USER MOD reduce.3.24.130724 H: found=0, std=0, add=858, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 855 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 47 GLN : amide:sc= -2.96 X(o=-3.7,f=-3.8) USER MOD Set 1.2: A 51 THR OG1 : rot 70:sc= -0.763! USER MOD Single : A 1 MET CE :methyl -104:sc= -3.45! (180deg=-5.06!) USER MOD Single : A 1 MET N :NH3+ -120:sc= -3.66! (180deg=-5.28!) USER MOD Single : A 7 SER OG : rot 180:sc= -0.748 USER MOD Single : A 23 GLN : amide:sc= -0.474 K(o=-0.47,f=-1.6) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 86:sc= 0.45 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -77:sc= 0.864 USER MOD Single : A 45 THR OG1 : rot 63:sc= 1.27 USER MOD Single : A 48 ASN : amide:sc= -2.84 K(o=-2.8,f=-4.8!) USER MOD Single : A 52 GLN : amide:sc= -0.491 X(o=-0.49,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -5.77! C(o=-5.8!,f=-2.9!) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 62 SER OG : rot 119:sc= 0.0872 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 84:sc= 0.202 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.0291 USER MOD Single : A 73 ASN : amide:sc= -0.646 K(o=-0.65,f=-0.0094) USER MOD Single : A 75 THR OG1 : rot -160:sc= -1.26 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 SER OG : rot -78:sc= 0.0785 USER MOD Single : A 92 MET CE :methyl -162:sc= 0 (180deg=-0.6) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 87:sc= 1.26 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.0885 X(o=-0.089,f=-0.0073) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.031 2.137 2.049 1.00 4.32 N ATOM 2 CA MET A 1 3.974 2.205 0.939 1.00 44.41 C ATOM 3 C MET A 1 4.970 3.344 1.140 1.00 75.11 C ATOM 4 O MET A 1 5.315 4.054 0.195 1.00 32.21 O ATOM 5 CB MET A 1 3.227 2.393 -0.383 1.00 14.45 C ATOM 6 CG MET A 1 1.889 1.673 -0.432 1.00 10.14 C ATOM 7 SD MET A 1 2.037 -0.091 -0.087 1.00 52.43 S ATOM 8 CE MET A 1 1.203 -0.198 1.494 1.00 4.25 C ATOM 0 H1 MET A 1 3.107 1.209 2.513 1.00 4.32 H new ATOM 0 H2 MET A 1 3.249 2.886 2.736 1.00 4.32 H new ATOM 0 H3 MET A 1 2.063 2.267 1.691 1.00 4.32 H new ATOM 0 HA MET A 1 4.525 1.265 0.906 1.00 44.41 H new ATOM 0 HB2 MET A 1 3.064 3.458 -0.551 1.00 14.45 H new ATOM 0 HB3 MET A 1 3.854 2.034 -1.199 1.00 14.45 H new ATOM 0 HG2 MET A 1 1.211 2.125 0.292 1.00 10.14 H new ATOM 0 HG3 MET A 1 1.443 1.811 -1.417 1.00 10.14 H new ATOM 0 HE1 MET A 1 1.942 -0.300 2.289 1.00 4.25 H new ATOM 0 HE2 MET A 1 0.617 0.706 1.658 1.00 4.25 H new ATOM 0 HE3 MET A 1 0.542 -1.065 1.499 1.00 4.25 H new ATOM 18 N PHE A 2 5.427 3.513 2.376 1.00 31.41 N ATOM 19 CA PHE A 2 6.382 4.566 2.701 1.00 54.01 C ATOM 20 C PHE A 2 7.617 3.988 3.385 1.00 43.24 C ATOM 21 O PHE A 2 8.747 4.356 3.062 1.00 22.05 O ATOM 22 CB PHE A 2 5.729 5.615 3.604 1.00 73.41 C ATOM 23 CG PHE A 2 4.228 5.610 3.541 1.00 60.55 C ATOM 24 CD1 PHE A 2 3.571 5.827 2.340 1.00 4.31 C ATOM 25 CD2 PHE A 2 3.474 5.387 4.682 1.00 41.44 C ATOM 26 CE1 PHE A 2 2.191 5.823 2.278 1.00 35.12 C ATOM 27 CE2 PHE A 2 2.093 5.381 4.626 1.00 41.43 C ATOM 28 CZ PHE A 2 1.451 5.601 3.423 1.00 74.31 C ATOM 0 H PHE A 2 5.151 2.934 3.169 1.00 31.41 H new ATOM 0 HA PHE A 2 6.693 5.040 1.770 1.00 54.01 H new ATOM 0 HB2 PHE A 2 6.042 5.442 4.634 1.00 73.41 H new ATOM 0 HB3 PHE A 2 6.093 6.603 3.322 1.00 73.41 H new ATOM 0 HD1 PHE A 2 4.145 6.001 1.442 1.00 4.31 H new ATOM 0 HD2 PHE A 2 3.971 5.216 5.626 1.00 41.44 H new ATOM 0 HE1 PHE A 2 1.691 5.993 1.336 1.00 35.12 H new ATOM 0 HE2 PHE A 2 1.516 5.204 5.522 1.00 41.43 H new ATOM 0 HZ PHE A 2 0.372 5.599 3.378 1.00 74.31 H new ATOM 38 N ASP A 3 7.394 3.082 4.330 1.00 54.20 N ATOM 39 CA ASP A 3 8.488 2.452 5.060 1.00 52.42 C ATOM 40 C ASP A 3 7.955 1.464 6.092 1.00 34.11 C ATOM 41 O ASP A 3 8.166 0.256 5.976 1.00 1.45 O ATOM 42 CB ASP A 3 9.348 3.514 5.748 1.00 33.41 C ATOM 43 CG ASP A 3 10.653 3.764 5.019 1.00 71.35 C ATOM 44 OD1 ASP A 3 11.450 2.812 4.887 1.00 43.00 O ATOM 45 OD2 ASP A 3 10.877 4.911 4.580 1.00 43.52 O ATOM 0 H ASP A 3 6.465 2.767 4.609 1.00 54.20 H new ATOM 0 HA ASP A 3 9.102 1.905 4.345 1.00 52.42 H new ATOM 0 HB2 ASP A 3 8.787 4.446 5.812 1.00 33.41 H new ATOM 0 HB3 ASP A 3 9.561 3.199 6.770 1.00 33.41 H new ATOM 50 N ILE A 4 7.264 1.985 7.101 1.00 72.34 N ATOM 51 CA ILE A 4 6.701 1.148 8.153 1.00 72.21 C ATOM 52 C ILE A 4 7.799 0.444 8.942 1.00 63.50 C ATOM 53 O ILE A 4 8.207 0.906 10.007 1.00 61.34 O ATOM 54 CB ILE A 4 5.739 0.091 7.578 1.00 43.12 C ATOM 55 CG1 ILE A 4 4.527 0.769 6.936 1.00 32.40 C ATOM 56 CG2 ILE A 4 5.298 -0.873 8.669 1.00 62.22 C ATOM 57 CD1 ILE A 4 3.682 1.550 7.917 1.00 14.24 C ATOM 0 H ILE A 4 7.081 2.982 7.212 1.00 72.34 H new ATOM 0 HA ILE A 4 6.146 1.809 8.818 1.00 72.21 H new ATOM 0 HB ILE A 4 6.263 -0.477 6.809 1.00 43.12 H new ATOM 0 HG12 ILE A 4 4.871 1.441 6.150 1.00 32.40 H new ATOM 0 HG13 ILE A 4 3.907 0.010 6.458 1.00 32.40 H new ATOM 0 HG21 ILE A 4 4.619 -1.614 8.247 1.00 62.22 H new ATOM 0 HG22 ILE A 4 6.171 -1.376 9.085 1.00 62.22 H new ATOM 0 HG23 ILE A 4 4.788 -0.321 9.458 1.00 62.22 H new ATOM 0 HD11 ILE A 4 2.841 2.003 7.392 1.00 14.24 H new ATOM 0 HD12 ILE A 4 3.308 0.879 8.690 1.00 14.24 H new ATOM 0 HD13 ILE A 4 4.287 2.332 8.377 1.00 14.24 H new ATOM 69 N GLY A 5 8.276 -0.678 8.411 1.00 71.34 N ATOM 70 CA GLY A 5 9.324 -1.428 9.077 1.00 5.15 C ATOM 71 C GLY A 5 8.776 -2.442 10.061 1.00 30.24 C ATOM 72 O GLY A 5 9.274 -3.565 10.150 1.00 44.42 O ATOM 0 H GLY A 5 7.955 -1.081 7.531 1.00 71.34 H new ATOM 0 HA2 GLY A 5 9.929 -1.942 8.330 1.00 5.15 H new ATOM 0 HA3 GLY A 5 9.984 -0.737 9.602 1.00 5.15 H new ATOM 76 N PHE A 6 7.748 -2.047 10.804 1.00 34.25 N ATOM 77 CA PHE A 6 7.132 -2.929 11.789 1.00 25.43 C ATOM 78 C PHE A 6 5.919 -2.265 12.432 1.00 14.40 C ATOM 79 O PHE A 6 5.009 -2.941 12.912 1.00 53.41 O ATOM 80 CB PHE A 6 8.149 -3.313 12.867 1.00 14.52 C ATOM 81 CG PHE A 6 8.446 -2.201 13.833 1.00 34.31 C ATOM 82 CD1 PHE A 6 8.947 -0.991 13.384 1.00 45.44 C ATOM 83 CD2 PHE A 6 8.222 -2.367 15.190 1.00 23.35 C ATOM 84 CE1 PHE A 6 9.222 0.033 14.271 1.00 43.25 C ATOM 85 CE2 PHE A 6 8.495 -1.347 16.082 1.00 11.21 C ATOM 86 CZ PHE A 6 8.995 -0.145 15.621 1.00 14.32 C ATOM 0 H PHE A 6 7.323 -1.122 10.743 1.00 34.25 H new ATOM 0 HA PHE A 6 6.799 -3.831 11.274 1.00 25.43 H new ATOM 0 HB2 PHE A 6 7.773 -4.174 13.420 1.00 14.52 H new ATOM 0 HB3 PHE A 6 9.077 -3.624 12.386 1.00 14.52 H new ATOM 0 HD1 PHE A 6 9.125 -0.845 12.329 1.00 45.44 H new ATOM 0 HD2 PHE A 6 7.829 -3.304 15.555 1.00 23.35 H new ATOM 0 HE1 PHE A 6 9.614 0.972 13.908 1.00 43.25 H new ATOM 0 HE2 PHE A 6 8.318 -1.490 17.138 1.00 11.21 H new ATOM 0 HZ PHE A 6 9.208 0.654 16.315 1.00 14.32 H new ATOM 96 N SER A 7 5.913 -0.935 12.438 1.00 62.53 N ATOM 97 CA SER A 7 4.814 -0.178 13.025 1.00 22.10 C ATOM 98 C SER A 7 3.476 -0.856 12.745 1.00 44.14 C ATOM 99 O SER A 7 2.733 -1.190 13.667 1.00 41.05 O ATOM 100 CB SER A 7 4.800 1.250 12.476 1.00 23.11 C ATOM 101 OG SER A 7 5.040 1.262 11.080 1.00 61.35 O ATOM 0 H SER A 7 6.657 -0.360 12.043 1.00 62.53 H new ATOM 0 HA SER A 7 4.965 -0.143 14.104 1.00 22.10 H new ATOM 0 HB2 SER A 7 3.837 1.714 12.686 1.00 23.11 H new ATOM 0 HB3 SER A 7 5.559 1.846 12.984 1.00 23.11 H new ATOM 0 HG SER A 7 5.024 2.186 10.753 1.00 61.35 H new ATOM 107 N GLU A 8 3.178 -1.055 11.465 1.00 71.14 N ATOM 108 CA GLU A 8 1.929 -1.692 11.062 1.00 24.13 C ATOM 109 C GLU A 8 1.725 -3.008 11.808 1.00 42.14 C ATOM 110 O GLU A 8 0.680 -3.232 12.420 1.00 61.33 O ATOM 111 CB GLU A 8 1.922 -1.942 9.553 1.00 52.23 C ATOM 112 CG GLU A 8 1.572 -0.711 8.734 1.00 44.52 C ATOM 113 CD GLU A 8 0.135 -0.720 8.251 1.00 40.32 C ATOM 114 OE1 GLU A 8 -0.777 -0.710 9.104 1.00 20.41 O ATOM 115 OE2 GLU A 8 -0.078 -0.737 7.021 1.00 40.44 O ATOM 0 H GLU A 8 3.783 -0.785 10.690 1.00 71.14 H new ATOM 0 HA GLU A 8 1.109 -1.020 11.315 1.00 24.13 H new ATOM 0 HB2 GLU A 8 2.904 -2.303 9.249 1.00 52.23 H new ATOM 0 HB3 GLU A 8 1.207 -2.733 9.328 1.00 52.23 H new ATOM 0 HG2 GLU A 8 1.743 0.182 9.336 1.00 44.52 H new ATOM 0 HG3 GLU A 8 2.240 -0.649 7.875 1.00 44.52 H new ATOM 122 N LEU A 9 2.730 -3.875 11.751 1.00 60.01 N ATOM 123 CA LEU A 9 2.662 -5.170 12.420 1.00 50.33 C ATOM 124 C LEU A 9 2.204 -5.012 13.866 1.00 24.02 C ATOM 125 O LEU A 9 1.224 -5.626 14.289 1.00 21.41 O ATOM 126 CB LEU A 9 4.026 -5.860 12.377 1.00 62.32 C ATOM 127 CG LEU A 9 4.004 -7.389 12.348 1.00 20.01 C ATOM 128 CD1 LEU A 9 3.069 -7.930 13.419 1.00 4.51 C ATOM 129 CD2 LEU A 9 3.589 -7.891 10.973 1.00 52.43 C ATOM 0 H LEU A 9 3.601 -3.705 11.249 1.00 60.01 H new ATOM 0 HA LEU A 9 1.933 -5.786 11.893 1.00 50.33 H new ATOM 0 HB2 LEU A 9 4.562 -5.507 11.496 1.00 62.32 H new ATOM 0 HB3 LEU A 9 4.600 -5.541 13.247 1.00 62.32 H new ATOM 0 HG LEU A 9 5.011 -7.751 12.556 1.00 20.01 H new ATOM 0 HD11 LEU A 9 3.066 -9.019 13.383 1.00 4.51 H new ATOM 0 HD12 LEU A 9 3.410 -7.600 14.400 1.00 4.51 H new ATOM 0 HD13 LEU A 9 2.060 -7.559 13.242 1.00 4.51 H new ATOM 0 HD21 LEU A 9 3.579 -8.981 10.971 1.00 52.43 H new ATOM 0 HD22 LEU A 9 2.593 -7.519 10.735 1.00 52.43 H new ATOM 0 HD23 LEU A 9 4.298 -7.534 10.226 1.00 52.43 H new ATOM 141 N LEU A 10 2.919 -4.184 14.620 1.00 13.31 N ATOM 142 CA LEU A 10 2.585 -3.943 16.020 1.00 51.44 C ATOM 143 C LEU A 10 1.128 -3.514 16.166 1.00 22.41 C ATOM 144 O LEU A 10 0.336 -4.186 16.828 1.00 72.53 O ATOM 145 CB LEU A 10 3.505 -2.871 16.606 1.00 11.35 C ATOM 146 CG LEU A 10 4.581 -3.366 17.573 1.00 3.11 C ATOM 147 CD1 LEU A 10 3.978 -3.665 18.937 1.00 54.34 C ATOM 148 CD2 LEU A 10 5.275 -4.599 17.013 1.00 75.31 C ATOM 0 H LEU A 10 3.733 -3.668 14.286 1.00 13.31 H new ATOM 0 HA LEU A 10 2.727 -4.875 16.568 1.00 51.44 H new ATOM 0 HB2 LEU A 10 3.996 -2.352 15.783 1.00 11.35 H new ATOM 0 HB3 LEU A 10 2.889 -2.136 17.124 1.00 11.35 H new ATOM 0 HG LEU A 10 5.324 -2.578 17.693 1.00 3.11 H new ATOM 0 HD11 LEU A 10 4.759 -4.016 19.611 1.00 54.34 H new ATOM 0 HD12 LEU A 10 3.529 -2.759 19.343 1.00 54.34 H new ATOM 0 HD13 LEU A 10 3.213 -4.435 18.836 1.00 54.34 H new ATOM 0 HD21 LEU A 10 6.038 -4.937 17.714 1.00 75.31 H new ATOM 0 HD22 LEU A 10 4.543 -5.392 16.863 1.00 75.31 H new ATOM 0 HD23 LEU A 10 5.743 -4.352 16.060 1.00 75.31 H new ATOM 160 N LEU A 11 0.781 -2.393 15.543 1.00 22.54 N ATOM 161 CA LEU A 11 -0.582 -1.876 15.602 1.00 25.11 C ATOM 162 C LEU A 11 -1.597 -2.987 15.355 1.00 20.21 C ATOM 163 O LEU A 11 -2.374 -3.341 16.242 1.00 51.20 O ATOM 164 CB LEU A 11 -0.769 -0.760 14.573 1.00 71.12 C ATOM 165 CG LEU A 11 -2.151 -0.107 14.535 1.00 33.30 C ATOM 166 CD1 LEU A 11 -2.129 1.232 15.255 1.00 42.33 C ATOM 167 CD2 LEU A 11 -2.621 0.065 13.098 1.00 44.22 C ATOM 0 H LEU A 11 1.424 -1.825 14.992 1.00 22.54 H new ATOM 0 HA LEU A 11 -0.749 -1.473 16.601 1.00 25.11 H new ATOM 0 HB2 LEU A 11 -0.028 0.015 14.769 1.00 71.12 H new ATOM 0 HB3 LEU A 11 -0.553 -1.165 13.584 1.00 71.12 H new ATOM 0 HG LEU A 11 -2.855 -0.761 15.050 1.00 33.30 H new ATOM 0 HD11 LEU A 11 -3.121 1.682 15.217 1.00 42.33 H new ATOM 0 HD12 LEU A 11 -1.838 1.081 16.295 1.00 42.33 H new ATOM 0 HD13 LEU A 11 -1.412 1.894 14.770 1.00 42.33 H new ATOM 0 HD21 LEU A 11 -3.606 0.531 13.091 1.00 44.22 H new ATOM 0 HD22 LEU A 11 -1.916 0.697 12.558 1.00 44.22 H new ATOM 0 HD23 LEU A 11 -2.678 -0.910 12.614 1.00 44.22 H new ATOM 179 N VAL A 12 -1.583 -3.536 14.144 1.00 15.23 N ATOM 180 CA VAL A 12 -2.501 -4.609 13.781 1.00 23.42 C ATOM 181 C VAL A 12 -2.556 -5.676 14.869 1.00 71.21 C ATOM 182 O VAL A 12 -3.635 -6.090 15.294 1.00 53.34 O ATOM 183 CB VAL A 12 -2.094 -5.269 12.450 1.00 25.45 C ATOM 184 CG1 VAL A 12 -3.024 -6.427 12.122 1.00 62.03 C ATOM 185 CG2 VAL A 12 -2.088 -4.244 11.327 1.00 0.42 C ATOM 0 H VAL A 12 -0.946 -3.255 13.398 1.00 15.23 H new ATOM 0 HA VAL A 12 -3.487 -4.158 13.668 1.00 23.42 H new ATOM 0 HB VAL A 12 -1.084 -5.665 12.555 1.00 25.45 H new ATOM 0 HG11 VAL A 12 -2.721 -6.881 11.178 1.00 62.03 H new ATOM 0 HG12 VAL A 12 -2.972 -7.172 12.916 1.00 62.03 H new ATOM 0 HG13 VAL A 12 -4.047 -6.059 12.036 1.00 62.03 H new ATOM 0 HG21 VAL A 12 -1.798 -4.728 10.394 1.00 0.42 H new ATOM 0 HG22 VAL A 12 -3.085 -3.816 11.219 1.00 0.42 H new ATOM 0 HG23 VAL A 12 -1.377 -3.452 11.561 1.00 0.42 H new ATOM 195 N PHE A 13 -1.386 -6.118 15.317 1.00 64.22 N ATOM 196 CA PHE A 13 -1.300 -7.138 16.356 1.00 52.04 C ATOM 197 C PHE A 13 -2.035 -6.693 17.617 1.00 41.43 C ATOM 198 O PHE A 13 -2.755 -7.475 18.237 1.00 20.32 O ATOM 199 CB PHE A 13 0.163 -7.440 16.684 1.00 23.12 C ATOM 200 CG PHE A 13 0.346 -8.661 17.539 1.00 30.43 C ATOM 201 CD1 PHE A 13 0.364 -9.925 16.971 1.00 53.10 C ATOM 202 CD2 PHE A 13 0.499 -8.546 18.912 1.00 44.15 C ATOM 203 CE1 PHE A 13 0.532 -11.051 17.755 1.00 51.21 C ATOM 204 CE2 PHE A 13 0.668 -9.668 19.700 1.00 24.13 C ATOM 205 CZ PHE A 13 0.683 -10.922 19.122 1.00 64.15 C ATOM 0 H PHE A 13 -0.484 -5.786 14.977 1.00 64.22 H new ATOM 0 HA PHE A 13 -1.775 -8.044 15.981 1.00 52.04 H new ATOM 0 HB2 PHE A 13 0.716 -7.571 15.754 1.00 23.12 H new ATOM 0 HB3 PHE A 13 0.598 -6.580 17.194 1.00 23.12 H new ATOM 0 HD1 PHE A 13 0.245 -10.032 15.903 1.00 53.10 H new ATOM 0 HD2 PHE A 13 0.486 -7.568 19.371 1.00 44.15 H new ATOM 0 HE1 PHE A 13 0.545 -12.030 17.299 1.00 51.21 H new ATOM 0 HE2 PHE A 13 0.788 -9.564 20.768 1.00 24.13 H new ATOM 0 HZ PHE A 13 0.813 -11.800 19.737 1.00 64.15 H new ATOM 215 N ILE A 14 -1.847 -5.431 17.989 1.00 23.24 N ATOM 216 CA ILE A 14 -2.491 -4.881 19.175 1.00 34.34 C ATOM 217 C ILE A 14 -4.004 -4.814 18.997 1.00 14.14 C ATOM 218 O ILE A 14 -4.759 -5.360 19.803 1.00 10.40 O ATOM 219 CB ILE A 14 -1.961 -3.473 19.503 1.00 40.14 C ATOM 220 CG1 ILE A 14 -0.473 -3.533 19.853 1.00 21.32 C ATOM 221 CG2 ILE A 14 -2.756 -2.860 20.646 1.00 23.21 C ATOM 222 CD1 ILE A 14 -0.188 -4.243 21.158 1.00 22.41 C ATOM 0 H ILE A 14 -1.254 -4.771 17.486 1.00 23.24 H new ATOM 0 HA ILE A 14 -2.254 -5.550 20.002 1.00 34.34 H new ATOM 0 HB ILE A 14 -2.082 -2.841 18.623 1.00 40.14 H new ATOM 0 HG12 ILE A 14 0.061 -4.039 19.049 1.00 21.32 H new ATOM 0 HG13 ILE A 14 -0.079 -2.518 19.907 1.00 21.32 H new ATOM 0 HG21 ILE A 14 -2.369 -1.865 20.866 1.00 23.21 H new ATOM 0 HG22 ILE A 14 -3.805 -2.786 20.361 1.00 23.21 H new ATOM 0 HG23 ILE A 14 -2.664 -3.489 21.532 1.00 23.21 H new ATOM 0 HD11 ILE A 14 0.886 -4.248 21.342 1.00 22.41 H new ATOM 0 HD12 ILE A 14 -0.694 -3.724 21.972 1.00 22.41 H new ATOM 0 HD13 ILE A 14 -0.551 -5.269 21.101 1.00 22.41 H new ATOM 234 N ILE A 15 -4.440 -4.143 17.937 1.00 54.22 N ATOM 235 CA ILE A 15 -5.863 -4.007 17.651 1.00 13.15 C ATOM 236 C ILE A 15 -6.553 -5.367 17.635 1.00 50.21 C ATOM 237 O ILE A 15 -7.732 -5.481 17.969 1.00 5.00 O ATOM 238 CB ILE A 15 -6.102 -3.306 16.301 1.00 73.20 C ATOM 239 CG1 ILE A 15 -5.342 -1.979 16.249 1.00 72.34 C ATOM 240 CG2 ILE A 15 -7.590 -3.080 16.078 1.00 50.23 C ATOM 241 CD1 ILE A 15 -5.575 -1.101 17.458 1.00 74.10 C ATOM 0 H ILE A 15 -3.828 -3.685 17.262 1.00 54.22 H new ATOM 0 HA ILE A 15 -6.288 -3.396 18.448 1.00 13.15 H new ATOM 0 HB ILE A 15 -5.728 -3.948 15.503 1.00 73.20 H new ATOM 0 HG12 ILE A 15 -4.275 -2.184 16.159 1.00 72.34 H new ATOM 0 HG13 ILE A 15 -5.639 -1.435 15.352 1.00 72.34 H new ATOM 0 HG21 ILE A 15 -7.743 -2.584 15.120 1.00 50.23 H new ATOM 0 HG22 ILE A 15 -8.108 -4.039 16.077 1.00 50.23 H new ATOM 0 HG23 ILE A 15 -7.987 -2.455 16.878 1.00 50.23 H new ATOM 0 HD11 ILE A 15 -5.005 -0.178 17.352 1.00 74.10 H new ATOM 0 HD12 ILE A 15 -6.636 -0.865 17.537 1.00 74.10 H new ATOM 0 HD13 ILE A 15 -5.252 -1.626 18.357 1.00 74.10 H new ATOM 253 N GLY A 16 -5.809 -6.397 17.245 1.00 63.31 N ATOM 254 CA GLY A 16 -6.365 -7.737 17.194 1.00 43.33 C ATOM 255 C GLY A 16 -6.775 -8.247 18.561 1.00 42.10 C ATOM 256 O GLY A 16 -7.781 -8.945 18.695 1.00 23.05 O ATOM 0 H GLY A 16 -4.831 -6.328 16.963 1.00 63.31 H new ATOM 0 HA2 GLY A 16 -7.231 -7.743 16.533 1.00 43.33 H new ATOM 0 HA3 GLY A 16 -5.630 -8.416 16.762 1.00 43.33 H new ATOM 260 N LEU A 17 -5.994 -7.900 19.578 1.00 33.24 N ATOM 261 CA LEU A 17 -6.281 -8.329 20.943 1.00 25.11 C ATOM 262 C LEU A 17 -7.321 -7.422 21.592 1.00 75.32 C ATOM 263 O LEU A 17 -8.212 -7.890 22.302 1.00 64.21 O ATOM 264 CB LEU A 17 -4.998 -8.331 21.777 1.00 35.35 C ATOM 265 CG LEU A 17 -3.732 -8.799 21.060 1.00 4.02 C ATOM 266 CD1 LEU A 17 -2.537 -8.752 22.001 1.00 55.13 C ATOM 267 CD2 LEU A 17 -3.921 -10.203 20.505 1.00 24.21 C ATOM 0 H LEU A 17 -5.158 -7.323 19.484 1.00 33.24 H new ATOM 0 HA LEU A 17 -6.684 -9.341 20.903 1.00 25.11 H new ATOM 0 HB2 LEU A 17 -4.828 -7.320 22.148 1.00 35.35 H new ATOM 0 HB3 LEU A 17 -5.155 -8.968 22.647 1.00 35.35 H new ATOM 0 HG LEU A 17 -3.539 -8.124 20.227 1.00 4.02 H new ATOM 0 HD11 LEU A 17 -1.645 -9.089 21.473 1.00 55.13 H new ATOM 0 HD12 LEU A 17 -2.388 -7.730 22.350 1.00 55.13 H new ATOM 0 HD13 LEU A 17 -2.721 -9.404 22.855 1.00 55.13 H new ATOM 0 HD21 LEU A 17 -3.010 -10.520 19.998 1.00 24.21 H new ATOM 0 HD22 LEU A 17 -4.139 -10.891 21.322 1.00 24.21 H new ATOM 0 HD23 LEU A 17 -4.750 -10.206 19.797 1.00 24.21 H new ATOM 279 N VAL A 18 -7.205 -6.122 21.341 1.00 23.03 N ATOM 280 CA VAL A 18 -8.137 -5.149 21.898 1.00 33.40 C ATOM 281 C VAL A 18 -9.512 -5.273 21.251 1.00 70.33 C ATOM 282 O VAL A 18 -10.521 -4.868 21.828 1.00 30.32 O ATOM 283 CB VAL A 18 -7.623 -3.709 21.714 1.00 71.34 C ATOM 284 CG1 VAL A 18 -6.121 -3.645 21.945 1.00 12.34 C ATOM 285 CG2 VAL A 18 -7.980 -3.190 20.329 1.00 1.10 C ATOM 0 H VAL A 18 -6.474 -5.718 20.755 1.00 23.03 H new ATOM 0 HA VAL A 18 -8.219 -5.363 22.964 1.00 33.40 H new ATOM 0 HB VAL A 18 -8.108 -3.071 22.453 1.00 71.34 H new ATOM 0 HG11 VAL A 18 -5.776 -2.620 21.811 1.00 12.34 H new ATOM 0 HG12 VAL A 18 -5.894 -3.974 22.959 1.00 12.34 H new ATOM 0 HG13 VAL A 18 -5.615 -4.295 21.231 1.00 12.34 H new ATOM 0 HG21 VAL A 18 -7.609 -2.171 20.216 1.00 1.10 H new ATOM 0 HG22 VAL A 18 -7.524 -3.828 19.572 1.00 1.10 H new ATOM 0 HG23 VAL A 18 -9.063 -3.198 20.205 1.00 1.10 H new ATOM 295 N VAL A 19 -9.545 -5.837 20.047 1.00 2.41 N ATOM 296 CA VAL A 19 -10.796 -6.016 19.321 1.00 52.03 C ATOM 297 C VAL A 19 -11.346 -7.425 19.513 1.00 42.05 C ATOM 298 O VAL A 19 -12.497 -7.605 19.911 1.00 33.21 O ATOM 299 CB VAL A 19 -10.614 -5.748 17.815 1.00 74.21 C ATOM 300 CG1 VAL A 19 -11.858 -6.166 17.044 1.00 5.22 C ATOM 301 CG2 VAL A 19 -10.293 -4.282 17.570 1.00 43.30 C ATOM 0 H VAL A 19 -8.719 -6.178 19.555 1.00 2.41 H new ATOM 0 HA VAL A 19 -11.504 -5.294 19.728 1.00 52.03 H new ATOM 0 HB VAL A 19 -9.775 -6.345 17.456 1.00 74.21 H new ATOM 0 HG11 VAL A 19 -11.711 -5.969 15.982 1.00 5.22 H new ATOM 0 HG12 VAL A 19 -12.039 -7.230 17.194 1.00 5.22 H new ATOM 0 HG13 VAL A 19 -12.716 -5.598 17.403 1.00 5.22 H new ATOM 0 HG21 VAL A 19 -10.168 -4.111 16.501 1.00 43.30 H new ATOM 0 HG22 VAL A 19 -11.109 -3.663 17.943 1.00 43.30 H new ATOM 0 HG23 VAL A 19 -9.372 -4.019 18.090 1.00 43.30 H new ATOM 311 N LEU A 20 -10.515 -8.422 19.227 1.00 55.21 N ATOM 312 CA LEU A 20 -10.918 -9.817 19.368 1.00 4.14 C ATOM 313 C LEU A 20 -10.867 -10.253 20.829 1.00 10.23 C ATOM 314 O LEU A 20 -11.221 -11.383 21.163 1.00 1.32 O ATOM 315 CB LEU A 20 -10.014 -10.717 18.524 1.00 4.12 C ATOM 316 CG LEU A 20 -10.589 -12.082 18.147 1.00 74.31 C ATOM 317 CD1 LEU A 20 -12.059 -11.958 17.776 1.00 11.23 C ATOM 318 CD2 LEU A 20 -9.799 -12.696 17.001 1.00 63.31 C ATOM 0 H LEU A 20 -9.559 -8.290 18.896 1.00 55.21 H new ATOM 0 HA LEU A 20 -11.945 -9.911 19.015 1.00 4.14 H new ATOM 0 HB2 LEU A 20 -9.761 -10.186 17.606 1.00 4.12 H new ATOM 0 HB3 LEU A 20 -9.083 -10.875 19.068 1.00 4.12 H new ATOM 0 HG LEU A 20 -10.507 -12.740 19.012 1.00 74.31 H new ATOM 0 HD11 LEU A 20 -12.451 -12.940 17.510 1.00 11.23 H new ATOM 0 HD12 LEU A 20 -12.616 -11.562 18.625 1.00 11.23 H new ATOM 0 HD13 LEU A 20 -12.164 -11.283 16.926 1.00 11.23 H new ATOM 0 HD21 LEU A 20 -10.223 -13.667 16.746 1.00 63.31 H new ATOM 0 HD22 LEU A 20 -9.848 -12.040 16.132 1.00 63.31 H new ATOM 0 HD23 LEU A 20 -8.759 -12.822 17.302 1.00 63.31 H new ATOM 330 N GLY A 21 -10.426 -9.347 21.697 1.00 12.20 N ATOM 331 CA GLY A 21 -10.340 -9.656 23.112 1.00 5.13 C ATOM 332 C GLY A 21 -9.302 -10.719 23.411 1.00 24.40 C ATOM 333 O GLY A 21 -9.231 -11.753 22.745 1.00 11.24 O ATOM 0 H GLY A 21 -10.127 -8.405 21.445 1.00 12.20 H new ATOM 0 HA2 GLY A 21 -10.096 -8.749 23.665 1.00 5.13 H new ATOM 0 HA3 GLY A 21 -11.314 -9.993 23.467 1.00 5.13 H new ATOM 337 N PRO A 22 -8.470 -10.470 24.434 1.00 52.25 N ATOM 338 CA PRO A 22 -7.415 -11.402 24.841 1.00 1.15 C ATOM 339 C PRO A 22 -7.975 -12.669 25.478 1.00 31.13 C ATOM 340 O PRO A 22 -7.225 -13.572 25.847 1.00 61.30 O ATOM 341 CB PRO A 22 -6.610 -10.599 25.866 1.00 25.44 C ATOM 342 CG PRO A 22 -7.573 -9.600 26.407 1.00 32.21 C ATOM 343 CD PRO A 22 -8.497 -9.259 25.271 1.00 43.44 C ATOM 0 HA PRO A 22 -6.826 -11.748 23.992 1.00 1.15 H new ATOM 0 HB2 PRO A 22 -6.222 -11.242 26.656 1.00 25.44 H new ATOM 0 HB3 PRO A 22 -5.753 -10.111 25.402 1.00 25.44 H new ATOM 0 HG2 PRO A 22 -8.127 -10.010 27.251 1.00 32.21 H new ATOM 0 HG3 PRO A 22 -7.053 -8.712 26.767 1.00 32.21 H new ATOM 0 HD2 PRO A 22 -9.504 -9.037 25.625 1.00 43.44 H new ATOM 0 HD3 PRO A 22 -8.152 -8.383 24.722 1.00 43.44 H new ATOM 351 N GLN A 23 -9.297 -12.728 25.604 1.00 61.34 N ATOM 352 CA GLN A 23 -9.956 -13.886 26.196 1.00 14.25 C ATOM 353 C GLN A 23 -9.748 -15.130 25.339 1.00 42.41 C ATOM 354 O GLN A 23 -9.545 -16.227 25.859 1.00 73.01 O ATOM 355 CB GLN A 23 -11.452 -13.615 26.368 1.00 51.23 C ATOM 356 CG GLN A 23 -11.758 -12.256 26.977 1.00 75.20 C ATOM 357 CD GLN A 23 -10.900 -11.953 28.189 1.00 30.32 C ATOM 358 OE1 GLN A 23 -10.017 -11.096 28.141 1.00 71.34 O ATOM 359 NE2 GLN A 23 -11.155 -12.657 29.286 1.00 11.33 N ATOM 0 H GLN A 23 -9.932 -11.988 25.304 1.00 61.34 H new ATOM 0 HA GLN A 23 -9.511 -14.064 27.175 1.00 14.25 H new ATOM 0 HB2 GLN A 23 -11.940 -13.686 25.396 1.00 51.23 H new ATOM 0 HB3 GLN A 23 -11.883 -14.392 26.999 1.00 51.23 H new ATOM 0 HG2 GLN A 23 -11.604 -11.482 26.225 1.00 75.20 H new ATOM 0 HG3 GLN A 23 -12.809 -12.218 27.262 1.00 75.20 H new ATOM 0 HE21 GLN A 23 -11.896 -13.358 29.282 1.00 11.33 H new ATOM 0 HE22 GLN A 23 -10.610 -12.497 30.133 1.00 11.33 H new ATOM 368 N ARG A 24 -9.799 -14.951 24.023 1.00 11.51 N ATOM 369 CA ARG A 24 -9.617 -16.059 23.094 1.00 54.15 C ATOM 370 C ARG A 24 -8.658 -15.675 21.971 1.00 63.11 C ATOM 371 O ARG A 24 -8.956 -15.869 20.792 1.00 65.05 O ATOM 372 CB ARG A 24 -10.964 -16.485 22.505 1.00 44.42 C ATOM 373 CG ARG A 24 -11.872 -15.317 22.154 1.00 25.20 C ATOM 374 CD ARG A 24 -11.551 -14.756 20.777 1.00 30.34 C ATOM 375 NE ARG A 24 -12.503 -13.726 20.371 1.00 4.42 N ATOM 376 CZ ARG A 24 -13.768 -13.977 20.056 1.00 33.10 C ATOM 377 NH1 ARG A 24 -14.232 -15.218 20.100 1.00 20.44 N ATOM 378 NH2 ARG A 24 -14.573 -12.986 19.696 1.00 52.51 N ATOM 0 H ARG A 24 -9.965 -14.049 23.577 1.00 11.51 H new ATOM 0 HA ARG A 24 -9.188 -16.896 23.645 1.00 54.15 H new ATOM 0 HB2 ARG A 24 -10.787 -17.079 21.608 1.00 44.42 H new ATOM 0 HB3 ARG A 24 -11.476 -17.130 23.219 1.00 44.42 H new ATOM 0 HG2 ARG A 24 -12.912 -15.642 22.182 1.00 25.20 H new ATOM 0 HG3 ARG A 24 -11.763 -14.532 22.902 1.00 25.20 H new ATOM 0 HD2 ARG A 24 -10.544 -14.338 20.781 1.00 30.34 H new ATOM 0 HD3 ARG A 24 -11.557 -15.564 20.046 1.00 30.34 H new ATOM 0 HE ARG A 24 -12.178 -12.760 20.327 1.00 4.42 H new ATOM 0 HH11 ARG A 24 -13.617 -15.983 20.376 1.00 20.44 H new ATOM 0 HH12 ARG A 24 -15.204 -15.408 19.857 1.00 20.44 H new ATOM 0 HH21 ARG A 24 -14.220 -12.030 19.661 1.00 52.51 H new ATOM 0 HH22 ARG A 24 -15.545 -13.180 19.454 1.00 52.51 H new ATOM 392 N LEU A 25 -7.506 -15.130 22.345 1.00 2.42 N ATOM 393 CA LEU A 25 -6.502 -14.718 21.370 1.00 3.33 C ATOM 394 C LEU A 25 -5.821 -15.931 20.744 1.00 3.35 C ATOM 395 O LEU A 25 -5.771 -16.084 19.524 1.00 63.31 O ATOM 396 CB LEU A 25 -5.457 -13.818 22.033 1.00 15.13 C ATOM 397 CG LEU A 25 -4.187 -13.555 21.224 1.00 10.11 C ATOM 398 CD1 LEU A 25 -3.155 -14.642 21.482 1.00 74.23 C ATOM 399 CD2 LEU A 25 -4.509 -13.464 19.740 1.00 75.03 C ATOM 0 H LEU A 25 -7.244 -14.963 23.316 1.00 2.42 H new ATOM 0 HA LEU A 25 -7.006 -14.159 20.581 1.00 3.33 H new ATOM 0 HB2 LEU A 25 -5.924 -12.860 22.260 1.00 15.13 H new ATOM 0 HB3 LEU A 25 -5.171 -14.267 22.984 1.00 15.13 H new ATOM 0 HG LEU A 25 -3.767 -12.601 21.543 1.00 10.11 H new ATOM 0 HD11 LEU A 25 -2.258 -14.438 20.898 1.00 74.23 H new ATOM 0 HD12 LEU A 25 -2.902 -14.659 22.542 1.00 74.23 H new ATOM 0 HD13 LEU A 25 -3.565 -15.609 21.192 1.00 74.23 H new ATOM 0 HD21 LEU A 25 -3.593 -13.276 19.180 1.00 75.03 H new ATOM 0 HD22 LEU A 25 -4.953 -14.402 19.406 1.00 75.03 H new ATOM 0 HD23 LEU A 25 -5.212 -12.649 19.570 1.00 75.03 H new ATOM 