ATOM 0 H ALA A 12 28.648 -11.502 -8.974 1.00 20.13 H new ATOM 0 HA ALA A 12 27.638 -9.359 -7.495 1.00 11.42 H new ATOM 0 HB1 ALA A 12 29.604 -8.155 -8.390 1.00 42.12 H new ATOM 0 HB2 ALA A 12 30.024 -9.798 -7.851 1.00 42.12 H new ATOM 0 HB3 ALA A 12 29.842 -9.450 -9.587 1.00 42.12 H new ATOM 187 N THR A 13 27.214 -9.083 -10.750 1.00 23.12 N ATOM 188 CA THR A 13 26.489 -8.347 -11.777 1.00 74.23 C ATOM 189 C THR A 13 24.986 -8.381 -11.521 1.00 23.35 C ATOM 190 O THR A 13 24.290 -7.388 -11.725 1.00 13.41 O ATOM 191 CB THR A 13 26.771 -8.916 -13.181 1.00 10.42 C ATOM 192 OG1 THR A 13 28.175 -8.863 -13.457 1.00 60.21 O ATOM 193 CG2 THR A 13 26.010 -8.137 -14.243 1.00 44.42 C ATOM 0 H THR A 13 27.731 -9.891 -11.096 1.00 23.12 H new ATOM 0 HA THR A 13 26.840 -7.316 -11.733 1.00 74.23 H new ATOM 0 HB THR A 13 26.435 -9.953 -13.204 1.00 10.42 H new ATOM 0 HG1 THR A 13 28.347 -9.228 -14.350 1.00 60.21 H new ATOM 0 HG21 THR A 13 26.225 -8.557 -15.226 1.00 44.42 H new ATOM 0 HG22 THR A 13 24.940 -8.203 -14.046 1.00 44.42 H new ATOM 0 HG23 THR A 13 26.319 -7.092 -14.219 1.00 44.42 H new ATOM 201 N MET A 14 24.494 -9.531 -11.071 1.00 15.32 N ATOM 202 CA MET A 14 23.073 -9.693 -10.784 1.00 52.52 C ATOM 203 C MET A 14 22.649 -8.806 -9.618 1.00 1.14 C ATOM 204 O MET A 14 21.643 -8.101 -9.695 1.00 40.44 O ATOM 205 CB MET A 14 22.758 -11.156 -10.468 1.00 51.04 C ATOM 206 CG MET A 14 22.680 -12.041 -11.702 1.00 4.20 C ATOM 207 SD MET A 14 21.128 -11.848 -12.599 1.00 11.04 S ATOM 208 CE MET A 14 21.725 -11.699 -14.281 1.00 33.52 C ATOM 0 H MET A 14 25.057 -10.363 -10.897 1.00 15.32 H new ATOM 0 HA MET A 14 22.513 -9.391 -11.669 1.00 52.52 H new ATOM 0 HB2 MET A 14 23.523 -11.547 -9.798 1.00 51.04 H new ATOM 0 HB3 MET A 14 21.810 -11.208 -9.933 1.00 51.04 H new ATOM 0 HG2 MET A 14 23.511 -11.805 -12.367 1.00 4.20 H new ATOM 0 HG3 MET A 14 22.796 -13.083 -11.405 1.00 4.20 H new ATOM 0 HE1 MET A 14 20.880 -11.573 -14.957 1.00 33.52 H new ATOM 0 HE2 MET A 14 22.383 -10.834 -14.358 1.00 33.52 H new ATOM 0 HE3 MET A 14 22.276 -12.599 -14.553 1.00 33.52 H new ATOM 218 N ARG A 15 23.422 -8.847 -8.538 1.00 5.04 N ATOM 219 CA ARG A 15 23.126 -8.048 -7.355 1.00 33.35 C ATOM 220 C ARG A 15 22.927 -6.581 -7.725 1.00 25.33 C ATOM 221 O ARG A 15 22.082 -5.895 -7.152 1.00 33.22 O ATOM 222 CB ARG A 15 24.253 -8.179 -6.329 1.00 3.30 C ATOM 223 CG ARG A 15 24.120 -9.396 -5.429 1.00 64.42 C ATOM 224 CD ARG A 15 24.665 -9.122 -4.036 1.00 42.12 C ATOM 225 NE ARG A 15 25.242 -10.318 -3.429 1.00 31.25 N ATOM 226 CZ ARG A 15 26.417 -10.828 -3.780 1.00 42.53 C ATOM 227 NH1 ARG A 15 27.137 -10.247 -4.731 1.00 22.45 N ATOM 228 NH2 ARG A 15 26.875 -11.919 -3.181 1.00 32.14 N ATOM 0 H ARG A 15 24.258 -9.425 -8.458 1.00 5.04 H new ATOM 0 HA ARG A 15 22.201 -8.423 -6.917 1.00 33.35 H new ATOM 0 HB2 ARG A 15 25.207 -8.229 -6.854 1.00 3.30 H new ATOM 0 HB3 ARG A 15 24.276 -7.282 -5.711 1.00 3.30 H new ATOM 0 HG2 ARG A 15 23.071 -9.686 -5.360 1.00 64.42 H new ATOM 0 HG3 ARG A 15 24.655 -10.237 -5.871 1.00 64.42 H new ATOM 0 HD2 ARG A 15 25.424 -8.341 -4.091 1.00 42.12 H new ATOM 0 HD3 ARG A 15 23.864 -8.744 -3.401 1.00 42.12 H new ATOM 0 HE ARG A 15 24.713 -10.788 -2.694 1.00 31.25 H new ATOM 0 HH11 ARG A 15 26.788 -9.407 -5.194 1.00 22.45 H new ATOM 0 HH12 ARG A 15 28.039 -10.640 -4.999 1.00 22.45 H new ATOM 0 HH21 ARG A 15 26.325 -12.368 -2.449 1.00 32.14 H new ATOM 0 HH22 ARG A 15 27.778 -12.309 -3.452 1.00 32.14 H new ATOM 242 N ALA A 16 23.714 -6.107 -8.686 1.00 32.43 N ATOM 243 CA ALA A 16 23.624 -4.723 -9.133 1.00 73.12 C ATOM 244 C ALA A 16 22.501 -4.547 -10.150 1.00 45.15 C ATOM 245 O ALA A 16 21.733 -3.587 -10.082 1.00 40.45 O ATOM 246 CB ALA A 16 24.951 -4.272 -9.725 1.00 71.41 C ATOM 0 H ALA A 16 24.421 -6.661 -9.169 1.00 32.43 H new ATOM 0 HA ALA A 16 23.396 -4.101 -8.267 1.00 73.12 H new ATOM 0 HB1 ALA A 16 24.869 -3.236 -10.055 1.00 71.41 H new ATOM 0 HB2 ALA A 16 25.732 -4.351 -8.969 1.00 71.41 H new ATOM 0 HB3 ALA A 16 25.204 -4.905 -10.576 1.00 71.41 H new ATOM 252 N LEU A 17 22.413 -5.478 -11.093 1.00 75.43 N ATOM 253 CA LEU A 17 21.384 -5.426 -12.126 1.00 53.33 C ATOM 254 C LEU A 17 19.995 -5.315 -11.506 1.00 74.11 C ATOM 255 O LEU A 17 19.285 -4.331 -11.718 1.00 11.21 O ATOM 256 CB LEU A 17 21.461 -6.669 -13.014 1.00 53.24 C ATOM 257 CG LEU A 17 20.551 -6.673 -14.243 1.00 74.31 C ATOM 258 CD1 LEU A 17 19.125 -7.029 -13.850 1.00 62.13 C ATOM 259 CD2 LEU A 17 20.592 -5.322 -14.942 1.00 73.22 C ATOM 0 H LEU A 17 23.042 -6.278 -11.164 1.00 75.43 H new ATOM 0 HA LEU A 17 21.561 -4.540 -12.736 1.00 53.33 H new ATOM 0 HB2 LEU A 17 22.491 -6.788 -13.349 1.00 53.24 H new ATOM 0 HB3 LEU A 17 21.221 -7.541 -12.406 1.00 53.24 H new ATOM 0 HG LEU A 17 20.915 -7.430 -14.938 1.00 74.31 H new ATOM 0 HD11 LEU A 17 18.492 -7.027 -14.737 1.00 62.13 H new ATOM 0 HD12 LEU A 17 19.109 -8.020 -13.395 1.00 62.13 H new ATOM 0 HD13 LEU A 17 18.751 -6.296 -13.135 1.00 62.13 H new ATOM 0 HD21 LEU A 17 19.939 -5.344 -15.814 1.00 73.22 H new ATOM 0 HD22 LEU A 17 20.254 -4.546 -14.255 1.00 73.22 H new ATOM 0 HD23 LEU A 17 21.613 -5.107 -15.259 1.00 73.22 H new ATOM 271 N LEU A 18 19.613 -6.329 -10.738 1.00 30.51 N ATOM 272 CA LEU A 18 18.309 -6.346 -10.084 1.00 50.31 C ATOM 273 C LEU A 18 18.139 -5.131 -9.178 1.00 0.41 C ATOM 274 O LEU A 18 17.044 -4.579 -9.060 1.00 22.22 O ATOM 275 CB LEU A 18 18.140 -7.630 -9.271 1.00 23.22 C ATOM 276 CG LEU A 18 18.515 -8.930 -9.984 1.00 35.12 C ATOM 277 CD1 LEU A 18 18.340 -10.119 -9.052 1.00 62.31 C ATOM 278 CD2 LEU A 18 17.677 -9.109 -11.242 1.00 0.42 C ATOM 0 H LEU A 18 20.188 -7.151 -10.553 1.00 30.51 H new ATOM 0 HA LEU A 18 17.542 -6.310 -10.858 1.00 50.31 H new ATOM 0 HB2 LEU A 18 18.745 -7.547 -8.368 1.00 23.22 H new ATOM 0 HB3 LEU A 18 17.100 -7.701 -8.953 1.00 23.22 H new ATOM 0 HG LEU A 18 19.564 -8.873 -10.275 1.00 35.12 H new ATOM 0 HD11 LEU A 18 18.611 -11.035 -9.576 1.00 62.31 H new ATOM 0 HD12 LEU A 18 18.983 -9.996 -8.180 1.00 62.31 H new ATOM 0 HD13 LEU A 18 17.300 -10.179 -8.730 1.00 62.31 H new ATOM 0 HD21 LEU A 18 17.957 -10.039 -11.737 1.00 0.42 H new ATOM 0 HD22 LEU A 18 16.621 -9.144 -10.974 1.00 0.42 H new ATOM 0 HD23 LEU A 18 17.852 -8.272 -11.918 1.00 0.42 H new ATOM 290 N HIS A 19 19.230 -4.717 -8.541 1.00 11.50 N ATOM 291 CA HIS A 19 19.202 -3.564 -7.647 1.00 63.22 C ATOM 292 C HIS A 19 18.880 -2.287 -8.417 1.00 44.03 C ATOM 293 O HIS A 19 18.191 -1.402 -7.910 1.00 64.25 O ATOM 294 CB HIS A 19 20.544 -3.416 -6.930 1.00 23.44 C ATOM 295 CG HIS A 19 20.666 -2.148 -6.142 1.00 71.31 C ATOM 296 ND1 HIS A 19 21.711 -1.262 -6.299 1.00 31.43 N ATOM 297 CD2 HIS A 19 19.865 -1.618 -5.188 1.00 61.23 C ATOM 298 CE1 HIS A 19 21.549 -0.243 -5.474 1.00 74.11 C ATOM 299 NE2 HIS A 19 20.436 -0.435 -4.789 1.00 55.52 N ATOM 0 H HIS A 19 20.144 -5.162 -8.627 1.00 11.50 H new ATOM 0 HA HIS A 19 18.419 -3.728 -6.907 1.00 63.22 H new ATOM 0 HB2 HIS A 19 20.684 -4.265 -6.261 1.00 23.44 H new ATOM 0 HB3 HIS A 19 21.346 -3.455 -7.667 1.00 23.44 H new ATOM 0 HD2 HIS A 19 18.948 -2.046 -4.811 1.00 61.23 H new ATOM 0 HE1 HIS A 19 22.213 0.603 -5.376 1.00 74.11 H new ATOM 0 HE2 HIS A 19 20.061 0.194 -4.079 1.00 55.52 H new ATOM 307 N ALA A 20 19.385 -2.198 -9.644 1.00 34.33 N ATOM 308 CA ALA A 20 19.150 -1.030 -10.484 1.00 34.34 C ATOM 309 C ALA A 20 17.742 -1.050 -11.070 1.00 10.13 C ATOM 310 O ALA A 20 17.094 -0.010 -11.192 1.00 41.32 O ATOM 311 CB ALA A 20 20.186 -0.963 -11.596 1.00 34.12 C ATOM 0 H ALA A 20 19.959 -2.921 -10.078 1.00 34.33 H new ATOM 0 HA ALA A 20 19.244 -0.140 -9.861 1.00 34.34 H new ATOM 0 HB1 ALA A 20 19.999 -0.086 -12.216 1.00 34.12 H new ATOM 0 HB2 ALA A 20 21.183 -0.893 -11.161 1.00 34.12 H new ATOM 0 HB3 ALA A 20 20.120 -1.862 -12.210 1.00 34.12 H new ATOM 317 N THR A 21 17.273 -2.240 -11.432 1.00 20.01 N ATOM 318 CA THR A 21 15.943 -2.395 -12.007 1.00 51.31 C ATOM 319 C THR A 21 14.885 -1.731 -11.133 1.00 22.24 C ATOM 320 O THR A 21 14.198 -0.805 -11.566 1.00 71.51 O ATOM 321 CB THR A 21 15.581 -3.880 -12.193 1.00 74.23 C ATOM 322 OG1 THR A 21 16.773 -4.671 -12.257 1.00 52.11 O ATOM 323 CG2 THR A 21 14.763 -4.083 -13.460 1.00 61.10 C ATOM 0 H THR A 21 17.795 -3.111 -11.337 1.00 20.01 H new ATOM 0 HA THR A 21 15.962 -1.909 -12.982 1.00 51.31 H new ATOM 0 HB THR A 21 14.982 -4.195 -11.338 1.00 74.23 H new ATOM 0 HG1 THR A 21 16.572 -5.531 -12.681 1.00 52.11 H new ATOM 0 HG21 THR A 21 14.519 -5.140 -13.570 1.00 61.10 H new ATOM 0 HG22 THR A 21 13.842 -3.503 -13.396 1.00 61.10 H new ATOM 0 HG23 THR A 21 15.341 -3.752 -14.323 1.00 61.10 H new ATOM 331 N LEU A 22 14.759 -2.209 -9.899 1.00 44.34 N ATOM 332 CA LEU A 22 13.785 -1.661 -8.962 1.00 52.34 C ATOM 333 C LEU A 22 14.144 -0.229 -8.579 1.00 11.24 C ATOM 334 O LEU A 22 13.266 0.615 -8.402 1.00 2.53 O ATOM 335 CB LEU A 22 13.708 -2.533 -7.708 1.00 54.11 C ATOM 336 CG LEU A 22 12.740 -3.715 -7.771 1.00 64.54 C ATOM 337 CD1 LEU A 22 13.023 -4.697 -6.645 1.00 21.22 C ATOM 338 CD2 LEU A 22 11.300 -3.230 -7.709 1.00 55.11 C ATOM 0 H LEU A 22 15.319 -2.975 -9.525 1.00 44.34 H new ATOM 0 HA LEU A 22 12.811 -1.653 -9.451 1.00 52.34 H new ATOM 0 HB2 LEU A 22 14.706 -2.917 -7.495 1.00 54.11 H new ATOM 0 HB3 LEU A 22 13.424 -1.901 -6.867 1.00 54.11 H new ATOM 0 HG LEU A 22 12.887 -4.230 -8.720 1.00 64.54 H new ATOM 0 HD11 LEU A 22 12.324 -5.532 -6.706 1.00 21.22 H new ATOM 0 HD12 LEU A 22 14.043 -5.070 -6.736 1.00 21.22 H new ATOM 0 HD13 LEU A 22 12.905 -4.194 -5.685 1.00 21.22 H new ATOM 0 HD21 LEU A 22 10.626 -4.085 -7.755 1.00 55.11 H new ATOM 0 HD22 LEU A 22 11.138 -2.690 -6.776 1.00 55.11 H new ATOM 0 HD23 LEU A 22 11.103 -2.567 -8.551 1.00 55.11 H new ATOM 350 N ALA A 23 15.440 0.038 -8.454 1.00 31.42 N ATOM 351 CA ALA A 23 15.915 1.368 -8.096 1.00 2.25 C ATOM 352 C ALA A 23 15.393 2.418 -9.070 1.00 10.51 C ATOM 353 O ALA A 23 14.805 3.419 -8.661 1.00 5.43 O ATOM 354 CB ALA A 23 17.436 1.392 -8.056 1.00 0.35 C ATOM 0 H ALA A 23 16.180 -0.650 -8.596 1.00 31.42 H new ATOM 0 HA ALA A 23 15.532 1.609 -7.104 1.00 2.25 H new ATOM 0 HB1 ALA A 23 17.777 2.392 -7.787 1.00 0.35 H new ATOM 0 HB2 ALA A 23 17.792 0.676 -7.315 1.00 0.35 H new ATOM 0 HB3 ALA A 23 17.830 1.126 -9.037 1.00 0.35 H new ATOM 360 N GLN A 24 15.612 2.183 -10.360 1.00 0.44 N ATOM 361 CA GLN A 24 15.164 3.111 -11.392 1.00 1.05 C ATOM 362 C GLN A 24 13.652 3.300 -11.335 1.00 32.33 C ATOM 363 O GLN A 24 13.142 4.387 -11.604 1.00 74.43 O ATOM 364 CB GLN A 24 15.575 2.605 -12.775 1.00 62.13 C ATOM 365 CG GLN A 24 17.060 2.755 -13.062 1.00 5.44 C ATOM 366 CD GLN A 24 17.487 4.205 -13.187 1.00 32.23 C ATOM 367 OE1 GLN A 24 16.675 5.118 -13.036 1.00 13.02 O ATOM 368 NE2 GLN A 24 18.767 4.424 -13.464 1.00 31.24 N ATOM 0 H GLN A 24 16.096 1.359 -10.715 1.00 0.44 H new ATOM 0 HA GLN A 24 15.639 4.075 -11.210 1.00 1.05 H new ATOM 0 HB2 GLN A 24 15.301 1.554 -12.864 1.00 62.13 H new ATOM 0 HB3 GLN A 24 15.010 3.147 -13.534 1.00 62.13 H new ATOM 0 HG2 GLN A 24 17.630 2.280 -12.264 1.00 5.44 H new ATOM 0 HG3 GLN A 24 17.303 2.228 -13.985 1.00 5.44 H new ATOM 0 HE21 GLN A 24 19.405 3.637 -13.581 1.00 31.24 H new ATOM 0 HE22 GLN A 24 19.112 5.379 -13.560 1.00 31.24 H new ATOM 377 N ALA A 25 12.940 2.234 -10.982 1.00 63.14 N ATOM 378 CA ALA A 25 11.487 2.283 -10.889 1.00 35.23 C ATOM 379 C ALA A 25 11.041 3.174 -9.735 1.00 15.42 C ATOM 380 O ALA A 25 9.906 3.649 -9.707 1.00 33.32 O ATOM 381 CB ALA A 25 10.921 0.880 -10.723 1.00 52.05 C ATOM 0 H ALA A 25 13.347 1.326 -10.756 1.00 63.14 H new ATOM 0 HA ALA A 25 11.103 2.711 -11.815 1.00 35.23 H new ATOM 0 HB1 ALA A 25 9.834 0.932 -10.655 1.00 52.05 H new ATOM 0 HB2 ALA A 25 11.202 0.270 -11.582 1.00 52.05 H new ATOM 0 HB3 ALA A 25 11.321 0.432 -9.813 1.00 52.05 H new ATOM 387 N GLY A 26 11.942 3.398 -8.783 1.00 34.01 N ATOM 388 CA GLY A 26 11.621 4.232 -7.639 1.00 62.41 C