USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1098 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 124 THR OG1 : rot 180:sc= 1.02 USER MOD Set 1.2: A 127 THR OG1 : rot 52:sc= 1.56 USER MOD Set 2.1: A 103 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 107 ASN : amide:sc= -0.621 K(o=-0.62,f=0.057) USER MOD Single : A 1 SER N :NH3+ 168:sc= 1.6 (180deg=1.44) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -21:sc= 1.01 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -139:sc= 1.26 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -0.913 K(o=-0.91,f=-0.0052) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 52 CYS SG : rot -98:sc= 0.0485 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -115:sc= -1.44 (180deg=-2.27) USER MOD Single : A 60 SER OG : rot 90:sc= -2.37! USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.759 K(o=-0.76,f=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 GLN : amide:sc= -1.33 K(o=-1.3,f=-7.4!) USER MOD Single : A 90 THR OG1 : rot 160:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot 77:sc= 0.535 USER MOD Single : A 112 THR OG1 : rot 63:sc= 0.398 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -1.29! K(o=-1.3!,f=0) USER MOD Single : A 122 THR OG1 : rot 31:sc= 0.272 USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 128 TYR OH : rot 130:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ -148:sc= -2.56! (180deg=-4.7!) USER MOD Single : A 131 CYS SG : rot 70:sc= 0 USER MOD Single : A 136 THR OG1 : rot 64:sc= 1.25 USER MOD Single : A 140 GLN : amide:sc= -2.82! K(o=-2.8!,f=-1.3) USER MOD Single : A 143 THR OG1 : rot 160:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 8.822 -7.455 4.099 1.00 13.22 N ATOM 2 CA SER A 1 7.608 -7.859 3.331 1.00 51.43 C ATOM 3 C SER A 1 6.449 -6.886 3.588 1.00 5.50 C ATOM 4 O SER A 1 6.578 -5.976 4.400 1.00 21.42 O ATOM 5 CB SER A 1 7.197 -9.293 3.697 1.00 71.41 C ATOM 6 OG SER A 1 6.900 -9.413 5.078 1.00 52.21 O ATOM 0 H1 SER A 1 9.520 -8.225 4.075 1.00 13.22 H new ATOM 0 H2 SER A 1 9.234 -6.600 3.673 1.00 13.22 H new ATOM 0 H3 SER A 1 8.559 -7.257 5.086 1.00 13.22 H new ATOM 0 HA SER A 1 7.849 -7.826 2.269 1.00 51.43 H new ATOM 0 HB2 SER A 1 6.326 -9.584 3.110 1.00 71.41 H new ATOM 0 HB3 SER A 1 8.001 -9.981 3.436 1.00 71.41 H new ATOM 0 HG SER A 1 6.640 -10.337 5.278 1.00 52.21 H new ATOM 14 N ILE A 2 5.317 -7.086 2.894 1.00 43.43 N ATOM 15 CA ILE A 2 4.161 -6.168 2.972 1.00 3.32 C ATOM 16 C ILE A 2 4.533 -4.740 2.516 1.00 5.40 C ATOM 17 O ILE A 2 5.274 -4.026 3.195 1.00 20.42 O ATOM 18 CB ILE A 2 3.529 -6.107 4.399 1.00 62.33 C ATOM 19 CG1 ILE A 2 2.862 -7.449 4.781 1.00 10.52 C ATOM 20 CG2 ILE A 2 2.507 -4.970 4.494 1.00 13.33 C ATOM 21 CD1 ILE A 2 3.829 -8.576 5.082 1.00 1.54 C ATOM 0 H ILE A 2 5.174 -7.879 2.268 1.00 43.43 H new ATOM 0 HA ILE A 2 3.417 -6.581 2.291 1.00 3.32 H new ATOM 0 HB ILE A 2 4.338 -5.915 5.104 1.00 62.33 H new ATOM 0 HG12 ILE A 2 2.230 -7.289 5.654 1.00 10.52 H new ATOM 0 HG13 ILE A 2 2.208 -7.758 3.966 1.00 10.52 H new ATOM 0 HG21 ILE A 2 2.080 -4.947 5.497 1.00 13.33 H new ATOM 0 HG22 ILE A 2 3.000 -4.020 4.288 1.00 13.33 H new ATOM 0 HG23 ILE A 2 1.713 -5.133 3.765 1.00 13.33 H new ATOM 0 HD11 ILE A 2 3.270 -9.476 5.340 1.00 1.54 H new ATOM 0 HD12 ILE A 2 4.446 -8.771 4.204 1.00 1.54 H new ATOM 0 HD13 ILE A 2 4.468 -8.294 5.919 1.00 1.54 H new ATOM 33 N GLY A 3 4.007 -4.325 1.362 1.00 30.22 N ATOM 34 CA GLY A 3 4.321 -3.000 0.828 1.00 13.11 C ATOM 35 C GLY A 3 3.447 -1.889 1.412 1.00 55.20 C ATOM 36 O GLY A 3 2.367 -1.610 0.893 1.00 51.34 O ATOM 0 H GLY A 3 3.371 -4.878 0.787 1.00 30.22 H new ATOM 0 HA2 GLY A 3 5.368 -2.773 1.030 1.00 13.11 H new ATOM 0 HA3 GLY A 3 4.202 -3.015 -0.255 1.00 13.11 H new ATOM 40 N VAL A 4 3.908 -1.261 2.491 1.00 1.45 N ATOM 41 CA VAL A 4 3.172 -0.161 3.134 1.00 20.44 C ATOM 42 C VAL A 4 3.396 1.170 2.397 1.00 63.24 C ATOM 43 O VAL A 4 4.533 1.613 2.238 1.00 63.43 O ATOM 44 CB VAL A 4 3.598 0.004 4.617 1.00 52.14 C ATOM 45 CG1 VAL A 4 2.816 1.133 5.292 1.00 24.13 C ATOM 46 CG2 VAL A 4 3.427 -1.310 5.379 1.00 63.40 C ATOM 0 H VAL A 4 4.792 -1.492 2.945 1.00 1.45 H new ATOM 0 HA VAL A 4 2.114 -0.419 3.089 1.00 20.44 H new ATOM 0 HB VAL A 4 4.654 0.273 4.636 1.00 52.14 H new ATOM 0 HG11 VAL A 4 3.135 1.226 6.330 1.00 24.13 H new ATOM 0 HG12 VAL A 4 3.005 2.070 4.769 1.00 24.13 H new ATOM 0 HG13 VAL A 4 1.750 0.908 5.259 1.00 24.13 H new ATOM 0 HG21 VAL A 4 3.732 -1.171 6.416 1.00 63.40 H new ATOM 0 HG22 VAL A 4 2.382 -1.617 5.346 1.00 63.40 H new ATOM 0 HG23 VAL A 4 4.046 -2.080 4.919 1.00 63.40 H new ATOM 56 N PHE A 5 2.311 1.813 1.961 1.00 21.52 N ATOM 57 CA PHE A 5 2.406 3.072 1.206 1.00 60.03 C ATOM 58 C PHE A 5 1.765 4.257 1.953 1.00 44.12 C ATOM 59 O PHE A 5 0.647 4.159 2.456 1.00 43.23 O ATOM 60 CB PHE A 5 1.752 2.916 -0.171 1.00 33.25 C ATOM 61 CG PHE A 5 2.427 1.894 -1.045 1.00 1.11 C ATOM 62 CD1 PHE A 5 3.661 2.164 -1.616 1.00 45.15 C ATOM 63 CD2 PHE A 5 1.829 0.668 -1.295 1.00 2.32 C ATOM 64 CE1 PHE A 5 4.287 1.232 -2.419 1.00 63.23 C ATOM 65 CE2 PHE A 5 2.451 -0.267 -2.097 1.00 34.21 C ATOM 66 CZ PHE A 5 3.682 0.014 -2.659 1.00 13.25 C ATOM 0 H PHE A 5 1.357 1.487 2.115 1.00 21.52 H new ATOM 0 HA PHE A 5 3.467 3.292 1.090 1.00 60.03 H new ATOM 0 HB2 PHE A 5 0.707 2.635 -0.038 1.00 33.25 H new ATOM 0 HB3 PHE A 5 1.761 3.880 -0.680 1.00 33.25 H new ATOM 0 HD1 PHE A 5 4.138 3.115 -1.430 1.00 45.15 H new ATOM 0 HD2 PHE A 5 0.867 0.443 -0.858 1.00 2.32 H new ATOM 0 HE1 PHE A 5 5.248 1.455 -2.859 1.00 63.23 H new ATOM 0 HE2 PHE A 5 1.976 -1.218 -2.286 1.00 34.21 H new ATOM 0 HZ PHE A 5 4.170 -0.718 -3.285 1.00 13.25 H new ATOM 76 N TYR A 6 2.480 5.384 1.993 1.00 40.43 N ATOM 77 CA TYR A 6 2.001 6.609 2.655 1.00 2.51 C ATOM 78 C TYR A 6 2.561 7.865 1.956 1.00 24.20 C ATOM 79 O TYR A 6 3.246 7.758 0.941 1.00 64.12 O ATOM 80 CB TYR A 6 2.375 6.597 4.150 1.00 42.34 C ATOM 81 CG TYR A 6 3.872 6.537 4.432 1.00 41.32 C ATOM 82 CD1 TYR A 6 4.652 5.483 3.962 1.00 21.13 C ATOM 83 CD2 TYR A 6 4.502 7.532 5.174 1.00 14.45 C ATOM 84 CE1 TYR A 6 6.008 5.426 4.221 1.00 71.44 C ATOM 85 CE2 TYR A 6 5.858 7.476 5.437 1.00 14.04 C ATOM 86 CZ TYR A 6 6.606 6.425 4.958 1.00 11.45 C ATOM 87 OH TYR A 6 7.959 6.369 5.219 1.00 41.14 O ATOM 0 H TYR A 6 3.404 5.477 1.571 1.00 40.43 H new ATOM 0 HA TYR A 6 0.914 6.639 2.576 1.00 2.51 H new ATOM 0 HB2 TYR A 6 1.966 7.491 4.620 1.00 42.34 H new ATOM 0 HB3 TYR A 6 1.895 5.740 4.624 1.00 42.34 H new ATOM 0 HD1 TYR A 6 4.189 4.696 3.385 1.00 21.13 H new ATOM 0 HD2 TYR A 6 3.922 8.362 5.550 1.00 14.45 H new ATOM 0 HE1 TYR A 6 6.597 4.602 3.847 1.00 71.44 H new ATOM 0 HE2 TYR A 6 6.329 8.256 6.017 1.00 14.04 H new ATOM 0 HH TYR A 6 8.222 7.150 5.749 1.00 41.14 H new ATOM 97 N VAL A 7 2.242 9.053 2.469 1.00 50.22 N ATOM 98 CA VAL A 7 2.734 10.307 1.872 1.00 20.52 C ATOM 99 C VAL A 7 3.377 11.233 2.930 1.00 23.12 C ATOM 100 O VAL A 7 2.740 12.147 3.458 1.00 3.44 O ATOM 101 CB VAL A 7 1.603 11.047 1.098 1.00 43.40 C ATOM 102 CG1 VAL A 7 0.387 11.307 1.991 1.00 24.43 C ATOM 103 CG2 VAL A 7 2.118 12.351 0.482 1.00 10.15 C ATOM 0 H VAL A 7 1.650 9.180 3.290 1.00 50.22 H new ATOM 0 HA VAL A 7 3.511 10.038 1.157 1.00 20.52 H new ATOM 0 HB VAL A 7 1.282 10.393 0.287 1.00 43.40 H