411 N PRO A 26 -5.285 -16.815 21.599 1.00 60.12 N ATOM 412 CA PRO A 26 -4.600 -18.032 21.152 1.00 3.34 C ATOM 413 C PRO A 26 -5.561 -19.050 20.548 1.00 43.31 C ATOM 414 O PRO A 26 -5.139 -20.077 20.016 1.00 11.21 O ATOM 415 CB PRO A 26 -3.978 -18.581 22.439 1.00 75.21 C ATOM 416 CG PRO A 26 -4.836 -18.046 23.533 1.00 54.43 C ATOM 417 CD PRO A 26 -5.307 -16.696 23.066 1.00 15.13 C ATOM 0 HA PRO A 26 -3.874 -17.826 20.365 1.00 3.34 H new ATOM 0 HB2 PRO A 26 -3.969 -19.671 22.440 1.00 75.21 H new ATOM 0 HB3 PRO A 26 -2.944 -18.253 22.550 1.00 75.21 H new ATOM 0 HG2 PRO A 26 -5.680 -18.708 23.727 1.00 54.43 H new ATOM 0 HG3 PRO A 26 -4.275 -17.963 24.464 1.00 54.43 H new ATOM 0 HD2 PRO A 26 -6.307 -16.469 23.436 1.00 15.13 H new ATOM 0 HD3 PRO A 26 -4.650 -15.899 23.414 1.00 15.13 H new ATOM 425 N VAL A 27 -6.855 -18.758 20.632 1.00 2.15 N ATOM 426 CA VAL A 27 -7.876 -19.647 20.092 1.00 20.41 C ATOM 427 C VAL A 27 -7.769 -19.749 18.575 1.00 52.13 C ATOM 428 O VAL A 27 -7.774 -20.844 18.014 1.00 64.31 O ATOM 429 CB VAL A 27 -9.292 -19.169 20.465 1.00 4.13 C ATOM 430 CG1 VAL A 27 -10.342 -19.967 19.708 1.00 51.31 C ATOM 431 CG2 VAL A 27 -9.511 -19.274 21.967 1.00 25.30 C ATOM 0 H VAL A 27 -7.221 -17.912 21.069 1.00 2.15 H new ATOM 0 HA VAL A 27 -7.705 -20.629 20.532 1.00 20.41 H new ATOM 0 HB VAL A 27 -9.390 -18.122 20.179 1.00 4.13 H new ATOM 0 HG11 VAL A 27 -11.336 -19.615 19.985 1.00 51.31 H new ATOM 0 HG12 VAL A 27 -10.196 -19.836 18.636 1.00 51.31 H new ATOM 0 HG13 VAL A 27 -10.248 -21.023 19.960 1.00 51.31 H new ATOM 0 HG21 VAL A 27 -10.516 -18.932 22.213 1.00 25.30 H new ATOM 0 HG22 VAL A 27 -9.394 -20.311 22.280 1.00 25.30 H new ATOM 0 HG23 VAL A 27 -8.780 -18.654 22.486 1.00 25.30 H new ATOM 441 N ALA A 28 -7.673 -18.599 17.916 1.00 41.04 N ATOM 442 CA ALA A 28 -7.562 -18.558 16.463 1.00 73.23 C ATOM 443 C ALA A 28 -6.280 -19.235 15.991 1.00 41.34 C ATOM 444 O ALA A 28 -6.311 -20.116 15.131 1.00 2.15 O ATOM 445 CB ALA A 28 -7.615 -17.120 15.970 1.00 40.34 C ATOM 0 H ALA A 28 -7.670 -17.683 18.365 1.00 41.04 H new ATOM 0 HA ALA A 28 -8.406 -19.105 16.043 1.00 73.23 H new ATOM 0 HB1 ALA A 28 -7.531 -17.105 14.883 1.00 40.34 H new ATOM 0 HB2 ALA A 28 -8.561 -16.668 16.267 1.00 40.34 H new ATOM 0 HB3 ALA A 28 -6.791 -16.555 16.406 1.00 40.34 H new ATOM 451 N VAL A 29 -5.152 -18.816 16.557 1.00 74.30 N ATOM 452 CA VAL A 29 -3.859 -19.382 16.194 1.00 23.30 C ATOM 453 C VAL A 29 -3.860 -20.899 16.348 1.00 24.03 C ATOM 454 O VAL A 29 -3.546 -21.630 15.409 1.00 72.33 O ATOM 455 CB VAL A 29 -2.726 -18.791 17.054 1.00 50.52 C ATOM 456 CG1 VAL A 29 -1.371 -19.263 16.550 1.00 4.51 C ATOM 457 CG2 VAL A 29 -2.802 -17.271 17.061 1.00 23.24 C ATOM 0 H VAL A 29 -5.108 -18.087 17.269 1.00 74.30 H new ATOM 0 HA VAL A 29 -3.684 -19.126 15.149 1.00 23.30 H new ATOM 0 HB VAL A 29 -2.848 -19.144 18.078 1.00 50.52 H new ATOM 0 HG11 VAL A 29 -0.583 -18.835 17.170 1.00 4.51 H new ATOM 0 HG12 VAL A 29 -1.323 -20.351 16.601 1.00 4.51 H new ATOM 0 HG13 VAL A 29 -1.235 -18.942 15.517 1.00 4.51 H new ATOM 0 HG21 VAL A 29 -1.995 -16.869 17.673 1.00 23.24 H new ATOM 0 HG22 VAL A 29 -2.705 -16.897 16.042 1.00 23.24 H new ATOM 0 HG23 VAL A 29 -3.761 -16.957 17.473 1.00 23.24 H new ATOM 467 N LYS A 30 -4.215 -21.367 17.540 1.00 4.43 N ATOM 468 CA LYS A 30 -4.259 -22.797 17.819 1.00 21.14 C ATOM 469 C LYS A 30 -5.143 -23.521 16.809 1.00 32.44 C ATOM 470 O LYS A 30 -4.758 -24.552 16.257 1.00 65.21 O ATOM 471 CB LYS A 30 -4.778 -23.045 19.238 1.00 65.14 C ATOM 472 CG LYS A 30 -3.801 -22.629 20.324 1.00 64.41 C ATOM 473 CD LYS A 30 -3.105 -23.832 20.938 1.00 20.44 C ATOM 474 CE LYS A 30 -1.751 -23.456 21.520 1.00 22.20 C ATOM 475 NZ LYS A 30 -1.407 -24.287 22.707 1.00 0.12 N ATOM 0 H LYS A 30 -4.477 -20.776 18.329 1.00 4.43 H new ATOM 0 HA LYS A 30 -3.246 -23.190 17.736 1.00 21.14 H new ATOM 0 HB2 LYS A 30 -5.713 -22.501 19.374 1.00 65.14 H new ATOM 0 HB3 LYS A 30 -5.006 -24.105 19.353 1.00 65.14 H new ATOM 0 HG2 LYS A 30 -3.057 -21.951 19.905 1.00 64.41 H new ATOM 0 HG3 LYS A 30 -4.332 -22.079 21.101 1.00 64.41 H new ATOM 0 HD2 LYS A 30 -3.733 -24.257 21.721 1.00 20.44 H new ATOM 0 HD3 LYS A 30 -2.975 -24.604 20.180 1.00 20.44 H new ATOM 0 HE2 LYS A 30 -0.982 -23.576 20.757 1.00 22.20 H new ATOM 0 HE3 LYS A 30 -1.757 -22.403 21.803 1.00 22.20 H new ATOM 0 HZ1 LYS A 30 -0.477 -24.000 23.074 1.00 0.12 H new ATOM 0 HZ2 LYS A 30 -2.127 -24.153 23.445 1.00 0.12 H new ATOM 0 HZ3 LYS A 30 -1.376 -25.289 22.432 1.00 0.12 H new ATOM 489 N THR A 31 -6.332 -22.975 16.571 1.00 44.01 N ATOM 490 CA THR A 31 -7.270 -23.569 15.627 1.00 13.34 C ATOM 491 C THR A 31 -6.658 -23.675 14.236 1.00 43.15 C ATOM 492 O THR A 31 -6.481 -24.772 13.706 1.00 21.21 O ATOM 493 CB THR A 31 -8.573 -22.751 15.541 1.00 30.34 C ATOM 494 OG1 THR A 31 -9.349 -22.940 16.730 1.00 74.44 O ATOM 495 CG2 THR A 31 -9.390 -23.161 14.325 1.00 22.23 C ATOM 0 H THR A 31 -6.668 -22.122 17.019 1.00 44.01 H new ATOM 0 HA THR A 31 -7.500 -24.568 15.996 1.00 13.34 H new ATOM 0 HB THR A 31 -8.310 -21.698 15.443 1.00 30.34 H new ATOM 0 HG1 THR A 31 -9.059 -22.302 17.415 1.00 74.44 H new ATOM 0 HG21 THR A 31 -10.305 -22.570 14.285 1.00 22.23 H new ATOM 0 HG22 THR A 31 -8.807 -22.989 13.420 1.00 22.23 H new ATOM 0 HG23 THR A 31 -9.644 -24.219 14.397 1.00 22.23 H new ATOM 503 N VAL A 32 -6.334 -22.528 13.647 1.00 14.31 N ATOM 504 CA VAL A 32 -5.739 -22.492 12.317 1.00 73.05 C ATOM 505 C VAL A 32 -4.612 -23.511 12.191 1.00 2.43 C ATOM 506 O VAL A 32 -4.701 -24.457 11.410 1.00 21.43 O ATOM 507 CB VAL A 32 -5.191 -21.092 11.984 1.00 5.34 C ATOM 508 CG1 VAL A 32 -4.705 -21.036 10.544 1.00 60.10 C ATOM 509 CG2 VAL A 32 -6.250 -20.030 12.240 1.00 61.40 C ATOM 0 H VAL A 32 -6.474 -21.611 14.071 1.00 14.31 H new ATOM 0 HA VAL A 32 -6.530 -22.741 11.610 1.00 73.05 H new ATOM 0 HB VAL A 32 -4.341 -20.890 12.636 1.00 5.34 H new ATOM 0 HG11 VAL A 32 -4.322 -20.039 10.328 1.00 60.10 H new ATOM 0 HG12 VAL A 32 -3.912 -21.769 10.399 1.00 60.10 H new ATOM 0 HG13 VAL A 32 -5.533 -21.260 9.872 1.00 60.10 H new ATOM 0 HG21 VAL A 32 -5.845 -19.047 11.999 1.00 61.40 H new ATOM 0 HG22 VAL A 32 -7.121 -20.227 11.615 1.00 61.40 H new ATOM 0 HG23 VAL A 32 -6.544 -20.054 13.289 1.00 61.40 H new ATOM 519 N ALA A 33 -3.551 -23.309 12.967 1.00 74.43 N ATOM 520 CA ALA A 33 -2.407 -24.212 12.945 1.00 42.23 C ATOM 521 C ALA A 33 -2.825 -25.637 13.289 1.00 21.31 C ATOM 522 O ALA A 33 -2.126 -26.596 12.963 1.00 4.51 O ATOM 523 CB ALA A 33 -1.334 -23.727 13.909 1.00 40.15 C ATOM 0 H ALA A 33 -3.461 -22.529 13.618 1.00 74.43 H new ATOM 0 HA ALA A 33 -1.998 -24.216 11.935 1.00 42.23 H new ATOM 0 HB1 ALA A 33 -0.485 -24.411 13.883 1.00 40.15 H new ATOM 0 HB2 ALA A 33 -1.006 -22.730 13.616 1.00 40.15 H new ATOM 0 HB3 ALA A 33 -1.741 -23.693 14.920 1.00 40.15 H new ATOM 529 N GLY A 34 -3.970 -25.770 13.951 1.00 14.21 N ATOM 530 CA GLY A 34 -4.461 -27.082 14.329 1.00 31.14 C ATOM 531 C GLY A 34 -4.739 -27.965 13.129 1.00 24.42 C ATOM 532 O GLY A 34 -4.047 -28.960 12.909 1.00 13.11 O ATOM 0 H GLY A 34 -4.567 -24.992 14.232 1.00 14.21 H new ATOM 0 HA2 GLY A 34 -3.728 -27.569 14.973 1.00 31.14 H new ATOM 0 HA3 GLY A 34 -5.374 -26.970 14.913 1.00 31.14 H new ATOM 536 N TRP A 35 -5.753 -27.603 12.353 1.00 72.35 N ATOM 537 CA TRP A 35 -6.122 -28.372 11.169 1.00 44.11 C ATOM 538 C TRP A 35 -5.118 -28.152 10.043 1.00 43.53 C ATOM 539 O TRP A 35 -5.006 -28.971 9.130 1.00 42.40 O ATOM 540 CB TRP A 35 -7.525 -27.985 10.701 1.00 52.44 C ATOM 541 CG TRP A 35 -7.723 -26.504 10.578 1.00 32.01 C ATOM 542 CD1 TRP A 35 -8.109 -25.644 11.567 1.00 71.25 C ATOM 543 CD2 TRP A 35 -7.547 -25.710 9.400 1.00 63.54 C ATOM 544 NE1 TRP A 35 -8.183 -24.364 11.073 1.00 13.23 N ATOM 545 CE2 TRP A 35 -7.842 -24.378 9.747 1.00 51.43 C ATOM 546 CE3 TRP A 35 -7.166 -25.996 8.086 1.00 41.53 C ATOM 547 CZ2 TRP A 35 -7.769 -23.335 8.826 1.00 32.44 C ATOM 548 CZ3 TRP A 35 -7.094 -24.960 7.173 1.00 33.14 C ATOM 549 CH2 TRP A 35 -7.394 -23.643 7.547 1.00 61.20 C ATOM 0 H TRP A 35 -6.335 -26.782 12.521 1.00 72.35 H new ATOM 0 HA TRP A 35 -6.115 -29.429 11.436 1.00 44.11 H new ATOM 0 HB2 TRP A 35 -7.720 -28.452 9.735 1.00 52.44 H new ATOM 0 HB3 TRP A 35 -8.257 -28.385 11.402 1.00 52.44 H new ATOM 0 HD1 TRP A 35 -8.324 -25.928 12.586 1.00 71.25 H new ATOM 0 HE1 TRP A 35 -8.449 -23.537 11.608 1.00 13.23 H new ATOM 0 HE3 TRP A 35 -6.932 -27.008 7.789 1.00 41.53 H new ATOM 0 HZ2 TRP A 35 -8.000 -22.319 9.112 1.00 32.44 H new ATOM 0 HZ3 TRP A 35 -6.802 -25.169 6.155 1.00 33.14 H new ATOM 0 HH2 TRP A 35 -7.328 -22.856 6.811 1.00 61.20 H new ATOM 560 N ILE A 36 -4.390 -27.042 10.113 1.00 12.00 N ATOM 561 CA ILE A 36 -3.395 -26.716 9.099 1.00 22.22 C ATOM 562 C ILE A 36 -2.234 -27.704 9.131 1.00 61.40 C ATOM 563 O ILE A 36 -1.866 -28.279 8.106 1.00 11.40 O ATOM 564 CB ILE A 36 -2.845 -25.290 9.288 1.00 54.23 C ATOM 565 CG1 ILE A 36 -3.771 -24.271 8.620 1.00 14.25 C ATOM 566 CG2 ILE A 36 -1.438 -25.185 8.720 1.00 24.35 C ATOM 567 CD1 ILE A 36 -3.176 -22.883 8.528 1.00 71.34 C ATOM 0 H ILE A 36 -4.471 -26.354 10.861 1.00 12.00 H new ATOM 0 HA ILE A 36 -3.897 -26.779 8.133 1.00 22.22 H new ATOM 0 HB ILE A 36 -2.803 -25.071 10.355 1.00 54.23 H new ATOM 0 HG12 ILE A 36 -4.018 -24.619 7.617 1.00 14.25 H new ATOM 0 HG13 ILE A 36 -4.706 -24.221 9.179 1.00 14.25 H new ATOM 0 HG21 ILE A 36 -1.063 -24.171 8.861 1.00 24.35 H new ATOM 0 HG22 ILE A 36 -0.784 -25.889 9.235 1.00 24.35 H new ATOM 0 HG23 ILE A 36 -1.457 -25.420 7.656 1.00 24.35 H new ATOM 0 HD11 ILE A 36 -3.887 -22.214 8.044 1.00 71.34 H new ATOM 0 HD12 ILE A 36 -2.955 -22.515 9.530 1.00 71.34 H new ATOM 0 HD13 ILE A 36 -2.256 -22.919 7.944 1.00 71.34 H new ATOM 579 N ARG A 37 -1.662 -27.899 10.315 1.00 60.13 N ATOM 580 CA ARG A 37 -0.543 -28.819 10.481 1.00 41.35 C ATOM 581 C ARG A 37 -1.006 -30.267 10.353 1.00 70.01 C ATOM 582 O ARG A 37 -0.318 -31.099 9.763 1.00 71.34 O ATOM 583 CB ARG A 37 0.125 -28.603 11.840 1.00 34.41 C ATOM 584 CG ARG A 37 1.549 -29.129 11.909 1.00 2.21 C ATOM 585 CD ARG A 37 2.457 -28.407 10.926 1.00 4.10 C ATOM 586 NE ARG A 37 3.869 -28.686 11.178 1.00 74.20 N ATOM 587 CZ ARG A 37 4.459 -29.833 10.860 1.00 41.34 C ATOM 588 NH1 ARG A 37 3.764 -30.802 10.280 1.00 41.53 N ATOM 589 NH2 ARG A 37 5.748 -30.012 11.121 1.00 54.31 N ATOM 0 H ARG A 37 -1.955 -27.432 11.173 1.00 60.13 H new ATOM 0 HA ARG A 37 0.181 -28.617 9.692 1.00 41.35 H new ATOM 0 HB2 ARG A 37 0.129 -27.537 12.068 1.00 34.41 H new ATOM 0 HB3 ARG A 37 -0.472 -29.092 12.610 1.00 34.41 H new ATOM 0 HG2 ARG A 37 1.935 -29.006 12.921 1.00 2.21 H new ATOM 0 HG3 ARG A 37 1.554 -30.198 11.694 1.00 2.21 H new ATOM 0 HD2 ARG A 37 2.204 -28.709 9.910 1.00 4.10 H new ATOM 0 HD3 ARG A 37 2.282 -27.333 10.993 1.00 4.10 H new ATOM 0 HE ARG A 37 4.432 -27.961 11.622 1.00 74.20 H new ATOM 0 HH11 ARG A 37 2.773 -30.668 10.077 1.00 41.53 H new ATOM 0 HH12 ARG A 37 4.220 -31.681 10.037 1.00 41.53 H new ATOM 0 HH21 ARG A 37 6.286 -29.269 11.566 1.00 54.31 H new ATOM 0 HH22 ARG A 37 6.200 -30.893 10.877 1.00 54.31 H new ATOM 603 N ALA A 38 -2.176 -30.560 10.911 1.00 60.10 N ATOM 604 CA ALA A 38 -2.732 -31.907 10.858 1.00 5.34 C ATOM 605 C ALA A 38 -2.887 -32.380 9.417 1.00 34.33 C ATOM 606 O ALA A 38 -2.476 -33.488 9.069 1.00 50.10 O ATOM 607 CB ALA A 38 -4.071 -31.954 11.579 1.00 4.32 C ATOM 0 H ALA A 38 -2.757 -29.883 11.405 1.00 60.10 H new ATOM 0 HA ALA A 38 -2.038 -32.580 11.361 1.00 5.34 H new ATOM 0 HB1 ALA A 38 -4.475 -32.965 11.532 1.00 4.32 H new ATOM 0 HB2 ALA A 38 -3.933 -31.667 12.621 1.00 4.32 H new ATOM 0 HB3 ALA A 38 -4.766 -31.263 11.101 1.00 4.32 H new ATOM 613 N LEU A 39 -3.484 -31.536 8.583 1.00 11.13 N ATOM 614 CA LEU A 39 -3.695 -31.869 7.179 1.00 51.43 C ATOM 615 C LEU A 39 -2.369 -31.925 6.427 1.00 1.13 C ATOM 616 O LEU A 39 -2.043 -32.932 5.798 1.00 2.23 O ATOM 617 CB LEU A 39 -4.622 -30.842 6.525 1.00 63.13 C ATOM 618 CG LEU A 39 -6.050 -31.310 6.244 1.00 31.11 C ATOM 619 CD1 LEU A 39 -6.953 -31.008 7.430 1.00 74.14 C ATOM 620 CD2 LEU A 39 -6.588 -30.654 4.981 1.00 42.13 C ATOM 0 H LEU A 39 -3.831 -30.616 8.855 1.00 11.13 H new ATOM 0 HA LEU A 39 -4.161 -32.853 7.131 1.00 51.43 H new ATOM 0 HB2 LEU A 39 -4.669 -29.963 7.168 1.00 63.13 H new ATOM 0 HB3 LEU A 39 -4.173 -30.525 5.584 1.00 63.13 H new ATOM 0 HG LEU