ATOM 389 C GLY A 26 11.659 3.463 -6.333 1.00 11.30 C ATOM 390 O GLY A 26 12.019 4.013 -5.292 1.00 22.23 O ATOM 0 H GLY A 26 12.888 3.017 -8.784 1.00 34.01 H new ATOM 0 HA2 GLY A 26 12.326 5.062 -7.589 1.00 62.41 H new ATOM 0 HA3 GLY A 26 10.629 4.663 -7.774 1.00 62.41 H new ATOM 394 N TYR A 27 11.285 2.190 -6.387 1.00 32.03 N ATOM 395 CA TYR A 27 11.273 1.346 -5.198 1.00 24.12 C ATOM 396 C TYR A 27 12.634 1.359 -4.508 1.00 31.54 C ATOM 397 O TYR A 27 13.662 1.589 -5.143 1.00 52.54 O ATOM 398 CB TYR A 27 10.890 -0.088 -5.568 1.00 42.22 C ATOM 399 CG TYR A 27 9.652 -0.180 -6.430 1.00 74.15 C ATOM 400 CD1 TYR A 27 9.750 -0.334 -7.808 1.00 14.12 C ATOM 401 CD2 TYR A 27 8.383 -0.114 -5.867 1.00 60.43 C ATOM 402 CE1 TYR A 27 8.621 -0.418 -8.599 1.00 54.23 C ATOM 403 CE2 TYR A 27 7.248 -0.199 -6.651 1.00 4.11 C ATOM 404 CZ TYR A 27 7.372 -0.350 -8.016 1.00 64.03 C ATOM 405 OH TYR A 27 6.245 -0.435 -8.801 1.00 42.42 O ATOM 0 H TYR A 27 10.986 1.720 -7.241 1.00 32.03 H new ATOM 0 HA TYR A 27 10.531 1.746 -4.507 1.00 24.12 H new ATOM 0 HB2 TYR A 27 11.724 -0.554 -6.093 1.00 42.22 H new ATOM 0 HB3 TYR A 27 10.730 -0.660 -4.654 1.00 42.22 H new ATOM 0 HD1 TYR A 27 10.726 -0.389 -8.268 1.00 14.12 H new ATOM 0 HD2 TYR A 27 8.282 0.006 -4.798 1.00 60.43 H new ATOM 0 HE1 TYR A 27 8.715 -0.536 -9.668 1.00 54.23 H new ATOM 0 HE2 TYR A 27 6.269 -0.147 -6.197 1.00 4.11 H new ATOM 0 HH TYR A 27 6.435 -0.987 -9.588 1.00 42.42 H new ATOM 415 N GLU A 28 12.630 1.108 -3.202 1.00 63.31 N ATOM 416 CA GLU A 28 13.864 1.090 -2.425 1.00 11.31 C ATOM 417 C GLU A 28 14.386 -0.335 -2.264 1.00 52.34 C ATOM 418 O GLU A 28 14.219 -0.954 -1.214 1.00 21.33 O ATOM 419 CB GLU A 28 13.635 1.719 -1.049 1.00 11.21 C ATOM 420 CG GLU A 28 14.903 2.254 -0.405 1.00 62.23 C ATOM 421 CD GLU A 28 15.640 3.236 -1.295 1.00 71.24 C ATOM 422 OE1 GLU A 28 15.102 4.336 -1.539 1.00 74.22 O ATOM 423 OE2 GLU A 28 16.756 2.904 -1.748 1.00 74.41 O ATOM 0 H GLU A 28 11.787 0.915 -2.661 1.00 63.31 H new ATOM 0 HA GLU A 28 14.611 1.673 -2.964 1.00 11.31 H new ATOM 0 HB2 GLU A 28 12.916 2.532 -1.146 1.00 11.21 H new ATOM 0 HB3 GLU A 28 13.188 0.976 -0.389 1.00 11.21 H new ATOM 0 HG2 GLU A 28 14.650 2.742 0.536 1.00 62.23 H new ATOM 0 HG3 GLU A 28 15.563 1.421 -0.165 1.00 62.23 H new ATOM 430 N VAL A 29 15.018 -0.849 -3.315 1.00 0.14 N ATOM 431 CA VAL A 29 15.565 -2.200 -3.291 1.00 61.23 C ATOM 432 C VAL A 29 16.953 -2.220 -2.660 1.00 73.51 C ATOM 433 O VAL A 29 17.790 -1.364 -2.946 1.00 64.44 O ATOM 434 CB VAL A 29 15.649 -2.796 -4.709 1.00 63.11 C ATOM 435 CG1 VAL A 29 16.435 -1.875 -5.630 1.00 12.11 C ATOM 436 CG2 VAL A 29 16.275 -4.182 -4.668 1.00 30.13 C ATOM 0 H VAL A 29 15.164 -0.350 -4.193 1.00 0.14 H new ATOM 0 HA VAL A 29 14.887 -2.806 -2.689 1.00 61.23 H new ATOM 0 HB VAL A 29 14.638 -2.890 -5.105 1.00 63.11 H new ATOM 0 HG11 VAL A 29 16.484 -2.313 -6.627 1.00 12.11 H new ATOM 0 HG12 VAL A 29 15.940 -0.905 -5.683 1.00 12.11 H new ATOM 0 HG13 VAL A 29 17.445 -1.746 -5.241 1.00 12.11 H new ATOM 0 HG21 VAL A 29 16.326 -4.588 -5.678 1.00 30.13 H new ATOM 0 HG22 VAL A 29 17.280 -4.115 -4.252 1.00 30.13 H new ATOM 0 HG23 VAL A 29 15.667 -4.837 -4.044 1.00 30.13 H new ATOM 446 N THR A 30 17.191 -3.205 -1.799 1.00 13.34 N ATOM 447 CA THR A 30 18.477 -3.337 -1.126 1.00 34.14 C ATOM 448 C THR A 30 18.983 -4.774 -1.184 1.00 54.23 C ATOM 449 O THR A 30 18.200 -5.722 -1.119 1.00 13.41 O ATOM 450 CB THR A 30 18.388 -2.896 0.348 1.00 53.14 C ATOM 451 OG1 THR A 30 17.999 -1.520 0.424 1.00 34.03 O ATOM 452 CG2 THR A 30 19.722 -3.091 1.052 1.00 33.03 C ATOM 0 H THR A 30 16.510 -3.923 -1.552 1.00 13.34 H new ATOM 0 HA THR A 30 19.176 -2.686 -1.651 1.00 34.14 H new ATOM 0 HB THR A 30 17.639 -3.513 0.845 1.00 53.14 H new ATOM 0 HG1 THR A 30 17.943 -1.247 1.364 1.00 34.03 H new ATOM 0 HG21 THR A 30 19.635 -2.773 2.091 1.00 33.03 H new ATOM 0 HG22 THR A 30 20.001 -4.144 1.017 1.00 33.03 H new ATOM 0 HG23 THR A 30 20.487 -2.496 0.553 1.00 33.03 H new ATOM 460 N VAL A 31 20.297 -4.929 -1.308 1.00 1.24 N ATOM 461 CA VAL A 31 20.908 -6.251 -1.373 1.00 61.02 C ATOM 462 C VAL A 31 21.727 -6.541 -0.121 1.00 5.44 C ATOM 463 O VAL A 31 22.427 -5.667 0.392 1.00 72.14 O ATOM 464 CB VAL A 31 21.815 -6.389 -2.610 1.00 64.32 C ATOM 465 CG1 VAL A 31 21.042 -6.063 -3.879 1.00 3.12 C ATOM 466 CG2 VAL A 31 23.038 -5.494 -2.476 1.00 62.41 C ATOM 0 H VAL A 31 20.959 -4.155 -1.365 1.00 1.24 H new ATOM 0 HA VAL A 31 20.094 -6.972 -1.445 1.00 61.02 H new ATOM 0 HB VAL A 31 22.155 -7.423 -2.676 1.00 64.32 H new ATOM 0 HG11 VAL A 31 21.700 -6.166 -4.742 1.00 3.12 H new ATOM 0 HG12 VAL A 31 20.201 -6.749 -3.979 1.00 3.12 H new ATOM 0 HG13 VAL A 31 20.671 -5.040 -3.826 1.00 3.12 H new ATOM 0 HG21 VAL A 31 23.668 -5.604 -3.359 1.00 62.41 H new ATOM 0 HG22 VAL A 31 22.720 -4.455 -2.384 1.00 62.41 H new ATOM 0 HG23 VAL A 31 23.603 -5.781 -1.589 1.00 62.41 H new ATOM 476 N ALA A 32 21.636 -7.773 0.368 1.00 63.34 N ATOM 477 CA ALA A 32 22.371 -8.179 1.559 1.00 22.31 C ATOM 478 C ALA A 32 23.592 -9.017 1.192 1.00 14.05 C ATOM 479 O ALA A 32 23.893 -9.210 0.015 1.00 51.50 O ATOM 480 CB ALA A 32 21.462 -8.953 2.502 1.00 13.11 C ATOM 0 H ALA A 32 21.060 -8.508 -0.043 1.00 63.34 H new ATOM 0 HA ALA A 32 22.719 -7.279 2.065 1.00 22.31 H new ATOM 0 HB1 ALA A 32 22.024 -9.250 3.387 1.00 13.11 H new ATOM 0 HB2 ALA A 32 20.624 -8.322 2.799 1.00 13.11 H new ATOM 0 HB3 ALA A 32 21.085 -9.842 1.996 1.00 13.11 H new ATOM 486 N ALA A 33 24.291 -9.512 2.209 1.00 53.04 N ATOM 487 CA ALA A 33 25.478 -10.330 1.993 1.00 74.04 C ATOM 488 C ALA A 33 25.100 -11.738 1.546 1.00 71.24 C ATOM 489 O ALA A 33 25.699 -12.288 0.621 1.00 10.12 O ATOM 490 CB ALA A 33 26.319 -10.384 3.259 1.00 30.01 C ATOM 0 H ALA A 33 24.056 -9.361 3.190 1.00 53.04 H new ATOM 0 HA ALA A 33 26.066 -9.871 1.199 1.00 74.04 H new ATOM 0 HB1 ALA A 33 27.202 -10.998 3.083 1.00 30.01 H new ATOM 0 HB2 ALA A 33 26.627 -9.375 3.534 1.00 30.01 H new ATOM 0 HB3 ALA A 33 25.731 -10.817 4.068 1.00 30.01 H new ATOM 496 N ASP A 34 24.104 -12.317 2.208 1.00 41.33 N ATOM 497 CA ASP A 34 23.646 -13.661 1.878 1.00 23.51 C ATOM 498 C ASP A 34 22.159 -13.819 2.181 1.00 5.12 C ATOM 499 O ASP A 34 21.517 -12.898 2.684 1.00 23.15 O ATOM 500 CB ASP A 34 24.451 -14.703 2.657 1.00 4.32 C ATOM 501 CG ASP A 34 25.786 -15.008 2.006 1.00 20.22 C ATOM 502 OD1 ASP A 34 26.822 -14.554 2.536 1.00 64.55 O ATOM 503 OD2 ASP A 34 25.794 -15.702 0.968 1.00 3.20 O ATOM 0 H ASP A 34 23.599 -11.876 2.976 1.00 41.33 H new ATOM 0 HA ASP A 34 23.799 -13.818 0.810 1.00 23.51 H new ATOM 0 HB2 ASP A 34 24.619 -14.344 3.672 1.00 4.32 H new ATOM 0 HB3 ASP A 34 23.870 -15.622 2.736 1.00 4.32 H new ATOM 508 N GLY A 35 21.618 -14.993 1.870 1.00 1.21 N ATOM 509 CA GLY A 35 20.211 -15.249 2.115 1.00 12.01 C ATOM 510 C GLY A 35 19.836 -15.081 3.574 1.00 4.33 C ATOM 511 O GLY A 35 18.722 -14.665 3.891 1.00 24.54 O ATOM 0 H GLY A 35 22.129 -15.771 1.453 1.00 1.21 H new ATOM 0 HA2 GLY A 35 19.611 -14.571 1.508 1.00 12.01 H new ATOM 0 HA3 GLY A 35 19.968 -16.262 1.795 1.00 12.01 H new ATOM 515 N GLU A 36 20.769 -15.406 4.464 1.00 10.43 N ATOM 516 CA GLU A 36 20.529 -15.290 5.898 1.00 71.21 C ATOM 517 C GLU A 36 20.553 -13.829 6.338 1.00 74.14 C ATOM 518 O GLU A 36 19.660 -13.370 7.050 1.00 41.45 O ATOM 519 CB GLU A 36 21.577 -16.086 6.679 1.00 72.13 C ATOM 520 CG GLU A 36 21.485 -15.900 8.184 1.00 62.20 C ATOM 521 CD GLU A 36 22.396 -16.844 8.945 1.00 61.12 C ATOM 522 OE1 GLU A 36 21.940 -17.424 9.952 1.00 33.33 O ATOM 523 OE2 GLU A 36 23.564 -17.002 8.534 1.00 63.34 O ATOM 0 H GLU A 36 21.697 -15.751 4.218 1.00 10.43 H new ATOM 0 HA GLU A 36 19.541 -15.699 6.109 1.00 71.21 H new ATOM 0 HB2 GLU A 36 21.466 -17.145 6.445 1.00 72.13 H new ATOM 0 HB3 GLU A 36 22.571 -15.788 6.345 1.00 72.13 H new ATOM 0 HG2 GLU A 36 21.742 -14.871 8.436 1.00 62.20 H new ATOM 0 HG3 GLU A 36 20.455 -16.058 8.504 1.00 62.20 H new ATOM 530 N ALA A 37 21.581 -13.105 5.908 1.00 12.34 N ATOM 531 CA ALA A 37 21.721 -11.696 6.256 1.00 72.02 C ATOM 532 C ALA A 37 20.520 -10.889 5.772 1.00 25.43 C ATOM 533 O ALA A 37 20.098 -9.935 6.424 1.00 64.11 O ATOM 534 CB ALA A 37 23.008 -11.133 5.670 1.00 34.55 C ATOM 0 H ALA A 37 22.329 -13.470 5.318 1.00 12.34 H new ATOM 0 HA ALA A 37 21.764 -11.618 7.342 1.00 72.02 H new ATOM 0 HB1 ALA A 37 23.100 -10.080 5.938 1.00 34.55 H new ATOM 0 HB2 ALA A 37 23.860 -11.684 6.068 1.00 34.55 H new ATOM 0 HB3 ALA A 37 22.987 -11.231 4.585 1.00 34.55 H new ATOM 540 N GLY A 38 19.975 -11.279 4.624 1.00 32.31 N ATOM 541 CA GLY A 38 18.829 -10.581 4.073 1.00 55.34 C ATOM 542 C GLY A 38 17.537 -10.934 4.784 1.00 42.43 C ATOM 543 O GLY A 38 16.793 -10.050 5.209 1.00 32.12 O ATOM 0 H GLY A 38 20.307 -12.066 4.066 1.00 32.31 H new ATOM 0 HA2 GLY A 38 18.995 -9.506 4.141 1.00 55.34 H new ATOM 0 HA3 GLY A 38 18.735 -10.823 3.014 1.00 55.34 H new ATOM 547 N PHE A 39 17.269 -12.229 4.912 1.00 42.11 N ATOM 548 CA PHE A 39 16.057 -12.697 5.574 1.00 1.21 C ATOM 549 C PHE A 39 16.033 -12.260 7.036 1.00 55.32 C ATOM 550 O PHE A 39 14.995 -11.847 7.554 1.00 31.12 O ATOM 551 CB PHE A 39 15.957 -14.221 5.484 1.00 3.00 C ATOM 552 CG PHE A 39 15.104 -14.700 4.344 1.00 4.41 C ATOM 553 CD1 PHE A 39 13.783 -14.299 4.235 1.00 53.54 C ATOM 554 CD2 PHE A 39 15.624 -15.550 3.382 1.00 65.02 C ATOM 555 CE1 PHE A 39 12.996 -14.738 3.187 1.00 34.21 C ATOM 556 CE2 PHE A 39 14.842 -15.993 2.332 1.00 42.33 C ATOM 557 CZ PHE A 39 13.526 -15.585 2.234 1.00 63.22 C ATOM 0 H PHE A 39 17.875 -12.973 4.566 1.00 42.11 H new ATOM 0 HA PHE A 39 15.201 -12.253 5.066 1.00 1.21 H new ATOM 0 HB2 PHE A 39 16.959 -14.637 5.377 1.00 3.00 H new ATOM 0 HB3 PHE A 39 15.550 -14.606 6.419 1.00 3.00 H new ATOM 0 HD1 PHE A 39 13.363 -13.636 4.977 1.00 53.54 H new ATOM 0 HD2 PHE A 39 16.653 -15.870 3.453 1.00 65.02 H new ATOM 0 HE1 PHE A 39 11.967 -14.419 3.114 1.00 34.21 H new ATOM 0 HE2 PHE A 39 15.259 -16.657 1.589 1.00 42.33 H new ATOM 0 HZ PHE A 39 12.913 -15.928 1.414 1.00 63.22 H new ATOM 567 N ASP A 40 17.182 -12.354 7.694 1.00 23.25 N ATOM 568 CA ASP A 40 17.294 -11.968 9.096 1.00 22.54 C ATOM 569 C ASP A 40 16.868 -10.517 9.296 1.00 21.45 C ATOM 570 O ASP A 40 16.139 -10.197 10.237 1.00 65.14 O ATOM 571 CB ASP A 40 18.729 -12.164 9.588 1.00 22.13 C ATOM 572 CG ASP A 40 18.947 -11.599 10.978 1.00 32.12 C ATOM 573 OD1 ASP A 40 18.153 -11.930 11.884 1.00 41.34 O ATOM 574 OD2 ASP A 40 19.910 -10.826 11.160 1.00 5.44 O ATOM 0 H ASP A 40 18.050 -12.694 7.280 1.00 23.25 H new ATOM 0 HA ASP A 40 16.629 -12.606 9.677 1.00 22.54 H new ATOM 0 HB2 ASP A 40 18.967 -13.228 9.590 1.00 22.13 H new ATOM 0 HB3 ASP A 40 19.417 -11.684 8.892 1.00 22.13 H new ATOM 579 N LEU A 41 17.328 -9.644 8.408 1.00 54.52 N ATOM 580 CA LEU A 41 16.995 -8.225 8.487 1.00 60.31 C ATOM 581 C LEU A 41 15.576 -7.970 7.990 1.00 34.31 C ATOM 582 O LEU A 41 14.873 -7.103 8.508 1.00 52.34 O ATOM 583 CB LEU A 41 17.990 -7.402 7.668 1.00 40.55 C ATOM 584 CG LEU A 41 19.452 -7.484 8.107 1.00 2.02 C ATOM 585 CD1 LEU A 41 20.370 -6.975 7.006 1.00 21.34 C ATOM 586 CD2 LEU A 41 19.668 -6.696 9.391 1.00 44.11 C ATOM 0 H LEU A 41 17.932 -9.892 7.625 1.00 54.52 H new ATOM 0 HA LEU A 41 17.054 -7.921 9.532 1.00 60.31 H new ATOM 0 HB2 LEU A 41 17.926 -7.722 6.628 1.00 40.55 H new ATOM 0 HB3 LEU A 41 17.680 -6.357 7.700 1.00 40.55 H new ATOM 0 HG LEU A 41 19.695 -8.529 8.300 1.00 2.02 H new ATOM 0 HD11 LEU A 41 21.406 -7.041 7.337 1.00 21.34 H new ATOM 0 HD12 LEU A 41 20.236 -7.582 6.111 1.00 21.34 H new ATOM 0 HD13 LEU A 41 20.127 -5.937 6.780 1.00 21.34 H new ATOM 0 HD21 LEU A 41 20.714 -6.765 9.689 1.00 44.11 H new ATOM 0 HD22 LEU A 41 19.407 -5.651 9.225 1.00 44.11 H new ATOM 0 HD23 LEU A 41 19.038 -7.107 10.180 1.00 44.11 H new ATOM 598 N ALA A 42 15.160 -8.734 6.985 1.00 51.32 N ATOM 599 CA ALA A 42 13.823 -8.593 6.421 1.00 21.52 