new ATOM 0 HG11 VAL A 7 -0.382 11.825 1.417 1.00 24.43 H new ATOM 0 HG12 VAL A 7 -0.008 10.358 2.353 1.00 24.43 H new ATOM 0 HG13 VAL A 7 0.684 11.924 2.839 1.00 24.43 H new ATOM 0 HG21 VAL A 7 1.307 12.846 -0.052 1.00 10.15 H new ATOM 0 HG22 VAL A 7 2.486 13.006 1.272 1.00 10.15 H new ATOM 0 HG23 VAL A 7 2.928 12.130 -0.213 1.00 10.15 H new ATOM 113 N SER A 8 4.653 10.981 3.227 1.00 35.05 N ATOM 114 CA SER A 8 5.397 11.700 4.286 1.00 11.01 C ATOM 115 C SER A 8 5.350 13.226 4.122 1.00 72.43 C ATOM 116 O SER A 8 5.428 13.968 5.101 1.00 72.43 O ATOM 117 CB SER A 8 6.868 11.258 4.298 1.00 55.32 C ATOM 118 OG SER A 8 6.991 9.852 4.399 1.00 4.23 O ATOM 0 H SER A 8 5.208 10.274 2.745 1.00 35.05 H new ATOM 0 HA SER A 8 4.907 11.446 5.226 1.00 11.01 H new ATOM 0 HB2 SER A 8 7.359 11.602 3.387 1.00 55.32 H new ATOM 0 HB3 SER A 8 7.383 11.729 5.135 1.00 55.32 H new ATOM 0 HG SER A 8 6.164 9.477 4.766 1.00 4.23 H new ATOM 124 N GLU A 9 5.244 13.689 2.883 1.00 52.33 N ATOM 125 CA GLU A 9 5.263 15.127 2.586 1.00 5.11 C ATOM 126 C GLU A 9 3.986 15.846 3.079 1.00 21.40 C ATOM 127 O GLU A 9 3.953 17.079 3.171 1.00 34.14 O ATOM 128 CB GLU A 9 5.450 15.334 1.074 1.00 1.41 C ATOM 129 CG GLU A 9 5.680 16.789 0.664 1.00 11.42 C ATOM 130 CD GLU A 9 5.921 16.954 -0.829 1.00 41.24 C ATOM 131 OE1 GLU A 9 4.937 17.073 -1.585 1.00 50.24 O ATOM 132 OE2 GLU A 9 7.099 16.983 -1.254 1.00 63.32 O ATOM 0 H GLU A 9 5.143 13.093 2.061 1.00 52.33 H new ATOM 0 HA GLU A 9 6.100 15.570 3.126 1.00 5.11 H new ATOM 0 HB2 GLU A 9 6.297 14.736 0.739 1.00 1.41 H new ATOM 0 HB3 GLU A 9 4.568 14.957 0.555 1.00 1.41 H new ATOM 0 HG2 GLU A 9 4.814 17.384 0.955 1.00 11.42 H new ATOM 0 HG3 GLU A 9 6.536 17.184 1.211 1.00 11.42 H new ATOM 139 N TYR A 10 2.945 15.079 3.426 1.00 71.24 N ATOM 140 CA TYR A 10 1.651 15.666 3.812 1.00 51.32 C ATOM 141 C TYR A 10 1.035 15.023 5.075 1.00 41.12 C ATOM 142 O TYR A 10 0.993 13.797 5.216 1.00 63.42 O ATOM 143 CB TYR A 10 0.650 15.553 2.644 1.00 45.04 C ATOM 144 CG TYR A 10 -0.757 16.015 2.999 1.00 22.40 C ATOM 145 CD1 TYR A 10 -1.145 17.342 2.839 1.00 54.23 C ATOM 146 CD2 TYR A 10 -1.695 15.121 3.516 1.00 51.23 C ATOM 147 CE1 TYR A 10 -2.419 17.761 3.180 1.00 1.11 C ATOM 148 CE2 TYR A 10 -2.966 15.533 3.853 1.00 51.03 C ATOM 149 CZ TYR A 10 -3.324 16.851 3.687 1.00 61.43 C ATOM 150 OH TYR A 10 -4.591 17.262 4.042 1.00 21.31 O ATOM 0 H TYR A 10 2.970 14.060 3.448 1.00 71.24 H new ATOM 0 HA TYR A 10 1.850 16.711 4.050 1.00 51.32 H new ATOM 0 HB2 TYR A 10 1.016 16.144 1.804 1.00 45.04 H new ATOM 0 HB3 TYR A 10 0.609 14.516 2.310 1.00 45.04 H new ATOM 0 HD1 TYR A 10 -0.440 18.057 2.442 1.00 54.23 H new ATOM 0 HD2 TYR A 10 -1.420 14.086 3.655 1.00 51.23 H new ATOM 0 HE1 TYR A 10 -2.703 18.795 3.050 1.00 1.11 H new ATOM 0 HE2 TYR A 10 -3.679 14.823 4.246 1.00 51.03 H new ATOM 0 HH TYR A 10 -5.101 16.496 4.380 1.00 21.31 H new ATOM 160 N GLY A 11 0.536 15.886 5.966 1.00 62.14 N ATOM 161 CA GLY A 11 -0.313 15.471 7.084 1.00 31.31 C ATOM 162 C GLY A 11 0.260 14.399 8.011 1.00 24.45 C ATOM 163 O GLY A 11 1.462 14.142 8.039 1.00 5.24 O ATOM 0 H GLY A 11 0.710 16.890 5.931 1.00 62.14 H new ATOM 0 HA2 GLY A 11 -0.545 16.352 7.683 1.00 31.31 H new ATOM 0 HA3 GLY A 11 -1.256 15.104 6.679 1.00 31.31 H new ATOM 167 N TYR A 12 -0.643 13.777 8.774 1.00 4.45 N ATOM 168 CA TYR A 12 -0.298 12.794 9.813 1.00 50.34 C ATOM 169 C TYR A 12 0.089 11.416 9.246 1.00 60.51 C ATOM 170 O TYR A 12 0.212 10.453 10.002 1.00 12.41 O ATOM 171 CB TYR A 12 -1.479 12.633 10.780 1.00 12.21 C ATOM 172 CG TYR A 12 -1.789 13.876 11.592 1.00 72.40 C ATOM 173 CD1 TYR A 12 -2.517 14.927 11.047 1.00 2.42 C ATOM 174 CD2 TYR A 12 -1.354 13.993 12.908 1.00 71.34 C ATOM 175 CE1 TYR A 12 -2.803 16.056 11.790 1.00 52.22 C ATOM 176 CE2 TYR A 12 -1.637 15.117 13.654 1.00 52.12 C ATOM 177 CZ TYR A 12 -2.359 16.147 13.092 1.00 51.32 C ATOM 178 OH TYR A 12 -2.650 17.269 13.837 1.00 10.43 O ATOM 0 H TYR A 12 -1.646 13.941 8.689 1.00 4.45 H new ATOM 0 HA TYR A 12 0.579 13.181 10.331 1.00 50.34 H new ATOM 0 HB2 TYR A 12 -2.365 12.354 10.210 1.00 12.21 H new ATOM 0 HB3 TYR A 12 -1.266 11.810 11.462 1.00 12.21 H new ATOM 0 HD1 TYR A 12 -2.865 14.860 10.027 1.00 2.42 H new ATOM 0 HD2 TYR A 12 -0.785 13.190 13.353 1.00 71.34 H new ATOM 0 HE1 TYR A 12 -3.372 16.863 11.353 1.00 52.22 H new ATOM 0 HE2 TYR A 12 -1.294 15.190 14.675 1.00 52.12 H new ATOM 0 HH TYR A 12 -2.266 17.175 14.734 1.00 10.43 H new ATOM 188 N SER A 13 0.241 11.312 7.927 1.00 61.43 N ATOM 189 CA SER A 13 0.589 10.031 7.283 1.00 64.21 C ATOM 190 C SER A 13 1.784 9.343 7.969 1.00 35.41 C ATOM 191 O SER A 13 1.832 8.116 8.065 1.00 35.05 O ATOM 192 CB SER A 13 0.922 10.249 5.807 1.00 60.11 C ATOM 193 OG SER A 13 2.118 10.992 5.664 1.00 53.22 O ATOM 0 H SER A 13 0.131 12.092 7.279 1.00 61.43 H new ATOM 0 HA SER A 13 -0.282 9.383 7.379 1.00 64.21 H new ATOM 0 HB2 SER A 13 1.025 9.286 5.307 1.00 60.11 H new ATOM 0 HB3 SER A 13 0.102 10.775 5.319 1.00 60.11 H new ATOM 0 HG SER A 13 2.013 11.645 4.941 1.00 53.22 H new ATOM 199 N ASP A 14 2.742 10.142 8.442 1.00 53.44 N ATOM 200 CA ASP A 14 3.905 9.628 9.175 1.00 22.33 C ATOM 201 C ASP A 14 3.480 9.021 10.524 1.00 64.34 C ATOM 202 O ASP A 14 4.009 7.995 10.961 1.00 22.01 O ATOM 203 CB ASP A 14 4.936 10.750 9.388 1.00 14.24 C ATOM 204 CG ASP A 14 4.407 11.912 10.224 1.00 51.14 C ATOM 205 OD1 ASP A 14 3.220 12.270 10.083 1.00 1.11 O ATOM 206 OD2 ASP A 14 5.184 12.485 11.020 1.00 34.40 O ATOM 0 H ASP A 14 2.736 11.156 8.330 1.00 53.44 H new ATOM 0 HA ASP A 14 4.364 8.838 8.581 1.00 22.33 H new ATOM 0 HB2 ASP A 14 5.818 10.334 9.875 1.00 14.24 H new ATOM 0 HB3 ASP A 14 5.256 11.128 8.417 1.00 14.24 H new ATOM 211 N ARG A 15 2.507 9.660 11.167 1.00 10.35 N ATOM 212 CA ARG A 15 1.953 9.177 12.437 1.00 2.51 C ATOM 213 C ARG A 15 1.152 7.881 12.224 1.00 3.20 C ATOM 214 O ARG A 15 1.211 6.956 13.037 1.00 33.44 O ATOM 215 CB ARG A 15 1.064 10.263 13.066 1.00 54.21 C ATOM 216 CG ARG A 15 1.731 11.639 13.112 1.00 40.21 C ATOM 217 CD ARG A 15 2.991 11.638 13.973 1.00 72.23 C ATOM 218 NE ARG A 15 3.904 12.719 13.604 1.00 75.43 N ATOM 219 CZ ARG A 15 4.404 13.587 14.440 1.00 62.33 C ATOM 220 NH1 ARG A 15 4.018 13.615 15.675 1.00 20.04 N ATOM 221 NH2 ARG A 15 5.274 14.450 14.030 1.00 33.30 N ATOM 0 H ARG A 15 2.080 10.522 10.829 1.00 10.35 H new ATOM 0 HA ARG A 15 2.776 8.957 13.116 1.00 2.51 H new ATOM 0 HB2 ARG A 15 0.135 10.336 12.500 1.00 54.21 H new ATOM 0 HB3 ARG A 15 0.797 9.962 14.079 1.00 54.21 H new ATOM 0 HG2 ARG A 15 1.985 11.952 12.099 1.00 40.21 H new ATOM 0 HG3 ARG A 15 1.025 12.371 13.505 1.00 40.21 H new ATOM 0 HD2 ARG A 15 2.714 11.739 15.022 1.00 72.23 H new ATOM 0 HD3 ARG A 15 3.501 10.680 13.869 1.00 72.23 H new ATOM 0 HE ARG A 15 4.169 12.800 12.622 1.00 75.43 H new ATOM 0 HH11 ARG A 15 3.315 12.953 16.005 1.00 20.04 H new ATOM 0 HH12 ARG A 15 4.417 14.299 16.319 1.00 20.04 H new ATOM 0 HH21 ARG A 15 5.569 14.452 13.054 1.00 33.30 H new ATOM 0 HH22 ARG A 15 5.666 15.129 14.683 1.00 33.30 H new ATOM 235 N LEU A 16 0.410 7.824 11.118 1.00 52.35 N ATOM 236 CA LEU A 16 -0.317 6.609 10.730 1.00 31.33 C ATOM 237 C LEU A 16 0.663 5.475 10.399 1.00 43.03 C ATOM 238 O LEU A 16 0.450 4.321 10.773 1.00 40.45 O ATOM 239 CB LEU A 16 -1.223 6.891 