A 39 -6.035 -32.389 6.090 1.00 31.11 H new ATOM 0 HD11 LEU A 39 -7.965 -31.348 7.212 1.00 74.14 H new ATOM 0 HD12 LEU A 39 -6.579 -31.525 8.313 1.00 74.14 H new ATOM 0 HD13 LEU A 39 -6.963 -29.934 7.616 1.00 74.14 H new ATOM 0 HD21 LEU A 39 -7.605 -30.999 4.797 1.00 42.13 H new ATOM 0 HD22 LEU A 39 -6.589 -29.571 5.106 1.00 42.13 H new ATOM 0 HD23 LEU A 39 -5.955 -30.921 4.134 1.00 42.13 H new ATOM 632 N ARG A 40 -1.607 -30.838 6.499 1.00 34.11 N ATOM 633 CA ARG A 40 -0.316 -30.764 5.826 1.00 20.35 C ATOM 634 C ARG A 40 0.544 -31.979 6.165 1.00 55.20 C ATOM 635 O ARG A 40 1.113 -32.615 5.279 1.00 70.35 O ATOM 636 CB ARG A 40 0.417 -29.481 6.223 1.00 73.23 C ATOM 637 CG ARG A 40 1.321 -28.934 5.131 1.00 63.35 C ATOM 638 CD ARG A 40 0.520 -28.462 3.928 1.00 54.12 C ATOM 639 NE ARG A 40 1.161 -28.823 2.666 1.00 1.24 N ATOM 640 CZ ARG A 40 0.570 -28.708 1.482 1.00 2.12 C ATOM 641 NH1 ARG A 40 -0.669 -28.244 1.398 1.00 1.12 N ATOM 642 NH2 ARG A 40 1.219 -29.057 0.379 1.00 64.01 N ATOM 0 H ARG A 40 -1.862 -29.997 7.017 1.00 34.11 H new ATOM 0 HA ARG A 40 -0.495 -30.755 4.751 1.00 20.35 H new ATOM 0 HB2 ARG A 40 -0.317 -28.721 6.490 1.00 73.23 H new ATOM 0 HB3 ARG A 40 1.014 -29.674 7.114 1.00 73.23 H new ATOM 0 HG2 ARG A 40 1.909 -28.105 5.525 1.00 63.35 H new ATOM 0 HG3 ARG A 40 2.026 -29.705 4.820 1.00 63.35 H new ATOM 0 HD2 ARG A 40 -0.479 -28.897 3.964 1.00 54.12 H new ATOM 0 HD3 ARG A 40 0.398 -27.380 3.976 1.00 54.12 H new ATOM 0 HE ARG A 40 2.115 -29.183 2.696 1.00 1.24 H new ATOM 0 HH11 ARG A 40 -1.171 -27.974 2.244 1.00 1.12 H new ATOM 0 HH12 ARG A 40 -1.120 -28.157 0.487 1.00 1.12 H new ATOM 0 HH21 ARG A 40 2.173 -29.414 0.440 1.00 64.01 H new ATOM 0 HH22 ARG A 40 0.764 -28.968 -0.530 1.00 64.01 H new ATOM 656 N SER A 41 0.633 -32.294 7.453 1.00 13.33 N ATOM 657 CA SER A 41 1.426 -33.429 7.910 1.00 41.14 C ATOM 658 C SER A 41 0.869 -34.738 7.358 1.00 50.30 C ATOM 659 O SER A 41 1.621 -35.618 6.937 1.00 11.10 O ATOM 660 CB SER A 41 1.454 -33.477 9.438 1.00 33.34 C ATOM 661 OG SER A 41 2.332 -34.489 9.901 1.00 40.41 O ATOM 0 H SER A 41 0.165 -31.779 8.199 1.00 13.33 H new ATOM 0 HA SER A 41 2.443 -33.302 7.540 1.00 41.14 H new ATOM 0 HB2 SER A 41 1.770 -32.510 9.830 1.00 33.34 H new ATOM 0 HB3 SER A 41 0.449 -33.662 9.818 1.00 33.34 H new ATOM 0 HG SER A 41 2.333 -34.498 10.881 1.00 40.41 H new ATOM 667 N LEU A 42 -0.454 -34.859 7.363 1.00 21.05 N ATOM 668 CA LEU A 42 -1.114 -36.060 6.864 1.00 72.11 C ATOM 669 C LEU A 42 -0.847 -36.249 5.374 1.00 0.30 C ATOM 670 O LEU A 42 -0.547 -37.353 4.922 1.00 35.40 O ATOM 671 CB LEU A 42 -2.621 -35.981 7.117 1.00 4.25 C ATOM 672 CG LEU A 42 -3.125 -36.671 8.385 1.00 11.12 C ATOM 673 CD1 LEU A 42 -4.429 -36.043 8.852 1.00 51.10 C ATOM 674 CD2 LEU A 42 -3.306 -38.163 8.145 1.00 44.35 C ATOM 0 H LEU A 42 -1.091 -34.140 7.707 1.00 21.05 H new ATOM 0 HA LEU A 42 -0.706 -36.917 7.400 1.00 72.11 H new ATOM 0 HB2 LEU A 42 -2.907 -34.930 7.161 1.00 4.25 H new ATOM 0 HB3 LEU A 42 -3.136 -36.416 6.261 1.00 4.25 H new ATOM 0 HG LEU A 42 -2.379 -36.537 9.169 1.00 11.12 H new ATOM 0 HD11 LEU A 42 -4.772 -36.547 9.755 1.00 51.10 H new ATOM 0 HD12 LEU A 42 -4.268 -34.986 9.065 1.00 51.10 H new ATOM 0 HD13 LEU A 42 -5.182 -36.145 8.071 1.00 51.10 H new ATOM 0 HD21 LEU A 42 -3.665 -38.637 9.058 1.00 44.35 H new ATOM 0 HD22 LEU A 42 -4.031 -38.318 7.346 1.00 44.35 H new ATOM 0 HD23 LEU A 42 -2.351 -38.604 7.858 1.00 44.35 H new ATOM 686 N ALA A 43 -0.956 -35.162 4.617 1.00 65.15 N ATOM 687 CA ALA A 43 -0.721 -35.207 3.179 1.00 55.05 C ATOM 688 C ALA A 43 0.701 -35.661 2.868 1.00 73.14 C ATOM 689 O ALA A 43 0.915 -36.542 2.034 1.00 34.11 O ATOM 690 CB ALA A 43 -0.990 -33.844 2.557 1.00 31.24 C ATOM 0 H ALA A 43 -1.205 -34.240 4.975 1.00 65.15 H new ATOM 0 HA ALA A 43 -1.409 -35.934 2.747 1.00 55.05 H new ATOM 0 HB1 ALA A 43 -0.810 -33.892 1.483 1.00 31.24 H new ATOM 0 HB2 ALA A 43 -2.026 -33.559 2.739 1.00 31.24 H new ATOM 0 HB3 ALA A 43 -0.326 -33.103 3.003 1.00 31.24 H new ATOM 696 N THR A 44 1.672 -35.054 3.543 1.00 51.35 N ATOM 697 CA THR A 44 3.074 -35.394 3.337 1.00 71.31 C ATOM 698 C THR A 44 3.389 -36.781 3.886 1.00 3.35 C ATOM 699 O THR A 44 4.259 -37.483 3.369 1.00 53.22 O ATOM 700 CB THR A 44 4.006 -34.366 4.005 1.00 13.40 C ATOM 701 OG1 THR A 44 3.523 -34.046 5.315 1.00 43.43 O ATOM 702 CG2 THR A 44 4.099 -33.098 3.170 1.00 43.42 C ATOM 0 H THR A 44 1.513 -34.324 4.237 1.00 51.35 H new ATOM 0 HA THR A 44 3.247 -35.384 2.261 1.00 71.31 H new ATOM 0 HB THR A 44 5.000 -34.806 4.082 1.00 13.40 H new ATOM 0 HG1 THR A 44 2.766 -33.428 5.243 1.00 43.43 H new ATOM 0 HG21 THR A 44 4.763 -32.387 3.662 1.00 43.42 H new ATOM 0 HG22 THR A 44 4.494 -33.340 2.183 1.00 43.42 H new ATOM 0 HG23 THR A 44 3.108 -32.657 3.066 1.00 43.42 H new ATOM 710 N THR A 45 2.677 -37.171 4.939 1.00 71.42 N ATOM 711 CA THR A 45 2.881 -38.474 5.559 1.00 22.30 C ATOM 712 C THR A 45 2.369 -39.596 4.663 1.00 65.23 C ATOM 713 O THR A 45 2.873 -40.719 4.708 1.00 55.11 O ATOM 714 CB THR A 45 2.176 -38.563 6.926 1.00 43.42 C ATOM 715 OG1 THR A 45 2.822 -37.698 7.867 1.00 50.32 O ATOM 716 CG2 THR A 45 2.189 -39.991 7.450 1.00 3.41 C ATOM 0 H THR A 45 1.954 -36.603 5.380 1.00 71.42 H new ATOM 0 HA THR A 45 3.955 -38.589 5.704 1.00 22.30 H new ATOM 0 HB THR A 45 1.140 -38.250 6.797 1.00 43.42 H new ATOM 0 HG1 THR A 45 2.745 -36.769 7.564 1.00 50.32 H new ATOM 0 HG21 THR A 45 1.686 -40.029 8.416 1.00 3.41 H new ATOM 0 HG22 THR A 45 1.671 -40.642 6.745 1.00 3.41 H new ATOM 0 HG23 THR A 45 3.220 -40.327 7.564 1.00 3.41 H new ATOM 724 N VAL A 46 1.366 -39.285 3.848 1.00 65.54 N ATOM 725 CA VAL A 46 0.788 -40.268 2.939 1.00 53.43 C ATOM 726 C VAL A 46 1.249 -40.029 1.505 1.00 0.14 C ATOM 727 O VAL A 46 0.750 -40.654 0.571 1.00 75.25 O ATOM 728 CB VAL A 46 -0.752 -40.235 2.983 1.00 4.21 C ATOM 729 CG1 VAL A 46 -1.282 -39.020 2.236 1.00 23.41 C ATOM 730 CG2 VAL A 46 -1.328 -41.519 2.407 1.00 73.11 C ATOM 0 H VAL A 46 0.937 -38.361 3.799 1.00 65.54 H new ATOM 0 HA VAL A 46 1.134 -41.247 3.270 1.00 53.43 H new ATOM 0 HB VAL A 46 -1.067 -40.157 4.023 1.00 4.21 H new ATOM 0 HG11 VAL A 46 -2.371 -39.014 2.278 1.00 23.41 H new ATOM 0 HG12 VAL A 46 -0.896 -38.112 2.698 1.00 23.41 H new ATOM 0 HG13 VAL A 46 -0.959 -39.063 1.196 1.00 23.41 H new ATOM 0 HG21 VAL A 46 -2.417 -41.479 2.446 1.00 73.11 H new ATOM 0 HG22 VAL A 46 -1.006 -41.630 1.372 1.00 73.11 H new ATOM 0 HG23 VAL A 46 -0.975 -42.370 2.990 1.00 73.11 H new ATOM 740 N GLN A 47 2.205 -39.121 1.341 1.00 44.31 N ATOM 741 CA GLN A 47 2.734 -38.799 0.021 1.00 61.44 C ATOM 742 C GLN A 47 4.246 -38.994 -0.022 1.00 42.44 C ATOM 743 O GLN A 47 4.810 -39.326 -1.064 1.00 55.33 O ATOM 744 CB GLN A 47 2.382 -37.359 -0.356 1.00 60.34 C ATOM 745 CG GLN A 47 0.929 -37.175 -0.764 1.00 42.10 C ATOM 746 CD GLN A 47 0.754 -37.061 -2.266 1.00 4.14 C ATOM 747 OE1 GLN A 47 1.183 -37.934 -3.020 1.00 70.42 O ATOM 748 NE2 GLN A 47 0.122 -35.980 -2.708 1.00 33.42 N ATOM 0 H GLN A 47 2.629 -38.595 2.105 1.00 44.31 H new ATOM 0 HA GLN A 47 2.278 -39.477 -0.700 1.00 61.44 H new ATOM 0 HB2 GLN A 47 2.598 -36.707 0.491 1.00 60.34 H new ATOM 0 HB3 GLN A 47 3.024 -37.040 -1.177 1.00 60.34 H new ATOM 0 HG2 GLN A 47 0.343 -38.018 -0.397 1.00 42.10 H new ATOM 0 HG3 GLN A 47 0.532 -36.279 -0.287 1.00 42.10 H new ATOM 0 HE21 GLN A 47 -0.217 -35.281 -2.047 1.00 33.42 H new ATOM 0 HE22 GLN A 47 -0.024 -35.848 -3.709 1.00 33.42 H new ATOM 757 N ASN A 48 4.897 -38.784 1.117 1.00 4.41 N ATOM 758 CA ASN A 48 6.345 -38.935 1.209 1.00 0.21 C ATOM 759 C ASN A 48 6.712 -40.224 1.938 1.00 41.12 C ATOM 760 O ASN A 48 7.791 -40.333 2.520 1.00 73.31 O ATOM 761 CB ASN A 48 6.959 -37.734 1.932 1.00 21.42 C ATOM 762 CG ASN A 48 6.284 -36.428 1.561 1.00 70.34 C ATOM 763 OD1 ASN A 48 6.171 -35.519 2.383 1.00 32.21 O ATOM 764 ND2 ASN A 48 5.831 -36.330 0.316 1.00 2.42 N ATOM 0 H ASN A 48 4.445 -38.509 1.989 1.00 4.41 H new ATOM 0 HA ASN A 48 6.745 -38.985 0.196 1.00 0.21 H new ATOM 0 HB2 ASN A 48 6.885 -37.885 3.009 1.00 21.42 H new ATOM 0 HB3 ASN A 48 8.020 -37.672 1.691 1.00 21.42 H new ATOM 0 HD21 ASN A 48 5.367 -35.475 0.008 1.00 2.42 H new ATOM 0 HD22 ASN A 48 5.947 -37.109 -0.332 1.00 2.42 H new ATOM 771 N GLU A 49 5.807 -41.197 1.900 1.00 1.01 N ATOM 772 CA GLU A 49 6.036 -42.478 2.557 1.00 23.32 C ATOM 773 C GLU A 49 5.541 -43.631 1.689 1.00 32.41 C ATOM 774 O GLU A 49 6.182 -44.003 0.705 1.00 52.41 O ATOM 775 CB GLU A 49 5.336 -42.512 3.917 1.00 12.21 C ATOM 776 CG GLU A 49 5.938 -41.559 4.936 1.00 42.33 C ATOM 777 CD GLU A 49 7.003 -42.216 5.792 1.00 62.54 C ATOM 778 OE1 GLU A 49 7.722 -43.096 5.273 1.00 2.12 O ATOM 779 OE2 GLU A 49 7.117 -41.851 6.980 1.00 3.14 O ATOM 0 H GLU A 49 4.909 -41.122 1.422 1.00 1.01 H new ATOM 0 HA GLU A 49 7.110 -42.593 2.706 1.00 23.32 H new ATOM 0 HB2 GLU A 49 4.283 -42.266 3.780 1.00 12.21 H new ATOM 0 HB3 GLU A 49 5.378 -43.527 4.312 1.00 12.21 H new ATOM 0 HG2 GLU A 49 6.371 -40.704 4.417 1.00 42.33 H new ATOM 0 HG3 GLU A 49 5.147 -41.174 5.579 1.00 42.33 H new ATOM 786 N LEU A 50 4.396 -44.194 2.061 1.00 64.34 N ATOM 787 CA LEU A 50 3.814 -45.306 1.317 1.00 14.11 C ATOM 788 C LEU A 50 3.604 -44.932 -0.147 1.00 2.43 C ATOM 789 O LEU A 50 3.638 -45.789 -1.030 1.00 24.42 O ATOM 790 CB LEU A 50 2.482 -45.722 1.944 1.00 21.53 C ATOM 791 CG LEU A 50 2.382 -45.579 3.463 1.00 33.13 C ATOM 792 CD1 LEU A 50 3.692 -45.976 4.125 1.00 45.33 C ATOM 793 CD2 LEU A 50 2.001 -44.155 3.841 1.00 44.34 C ATOM 0 H LEU A 50 3.853 -43.899 2.872 1.00 64.34 H new ATOM 0 HA LEU A 50 4.509 -46.145 1.362 1.00 14.11 H new ATOM 0 HB2 LEU A 50 1.688 -45.128 1.490 1.00 21.53 H new ATOM 0 HB3 LEU A 50 2.290 -46.763 1.684 1.00 21.53 H new ATOM 0 HG LEU A 50 1.601 -46.250 3.821 1.00 33.13 H new ATOM 0 HD11 LEU A 50 3.601 -45.868 5.206 1.00 45.33 H new ATOM 0 HD12 LEU A 50 3.922 -47.013 3.883 1.00 45.33 H new ATOM 0 HD13 LEU A 50 4.493 -45.332 3.762 1.00 45.33 H new ATOM 0 HD21 LEU A 50 1.934 -44.072 4.926 1.00 44.34 H new ATOM 0 HD22 LEU A 50 2.759 -43.465 3.470 1.00 44.34 H new ATOM 0 HD23 LEU A 50 1.036 -43.907 3.398 1.00 44.34 H new ATOM 805 N THR A 51 3.389 -43.644 -0.398 1.00 42.12 N ATOM 806 CA THR A 51 3.176 -43.155 -1.755 1.00 34.45 C ATOM 807 C THR A 51 4.263 -43.658 -2.698 1.00 12.35 C ATOM 808 O THR A 51 4.073 -43.697 -3.913 1.00 13.23 O ATOM 809 CB THR A 51 3.145 -41.616 -1.799 1.00 15.03 C ATOM 810 OG1 THR A 51 1.789 -41.153 -1.799 1.00 65.12 O ATOM 811 CG2 THR A 51 3.864 -41.095 -3.034 1.00 20.51 C ATOM 0 H THR A 51 3.358 -42.921 0.321 1.00 42.12 H new ATOM 0 HA THR A 51 2.210 -43.540 -2.081 1.00 34.45 H new ATOM 0 HB THR A 51 3.657 -41.239 -0.914 1.00 15.03 H new ATOM 0 HG1 THR A 51 1.383 -41.329 -0.925 1.00 65.12 H new ATOM 0 HG21 THR A 51 3.829 -40.006 -3.043 1.00 20.51 H new ATOM 0 HG22 THR A 51 4.903 -41.424 -3.016 1.00 20.51 H new ATOM 0 HG23 THR A 51 3.376 -41.481 -3.929 1.00 20.51 H new ATOM 819 N GLN A 52 5.402 -44.041 -2.129 1.00 75.34 N ATOM 820 CA GLN A 52 6.519 -44.541 -2.921 1.00 61.42 C ATOM 821 C GLN A 52 6.972 -45.909 -2.421 1.00 74.30 C ATOM 822 O GLN A 52 8.139 -46.274 -2.556 1.00 20.23 O ATOM 823 CB GLN A 52 7.688 -43.555 -2.873 1.00 35.43 C ATOM 824 CG GLN A 52 8.678 -43.840 -1.756 1.00 23.44 C ATOM 825 CD GLN A 52 8.990 -42.612 -0.925 1.00 4.53 C ATOM 826 OE1 GLN A 52 10.128 -42.142 -0.893 1.00 3.00 O ATOM 827 NE2 GLN A 52 7.979 -42.083 -0.246 1.00 51.20 N ATOM 0 H GLN A 52 5.575 -44.015 -1.124 1.00 75.34 H new ATOM 0 HA GLN A 52 6.182 -44.645 -3.952 1.00 61.42 H new ATOM 0 HB2 GLN A 52 8.213 -43.580 -3.828 1.00 35.43 H new ATOM 0 HB3 GLN A 52 7.296 -42.545 -2.751 1.00 35.43 H new ATOM 0 HG2 GLN A 52 8.275 -44.619 -1.109 1.00 23.44 H new ATOM 0 HG3 GLN A 52 9.602 -44.228 -2.185 1.00 23.44 H new ATOM 0 HE21 GLN A 52 7.052 -42.504 -0.301 1.00 51.20 H new ATOM 0 HE22 GLN A 52 8.130 -41.255 0.330 1.00 51.20 H new ATOM 836 N GLU A 53 6.040 -46.661 -1.843 1.00 54.23 N ATOM 837 CA GLU A 53 6.344 -47.988 -1.322 1.00 64.10 C ATOM 838 C GLU A 53 5.116 -48.891 -1.382 1.00 32.34 C ATOM 839 O GLU A 53 5.205 -50.056 -1.773 1.00 45.33 O ATOM 840 CB GLU A 53 6.850 -47.891 0.119 1.00 50.31 C ATOM 841 CG GLU A 53 7.146 -49.240 0.753 1.00 51.35 C ATOM 842 CD GLU A 53 8.378 -49.902 0.167 1.00 52.24 C ATOM 843 OE1 GLU A 53 9.500 -49.459 0.489 1.00 30.40 O ATOM 