C ATOM 600 C ALA A 42 12.755 -8.738 7.500 1.00 53.04 C ATOM 601 O ALA A 42 11.647 -8.220 7.362 1.00 11.14 O ATOM 602 CB ALA A 42 13.605 -9.619 5.319 1.00 51.04 C ATOM 0 H ALA A 42 15.730 -9.457 6.545 1.00 51.32 H new ATOM 0 HA ALA A 42 13.738 -7.594 5.994 1.00 21.52 H new ATOM 0 HB1 ALA A 42 12.603 -9.503 4.907 1.00 51.04 H new ATOM 0 HB2 ALA A 42 14.342 -9.468 4.530 1.00 51.04 H new ATOM 0 HB3 ALA A 42 13.714 -10.623 5.730 1.00 51.04 H new ATOM 608 N ALA A 43 13.095 -9.446 8.572 1.00 54.13 N ATOM 609 CA ALA A 43 12.165 -9.657 9.674 1.00 34.20 C ATOM 610 C ALA A 43 12.203 -8.491 10.656 1.00 22.30 C ATOM 611 O ALA A 43 11.206 -8.183 11.310 1.00 3.11 O ATOM 612 CB ALA A 43 12.481 -10.963 10.389 1.00 42.52 C ATOM 0 H ALA A 43 14.008 -9.883 8.701 1.00 54.13 H new ATOM 0 HA ALA A 43 11.158 -9.716 9.261 1.00 34.20 H new ATOM 0 HB1 ALA A 43 11.779 -11.108 11.210 1.00 42.52 H new ATOM 0 HB2 ALA A 43 12.395 -11.792 9.687 1.00 42.52 H new ATOM 0 HB3 ALA A 43 13.497 -10.926 10.783 1.00 42.52 H new ATOM 618 N THR A 44 13.361 -7.846 10.756 1.00 40.51 N ATOM 619 CA THR A 44 13.530 -6.715 11.660 1.00 41.35 C ATOM 620 C THR A 44 13.062 -5.417 11.010 1.00 34.45 C ATOM 621 O THR A 44 12.640 -4.485 11.695 1.00 2.43 O ATOM 622 CB THR A 44 15.000 -6.557 12.093 1.00 14.13 C ATOM 623 OG1 THR A 44 15.065 -6.173 13.471 1.00 2.22 O ATOM 624 CG2 THR A 44 15.708 -5.518 11.238 1.00 52.45 C ATOM 0 H THR A 44 14.196 -8.088 10.222 1.00 40.51 H new ATOM 0 HA THR A 44 12.919 -6.919 12.539 1.00 41.35 H new ATOM 0 HB THR A 44 15.501 -7.516 11.959 1.00 14.13 H new ATOM 0 HG1 THR A 44 16.002 -6.076 13.740 1.00 2.22 H new ATOM 0 HG21 THR A 44 16.744 -5.424 11.563 1.00 52.45 H new ATOM 0 HG22 THR A 44 15.682 -5.827 10.193 1.00 52.45 H new ATOM 0 HG23 THR A 44 15.206 -4.556 11.344 1.00 52.45 H new ATOM 632 N THR A 45 13.137 -5.364 9.684 1.00 11.32 N ATOM 633 CA THR A 45 12.721 -4.180 8.942 1.00 30.24 C ATOM 634 C THR A 45 11.340 -4.374 8.327 1.00 70.32 C ATOM 635 O THR A 45 10.551 -3.434 8.241 1.00 72.05 O ATOM 636 CB THR A 45 13.724 -3.836 7.826 1.00 44.43 C ATOM 637 OG1 THR A 45 14.891 -3.223 8.387 1.00 54.31 O ATOM 638 CG2 THR A 45 13.096 -2.901 6.803 1.00 3.32 C ATOM 0 H THR A 45 13.482 -6.127 9.102 1.00 11.32 H new ATOM 0 HA THR A 45 12.686 -3.356 9.655 1.00 30.24 H new ATOM 0 HB THR A 45 14.006 -4.761 7.324 1.00 44.43 H new ATOM 0 HG1 THR A 45 15.525 -3.009 7.671 1.00 54.31 H new ATOM 0 HG21 THR A 45 13.824 -2.672 6.024 1.00 3.32 H new ATOM 0 HG22 THR A 45 12.226 -3.382 6.356 1.00 3.32 H new ATOM 0 HG23 THR A 45 12.788 -1.978 7.294 1.00 3.32 H new ATOM 646 N ALA A 46 11.054 -5.600 7.901 1.00 62.33 N ATOM 647 CA ALA A 46 9.767 -5.918 7.296 1.00 53.14 C ATOM 648 C ALA A 46 9.572 -5.157 5.988 1.00 31.24 C ATOM 649 O ALA A 46 8.949 -4.096 5.964 1.00 55.34 O ATOM 650 CB ALA A 46 8.636 -5.604 8.265 1.00 64.35 C ATOM 0 H ALA A 46 11.697 -6.389 7.964 1.00 62.33 H new ATOM 0 HA ALA A 46 9.753 -6.984 7.071 1.00 53.14 H new ATOM 0 HB1 ALA A 46 7.681 -5.846 7.800 1.00 64.35 H new ATOM 0 HB2 ALA A 46 8.759 -6.196 9.172 1.00 64.35 H new ATOM 0 HB3 ALA A 46 8.658 -4.544 8.518 1.00 64.35 H new ATOM 656 N TYR A 47 10.109 -5.706 4.905 1.00 42.35 N ATOM 657 CA TYR A 47 9.997 -5.077 3.594 1.00 50.21 C ATOM 658 C TYR A 47 8.697 -5.481 2.905 1.00 62.40 C ATOM 659 O TYR A 47 7.993 -6.382 3.363 1.00 41.44 O ATOM 660 CB TYR A 47 11.192 -5.458 2.718 1.00 74.00 C ATOM 661 CG TYR A 47 12.514 -4.940 3.238 1.00 35.21 C ATOM 662 CD1 TYR A 47 13.156 -5.563 4.301 1.00 45.42 C ATOM 663 CD2 TYR A 47 13.120 -3.829 2.666 1.00 40.42 C ATOM 664 CE1 TYR A 47 14.364 -5.092 4.780 1.00 71.34 C ATOM 665 CE2 TYR A 47 14.328 -3.352 3.137 1.00 21.21 C ATOM 666 CZ TYR A 47 14.946 -3.987 4.194 1.00 32.14 C ATOM 667 OH TYR A 47 16.149 -3.516 4.668 1.00 62.35 O ATOM 0 H TYR A 47 10.626 -6.585 4.908 1.00 42.35 H new ATOM 0 HA TYR A 47 9.990 -3.996 3.737 1.00 50.21 H new ATOM 0 HB2 TYR A 47 11.243 -6.544 2.639 1.00 74.00 H new ATOM 0 HB3 TYR A 47 11.031 -5.073 1.711 1.00 74.00 H new ATOM 0 HD1 TYR A 47 12.704 -6.429 4.761 1.00 45.42 H new ATOM 0 HD2 TYR A 47 12.638 -3.329 1.839 1.00 40.42 H new ATOM 0 HE1 TYR A 47 14.850 -5.586 5.608 1.00 71.34 H new ATOM 0 HE2 TYR A 47 14.786 -2.487 2.680 1.00 21.21 H new ATOM 0 HH TYR A 47 16.422 -2.733 4.146 1.00 62.35 H new ATOM 677 N ASP A 48 8.386 -4.810 1.802 1.00 45.13 N ATOM 678 CA ASP A 48 7.173 -5.099 1.047 1.00 73.21 C ATOM 679 C ASP A 48 7.373 -6.308 0.139 1.00 72.53 C ATOM 680 O ASP A 48 6.452 -7.100 -0.072 1.00 4.44 O ATOM 681 CB ASP A 48 6.762 -3.883 0.215 1.00 60.31 C ATOM 682 CG ASP A 48 5.470 -3.258 0.702 1.00 12.03 C ATOM 683 OD1 ASP A 48 4.424 -3.938 0.648 1.00 33.22 O ATOM 684 OD2 ASP A 48 5.505 -2.089 1.139 1.00 52.43 O ATOM 0 H ASP A 48 8.958 -4.061 1.411 1.00 45.13 H new ATOM 0 HA ASP A 48 6.379 -5.328 1.757 1.00 73.21 H new ATOM 0 HB2 ASP A 48 7.557 -3.138 0.248 1.00 60.31 H new ATOM 0 HB3 ASP A 48 6.648 -4.181 -0.827 1.00 60.31 H new ATOM 689 N LEU A 49 8.580 -6.445 -0.398 1.00 62.30 N ATOM 690 CA LEU A 49 8.902 -7.558 -1.285 1.00 54.12 C ATOM 691 C LEU A 49 10.296 -8.102 -0.993 1.00 44.22 C ATOM 692 O LEU A 49 11.241 -7.340 -0.788 1.00 0.44 O ATOM 693 CB LEU A 49 8.810 -7.114 -2.746 1.00 44.31 C ATOM 694 CG LEU A 49 8.206 -8.127 -3.719 1.00 52.41 C ATOM 695 CD1 LEU A 49 8.210 -7.574 -5.136 1.00 12.11 C ATOM 696 CD2 LEU A 49 8.964 -9.444 -3.657 1.00 21.54 C ATOM 0 H LEU A 49 9.352 -5.799 -0.235 1.00 62.30 H new ATOM 0 HA LEU A 49 8.178 -8.353 -1.107 1.00 54.12 H new ATOM 0 HB2 LEU A 49 8.218 -6.200 -2.790 1.00 44.31 H new ATOM 0 HB3 LEU A 49 9.812 -6.861 -3.092 1.00 44.31 H new ATOM 0 HG LEU A 49 7.173 -8.312 -3.426 1.00 52.41 H new ATOM 0 HD11 LEU A 49 7.777 -8.309 -5.815 1.00 12.11 H new ATOM 0 HD12 LEU A 49 7.622 -6.657 -5.170 1.00 12.11 H new ATOM 0 HD13 LEU A 49 9.235 -7.360 -5.440 1.00 12.11 H new ATOM 0 HD21 LEU A 49 8.520 -10.153 -4.356 1.00 21.54 H new ATOM 0 HD22 LEU A 49 10.007 -9.276 -3.924 1.00 21.54 H new ATOM 0 HD23 LEU A 49 8.909 -9.848 -2.646 1.00 21.54 H new ATOM 708 N VAL A 50 10.419 -9.425 -0.979 1.00 32.43 N ATOM 709 CA VAL A 50 11.699 -10.072 -0.716 1.00 11.15 C ATOM 710 C VAL A 50 12.075 -11.025 -1.844 1.00 63.21 C ATOM 711 O VAL A 50 11.226 -11.742 -2.375 1.00 63.42 O ATOM 712 CB VAL A 50 11.671 -10.852 0.613 1.00 43.45 C ATOM 713 CG1 VAL A 50 13.008 -11.534 0.859 1.00 21.20 C ATOM 714 CG2 VAL A 50 11.315 -9.926 1.766 1.00 4.10 C ATOM 0 H VAL A 50 9.647 -10.070 -1.147 1.00 32.43 H new ATOM 0 HA VAL A 50 12.446 -9.281 -0.649 1.00 11.15 H new ATOM 0 HB VAL A 50 10.904 -11.623 0.546 1.00 43.45 H new ATOM 0 HG11 VAL A 50 12.970 -12.080 1.802 1.00 21.20 H new ATOM 0 HG12 VAL A 50 13.217 -12.229 0.046 1.00 21.20 H new ATOM 0 HG13 VAL A 50 13.796 -10.783 0.906 1.00 21.20 H new ATOM 0 HG21 VAL A 50 11.300 -10.493 2.697 1.00 4.10 H new ATOM 0 HG22 VAL A 50 12.058 -9.132 1.837 1.00 4.10 H new ATOM 0 HG23 VAL A 50 10.332 -9.489 1.591 1.00 4.10 H new ATOM 724 N LEU A 51 13.353 -11.029 -2.206 1.00 44.22 N ATOM 725 CA LEU A 51 13.844 -11.895 -3.272 1.00 61.15 C ATOM 726 C LEU A 51 14.992 -12.769 -2.779 1.00 24.42 C ATOM 727 O LEU A 51 16.093 -12.281 -2.520 1.00 12.22 O ATOM 728 CB LEU A 51 14.303 -11.057 -4.467 1.00 2.12 C ATOM 729 CG LEU A 51 13.242 -10.160 -5.105 1.00 72.32 C ATOM 730 CD1 LEU A 51 11.926 -10.909 -5.247 1.00 14.24 C ATOM 731 CD2 LEU A 51 13.051 -8.893 -4.285 1.00 42.42 C ATOM 0 H LEU A 51 14.068 -10.442 -1.777 1.00 44.22 H new ATOM 0 HA LEU A 51 13.026 -12.544 -3.584 1.00 61.15 H new ATOM 0 HB2 LEU A 51 15.135 -10.430 -4.147 1.00 2.12 H new ATOM 0 HB3 LEU A 51 14.687 -11.732 -5.232 1.00 2.12 H new ATOM 0 HG LEU A 51 13.584 -9.876 -6.100 1.00 72.32 H new ATOM 0 HD11 LEU A 51 11.183 -10.255 -5.703 1.00 14.24 H new ATOM 0 HD12 LEU A 51 12.073 -11.786 -5.877 1.00 14.24 H new ATOM 0 HD13 LEU A 51 11.578 -11.223 -4.263 1.00 14.24 H new ATOM 0 HD21 LEU A 51 12.292 -8.267 -4.754 1.00 42.42 H new ATOM 0 HD22 LEU A 51 12.731 -9.157 -3.277 1.00 42.42 H new ATOM 0 HD23 LEU A 51 13.993 -8.346 -4.235 1.00 42.42 H new ATOM 743 N THR A 52 14.730 -14.067 -2.652 1.00 51.52 N ATOM 744 CA THR A 52 15.741 -15.009 -2.191 1.00 32.51 C ATOM 745 C THR A 52 16.001 -16.090 -3.234 1.00 63.20 C ATOM 746 O THR A 52 15.198 -16.294 -4.144 1.00 60.14 O ATOM 747 CB THR A 52 15.323 -15.679 -0.868 1.00 52.11 C ATOM 748 OG1 THR A 52 16.318 -16.626 -0.462 1.00 55.34 O ATOM 749 CG2 THR A 52 13.980 -16.378 -1.016 1.00 61.43 C ATOM 0 H THR A 52 13.825 -14.489 -2.862 1.00 51.52 H new ATOM 0 HA THR A 52 16.655 -14.437 -2.028 1.00 32.51 H new ATOM 0 HB THR A 52 15.229 -14.904 -0.108 1.00 52.11 H new ATOM 0 HG1 THR A 52 16.786 -16.289 0.331 1.00 55.34 H new ATOM 0 HG21 THR A 52 13.706 -16.844 -0.069 1.00 61.43 H new ATOM 0 HG22 THR A 52 13.219 -15.649 -1.296 1.00 61.43 H new ATOM 0 HG23 THR A 52 14.051 -17.143 -1.789 1.00 61.43 H new ATOM 757 N ASP A 53 17.128 -16.780 -3.095 1.00 71.32 N ATOM 758 CA ASP A 53 17.493 -17.842 -4.025 1.00 64.43 C ATOM 759 C ASP A 53 17.912 -19.102 -3.274 1.00 73.51 C ATOM 760 O ASP A 53 18.287 -19.042 -2.104 1.00 31.14 O ATOM 761 CB ASP A 53 18.628 -17.379 -4.941 1.00 75.52 C ATOM 762 CG ASP A 53 19.973 -17.381 -4.243 1.00 0.04 C ATOM 763 OD1 ASP A 53 19.998 -17.222 -3.004 1.00 63.44 O ATOM 764 OD2 ASP A 53 21.001 -17.540 -4.934 1.00 51.12 O ATOM 0 H ASP A 53 17.804 -16.623 -2.348 1.00 71.32 H new ATOM 0 HA ASP A 53 16.618 -18.076 -4.632 1.00 64.43 H new ATOM 0 HB2 ASP A 53 18.674 -18.030 -5.814 1.00 75.52 H new ATOM 0 HB3 ASP A 53 18.412 -16.374 -5.303 1.00 75.52 H new ATOM 769 N GLN A 54 17.843 -20.242 -3.955 1.00 41.32 N ATOM 770 CA GLN A 54 18.213 -21.516 -3.351 1.00 1.01 C ATOM 771 C GLN A 54 19.680 -21.838 -3.614 1.00 44.25 C ATOM 772 O GLN A 54 20.240 -21.437 -4.634 1.00 61.21 O ATOM 773 CB GLN A 54 17.327 -22.638 -3.894 1.00 30.41 C ATOM 774 CG GLN A 54 17.681 -23.062 -5.310 1.00 64.21 C ATOM 775 CD GLN A 54 18.772 -24.114 -5.349 1.00 22.22 C ATOM 776 OE1 GLN A 54 19.852 -23.885 -5.894 1.00 62.52 O ATOM 777 NE2 GLN A 54 18.495 -25.276 -4.768 1.00 63.04 N ATOM 0 H GLN A 54 17.534 -20.309 -4.925 1.00 41.32 H new ATOM 0 HA GLN A 54 18.066 -21.435 -2.274 1.00 1.01 H new ATOM 0 HB2 GLN A 54 17.405 -23.502 -3.235 1.00 30.41 H new ATOM 0 HB3 GLN A 54 16.287 -22.312 -3.871 1.00 30.41 H new ATOM 0 HG2 GLN A 54 16.789 -23.450 -5.802 1.00 64.21 H new ATOM 0 HG3 GLN A 54 18.003 -22.189 -5.877 1.00 64.21 H new ATOM 0 HE21 GLN A 54 17.587 -25.422 -4.328 1.00 63.04 H new ATOM 0 HE22 GLN A 54 19.191 -26.022 -4.762 1.00 63.04 H new ATOM 786 N ASN A 55 20.298 -22.564 -2.688 1.00 13.42 N ATOM 787 CA ASN A 55 21.701 -22.938 -2.820 1.00 31.51 C ATOM 788 C ASN A 55 22.073 -24.019 -1.809 1.00 12.22 C ATOM 789 O ASN A 55 22.054 -23.785 -0.601 1.00 32.33 O ATOM 790 CB ASN A 55 22.598 -21.714 -2.628 1.00 13.13 C ATOM 791 CG ASN A 55 22.922 -21.024 -3.938 1.00 43.54 C ATOM 792 OD1 ASN A 55 22.366 -19.972 -4.253 1.00 55.42 O ATOM 793 ND2 ASN A 55 23.827 -21.614 -4.710 1.00 23.51 N ATOM 0 H ASN A 55 19.849 -22.905 -1.838 1.00 13.42 H new ATOM 0 HA ASN A 55 21.852 -23.336 -3.823 1.00 31.51 H new ATOM 0 HB2 ASN A 55 22.105 -21.007 -1.960 1.00 13.13 H new ATOM 0 HB3 ASN A 55 23.525 -22.019 -2.142 1.00 13.13 H new ATOM 0 HD21 ASN A 55 24.086 -21.195 -5.603 1.00 23.51 H new ATOM 0 HD22 ASN A 55 24.263 -22.486 -4.410 1.00 23.51 H new ATOM 800 N MET A 56 22.411 -25.201 -2.312 1.00 61.32 N ATOM 801 CA MET A 56 22.789 -26.317 -1.453 1.00 24.31 C ATOM 802 C MET A 56 21.624 -26.737 -0.562 1.00 5.51 C ATOM 803 O MET A 56 20.675 -25.983 -0.346 1.00 32.44 O ATOM 804 CB MET A 56 23.996 -25.939 -0.591 1.00 74.11 C ATOM 805 CG MET A 56 25.301 -26.556 -1.068 1.00 55.41 C ATOM 806 SD MET A 56 26.279 -25.421 -2.072 1.00 75.20 S ATOM 807 CE MET A 56 27.668 -26.465 -2.506 1.00 0.22 C ATOM 0 H MET A 56 22.431 -25.411 -3.310 1.00 61.32 H new ATOM 0 HA MET A 56 