9.521 1.00 10.21 C ATOM 240 CG LEU A 16 -2.313 7.955 9.745 1.00 2.34 C ATOM 241 CD1 LEU A 16 -3.122 8.178 8.468 1.00 20.11 C ATOM 242 CD2 LEU A 16 -3.227 7.557 10.903 1.00 24.41 C ATOM 0 H LEU A 16 0.295 8.605 10.472 1.00 52.35 H new ATOM 0 HA LEU A 16 -0.937 6.299 11.571 1.00 31.33 H new ATOM 0 HB2 LEU A 16 -0.598 7.207 8.686 1.00 10.21 H new ATOM 0 HB3 LEU A 16 -1.705 5.959 9.224 1.00 10.21 H new ATOM 0 HG LEU A 16 -1.824 8.894 10.005 1.00 2.34 H new ATOM 0 HD11 LEU A 16 -3.887 8.934 8.649 1.00 20.11 H new ATOM 0 HD12 LEU A 16 -2.459 8.516 7.672 1.00 20.11 H new ATOM 0 HD13 LEU A 16 -3.598 7.244 8.171 1.00 20.11 H new ATOM 0 HD21 LEU A 16 -3.990 8.323 11.044 1.00 24.41 H new ATOM 0 HD22 LEU A 16 -3.706 6.604 10.677 1.00 24.41 H new ATOM 0 HD23 LEU A 16 -2.638 7.460 11.815 1.00 24.41 H new ATOM 254 N ALA A 17 1.743 5.820 9.697 1.00 25.32 N ATOM 255 CA ALA A 17 2.808 4.862 9.388 1.00 12.40 C ATOM 256 C ALA A 17 3.419 4.289 10.676 1.00 3.03 C ATOM 257 O ALA A 17 3.664 3.086 10.781 1.00 62.22 O ATOM 258 CB ALA A 17 3.885 5.522 8.529 1.00 42.42 C ATOM 0 H ALA A 17 1.905 6.758 9.330 1.00 25.32 H new ATOM 0 HA ALA A 17 2.373 4.037 8.824 1.00 12.40 H new ATOM 0 HB1 ALA A 17 4.669 4.798 8.308 1.00 42.42 H new ATOM 0 HB2 ALA A 17 3.442 5.873 7.597 1.00 42.42 H new ATOM 0 HB3 ALA A 17 4.313 6.367 9.068 1.00 42.42 H new ATOM 264 N GLN A 18 3.652 5.164 11.657 1.00 72.33 N ATOM 265 CA GLN A 18 4.141 4.748 12.975 1.00 4.15 C ATOM 266 C GLN A 18 3.185 3.729 13.620 1.00 71.05 C ATOM 267 O GLN A 18 3.617 2.698 14.138 1.00 13.14 O ATOM 268 CB GLN A 18 4.290 5.966 13.899 1.00 5.13 C ATOM 269 CG GLN A 18 4.865 5.629 15.272 1.00 1.20 C ATOM 270 CD GLN A 18 4.801 6.793 16.246 1.00 73.14 C ATOM 271 OE1 GLN A 18 5.709 7.612 16.317 1.00 44.24 O ATOM 272 NE2 GLN A 18 3.730 6.868 17.014 1.00 53.15 N ATOM 0 H GLN A 18 3.509 6.170 11.563 1.00 72.33 H new ATOM 0 HA GLN A 18 5.114 4.278 12.837 1.00 4.15 H new ATOM 0 HB2 GLN A 18 4.934 6.701 13.416 1.00 5.13 H new ATOM 0 HB3 GLN A 18 3.314 6.434 14.029 1.00 5.13 H new ATOM 0 HG2 GLN A 18 4.320 4.783 15.690 1.00 1.20 H new ATOM 0 HG3 GLN A 18 5.903 5.315 15.158 1.00 1.20 H new ATOM 0 HE21 GLN A 18 2.992 6.169 16.929 1.00 53.15 H new ATOM 0 HE22 GLN A 18 3.641 7.625 17.692 1.00 53.15 H new ATOM 281 N ALA A 19 1.884 4.032 13.577 1.00 62.21 N ATOM 282 CA ALA A 19 0.855 3.131 14.110 1.00 41.10 C ATOM 283 C ALA A 19 0.935 1.742 13.455 1.00 50.34 C ATOM 284 O ALA A 19 0.912 0.717 14.139 1.00 10.21 O ATOM 285 CB ALA A 19 -0.529 3.741 13.910 1.00 31.32 C ATOM 0 H ALA A 19 1.517 4.896 13.178 1.00 62.21 H new ATOM 0 HA ALA A 19 1.034 3.003 15.178 1.00 41.10 H new ATOM 0 HB1 ALA A 19 -1.286 3.065 14.309 1.00 31.32 H new ATOM 0 HB2 ALA A 19 -0.584 4.696 14.432 1.00 31.32 H new ATOM 0 HB3 ALA A 19 -0.707 3.898 12.846 1.00 31.32 H new ATOM 291 N ILE A 20 1.042 1.724 12.125 1.00 11.53 N ATOM 292 CA ILE A 20 1.206 0.477 11.369 1.00 52.15 C ATOM 293 C ILE A 20 2.417 -0.321 11.877 1.00 4.20 C ATOM 294 O ILE A 20 2.308 -1.506 12.194 1.00 41.42 O ATOM 295 CB ILE A 20 1.382 0.763 9.853 1.00 54.42 C ATOM 296 CG1 ILE A 20 0.151 1.496 9.298 1.00 60.44 C ATOM 297 CG2 ILE A 20 1.637 -0.531 9.075 1.00 74.43 C ATOM 298 CD1 ILE A 20 0.279 1.904 7.846 1.00 14.24 C ATOM 0 H ILE A 20 1.018 2.563 11.545 1.00 11.53 H new ATOM 0 HA ILE A 20 0.301 -0.113 11.519 1.00 52.15 H new ATOM 0 HB ILE A 20 2.253 1.406 9.728 1.00 54.42 H new ATOM 0 HG12 ILE A 20 -0.722 0.853 9.408 1.00 60.44 H new ATOM 0 HG13 ILE A 20 -0.031 2.386 9.900 1.00 60.44 H new ATOM 0 HG21 ILE A 20 1.756 -0.301 8.016 1.00 74.43 H new ATOM 0 HG22 ILE A 20 2.544 -1.007 9.448 1.00 74.43 H new ATOM 0 HG23 ILE A 20 0.792 -1.207 9.207 1.00 74.43 H new ATOM 0 HD11 ILE A 20 -0.630 2.415 7.530 1.00 14.24 H new ATOM 0 HD12 ILE A 20 1.131 2.574 7.730 1.00 14.24 H new ATOM 0 HD13 ILE A 20 0.429 1.017 7.231 1.00 14.24 H new ATOM 310 N ILE A 21 3.569 0.348 11.965 1.00 33.52 N ATOM 311 CA ILE A 21 4.795 -0.277 12.477 1.00 0.13 C ATOM 312 C ILE A 21 4.576 -0.861 13.883 1.00 50.12 C ATOM 313 O ILE A 21 4.752 -2.059 14.101 1.00 0.42 O ATOM 314 CB ILE A 21 5.968 0.738 12.523 1.00 1.13 C ATOM 315 CG1 ILE A 21 6.267 1.280 11.114 1.00 33.01 C ATOM 316 CG2 ILE A 21 7.221 0.100 13.131 1.00 12.34 C ATOM 317 CD1 ILE A 21 7.350 2.341 11.082 1.00 44.53 C ATOM 0 H ILE A 21 3.680 1.323 11.689 1.00 33.52 H new ATOM 0 HA ILE A 21 5.050 -1.084 11.791 1.00 0.13 H new ATOM 0 HB ILE A 21 5.671 1.572 13.159 1.00 1.13 H new ATOM 0 HG12 ILE A 21 6.565 0.451 10.472 1.00 33.01 H new ATOM 0 HG13 ILE A 21 5.352 1.696 10.693 1.00 33.01 H new ATOM 0 HG21 ILE A 21 8.028 0.832 13.152 1.00 12.34 H new ATOM 0 HG22 ILE A 21 7.005 -0.231 14.147 1.00 12.34 H new ATOM 0 HG23 ILE A 21 7.523 -0.756 12.527 1.00 12.34 H new ATOM 0 HD11 ILE A 21 7.504 2.673 10.055 1.00 44.53 H new ATOM 0 HD12 ILE A 21 7.047 3.189 11.696 1.00 44.53 H new ATOM 0 HD13 ILE A 21 8.279 1.925 11.471 1.00 44.53 H new ATOM 329 N ASN A 22 4.164 -0.012 14.823 1.00 33.50 N ATOM 330 CA ASN A 22 3.965 -0.426 16.218 1.00 20.04 C ATOM 331 C ASN A 22 2.932 -1.563 16.333 1.00 75.35 C ATOM 332 O ASN A 22 2.994 -2.384 17.252 1.00 21.42 O ATOM 333 CB ASN A 22 3.523 0.773 17.070 1.00 35.30 C ATOM 334 CG ASN A 22 3.511 0.465 18.559 1.00 0.13 C ATOM 335 OD1 ASN A 22 2.663 0.945 19.302 1.00 61.53 O ATOM 336 ND2 ASN A 22 4.476 -0.309 19.019 1.00 13.23 N ATOM 0 H ASN A 22 3.960 0.972 14.646 1.00 33.50 H new ATOM 0 HA ASN A 22 4.918 -0.802 16.589 1.00 20.04 H new ATOM 0 HB2 ASN A 22 4.192 1.613 16.883 1.00 35.30 H new ATOM 0 HB3 ASN A 22 2.526 1.085 16.760 1.00 35.30 H new ATOM 0 HD21 ASN A 22 4.529 -0.521 20.015 1.00 13.23 H new ATOM 0 HD22 ASN A 22 5.169 -0.695 18.378 1.00 13.23 H new ATOM 343 N GLY A 23 1.978 -1.598 15.404 1.00 33.00 N ATOM 344 CA GLY A 23 0.975 -2.658 15.393 1.00 5.03 C ATOM 345 C GLY A 23 1.504 -3.992 14.865 1.00 43.53 C ATOM 346 O GLY A 23 1.158 -5.055 15.383 1.00 3.11 O ATOM 0 H GLY A 23 1.880 -0.911 14.656 1.00 33.00 H new ATOM 0 HA2 GLY A 23 0.598 -2.801 16.406 1.00 5.03 H new ATOM 0 HA3 GLY A 23 0.131 -2.342 14.780 1.00 5.03 H new ATOM 350 N ILE A 24 2.348 -3.935 13.833 1.00 5.11 N ATOM 351 CA ILE A 24 2.869 -5.145 13.183 1.00 54.35 C ATOM 352 C ILE A 24 4.128 -5.694 13.882 1.00 50.43 C ATOM 353 O ILE A 24 4.418 -6.891 13.802 1.00 11.13 O ATOM 354 CB ILE A 24 3.165 -4.882 11.682 1.00 32.31 C ATOM 355 CG1 ILE A 24 1.877 -4.441 10.964 1.00 73.30 C ATOM 356 CG2 ILE A 24 3.757 -6.127 11.013 1.00 52.32 C ATOM 357 CD1 ILE A 24 2.061 -4.132 9.493 1.00 54.24 C ATOM 0 H ILE A 24 2.687 -3.063 13.427 1.00 5.11 H new ATOM 0 HA ILE A 24 2.091 -5.904 13.267 1.00 54.35 H new ATOM 0 HB ILE A 24 3.902 -4.082 11.609 1.00 32.31 H new ATOM 0 HG12 ILE A 24 1.129 -5.227 11.068 1.00 73.30 H new ATOM 0 HG13 ILE A 24 1.481 -3.556 11.463 1.00 73.30 H new ATOM 0 HG21 ILE A 24 3.955 -5.916 9.962 1.00 52.32 H new ATOM 0 HG22 ILE A 24 4.688 -6.399 11.510 1.00 52.32 H new ATOM 0 HG23 ILE A 24 3.050 -6.953 11.090 1.00 52.32 H new ATOM 0 HD11 ILE A 24 1.106 -3.829 9.063 1.00 54.24 H new ATOM 0 HD12 ILE A 24 2.783 -3.324 9.379 1.00 54.24 H new ATOM 0 HD13 ILE A 24 2.426 -5.020 8.977 1.00 54.24 H new ATOM 369 N THR A 25 4.866 -4.831 14.586 1.00 12.52 N ATOM 370 CA THR A 25 6.070 -5.266 15.324 1.00 22.55 C ATOM 371 C THR A 