844 OE2 GLU A 53 8.219 -50.863 -0.615 1.00 32.23 O ATOM 0 H GLU A 53 5.069 -46.373 -1.724 1.00 54.23 H new ATOM 0 HA GLU A 53 7.125 -48.424 -1.945 1.00 64.10 H new ATOM 0 HB2 GLU A 53 7.755 -47.284 0.137 1.00 50.31 H new ATOM 0 HB3 GLU A 53 6.106 -47.371 0.722 1.00 50.31 H new ATOM 0 HG2 GLU A 53 7.284 -49.110 1.826 1.00 51.35 H new ATOM 0 HG3 GLU A 53 6.287 -49.897 0.619 1.00 51.35 H new ATOM 851 N LEU A 54 3.969 -48.347 -0.990 1.00 2.22 N ATOM 852 CA LEU A 54 2.721 -49.102 -0.998 1.00 23.44 C ATOM 853 C LEU A 54 1.584 -48.269 -1.580 1.00 31.25 C ATOM 854 O LEU A 54 0.766 -48.769 -2.353 1.00 1.33 O ATOM 855 CB LEU A 54 2.366 -49.552 0.421 1.00 74.15 C ATOM 856 CG LEU A 54 0.972 -50.153 0.604 1.00 33.32 C ATOM 857 CD1 LEU A 54 -0.070 -49.054 0.745 1.00 44.22 C ATOM 858 CD2 LEU A 54 0.628 -51.070 -0.561 1.00 43.31 C ATOM 0 H LEU A 54 3.878 -47.385 -0.662 1.00 2.22 H new ATOM 0 HA LEU A 54 2.860 -49.981 -1.627 1.00 23.44 H new ATOM 0 HB2 LEU A 54 3.103 -50.288 0.742 1.00 74.15 H new ATOM 0 HB3 LEU A 54 2.461 -48.695 1.087 1.00 74.15 H new ATOM 0 HG LEU A 54 0.971 -50.745 1.519 1.00 33.32 H new ATOM 0 HD11 LEU A 54 -1.055 -49.501 0.874 1.00 44.22 H new ATOM 0 HD12 LEU A 54 0.166 -48.438 1.613 1.00 44.22 H new ATOM 0 HD13 LEU A 54 -0.068 -48.434 -0.151 1.00 44.22 H new ATOM 0 HD21 LEU A 54 -0.368 -51.488 -0.413 1.00 43.31 H new ATOM 0 HD22 LEU A 54 0.648 -50.501 -1.490 1.00 43.31 H new ATOM 0 HD23 LEU A 54 1.357 -51.879 -0.615 1.00 43.31 H new ATOM 870 N LYS A 55 1.539 -46.995 -1.205 1.00 32.34 N ATOM 871 CA LYS A 55 0.504 -46.090 -1.691 1.00 63.21 C ATOM 872 C LYS A 55 0.915 -45.457 -3.017 1.00 33.41 C ATOM 873 O LYS A 55 0.482 -44.353 -3.350 1.00 23.04 O ATOM 874 CB LYS A 55 0.226 -44.997 -0.657 1.00 23.34 C ATOM 875 CG LYS A 55 -0.710 -43.911 -1.156 1.00 42.45 C ATOM 876 CD LYS A 55 -1.659 -43.447 -0.065 1.00 14.14 C ATOM 877 CE LYS A 55 -2.988 -44.185 -0.131 1.00 24.15 C ATOM 878 NZ LYS A 55 -3.441 -44.632 1.216 1.00 61.44 N ATOM 0 H LYS A 55 2.208 -46.566 -0.566 1.00 32.34 H new ATOM 0 HA LYS A 55 -0.405 -46.670 -1.851 1.00 63.21 H new ATOM 0 HB2 LYS A 55 -0.203 -45.453 0.235 1.00 23.34 H new ATOM 0 HB3 LYS A 55 1.171 -44.542 -0.359 1.00 23.34 H new ATOM 0 HG2 LYS A 55 -0.126 -43.064 -1.516 1.00 42.45 H new ATOM 0 HG3 LYS A 55 -1.284 -44.286 -2.003 1.00 42.45 H new ATOM 0 HD2 LYS A 55 -1.200 -43.608 0.911 1.00 14.14 H new ATOM 0 HD3 LYS A 55 -1.832 -42.375 -0.163 1.00 14.14 H new ATOM 0 HE2 LYS A 55 -3.744 -43.534 -0.571 1.00 24.15 H new ATOM 0 HE3 LYS A 55 -2.891 -45.050 -0.787 1.00 24.15 H new ATOM 0 HZ1 LYS A 55 -4.350 -45.131 1.129 1.00 61.44 H new ATOM 0 HZ2 LYS A 55 -2.732 -45.273 1.626 1.00 61.44 H new ATOM 0 HZ3 LYS A 55 -3.558 -43.805 1.835 1.00 61.44 H new ATOM 892 N LEU A 56 1.750 -46.164 -3.771 1.00 11.32 N ATOM 893 CA LEU A 56 2.217 -45.672 -5.062 1.00 45.51 C ATOM 894 C LEU A 56 1.199 -45.966 -6.158 1.00 55.53 C ATOM 895 O LEU A 56 1.436 -45.680 -7.332 1.00 11.35 O ATOM 896 CB LEU A 56 3.562 -46.308 -5.416 1.00 65.30 C ATOM 897 CG LEU A 56 3.760 -47.755 -4.963 1.00 22.24 C ATOM 898 CD1 LEU A 56 2.498 -48.568 -5.205 1.00 51.23 C ATOM 899 CD2 LEU A 56 4.946 -48.382 -5.681 1.00 5.23 C ATOM 0 H LEU A 56 2.117 -47.079 -3.510 1.00 11.32 H new ATOM 0 HA LEU A 56 2.341 -44.592 -4.988 1.00 45.51 H new ATOM 0 HB2 LEU A 56 3.687 -46.267 -6.498 1.00 65.30 H new ATOM 0 HB3 LEU A 56 4.355 -45.700 -4.980 1.00 65.30 H new ATOM 0 HG LEU A 56 3.968 -47.754 -3.893 1.00 22.24 H new ATOM 0 HD11 LEU A 56 2.658 -49.595 -4.876 1.00 51.23 H new ATOM 0 HD12 LEU A 56 1.671 -48.132 -4.644 1.00 51.23 H new ATOM 0 HD13 LEU A 56 2.259 -48.560 -6.268 1.00 51.23 H new ATOM 0 HD21 LEU A 56 5.071 -49.412 -5.346 1.00 5.23 H new ATOM 0 HD22 LEU A 56 4.768 -48.370 -6.756 1.00 5.23 H new ATOM 0 HD23 LEU A 56 5.849 -47.815 -5.456 1.00 5.23 H new ATOM 911 N GLN A 57 0.064 -46.536 -5.767 1.00 13.12 N ATOM 912 CA GLN A 57 -0.992 -46.867 -6.717 1.00 1.33 C ATOM 913 C GLN A 57 -2.270 -46.098 -6.400 1.00 12.33 C ATOM 914 O GLN A 57 -2.869 -45.482 -7.281 1.00 34.23 O ATOM 915 CB GLN A 57 -1.270 -48.371 -6.699 1.00 42.21 C ATOM 916 CG GLN A 57 -1.124 -49.032 -8.060 1.00 74.41 C ATOM 917 CD GLN A 57 0.267 -49.587 -8.294 1.00 32.45 C ATOM 918 OE1 GLN A 57 0.427 -50.712 -8.768 1.00 65.22 O ATOM 919 NE2 GLN A 57 1.282 -48.799 -7.961 1.00 24.34 N ATOM 0 H GLN A 57 -0.148 -46.778 -4.799 1.00 13.12 H new ATOM 0 HA GLN A 57 -0.654 -46.579 -7.712 1.00 1.33 H new ATOM 0 HB2 GLN A 57 -0.588 -48.850 -5.997 1.00 42.21 H new ATOM 0 HB3 GLN A 57 -2.281 -48.541 -6.328 1.00 42.21 H new ATOM 0 HG2 GLN A 57 -1.852 -49.838 -8.148 1.00 74.41 H new ATOM 0 HG3 GLN A 57 -1.357 -48.306 -8.839 1.00 74.41 H new ATOM 0 HE21 GLN A 57 1.103 -47.874 -7.571 1.00 24.34 H new ATOM 0 HE22 GLN A 57 2.241 -49.119 -8.095 1.00 24.34 H new ATOM 928 N GLU A 58 -2.682 -46.138 -5.136 1.00 64.42 N ATOM 929 CA GLU A 58 -3.890 -45.446 -4.704 1.00 40.23 C ATOM 930 C GLU A 58 -3.970 -44.054 -5.324 1.00 52.34 C ATOM 931 O GLU A 58 -4.962 -43.703 -5.963 1.00 55.22 O ATOM 932 CB GLU A 58 -3.926 -45.339 -3.178 1.00 64.24 C ATOM 933 CG GLU A 58 -5.329 -45.207 -2.610 1.00 64.21 C ATOM 934 CD GLU A 58 -5.698 -43.771 -2.295 1.00 43.42 C ATOM 935 OE1 GLU A 58 -5.571 -42.914 -3.195 1.00 12.02 O ATOM 936 OE2 GLU A 58 -6.114 -43.503 -1.148 1.00 64.32 O ATOM 0 H GLU A 58 -2.197 -46.642 -4.394 1.00 64.42 H new ATOM 0 HA GLU A 58 -4.750 -46.025 -5.040 1.00 40.23 H new ATOM 0 HB2 GLU A 58 -3.451 -46.221 -2.749 1.00 64.24 H new ATOM 0 HB3 GLU A 58 -3.335 -44.477 -2.869 1.00 64.24 H new ATOM 0 HG2 GLU A 58 -6.046 -45.614 -3.323 1.00 64.21 H new ATOM 0 HG3 GLU A 58 -5.407 -45.806 -1.703 1.00 64.21 H new ATOM 943 N PHE A 59 -2.919 -43.265 -5.131 1.00 3.44 N ATOM 944 CA PHE A 59 -2.870 -41.910 -5.669 1.00 23.22 C ATOM 945 C PHE A 59 -3.055 -41.920 -7.183 1.00 50.24 C ATOM 946 O PHE A 59 -3.867 -41.170 -7.724 1.00 11.52 O ATOM 947 CB PHE A 59 -1.540 -41.244 -5.311 1.00 23.14 C ATOM 948 CG PHE A 59 -1.610 -40.390 -4.077 1.00 60.10 C ATOM 949 CD1 PHE A 59 -1.359 -40.933 -2.827 1.00 71.22 C ATOM 950 CD2 PHE A 59 -1.926 -39.044 -4.167 1.00 73.22 C ATOM 951 CE1 PHE A 59 -1.424 -40.150 -1.691 1.00 10.34 C ATOM 952 CE2 PHE A 59 -1.992 -38.256 -3.034 1.00 12.50 C ATOM 953 CZ PHE A 59 -1.740 -38.809 -1.794 1.00 63.01 C ATOM 0 H PHE A 59 -2.089 -43.540 -4.606 1.00 3.44 H new ATOM 0 HA PHE A 59 -3.685 -41.339 -5.224 1.00 23.22 H new ATOM 0 HB2 PHE A 59 -0.784 -42.016 -5.167 1.00 23.14 H new ATOM 0 HB3 PHE A 59 -1.213 -40.630 -6.150 1.00 23.14 H new ATOM 0 HD1 PHE A 59 -1.110 -41.980 -2.740 1.00 71.22 H new ATOM 0 HD2 PHE A 59 -2.123 -38.606 -5.134 1.00 73.22 H new ATOM 0 HE1 PHE A 59 -1.228 -40.586 -0.723 1.00 10.34 H new ATOM 0 HE2 PHE A 59 -2.240 -37.208 -3.118 1.00 12.50 H new ATOM 0 HZ PHE A 59 -1.790 -38.195 -0.907 1.00 63.01 H new ATOM 963 N GLN A 60 -2.295 -42.774 -7.861 1.00 75.40 N ATOM 964 CA GLN A 60 -2.375 -42.881 -9.313 1.00 41.21 C ATOM 965 C GLN A 60 -3.807 -43.153 -9.761 1.00 61.35 C ATOM 966 O GLN A 60 -4.310 -42.515 -10.686 1.00 72.33 O ATOM 967 CB GLN A 60 -1.451 -43.991 -9.815 1.00 65.35 C ATOM 968 CG GLN A 60 -0.470 -43.531 -10.881 1.00 44.55 C ATOM 969 CD GLN A 60 0.558 -44.590 -11.226 1.00 22.30 C ATOM 970 OE1 GLN A 60 0.218 -45.753 -11.447 1.00 51.24 O ATOM 971 NE2 GLN A 60 1.825 -44.194 -11.273 1.00 54.14 N ATOM 0 H GLN A 60 -1.617 -43.402 -7.428 1.00 75.40 H new ATOM 0 HA GLN A 60 -2.055 -41.931 -9.740 1.00 41.21 H new ATOM 0 HB2 GLN A 60 -0.893 -44.397 -8.971 1.00 65.35 H new ATOM 0 HB3 GLN A 60 -2.057 -44.803 -10.217 1.00 65.35 H new ATOM 0 HG2 GLN A 60 -1.020 -43.257 -11.781 1.00 44.55 H new ATOM 0 HG3 GLN A 60 0.042 -42.633 -10.535 1.00 44.55 H new ATOM 0 HE21 GLN A 60 2.062 -43.220 -11.083 1.00 54.14 H new ATOM 0 HE22 GLN A 60 2.561 -44.864 -11.499 1.00 54.14 H new ATOM 980 N ASP A 61 -4.457 -44.104 -9.101 1.00 35.54 N ATOM 981 CA ASP A 61 -5.832 -44.461 -9.431 1.00 34.23 C ATOM 982 C ASP A 61 -6.779 -43.301 -9.141 1.00 14.21 C ATOM 983 O ASP A 61 -7.772 -43.107 -9.843 1.00 1.44 O ATOM 984 CB ASP A 61 -6.265 -45.698 -8.641 1.00 44.22 C ATOM 985 CG ASP A 61 -7.600 -46.245 -9.107 1.00 45.21 C ATOM 986 OD1 ASP A 61 -8.632 -45.590 -8.850 1.00 43.14 O ATOM 987 OD2 ASP A 61 -7.612 -47.327 -9.729 1.00 71.33 O ATOM 0 H ASP A 61 -4.054 -44.642 -8.334 1.00 35.54 H new ATOM 0 HA ASP A 61 -5.877 -44.686 -10.497 1.00 34.23 H new ATOM 0 HB2 ASP A 61 -5.504 -46.473 -8.739 1.00 44.22 H new ATOM 0 HB3 ASP A 61 -6.329 -45.446 -7.583 1.00 44.22 H new ATOM 992 N SER A 62 -6.466 -42.533 -8.102 1.00 70.21 N ATOM 993 CA SER A 62 -7.292 -41.395 -7.716 1.00 44.22 C ATOM 994 C SER A 62 -7.295 -40.331 -8.810 1.00 13.12 C ATOM 995 O SER A 62 -8.338 -40.020 -9.386 1.00 55.31 O ATOM 996 CB SER A 62 -6.785 -40.792 -6.404 1.00 74.03 C ATOM 997 OG SER A 62 -7.449 -41.364 -5.291 1.00 15.23 O ATOM 0 H SER A 62 -5.646 -42.678 -7.513 1.00 70.21 H new ATOM 0 HA SER A 62 -8.313 -41.749 -7.574 1.00 44.22 H new ATOM 0 HB2 SER A 62 -5.711 -40.957 -6.315 1.00 74.03 H new ATOM 0 HB3 SER A 62 -6.942 -39.713 -6.411 1.00 74.03 H new ATOM 0 HG SER A 62 -6.795 -41.813 -4.715 1.00 15.23 H new ATOM 1003 N LEU A 63 -6.121 -39.776 -9.091 1.00 33.34 N ATOM 1004 CA LEU A 63 -5.987 -38.747 -10.115 1.00 50.42 C ATOM 1005 C LEU A 63 -6.448 -39.266 -11.473 1.00 72.31 C ATOM 1006 O LEU A 63 -6.999 -38.519 -12.282 1.00 31.02 O ATOM 1007 CB LEU A 63 -4.535 -38.274 -10.204 1.00 10.43 C ATOM 1008 CG LEU A 63 -3.886 -37.848 -8.886 1.00 55.51 C ATOM 1009 CD1 LEU A 63 -2.525 -37.219 -9.140 1.00 53.41 C ATOM 1010 CD2 LEU A 63 -4.791 -36.881 -8.135 1.00 24.45 C ATOM 0 H LEU A 63 -5.248 -40.022 -8.624 1.00 33.34 H new ATOM 0 HA LEU A 63 -6.621 -37.906 -9.834 1.00 50.42 H new ATOM 0 HB2 LEU A 63 -3.938 -39.077 -10.637 1.00 10.43 H new ATOM 0 HB3 LEU A 63 -4.489 -37.434 -10.897 1.00 10.43 H new ATOM 0 HG LEU A 63 -3.744 -38.735 -8.269 1.00 55.51 H new ATOM 0 HD11 LEU A 63 -2.079 -36.922 -8.191 1.00 53.41 H new ATOM 0 HD12 LEU A 63 -1.877 -37.942 -9.636 1.00 53.41 H new ATOM 0 HD13 LEU A 63 -2.643 -36.341 -9.776 1.00 53.41 H new ATOM 0 HD21 LEU A 63 -4.314 -36.588 -7.200 1.00 24.45 H new ATOM 0 HD22 LEU A 63 -4.965 -35.996 -8.747 1.00 24.45 H new ATOM 0 HD23 LEU A 63 -5.743 -37.366 -7.920 1.00 24.45 H new ATOM 1022 N LYS A 64 -6.221 -40.553 -11.717 1.00 12.43 N ATOM 1023 CA LYS A 64 -6.616 -41.175 -12.975 1.00 0.22 C ATOM 1024 C LYS A 64 -8.134 -41.296 -13.069 1.00 65.22 C ATOM 1025 O LYS A 64 -8.726 -41.015 -14.111 1.00 62.34 O ATOM 1026 CB LYS A 64 -5.974 -42.558 -13.107 1.00 41.32 C ATOM 1027 CG LYS A 64 -6.240 -43.226 -14.445 1.00 24.21 C ATOM 1028 CD LYS A 64 -6.703 -44.663 -14.268 1.00 43.53 C ATOM 1029 CE LYS A 64 -8.189 -44.809 -14.559 1.00 5.21 C ATOM 1030 NZ LYS A 64 -8.436 -45.567 -15.817 1.00 3.42 N ATOM 0 H LYS A 64 -5.765 -41.185 -11.059 1.00 12.43 H new ATOM 0 HA LYS A 64 -6.269 -40.541 -13.790 1.00 0.22 H new ATOM 0 HB2 LYS A 64 -4.897 -42.465 -12.964 1.00 41.32 H new ATOM 0 HB3 LYS A 64 -6.347 -43.200 -12.309 1.00 41.32 H new ATOM 0 HG2 LYS A 64 -6.998 -42.663 -14.990 1.00 24.21 H new ATOM 0 HG3 LYS A 64 -5.333 -43.207 -15.049 1.00 24.21 H new ATOM 0 HD2 LYS A 64 -6.135 -45.314 -14.933 1.00 43.53 H new ATOM 0 HD3 LYS A 64 -6.497 -44.990 -13.249 1.00 43.53 H new ATOM 0 HE2 LYS A 64 -8.674 -45.319 -13.727 1.00 5.21 H new ATOM 0 HE3 LYS A 64 -8.643 -43.821 -14.635 1.00 5.21 H new ATOM 0 HZ1 LYS A 64 -9.460 -45.645 -15.980 1.00 3.42 H new ATOM 0 HZ2 LYS A 64 -7.995 -45.067 -16.616 1.00 3.42 H new ATOM 0 HZ3 LYS A 64 -8.025 -46.519 -15.735 1.00 3.42 H new ATOM 1044 N LYS A 65 -8.758 -41.715 -11.974 1.00 32.11 N ATOM 1045 CA LYS A 65 -10.207 -41.871 -11.931 1.00 73.23 C ATOM 1046 C LYS A 65 -10.906 -40.538 -12.181 1.00 23.32 C ATOM 1047 O LYS A 65 -11.804 -40.444 -13.017 1.00 14.22 O ATOM 1048 CB LYS A 65 -10.640 -42.440 -10.578 1.00 70.32 C ATOM 1049 CG LYS A 65 -12.083 -42.913 -10.550 1.00 53.45 C ATOM 1050 CD LYS A 65 -12.304 -44.088 -11.488 1.00 25.01 C ATOM 1051 CE LYS A 65 -12.866 -43.635 -12.827 1.00 21.42 C ATOM 1052 NZ LYS A 65 -14.328 -43.900 -12.932 1.00 44.33 N ATOM 0 H LYS A 65 -8.283 -41.953 -11.103 1.00 32.11 H new ATOM 0 HA LYS A 65 -10.496 -42.566 -12.720 1.00 73.23 H new ATOM 0 HB2 LYS A 65 -9.988 -43.274 -10.319 1.00 70.32 H new ATOM 0 HB3 LYS A 65 -10.502 -41.677 -9.812 1.00 70.32 H