23.057 -27.159 -2.091 1.00 24.31 H new ATOM 0 HB2 MET A 56 24.099 -24.854 -0.581 1.00 74.11 H new ATOM 0 HB3 MET A 56 23.810 -26.251 0.437 1.00 74.11 H new ATOM 0 HG2 MET A 56 25.888 -26.869 -0.204 1.00 55.41 H new ATOM 0 HG3 MET A 56 25.084 -27.453 -1.648 1.00 55.41 H new ATOM 0 HE1 MET A 56 28.364 -25.904 -3.129 1.00 0.22 H new ATOM 0 HE2 MET A 56 28.175 -26.792 -1.598 1.00 0.22 H new ATOM 0 HE3 MET A 56 27.311 -27.336 -3.056 1.00 0.22 H new ATOM 817 N PRO A 57 21.696 -27.967 -0.032 1.00 42.32 N ATOM 818 CA PRO A 57 20.656 -28.513 0.844 1.00 72.20 C ATOM 819 C PRO A 57 20.622 -27.823 2.203 1.00 35.45 C ATOM 820 O PRO A 57 19.553 -27.622 2.781 1.00 22.43 O ATOM 821 CB PRO A 57 21.058 -29.982 1.000 1.00 44.25 C ATOM 822 CG PRO A 57 22.529 -29.998 0.764 1.00 63.30 C ATOM 823 CD PRO A 57 22.799 -28.919 -0.247 1.00 51.33 C ATOM 0 HA PRO A 57 19.658 -28.372 0.429 1.00 72.20 H new ATOM 0 HB2 PRO A 57 20.812 -30.357 1.994 1.00 44.25 H new ATOM 0 HB3 PRO A 57 20.535 -30.614 0.283 1.00 44.25 H new ATOM 0 HG2 PRO A 57 23.074 -29.811 1.689 1.00 63.30 H new ATOM 0 HG3 PRO A 57 22.854 -30.970 0.393 1.00 63.30 H new ATOM 0 HD2 PRO A 57 23.770 -28.452 -0.086 1.00 51.33 H new ATOM 0 HD3 PRO A 57 22.799 -29.312 -1.264 1.00 51.33 H new ATOM 831 N ARG A 58 21.797 -27.463 2.709 1.00 54.44 N ATOM 832 CA ARG A 58 21.900 -26.796 4.001 1.00 45.31 C ATOM 833 C ARG A 58 21.714 -25.289 3.851 1.00 5.44 C ATOM 834 O ARG A 58 22.407 -24.641 3.066 1.00 62.31 O ATOM 835 CB ARG A 58 23.257 -27.092 4.644 1.00 54.30 C ATOM 836 CG ARG A 58 23.215 -27.129 6.163 1.00 61.41 C ATOM 837 CD ARG A 58 22.532 -28.390 6.670 1.00 11.44 C ATOM 838 NE ARG A 58 23.378 -29.570 6.519 1.00 63.03 N ATOM 839 CZ ARG A 58 22.986 -30.800 6.830 1.00 23.41 C ATOM 840 NH1 ARG A 58 21.767 -31.010 7.307 1.00 23.44 N ATOM 841 NH2 ARG A 58 23.814 -31.824 6.664 1.00 42.12 N ATOM 0 H ARG A 58 22.691 -27.622 2.244 1.00 54.44 H new ATOM 0 HA ARG A 58 21.109 -27.180 4.645 1.00 45.31 H new ATOM 0 HB2 ARG A 58 23.623 -28.050 4.275 1.00 54.30 H new ATOM 0 HB3 ARG A 58 23.973 -26.334 4.327 1.00 54.30 H new ATOM 0 HG2 ARG A 58 24.230 -27.080 6.558 1.00 61.41 H new ATOM 0 HG3 ARG A 58 22.685 -26.252 6.535 1.00 61.41 H new ATOM 0 HD2 ARG A 58 22.271 -28.263 7.721 1.00 11.44 H new ATOM 0 HD3 ARG A 58 21.600 -28.541 6.126 1.00 11.44 H new ATOM 0 HE ARG A 58 24.322 -29.443 6.155 1.00 63.03 H new ATOM 0 HH11 ARG A 58 21.128 -30.226 7.436 1.00 23.44 H new ATOM 0 HH12 ARG A 58 21.468 -31.956 7.545 1.00 23.44 H new ATOM 0 HH21 ARG A 58 24.753 -31.667 6.297 1.00 42.12 H new ATOM 0 HH22 ARG A 58 23.512 -32.768 6.903 1.00 42.12 H new ATOM 855 N LYS A 59 20.774 -24.736 4.610 1.00 41.30 N ATOM 856 CA LYS A 59 20.496 -23.305 4.564 1.00 62.13 C ATOM 857 C LYS A 59 21.143 -22.587 5.744 1.00 41.34 C ATOM 858 O LYS A 59 21.742 -23.218 6.614 1.00 32.03 O ATOM 859 CB LYS A 59 18.986 -23.058 4.568 1.00 0.40 C ATOM 860 CG LYS A 59 18.256 -23.770 5.694 1.00 62.14 C ATOM 861 CD LYS A 59 17.661 -25.087 5.226 1.00 74.40 C ATOM 862 CE LYS A 59 16.152 -24.988 5.056 1.00 64.03 C ATOM 863 NZ LYS A 59 15.598 -26.161 4.324 1.00 3.13 N ATOM 0 H LYS A 59 20.191 -25.257 5.265 1.00 41.30 H new ATOM 0 HA LYS A 59 20.921 -22.907 3.642 1.00 62.13 H new ATOM 0 HB2 LYS A 59 18.802 -21.987 4.647 1.00 0.40 H new ATOM 0 HB3 LYS A 59 18.571 -23.383 3.614 1.00 0.40 H new ATOM 0 HG2 LYS A 59 18.946 -23.953 6.518 1.00 62.14 H new ATOM 0 HG3 LYS A 59 17.464 -23.128 6.079 1.00 62.14 H new ATOM 0 HD2 LYS A 59 18.117 -25.377 4.279 1.00 74.40 H new ATOM 0 HD3 LYS A 59 17.896 -25.870 5.946 1.00 74.40 H new ATOM 0 HE2 LYS A 59 15.680 -24.916 6.036 1.00 64.03 H new ATOM 0 HE3 LYS A 59 15.907 -24.074 4.516 1.00 64.03 H new ATOM 0 HZ1 LYS A 59 14.568 -26.056 4.229 1.00 3.13 H new ATOM 0 HZ2 LYS A 59 16.029 -26.216 3.379 1.00 3.13 H new ATOM 0 HZ3 LYS A 59 15.810 -27.031 4.852 1.00 3.13 H new ATOM 877 N SER A 60 21.017 -21.264 5.766 1.00 3.33 N ATOM 878 CA SER A 60 21.592 -20.459 6.838 1.00 32.54 C ATOM 879 C SER A 60 20.512 -19.646 7.546 1.00 42.24 C ATOM 880 O SER A 60 20.427 -19.640 8.773 1.00 62.11 O ATOM 881 CB SER A 60 22.669 -19.525 6.283 1.00 33.40 C ATOM 882 OG SER A 60 22.264 -18.956 5.050 1.00 33.40 O ATOM 0 H SER A 60 20.522 -20.727 5.054 1.00 3.33 H new ATOM 0 HA SER A 60 22.047 -21.135 7.562 1.00 32.54 H new ATOM 0 HB2 SER A 60 22.874 -18.733 7.003 1.00 33.40 H new ATOM 0 HB3 SER A 60 23.598 -20.078 6.144 1.00 33.40 H new ATOM 0 HG SER A 60 22.969 -18.362 4.717 1.00 33.40 H new ATOM 888 N GLY A 61 19.688 -18.959 6.760 1.00 1.43 N ATOM 889 CA GLY A 61 18.625 -18.150 7.328 1.00 74.45 C ATOM 890 C GLY A 61 17.348 -18.218 6.513 1.00 11.22 C ATOM 891 O GLY A 61 16.599 -17.243 6.437 1.00 41.32 O ATOM 0 H GLY A 61 19.738 -18.948 5.741 1.00 1.43 H new ATOM 0 HA2 GLY A 61 18.422 -18.484 8.345 1.00 74.45 H new ATOM 0 HA3 GLY A 61 18.956 -17.114 7.393 1.00 74.45 H new ATOM 895 N LEU A 62 17.098 -19.370 5.902 1.00 65.35 N ATOM 896 CA LEU A 62 15.904 -19.561 5.087 1.00 74.14 C ATOM 897 C LEU A 62 14.726 -20.013 5.944 1.00 11.44 C ATOM 898 O LEU A 62 13.581 -19.640 5.688 1.00 23.55 O ATOM 899 CB LEU A 62 16.172 -20.589 3.986 1.00 34.22 C ATOM 900 CG LEU A 62 16.807 -20.050 2.704 1.00 23.13 C ATOM 901 CD1 LEU A 62 15.810 -19.203 1.929 1.00 1.24 C ATOM 902 CD2 LEU A 62 18.057 -19.244 3.027 1.00 64.42 C ATOM 0 H LEU A 62 17.707 -20.187 5.955 1.00 65.35 H new ATOM 0 HA LEU A 62 15.651 -18.605 4.629 1.00 74.14 H new ATOM 0 HB2 LEU A 62 16.822 -21.364 4.391 1.00 34.22 H new ATOM 0 HB3 LEU A 62 15.228 -21.068 3.726 1.00 34.22 H new ATOM 0 HG LEU A 62 17.095 -20.896 2.080 1.00 23.13 H new ATOM 0 HD11 LEU A 62 16.280 -18.828 1.020 1.00 1.24 H new ATOM 0 HD12 LEU A 62 14.944 -19.810 1.666 1.00 1.24 H new ATOM 0 HD13 LEU A 62 15.490 -18.363 2.545 1.00 1.24 H new ATOM 0 HD21 LEU A 62 18.496 -18.868 2.103 1.00 64.42 H new ATOM 0 HD22 LEU A 62 17.793 -18.405 3.671 1.00 64.42 H new ATOM 0 HD23 LEU A 62 18.779 -19.881 3.539 1.00 64.42 H new ATOM 914 N GLU A 63 15.016 -20.815 6.964 1.00 41.02 N ATOM 915 CA GLU A 63 13.980 -21.316 7.860 1.00 44.41 C ATOM 916 C GLU A 63 13.123 -20.172 8.393 1.00 54.41 C ATOM 917 O GLU A 63 11.938 -20.350 8.680 1.00 61.00 O ATOM 918 CB GLU A 63 14.610 -22.082 9.025 1.00 12.44 C ATOM 919 CG GLU A 63 13.645 -23.023 9.727 1.00 62.25 C ATOM 920 CD GLU A 63 13.068 -24.069 8.792 1.00 12.33 C ATOM 921 OE1 GLU A 63 13.856 -24.750 8.103 1.00 13.35 O ATOM 922 OE2 GLU A 63 11.827 -24.206 8.751 1.00 40.33 O ATOM 0 H GLU A 63 15.959 -21.131 7.190 1.00 41.02 H new ATOM 0 HA GLU A 63 13.340 -21.993 7.293 1.00 44.41 H new ATOM 0 HB2 GLU A 63 15.459 -22.656 8.655 1.00 12.44 H new ATOM 0 HB3 GLU A 63 15.000 -21.368 9.750 1.00 12.44 H new ATOM 0 HG2 GLU A 63 14.161 -23.520 10.549 1.00 62.25 H new ATOM 0 HG3 GLU A 63 12.832 -22.444 10.165 1.00 62.25 H new ATOM 929 N LEU A 64 13.729 -18.997 8.523 1.00 11.24 N ATOM 930 CA LEU A 64 13.022 -17.822 9.023 1.00 70.35 C ATOM 931 C LEU A 64 11.701 -17.628 8.286 1.00 73.04 C ATOM 932 O LEU A 64 10.716 -17.171 8.867 1.00 40.11 O ATOM 933 CB LEU A 64 13.893 -16.575 8.868 1.00 3.53 C ATOM 934 CG LEU A 64 14.874 -16.295 10.008 1.00 72.50 C ATOM 935 CD1 LEU A 64 15.776 -17.497 10.242 1.00 62.00 C ATOM 936 CD2 LEU A 64 15.702 -15.055 9.707 1.00 11.33 C ATOM 0 H LEU A 64 14.708 -18.832 8.289 1.00 11.24 H new ATOM 0 HA LEU A 64 12.808 -17.979 10.080 1.00 70.35 H new ATOM 0 HB2 LEU A 64 14.460 -16.665 7.941 1.00 3.53 H new ATOM 0 HB3 LEU A 64 13.238 -15.710 8.758 1.00 3.53 H new ATOM 0 HG LEU A 64 14.302 -16.113 10.918 1.00 72.50 H new ATOM 0 HD11 LEU A 64 16.467 -17.280 11.056 1.00 62.00 H new ATOM 0 HD12 LEU A 64 15.168 -18.363 10.503 1.00 62.00 H new ATOM 0 HD13 LEU A 64 16.340 -17.711 9.334 1.00 62.00 H new ATOM 0 HD21 LEU A 64 16.394 -14.871 10.529 1.00 11.33 H new ATOM 0 HD22 LEU A 64 16.265 -15.208 8.786 1.00 11.33 H new ATOM 0 HD23 LEU A 64 15.041 -14.196 9.590 1.00 11.33 H new ATOM 948 N ILE A 65 11.686 -17.980 7.004 1.00 25.04 N ATOM 949 CA ILE A 65 10.485 -17.847 6.190 1.00 62.44 C ATOM 950 C ILE A 65 9.278 -18.469 6.884 1.00 3.13 C ATOM 951 O ILE A 65 8.180 -17.915 6.856 1.00 11.24 O ATOM 952 CB ILE A 65 10.665 -18.507 4.810 1.00 62.23 C ATOM 953 CG1 ILE A 65 11.830 -17.860 4.059 1.00 43.44 C ATOM 954 CG2 ILE A 65 9.381 -18.401 4.000 1.00 5.12 C ATOM 955 CD1 ILE A 65 12.283 -18.648 2.850 1.00 71.32 C ATOM 0 H ILE A 65 12.492 -18.359 6.508 1.00 25.04 H new ATOM 0 HA ILE A 65 10.313 -16.779 6.054 1.00 62.44 H new ATOM 0 HB ILE A 65 10.893 -19.563 4.956 1.00 62.23 H new ATOM 0 HG12 ILE A 65 11.536 -16.860 3.741 1.00 43.44 H new ATOM 0 HG13 ILE A 65 12.671 -17.743 4.742 1.00 43.44 H new ATOM 0 HG21 ILE A 65 9.524 -18.872 3.028 1.00 5.12 H new ATOM 0 HG22 ILE A 65 8.573 -18.904 4.531 1.00 5.12 H new ATOM 0 HG23 ILE A 65 9.125 -17.351 3.860 1.00 5.12 H new ATOM 0 HD11 ILE A 65 13.111 -18.130 2.367 1.00 71.32 H new ATOM 0 HD12 ILE A 65 12.609 -19.640 3.163 1.00 71.32 H new ATOM 0 HD13 ILE A 65 11.456 -18.743 2.147 1.00 71.32 H new ATOM 967 N ALA A 66 9.491 -19.623 7.509 1.00 41.44 N ATOM 968 CA ALA A 66 8.422 -20.318 8.214 1.00 11.13 C ATOM 969 C ALA A 66 7.922 -19.498 9.399 1.00 42.11 C ATOM 970 O ALA A 66 6.733 -19.506 9.714 1.00 54.03 O ATOM 971 CB ALA A 66 8.899 -21.685 8.680 1.00 22.43 C ATOM 0 H ALA A 66 10.394 -20.096 7.541 1.00 41.44 H new ATOM 0 HA ALA A 66 7.591 -20.452 7.522 1.00 11.13 H new ATOM 0 HB1 ALA A 66 8.090 -22.193 9.205 1.00 22.43 H new ATOM 0 HB2 ALA A 66 9.201 -22.279 7.817 1.00 22.43 H new ATOM 0 HB3 ALA A 66 9.749 -21.564 9.352 1.00 22.43 H new ATOM 977 N ALA A 67 8.839 -18.792 10.052 1.00 11.45 N ATOM 978 CA ALA A 67 8.490 -17.965 11.202 1.00 64.43 C ATOM 979 C ALA A 67 7.750 -16.705 10.767 1.00 30.14 C ATOM 980 O ALA A 67 6.872 -16.213 11.477 1.00 12.11 O ATOM 981 CB ALA A 67 9.741 -17.601 11.988 1.00 11.30 C ATOM 0 H ALA A 67 9.829 -18.776 9.805 1.00 11.45 H new ATOM 0 HA ALA A 67 7.825 -18.541 11.845 1.00 64.43 H new ATOM 0 HB1 ALA A 67 9.466 -16.984 12.843 1.00 11.30 H new ATOM 0 HB2 ALA A 67 10.228 -18.511 12.338 1.00 11.30 H new ATOM 0 HB3 ALA A 67 10.426 -17.047 11.346 1.00 11.30 H new ATOM 987 N LEU A 68 8.110 -16.187 9.598 1.00 13.55 N ATOM 988 CA LEU A 68 7.479 -14.982 9.069 1.00 4.14 C ATOM 989 C LEU A 68 6.133 -15.308 8.430 1.00 44.40 C ATOM 990 O LEU A 68 5.193 -14.516 8.502 1.00 21.31 O ATOM 991 CB LEU A 68 8.395 -14.312 8.044 1.00 43.32 C ATOM 992 CG LEU A 68 9.382 -13.283 8.596 1.00 0.45 C ATOM 993 CD1 LEU A 68 10.353 -13.940 9.565 1.00 33.30 C ATOM 994 CD2 LEU A 68 10.136 -12.604 7.462 1.00 14.51 C ATOM 0 H LEU A 68 8.835 -16.582 8.999 1.00 13.55 H new ATOM 0 HA LEU A 68 7.309 -14.296 9.899 1.00 4.14 H new ATOM 0 HB2 LEU A 68 8.961 -15.089 7.530 1.00 43.32 H new ATOM 0 HB3 LEU A 68 7.772 -13.823 7.295 1.00 43.32 H new ATOM 0 HG LEU A 68 8.819 -12.523 9.137 1.00 0.45 H new ATOM 0 HD11 LEU A 68 11.048 -13.192 9.947 1.00 33.30 H new ATOM 0 HD12 LEU A 68 9.798 -14.378 10.395 1.00 33.30 H new ATOM 0 HD13 LEU A 68 10.910 -14.722 9.048 1.00 33.30 H new ATOM 0 HD21 LEU A 68 10.834 -11.875 7.874 1.00 14.51 H new ATOM 0 HD22 LEU A 68 10.687 -13.352 6.892 1.00 14.51 H new ATOM 0 HD23 LEU A 68 9.428 -12.098 6.806 1.00 14.51 H new ATOM 1006 N ARG A 69 6.048 -16.478 7.806 1.00 22.13 N ATOM 1007 CA ARG A 69 4.817 -16.909 7.155 1.00 10.02 C ATOM 1008 C ARG A 69 3.709 -17.132 8.180 1.00 21.24 C ATOM 1009 O ARG A 69 2.588 -16.653 8.010 1.00 22.44 O ATOM 1010 CB ARG A 69 5.058 -18.194 6.361 1.00 52.13 C ATOM 1011 CG ARG A 69 3.815 -18.720 5.662 1.00 34.35 C ATOM 1012 CD ARG A 69 3.601 -20.199 5.945 1.00 32.13 C ATOM 1013 NE ARG A 69 2.736 -20.827 4.950 1.00 33.23 N ATOM 1014 CZ ARG A 69 2.582 -22.142 4.835 1.00 50.40 C ATOM 1015 NH1 ARG A 69 3.232 -22.962 5.649 1.00 75.31 N ATOM 1016 NH2 ARG A 69 1.777 -22.637 3.904 1.00 34.43 N ATOM 0 H ARG A 69 6.817 -17.145 7.737 1.00 22.13 H new ATOM 