25 5.747 -6.366 16.341 1.00 60.20 C ATOM 372 O THR A 25 6.588 -7.212 16.639 1.00 71.23 O ATOM 373 CB THR A 25 6.772 -4.098 16.063 1.00 52.45 C ATOM 374 OG1 THR A 25 5.828 -3.381 16.872 1.00 3.53 O ATOM 375 CG2 THR A 25 7.442 -3.146 15.078 1.00 75.11 C ATOM 0 H THR A 25 4.659 -3.835 14.665 1.00 12.52 H new ATOM 0 HA THR A 25 6.748 -5.657 14.565 1.00 22.55 H new ATOM 0 HB THR A 25 7.543 -4.524 16.705 1.00 52.45 H new ATOM 0 HG1 THR A 25 6.284 -2.647 17.334 1.00 3.53 H new ATOM 0 HG21 THR A 25 7.926 -2.337 15.626 1.00 75.11 H new ATOM 0 HG22 THR A 25 8.188 -3.689 14.498 1.00 75.11 H new ATOM 0 HG23 THR A 25 6.691 -2.731 14.406 1.00 75.11 H new ATOM 383 N LYS A 26 4.520 -6.359 16.861 1.00 54.23 N ATOM 384 CA LYS A 26 4.062 -7.402 17.792 1.00 51.30 C ATOM 385 C LYS A 26 4.002 -8.790 17.119 1.00 23.13 C ATOM 386 O LYS A 26 3.946 -9.821 17.795 1.00 41.22 O ATOM 387 CB LYS A 26 2.684 -7.034 18.363 1.00 42.21 C ATOM 388 CG LYS A 26 2.655 -5.738 19.188 1.00 33.44 C ATOM 389 CD LYS A 26 3.210 -5.916 20.611 1.00 31.34 C ATOM 390 CE LYS A 26 4.735 -5.994 20.659 1.00 14.14 C ATOM 391 NZ LYS A 26 5.241 -6.152 22.051 1.00 53.14 N ATOM 0 H LYS A 26 3.822 -5.644 16.656 1.00 54.23 H new ATOM 0 HA LYS A 26 4.788 -7.459 18.603 1.00 51.30 H new ATOM 0 HB2 LYS A 26 1.978 -6.939 17.538 1.00 42.21 H new ATOM 0 HB3 LYS A 26 2.334 -7.855 18.989 1.00 42.21 H new ATOM 0 HG2 LYS A 26 3.234 -4.973 18.672 1.00 33.44 H new ATOM 0 HG3 LYS A 26 1.629 -5.375 19.247 1.00 33.44 H new ATOM 0 HD2 LYS A 26 2.876 -5.084 21.231 1.00 31.34 H new ATOM 0 HD3 LYS A 26 2.793 -6.824 21.045 1.00 31.34 H new ATOM 0 HE2 LYS A 26 5.075 -6.833 20.052 1.00 14.14 H new ATOM 0 HE3 LYS A 26 5.158 -5.091 20.219 1.00 14.14 H new ATOM 0 HZ1 LYS A 26 6.280 -6.201 22.039 1.00 53.14 H new ATOM 0 HZ2 LYS A 26 4.939 -5.339 22.625 1.00 53.14 H new ATOM 0 HZ3 LYS A 26 4.858 -7.027 22.462 1.00 53.14 H new ATOM 405 N THR A 27 4.001 -8.806 15.786 1.00 55.12 N ATOM 406 CA THR A 27 4.048 -10.059 15.018 1.00 10.32 C ATOM 407 C THR A 27 5.505 -10.494 14.768 1.00 62.12 C ATOM 408 O THR A 27 5.767 -11.609 14.314 1.00 42.32 O ATOM 409 CB THR A 27 3.313 -9.911 13.658 1.00 32.54 C ATOM 410 OG1 THR A 27 1.982 -9.415 13.871 1.00 55.44 O ATOM 411 CG2 THR A 27 3.230 -11.241 12.909 1.00 31.10 C ATOM 0 H THR A 27 3.968 -7.965 15.210 1.00 55.12 H new ATOM 0 HA THR A 27 3.543 -10.822 15.610 1.00 10.32 H new ATOM 0 HB THR A 27 3.888 -9.209 13.054 1.00 32.54 H new ATOM 0 HG1 THR A 27 1.525 -9.323 13.009 1.00 55.44 H new ATOM 0 HG21 THR A 27 2.709 -11.094 11.963 1.00 31.10 H new ATOM 0 HG22 THR A 27 4.236 -11.613 12.715 1.00 31.10 H new ATOM 0 HG23 THR A 27 2.686 -11.966 13.514 1.00 31.10 H new ATOM 419 N GLY A 28 6.451 -9.608 15.084 1.00 53.35 N ATOM 420 CA GLY A 28 7.870 -9.897 14.876 1.00 62.12 C ATOM 421 C GLY A 28 8.270 -9.938 13.403 1.00 4.54 C ATOM 422 O GLY A 28 9.099 -10.755 13.000 1.00 53.14 O ATOM 0 H GLY A 28 6.261 -8.689 15.483 1.00 53.35 H new ATOM 0 HA2 GLY A 28 8.466 -9.140 15.386 1.00 62.12 H new ATOM 0 HA3 GLY A 28 8.110 -10.855 15.337 1.00 62.12 H new ATOM 426 N VAL A 29 7.685 -9.053 12.597 1.00 2.23 N ATOM 427 CA VAL A 29 7.952 -9.015 11.151 1.00 41.44 C ATOM 428 C VAL A 29 8.326 -7.598 10.682 1.00 41.43 C ATOM 429 O VAL A 29 7.764 -6.608 11.154 1.00 55.44 O ATOM 430 CB VAL A 29 6.718 -9.513 10.350 1.00 1.44 C ATOM 431 CG1 VAL A 29 6.984 -9.480 8.843 1.00 5.04 C ATOM 432 CG2 VAL A 29 6.317 -10.918 10.802 1.00 12.51 C ATOM 0 H VAL A 29 7.020 -8.349 12.918 1.00 2.23 H new ATOM 0 HA VAL A 29 8.797 -9.677 10.964 1.00 41.44 H new ATOM 0 HB VAL A 29 5.889 -8.836 10.554 1.00 1.44 H new ATOM 0 HG11 VAL A 29 6.102 -9.834 8.310 1.00 5.04 H new ATOM 0 HG12 VAL A 29 7.208 -8.459 8.535 1.00 5.04 H new ATOM 0 HG13 VAL A 29 7.832 -10.124 8.609 1.00 5.04 H new ATOM 0 HG21 VAL A 29 5.451 -11.251 10.230 1.00 12.51 H new ATOM 0 HG22 VAL A 29 7.147 -11.604 10.636 1.00 12.51 H new ATOM 0 HG23 VAL A 29 6.067 -10.901 11.863 1.00 12.51 H new ATOM 442 N GLY A 30 9.279 -7.512 9.754 1.00 12.11 N ATOM 443 CA GLY A 30 9.696 -6.224 9.207 1.00 43.13 C ATOM 444 C GLY A 30 8.962 -5.854 7.919 1.00 13.13 C ATOM 445 O GLY A 30 9.124 -6.516 6.887 1.00 22.21 O ATOM 0 H GLY A 30 9.774 -8.316 9.368 1.00 12.11 H new ATOM 0 HA2 GLY A 30 9.525 -5.447 9.952 1.00 43.13 H new ATOM 0 HA3 GLY A 30 10.768 -6.248 9.013 1.00 43.13 H new ATOM 449 N VAL A 31 8.152 -4.799 7.974 1.00 14.33 N ATOM 450 CA VAL A 31 7.391 -4.347 6.804 1.00 71.13 C ATOM 451 C VAL A 31 8.122 -3.233 6.036 1.00 44.41 C ATOM 452 O VAL A 31 8.843 -2.419 6.624 1.00 25.02 O ATOM 453 CB VAL A 31 5.973 -3.864 7.194 1.00 51.05 C ATOM 454 CG1 VAL A 31 5.159 -5.025 7.764 1.00 1.14 C ATOM 455 CG2 VAL A 31 6.036 -2.700 8.185 1.00 51.23 C ATOM 0 H VAL A 31 8.004 -4.239 8.814 1.00 14.33 H new ATOM 0 HA VAL A 31 7.298 -5.214 6.149 1.00 71.13 H new ATOM 0 HB VAL A 31 5.476 -3.500 6.295 1.00 51.05 H new ATOM 0 HG11 VAL A 31 4.164 -4.673 8.035 1.00 1.14 H new ATOM 0 HG12 VAL A 31 5.074 -5.812 7.015 1.00 1.14 H new ATOM 0 HG13 VAL A 31 5.658 -5.419 8.650 1.00 1.14 H new ATOM 0 HG21 VAL A 31 5.024 -2.384 8.439 1.00 51.23 H new ATOM 0 HG22 VAL A 31 6.554 -3.020 9.089 1.00 51.23 H new ATOM 0 HG23 VAL A 31 6.574 -1.867 7.734 1.00 51.23 H new ATOM 465 N ASP A 32 7.922 -3.197 4.719 1.00 12.23 N ATOM 466 CA ASP A 32 8.588 -2.214 3.857 1.00 11.13 C ATOM 467 C ASP A 32 7.708 -0.970 3.655 1.00 51.30 C ATOM 468 O ASP A 32 6.561 -1.076 3.226 1.00 21.33 O ATOM 469 CB ASP A 32 8.919 -2.850 2.499 1.00 64.31 C ATOM 470 CG ASP A 32 9.764 -4.107 2.636 1.00 14.15 C ATOM 471 OD1 ASP A 32 10.985 -3.995 2.870 1.00 42.43 O ATOM 472 OD2 ASP A 32 9.212 -5.219 2.512 1.00 75.24 O ATOM 0 H ASP A 32 7.303 -3.838 4.222 1.00 12.23 H new ATOM 0 HA ASP A 32 9.511 -1.901 4.345 1.00 11.13 H new ATOM 0 HB2 ASP A 32 7.992 -3.094 1.980 1.00 64.31 H new ATOM 0 HB3 ASP A 32 9.449 -2.125 1.881 1.00 64.31 H new ATOM 477 N VAL A 33 8.252 0.207 3.964 1.00 72.33 N ATOM 478 CA VAL A 33 7.510 1.467 3.838 1.00 54.22 C ATOM 479 C VAL A 33 7.977 2.287 2.618 1.00 40.13 C ATOM 480 O VAL A 33 9.176 2.472 2.399 1.00 12.52 O ATOM 481 CB VAL A 33 7.640 2.328 5.124 1.00 22.11 C ATOM 482 CG1 VAL A 33 6.981 1.628 6.312 1.00 15.14 C ATOM 483 CG2 VAL A 33 9.106 2.646 5.428 1.00 33.15 C ATOM 0 H VAL A 33 9.207 0.317 4.305 1.00 72.33 H new ATOM 0 HA VAL A 33 6.463 1.200 3.694 1.00 54.22 H new ATOM 0 HB VAL A 33 7.121 3.271 4.951 1.00 22.11 H new ATOM 0 HG11 VAL A 33 7.084 2.248 7.202 1.00 15.14 H new ATOM 0 HG12 VAL A 33 5.924 1.469 6.100 1.00 15.14 H new ATOM 0 HG13 VAL A 33 7.465 0.666 6.482 1.00 15.14 H new ATOM 0 HG21 VAL A 33 9.167 3.250 6.333 1.00 33.15 H new ATOM 0 HG22 VAL A 33 9.657 1.717 5.573 1.00 33.15 H new ATOM 0 HG23 VAL A 33 9.539 3.198 4.594 1.00 33.15 H new ATOM 493 N VAL A 34 7.019 2.763 1.820 1.00 31.35 N ATOM 494 CA VAL A 34 7.312 3.559 0.616 1.00 54.13 C ATOM 495 C VAL A 34 6.286 4.697 0.443 1.00 53.13 C ATOM 496 O VAL A 34 5.116 4.554 0.805 1.00 51.01 O ATOM 497 CB VAL A 34 7.306 2.675 -0.668 1.00 63.14 C ATOM 498 CG1 VAL A 34 7.612 3.506 -1.917 1.00 21.24 C ATOM 499 CG2 VAL A 34 8.290 1.511 -0.546 1.00 64.22 C ATOM 0 H VAL A 34 6.024 2.612 1.984 1.00 31.35 H new ATOM 0 HA VAL A 34 8.307 3.983 0.752 1.00 54.13 H new ATOM 0 HB VAL A 34 6.303 2.262 -0.772 1.00 63.14 H new