new ATOM 0 HG2 LYS A 65 -12.352 -43.202 -9.534 1.00 53.45 H new ATOM 0 HG3 LYS A 65 -12.741 -42.092 -10.833 1.00 53.45 H new ATOM 0 HD2 LYS A 65 -11.361 -44.611 -11.646 1.00 25.01 H new ATOM 0 HD3 LYS A 65 -12.989 -44.799 -11.027 1.00 25.01 H new ATOM 0 HE2 LYS A 65 -12.680 -42.569 -12.957 1.00 21.42 H new ATOM 0 HE3 LYS A 65 -12.344 -44.151 -13.633 1.00 21.42 H new ATOM 0 HZ1 LYS A 65 -14.674 -43.577 -13.858 1.00 44.33 H new ATOM 0 HZ2 LYS A 65 -14.504 -44.920 -12.833 1.00 44.33 H new ATOM 0 HZ3 LYS A 65 -14.829 -43.388 -12.178 1.00 44.33 H new ATOM 1066 N VAL A 66 -10.486 -39.509 -11.451 1.00 64.53 N ATOM 1067 CA VAL A 66 -11.069 -38.181 -11.596 1.00 30.13 C ATOM 1068 C VAL A 66 -10.846 -37.633 -13.001 1.00 11.35 C ATOM 1069 O VAL A 66 -11.757 -37.073 -13.610 1.00 61.53 O ATOM 1070 CB VAL A 66 -10.478 -37.194 -10.571 1.00 60.24 C ATOM 1071 CG1 VAL A 66 -8.962 -37.154 -10.682 1.00 45.54 C ATOM 1072 CG2 VAL A 66 -11.072 -35.807 -10.764 1.00 73.33 C ATOM 0 H VAL A 66 -9.744 -39.570 -10.754 1.00 64.53 H new ATOM 0 HA VAL A 66 -12.139 -38.283 -11.415 1.00 30.13 H new ATOM 0 HB VAL A 66 -10.736 -37.538 -9.570 1.00 60.24 H new ATOM 0 HG11 VAL A 66 -8.562 -36.452 -9.951 1.00 45.54 H new ATOM 0 HG12 VAL A 66 -8.557 -38.148 -10.490 1.00 45.54 H new ATOM 0 HG13 VAL A 66 -8.679 -36.834 -11.685 1.00 45.54 H new ATOM 0 HG21 VAL A 66 -10.644 -35.123 -10.032 1.00 73.33 H new ATOM 0 HG22 VAL A 66 -10.846 -35.451 -11.769 1.00 73.33 H new ATOM 0 HG23 VAL A 66 -12.153 -35.852 -10.630 1.00 73.33 H new ATOM 1082 N GLU A 67 -9.629 -37.798 -13.508 1.00 45.41 N ATOM 1083 CA GLU A 67 -9.286 -37.318 -14.842 1.00 74.10 C ATOM 1084 C GLU A 67 -10.234 -37.898 -15.888 1.00 50.12 C ATOM 1085 O GLU A 67 -10.857 -37.162 -16.654 1.00 63.34 O ATOM 1086 CB GLU A 67 -7.842 -37.688 -15.186 1.00 1.51 C ATOM 1087 CG GLU A 67 -6.812 -36.753 -14.574 1.00 13.25 C ATOM 1088 CD GLU A 67 -6.072 -35.938 -15.616 1.00 5.43 C ATOM 1089 OE1 GLU A 67 -5.325 -36.538 -16.417 1.00 22.02 O ATOM 1090 OE2 GLU A 67 -6.238 -34.700 -15.630 1.00 70.23 O ATOM 0 H GLU A 67 -8.864 -38.260 -13.016 1.00 45.41 H new ATOM 0 HA GLU A 67 -9.386 -36.233 -14.847 1.00 74.10 H new ATOM 0 HB2 GLU A 67 -7.645 -38.705 -14.845 1.00 1.51 H new ATOM 0 HB3 GLU A 67 -7.724 -37.686 -16.270 1.00 1.51 H new ATOM 0 HG2 GLU A 67 -7.308 -36.079 -13.876 1.00 13.25 H new ATOM 0 HG3 GLU A 67 -6.094 -37.337 -13.998 1.00 13.25 H new ATOM 1097 N LYS A 68 -10.338 -39.222 -15.915 1.00 23.34 N ATOM 1098 CA LYS A 68 -11.209 -39.903 -16.865 1.00 61.21 C ATOM 1099 C LYS A 68 -12.642 -39.394 -16.751 1.00 11.30 C ATOM 1100 O LYS A 68 -13.321 -39.191 -17.757 1.00 63.14 O ATOM 1101 CB LYS A 68 -11.173 -41.415 -16.629 1.00 13.33 C ATOM 1102 CG LYS A 68 -9.842 -42.055 -16.984 1.00 13.35 C ATOM 1103 CD LYS A 68 -9.775 -42.422 -18.456 1.00 74.34 C ATOM 1104 CE LYS A 68 -8.426 -42.064 -19.060 1.00 1.35 C ATOM 1105 NZ LYS A 68 -8.475 -42.030 -20.547 1.00 63.35 N ATOM 0 H LYS A 68 -9.829 -39.846 -15.289 1.00 23.34 H new ATOM 0 HA LYS A 68 -10.845 -39.690 -17.870 1.00 61.21 H new ATOM 0 HB2 LYS A 68 -11.395 -41.616 -15.581 1.00 13.33 H new ATOM 0 HB3 LYS A 68 -11.961 -41.885 -17.218 1.00 13.33 H new ATOM 0 HG2 LYS A 68 -9.031 -41.368 -16.742 1.00 13.35 H new ATOM 0 HG3 LYS A 68 -9.694 -42.949 -16.378 1.00 13.35 H new ATOM 0 HD2 LYS A 68 -9.955 -43.490 -18.574 1.00 74.34 H new ATOM 0 HD3 LYS A 68 -10.566 -41.903 -18.998 1.00 74.34 H new ATOM 0 HE2 LYS A 68 -8.107 -41.092 -18.685 1.00 1.35 H new ATOM 0 HE3 LYS A 68 -7.680 -42.790 -18.738 1.00 1.35 H new ATOM 0 HZ1 LYS A 68 -7.536 -41.782 -20.920 1.00 63.35 H new ATOM 0 HZ2 LYS A 68 -8.755 -42.965 -20.907 1.00 63.35 H new ATOM 0 HZ3 LYS A 68 -9.168 -41.319 -20.855 1.00 63.35 H new ATOM 1119 N ALA A 69 -13.096 -39.188 -15.519 1.00 3.41 N ATOM 1120 CA ALA A 69 -14.447 -38.698 -15.274 1.00 62.42 C ATOM 1121 C ALA A 69 -14.540 -37.197 -15.522 1.00 52.32 C ATOM 1122 O ALA A 69 -15.634 -36.638 -15.599 1.00 51.53 O ATOM 1123 CB ALA A 69 -14.878 -39.028 -13.853 1.00 32.41 C ATOM 0 H ALA A 69 -12.548 -39.353 -14.675 1.00 3.41 H new ATOM 0 HA ALA A 69 -15.120 -39.197 -15.971 1.00 62.42 H new ATOM 0 HB1 ALA A 69 -15.889 -38.656 -13.684 1.00 32.41 H new ATOM 0 HB2 ALA A 69 -14.860 -40.108 -13.709 1.00 32.41 H new ATOM 0 HB3 ALA A 69 -14.195 -38.556 -13.147 1.00 32.41 H new ATOM 1129 N SER A 70 -13.386 -36.549 -15.646 1.00 11.05 N ATOM 1130 CA SER A 70 -13.338 -35.111 -15.880 1.00 51.43 C ATOM 1131 C SER A 70 -12.716 -34.802 -17.239 1.00 21.42 C ATOM 1132 O SER A 70 -12.453 -33.644 -17.566 1.00 73.33 O ATOM 1133 CB SER A 70 -12.541 -34.418 -14.773 1.00 34.11 C ATOM 1134 OG SER A 70 -13.208 -34.517 -13.527 1.00 34.15 O ATOM 0 H SER A 70 -12.472 -36.998 -15.588 1.00 11.05 H new ATOM 0 HA SER A 70 -14.360 -34.733 -15.873 1.00 51.43 H new ATOM 0 HB2 SER A 70 -11.551 -34.869 -14.696 1.00 34.11 H new ATOM 0 HB3 SER A 70 -12.394 -33.369 -15.028 1.00 34.11 H new ATOM 0 HG SER A 70 -12.998 -35.379 -13.111 1.00 34.15 H new ATOM 1140 N LEU A 71 -12.482 -35.847 -18.026 1.00 15.30 N ATOM 1141 CA LEU A 71 -11.891 -35.690 -19.350 1.00 40.52 C ATOM 1142 C LEU A 71 -12.800 -36.276 -20.426 1.00 1.13 C ATOM 1143 O LEU A 71 -12.832 -35.793 -21.558 1.00 74.22 O ATOM 1144 CB LEU A 71 -10.520 -36.365 -19.401 1.00 64.33 C ATOM 1145 CG LEU A 71 -9.309 -35.436 -19.299 1.00 34.55 C ATOM 1146 CD1 LEU A 71 -9.282 -34.743 -17.945 1.00 52.24 C ATOM 1147 CD2 LEU A 71 -8.021 -36.212 -19.528 1.00 64.31 C ATOM 0 H LEU A 71 -12.693 -36.812 -17.770 1.00 15.30 H new ATOM 0 HA LEU A 71 -11.772 -34.624 -19.543 1.00 40.52 H new ATOM 0 HB2 LEU A 71 -10.465 -37.091 -18.590 1.00 64.33 H new ATOM 0 HB3 LEU A 71 -10.447 -36.923 -20.334 1.00 64.33 H new ATOM 0 HG LEU A 71 -9.393 -34.674 -20.074 1.00 34.55 H new ATOM 0 HD11 LEU A 71 -8.414 -34.086 -17.890 1.00 52.24 H new ATOM 0 HD12 LEU A 71 -10.191 -34.155 -17.819 1.00 52.24 H new ATOM 0 HD13 LEU A 71 -9.222 -35.491 -17.155 1.00 52.24 H new ATOM 0 HD21 LEU A 71 -7.170 -35.535 -19.452 1.00 64.31 H new ATOM 0 HD22 LEU A 71 -7.930 -36.996 -18.776 1.00 64.31 H new ATOM 0 HD23 LEU A 71 -8.039 -36.662 -20.521 1.00 64.31 H new ATOM 1159 N THR A 72 -13.540 -37.320 -20.064 1.00 2.54 N ATOM 1160 CA THR A 72 -14.450 -37.971 -20.996 1.00 73.34 C ATOM 1161 C THR A 72 -14.911 -37.004 -22.081 1.00 35.41 C ATOM 1162 O THR A 72 -14.561 -37.156 -23.250 1.00 40.13 O ATOM 1163 CB THR A 72 -15.685 -38.539 -20.272 1.00 34.12 C ATOM 1164 OG1 THR A 72 -16.102 -37.641 -19.237 1.00 55.05 O ATOM 1165 CG2 THR A 72 -15.381 -39.904 -19.673 1.00 34.10 C ATOM 0 H THR A 72 -13.526 -37.732 -19.131 1.00 2.54 H new ATOM 0 HA THR A 72 -13.898 -38.791 -21.455 1.00 73.34 H new ATOM 0 HB THR A 72 -16.487 -38.650 -21.002 1.00 34.12 H new ATOM 0 HG1 THR A 72 -16.889 -38.008 -18.783 1.00 55.05 H new ATOM 0 HG21 THR A 72 -16.268 -40.285 -19.167 1.00 34.10 H new ATOM 0 HG22 THR A 72 -15.092 -40.593 -20.466 1.00 34.10 H new ATOM 0 HG23 THR A 72 -14.565 -39.813 -18.956 1.00 34.10 H new ATOM 1173 N ASN A 73 -15.699 -36.010 -21.685 1.00 11.14 N ATOM 1174 CA ASN A 73 -16.208 -35.017 -22.624 1.00 73.41 C ATOM 1175 C ASN A 73 -15.947 -33.603 -22.116 1.00 15.25 C ATOM 1176 O ASN A 73 -16.796 -32.719 -22.243 1.00 31.13 O ATOM 1177 CB ASN A 73 -17.708 -35.221 -22.851 1.00 65.51 C ATOM 1178 CG ASN A 73 -18.390 -35.868 -21.661 1.00 2.43 C ATOM 1179 OD1 ASN A 73 -18.913 -36.978 -21.758 1.00 40.32 O ATOM 1180 ND2 ASN A 73 -18.387 -35.173 -20.529 1.00 33.22 N ATOM 0 H ASN A 73 -15.999 -35.871 -20.720 1.00 11.14 H new ATOM 0 HA ASN A 73 -15.683 -35.146 -23.570 1.00 73.41 H new ATOM 0 HB2 ASN A 73 -18.176 -34.258 -23.055 1.00 65.51 H new ATOM 0 HB3 ASN A 73 -17.858 -35.842 -23.734 1.00 65.51 H new ATOM 0 HD21 ASN A 73 -18.830 -35.556 -19.694 1.00 33.22 H new ATOM 0 HD22 ASN A 73 -17.941 -34.256 -20.495 1.00 33.22 H new ATOM 1187 N LEU A 74 -14.769 -33.395 -21.540 1.00 25.23 N ATOM 1188 CA LEU A 74 -14.394 -32.088 -21.012 1.00 54.40 C ATOM 1189 C LEU A 74 -13.255 -31.479 -21.823 1.00 2.02 C ATOM 1190 O LEU A 74 -12.926 -30.302 -21.667 1.00 31.31 O ATOM 1191 CB LEU A 74 -13.984 -32.207 -19.543 1.00 43.14 C ATOM 1192 CG LEU A 74 -15.127 -32.317 -18.534 1.00 23.14 C ATOM 1193 CD1 LEU A 74 -15.042 -31.198 -17.508 1.00 12.25 C ATOM 1194 CD2 LEU A 74 -16.471 -32.290 -19.245 1.00 75.23 C ATOM 0 H LEU A 74 -14.056 -34.115 -21.426 1.00 25.23 H new ATOM 0 HA LEU A 74 -15.260 -31.431 -21.088 1.00 54.40 H new ATOM 0 HB2 LEU A 74 -13.345 -33.083 -19.435 1.00 43.14 H new ATOM 0 HB3 LEU A 74 -13.380 -31.338 -19.284 1.00 43.14 H new ATOM 0 HG LEU A 74 -15.035 -33.269 -18.012 1.00 23.14 H new ATOM 0 HD11 LEU A 74 -15.864 -31.292 -16.798 1.00 12.25 H new ATOM 0 HD12 LEU A 74 -14.093 -31.264 -16.976 1.00 12.25 H new ATOM 0 HD13 LEU A 74 -15.108 -30.235 -18.014 1.00 12.25 H new ATOM 0 HD21 LEU A 74 -17.273 -32.369 -18.511 1.00 75.23 H new ATOM 0 HD22 LEU A 74 -16.573 -31.354 -19.794 1.00 75.23 H new ATOM 0 HD23 LEU A 74 -16.532 -33.127 -19.940 1.00 75.23 H new ATOM 1206 N THR A 75 -12.655 -32.288 -22.691 1.00 54.44 N ATOM 1207 CA THR A 75 -11.553 -31.829 -23.528 1.00 35.13 C ATOM 1208 C THR A 75 -11.574 -32.515 -24.889 1.00 53.41 C ATOM 1209 O THR A 75 -12.006 -33.659 -25.028 1.00 71.21 O ATOM 1210 CB THR A 75 -10.192 -32.089 -22.856 1.00 31.05 C ATOM 1211 OG1 THR A 75 -10.374 -32.858 -21.661 1.00 53.23 O ATOM 1212 CG2 THR A 75 -9.495 -30.779 -22.520 1.00 74.00 C ATOM 0 H THR A 75 -12.914 -33.264 -22.833 1.00 54.44 H new ATOM 0 HA THR A 75 -11.684 -30.755 -23.663 1.00 35.13 H new ATOM 0 HB THR A 75 -9.568 -32.646 -23.555 1.00 31.05 H new ATOM 0 HG1 THR A 75 -9.589 -32.755 -21.083 1.00 53.23 H new ATOM 0 HG21 THR A 75 -8.536 -30.988 -22.046 1.00 74.00 H new ATOM 0 HG22 THR A 75 -9.331 -30.209 -23.435 1.00 74.00 H new ATOM 0 HG23 THR A 75 -10.118 -30.200 -21.838 1.00 74.00 H new ATOM 1220 N PRO A 76 -11.096 -31.801 -25.919 1.00 55.13 N ATOM 1221 CA PRO A 76 -11.049 -32.322 -27.289 1.00 5.13 C ATOM 1222 C PRO A 76 -10.015 -33.431 -27.451 1.00 31.41 C ATOM 1223 O PRO A 76 -10.219 -34.374 -28.215 1.00 43.02 O ATOM 1224 CB PRO A 76 -10.655 -31.099 -28.120 1.00 43.51 C ATOM 1225 CG PRO A 76 -9.925 -30.213 -27.170 1.00 21.55 C ATOM 1226 CD PRO A 76 -10.566 -30.430 -25.827 1.00 23.54 C ATOM 0 HA PRO A 76 -11.997 -32.770 -27.588 1.00 5.13 H new ATOM 0 HB2 PRO A 76 -10.024 -31.380 -28.963 1.00 43.51 H new ATOM 0 HB3 PRO A 76 -11.533 -30.600 -28.531 1.00 43.51 H new ATOM 0 HG2 PRO A 76 -8.864 -30.462 -27.141 1.00 21.55 H new ATOM 0 HG3 PRO A 76 -10.000 -29.169 -27.474 1.00 21.55 H new ATOM 0 HD2 PRO A 76 -9.844 -30.332 -25.017 1.00 23.54 H new ATOM 0 HD3 PRO A 76 -11.358 -29.705 -25.638 1.00 23.54 H new ATOM 1234 N GLU A 77 -8.907 -33.312 -26.727 1.00 23.14 N ATOM 1235 CA GLU A 77 -7.842 -34.306 -26.792 1.00 22.02 C ATOM 1236 C GLU A 77 -8.391 -35.709 -26.547 1.00 41.42 C ATOM 1237 O GLU A 77 -7.924 -36.683 -27.139 1.00 42.43 O ATOM 1238 CB GLU A 77 -6.752 -33.987 -25.766 1.00 15.23 C ATOM 1239 CG GLU A 77 -5.445 -33.526 -26.389 1.00 35.31 C ATOM 1240 CD GLU A 77 -4.598 -34.681 -26.886 1.00 44.23 C ATOM 1241 OE1 GLU A 77 -4.890 -35.204 -27.982 1.00 13.04 O ATOM 1242 OE2 GLU A 77 -3.641 -35.061 -26.179 1.00 45.25 O ATOM 0 H GLU A 77 -8.723 -32.538 -26.089 1.00 23.14 H new ATOM 0 HA GLU A 77 -7.410 -34.273 -27.792 1.00 22.02 H new ATOM 0 HB2 GLU A 77 -7.116 -33.212 -25.091 1.00 15.23 H new ATOM 0 HB3 GLU A 77 -6.563 -34.874 -25.161 1.00 15.23 H new ATOM 0 HG2 GLU A 77 -5.660 -32.854 -27.220 1.00 35.31 H new ATOM 0 HG3 GLU A 77 -4.878 -32.954 -25.654 1.00 35.31 H new ATOM 1249 N LEU A 78 -9.385 -35.804 -25.671 1.00 3.21 N ATOM 1250 CA LEU A 78 -9.998 -37.087 -25.346 1.00 54.14 C ATOM 1251 C LEU A 78 -10.731 -37.661 -26.555 1.00 20.23 C ATOM 1252 O LEU A 78 -10.416 -38.756 -27.023 1.00 14.41 O ATOM 1253 CB LEU A 78 -10.969 -36.928 -24.175 1.00 32.50 C ATOM 1254 CG LEU A 78 -10.355 -37.019 -22.777 1.00 73.55 C ATOM 1255 CD1 LEU A 78 -9.405 -38.203 -22.688 1.00 63.11 C ATOM 1256 CD2 LEU A 78 -9.634 -35.726 -22.426 1.00 72.25 C ATOM 0 H LEU A 78 -9.784 -35.008 -25.173 1.00 3.21 H new ATOM 0 HA LEU A 78 -9.206 -37.779 -25.062 1.00 54.14 H new ATOM 0 HB2 LEU A 78 -11.466 -35.963 -24.270 1.00 32.50 H new ATOM 0 HB3 LEU A 78 -11.740 -37.693 -24.262 1.00 32.50 H new ATOM 0 HG LEU A 78 -11.159 -37.170 -22.057 1.00 73.55 H new ATOM 0 HD11 