0 HA ARG A 69 4.502 -16.121 6.471 1.00 10.02 H new ATOM 0 HB2 ARG A 69 5.833 -18.011 5.617 1.00 52.13 H new ATOM 0 HB3 ARG A 69 5.438 -18.962 7.035 1.00 52.13 H new ATOM 0 HG2 ARG A 69 2.943 -18.155 5.993 1.00 34.35 H new ATOM 0 HG3 ARG A 69 3.907 -18.564 4.587 1.00 34.35 H new ATOM 0 HD2 ARG A 69 4.565 -20.708 5.961 1.00 32.13 H new ATOM 0 HD3 ARG A 69 3.161 -20.319 6.935 1.00 32.13 H new ATOM 0 HE ARG A 69 2.222 -20.223 4.308 1.00 33.23 H new ATOM 0 HH11 ARG A 69 3.852 -22.584 6.365 1.00 75.31 H new ATOM 0 HH12 ARG A 69 3.112 -23.971 5.559 1.00 75.31 H new ATOM 0 HH21 ARG A 69 1.276 -22.008 3.276 1.00 34.43 H new ATOM 0 HH22 ARG A 69 1.659 -23.646 3.816 1.00 34.43 H new ATOM 1030 N GLN A 70 4.032 -17.862 9.243 1.00 33.40 N ATOM 1031 CA GLN A 70 3.063 -18.150 10.294 1.00 1.24 C ATOM 1032 C GLN A 70 2.475 -16.861 10.860 1.00 60.22 C ATOM 1033 O GLN A 70 1.302 -16.813 11.234 1.00 63.13 O ATOM 1034 CB GLN A 70 3.719 -18.959 11.414 1.00 24.23 C ATOM 1035 CG GLN A 70 4.919 -18.268 12.042 1.00 14.33 C ATOM 1036 CD GLN A 70 5.473 -19.026 13.232 1.00 33.31 C ATOM 1037 OE1 GLN A 70 5.270 -18.635 14.382 1.00 44.52 O ATOM 1038 NE2 GLN A 70 6.177 -20.119 12.962 1.00 73.41 N ATOM 0 H GLN A 70 4.956 -18.264 9.399 1.00 33.40 H new ATOM 0 HA GLN A 70 2.255 -18.736 9.857 1.00 1.24 H new ATOM 0 HB2 GLN A 70 2.978 -19.158 12.189 1.00 24.23 H new ATOM 0 HB3 GLN A 70 4.033 -19.925 11.017 1.00 24.23 H new ATOM 0 HG2 GLN A 70 5.702 -18.155 11.292 1.00 14.33 H new ATOM 0 HG3 GLN A 70 4.632 -17.265 12.357 1.00 14.33 H new ATOM 0 HE21 GLN A 70 6.321 -20.407 11.994 1.00 73.41 H new ATOM 0 HE22 GLN A 70 6.574 -20.671 13.723 1.00 73.41 H new ATOM 1047 N LEU A 71 3.296 -15.819 10.920 1.00 2.31 N ATOM 1048 CA LEU A 71 2.858 -14.528 11.441 1.00 74.35 C ATOM 1049 C LEU A 71 1.931 -13.829 10.451 1.00 3.52 C ATOM 1050 O LEU A 71 1.963 -14.106 9.252 1.00 25.03 O ATOM 1051 CB LEU A 71 4.066 -13.640 11.741 1.00 21.11 C ATOM 1052 CG LEU A 71 4.471 -13.532 13.212 1.00 73.42 C ATOM 1053 CD1 LEU A 71 4.762 -14.909 13.787 1.00 24.44 C ATOM 1054 CD2 LEU A 71 5.679 -12.620 13.367 1.00 31.41 C ATOM 0 H LEU A 71 4.269 -15.842 10.614 1.00 2.31 H new ATOM 0 HA LEU A 71 2.307 -14.704 12.365 1.00 74.35 H new ATOM 0 HB2 LEU A 71 4.919 -14.018 11.177 1.00 21.11 H new ATOM 0 HB3 LEU A 71 3.856 -12.637 11.368 1.00 21.11 H new ATOM 0 HG LEU A 71 3.640 -13.097 13.767 1.00 73.42 H new ATOM 0 HD11 LEU A 71 5.049 -14.813 14.834 1.00 24.44 H new ATOM 0 HD12 LEU A 71 3.870 -15.531 13.710 1.00 24.44 H new ATOM 0 HD13 LEU A 71 5.576 -15.372 13.229 1.00 24.44 H new ATOM 0 HD21 LEU A 71 5.953 -12.555 14.420 1.00 31.41 H new ATOM 0 HD22 LEU A 71 6.516 -13.025 12.799 1.00 31.41 H new ATOM 0 HD23 LEU A 71 5.434 -11.626 12.994 1.00 31.41 H new ATOM 1066 N SER A 72 1.108 -12.918 10.961 1.00 30.34 N ATOM 1067 CA SER A 72 0.171 -12.179 10.123 1.00 23.30 C ATOM 1068 C SER A 72 0.758 -10.833 9.709 1.00 21.20 C ATOM 1069 O SER A 72 0.040 -9.841 9.589 1.00 30.15 O ATOM 1070 CB SER A 72 -1.150 -11.966 10.864 1.00 73.23 C ATOM 1071 OG SER A 72 -2.184 -11.598 9.967 1.00 60.52 O ATOM 0 H SER A 72 1.071 -12.674 11.951 1.00 30.34 H new ATOM 0 HA SER A 72 -0.016 -12.766 9.224 1.00 23.30 H new ATOM 0 HB2 SER A 72 -1.428 -12.880 11.389 1.00 73.23 H new ATOM 0 HB3 SER A 72 -1.026 -11.190 11.619 1.00 73.23 H new ATOM 0 HG SER A 72 -1.895 -10.830 9.432 1.00 60.52 H new ATOM 1077 N ALA A 73 2.069 -10.808 9.492 1.00 70.02 N ATOM 1078 CA ALA A 73 2.753 -9.586 9.089 1.00 3.53 C ATOM 1079 C ALA A 73 3.488 -9.778 7.767 1.00 3.31 C ATOM 1080 O ALA A 73 3.615 -8.844 6.975 1.00 53.14 O ATOM 1081 CB ALA A 73 3.723 -9.142 10.175 1.00 52.43 C ATOM 0 H ALA A 73 2.678 -11.620 9.589 1.00 70.02 H new ATOM 0 HA ALA A 73 2.002 -8.809 8.947 1.00 3.53 H new ATOM 0 HB1 ALA A 73 4.227 -8.228 9.861 1.00 52.43 H new ATOM 0 HB2 ALA A 73 3.175 -8.955 11.098 1.00 52.43 H new ATOM 0 HB3 ALA A 73 4.463 -9.925 10.344 1.00 52.43 H new ATOM 1087 N TYR A 74 3.972 -10.993 7.536 1.00 73.13 N ATOM 1088 CA TYR A 74 4.697 -11.306 6.310 1.00 22.54 C ATOM 1089 C TYR A 74 3.889 -12.250 5.425 1.00 51.22 C ATOM 1090 O TYR A 74 4.071 -12.286 4.208 1.00 2.23 O ATOM 1091 CB TYR A 74 6.052 -11.935 6.642 1.00 73.25 C ATOM 1092 CG TYR A 74 6.809 -11.205 7.728 1.00 72.22 C ATOM 1093 CD1 TYR A 74 6.501 -11.401 9.068 1.00 34.44 C ATOM 1094 CD2 TYR A 74 7.831 -10.319 7.414 1.00 44.42 C ATOM 1095 CE1 TYR A 74 7.189 -10.736 10.064 1.00 21.24 C ATOM 1096 CE2 TYR A 74 8.526 -9.650 8.403 1.00 21.22 C ATOM 1097 CZ TYR A 74 8.201 -9.862 9.727 1.00 62.12 C ATOM 1098 OH TYR A 74 8.890 -9.197 10.715 1.00 30.12 O ATOM 0 H TYR A 74 3.876 -11.777 8.181 1.00 73.13 H new ATOM 0 HA TYR A 74 4.858 -10.376 5.765 1.00 22.54 H new ATOM 0 HB2 TYR A 74 5.897 -12.969 6.951 1.00 73.25 H new ATOM 0 HB3 TYR A 74 6.662 -11.960 5.739 1.00 73.25 H new ATOM 0 HD1 TYR A 74 5.710 -12.085 9.336 1.00 34.44 H new ATOM 0 HD2 TYR A 74 8.087 -10.150 6.379 1.00 44.42 H new ATOM 0 HE1 TYR A 74 6.936 -10.900 11.101 1.00 21.24 H new ATOM 0 HE2 TYR A 74 9.319 -8.965 8.141 1.00 21.22 H new ATOM 0 HH TYR A 74 9.650 -8.721 10.320 1.00 30.12 H new ATOM 1108 N ALA A 75 2.994 -13.012 6.045 1.00 1.12 N ATOM 1109 CA ALA A 75 2.155 -13.954 5.315 1.00 42.23 C ATOM 1110 C ALA A 75 1.518 -13.292 4.098 1.00 54.21 C ATOM 1111 O ALA A 75 1.390 -13.908 3.040 1.00 41.13 O ATOM 1112 CB ALA A 75 1.082 -14.525 6.230 1.00 4.11 C ATOM 0 H ALA A 75 2.831 -12.995 7.052 1.00 1.12 H new ATOM 0 HA ALA A 75 2.788 -14.769 4.963 1.00 42.23 H new ATOM 0 HB1 ALA A 75 0.463 -15.227 5.671 1.00 4.11 H new ATOM 0 HB2 ALA A 75 1.554 -15.043 7.065 1.00 4.11 H new ATOM 0 HB3 ALA A 75 0.459 -13.715 6.610 1.00 4.11 H new ATOM 1118 N ASP A 76 1.118 -12.035 4.256 1.00 42.33 N ATOM 1119 CA ASP A 76 0.494 -11.289 3.169 1.00 13.23 C ATOM 1120 C ASP A 76 1.538 -10.819 2.162 1.00 64.44 C ATOM 1121 O ASP A 76 1.280 -10.772 0.959 1.00 54.25 O ATOM 1122 CB ASP A 76 -0.275 -10.088 3.723 1.00 41.23 C ATOM 1123 CG ASP A 76 -1.279 -9.535 2.730 1.00 63.52 C ATOM 1124 OD1 ASP A 76 -2.167 -10.299 2.298 1.00 71.20 O ATOM 1125 OD2 ASP A 76 -1.175 -8.340 2.384 1.00 15.30 O ATOM 0 H ASP A 76 1.215 -11.511 5.126 1.00 42.33 H new ATOM 0 HA ASP A 76 -0.203 -11.954 2.658 1.00 13.23 H new ATOM 0 HB2 ASP A 76 -0.795 -10.382 4.635 1.00 41.23 H new ATOM 0 HB3 ASP A 76 0.430 -9.304 3.997 1.00 41.23 H new ATOM 1130 N THR A 77 2.721 -10.472 2.661 1.00 73.13 N ATOM 1131 CA THR A 77 3.804 -10.004 1.805 1.00 32.31 C ATOM 1132 C THR A 77 4.089 -10.999 0.686 1.00 62.01 C ATOM 1133 O THR A 77 4.334 -12.182 0.922 1.00 63.32 O ATOM 1134 CB THR A 77 5.096 -9.771 2.611 1.00 33.11 C ATOM 1135 OG1 THR A 77 4.888 -8.739 3.581 1.00 1.33 O ATOM 1136 CG2 THR A 77 6.245 -9.386 1.692 1.00 60.53 C ATOM 0 H THR A 77 2.953 -10.506 3.654 1.00 73.13 H new ATOM 0 HA THR A 77 3.479 -9.058 1.372 1.00 32.31 H new ATOM 0 HB THR A 77 5.354 -10.700 3.119 1.00 33.11 H new ATOM 0 HG1 THR A 77 5.713 -8.598 4.091 1.00 1.33 H new ATOM 0 HG21 THR A 77 7.146 -9.227 2.284 1.00 60.53 H new ATOM 0 HG22 THR A 77 6.420 -10.186 0.973 1.00 60.53 H new ATOM 0 HG23 THR A 77 5.993 -8.469 1.160 1.00 60.53 H new ATOM 1144 N PRO A 78 4.058 -10.511 -0.563 1.00 42.20 N ATOM 1145 CA PRO A 78 4.313 -11.341 -1.744 1.00 53.11 C ATOM 1146 C PRO A 78 5.771 -11.774 -1.845 1.00 23.11 C ATOM 1147 O PRO A 78 6.597 -11.075 -2.434 1.00 35.30 O ATOM 1148 CB PRO A 78 3.947 -10.420 -2.911 1.00 14.14 C ATOM 1149 CG PRO A 78 4.131 -9.041 -2.377 1.00 71.31 C ATOM 1150 CD PRO A 78 3.773 -9.110 -0.918 1.00 72.53 C ATOM 0 HA PRO A 78 3.742 -12.269 -1.720 1.00 53.11 H new ATOM 0 HB2 PRO A 78 4.589 -10.600 -3.773 1.00 14.14 H new ATOM 0 HB3 PRO A 78 2.920 -10.584 -3.238 1.00 14.14 H new ATOM 0 HG2 PRO A 78 5.159 -8.705 -2.511 1.00 71.31 H new ATOM 0 HG3 PRO A 78 3.492 -8.331 -2.902 1.00 71.31 H new ATOM 0 HD2 PRO A 78 4.368 -8.416 -0.325 1.00 72.53 H new ATOM 0 HD3 PRO A 78 2.726 -8.857 -0.749 1.00 72.53 H new ATOM 1158 N ILE A 79 6.082 -12.930 -1.267 1.00 53.33 N ATOM 1159 CA ILE A 79 7.441 -13.456 -1.294 1.00 52.31 C ATOM 1160 C ILE A 79 7.732 -14.160 -2.615 1.00 51.42 C ATOM 1161 O ILE A 79 6.908 -14.924 -3.119 1.00 32.23 O ATOM 1162 CB ILE A 79 7.686 -14.441 -0.136 1.00 3.43 C ATOM 1163 CG1 ILE A 79 7.492 -13.738 1.210 1.00 71.14 C ATOM 1164 CG2 ILE A 79 9.084 -15.034 -0.232 1.00 73.34 C ATOM 1165 CD1 ILE A 79 8.458 -12.597 1.440 1.00 14.05 C ATOM 0 H ILE A 79 5.411 -13.520 -0.775 1.00 53.33 H new ATOM 0 HA ILE A 79 8.111 -12.604 -1.184 1.00 52.31 H new ATOM 0 HB ILE A 79 6.962 -15.252 -0.209 1.00 3.43 H new ATOM 0 HG12 ILE A 79 6.472 -13.357 1.268 1.00 71.14 H new ATOM 0 HG13 ILE A 79 7.606 -14.468 2.012 1.00 71.14 H new ATOM 0 HG21 ILE A 79 9.242 -15.728 0.593 1.00 73.34 H new ATOM 0 HG22 ILE A 79 9.190 -15.565 -1.178 1.00 73.34 H new ATOM 0 HG23 ILE A 79 9.823 -14.234 -0.180 1.00 73.34 H new ATOM 0 HD11 ILE A 79 8.263 -12.145 2.413 1.00 14.05 H new ATOM 0 HD12 ILE A 79 9.480 -12.975 1.414 1.00 14.05 H new ATOM 0 HD13 ILE A 79 8.328 -11.847 0.659 1.00 14.05 H new ATOM 1177 N LEU A 80 8.910 -13.898 -3.171 1.00 75.14 N ATOM 1178 CA LEU A 80 9.312 -14.508 -4.434 1.00 54.02 C ATOM 1179 C LEU A 80 10.689 -15.152 -4.314 1.00 1.23 C ATOM 1180 O LEU A 80 11.690 -14.466 -4.105 1.00 23.51 O ATOM 1181 CB LEU A 80 9.321 -13.460 -5.549 1.00 24.51 C ATOM 1182 CG LEU A 80 8.087 -12.562 -5.637 1.00 21.14 C ATOM 1183 CD1 LEU A 80 8.207 -11.604 -6.812 1.00 34.04 C ATOM 1184 CD2 LEU A 80 6.824 -13.402 -5.757 1.00 52.21 C ATOM 0 H LEU A 80 9.603 -13.268 -2.768 1.00 75.14 H new ATOM 0 HA LEU A 80 8.589 -15.285 -4.680 1.00 54.02 H new ATOM 0 HB2 LEU A 80 10.198 -12.826 -5.417 1.00 24.51 H new ATOM 0 HB3 LEU A 80 9.440 -13.974 -6.503 1.00 24.51 H new ATOM 0 HG LEU A 80 8.022 -11.974 -4.721 1.00 21.14 H new ATOM 0 HD11 LEU A 80 7.320 -10.973 -6.859 1.00 34.04 H new ATOM 0 HD12 LEU A 80 9.091 -10.979 -6.683 1.00 34.04 H new ATOM 0 HD13 LEU A 80 8.297 -12.173 -7.737 1.00 34.04 H new ATOM 0 HD21 LEU A 80 5.955 -12.746 -5.819 1.00 52.21 H new ATOM 0 HD22 LEU A 80 6.879 -14.016 -6.656 1.00 52.21 H new ATOM 0 HD23 LEU A 80 6.731 -14.046 -4.883 1.00 52.21 H new ATOM 1196 N VAL A 81 10.733 -16.474 -4.449 1.00 12.53 N ATOM 1197 CA VAL A 81 11.988 -17.210 -4.358 1.00 72.14 C ATOM 1198 C VAL A 81 12.430 -17.712 -5.728 1.00 62.13 C ATOM 1199 O VAL A 81 11.602 -18.030 -6.583 1.00 14.43 O ATOM 1200 CB VAL A 81 11.867 -18.409 -3.399 1.00 2.11 C ATOM 1201 CG1 VAL A 81 10.819 -19.391 -3.900 1.00 43.11 C ATOM 1202 CG2 VAL A 81 13.215 -19.094 -3.231 1.00 71.21 C ATOM 0 H VAL A 81 9.914 -17.057 -4.622 1.00 12.53 H new ATOM 0 HA VAL A 81 12.734 -16.517 -3.969 1.00 72.14 H new ATOM 0 HB VAL A 81 11.548 -18.041 -2.424 1.00 2.11 H new ATOM 0 HG11 VAL A 81 10.748 -20.231 -3.209 1.00 43.11 H new ATOM 0 HG12 VAL A 81 9.853 -18.891 -3.964 1.00 43.11 H new ATOM 0 HG13 VAL A 81 11.104 -19.756 -4.887 1.00 43.11 H new ATOM 0 HG21 VAL A 81 13.111 -19.939 -2.550 1.00 71.21 H new ATOM 0 HG22 VAL A 81 13.566 -19.449 -4.200 1.00 71.21 H new ATOM 0 HG23 VAL A 81 13.935 -18.385 -2.822 1.00 71.21 H new ATOM 1212 N LEU A 82 13.741 -17.782 -5.931 1.00 61.24 N ATOM 1213 CA LEU A 82 14.295 -18.247 -7.198 1.00 42.35 C ATOM 1214 C LEU A 82 14.658 -19.726 -7.124 1.00 74.44 C ATOM 1215 O LEU A 82 14.986 -20.244 -6.056 1.00 71.33 O ATOM 1216 CB LEU A 82 15.531 -17.425 -7.569 1.00 22.11 C ATOM 1217 CG LEU A 82 15.276 -15.972 -7.969 1.00 12.51 C ATOM 1218 CD1 LEU A 82 15.387 -15.057 -6.759 1.00 21.44 C ATOM 1219 CD2 LEU A 82 16.248 -15.539 -9.057 1.00 74.22 C ATOM 0 H LEU A 82 14.440 -17.523 -5.235 1.00 61.24 H new ATOM 0 HA LEU A 82 13.535 -18.117 -7.968 1.00 42.35 H new ATOM 0 HB2 LEU A 82 16.215 -17.432 -6.721 1.00 22.11 H new ATOM 0 HB3 LEU A 82 16.040 -17.924 -8.394 1.00 22.11 H new ATOM 0 HG LEU A 82 14.263 -15.898 -8.364 1.00 12.51 H new ATOM 0 HD11 LEU A 82 15.202 -14.027 -7.064 1.00 21.44 H