ATOM 0 HG11 VAL A 34 7.600 2.861 -2.795 1.00 21.24 H new ATOM 0 HG12 VAL A 34 6.858 4.285 -2.029 1.00 21.24 H new ATOM 0 HG13 VAL A 34 8.596 3.965 -1.817 1.00 21.24 H new ATOM 0 HG21 VAL A 34 8.262 0.914 -1.457 1.00 64.22 H new ATOM 0 HG22 VAL A 34 9.297 1.900 -0.398 1.00 64.22 H new ATOM 0 HG23 VAL A 34 8.013 0.888 0.305 1.00 64.22 H new ATOM 509 N ASP A 35 6.726 5.825 -0.106 1.00 12.12 N ATOM 510 CA ASP A 35 5.829 6.956 -0.368 1.00 43.10 C ATOM 511 C ASP A 35 5.060 6.791 -1.688 1.00 52.32 C ATOM 512 O ASP A 35 5.654 6.748 -2.763 1.00 32.01 O ATOM 513 CB ASP A 35 6.624 8.260 -0.398 1.00 22.21 C ATOM 514 CG ASP A 35 7.115 8.659 0.977 1.00 53.23 C ATOM 515 OD1 ASP A 35 8.215 8.224 1.374 1.00 44.24 O ATOM 516 OD2 ASP A 35 6.399 9.406 1.664 1.00 74.34 O ATOM 0 H ASP A 35 7.696 5.985 -0.379 1.00 12.12 H new ATOM 0 HA ASP A 35 5.099 6.984 0.441 1.00 43.10 H new ATOM 0 HB2 ASP A 35 7.476 8.149 -1.069 1.00 22.21 H new ATOM 0 HB3 ASP A 35 6.000 9.056 -0.805 1.00 22.21 H new ATOM 521 N LEU A 36 3.730 6.723 -1.601 1.00 5.35 N ATOM 522 CA LEU A 36 2.879 6.618 -2.797 1.00 54.11 C ATOM 523 C LEU A 36 2.721 7.973 -3.508 1.00 62.33 C ATOM 524 O LEU A 36 2.471 8.031 -4.709 1.00 54.23 O ATOM 525 CB LEU A 36 1.498 6.016 -2.439 1.00 31.53 C ATOM 526 CG LEU A 36 0.783 6.586 -1.188 1.00 33.15 C ATOM 527 CD1 LEU A 36 0.348 8.038 -1.384 1.00 73.41 C ATOM 528 CD2 LEU A 36 -0.422 5.723 -0.821 1.00 24.12 C ATOM 0 H LEU A 36 3.216 6.738 -0.720 1.00 5.35 H new ATOM 0 HA LEU A 36 3.377 5.944 -3.493 1.00 54.11 H new ATOM 0 HB2 LEU A 36 0.838 6.150 -3.296 1.00 31.53 H new ATOM 0 HB3 LEU A 36 1.623 4.943 -2.297 1.00 31.53 H new ATOM 0 HG LEU A 36 1.503 6.566 -0.370 1.00 33.15 H new ATOM 0 HD11 LEU A 36 -0.148 8.394 -0.481 1.00 73.41 H new ATOM 0 HD12 LEU A 36 1.223 8.656 -1.585 1.00 73.41 H new ATOM 0 HD13 LEU A 36 -0.341 8.101 -2.226 1.00 73.41 H new ATOM 0 HD21 LEU A 36 -0.912 6.138 0.060 1.00 24.12 H new ATOM 0 HD22 LEU A 36 -1.125 5.707 -1.654 1.00 24.12 H new ATOM 0 HD23 LEU A 36 -0.090 4.707 -0.607 1.00 24.12 H new ATOM 540 N GLY A 37 2.873 9.062 -2.758 1.00 42.03 N ATOM 541 CA GLY A 37 2.705 10.397 -3.325 1.00 4.31 C ATOM 542 C GLY A 37 3.984 10.954 -3.942 1.00 75.54 C ATOM 543 O GLY A 37 3.948 11.946 -4.671 1.00 54.23 O ATOM 0 H GLY A 37 3.110 9.047 -1.766 1.00 42.03 H new ATOM 0 HA2 GLY A 37 1.926 10.366 -4.087 1.00 4.31 H new ATOM 0 HA3 GLY A 37 2.361 11.075 -2.544 1.00 4.31 H new ATOM 547 N ALA A 38 5.112 10.313 -3.659 1.00 21.33 N ATOM 548 CA ALA A 38 6.411 10.784 -4.144 1.00 55.02 C ATOM 549 C ALA A 38 6.676 10.352 -5.593 1.00 53.22 C ATOM 550 O ALA A 38 5.982 9.495 -6.146 1.00 63.44 O ATOM 551 CB ALA A 38 7.520 10.278 -3.230 1.00 55.11 C ATOM 0 H ALA A 38 5.157 9.464 -3.095 1.00 21.33 H new ATOM 0 HA ALA A 38 6.395 11.874 -4.129 1.00 55.02 H new ATOM 0 HB1 ALA A 38 8.484 10.632 -3.597 1.00 55.11 H new ATOM 0 HB2 ALA A 38 7.357 10.651 -2.219 1.00 55.11 H new ATOM 0 HB3 ALA A 38 7.514 9.188 -3.220 1.00 55.11 H new ATOM 557 N ALA A 39 7.688 10.957 -6.204 1.00 54.34 N ATOM 558 CA ALA A 39 8.086 10.618 -7.571 1.00 15.54 C ATOM 559 C ALA A 39 8.835 9.273 -7.621 1.00 1.42 C ATOM 560 O ALA A 39 10.064 9.237 -7.725 1.00 24.22 O ATOM 561 CB ALA A 39 8.945 11.739 -8.147 1.00 63.40 C ATOM 0 H ALA A 39 8.253 11.689 -5.774 1.00 54.34 H new ATOM 0 HA ALA A 39 7.187 10.510 -8.177 1.00 15.54 H new ATOM 0 HB1 ALA A 39 9.240 11.485 -9.165 1.00 63.40 H new ATOM 0 HB2 ALA A 39 8.374 12.667 -8.156 1.00 63.40 H new ATOM 0 HB3 ALA A 39 9.836 11.867 -7.532 1.00 63.40 H new ATOM 567 N VAL A 40 8.089 8.176 -7.527 1.00 5.34 N ATOM 568 CA VAL A 40 8.678 6.829 -7.524 1.00 63.21 C ATOM 569 C VAL A 40 8.972 6.316 -8.945 1.00 60.23 C ATOM 570 O VAL A 40 8.471 6.860 -9.934 1.00 63.13 O ATOM 571 CB VAL A 40 7.753 5.818 -6.797 1.00 65.23 C ATOM 572 CG1 VAL A 40 7.558 6.221 -5.336 1.00 13.02 C ATOM 573 CG2 VAL A 40 6.410 5.692 -7.517 1.00 12.04 C ATOM 0 H VAL A 40 7.072 8.188 -7.451 1.00 5.34 H new ATOM 0 HA VAL A 40 9.624 6.910 -6.988 1.00 63.21 H new ATOM 0 HB VAL A 40 8.234 4.840 -6.816 1.00 65.23 H new ATOM 0 HG11 VAL A 40 6.906 5.499 -4.843 1.00 13.02 H new ATOM 0 HG12 VAL A 40 8.524 6.241 -4.832 1.00 13.02 H new ATOM 0 HG13 VAL A 40 7.104 7.211 -5.289 1.00 13.02 H new ATOM 0 HG21 VAL A 40 5.779 4.978 -6.988 1.00 12.04 H new ATOM 0 HG22 VAL A 40 5.917 6.664 -7.540 1.00 12.04 H new ATOM 0 HG23 VAL A 40 6.575 5.345 -8.537 1.00 12.04 H new ATOM 583 N ASP A 41 9.790 5.265 -9.043 1.00 43.12 N ATOM 584 CA ASP A 41 10.131 4.669 -10.344 1.00 22.41 C ATOM 585 C ASP A 41 9.997 3.133 -10.327 1.00 44.44 C ATOM 586 O ASP A 41 9.367 2.556 -9.437 1.00 24.33 O ATOM 587 CB ASP A 41 11.547 5.087 -10.768 1.00 43.21 C ATOM 588 CG ASP A 41 12.615 4.630 -9.794 1.00 2.22 C ATOM 589 OD1 ASP A 41 13.089 3.478 -9.921 1.00 25.14 O ATOM 590 OD2 ASP A 41 12.987 5.419 -8.900 1.00 53.13 O ATOM 0 H ASP A 41 10.228 4.809 -8.243 1.00 43.12 H new ATOM 0 HA ASP A 41 9.418 5.046 -11.077 1.00 22.41 H new ATOM 0 HB2 ASP A 41 11.762 4.675 -11.754 1.00 43.21 H new ATOM 0 HB3 ASP A 41 11.587 6.172 -10.860 1.00 43.21 H new ATOM 595 N LEU A 42 10.603 2.477 -11.321 1.00 12.32 N ATOM 596 CA LEU A 42 10.449 1.028 -11.522 1.00 23.12 C ATOM 597 C LEU A 42 10.976 0.194 -10.341 1.00 3.33 C ATOM 598 O LEU A 42 10.540 -0.939 -10.146 1.00 15.14 O ATOM 599 CB LEU A 42 11.141 0.582 -12.824 1.00 1.10 C ATOM 600 CG LEU A 42 10.462 1.031 -14.133 1.00 64.41 C ATOM 601 CD1 LEU A 42 9.008 0.564 -14.176 1.00 44.22 C ATOM 602 CD2 LEU A 42 10.552 2.544 -14.313 1.00 4.25 C ATOM 0 H LEU A 42 11.210 2.928 -12.005 1.00 12.32 H new ATOM 0 HA LEU A 42 9.377 0.844 -11.592 1.00 23.12 H new ATOM 0 HB2 LEU A 42 12.163 0.961 -12.818 1.00 1.10 H new ATOM 0 HB3 LEU A 42 11.205 -0.506 -12.825 1.00 1.10 H new ATOM 0 HG LEU A 42 10.995 0.566 -14.962 1.00 64.41 H new ATOM 0 HD11 LEU A 42 8.548 0.892 -15.108 1.00 44.22 H new ATOM 0 HD12 LEU A 42 8.973 -0.524 -14.117 1.00 44.22 H new ATOM 0 HD13 LEU A 42 8.464 0.990 -13.333 1.00 44.22 H new ATOM 0 HD21 LEU A 42 10.064 2.829 -15.245 1.00 4.25 H new ATOM 0 HD22 LEU A 42 10.057 3.040 -13.478 1.00 4.25 H new ATOM 0 HD23 LEU A 42 11.599 2.845 -14.345 1.00 4.25 H new ATOM 614 N GLN A 43 11.904 0.740 -9.557 1.00 13.41 N ATOM 615 CA GLN A 43 12.434 0.012 -8.397 1.00 65.12 C ATOM 616 C GLN A 43 11.323 -0.263 -7.369 1.00 61.44 C ATOM 617 O GLN A 43 11.113 -1.406 -6.961 1.00 23.30 O ATOM 618 CB GLN A 43 13.592 0.779 -7.741 1.00 12.14 C ATOM 619 CG GLN A 43 14.196 0.054 -6.538 1.00 53.32 C ATOM 620 CD GLN A 43 15.388 0.779 -5.935 1.00 33.35 C ATOM 621 OE1 GLN A 43 15.488 1.997 -5.994 1.00 23.43 O ATOM 622 NE2 GLN A 43 16.295 0.042 -5.333 1.00 0.23 N ATOM 0 H GLN A 43 12.302 1.669 -9.697 1.00 13.41 H new ATOM 0 HA GLN A 43 12.819 -0.943 -8.754 1.00 65.12 H new ATOM 0 HB2 GLN A 43 14.372 0.948 -8.483 1.00 12.14 H new ATOM 0 HB3 GLN A 43 13.235 1.759 -7.424 1.00 12.14 H new ATOM 0 HG2 GLN A 43 13.429 -0.068 -5.773 1.00 53.32 H new ATOM 0 HG3 GLN A 43 14.504 -0.946 -6.843 1.00 53.32 H new ATOM 0 HE21 GLN A 43 16.187 -0.972 -5.298 1.00 0.23 H new ATOM 0 HE22 GLN A 43 17.106 0.484 -4.901 1.00 0.23 H new ATOM 631 N GLU A 44 10.604 0.787 -6.970 1.00 3.25 N ATOM 632 CA GLU A 44 9.463 0.645 -6.057 1.00 21.13 C ATOM 633 C GLU A 44 8.363 -0.224 -6.679 1.00 73.14 C ATOM 