LEU A 78 -8.978 -38.252 -21.686 1.00 63.11 H new ATOM 0 HD12 LEU A 78 -9.951 -39.124 -22.895 1.00 63.11 H new ATOM 0 HD13 LEU A 78 -8.605 -38.083 -23.418 1.00 63.11 H new ATOM 0 HD21 LEU A 78 -9.203 -35.809 -21.428 1.00 72.25 H new ATOM 0 HD22 LEU A 78 -8.840 -35.544 -23.150 1.00 72.25 H new ATOM 0 HD23 LEU A 78 -10.342 -34.897 -22.448 1.00 72.25 H new ATOM 1268 N LYS A 79 -11.709 -36.915 -27.057 1.00 44.32 N ATOM 1269 CA LYS A 79 -12.485 -37.347 -28.214 1.00 4.55 C ATOM 1270 C LYS A 79 -11.570 -37.854 -29.324 1.00 10.30 C ATOM 1271 O LYS A 79 -11.890 -38.824 -30.009 1.00 61.35 O ATOM 1272 CB LYS A 79 -13.346 -36.194 -28.734 1.00 73.15 C ATOM 1273 CG LYS A 79 -14.550 -35.891 -27.859 1.00 50.22 C ATOM 1274 CD LYS A 79 -15.502 -34.919 -28.537 1.00 24.11 C ATOM 1275 CE LYS A 79 -15.215 -33.482 -28.129 1.00 30.24 C ATOM 1276 NZ LYS A 79 -15.597 -32.516 -29.195 1.00 52.22 N ATOM 0 H LYS A 79 -11.983 -36.008 -26.681 1.00 44.32 H new ATOM 0 HA LYS A 79 -13.134 -38.165 -27.901 1.00 4.55 H new ATOM 0 HB2 LYS A 79 -12.730 -35.298 -28.812 1.00 73.15 H new ATOM 0 HB3 LYS A 79 -13.690 -36.434 -29.740 1.00 73.15 H new ATOM 0 HG2 LYS A 79 -15.077 -36.817 -27.630 1.00 50.22 H new ATOM 0 HG3 LYS A 79 -14.215 -35.472 -26.910 1.00 50.22 H new ATOM 0 HD2 LYS A 79 -15.413 -35.016 -29.619 1.00 24.11 H new ATOM 0 HD3 LYS A 79 -16.530 -35.174 -28.278 1.00 24.11 H new ATOM 0 HE2 LYS A 79 -15.760 -33.248 -27.215 1.00 30.24 H new ATOM 0 HE3 LYS A 79 -14.154 -33.373 -27.904 1.00 30.24 H new ATOM 0 HZ1 LYS A 79 -15.386 -31.548 -28.878 1.00 52.22 H new ATOM 0 HZ2 LYS A 79 -15.058 -32.723 -30.060 1.00 52.22 H new ATOM 0 HZ3 LYS A 79 -16.615 -32.601 -29.392 1.00 52.22 H new ATOM 1290 N ALA A 80 -10.431 -37.191 -29.495 1.00 24.34 N ATOM 1291 CA ALA A 80 -9.468 -37.578 -30.519 1.00 55.42 C ATOM 1292 C ALA A 80 -8.817 -38.915 -30.184 1.00 40.02 C ATOM 1293 O ALA A 80 -8.739 -39.807 -31.029 1.00 24.02 O ATOM 1294 CB ALA A 80 -8.409 -36.498 -30.682 1.00 23.11 C ATOM 0 H ALA A 80 -10.152 -36.383 -28.938 1.00 24.34 H new ATOM 0 HA ALA A 80 -10.003 -37.692 -31.462 1.00 55.42 H new ATOM 0 HB1 ALA A 80 -7.696 -36.800 -31.450 1.00 23.11 H new ATOM 0 HB2 ALA A 80 -8.885 -35.563 -30.977 1.00 23.11 H new ATOM 0 HB3 ALA A 80 -7.885 -36.356 -29.737 1.00 23.11 H new ATOM 1300 N SER A 81 -8.350 -39.047 -28.947 1.00 31.13 N ATOM 1301 CA SER A 81 -7.701 -40.275 -28.502 1.00 2.44 C ATOM 1302 C SER A 81 -8.666 -41.454 -28.567 1.00 72.21 C ATOM 1303 O SER A 81 -8.331 -42.516 -29.090 1.00 64.42 O ATOM 1304 CB SER A 81 -7.175 -40.110 -27.074 1.00 51.13 C ATOM 1305 OG SER A 81 -5.950 -39.399 -27.061 1.00 45.42 O ATOM 0 H SER A 81 -8.409 -38.319 -28.235 1.00 31.13 H new ATOM 0 HA SER A 81 -6.863 -40.477 -29.170 1.00 2.44 H new ATOM 0 HB2 SER A 81 -7.912 -39.581 -26.470 1.00 51.13 H new ATOM 0 HB3 SER A 81 -7.035 -41.091 -26.619 1.00 51.13 H new ATOM 0 HG SER A 81 -5.636 -39.305 -26.137 1.00 45.42 H new ATOM 1311 N MET A 82 -9.867 -41.259 -28.032 1.00 2.50 N ATOM 1312 CA MET A 82 -10.882 -42.305 -28.030 1.00 71.43 C ATOM 1313 C MET A 82 -11.299 -42.660 -29.454 1.00 34.30 C ATOM 1314 O MET A 82 -11.499 -43.831 -29.779 1.00 12.13 O ATOM 1315 CB MET A 82 -12.104 -41.859 -27.225 1.00 22.44 C ATOM 1316 CG MET A 82 -11.751 -41.208 -25.897 1.00 34.41 C ATOM 1317 SD MET A 82 -12.653 -41.927 -24.510 1.00 41.43 S ATOM 1318 CE MET A 82 -11.526 -43.226 -24.010 1.00 40.13 C ATOM 0 H MET A 82 -10.161 -40.386 -27.594 1.00 2.50 H new ATOM 0 HA MET A 82 -10.453 -43.192 -27.563 1.00 71.43 H new ATOM 0 HB2 MET A 82 -12.686 -41.156 -27.822 1.00 22.44 H new ATOM 0 HB3 MET A 82 -12.742 -42.723 -27.039 1.00 22.44 H new ATOM 0 HG2 MET A 82 -10.680 -41.309 -25.721 1.00 34.41 H new ATOM 0 HG3 MET A 82 -11.966 -40.141 -25.951 1.00 34.41 H new ATOM 0 HE1 MET A 82 -11.945 -43.763 -23.159 1.00 40.13 H new ATOM 0 HE2 MET A 82 -11.378 -43.918 -24.839 1.00 40.13 H new ATOM 0 HE3 MET A 82 -10.569 -42.788 -23.727 1.00 40.13 H new ATOM 1328 N ASP A 83 -11.429 -41.643 -30.298 1.00 73.15 N ATOM 1329 CA ASP A 83 -11.822 -41.848 -31.688 1.00 32.22 C ATOM 1330 C ASP A 83 -10.801 -42.714 -32.419 1.00 41.22 C ATOM 1331 O ASP A 83 -11.165 -43.607 -33.183 1.00 63.02 O ATOM 1332 CB ASP A 83 -11.974 -40.504 -32.401 1.00 42.31 C ATOM 1333 CG ASP A 83 -12.406 -40.660 -33.846 1.00 22.32 C ATOM 1334 OD1 ASP A 83 -11.586 -41.130 -34.663 1.00 13.00 O ATOM 1335 OD2 ASP A 83 -13.564 -40.314 -34.159 1.00 42.11 O ATOM 0 H ASP A 83 -11.268 -40.668 -30.045 1.00 73.15 H new ATOM 0 HA ASP A 83 -12.782 -42.365 -31.696 1.00 32.22 H new ATOM 0 HB2 ASP A 83 -12.706 -39.895 -31.870 1.00 42.31 H new ATOM 0 HB3 ASP A 83 -11.026 -39.967 -32.364 1.00 42.31 H new ATOM 1340 N GLU A 84 -9.522 -42.441 -32.180 1.00 21.21 N ATOM 1341 CA GLU A 84 -8.449 -43.194 -32.818 1.00 23.41 C ATOM 1342 C GLU A 84 -8.379 -44.616 -32.266 1.00 51.45 C ATOM 1343 O GLU A 84 -8.086 -45.563 -32.997 1.00 20.44 O ATOM 1344 CB GLU A 84 -7.107 -42.489 -32.610 1.00 50.23 C ATOM 1345 CG GLU A 84 -6.770 -41.488 -33.703 1.00 30.21 C ATOM 1346 CD GLU A 84 -5.360 -41.657 -34.234 1.00 23.01 C ATOM 1347 OE1 GLU A 84 -4.498 -42.159 -33.482 1.00 52.40 O ATOM 1348 OE2 GLU A 84 -5.118 -41.287 -35.402 1.00 71.41 O ATOM 0 H GLU A 84 -9.204 -41.705 -31.550 1.00 21.21 H new ATOM 0 HA GLU A 84 -8.662 -43.247 -33.886 1.00 23.41 H new ATOM 0 HB2 GLU A 84 -7.122 -41.974 -31.649 1.00 50.23 H new ATOM 0 HB3 GLU A 84 -6.317 -43.238 -32.558 1.00 50.23 H new ATOM 0 HG2 GLU A 84 -7.479 -41.599 -34.523 1.00 30.21 H new ATOM 0 HG3 GLU A 84 -6.889 -40.477 -33.314 1.00 30.21 H new ATOM 1355 N LEU A 85 -8.650 -44.756 -30.974 1.00 1.14 N ATOM 1356 CA LEU A 85 -8.618 -46.061 -30.322 1.00 61.04 C ATOM 1357 C LEU A 85 -9.820 -46.905 -30.734 1.00 41.34 C ATOM 1358 O LEU A 85 -9.723 -48.127 -30.849 1.00 12.34 O ATOM 1359 CB LEU A 85 -8.595 -45.894 -28.802 1.00 43.11 C ATOM 1360 CG LEU A 85 -7.218 -45.962 -28.140 1.00 60.22 C ATOM 1361 CD1 LEU A 85 -6.579 -44.583 -28.095 1.00 25.11 C ATOM 1362 CD2 LEU A 85 -7.328 -46.547 -26.740 1.00 21.42 C ATOM 0 H LEU A 85 -8.895 -43.982 -30.356 1.00 1.14 H new ATOM 0 HA LEU A 85 -7.710 -46.575 -30.638 1.00 61.04 H new ATOM 0 HB2 LEU A 85 -9.048 -44.934 -28.555 1.00 43.11 H new ATOM 0 HB3 LEU A 85 -9.226 -46.666 -28.362 1.00 43.11 H new ATOM 0 HG LEU A 85 -6.581 -46.616 -28.736 1.00 60.22 H new ATOM 0 HD11 LEU A 85 -5.600 -44.651 -27.621 1.00 25.11 H new ATOM 0 HD12 LEU A 85 -6.465 -44.202 -29.110 1.00 25.11 H new ATOM 0 HD13 LEU A 85 -7.213 -43.907 -27.522 1.00 25.11 H new ATOM 0 HD21 LEU A 85 -6.339 -46.588 -26.284 1.00 21.42 H new ATOM 0 HD22 LEU A 85 -7.981 -45.920 -26.134 1.00 21.42 H new ATOM 0 HD23 LEU A 85 -7.743 -47.553 -26.798 1.00 21.42 H new ATOM 1374 N ARG A 86 -10.951 -46.244 -30.958 1.00 72.23 N ATOM 1375 CA ARG A 86 -12.172 -46.933 -31.359 1.00 21.31 C ATOM 1376 C ARG A 86 -12.073 -47.420 -32.802 1.00 22.45 C ATOM 1377 O ARG A 86 -12.324 -48.590 -33.090 1.00 30.23 O ATOM 1378 CB ARG A 86 -13.380 -46.008 -31.204 1.00 1.43 C ATOM 1379 CG ARG A 86 -14.650 -46.729 -30.783 1.00 50.05 C ATOM 1380 CD ARG A 86 -15.203 -46.170 -29.482 1.00 75.00 C ATOM 1381 NE ARG A 86 -16.660 -46.070 -29.505 1.00 33.53 N ATOM 1382 CZ ARG A 86 -17.471 -47.097 -29.275 1.00 22.54 C ATOM 1383 NH1 ARG A 86 -16.969 -48.295 -29.005 1.00 51.25 N ATOM 1384 NH2 ARG A 86 -18.786 -46.928 -29.313 1.00 52.30 N ATOM 0 H ARG A 86 -11.047 -45.232 -30.869 1.00 72.23 H new ATOM 0 HA ARG A 86 -12.300 -47.799 -30.709 1.00 21.31 H new ATOM 0 HB2 ARG A 86 -13.147 -45.240 -30.466 1.00 1.43 H new ATOM 0 HB3 ARG A 86 -13.559 -45.497 -32.150 1.00 1.43 H new ATOM 0 HG2 ARG A 86 -15.400 -46.635 -31.568 1.00 50.05 H new ATOM 0 HG3 ARG A 86 -14.444 -47.793 -30.665 1.00 50.05 H new ATOM 0 HD2 ARG A 86 -14.896 -46.809 -28.654 1.00 75.00 H new ATOM 0 HD3 ARG A 86 -14.775 -45.184 -29.300 1.00 75.00 H new ATOM 0 HE ARG A 86 -17.078 -45.162 -29.709 1.00 33.53 H new ATOM 0 HH11 ARG A 86 -15.958 -48.429 -28.974 1.00 51.25 H new ATOM 0 HH12 ARG A 86 -17.594 -49.082 -28.829 1.00 51.25 H new ATOM 0 HH21 ARG A 86 -19.176 -46.008 -29.519 1.00 52.30 H new ATOM 0 HH22 ARG A 86 -19.407 -47.718 -29.136 1.00 52.30 H new ATOM 1398 N GLN A 87 -11.706 -46.515 -33.703 1.00 2.15 N ATOM 1399 CA GLN A 87 -11.575 -46.853 -35.115 1.00 11.31 C ATOM 1400 C GLN A 87 -10.471 -47.882 -35.328 1.00 65.44 C ATOM 1401 O GLN A 87 -10.626 -48.821 -36.109 1.00 32.24 O ATOM 1402 CB GLN A 87 -11.283 -45.596 -35.937 1.00 21.03 C ATOM 1403 CG GLN A 87 -12.365 -44.534 -35.830 1.00 74.12 C ATOM 1404 CD GLN A 87 -13.011 -44.223 -37.166 1.00 43.41 C ATOM 1405 OE1 GLN A 87 -13.726 -45.050 -37.731 1.00 33.30 O ATOM 1406 NE2 GLN A 87 -12.761 -43.024 -37.679 1.00 41.42 N ATOM 0 H GLN A 87 -11.494 -45.542 -33.480 1.00 2.15 H new ATOM 0 HA GLN A 87 -12.518 -47.285 -35.448 1.00 11.31 H new ATOM 0 HB2 GLN A 87 -10.334 -45.170 -35.610 1.00 21.03 H new ATOM 0 HB3 GLN A 87 -11.163 -45.876 -36.984 1.00 21.03 H new ATOM 0 HG2 GLN A 87 -13.130 -44.869 -35.130 1.00 74.12 H new ATOM 0 HG3 GLN A 87 -11.934 -43.622 -35.418 1.00 74.12 H new ATOM 0 HE21 GLN A 87 -12.162 -42.369 -37.176 1.00 41.42 H new ATOM 0 HE22 GLN A 87 -13.168 -42.758 -38.576 1.00 41.42 H new ATOM 1415 N ALA A 88 -9.355 -47.699 -34.630 1.00 63.31 N ATOM 1416 CA ALA A 88 -8.225 -48.613 -34.742 1.00 62.30 C ATOM 1417 C ALA A 88 -8.573 -49.988 -34.180 1.00 44.42 C ATOM 1418 O ALA A 88 -8.261 -51.013 -34.786 1.00 14.15 O ATOM 1419 CB ALA A 88 -7.010 -48.041 -34.027 1.00 41.30 C ATOM 0 H ALA A 88 -9.209 -46.926 -33.981 1.00 63.31 H new ATOM 0 HA ALA A 88 -7.988 -48.731 -35.800 1.00 62.30 H new ATOM 0 HB1 ALA A 88 -6.174 -48.734 -34.119 1.00 41.30 H new ATOM 0 HB2 ALA A 88 -6.740 -47.085 -34.476 1.00 41.30 H new ATOM 0 HB3 ALA A 88 -7.244 -47.893 -32.973 1.00 41.30 H new ATOM 1425 N ALA A 89 -9.219 -50.001 -33.019 1.00 40.21 N ATOM 1426 CA ALA A 89 -9.610 -51.249 -32.377 1.00 20.44 C ATOM 1427 C ALA A 89 -10.709 -51.952 -33.166 1.00 61.41 C ATOM 1428 O ALA A 89 -10.680 -53.171 -33.336 1.00 53.35 O ATOM 1429 CB ALA A 89 -10.068 -50.988 -30.949 1.00 43.34 C ATOM 0 H ALA A 89 -9.483 -49.161 -32.504 1.00 40.21 H new ATOM 0 HA ALA A 89 -8.739 -51.904 -32.354 1.00 20.44 H new ATOM 0 HB1 ALA A 89 -10.357 -51.929 -30.482 1.00 43.34 H new ATOM 0 HB2 ALA A 89 -9.253 -50.537 -30.382 1.00 43.34 H new ATOM 0 HB3 ALA A 89 -10.922 -50.311 -30.959 1.00 43.34 H new ATOM 1435 N GLU A 90 -11.676 -51.176 -33.645 1.00 33.31 N ATOM 1436 CA GLU A 90 -12.785 -51.727 -34.415 1.00 54.31 C ATOM 1437 C GLU A 90 -12.310 -52.214 -35.781 1.00 34.00 C ATOM 1438 O GLU A 90 -12.665 -53.308 -36.219 1.00 60.33 O ATOM 1439 CB GLU A 90 -13.885 -50.677 -34.590 1.00 44.31 C ATOM 1440 CG GLU A 90 -14.837 -50.589 -33.409 1.00 65.40 C ATOM 1441 CD GLU A 90 -15.667 -49.321 -33.421 1.00 42.44 C ATOM 1442 OE1 GLU A 90 -15.719 -48.655 -34.477 1.00 20.33 O ATOM 1443 OE2 GLU A 90 -16.265 -48.993 -32.375 1.00 23.52 O ATOM 0 H GLU A 90 -11.714 -50.165 -33.514 1.00 33.31 H new ATOM 0 HA GLU A 90 -13.188 -52.577 -33.865 1.00 54.31 H new ATOM 0 HB2 GLU A 90 -13.423 -49.702 -34.747 1.00 44.31 H new ATOM 0 HB3 GLU A 90 -14.456 -50.908 -35.489 1.00 44.31 H new ATOM 0 HG2 GLU A 90 -15.501 -51.453 -33.418 1.00 65.40 H new ATOM 0 HG3 GLU A 90 -14.265 -50.636 -32.482 1.00 65.40 H new ATOM 1450 N SER A 91 -11.506 -51.393 -36.449 1.00 32.02 N ATOM 1451 CA SER A 91 -10.986 -51.737 -37.767 1.00 24.43 C ATOM 1452 C SER A 91 -10.149 -53.012 -37.704 1.00 51.13 C ATOM 1453 O SER A 91 -10.270 -53.889 -38.559 1.00 34.13 O ATOM 1454 CB SER A 91 -10.143 -50.588 -38.322 1.00 0.51 C ATOM 1455 OG SER A 91 -8.958 -50.412 -37.565 1.00 63.24 O ATOM 0 H SER A 91 -11.201 -50.485 -36.099 1.00 32.02 H new ATOM 0 HA SER A 91 -11.833 -51.910 -38.431 1.00 24.43 H new ATOM 0 HB2 SER A 91 -9.887 -50.790 -39.362 1.00 0.51 H new ATOM 0 HB3 SER A 91 -10.726 -49.667 -38.310 1.00 0.51 H new ATOM 0 HG SER A 91 -9.169 -49.941 -36.732 1.00 63.24 H new ATOM 1461 N MET A 92 -9.300 -53.106 -36.686 1.00 52.40 N ATOM 1462 CA MET A 92 -8.444 -54.273 -36.511 1.00 2.14 C ATOM 1463 C MET A 92 -9.269 -55.503 -36.147 1.00 33.00 C ATOM 1464 O MET A 92 -9.032 -56.597 -36.660 1.00 3.22 O ATOM 1465 CB MET A 92 -7.399 -54.007 -35.426 1.00 4.34 C ATOM 1466 CG MET A 92 -6.057 -53.547 -35.974 1.00 33.34 C ATOM 1467 SD MET A 92 -4.686 -53.934 -34.868 1.00 51.14 S ATOM 1468 