new ATOM 0 HD12 LEU A 82 14.651 -15.352 -6.011 1.00 21.44 H new ATOM 0 HD13 LEU A 82 16.388 -15.136 -6.334 1.00 21.44 H new ATOM 0 HD21 LEU A 82 16.051 -14.502 -9.329 1.00 74.22 H new ATOM 0 HD22 LEU A 82 17.270 -15.630 -8.689 1.00 74.22 H new ATOM 0 HD23 LEU A 82 16.120 -16.174 -9.933 1.00 74.22 H new ATOM 1231 N THR A 83 14.598 -20.403 -8.267 1.00 61.13 N ATOM 1232 CA THR A 83 14.921 -21.823 -8.333 1.00 12.23 C ATOM 1233 C THR A 83 15.814 -22.129 -9.529 1.00 62.02 C ATOM 1234 O THR A 83 15.957 -21.309 -10.437 1.00 72.44 O ATOM 1235 CB THR A 83 13.647 -22.685 -8.423 1.00 44.23 C ATOM 1236 OG1 THR A 83 13.988 -24.073 -8.329 1.00 55.51 O ATOM 1237 CG2 THR A 83 12.910 -22.426 -9.728 1.00 42.54 C ATOM 0 H THR A 83 14.328 -19.990 -9.160 1.00 61.13 H new ATOM 0 HA THR A 83 15.453 -22.069 -7.414 1.00 12.23 H new ATOM 0 HB THR A 83 12.992 -22.415 -7.595 1.00 44.23 H new ATOM 0 HG1 THR A 83 13.704 -24.536 -9.145 1.00 55.51 H new ATOM 0 HG21 THR A 83 12.014 -23.046 -9.769 1.00 42.54 H new ATOM 0 HG22 THR A 83 12.627 -21.375 -9.784 1.00 42.54 H new ATOM 0 HG23 THR A 83 13.560 -22.672 -10.568 1.00 42.54 H new ATOM 1245 N THR A 84 16.415 -23.315 -9.526 1.00 32.15 N ATOM 1246 CA THR A 84 17.295 -23.730 -10.611 1.00 0.54 C ATOM 1247 C THR A 84 16.550 -24.591 -11.624 1.00 43.23 C ATOM 1248 O THR A 84 16.594 -24.328 -12.826 1.00 22.44 O ATOM 1249 CB THR A 84 18.509 -24.515 -10.080 1.00 62.12 C ATOM 1250 OG1 THR A 84 18.074 -25.735 -9.469 1.00 45.01 O ATOM 1251 CG2 THR A 84 19.291 -23.687 -9.071 1.00 73.14 C ATOM 0 H THR A 84 16.308 -24.006 -8.783 1.00 32.15 H new ATOM 0 HA THR A 84 17.645 -22.821 -11.100 1.00 0.54 H new ATOM 0 HB THR A 84 19.162 -24.743 -10.922 1.00 62.12 H new ATOM 0 HG1 THR A 84 18.048 -26.447 -10.142 1.00 45.01 H new ATOM 0 HG21 THR A 84 20.143 -24.263 -8.710 1.00 73.14 H new ATOM 0 HG22 THR A 84 19.646 -22.773 -9.547 1.00 73.14 H new ATOM 0 HG23 THR A 84 18.645 -23.431 -8.231 1.00 73.14 H new ATOM 1259 N GLU A 85 15.867 -25.619 -11.132 1.00 13.04 N ATOM 1260 CA GLU A 85 15.112 -26.519 -11.996 1.00 44.45 C ATOM 1261 C GLU A 85 13.615 -26.245 -11.892 1.00 52.34 C ATOM 1262 O GLU A 85 13.083 -26.049 -10.801 1.00 12.34 O ATOM 1263 CB GLU A 85 15.402 -27.976 -11.631 1.00 1.24 C ATOM 1264 CG GLU A 85 14.254 -28.921 -11.941 1.00 72.22 C ATOM 1265 CD GLU A 85 14.720 -30.342 -12.191 1.00 74.50 C ATOM 1266 OE1 GLU A 85 14.086 -31.040 -13.010 1.00 50.35 O ATOM 1267 OE2 GLU A 85 15.719 -30.757 -11.567 1.00 33.14 O ATOM 0 H GLU A 85 15.821 -25.850 -10.140 1.00 13.04 H new ATOM 0 HA GLU A 85 15.425 -26.341 -13.025 1.00 44.45 H new ATOM 0 HB2 GLU A 85 16.290 -28.307 -12.170 1.00 1.24 H new ATOM 0 HB3 GLU A 85 15.634 -28.036 -10.568 1.00 1.24 H new ATOM 0 HG2 GLU A 85 13.549 -28.915 -11.110 1.00 72.22 H new ATOM 0 HG3 GLU A 85 13.717 -28.559 -12.818 1.00 72.22 H new ATOM 1274 N GLY A 86 12.940 -26.232 -13.038 1.00 62.43 N ATOM 1275 CA GLY A 86 11.511 -25.981 -13.055 1.00 40.00 C ATOM 1276 C GLY A 86 10.700 -27.226 -12.757 1.00 32.23 C ATOM 1277 O GLY A 86 9.831 -27.611 -13.539 1.00 35.13 O ATOM 0 H GLY A 86 13.358 -26.391 -13.955 1.00 62.43 H new ATOM 0 HA2 GLY A 86 11.272 -25.211 -12.321 1.00 40.00 H new ATOM 0 HA3 GLY A 86 11.225 -25.590 -14.032 1.00 40.00 H new ATOM 1281 N SER A 87 10.985 -27.859 -11.623 1.00 50.11 N ATOM 1282 CA SER A 87 10.279 -29.071 -11.226 1.00 30.50 C ATOM 1283 C SER A 87 9.192 -28.757 -10.203 1.00 54.32 C ATOM 1284 O SER A 87 9.345 -27.860 -9.374 1.00 11.12 O ATOM 1285 CB SER A 87 11.261 -30.092 -10.646 1.00 55.31 C ATOM 1286 OG SER A 87 10.582 -31.079 -9.889 1.00 1.33 O ATOM 0 H SER A 87 11.700 -27.552 -10.963 1.00 50.11 H new ATOM 0 HA SER A 87 9.807 -29.494 -12.113 1.00 30.50 H new ATOM 0 HB2 SER A 87 11.816 -30.567 -11.455 1.00 55.31 H new ATOM 0 HB3 SER A 87 11.990 -29.583 -10.015 1.00 55.31 H new ATOM 0 HG SER A 87 11.231 -31.720 -9.531 1.00 1.33 H new ATOM 1292 N ASP A 88 8.093 -29.501 -10.269 1.00 42.12 N ATOM 1293 CA ASP A 88 6.979 -29.303 -9.349 1.00 23.31 C ATOM 1294 C ASP A 88 7.374 -29.689 -7.927 1.00 4.52 C ATOM 1295 O ASP A 88 6.951 -29.054 -6.961 1.00 73.30 O ATOM 1296 CB ASP A 88 5.769 -30.125 -9.796 1.00 10.24 C ATOM 1297 CG ASP A 88 4.705 -30.221 -8.719 1.00 44.15 C ATOM 1298 OD1 ASP A 88 4.417 -31.349 -8.270 1.00 24.44 O ATOM 1299 OD2 ASP A 88 4.160 -29.167 -8.328 1.00 23.52 O ATOM 0 H ASP A 88 7.950 -30.247 -10.950 1.00 42.12 H new ATOM 0 HA ASP A 88 6.714 -28.246 -9.359 1.00 23.31 H new ATOM 0 HB2 ASP A 88 5.338 -29.675 -10.690 1.00 10.24 H new ATOM 0 HB3 ASP A 88 6.096 -31.128 -10.070 1.00 10.24 H new ATOM 1304 N ALA A 89 8.188 -30.733 -7.806 1.00 52.43 N ATOM 1305 CA ALA A 89 8.641 -31.202 -6.503 1.00 14.23 C ATOM 1306 C ALA A 89 9.260 -30.066 -5.695 1.00 64.24 C ATOM 1307 O ALA A 89 9.113 -30.006 -4.475 1.00 35.34 O ATOM 1308 CB ALA A 89 9.637 -32.339 -6.668 1.00 64.43 C ATOM 0 H ALA A 89 8.547 -31.270 -8.595 1.00 52.43 H new ATOM 0 HA ALA A 89 7.773 -31.571 -5.956 1.00 14.23 H new ATOM 0 HB1 ALA A 89 9.967 -32.679 -5.686 1.00 64.43 H new ATOM 0 HB2 ALA A 89 9.162 -33.165 -7.198 1.00 64.43 H new ATOM 0 HB3 ALA A 89 10.497 -31.989 -7.239 1.00 64.43 H new ATOM 1314 N PHE A 90 9.955 -29.167 -6.385 1.00 24.34 N ATOM 1315 CA PHE A 90 10.599 -28.034 -5.731 1.00 5.10 C ATOM 1316 C PHE A 90 9.561 -27.064 -5.176 1.00 34.14 C ATOM 1317 O PHE A 90 9.742 -26.489 -4.102 1.00 71.21 O ATOM 1318 CB PHE A 90 11.519 -27.306 -6.714 1.00 30.21 C ATOM 1319 CG PHE A 90 12.683 -26.625 -6.053 1.00 40.53 C ATOM 1320 CD1 PHE A 90 12.482 -25.545 -5.208 1.00 21.43 C ATOM 1321 CD2 PHE A 90 13.978 -27.063 -6.278 1.00 20.15 C ATOM 1322 CE1 PHE A 90 13.552 -24.916 -4.599 1.00 55.14 C ATOM 1323 CE2 PHE A 90 15.052 -26.438 -5.672 1.00 15.25 C ATOM 1324 CZ PHE A 90 14.838 -25.363 -4.831 1.00 33.44 C ATOM 0 H PHE A 90 10.086 -29.201 -7.396 1.00 24.34 H new ATOM 0 HA PHE A 90 11.194 -28.416 -4.901 1.00 5.10 H new ATOM 0 HB2 PHE A 90 11.894 -28.021 -7.446 1.00 30.21 H new ATOM 0 HB3 PHE A 90 10.938 -26.564 -7.262 1.00 30.21 H new ATOM 0 HD1 PHE A 90 11.479 -25.191 -5.023 1.00 21.43 H new ATOM 0 HD2 PHE A 90 14.151 -27.903 -6.935 1.00 20.15 H new ATOM 0 HE1 PHE A 90 13.382 -24.076 -3.942 1.00 55.14 H new ATOM 0 HE2 PHE A 90 16.057 -26.790 -5.856 1.00 15.25 H new ATOM 0 HZ PHE A 90 15.675 -24.873 -4.356 1.00 33.44 H new ATOM 1334 N LYS A 91 8.471 -26.887 -5.915 1.00 50.50 N ATOM 1335 CA LYS A 91 7.401 -25.987 -5.499 1.00 23.54 C ATOM 1336 C LYS A 91 6.949 -26.302 -4.076 1.00 43.21 C ATOM 1337 O LYS A 91 6.606 -25.401 -3.311 1.00 22.44 O ATOM 1338 CB LYS A 91 6.214 -26.096 -6.458 1.00 11.50 C ATOM 1339 CG LYS A 91 6.558 -25.741 -7.894 1.00 62.23 C ATOM 1340 CD LYS A 91 5.369 -25.943 -8.819 1.00 24.32 C ATOM 1341 CE LYS A 91 4.208 -25.038 -8.439 1.00 53.21 C ATOM 1342 NZ LYS A 91 3.244 -24.872 -9.562 1.00 40.41 N ATOM 0 H LYS A 91 8.305 -27.355 -6.806 1.00 50.50 H new ATOM 0 HA LYS A 91 7.787 -24.968 -5.522 1.00 23.54 H new ATOM 0 HB2 LYS A 91 5.825 -27.114 -6.427 1.00 11.50 H new ATOM 0 HB3 LYS A 91 5.416 -25.439 -6.111 1.00 11.50 H new ATOM 0 HG2 LYS A 91 6.887 -24.703 -7.944 1.00 62.23 H new ATOM 0 HG3 LYS A 91 7.392 -26.356 -8.232 1.00 62.23 H new ATOM 0 HD2 LYS A 91 5.668 -25.741 -9.847 1.00 24.32 H new ATOM 0 HD3 LYS A 91 5.048 -26.984 -8.779 1.00 24.32 H new ATOM 0 HE2 LYS A 91 3.691 -25.454 -7.575 1.00 53.21 H new ATOM 0 HE3 LYS A 91 4.591 -24.062 -8.141 1.00 53.21 H new ATOM 0 HZ1 LYS A 91 2.467 -24.248 -9.263 1.00 40.41 H new ATOM 0 HZ2 LYS A 91 3.731 -24.451 -10.379 1.00 40.41 H new ATOM 0 HZ3 LYS A 91 2.859 -25.800 -9.829 1.00 40.41 H new ATOM 1356 N ALA A 92 6.953 -27.585 -3.729 1.00 10.43 N ATOM 1357 CA ALA A 92 6.547 -28.017 -2.397 1.00 52.42 C ATOM 1358 C ALA A 92 7.434 -27.395 -1.324 1.00 13.31 C ATOM 1359 O ALA A 92 6.969 -27.073 -0.231 1.00 14.30 O ATOM 1360 CB ALA A 92 6.584 -29.535 -2.301 1.00 14.43 C ATOM 0 H ALA A 92 7.233 -28.343 -4.351 1.00 10.43 H new ATOM 0 HA ALA A 92 5.525 -27.678 -2.227 1.00 52.42 H new ATOM 0 HB1 ALA A 92 6.279 -29.844 -1.301 1.00 14.43 H new ATOM 0 HB2 ALA A 92 5.903 -29.963 -3.037 1.00 14.43 H new ATOM 0 HB3 ALA A 92 7.597 -29.887 -2.496 1.00 14.43 H new ATOM 1366 N ALA A 93 8.713 -27.229 -1.643 1.00 22.31 N ATOM 1367 CA ALA A 93 9.665 -26.645 -0.706 1.00 54.30 C ATOM 1368 C ALA A 93 9.356 -25.172 -0.457 1.00 71.31 C ATOM 1369 O ALA A 93 9.074 -24.770 0.671 1.00 54.31 O ATOM 1370 CB ALA A 93 11.085 -26.808 -1.226 1.00 42.40 C ATOM 0 H ALA A 93 9.114 -27.491 -2.544 1.00 22.31 H new ATOM 0 HA ALA A 93 9.575 -27.174 0.243 1.00 54.30 H new ATOM 0 HB1 ALA A 93 11.785 -26.367 -0.516 1.00 42.40 H new ATOM 0 HB2 ALA A 93 11.309 -27.868 -1.346 1.00 42.40 H new ATOM 0 HB3 ALA A 93 11.180 -26.306 -2.189 1.00 42.40 H new ATOM 1376 N ALA A 94 9.412 -24.373 -1.518 1.00 24.15 N ATOM 1377 CA ALA A 94 9.138 -22.945 -1.414 1.00 35.53 C ATOM 1378 C ALA A 94 7.774 -22.694 -0.779 1.00 1.33 C ATOM 1379 O ALA A 94 7.596 -21.734 -0.028 1.00 61.04 O ATOM 1380 CB ALA A 94 9.211 -22.293 -2.786 1.00 4.40 C ATOM 0 H ALA A 94 9.645 -24.691 -2.459 1.00 24.15 H new ATOM 0 HA ALA A 94 9.897 -22.499 -0.771 1.00 35.53 H new ATOM 0 HB1 ALA A 94 9.004 -21.227 -2.694 1.00 4.40 H new ATOM 0 HB2 ALA A 94 10.208 -22.435 -3.204 1.00 4.40 H new ATOM 0 HB3 ALA A 94 8.473 -22.750 -3.446 1.00 4.40 H new ATOM 1386 N ARG A 95 6.815 -23.561 -1.085 1.00 13.12 N ATOM 1387 CA ARG A 95 5.467 -23.431 -0.545 1.00 54.22 C ATOM 1388 C ARG A 95 5.422 -23.866 0.917 1.00 51.32 C ATOM 1389 O ARG A 95 4.691 -23.291 1.724 1.00 44.42 O ATOM 1390 CB ARG A 95 4.483 -24.265 -1.367 1.00 34.50 C ATOM 1391 CG ARG A 95 4.054 -23.599 -2.664 1.00 33.00 C ATOM 1392 CD ARG A 95 2.725 -24.148 -3.160 1.00 21.24 C ATOM 1393 NE ARG A 95 1.589 -23.418 -2.604 1.00 3.24 N ATOM 1394 CZ ARG A 95 0.366 -23.457 -3.120 1.00 61.31 C ATOM 1395 NH1 ARG A 95 0.122 -24.188 -4.199 1.00 33.42 N ATOM 1396 NH2 ARG A 95 -0.616 -22.765 -2.557 1.00 41.11 N ATOM 0 H ARG A 95 6.946 -24.361 -1.704 1.00 13.12 H new ATOM 0 HA ARG A 95 5.180 -22.381 -0.602 1.00 54.22 H new ATOM 0 HB2 ARG A 95 4.940 -25.228 -1.597 1.00 34.50 H new ATOM 0 HB3 ARG A 95 3.599 -24.468 -0.763 1.00 34.50 H new ATOM 0 HG2 ARG A 95 3.970 -22.523 -2.511 1.00 33.00 H new ATOM 0 HG3 ARG A 95 4.819 -23.754 -3.424 1.00 33.00 H new ATOM 0 HD2 ARG A 95 2.694 -24.093 -4.248 1.00 21.24 H new ATOM 0 HD3 ARG A 95 2.645 -25.201 -2.892 1.00 21.24 H new ATOM 0 HE ARG A 95 1.743 -22.847 -1.773 1.00 3.24 H new ATOM 0 HH11 ARG A 95 0.874 -24.722 -4.634 1.00 33.42 H new ATOM 0 HH12 ARG A 95 -0.818 -24.217 -4.594 1.00 33.42 H new ATOM 0 HH21 ARG A 95 -0.432 -22.202 -1.727 1.00 41.11 H new ATOM 0 HH22 ARG A 95 -1.555 -22.796 -2.955 1.00 41.11 H new ATOM 1410 N ASP A 96 6.207 -24.884 1.250 1.00 61.23 N ATOM 1411 CA ASP A 96 6.258 -25.396 2.614 1.00 32.33 C ATOM 1412 C ASP A 96 6.956 -24.406 3.541 1.00 51.42 C ATOM 1413 O ASP A 96 6.565 -24.240 4.696 1.00 44.01 O ATOM 1414 CB ASP A 96 6.981 -26.743 2.650 1.00 61.44 C ATOM 1415 CG ASP A 96 7.346 -27.168 4.059 1.00 53.04 C ATOM 1416 OD1 ASP A 96 8.546 -27.123 4.400 1.00 3.33 O ATOM 1417 OD2 ASP A 96 6.431 -27.545 4.820 1.00 54.32 O ATOM 0 H ASP A 96 6.817 -25.371 0.594 1.00 61.23 H new ATOM 0 HA ASP A 96 5.234 -25.533 2.962 1.00 32.33 H new ATOM 0 HB2 ASP A 96 6.346 -27.505 2.197 1.00 61.44 H new ATOM 0 HB3 ASP A 96 7.886 -26.682 2.046 1.00 61.44 H new ATOM 1422 N ALA A 97 7.991 -23.750 3.026 1.00 23.40 N ATOM 1423 CA ALA A 97 8.743 -22.776 3.807 1.00 41.24 C ATOM 1424 C ALA A 97 7.853 -21.617 4.242 1.00 11.13 C ATOM 1425 O ALA A 97 7.998 -21.090 5.345 1.00 74.53 O ATOM 1426 CB ALA A 97 9.930 -22.260 3.006 1.00 74.33 C ATOM 0 H ALA A 97 8.328 -23.876 2.071 1.00 23.40 H new ATOM 0 HA ALA A 97 9.112 -23.273 4.704 1.00 41.24 H new ATOM 0 HB1 ALA A 97 10.483 -21.533 3.602 1.00 74.33 H new ATOM 0 HB2 ALA A 97 10.585 -23.092 2.749 1.00 74.33 H new ATOM 0 HB3 ALA A 97 9.573 -21.784 2.093 1.00 74.33 H new ATOM 1432 N GLY A 98 6.931 -21.223 3.368 1.00 23.32 N ATOM 1433 CA GLY A 98 6.032 -20.128 3.681 1.00 32.31 C ATOM 1434 C GLY A 98 6.136 -18.990 2.685 1.00 34.15 C ATOM 1435 O GLY A 98 5.978 -17.824 3.047 1.00 64.32 O ATOM 0 H GLY A 98 6.791 -21.643 2.449 1.00 23.32 H new ATOM 0 HA2 GLY A 98 5.007 -20.498 3.700 1.00 32.31 H new ATOM 0 HA3 GLY A 98 6.254 -19.754 4.680 1.00 32.31 H new ATOM 1439 N ALA A 99 6.403 -19.328 1.428 1.00 32.23 N ATOM 1440 CA ALA A 99 6.527 -18.326 0.378 1.00 42.34 C ATOM 1441 C ALA A 99 5.251 -18.239 -0.453 1.00 21.33 C ATOM 1442 O ALA A 99 4.412 -19.140 -0.418 1.00 24.53 O ATOM 1443 CB ALA A 99 7.719 -18.641 -0.514 1.00 41.12 C ATOM 0 H ALA A 99 6.538 -20.289 1.112 1.00 32.23 H new ATOM 0 HA ALA A 99 6.687 -17.358 0.852 1.00 42.34 H new ATOM 0 HB1 ALA A 99 7.800 -17.884 -1.294 1.00 41.12 H new ATOM 0 HB2 ALA A 99 8.630 -18.644 0.084 1.00 41.12 H new ATOM 0 HB3 ALA A 99 7.582 -19.621 -0.972 1.00 41.12 H new ATOM 1449 N THR A 100 5.109 -17.149 -1.200 1.00 0.34 N ATOM 1450 CA THR A 100 3.934 -16.944 -2.037 1.00 42.33 C ATOM 1451 C THR A 100 4.147 -17.519 -3.433 1.00 41.51 C ATOM 1452 O THR A 100 3.404 -18.394 -3.874 1.00 65.52 O ATOM 1453 CB THR A 100 3.584 -15.449 -2.158 1.00 44.52 C ATOM 1454 OG1 THR A 100 3.367 -14.889 -0.858 1.00 25.51 O ATOM 1455 CG2 THR A 100 2.343 -15.251 -3.014 1.00 54.23 C ATOM 0 H THR A 100 5.794 -16.394 -1.242 1.00 0.34 H new ATOM 0 HA THR A 100 3.107 -17.465 -1.554 1.00 42.33 H new ATOM 0 HB THR A 100 4.421 -14.941 -2.637 1.00 44.52 H new ATOM 0 HG1 THR A 100 2.721 -14.155 -0.922 1.00 25.51 H new ATOM 0 HG21 THR A 100 2.116 -14.187 -3.085 1.00 54.23 H new ATOM 0 HG22 THR A 100 2.522 -15.651 -4.012 1.00 54.23 H new ATOM 0 HG23 THR A 100 1.501 -15.773 -2.560 1.00 54.23 H new ATOM 1463 N GLY A 101 5.168 -17.020 -4.124 1.00 53.23 N ATOM 1464 CA GLY A 101 5.460 -17.497 -5.463 1.00 42.34 C ATOM 1465 C GLY A 101 6.941 -17.736 -5.683 1.00 52.12 C ATOM 1466 O GLY A 101 7.767 -17.359 -4.852 1.00 41.23 O ATOM 0 H GLY A 101 5.797 -16.295 -3.780 1.00 53.23 H new ATOM 0 HA2 GLY A 101 4.915 -18.424 -5.642 1.00 42.34 H new ATOM 0 HA3 GLY A 101 5.100 -16.770 -6.191 1.00 42.34 H new ATOM 1470 N TRP A 102 7.277 -18.365 -6.803 1.00 74.14 N ATOM 1471 CA TRP A 102 8.668 -18.656 -7.129 1.00 4.23 C ATOM 1472 C TRP A 102 8.941 -18.422 -8.610 1.00 44.33 C ATOM 1473 O TRP A 102 8.013 -18.320 -9.413 1.00 42.01 O ATOM 1474 CB TRP A 102 9.010 -20.100 -6.756 1.00 52.53 C ATOM 1475 CG TRP A 102 8.535 -21.101 -7.765 1.00 61.30 C ATOM 1476 CD1 TRP A 102 7.405 -21.024 -8.527 1.00 75.13 C ATOM 1477 CD2 TRP A 102 9.177 -22.331 -8.119 1.00 70.01 C ATOM 1478 NE1 TRP A 102 7.305 -22.132 -9.334 1.00 30.01 N ATOM 1479 CE2 TRP A 102 8.380 -22.948 -9.103 1.00 63.52 C ATOM 1480 CE3 TRP A 102 10.348 -22.970 -7.702 1.00 50.34 C ATOM 1481 CZ2 TRP A 102 8.718 -24.173 -9.674 1.00 3.23 C ATOM 1482 CZ3 TRP A 102 10.682 -24.185 -8.269 1.00 52.14 C ATOM 1483 CH2 TRP A 102 9.870 -24.776 -9.247 1.00 2.22 C ATOM 0 H TRP A 102 6.605 -18.683 -7.501 1.00 74.14 H new ATOM 0 HA TRP A 102 9.299 -17.980 -6.552 1.00 4.23 H new ATOM 0 HB2 TRP A 102 10.090 -20.193 -6.643 1.00 52.53 H new ATOM 0 HB3 TRP A 102 8.567 -20.332 -5.788 1.00 52.53 H new ATOM 0 HD1 TRP A 102 6.694 -20.212 -8.500 1.00 75.13 H new ATOM 0 HE1 TRP A 102 6.552 -22.316 -9.997 1.00 30.01 H new ATOM 0 HE3 TRP A 102 10.981 -22.522 -6.950 1.00 50.34 H new ATOM 0 HZ2 TRP A 102 8.093 -24.630 -10.427 1.00 3.23 H new ATOM 0 HZ3 TRP A 102 11.584 -24.688 -7.953 1.00 52.14 H new ATOM 0 HH2 TRP A 102 10.159 -25.726 -9.672 1.00 2.22 H new ATOM 1494 N ILE A 103 10.219 -18.338 -8.966 1.00 52.41 N ATOM 1495 CA ILE A 103 10.612 -18.117 -10.352 1.00 43.21 C ATOM 1496 C ILE A 103 11.888 -18.880 -10.690 1.00 25.45 C ATOM 1497 O ILE A 103 12.554 -19.418 -9.805 1.00 13.33 O ATOM 1498 CB ILE A 103 10.830 -16.620 -10.644 1.00 25.41 C ATOM 1499 CG1 ILE A 103 11.303 -15.896 -9.382 1.00 12.12 C ATOM 1500 CG2 ILE A 103 9.550 -15.992 -11.174 1.00 64.23 C ATOM 1501 CD1 ILE A 103 10.171 -15.347 -8.541 1.00 44.32 C ATOM 0 H ILE A 103 10.999 -18.420 -8.314 1.00 52.41 H new ATOM 0 HA ILE A 103 9.796 -18.485 -10.974 1.00 43.21 H new ATOM 0 HB ILE A 103 11.602 -16.522 -11.407 1.00 25.41 H new ATOM 0 HG12 ILE A 103 11.893 -16.584 -8.777 1.00 12.12 H new ATOM 0 HG13 ILE A 103 11.963 -15.077 -9.668 1.00 12.12 H new ATOM 0 HG21 ILE A 103 9.720 -14.934 -11.376 1.00 64.23 H new ATOM 0 HG22 ILE A 103 9.253 -16.494 -12.095 1.00 64.23 H new ATOM 0 HG23 ILE A 103 8.759 -16.097 -10.432 1.00 64.23 H new ATOM 0 HD11 ILE A 103 10.580 -14.847 -7.663 1.00 44.32 H new ATOM 0 HD12 ILE A 103 9.594 -14.634 -9.129 1.00 44.32 H new ATOM 0 HD13 ILE A 103 9.523 -16.165 -8.224 1.00 44.32 H new ATOM 1513 N GLU A 104 12.224 -18.922 -11.975 1.00 64.11 N ATOM 1514 CA GLU A 104 13.422 -19.619 -12.429 1.00 20.22 C ATOM 1515 C GLU A 104 14.519 -18.628 -12.804 1.00 45.52 C ATOM 1516 O GLU A 104 14.374 -17.850 -13.748 1.00 31.32 O ATOM 1517 CB GLU A 104 13.096 -20.513 -13.627 1.00 33.21 C ATOM 1518 CG GLU A 104 12.136 -21.644 -13.299 1.00 31.53 C ATOM 1519 CD GLU A 104 12.195 -22.772 -14.311 1.00 22.01 C ATOM 1520 OE1 GLU A 104 11.408 -22.742 -15.280 1.00 22.32 O ATOM 1521 OE2 GLU A 104 13.030 -23.684 -14.133 1.00 75.35 O ATOM 0 H GLU A 104 11.684 -18.482 -12.720 1.00 64.11 H new ATOM 0 HA GLU A 104 13.782 -20.240 -11.609 1.00 20.22 H new ATOM 0 HB2 GLU A 104 12.666 -19.901 -14.420 1.00 33.21 H new ATOM 0 HB3 GLU A 104 14.022 -20.935 -14.017 1.00 33.21 H new ATOM 0 HG2 GLU A 104 12.368 -22.037 -12.309 1.00 31.53 H new ATOM 0 HG3 GLU A 104 11.120 -21.252 -13.256 1.00 31.53 H new ATOM 1528 N LYS A 105 15.618 -18.660 -12.058 1.00 44.00 N ATOM 1529 CA LYS A 105 16.742 -17.766 -12.311 1.00 1.12 C ATOM 1530 C LYS A 105 17.565 -18.249 -13.501 1.00 20.23 C ATOM 1531 O LYS A 105 17.542 -19.425 -13.865 1.00 41.14 O ATOM 1532 CB LYS A 105 17.631 -17.667 -11.069 1.00 10.20 C ATOM 1533 CG LYS A 105 18.745 -18.698 -11.035 1.00 22.43 C ATOM 1534 CD LYS A 105 19.097 -19.092 -9.610 1.00 20.01 C ATOM 1535 CE LYS A 105 20.424 -19.833 -9.548 1.00 33.32 C ATOM 1536 NZ LYS A 105 20.463 -20.981 -10.496 1.00 52.23 N ATOM 0 H LYS A 105 15.754 -19.296 -11.272 1.00 44.00 H new ATOM 0 HA LYS A 105 16.343 -16.779 -12.545 1.00 1.12 H new ATOM 0 HB2 LYS A 105 18.069 -16.670 -11.024 1.00 10.20 H new ATOM 0 HB3 LYS A 105 17.012 -17.784 -10.179 1.00 10.20 H new ATOM 0 HG2 LYS A 105 18.440 -19.583 -11.593 1.00 22.43 H new ATOM 0 HG3 LYS A 105 19.629 -18.297 -11.531 1.00 22.43 H new ATOM 0 HD2 LYS A 105 19.148 -18.199 -8.987 1.00 20.01 H new ATOM 0 HD3 LYS A 105 18.308 -19.722 -9.200 1.00 20.01 H new ATOM 0 HE2 LYS A 105 21.236 -19.144 -9.779 1.00 33.32 H new ATOM 0 HE3 LYS A 105 20.591 -20.194 -8.533 1.00 33.32 H new ATOM 0 HZ1 LYS A 105 21.040 -21.746 -10.091 1.00 52.23 H new ATOM 0 HZ2 LYS A 105 19.496 -21.327 -10.662 1.00 52.23 H new ATOM 0 HZ3 LYS A 105 20.880 -20.673 -11.397 1.00 52.23 H new ATOM 1550 N PRO A 106 18.311 -17.323 -14.121 1.00 2.13 N ATOM 1551 CA PRO A 106 18.346 -15.920 -13.696 1.00 30.42 C ATOM 1552 C PRO A 106 17.035 -15.196 -13.980 1.00 52.22 C ATOM 1553 O PRO A 106 16.121 -15.761 -14.582 1.00 14.45 O ATOM 1554 CB PRO A 106 19.479 -15.324 -14.534 1.00 43.12 C ATOM 1555 CG PRO A 106 19.553 -16.191 -15.743 1.00 24.40 C ATOM 1556 CD PRO A 106 19.178 -17.573 -15.284 1.00 71.45 C ATOM 0 HA PRO A 106 18.497 -15.823 -12.621 1.00 30.42 H new ATOM 0 HB2 PRO A 106 19.270 -14.288 -14.802 1.00 43.12 H new ATOM 0 HB3 PRO A 106 20.421 -15.328 -13.986 1.00 43.12 H new ATOM 0 HG2 PRO A 106 18.872 -15.839 -16.518 1.00 24.40 H new ATOM 0 HG3 PRO A 106 20.556 -16.180 -16.170 1.00 24.40 H new ATOM 0 HD2 PRO A 106 18.655 -18.127 -16.063 1.00 71.45 H new ATOM 0 HD3 PRO A 106 20.056 -18.158 -15.012 1.00 71.45 H new ATOM 1564 N ILE A 107 16.950 -13.943 -13.545 1.00 71.30 N ATOM 1565 CA ILE A 107 15.751 -13.142 -13.755 1.00 14.22 C ATOM 1566 C ILE A 107 16.031 -11.966 -14.685 1.00 33.31 C ATOM 1567 O ILE A 107 17.136 -11.424 -14.702 1.00 30.34 O ATOM 1568 CB ILE A 107 15.191 -12.607 -12.423 1.00 42.55 C ATOM 1569 CG1 ILE A 107 15.039 -13.746 -11.414 1.00 70.31 C ATOM 1570 CG2 ILE A 107 13.857 -11.911 -12.651 1.00 22.41 C ATOM 1571 CD1 ILE A 107 14.018 -14.784 -11.824 1.00 34.10 C ATOM 0 H ILE A 107 17.697 -13.461 -13.045 1.00 71.30 H new ATOM 0 HA ILE A 107 15.011 -13.797 -14.214 1.00 14.22 H new ATOM 0 HB ILE A 107 15.893 -11.879 -12.017 1.00 42.55 H new ATOM 0 HG12 ILE A 107 16.005 -14.232 -11.279 1.00 70.31 H new ATOM 0 HG13 ILE A 107 14.754 -13.329 -10.448 1.00 70.31 H new ATOM 0 HG21 ILE A 107 13.474 -11.538 -11.701 1.00 22.41 H new ATOM 0 HG22 ILE A 107 13.995 -11.077 -13.339 1.00 22.41 H new ATOM 0 HG23 ILE A 107 13.146 -12.619 -13.077 1.00 22.41 H new ATOM 0 HD11 ILE A 107 13.963 -15.561 -11.062 1.00 34.10 H new ATOM 0 HD12 ILE A 107 13.042 -14.311 -11.931 1.00 34.10 H new ATOM 0 HD13 ILE A 107 14.312 -15.228 -12.775 1.00 34.10 H new ATOM 1583 N ASP A 108 15.022 -11.576 -15.456 1.00 61.24 N ATOM 1584 CA ASP A 108 15.158 -10.462 -16.388 1.00 22.42 C ATOM 1585 C ASP A 108 14.689 -9.159 -15.749 1.00 32.23 C ATOM 1586 O ASP A 108 13.933 -9.153 -14.777 1.00 3.34 O ATOM 1587 CB ASP A 108 14.360 -10.736 -17.663 1.00 51.14 C ATOM 1588 CG ASP A 108 15.252 -11.040 -18.851 1.00 2.42 C ATOM 1589 OD1 ASP A 108 16.394 -11.497 -18.634 1.00 31.31 O ATOM 1590 OD2 ASP A 108 14.808 -10.820 -19.997 1.00 65.42 O ATOM 0 H ASP A 108 14.101 -12.014 -15.454 1.00 61.24 H new ATOM 0 HA ASP A 108 16.213 -10.361 -16.644 1.00 22.42 H new ATOM 0 HB2 ASP A 108 13.687 -11.577 -17.493 1.00 51.14 H new ATOM 0 HB3 ASP A 108 13.738 -9.871 -17.892 1.00 51.14 H new ATOM 1595 N PRO A 109 15.147 -8.028 -16.306 1.00 32.15 N ATOM 1596 CA PRO A 109 14.787 -6.698 -15.806 1.00 2.32 C ATOM 1597 C PRO A 109 13.326 -6.353 -16.073 1.00 70.52 C ATOM 1598 O PRO A 109 12.689 -5.655 -15.286 1.00 74.12 O ATOM 1599 CB PRO A 109 15.709 -5.762 -16.592 1.00 24.43 C ATOM 1600 CG PRO A 109 16.025 -6.506 -17.844 1.00 11.52 C ATOM 1601 CD PRO A 109 16.051 -7.961 -17.466 1.00 55.12 C ATOM 0 HA PRO A 109 14.903 -6.625 -14.725 1.00 2.32 H new ATOM 0 HB2 PRO A 109 15.219 -4.813 -16.808 1.00 24.43 H new ATOM 0 HB3 PRO A 109 16.614 -5.532 -16.029 1.00 24.43 H new ATOM 0 HG2 PRO A 109 15.274 -6.316 -18.611 1.00 11.52 H new ATOM 0 HG3 PRO A 109 16.985 -6.192 -18.253 1.00 11.52 H new ATOM 0 HD2 PRO A 109 15.705 -8.595 -18.283 1.00 55.12 H new ATOM 0 HD3 PRO A 109 17.058 -8.292 -17.211 1.00 55.12 H new ATOM 1609 N GLY A 110 12.801 -6.849 -17.190 1.00 35.24 N ATOM 1610 CA GLY A 110 11.418 -6.583 -17.540 1.00 73.14 C ATOM 1611 C GLY A 110 10.445 -7.441 -16.755 1.00 41.42 C ATOM 1612 O GLY A 110 9.338 -7.005 -16.438 1.00 3.02 O ATOM 0 H GLY A 110 13.308 -7.430 -17.858 1.00 35.24 H new ATOM 0 HA2 GLY A 110 11.197 -5.531 -17.360 1.00 73.14 H new ATOM 0 HA3 GLY A 110 11.276 -6.761 -18.606 1.00 73.14 H new ATOM 1616 N VAL A 111 10.857 -8.665 -16.442 1.00 4.11 N ATOM 1617 CA VAL A 111 10.014 -9.586 -15.690 1.00 24.35 C ATOM 1618 C VAL A 111 10.051 -9.271 -14.198 1.00 74.33 C ATOM 1619 O VAL A 111 9.071 -9.485 -13.483 1.00 75.04 O ATOM 1620 CB VAL A 111 10.449 -11.048 -15.905 1.00 22.10 C ATOM 1621 CG1 VAL A 111 9.578 -11.990 -15.089 1.00 34.42 C ATOM 1622 CG2 VAL A 111 10.398 -11.406 -17.382 1.00 71.55 C ATOM 0 H VAL A 111 11.770 -9.042 -16.698 1.00 4.11 H new ATOM 0 HA VAL A 111 8.997 -9.459 -16.061 1.00 24.35 H new ATOM 0 HB VAL A 111 11.478 -11.157 -15.563 1.00 22.10 H new ATOM 0 HG11 VAL A 111 9.900 -13.018 -15.254 1.00 34.42 H new ATOM 0 HG12 VAL A 111 9.670 -11.746 -14.031 1.00 34.42 H new ATOM 0 HG13 VAL A 111 8.538 -11.882 -15.397 1.00 34.42 H new ATOM 0 HG21 VAL A 111 10.708 -12.442 -17.516 1.00 71.55 H new ATOM 0 HG22 VAL A 111 9.380 -11.281 -17.752 1.00 71.55 H new ATOM 0 HG23 VAL A 