CE MET A 92 -5.385 -53.467 -33.286 1.00 64.44 C ATOM 0 H MET A 92 -9.187 -52.388 -35.970 1.00 52.40 H new ATOM 0 HA MET A 92 -7.936 -54.465 -37.456 1.00 2.14 H new ATOM 0 HB2 MET A 92 -7.782 -53.249 -34.742 1.00 4.34 H new ATOM 0 HB3 MET A 92 -7.252 -54.917 -34.844 1.00 4.34 H new ATOM 0 HG2 MET A 92 -5.883 -54.019 -36.941 1.00 33.34 H new ATOM 0 HG3 MET A 92 -6.088 -52.471 -36.145 1.00 33.34 H new ATOM 0 HE1 MET A 92 -4.584 -53.340 -32.558 1.00 64.44 H new ATOM 0 HE2 MET A 92 -5.931 -52.530 -33.392 1.00 64.44 H new ATOM 0 HE3 MET A 92 -6.066 -54.247 -32.945 1.00 64.44 H new ATOM 1478 N LYS A 93 -10.240 -55.317 -35.259 1.00 21.32 N ATOM 1479 CA LYS A 93 -11.102 -56.411 -34.827 1.00 22.14 C ATOM 1480 C LYS A 93 -12.121 -56.760 -35.907 1.00 1.05 C ATOM 1481 O LYS A 93 -12.767 -57.806 -35.848 1.00 74.13 O ATOM 1482 CB LYS A 93 -11.824 -56.037 -33.530 1.00 52.24 C ATOM 1483 CG LYS A 93 -13.173 -55.376 -33.755 1.00 53.00 C ATOM 1484 CD LYS A 93 -14.302 -56.393 -33.741 1.00 62.30 C ATOM 1485 CE LYS A 93 -15.358 -56.040 -32.705 1.00 24.34 C ATOM 1486 NZ LYS A 93 -16.163 -54.857 -33.114 1.00 52.34 N ATOM 0 H LYS A 93 -10.450 -54.418 -34.824 1.00 21.32 H new ATOM 0 HA LYS A 93 -10.476 -57.285 -34.648 1.00 22.14 H new ATOM 0 HB2 LYS A 93 -11.965 -56.936 -32.930 1.00 52.24 H new ATOM 0 HB3 LYS A 93 -11.191 -55.364 -32.952 1.00 52.24 H new ATOM 0 HG2 LYS A 93 -13.346 -54.628 -32.981 1.00 53.00 H new ATOM 0 HG3 LYS A 93 -13.167 -54.851 -34.710 1.00 53.00 H new ATOM 0 HD2 LYS A 93 -14.761 -56.442 -34.728 1.00 62.30 H new ATOM 0 HD3 LYS A 93 -13.899 -57.383 -33.528 1.00 62.30 H new ATOM 0 HE2 LYS A 93 -16.018 -56.894 -32.554 1.00 24.34 H new ATOM 0 HE3 LYS A 93 -14.875 -55.838 -31.749 1.00 24.34 H new ATOM 0 HZ1 LYS A 93 -16.871 -54.649 -32.381 1.00 52.34 H new ATOM 0 HZ2 LYS A 93 -15.537 -54.035 -33.233 1.00 52.34 H new ATOM 0 HZ3 LYS A 93 -16.644 -55.059 -34.014 1.00 52.34 H new ATOM 1500 N ARG A 94 -12.258 -55.878 -36.891 1.00 71.24 N ATOM 1501 CA ARG A 94 -13.198 -56.094 -37.984 1.00 54.15 C ATOM 1502 C ARG A 94 -12.528 -56.830 -39.141 1.00 32.11 C ATOM 1503 O ARG A 94 -13.162 -57.625 -39.835 1.00 14.04 O ATOM 1504 CB ARG A 94 -13.760 -54.758 -38.474 1.00 2.43 C ATOM 1505 CG ARG A 94 -14.807 -54.900 -39.566 1.00 64.14 C ATOM 1506 CD ARG A 94 -15.947 -53.912 -39.377 1.00 73.34 C ATOM 1507 NE ARG A 94 -16.967 -54.048 -40.414 1.00 65.35 N ATOM 1508 CZ ARG A 94 -17.914 -54.979 -40.396 1.00 63.54 C ATOM 1509 NH1 ARG A 94 -17.971 -55.852 -39.400 1.00 14.23 N ATOM 1510 NH2 ARG A 94 -18.806 -55.039 -41.377 1.00 20.03 N ATOM 0 H ARG A 94 -11.730 -55.007 -36.954 1.00 71.24 H new ATOM 0 HA ARG A 94 -14.016 -56.709 -37.609 1.00 54.15 H new ATOM 0 HB2 ARG A 94 -14.198 -54.227 -37.629 1.00 2.43 H new ATOM 0 HB3 ARG A 94 -12.940 -54.144 -38.846 1.00 2.43 H new ATOM 0 HG2 ARG A 94 -14.343 -54.740 -40.539 1.00 64.14 H new ATOM 0 HG3 ARG A 94 -15.201 -55.916 -39.564 1.00 64.14 H new ATOM 0 HD2 ARG A 94 -16.402 -54.066 -38.399 1.00 73.34 H new ATOM 0 HD3 ARG A 94 -15.552 -52.896 -39.388 1.00 73.34 H new ATOM 0 HE ARG A 94 -16.951 -53.392 -41.195 1.00 65.35 H new ATOM 0 HH11 ARG A 94 -17.287 -55.810 -38.645 1.00 14.23 H new ATOM 0 HH12 ARG A 94 -18.699 -56.566 -39.389 1.00 14.23 H new ATOM 0 HH21 ARG A 94 -18.765 -54.370 -42.146 1.00 20.03 H new ATOM 0 HH22 ARG A 94 -19.533 -55.754 -41.362 1.00 20.03 H new ATOM 1524 N SER A 95 -11.243 -56.559 -39.342 1.00 64.33 N ATOM 1525 CA SER A 95 -10.487 -57.192 -40.417 1.00 74.51 C ATOM 1526 C SER A 95 -9.816 -58.472 -39.928 1.00 65.03 C ATOM 1527 O SER A 95 -9.451 -59.338 -40.724 1.00 22.01 O ATOM 1528 CB SER A 95 -9.434 -56.228 -40.966 1.00 55.21 C ATOM 1529 OG SER A 95 -9.893 -54.888 -40.913 1.00 72.10 O ATOM 0 H SER A 95 -10.703 -55.905 -38.775 1.00 64.33 H new ATOM 0 HA SER A 95 -11.184 -57.449 -41.215 1.00 74.51 H new ATOM 0 HB2 SER A 95 -8.513 -56.324 -40.390 1.00 55.21 H new ATOM 0 HB3 SER A 95 -9.195 -56.493 -41.996 1.00 55.21 H new ATOM 0 HG SER A 95 -9.688 -54.507 -40.034 1.00 72.10 H new ATOM 1535 N TYR A 96 -9.655 -58.584 -38.614 1.00 53.44 N ATOM 1536 CA TYR A 96 -9.025 -59.755 -38.018 1.00 73.50 C ATOM 1537 C TYR A 96 -10.066 -60.814 -37.666 1.00 12.31 C ATOM 1538 O TYR A 96 -9.930 -61.981 -38.032 1.00 33.32 O ATOM 1539 CB TYR A 96 -8.242 -59.358 -36.766 1.00 12.33 C ATOM 1540 CG TYR A 96 -7.679 -60.536 -36.004 1.00 32.21 C ATOM 1541 CD1 TYR A 96 -7.092 -61.604 -36.672 1.00 55.00 C ATOM 1542 CD2 TYR A 96 -7.735 -60.583 -34.616 1.00 44.54 C ATOM 1543 CE1 TYR A 96 -6.577 -62.683 -35.980 1.00 73.24 C ATOM 1544 CE2 TYR A 96 -7.221 -61.657 -33.917 1.00 3.15 C ATOM 1545 CZ TYR A 96 -6.643 -62.705 -34.603 1.00 13.22 C ATOM 1546 OH TYR A 96 -6.132 -63.777 -33.909 1.00 65.53 O ATOM 0 H TYR A 96 -9.953 -57.877 -37.941 1.00 53.44 H new ATOM 0 HA TYR A 96 -8.336 -60.177 -38.750 1.00 73.50 H new ATOM 0 HB2 TYR A 96 -7.424 -58.698 -37.054 1.00 12.33 H new ATOM 0 HB3 TYR A 96 -8.895 -58.787 -36.105 1.00 12.33 H new ATOM 0 HD1 TYR A 96 -7.038 -61.590 -37.751 1.00 55.00 H new ATOM 0 HD2 TYR A 96 -8.188 -59.765 -34.075 1.00 44.54 H new ATOM 0 HE1 TYR A 96 -6.125 -63.505 -36.515 1.00 73.24 H new ATOM 0 HE2 TYR A 96 -7.271 -61.677 -32.838 1.00 3.15 H new ATOM 0 HH TYR A 96 -6.258 -63.634 -32.948 1.00 65.53 H new ATOM 1556 N VAL A 97 -11.107 -60.396 -36.953 1.00 33.03 N ATOM 1557 CA VAL A 97 -12.174 -61.306 -36.552 1.00 3.25 C ATOM 1558 C VAL A 97 -13.113 -61.598 -37.716 1.00 35.43 C ATOM 1559 O VAL A 97 -14.321 -61.383 -37.621 1.00 34.43 O ATOM 1560 CB VAL A 97 -12.990 -60.731 -35.379 1.00 32.12 C ATOM 1561 CG1 VAL A 97 -13.954 -61.776 -34.836 1.00 42.43 C ATOM 1562 CG2 VAL A 97 -12.064 -60.227 -34.282 1.00 35.10 C ATOM 0 H VAL A 97 -11.234 -59.433 -36.641 1.00 33.03 H new ATOM 0 HA VAL A 97 -11.697 -62.233 -36.233 1.00 3.25 H new ATOM 0 HB VAL A 97 -13.575 -59.887 -35.745 1.00 32.12 H new ATOM 0 HG11 VAL A 97 -14.522 -61.352 -34.008 1.00 42.43 H new ATOM 0 HG12 VAL A 97 -14.639 -62.084 -35.626 1.00 42.43 H new ATOM 0 HG13 VAL A 97 -13.392 -62.642 -34.485 1.00 42.43 H new ATOM 0 HG21 VAL A 97 -12.658 -59.824 -33.461 1.00 35.10 H new ATOM 0 HG22 VAL A 97 -11.451 -61.051 -33.916 1.00 35.10 H new ATOM 0 HG23 VAL A 97 -11.419 -59.444 -34.681 1.00 35.10 H new ATOM 1572 N ALA A 98 -12.550 -62.091 -38.814 1.00 54.53 N ATOM 1573 CA ALA A 98 -13.338 -62.415 -39.997 1.00 33.32 C ATOM 1574 C ALA A 98 -12.446 -62.899 -41.135 1.00 33.20 C ATOM 1575 O ALA A 98 -12.714 -62.627 -42.304 1.00 41.14 O ATOM 1576 CB ALA A 98 -14.151 -61.207 -40.438 1.00 0.03 C ATOM 0 H ALA A 98 -11.551 -62.275 -38.909 1.00 54.53 H new ATOM 0 HA ALA A 98 -14.022 -63.223 -39.737 1.00 33.32 H new ATOM 0 HB1 ALA A 98 -14.734 -61.464 -41.322 1.00 0.03 H new ATOM 0 HB2 ALA A 98 -14.824 -60.908 -39.634 1.00 0.03 H new ATOM 0 HB3 ALA A 98 -13.478 -60.382 -40.674 1.00 0.03 H new ATOM 1582 N ASN A 99 -11.385 -63.618 -40.784 1.00 44.31 N ATOM 1583 CA ASN A 99 -10.452 -64.139 -41.777 1.00 50.51 C ATOM 1584 C ASN A 99 -9.538 -63.033 -42.297 1.00 23.30 C ATOM 1585 O ASN A 99 -9.709 -62.546 -43.415 1.00 31.24 O ATOM 1586 CB ASN A 99 -11.216 -64.773 -42.941 1.00 22.51 C ATOM 1587 CG ASN A 99 -10.439 -65.898 -43.598 1.00 5.14 C ATOM 1588 OD1 ASN A 99 -10.558 -67.060 -43.209 1.00 54.10 O ATOM 1589 ND2 ASN A 99 -9.636 -65.556 -44.599 1.00 1.02 N ATOM 0 H ASN A 99 -11.150 -63.853 -39.820 1.00 44.31 H new ATOM 0 HA ASN A 99 -9.836 -64.900 -41.297 1.00 50.51 H new ATOM 0 HB2 ASN A 99 -12.170 -65.157 -42.580 1.00 22.51 H new ATOM 0 HB3 ASN A 99 -11.441 -64.008 -43.684 1.00 22.51 H new ATOM 0 HD21 ASN A 99 -9.087 -66.269 -45.079 1.00 1.02 H new ATOM 0 HD22 ASN A 99 -9.569 -64.580 -44.888 1.00 1.02 H new ATOM 1596 N ASP A 100 -8.567 -62.643 -41.479 1.00 25.10 N ATOM 1597 CA ASP A 100 -7.623 -61.597 -41.856 1.00 55.42 C ATOM 1598 C ASP A 100 -6.754 -62.045 -43.027 1.00 12.30 C ATOM 1599 O ASP A 100 -5.971 -62.989 -42.925 1.00 31.23 O ATOM 1600 CB ASP A 100 -6.741 -61.221 -40.664 1.00 75.53 C ATOM 1601 CG ASP A 100 -6.431 -59.738 -40.618 1.00 61.30 C ATOM 1602 OD1 ASP A 100 -6.988 -58.989 -41.448 1.00 5.00 O ATOM 1603 OD2 ASP A 100 -5.632 -59.327 -39.751 1.00 41.33 O ATOM 0 H ASP A 100 -8.413 -63.035 -40.550 1.00 25.10 H new ATOM 0 HA ASP A 100 -8.194 -60.722 -42.165 1.00 55.42 H new ATOM 0 HB2 ASP A 100 -7.240 -61.514 -39.740 1.00 75.53 H new ATOM 0 HB3 ASP A 100 -5.808 -61.783 -40.714 1.00 75.53 H new ATOM 1608 N PRO A 101 -6.895 -61.353 -44.167 1.00 44.25 N ATOM 1609 CA PRO A 101 -6.131 -61.662 -45.380 1.00 2.11 C ATOM 1610 C PRO A 101 -4.652 -61.317 -45.238 1.00 14.55 C ATOM 1611 O PRO A 101 -3.835 -61.679 -46.085 1.00 12.10 O ATOM 1612 CB PRO A 101 -6.786 -60.780 -46.446 1.00 44.00 C ATOM 1613 CG PRO A 101 -7.382 -59.646 -45.686 1.00 31.23 C ATOM 1614 CD PRO A 101 -7.809 -60.215 -44.361 1.00 32.20 C ATOM 0 HA PRO A 101 -6.153 -62.726 -45.615 1.00 2.11 H new ATOM 0 HB2 PRO A 101 -6.054 -60.428 -47.173 1.00 44.00 H new ATOM 0 HB3 PRO A 101 -7.547 -61.329 -47.000 1.00 44.00 H new ATOM 0 HG2 PRO A 101 -6.657 -58.843 -45.551 1.00 31.23 H new ATOM 0 HG3 PRO A 101 -8.232 -59.222 -46.221 1.00 31.23 H new ATOM 0 HD2 PRO A 101 -7.714 -59.482 -43.560 1.00 32.20 H new ATOM 0 HD3 PRO A 101 -8.851 -60.535 -44.378 1.00 32.20 H new ATOM 1622 N LEU A 102 -4.315 -60.615 -44.161 1.00 44.23 N ATOM 1623 CA LEU A 102 -2.933 -60.221 -43.907 1.00 52.34 C ATOM 1624 C LEU A 102 -2.272 -61.165 -42.909 1.00 33.34 C ATOM 1625 O LEU A 102 -1.269 -60.821 -42.285 1.00 14.54 O ATOM 1626 CB LEU A 102 -2.880 -58.785 -43.381 1.00 70.34 C ATOM 1627 CG LEU A 102 -3.893 -58.432 -42.292 1.00 3.14 C ATOM 1628 CD1 LEU A 102 -3.191 -57.818 -41.090 1.00 54.41 C ATOM 1629 CD2 LEU A 102 -4.952 -57.484 -42.835 1.00 72.41 C ATOM 0 H LEU A 102 -4.979 -60.307 -43.450 1.00 44.23 H new ATOM 0 HA LEU A 102 -2.386 -60.277 -44.848 1.00 52.34 H new ATOM 0 HB2 LEU A 102 -1.879 -58.598 -42.992 1.00 70.34 H new ATOM 0 HB3 LEU A 102 -3.028 -58.106 -44.221 1.00 70.34 H new ATOM 0 HG LEU A 102 -4.386 -59.349 -41.970 1.00 3.14 H new ATOM 0 HD11 LEU A 102 -3.927 -57.573 -40.325 1.00 54.41 H new ATOM 0 HD12 LEU A 102 -2.471 -58.530 -40.686 1.00 54.41 H new ATOM 0 HD13 LEU A 102 -2.671 -56.911 -41.397 1.00 54.41 H new ATOM 0 HD21 LEU A 102 -5.664 -57.244 -42.046 1.00 72.41 H new ATOM 0 HD22 LEU A 102 -4.476 -56.568 -43.185 1.00 72.41 H new ATOM 0 HD23 LEU A 102 -5.476 -57.960 -43.664 1.00 72.41 H new ATOM 1641 N GLU A 103 -2.841 -62.358 -42.765 1.00 23.42 N ATOM 1642 CA GLU A 103 -2.305 -63.353 -41.843 1.00 1.24 C ATOM 1643 C GLU A 103 -2.727 -64.760 -42.254 1.00 75.14 C ATOM 1644 O GLU A 103 -1.900 -65.668 -42.344 1.00 41.32 O ATOM 1645 CB GLU A 103 -2.776 -63.064 -40.416 1.00 12.02 C ATOM 1646 CG GLU A 103 -1.664 -62.604 -39.489 1.00 23.23 C ATOM 1647 CD GLU A 103 -2.090 -62.580 -38.034 1.00 24.14 C ATOM 1648 OE1 GLU A 103 -2.607 -61.536 -37.585 1.00 1.42 O ATOM 1649 OE2 GLU A 103 -1.906 -63.605 -37.344 1.00 3.52 O ATOM 0 H GLU A 103 -3.672 -62.659 -43.274 1.00 23.42 H new ATOM 0 HA GLU A 103 -1.217 -63.294 -41.878 1.00 1.24 H new ATOM 0 HB2 GLU A 103 -3.552 -62.299 -40.447 1.00 12.02 H new ATOM 0 HB3 GLU A 103 -3.232 -63.964 -40.004 1.00 12.02 H new ATOM 0 HG2 GLU A 103 -0.805 -63.266 -39.601 1.00 23.23 H new ATOM 0 HG3 GLU A 103 -1.339 -61.607 -39.785 1.00 23.23 H new ATOM 1656 N HIS A 104 -4.022 -64.934 -42.503 1.00 63.21 N ATOM 1657 CA HIS A 104 -4.555 -66.231 -42.905 1.00 53.44 C ATOM 1658 C HIS A 104 -4.184 -67.309 -41.892 1.00 34.11 C ATOM 1659 O HIS A 104 -4.720 -67.343 -40.784 1.00 34.43 O ATOM 1660 CB HIS A 104 -4.032 -66.614 -44.290 1.00 1.21 C ATOM 1661 CG HIS A 104 -4.969 -66.259 -45.404 1.00 25.44 C ATOM 1662 ND1 HIS A 104 -4.578 -65.547 -46.518 1.00 23.41 N ATOM 1663 CD2 HIS A 104 -6.285 -66.525 -45.571 1.00 52.42 C ATOM 1664 CE1 HIS A 104 -5.614 -65.388 -47.322 1.00 22.42 C ATOM 1665 NE2 HIS A 104 -6.662 -65.973 -46.771 1.00 14.44 N ATOM 0 H HIS A 104 -4.720 -64.194 -42.433 1.00 63.21 H new ATOM 0 HA HIS A 104 -5.642 -66.153 -42.944 1.00 53.44 H new ATOM 0 HB2 HIS A 104 -3.076 -66.118 -44.458 1.00 1.21 H new ATOM 0 HB3 HIS A 104 -3.843 -67.687 -44.314 1.00 1.21 H new ATOM 0 HD2 HIS A 104 -6.920 -67.070 -44.888 1.00 52.42 H new ATOM 0 HE1 HIS A 104 -5.605 -64.868 -48.269 1.00 22.42 H new ATOM 0 HE2 HIS A 104 -7.599 -66.009 -47.172 1.00 14.44 H new TER 1673 HIS A 104