111 11.069 -10.751 -17.938 1.00 71.55 H new ATOM 1632 N LEU A 112 11.186 -8.762 -13.734 1.00 42.34 N ATOM 1633 CA LEU A 112 11.351 -8.416 -12.327 1.00 0.12 C ATOM 1634 C LEU A 112 10.544 -7.170 -11.974 1.00 64.31 C ATOM 1635 O LEU A 112 10.035 -7.043 -10.861 1.00 15.42 O ATOM 1636 CB LEU A 112 12.829 -8.187 -12.007 1.00 64.41 C ATOM 1637 CG LEU A 112 13.198 -8.156 -10.524 1.00 2.15 C ATOM 1638 CD1 LEU A 112 14.681 -8.437 -10.336 1.00 70.00 C ATOM 1639 CD2 LEU A 112 12.826 -6.814 -9.910 1.00 2.01 C ATOM 0 H LEU A 112 12.006 -8.579 -14.312 1.00 42.34 H new ATOM 0 HA LEU A 112 10.981 -9.248 -11.728 1.00 0.12 H new ATOM 0 HB2 LEU A 112 13.410 -8.973 -12.489 1.00 64.41 H new ATOM 0 HB3 LEU A 112 13.135 -7.243 -12.457 1.00 64.41 H new ATOM 0 HG LEU A 112 12.634 -8.936 -10.013 1.00 2.15 H new ATOM 0 HD11 LEU A 112 14.925 -8.411 -9.274 1.00 70.00 H new ATOM 0 HD12 LEU A 112 14.919 -9.422 -10.738 1.00 70.00 H new ATOM 0 HD13 LEU A 112 15.264 -7.680 -10.861 1.00 70.00 H new ATOM 0 HD21 LEU A 112 13.096 -6.810 -8.854 1.00 2.01 H new ATOM 0 HD22 LEU A 112 13.363 -6.017 -10.425 1.00 2.01 H new ATOM 0 HD23 LEU A 112 11.753 -6.653 -10.011 1.00 2.01 H new ATOM 1651 N VAL A 113 10.431 -6.254 -12.931 1.00 30.33 N ATOM 1652 CA VAL A 113 9.683 -5.020 -12.723 1.00 23.04 C ATOM 1653 C VAL A 113 8.184 -5.253 -12.874 1.00 24.43 C ATOM 1654 O VAL A 113 7.386 -4.754 -12.081 1.00 61.43 O ATOM 1655 CB VAL A 113 10.123 -3.924 -13.711 1.00 43.12 C ATOM 1656 CG1 VAL A 113 9.286 -2.668 -13.523 1.00 41.13 C ATOM 1657 CG2 VAL A 113 11.604 -3.618 -13.542 1.00 52.13 C ATOM 0 H VAL A 113 10.848 -6.343 -13.858 1.00 30.33 H new ATOM 0 HA VAL A 113 9.895 -4.689 -11.706 1.00 23.04 H new ATOM 0 HB VAL A 113 9.964 -4.289 -14.726 1.00 43.12 H new ATOM 0 HG11 VAL A 113 9.611 -1.905 -14.230 1.00 41.13 H new ATOM 0 HG12 VAL A 113 8.236 -2.901 -13.699 1.00 41.13 H new ATOM 0 HG13 VAL A 113 9.410 -2.297 -12.506 1.00 41.13 H new ATOM 0 HG21 VAL A 113 11.898 -2.841 -14.248 1.00 52.13 H new ATOM 0 HG22 VAL A 113 11.791 -3.273 -12.525 1.00 52.13 H new ATOM 0 HG23 VAL A 113 12.186 -4.520 -13.732 1.00 52.13 H new ATOM 1667 N GLU A 114 7.810 -6.016 -13.896 1.00 53.44 N ATOM 1668 CA GLU A 114 6.405 -6.315 -14.151 1.00 44.31 C ATOM 1669 C GLU A 114 5.832 -7.207 -13.054 1.00 74.24 C ATOM 1670 O GLU A 114 4.649 -7.118 -12.720 1.00 44.33 O ATOM 1671 CB GLU A 114 6.244 -6.994 -15.513 1.00 5.22 C ATOM 1672 CG GLU A 114 6.640 -8.461 -15.512 1.00 11.21 C ATOM 1673 CD GLU A 114 5.474 -9.379 -15.203 1.00 34.22 C ATOM 1674 OE1 GLU A 114 5.447 -9.950 -14.092 1.00 61.44 O ATOM 1675 OE2 GLU A 114 4.588 -9.527 -16.071 1.00 20.15 O ATOM 0 H GLU A 114 8.459 -6.438 -14.560 1.00 53.44 H new ATOM 0 HA GLU A 114 5.854 -5.374 -14.155 1.00 44.31 H new ATOM 0 HB2 GLU A 114 5.206 -6.907 -15.833 1.00 5.22 H new ATOM 0 HB3 GLU A 114 6.849 -6.463 -16.248 1.00 5.22 H new ATOM 0 HG2 GLU A 114 7.055 -8.722 -16.485 1.00 11.21 H new ATOM 0 HG3 GLU A 114 7.428 -8.620 -14.776 1.00 11.21 H new ATOM 1682 N LEU A 115 6.677 -8.068 -12.498 1.00 73.23 N ATOM 1683 CA LEU A 115 6.255 -8.978 -11.439 1.00 71.51 C ATOM 1684 C LEU A 115 5.953 -8.215 -10.153 1.00 71.35 C ATOM 1685 O LEU A 115 4.999 -8.530 -9.442 1.00 54.51 O ATOM 1686 CB LEU A 115 7.337 -10.028 -11.181 1.00 4.25 C ATOM 1687 CG LEU A 115 7.290 -11.273 -12.066 1.00 61.43 C ATOM 1688 CD1 LEU A 115 8.540 -12.117 -11.868 1.00 34.32 C ATOM 1689 CD2 LEU A 115 6.040 -12.090 -11.772 1.00 23.02 C ATOM 0 H LEU A 115 7.658 -8.155 -12.763 1.00 73.23 H new ATOM 0 HA LEU A 115 5.343 -9.478 -11.765 1.00 71.51 H new ATOM 0 HB2 LEU A 115 8.311 -9.555 -11.306 1.00 4.25 H new ATOM 0 HB3 LEU A 115 7.267 -10.344 -10.140 1.00 4.25 H new ATOM 0 HG LEU A 115 7.254 -10.953 -13.107 1.00 61.43 H new ATOM 0 HD11 LEU A 115 8.488 -12.999 -12.506 1.00 34.32 H new ATOM 0 HD12 LEU A 115 9.420 -11.530 -12.130 1.00 34.32 H new ATOM 0 HD13 LEU A 115 8.608 -12.427 -10.825 1.00 34.32 H new ATOM 0 HD21 LEU A 115 6.023 -12.973 -12.411 1.00 23.02 H new ATOM 0 HD22 LEU A 115 6.045 -12.399 -10.727 1.00 23.02 H new ATOM 0 HD23 LEU A 115 5.155 -11.484 -11.967 1.00 23.02 H new ATOM 1701 N VAL A 116 6.772 -7.209 -9.862 1.00 74.33 N ATOM 1702 CA VAL A 116 6.590 -6.398 -8.664 1.00 64.51 C ATOM 1703 C VAL A 116 5.540 -5.317 -8.886 1.00 54.54 C ATOM 1704 O VAL A 116 4.805 -4.953 -7.969 1.00 12.32 O ATOM 1705 CB VAL A 116 7.911 -5.735 -8.231 1.00 10.24 C ATOM 1706 CG1 VAL A 116 8.432 -4.817 -9.326 1.00 1.33 C ATOM 1707 CG2 VAL A 116 7.721 -4.971 -6.929 1.00 14.11 C ATOM 0 H VAL A 116 7.568 -6.936 -10.439 1.00 74.33 H new ATOM 0 HA VAL A 116 6.253 -7.070 -7.875 1.00 64.51 H new ATOM 0 HB VAL A 116 8.652 -6.517 -8.063 1.00 10.24 H new ATOM 0 HG11 VAL A 116 9.366 -4.358 -9.002 1.00 1.33 H new ATOM 0 HG12 VAL A 116 8.608 -5.396 -10.233 1.00 1.33 H new ATOM 0 HG13 VAL A 116 7.696 -4.039 -9.529 1.00 1.33 H new ATOM 0 HG21 VAL A 116 8.664 -4.509 -6.637 1.00 14.11 H new ATOM 0 HG22 VAL A 116 6.965 -4.198 -7.068 1.00 14.11 H new ATOM 0 HG23 VAL A 116 7.397 -5.659 -6.148 1.00 14.11 H new ATOM 1717 N ALA A 117 5.474 -4.806 -10.112 1.00 32.22 N ATOM 1718 CA ALA A 117 4.511 -3.767 -10.456 1.00 30.41 C ATOM 1719 C ALA A 117 3.101 -4.163 -10.031 1.00 71.22 C ATOM 1720 O ALA A 117 2.432 -3.431 -9.300 1.00 63.34 O ATOM 1721 CB ALA A 117 4.554 -3.482 -11.950 1.00 33.11 C ATOM 0 H ALA A 117 6.076 -5.095 -10.883 1.00 32.22 H new ATOM 0 HA ALA A 117 4.783 -2.860 -9.916 1.00 30.41 H new ATOM 0 HB1 ALA A 117 3.830 -2.704 -12.193 1.00 33.11 H new ATOM 0 HB2 ALA A 117 5.553 -3.147 -12.228 1.00 33.11 H new ATOM 0 HB3 ALA A 117 4.310 -4.390 -12.501 1.00 33.11 H new ATOM 1727 N THR A 118 2.653 -5.326 -10.494 1.00 72.11 N ATOM 1728 CA THR A 118 1.321 -5.818 -10.164 1.00 24.33 C ATOM 1729 C THR A 118 1.086 -5.798 -8.658 1.00 14.02 C ATOM 1730 O THR A 118 -0.026 -5.534 -8.196 1.00 45.25 O ATOM 1731 CB THR A 118 1.107 -7.251 -10.686 1.00 74.42 C ATOM 1732 OG1 THR A 118 -0.146 -7.762 -10.216 1.00 51.40 O ATOM 1733 CG2 THR A 118 2.234 -8.167 -10.234 1.00 45.25 C ATOM 0 H THR A 118 3.193 -5.945 -11.099 1.00 72.11 H new ATOM 0 HA THR A 118 0.608 -5.152 -10.650 1.00 24.33 H new ATOM 0 HB THR A 118 1.101 -7.219 -11.776 1.00 74.42 H new ATOM 0 HG1 THR A 118 -0.275 -8.673 -10.554 1.00 51.40 H new ATOM 0 HG21 THR A 118 2.060 -9.173 -10.615 1.00 45.25 H new ATOM 0 HG22 THR A 118 3.183 -7.793 -10.618 1.00 45.25 H new ATOM 0 HG23 THR A 118 2.268 -8.192 -9.145 1.00 45.25 H new ATOM 1741 N LEU A 119 2.137 -6.078 -7.895 1.00 50.55 N ATOM 1742 CA LEU A 119 2.045 -6.090 -6.440 1.00 35.54 C ATOM 1743 C LEU A 119 1.941 -4.672 -5.888 1.00 31.21 C ATOM 1744 O LEU A 119 1.194 -4.416 -4.944 1.00 11.23 O ATOM 1745 CB LEU A 119 3.261 -6.796 -5.838 1.00 30.30 C ATOM 1746 CG LEU A 119 3.627 -8.146 -6.456 1.00 23.22 C ATOM 1747 CD1 LEU A 119 4.825 -8.753 -5.741 1.00 35.11 C ATOM 1748 CD2 LEU A 119 2.438 -9.095 -6.408 1.00 43.35 C ATOM 0 H LEU A 119 3.063 -6.300 -8.260 1.00 50.55 H new ATOM 0 HA LEU A 119 1.142 -6.634 -6.163 1.00 35.54 H new ATOM 0 HB2 LEU A 119 4.122 -6.133 -5.927 1.00 30.30 H new ATOM 0 HB3 LEU A 119 3.080 -6.943 -4.773 1.00 30.30 H new ATOM 0 HG LEU A 119 3.896 -7.985 -7.500 1.00 23.22 H new ATOM 0 HD11 LEU A 119 5.071 -9.713 -6.194 1.00 35.11 H new ATOM 0 HD12 LEU A 119 5.679 -8.081 -5.828 1.00 35.11 H new ATOM 0 HD13 LEU A 119 4.584 -8.900 -4.688 1.00 35.11 H new ATOM 0 HD21 LEU A 119 2.717 -10.051 -6.852 1.00 43.35 H new ATOM 0 HD22 LEU A 119 2.138 -9.250 -5.372 1.00 43.35 H new ATOM 0 HD23 LEU A 119 1.606 -8.665 -6.966 1.00 43.35 H new ATOM 1760 N SER A 120 2.694 -3.754 -6.485 1.00 51.10 N ATOM 1761 CA SER A 120 2.688 -2.361 -6.052 1.00 61.45 C ATOM 1762 C SER A 120 1.295 -1.755 -6.193 1.00 2.23 C ATOM 1763 O SER A 120 0.876 -0.941 -5.371 1.00 1.14 O ATOM 1764 CB SER A 120 3.695 -1.548 -6.867 1.00 44.15 C ATOM 1765 OG SER A 120 4.749 -2.369 -7.342 1.00 55.43 O ATOM 0 H SER A 120 3.316 -3.949 -7.270 1.00 51.10 H new ATOM 0 HA SER A 120 2.974 -2.331 -5.001 1.00 61.45 H new ATOM 0 HB2 SER A 120 3.189 -1.076 -7.710 1.00 44.15 H new ATOM 0 HB3 SER A 120 4.103 -0.747 -6.251 1.00 44.15 H new ATOM 0 HG SER A 120 5.383 -1.824 -7.853 1.00 55.43 H new ATOM 1771 N GLU A 121 0.584 -2.158 -7.241 1.00 33.13 N ATOM 1772 CA GLU A 121 -0.762 -1.654 -7.490 1.00 3.35 C ATOM 1773 C GLU A 121 -1.791 -2.421 -6.665 1.00 14.21 C ATOM 1774 O GLU A 121 -1.545 -3.532 -6.196 1.00 30.04 O ATOM 1775 CB GLU A 121 -1.103 -1.759 -8.977 1.00 62.14 C ATOM 1776 CG GLU A 121 -0.654 -0.557 -9.791 1.00 61.13 C ATOM 1777 CD GLU A 121 -1.484 -0.358 -11.045 1.00 21.43 C ATOM 1778 OE1 GLU A 121 -1.446 -1.242 -11.927 1.00 11.22 O ATOM 1779 OE2 GLU A 121 -2.171 0.680 -11.144 1.00 24.32 O ATOM 0 H GLU A 121 0.917 -2.831 -7.931 1.00 33.13 H new ATOM 0 HA GLU A 121 -0.791 -0.606 -7.192 1.00 3.35 H new ATOM 0 HB2 GLU A 121 -0.639 -2.657 -9.385 1.00 62.14 H new ATOM 0 HB3 GLU A 121 -2.181 -1.879 -9.086 1.00 62.14 H new ATOM 0 HG2 GLU A 121 -0.716 0.339 -9.173 1.00 61.13 H new ATOM 0 HG3 GLU A 121 0.393 -0.681 -10.069 1.00 61.13 H new ATOM 1786 N PRO A 122 -2.974 -1.814 -6.483 1.00 23.20 N ATOM 1787 CA PRO A 122 -4.065 -2.421 -5.715 1.00 20.10 C ATOM 1788 C PRO A 122 -4.679 -3.620 -6.429 1.00 33.20 C ATOM 1789 O PRO A 122 -4.173 -4.069 -7.457 1.00 1.30 O ATOM 1790 CB PRO A 122 -5.088 -1.288 -5.596 1.00 25.24 C ATOM 1791 CG PRO A 122 -4.818 -0.410 -6.768 1.00 50.42 C ATOM 1792 CD PRO A 122 -3.337 -0.489 -7.014 1.00 24.35 C ATOM 0 HA PRO A 122 -3.722 -2.807 -4.755 1.00 20.10 H new ATOM 0 HB2 PRO A 122 -6.108 -1.672 -5.615 1.00 25.24 H new ATOM 0 HB3 PRO A 122 -4.970 -0.745 -4.659 1.00 25.24 H new ATOM 0 HG2 PRO A 122 -5.377 -0.744 -7.642 1.00 50.42 H new ATOM 0 HG3 PRO A 122 -5.126 0.616 -6.566 1.00 50.42 H new ATOM 0 HD2 PRO A 122 -3.100 -0.402 -8.074 1.00 24.35 H new ATOM 0 HD3 PRO A 122 -2.801 0.310 -6.502 1.00 24.35 H new ATOM 1800 N ALA A 123 -5.774 -4.135 -5.877 1.00 45.44 N ATOM 1801 CA ALA A 123 -6.458 -5.280 -6.463 1.00 71.34 C ATOM 1802 C ALA A 123 -6.758 -5.045 -7.940 1.00 4.51 C ATOM 1803 O ALA A 123 -7.074 -3.927 -8.348 1.00 64.51 O ATOM 1804 CB ALA A 123 -7.743 -5.573 -5.703 1.00 22.35 C ATOM 0 H ALA A 123 -6.205 -3.777 -5.025 1.00 45.44 H new ATOM 0 HA ALA A 123 -5.797 -6.144 -6.386 1.00 71.34 H new ATOM 0 HB1 ALA A 123 -8.244 -6.431 -6.152 1.00 22.35 H new ATOM 0 HB2 ALA A 123 -7.508 -5.794 -4.662 1.00 22.35 H new ATOM 0 HB3 ALA A 123 -8.400 -4.704 -5.750 1.00 22.35 H new ATOM 1810 N ALA A 124 -6.655 -6.104 -8.736 1.00 53.31 N ATOM 1811 CA ALA A 124 -6.917 -6.012 -10.167 1.00 44.32 C ATOM 1812 C ALA A 124 -7.023 -7.397 -10.796 1.00 15.11 C ATOM 1813 O ALA A 124 -6.465 -7.649 -11.863 1.00 34.12 O ATOM 1814 CB ALA A 124 -5.826 -5.202 -10.852 1.00 4.11 C ATOM 0 H ALA A 124 -6.392 -7.036 -8.414 1.00 53.31 H new ATOM 0 HA ALA A 124 -7.872 -5.505 -10.304 1.00 44.32 H new ATOM 0 HB1 ALA A 124 -6.034 -5.141 -11.920 1.00 4.11 H new ATOM 0 HB2 ALA A 124 -5.799 -4.197 -10.430 1.00 4.11 H new ATOM 0 HB3 ALA A 124 -4.862 -5.686 -10.697 1.00 4.11 H new ATOM 1820 N ASN A 125 -7.744 -8.291 -10.127 1.00 24.42 N ATOM 1821 CA ASN A 125 -7.922 -9.652 -10.620 1.00 72.21 C ATOM 1822 C ASN A 125 -8.512 -9.648 -12.027 1.00 42.33 C ATOM 1823 O ASN A 125 -9.114 -10.629 -12.461 1.00 62.44 O ATOM 1824 CB ASN A 125 -8.831 -10.444 -9.677 1.00 44.30 C ATOM 1825 CG ASN A 125 -10.196 -9.803 -9.516 1.00 62.25 C ATOM 1826 OD1 ASN A 125 -10.343 -8.795 -8.825 1.00 74.15 O ATOM 1827 ND2 ASN A 125 -11.202 -10.388 -10.156 1.00 12.31 N ATOM 0 H ASN A 125 -8.214 -8.098 -9.243 1.00 24.42 H new ATOM 0 HA ASN A 125 -6.943 -10.129 -10.656 1.00 72.21 H new ATOM 0 HB2 ASN A 125 -8.951 -11.458 -10.059 1.00 44.30 H new ATOM 0 HB3 ASN A 125 -8.354 -10.526 -8.701 1.00 44.30 H new ATOM 0 HD21 ASN A 125 -12.144 -10.003 -10.086 1.00 12.31 H new ATOM 0 HD22 ASN A 125 -11.033 -11.222 -10.718 1.00 12.31 H new TER 1834 ASN A 125