634 O GLU A 44 7.777 -1.075 -6.011 1.00 54.53 O ATOM 635 CB GLU A 44 8.876 2.018 -5.683 1.00 63.53 C ATOM 636 CG GLU A 44 9.807 2.908 -4.863 1.00 51.32 C ATOM 637 CD GLU A 44 10.963 3.477 -5.670 1.00 13.23 C ATOM 638 OE1 GLU A 44 10.811 4.575 -6.240 1.00 11.43 O ATOM 639 OE2 GLU A 44 12.028 2.837 -5.729 1.00 11.23 O ATOM 0 H GLU A 44 10.789 1.746 -7.263 1.00 3.25 H new ATOM 0 HA GLU A 44 9.833 0.159 -5.154 1.00 21.13 H new ATOM 0 HB2 GLU A 44 8.606 2.544 -6.599 1.00 63.53 H new ATOM 0 HB3 GLU A 44 7.955 1.863 -5.121 1.00 63.53 H new ATOM 0 HG2 GLU A 44 9.231 3.730 -4.438 1.00 51.32 H new ATOM 0 HG3 GLU A 44 10.205 2.332 -4.027 1.00 51.32 H new ATOM 646 N LEU A 45 8.093 0.002 -7.966 1.00 50.53 N ATOM 647 CA LEU A 45 7.061 -0.751 -8.691 1.00 12.32 C ATOM 648 C LEU A 45 7.353 -2.265 -8.654 1.00 2.21 C ATOM 649 O LEU A 45 6.540 -3.054 -8.172 1.00 32.43 O ATOM 650 CB LEU A 45 6.976 -0.234 -10.147 1.00 35.30 C ATOM 651 CG LEU A 45 5.750 -0.679 -10.982 1.00 44.15 C ATOM 652 CD1 LEU A 45 5.846 -2.145 -11.404 1.00 11.00 C ATOM 653 CD2 LEU A 45 4.452 -0.423 -10.216 1.00 2.03 C ATOM 0 H LEU A 45 8.574 0.702 -8.531 1.00 50.53 H new ATOM 0 HA LEU A 45 6.098 -0.596 -8.204 1.00 12.32 H new ATOM 0 HB2 LEU A 45 6.990 0.856 -10.121 1.00 35.30 H new ATOM 0 HB3 LEU A 45 7.877 -0.552 -10.672 1.00 35.30 H new ATOM 0 HG LEU A 45 5.744 -0.079 -11.892 1.00 44.15 H new ATOM 0 HD11 LEU A 45 4.965 -2.414 -11.987 1.00 11.00 H new ATOM 0 HD12 LEU A 45 6.741 -2.292 -12.009 1.00 11.00 H new ATOM 0 HD13 LEU A 45 5.900 -2.776 -10.517 1.00 11.00 H new ATOM 0 HD21 LEU A 45 3.603 -0.743 -10.821 1.00 2.03 H new ATOM 0 HD22 LEU A 45 4.464 -0.985 -9.282 1.00 2.03 H new ATOM 0 HD23 LEU A 45 4.362 0.641 -9.998 1.00 2.03 H new ATOM 665 N ARG A 46 8.521 -2.661 -9.156 1.00 51.23 N ATOM 666 CA ARG A 46 8.894 -4.079 -9.204 1.00 70.11 C ATOM 667 C ARG A 46 9.039 -4.681 -7.795 1.00 64.35 C ATOM 668 O ARG A 46 8.691 -5.842 -7.567 1.00 72.35 O ATOM 669 CB ARG A 46 10.193 -4.284 -9.997 1.00 14.24 C ATOM 670 CG ARG A 46 10.606 -5.750 -10.098 1.00 52.24 C ATOM 671 CD ARG A 46 11.825 -5.959 -10.990 1.00 4.04 C ATOM 672 NE ARG A 46 12.188 -7.374 -11.058 1.00 74.15 N ATOM 673 CZ ARG A 46 12.679 -7.966 -12.110 1.00 21.41 C ATOM 674 NH1 ARG A 46 12.946 -7.300 -13.190 1.00 71.04 N ATOM 675 NH2 ARG A 46 12.921 -9.234 -12.070 1.00 15.21 N ATOM 0 H ARG A 46 9.224 -2.026 -9.534 1.00 51.23 H new ATOM 0 HA ARG A 46 8.084 -4.601 -9.714 1.00 70.11 H new ATOM 0 HB2 ARG A 46 10.067 -3.878 -11.001 1.00 14.24 H new ATOM 0 HB3 ARG A 46 10.995 -3.718 -9.522 1.00 14.24 H new ATOM 0 HG2 ARG A 46 10.822 -6.132 -9.100 1.00 52.24 H new ATOM 0 HG3 ARG A 46 9.771 -6.332 -10.489 1.00 52.24 H new ATOM 0 HD2 ARG A 46 11.615 -5.585 -11.992 1.00 4.04 H new ATOM 0 HD3 ARG A 46 12.666 -5.382 -10.604 1.00 4.04 H new ATOM 0 HE ARG A 46 12.047 -7.939 -10.221 1.00 74.15 H new ATOM 0 HH11 ARG A 46 12.772 -6.296 -13.226 1.00 71.04 H new ATOM 0 HH12 ARG A 46 13.330 -7.781 -14.004 1.00 71.04 H new ATOM 0 HH21 ARG A 46 12.728 -9.764 -11.220 1.00 15.21 H new ATOM 0 HH22 ARG A 46 13.305 -9.706 -12.889 1.00 15.21 H new ATOM 689 N GLU A 47 9.552 -3.892 -6.849 1.00 3.42 N ATOM 690 CA GLU A 47 9.682 -4.354 -5.463 1.00 10.12 C ATOM 691 C GLU A 47 8.298 -4.635 -4.851 1.00 71.23 C ATOM 692 O GLU A 47 8.118 -5.605 -4.109 1.00 25.25 O ATOM 693 CB GLU A 47 10.460 -3.329 -4.624 1.00 54.21 C ATOM 694 CG GLU A 47 10.753 -3.793 -3.199 1.00 12.25 C ATOM 695 CD GLU A 47 11.829 -2.962 -2.512 1.00 34.22 C ATOM 696 OE1 GLU A 47 13.027 -3.284 -2.683 1.00 41.22 O ATOM 697 OE2 GLU A 47 11.487 -1.995 -1.803 1.00 1.34 O ATOM 0 H GLU A 47 9.881 -2.941 -7.013 1.00 3.42 H new ATOM 0 HA GLU A 47 10.244 -5.288 -5.462 1.00 10.12 H new ATOM 0 HB2 GLU A 47 11.402 -3.105 -5.124 1.00 54.21 H new ATOM 0 HB3 GLU A 47 9.891 -2.400 -4.584 1.00 54.21 H new ATOM 0 HG2 GLU A 47 9.836 -3.747 -2.612 1.00 12.25 H new ATOM 0 HG3 GLU A 47 11.066 -4.837 -3.220 1.00 12.25 H new ATOM 704 N LEU A 48 7.320 -3.794 -5.187 1.00 53.14 N ATOM 705 CA LEU A 48 5.925 -4.044 -4.815 1.00 55.12 C ATOM 706 C LEU A 48 5.436 -5.376 -5.404 1.00 53.13 C ATOM 707 O LEU A 48 4.789 -6.168 -4.719 1.00 12.53 O ATOM 708 CB LEU A 48 5.023 -2.896 -5.294 1.00 71.02 C ATOM 709 CG LEU A 48 3.514 -3.126 -5.105 1.00 65.10 C ATOM 710 CD1 LEU A 48 3.176 -3.385 -3.638 1.00 11.33 C ATOM 711 CD2 LEU A 48 2.717 -1.943 -5.649 1.00 72.12 C ATOM 0 H LEU A 48 7.466 -2.934 -5.716 1.00 53.14 H new ATOM 0 HA LEU A 48 5.871 -4.102 -3.728 1.00 55.12 H new ATOM 0 HB2 LEU A 48 5.305 -1.987 -4.762 1.00 71.02 H new ATOM 0 HB3 LEU A 48 5.218 -2.720 -6.352 1.00 71.02 H new ATOM 0 HG LEU A 48 3.234 -4.014 -5.671 1.00 65.10 H new ATOM 0 HD11 LEU A 48 2.103 -3.544 -3.535 1.00 11.33 H new ATOM 0 HD12 LEU A 48 3.709 -4.271 -3.293 1.00 11.33 H new ATOM 0 HD13 LEU A 48 3.475 -2.525 -3.038 1.00 11.33 H new ATOM 0 HD21 LEU A 48 1.652 -2.125 -5.506 1.00 72.12 H new ATOM 0 HD22 LEU A 48 3.005 -1.036 -5.118 1.00 72.12 H new ATOM 0 HD23 LEU A 48 2.925 -1.822 -6.712 1.00 72.12 H new ATOM 723 N VAL A 49 5.760 -5.619 -6.674 1.00 11.10 N ATOM 724 CA VAL A 49 5.428 -6.889 -7.331 1.00 31.22 C ATOM 725 C VAL A 49 6.024 -8.082 -6.556 1.00 63.05 C ATOM 726 O VAL A 49 5.437 -9.166 -6.506 1.00 21.41 O ATOM 727 CB VAL A 49 5.930 -6.911 -8.801 1.00 52.24 C ATOM 728 CG1 VAL A 49 5.573 -8.227 -9.489 1.00 40.21 C ATOM 729 CG2 VAL A 49 5.364 -5.722 -9.580 1.00 62.24 C ATOM 0 H VAL A 49 6.252 -4.954 -7.271 1.00 11.10 H new ATOM 0 HA VAL A 49 4.342 -6.979 -7.335 1.00 31.22 H new ATOM 0 HB VAL A 49 7.017 -6.828 -8.785 1.00 52.24 H new ATOM 0 HG11 VAL A 49 5.938 -8.211 -10.516 1.00 40.21 H new ATOM 0 HG12 VAL A 49 6.035 -9.055 -8.952 1.00 40.21 H new ATOM 0 HG13 VAL A 49 4.491 -8.355 -9.490 1.00 40.21 H new ATOM 0 HG21 VAL A 49 5.727 -5.754 -10.607 1.00 62.24 H new ATOM 0 HG22 VAL A 49 4.275 -5.771 -9.578 1.00 62.24 H new ATOM 0 HG23 VAL A 49 5.687 -4.793 -9.110 1.00 62.24 H new ATOM 739 N GLY A 50 7.191 -7.869 -5.944 1.00 74.33 N ATOM 740 CA GLY A 50 7.779 -8.882 -5.070 1.00 73.32 C ATOM 741 C GLY A 50 6.950 -9.116 -3.806 1.00 62.53 C ATOM 742 O GLY A 50 6.769 -10.253 -3.366 1.00 42.23 O ATOM 0 H GLY A 50 7.741 -7.015 -6.036 1.00 74.33 H new ATOM 0 HA2 GLY A 50 7.873 -9.820 -5.618 1.00 73.32 H new ATOM 0 HA3 GLY A 50 8.786 -8.574 -4.789 1.00 73.32 H new ATOM 746 N ARG A 51 6.435 -8.026 -3.234 1.00 0.10 N ATOM 747 CA ARG A 51 5.570 -8.086 -2.043 1.00 31.21 C ATOM 748 C ARG A 51 4.084 -8.286 -2.414 1.00 70.30 C ATOM 749 O ARG A 51 3.222 -8.252 -1.539 1.00 11.34 O ATOM 750 CB ARG A 51 5.702 -6.792 -1.214 1.00 54.32 C ATOM 751 CG ARG A 51 6.929 -6.709 -0.301 1.00 33.15 C ATOM 752 CD ARG A 51 8.245 -6.610 -1.065 1.00 60.14 C ATOM 753 NE ARG A 51 9.340 -6.196 -0.188 1.00 11.22 N ATOM 754 CZ ARG A 51 10.601 -6.208 -0.519 1.00 32.41 C ATOM 755 NH1 ARG A 51 10.982 -6.688 -1.660 1.00 1.24 N ATOM 756 NH2 ARG A 51 11.487 -5.756 0.307 1.00 55.41 N ATOM 0 H ARG A 51 6.601 -7.080 -3.577 1.00 0.10 H new ATOM 0 HA ARG A 51 5.901 -8.944 -1.458 1.00 31.21 H new ATOM 0 HB2 ARG A 51 5.724 -5.944 -1.899 1.00 54.32 H new ATOM 0 HB3 ARG A 51 4.808 -6.683 -0.600 1.00 54.32 H new ATOM 0 HG2 ARG A 51 6.830 -5.841 0.351 1.00 33.15 H new ATOM 0 HG3 ARG A 51 6.955 -7.589 0.341 1.00 33.15 H new ATOM 0 HD2 ARG A 51 8.481 -7.575 -1.514 1.00 60.14 H new ATOM 0 HD3 ARG A 51 8.141 -5.896 -1.882 1.00 60.14 H new ATOM 0 HE ARG A 51 9.100 -5.875 0.750 1.00 11.22 H new ATOM 0 HH11 ARG A 51 10.292 -7.062 -2.312 1.00 1.24 H new ATOM 0 HH12 ARG A 51 11.972 -6.692 -1.907 1.00 1.24 H new ATOM 0 HH21 ARG A 51 11.199 -5.391 1.215 1.00 55.41 H new ATOM 0 HH22 ARG A 51 12.474 -5.764 0.051 1.00 55.41 H new ATOM 770 N CYS A 52 3.802 -8.506 -3.703 1.00 64.13 N ATOM 771 CA CYS A 52 2.418 -8.520 -4.241 1.00 62.51 C ATOM 772 C CYS A 52 1.415 -9.319 -3.387 1.00 22.24 C ATOM 773 O CYS A 52 0.217 -9.043 -3.423 1.00 31.24 O ATOM 774 CB CYS A 52 2.402 -9.079 -5.669 1.00 42.21 C ATOM 775 SG CYS A 52 2.839 -10.830 -5.792 1.00 32.21 S ATOM 0 H CYS A 52 4.518 -8.680 -4.409 1.00 64.13 H new ATOM 0 HA CYS A 52 2.096 -7.479 -4.224 1.00 62.51 H new ATOM 0 HB2 CYS A 52 1.407 -8.935 -6.091 1.00 42.21 H new ATOM 0 HB3 CYS A 52 3.095 -8.501 -6.280 1.00 42.21 H new ATOM 0 HG CYS A 52 4.093 -10.943 -6.118 1.00 32.21 H new ATOM 781 N THR A 53 1.892 -10.313 -2.636 1.00 34.21 N ATOM 782 CA THR A 53 1.014 -11.122 -1.773 1.00 41.34 C ATOM 783 C THR A 53 0.199 -10.240 -0.809 1.00 65.12 C ATOM 784 O THR A 53 -0.939 -10.567 -0.463 1.00 33.25 O ATOM 785 CB THR A 53 1.818 -12.159 -0.948 1.00 75.21 C ATOM 786 OG1 THR A 53 2.646 -12.954 -1.814 1.00 33.15 O ATOM 787 CG2 THR A 53 0.893 -13.080 -0.153 1.00 53.24 C ATOM 0 H THR A 53 2.876 -10.580 -2.604 1.00 34.21 H new ATOM 0 HA THR A 53 0.332 -11.650 -2.440 1.00 41.34 H new ATOM 0 HB THR A 53 2.443 -11.605 -0.248 1.00 75.21 H new ATOM 0 HG1 THR A 53 3.149 -13.603 -1.280 1.00 33.15 H new ATOM 0 HG21 THR A 53 1.490 -13.794 0.414 1.00 53.24 H new ATOM 0 HG22 THR A 53 0.290 -12.486 0.534 1.00 53.24 H new ATOM 0 HG23 THR A 53 0.238 -13.618 -0.839 1.00 53.24 H new ATOM 795 N GLY A 54 0.786 -9.119 -0.384 1.00 73.11 N ATOM 796 CA GLY A 54 0.082 -8.184 0.489 1.00 64.53 C ATOM 797 C GLY A 54 0.694 -6.784 0.497 1.00 13.21 C ATOM 798 O GLY A 54 1.916 -6.627 0.554 1.00 12.32 O ATOM 0 H GLY A 54 1.736 -8.841 -0.628 1.00 73.11 H new ATOM 0 HA2 GLY A 54 -0.959 -8.116 0.172 1.00 64.53 H new ATOM 0 HA3 GLY A 54 0.081 -8.578 1.505 1.00 64.53 H new ATOM 802 N LEU A 55 -0.158 -5.762 0.461 1.00 43.41 N ATOM 803 CA LEU A 55 0.297 -4.367 0.481 1.00 50.11 C ATOM 804 C LEU A 55 -0.680 -3.469 1.257 1.00 65.42 C ATOM 805 O LEU A 55 -1.855 -3.800 1.420 1.00 44.10 O ATOM 806 CB LEU A 55 0.487 -3.826 -0.952 1.00 32.33 C ATOM 807 CG LEU A 55 -0.778 -3.768 -1.835 1.00 3.23 C ATOM 808 CD1 LEU A 55 -0.525 -2.928 -3.083 1.00 21.23 C ATOM 809 CD2 LEU A 55 -1.240 -5.171 -2.232 1.00 42.14 C ATOM 0 H LEU A 55 -1.171 -5.871 0.418 1.00 43.41 H new ATOM 0 HA LEU A 55 1.259 -4.348 0.993 1.00 50.11 H new ATOM 0 HB2 LEU A 55 0.904 -2.821 -0.886 1.00 32.33 H new ATOM 0 HB3 LEU A 55 1.228 -4.446 -1.456 1.00 32.33 H new ATOM 0 HG LEU A 55 -1.569 -3.300 -1.249 1.00 3.23 H new ATOM 0 HD11 LEU A 55 -1.429 -2.900 -3.692 1.00 21.23 H new ATOM 0 HD12 LEU A 55 -0.253 -1.914 -2.790 1.00 21.23 H new ATOM 0 HD13 LEU A 55 0.288 -3.369 -3.660 1.00 21.23 H new ATOM 0 HD21 LEU A 55 -2.133 -5.098 -2.853 1.00 42.14 H new ATOM 0 HD22 LEU A 55 -0.449 -5.670 -2.791 1.00 42.14 H new ATOM 0 HD23 LEU A 55 -1.469 -5.746 -1.335 1.00 42.14 H new ATOM 821 N VAL A 56 -0.185 -2.331 1.738 1.00 30.10 N ATOM 822 CA VAL A 56 -1.001 -1.375 2.493 1.00 4.42 C ATOM 823 C VAL A 56 -1.150 -0.048 1.724 1.00 4.52 C ATOM 824 O VAL A 56 -0.169 0.652 1.483 1.00 44.35 O ATOM 825 CB VAL A 56 -0.384 -1.103 3.890 1.00 24.32 C ATOM 826 CG1 VAL A 56 -1.220 -0.094 4.675 1.00 15.34 C ATOM 827 CG2 VAL A 56 -0.233 -2.408 4.671 1.00 33.03 C ATOM 0 H VAL A 56 0.786 -2.044 1.618 1.00 30.10 H new ATOM 0 HA VAL A 56 -1.988 -1.818 2.624 1.00 4.42 H new ATOM 0 HB VAL A 56 0.606 -0.672 3.744 1.00 24.32 H new ATOM 0 HG11 VAL A 56 -0.763 0.077 5.650 1.00 15.34 H new ATOM 0 HG12 VAL A 56 -1.265 0.846 4.126 1.00 15.34 H new ATOM 0 HG13 VAL A 56 -2.229 -0.484 4.810 1.00 15.34 H new ATOM 0 HG21 VAL A 56 0.201 -2.199 5.649 1.00 33.03 H new ATOM 0 HG22 VAL A 56 -1.212 -2.870 4.800 1.00 33.03 H new ATOM 0 HG23 VAL A 56 0.419 -3.087 4.122 1.00 33.03 H new ATOM 837 N ILE A 57 -2.382 0.293 1.345 1.00 65.34 N ATOM 838 CA ILE A 57 -2.645 1.489 0.536 1.00 54.12 C ATOM 839 C ILE A 57 -3.108 2.662 1.417 1.00 23.30 C ATOM 840 O ILE A 57 -4.168 2.600 2.037 1.00 53.15 O ATOM 841 CB ILE A 57 -3.726 1.223 -0.555 1.00 43.53 C ATOM 842 CG1 ILE A 57 -3.320 0.052 -1.481 1.00 1.12 C ATOM 843 CG2 ILE A 57 -3.980 2.492 -1.375 1.00 4.03 C ATOM 844 CD1 ILE A 57 -3.461 -1.323 -0.851 1.00 54.54 C ATOM 0 H ILE A 57 -3.217 -0.242 1.585 1.00 65.34 H new ATOM 0 HA ILE A 57 -1.705 1.746 0.047 1.00 54.12 H new ATOM 0 HB ILE A 57 -4.649 0.940 -0.048 1.00 43.53 H new ATOM 0 HG12 ILE A 57 -3.931 0.089 -2.383 1.00 1.12 H new ATOM 0 HG13 ILE A 57 -2.284 0.192 -1.791 1.00 1.12 H new ATOM 0 HG21 ILE A 57 -4.737 2.290 -2.133 1.00 4.03 H new ATOM 0 HG22 ILE A 57 -4.329 3.287 -0.716 1.00 4.03 H new ATOM 0 HG23 ILE A 57 -3.055 2.803 -1.860 1.00 4.03 H new ATOM 0 HD11 ILE A 57 -3.156 -2.085 -1.568 1.00 54.54 H new ATOM 0 HD12 ILE A 57 -2.829 -1.384 0.035 1.00 54.54 H new ATOM 0 HD13 ILE A 57 -4.500 -1.488 -0.567 1.00 54.54 H new ATOM 856 N GLY A 58 -2.302 3.722 1.474 1.00 62.24 N ATOM 857 CA GLY A 58 -2.655 4.899 2.270 1.00 62.15 C ATOM 858 C GLY A 58 -3.660 5.834 1.591 1.00 72.25 C ATOM 859 O GLY A 58 -4.354 6.591 2.268 1.00 44.43 O ATOM 0 H GLY A 58 -1.410 3.791 0.985 1.00 62.24 H new ATOM 0 HA2 GLY A 58 -3.068 4.569 3.223 1.00 62.15 H new ATOM 0 HA3 GLY A 58 -1.747 5.459 2.493 1.00 62.15 H new ATOM 863 N MET A 59 -3.718 5.785 0.252 1.00 34.13 N ATOM 864 CA MET A 59 -4.617 6.649 -0.539 1.00 64.05 C ATOM 865 C MET A 59 -4.182 8.133 -0.479 1.00 54.11 C ATOM 866 O MET A 59 -3.524 8.563 0.469 1.00 21.42 O ATOM 867 CB MET A 59 -6.077 6.460 -0.072 1.00 54.22 C ATOM 868 CG MET A 59 -7.120 7.230 -0.879 1.00 53.43 C ATOM 869 SD MET A 59 -7.164 8.990 -0.478 1.00 54.31 S ATOM 870 CE MET A 59 -7.706 8.941 1.230 1.00 33.51 C ATOM 0 H MET A 59 -3.150 5.153 -0.312 1.00 34.13 H new ATOM 0 HA MET A 59 -4.551 6.349 -1.585 1.00 64.05 H new ATOM 0 HB2 MET A 59 -6.320 5.398 -0.112 1.00 54.22 H new ATOM 0 HB3 MET A 59 -6.151 6.765 0.972 1.00 54.22 H new ATOM 0 HG2 MET A 59 -6.910 7.110 -1.942 1.00 53.43 H new ATOM 0 HG3 MET A 59 -8.104 6.797 -0.698 1.00 53.43 H new ATOM 0 HE1 MET A 59 -8.688 9.406 1.314 1.00 33.51 H new ATOM 0 HE2 MET A 59 -7.766 7.905 1.563 1.00 33.51 H new ATOM 0 HE3 MET A 59 -6.994 9.482 1.853 1.00 33.51 H new ATOM 880 N SER A 60 -4.529 8.907 -1.508 1.00 32.22 N ATOM 881 CA SER A 60 -4.131 10.323 -1.587 1.00 74.45 C ATOM 882 C SER A 60 -4.982 11.087 -2.615 1.00 14.31 C ATOM 883 O SER A 60 -5.387 10.518 -3.629 1.00 70.21 O ATOM 884 CB SER A 60 -2.641 10.438 -1.960 1.00 44.51 C ATOM 885 OG SER A 60 -2.219 11.794 -2.013 1.00 1.24 O ATOM 0 H SER A 60 -5.084 8.583 -2.300 1.00 32.22 H new ATOM 0 HA SER A 60 -4.296 10.769 -0.606 1.00 74.45 H new ATOM 0 HB2 SER A 60 -2.039 9.897 -1.229 1.00 44.51 H new ATOM 0 HB3 SER A 60 -2.470 9.965 -2.927 1.00 44.51 H new ATOM 0 HG SER A 60 -1.897 12.071 -1.130 1.00 1.24 H new ATOM 891 N PRO A 61 -5.267 12.387 -2.366 1.00 21.15 N ATOM 892 CA PRO A 61 -6.065 13.227 -3.287 1.00 61.13 C ATOM 893 C PRO A 61 -5.482 13.304 -4.711 1.00 61.01 C ATOM 894 O PRO A 61 -4.291 13.055 -4.920 1.00 41.34 O ATOM 895 CB PRO A 61 -6.040 14.619 -2.624 1.00 75.24 C ATOM 896 CG PRO A 61 -4.916 14.566 -1.641 1.00 23.01 C ATOM 897 CD PRO A 61 -4.854 13.141 -1.169 1.00 15.44 C ATOM 0 HA PRO A 61 -7.065 12.815 -3.424 1.00 61.13 H new ATOM 0 HB2 PRO A 61 -5.880 15.404 -3.363 1.00 75.24 H new ATOM 0 HB3 PRO A 61 -6.986 14.836 -2.128 1.00 75.24 H new ATOM 0 HG2 PRO A 61 -3.976 14.866 -2.105 1.00 23.01 H new ATOM 0 HG3 PRO A 61 -5.092 15.247 -0.808 1.00 23.01 H new ATOM 0 HD2 PRO A 61 -3.851 12.866 -0.843 1.00 15.44 H new ATOM 0 HD3 PRO A 61 -5.523 12.963 -0.327 1.00 15.44 H new ATOM 905 N ALA A 62 -6.330 13.690 -5.674 1.00 3.22 N ATOM 906 CA ALA A 62 -5.955 13.772 -7.099 1.00 61.25 C ATOM 907 C ALA A 62 -4.554 14.367 -7.337 1.00 21.04 C ATOM 908 O ALA A 62 -3.830 13.920 -8.232 1.00 43.00 O ATOM 909 CB ALA A 62 -6.997 14.586 -7.856 1.00 64.52 C ATOM 0 H ALA A 62 -7.298 13.955 -5.490 1.00 3.22 H new ATOM 0 HA ALA A 62 -5.921 12.748 -7.471 1.00 61.25 H new ATOM 0 HB1 ALA A 62 -6.718 14.645 -8.908 1.00 64.52 H new ATOM 0 HB2 ALA A 62 -7.971 14.105 -7.765 1.00 64.52 H new ATOM 0 HB3 ALA A 62 -7.048 15.591 -7.437 1.00 64.52 H new ATOM 915 N ALA A 63 -4.178 15.366 -6.531 1.00 31.25 N ATOM 916 CA ALA A 63 -2.864 16.021 -6.646 1.00 45.53 C ATOM 917 C ALA A 63 -1.711 15.003 -6.708 1.00 21.12 C ATOM 918 O ALA A 63 -0.824 15.102 -7.558 1.00 72.10 O ATOM 919 CB ALA A 63 -2.654 16.984 -5.481 1.00 33.22 C ATOM 0 H ALA A 63 -4.766 15.742 -5.787 1.00 31.25 H new ATOM 0 HA ALA A 63 -2.857 16.577 -7.584 1.00 45.53 H new ATOM 0 HB1 ALA A 63 -1.679 17.463 -5.576 1.00 33.22 H new ATOM 0 HB2 ALA A 63 -3.435 17.745 -5.492 1.00 33.22 H new ATOM 0 HB3 ALA A 63 -2.698 16.433 -4.541 1.00 33.22 H new ATOM 925 N SER A 64 -1.730 14.024 -5.805 1.00 40.22 N ATOM 926 CA SER A 64 -0.714 12.956 -5.795 1.00 21.12 C ATOM 927 C SER A 64 -1.229 11.687 -6.485 1.00 15.45 C ATOM 928 O SER A 64 -0.445 10.900 -7.022 1.00 32.43 O ATOM 929 CB SER A 64 -0.285 12.625 -4.358 1.00 53.32 C ATOM 930 OG SER A 64 0.305 13.747 -3.719 1.00 63.42 O ATOM 0 H SER A 64 -2.433 13.942 -5.070 1.00 40.22 H new ATOM 0 HA SER A 64 0.149 13.325 -6.349 1.00 21.12 H new ATOM 0 HB2 SER A 64 -1.151 12.293 -3.786 1.00 53.32 H new ATOM 0 HB3 SER A 64 0.424 11.798 -4.371 1.00 53.32 H new ATOM 0 HG SER A 64 0.565 13.504 -2.806 1.00 63.42 H new ATOM 936 N ALA A 65 -2.551 11.497 -6.473 1.00 41.44 N ATOM 937 CA ALA A 65 -3.183 10.326 -7.097 1.00 31.52 C ATOM 938 C ALA A 65 -2.800 10.192 -8.578 1.00 13.23 C ATOM 939 O ALA A 65 -2.697 9.083 -9.099 1.00 42.21 O ATOM 940 CB ALA A 65 -4.699 10.393 -6.946 1.00 15.33 C ATOM 0 H ALA A 65 -3.210 12.142 -6.036 1.00 41.44 H new ATOM 0 HA ALA A 65 -2.813 9.441 -6.579 1.00 31.52 H new ATOM 0 HB1 ALA A 65 -5.150 9.518 -7.414 1.00 15.33 H new ATOM 0 HB2 ALA A 65 -4.959 10.413 -5.888 1.00 15.33 H new ATOM 0 HB3 ALA A 65 -5.073 11.296 -7.429 1.00 15.33 H new ATOM 946 N ALA A 66 -2.592 11.326 -9.250 1.00 55.04 N ATOM 947 CA ALA A 66 -2.111 11.326 -10.638 1.00 72.13 C ATOM 948 C ALA A 66 -0.751 10.614 -10.754 1.00 41.10 C ATOM 949 O ALA A 66 -0.549 9.772 -11.632 1.00 33.35 O ATOM 950 CB ALA A 66 -2.014 12.754 -11.165 1.00 11.43 C ATOM 0 H ALA A 66 -2.748 12.255 -8.859 1.00 55.04 H new ATOM 0 HA ALA A 66 -2.830 10.776 -11.246 1.00 72.13 H new ATOM 0 HB1 ALA A 66 -1.656 12.738 -12.195 1.00 11.43 H new ATOM 0 HB2 ALA A 66 -2.998 13.222 -11.130 1.00 11.43 H new ATOM 0 HB3 ALA A 66 -1.319 13.323 -10.548 1.00 11.43 H new ATOM 956 N SER A 67 0.168 10.942 -9.841 1.00 75.11 N ATOM 957 CA SER A 67 1.497 10.304 -9.805 1.00 63.33 C ATOM 958 C SER A 67 1.377 8.796 -9.537 1.00 15.21 C ATOM 959 O SER A 67 2.167 7.993 -10.039 1.00 30.22 O ATOM 960 CB SER A 67 2.380 10.953 -8.723 1.00 52.14 C ATOM 961 OG SER A 67 3.689 10.397 -8.708 1.00 11.10 O ATOM 0 H SER A 67 0.021 11.644 -9.116 1.00 75.11 H new ATOM 0 HA SER A 67 1.961 10.450 -10.780 1.00 63.33 H new ATOM 0 HB2 SER A 67 2.443 12.027 -8.901 1.00 52.14 H new ATOM 0 HB3 SER A 67 1.916 10.818 -7.746 1.00 52.14 H new ATOM 0 HG SER A 67 4.222 10.833 -8.011 1.00 11.10 H new ATOM 967 N ILE A 68 0.376 8.423 -8.743 1.00 11.15 N ATOM 968 CA ILE A 68 0.098 7.016 -8.436 1.00 43.22 C ATOM 969 C ILE A 68 -0.564 6.308 -9.627 1.00 35.34 C ATOM 970 O ILE A 68 -0.242 5.164 -9.942 1.00 35.11 O ATOM 971 CB ILE A 68 -0.846 6.890 -7.210 1.00 41.35 C ATOM 972 CG1 ILE A 68 -0.278 7.659 -6.008 1.00 54.33 C ATOM 973 CG2 ILE A 68 -1.075 5.418 -6.852 1.00 12.14 C ATOM 974 CD1 ILE A 68 -1.196 7.666 -4.801 1.00 31.12 C ATOM 0 H ILE A 68 -0.263 9.080 -8.295 1.00 11.15 H new ATOM 0 HA ILE A 68 1.056 6.546 -8.216 1.00 43.22 H new ATOM 0 HB ILE A 68 -1.808 7.330 -7.473 1.00 41.35 H new ATOM 0 HG12 ILE A 68 0.678 7.218 -5.724 1.00 54.33 H new ATOM 0 HG13 ILE A 68 -0.078 8.688 -6.307 1.00 54.33 H new ATOM 0 HG21 ILE A 68 -1.739 5.352 -5.990 1.00 12.14 H new ATOM 0 HG22 ILE A 68 -1.528 4.904 -7.700 1.00 12.14 H new ATOM 0 HG23 ILE A 68 -0.121 4.949 -6.611 1.00 12.14 H new ATOM 0 HD11 ILE A 68 -0.729 8.227 -3.992 1.00 31.12 H new ATOM 0 HD12 ILE A 68 -2.144 8.134 -5.067 1.00 31.12 H new ATOM 0 HD13 ILE A 68 -1.376 6.642 -4.475 1.00 31.12 H new ATOM 986 N GLN A 69 -1.478 7.017 -10.290 1.00 55.11 N ATOM 987 CA GLN A 69 -2.319 6.450 -11.353 1.00 25.02 C ATOM 988 C GLN A 69 -1.495 5.750 -12.448 1.00 63.23 C ATOM 989 O GLN A 69 -1.835 4.644 -12.877 1.00 2.40 O ATOM 990 CB GLN A 69 -3.184 7.561 -11.963 1.00 12.24 C ATOM 991 CG GLN A 69 -4.236 7.067 -12.946 1.00 15.20 C ATOM 992 CD GLN A 69 -5.046 8.205 -13.544 1.00 43.02 C ATOM 993 OE1 GLN A 69 -4.685 8.763 -14.574 1.00 24.53 O ATOM 994 NE2 GLN A 69 -6.140 8.561 -12.904 1.00 30.23 N ATOM 0 H GLN A 69 -1.659 8.004 -10.107 1.00 55.11 H new ATOM 0 HA GLN A 69 -2.953 5.686 -10.903 1.00 25.02 H new ATOM 0 HB2 GLN A 69 -3.681 8.102 -11.158 1.00 12.24 H new ATOM 0 HB3 GLN A 69 -2.534 8.273 -12.472 1.00 12.24 H new ATOM 0 HG2 GLN A 69 -3.749 6.511 -13.747 1.00 15.20 H new ATOM 0 HG3 GLN A 69 -4.907 6.374 -12.439 1.00 15.20 H new ATOM 0 HE21 GLN A 69 -6.412 8.075 -12.049 1.00 30.23 H new ATOM 0 HE22 GLN A 69 -6.716 9.322 -13.263 1.00 30.23 H new ATOM 1003 N GLY A 70 -0.410 6.391 -12.888 1.00 51.41 N ATOM 1004 CA GLY A 70 0.462 5.792 -13.901 1.00 63.10 C ATOM 1005 C GLY A 70 0.963 4.400 -13.506 1.00 62.44 C ATOM 1006 O GLY A 70 0.966 3.472 -14.316 1.00 63.33 O ATOM 0 H GLY A 70 -0.117 7.313 -12.564 1.00 51.41 H new ATOM 0 HA2 GLY A 70 -0.079 5.724 -14.845 1.00 63.10 H new ATOM 0 HA3 GLY A 70 1.317 6.446 -14.070 1.00 63.10 H new ATOM 1010 N ALA A 71 1.375 4.254 -12.249 1.00 74.40 N ATOM 1011 CA ALA A 71 1.814 2.959 -11.719 1.00 22.12 C ATOM 1012 C ALA A 71 0.610 2.058 -11.403 1.00 65.43 C ATOM 1013 O ALA A 71 0.663 0.841 -11.586 1.00 44.20 O ATOM 1014 CB ALA A 71 2.670 3.162 -10.472 1.00 53.14 C ATOM 0 H ALA A 71 1.415 5.018 -11.574 1.00 74.40 H new ATOM 0 HA ALA A 71 2.416 2.464 -12.481 1.00 22.12 H new ATOM 0 HB1 ALA A 71 2.989 2.193 -10.088 1.00 53.14 H new ATOM 0 HB2 ALA A 71 3.546 3.759 -10.725 1.00 53.14 H new ATOM 0 HB3 ALA A 71 2.087 3.679 -9.710 1.00 53.14 H new ATOM 1020 N LEU A 72 -0.480 2.675 -10.952 1.00 62.13 N ATOM 1021 CA LEU A 72 -1.709 1.961 -10.587 1.00 11.13 C ATOM 1022 C LEU A 72 -2.232 1.117 -11.759 1.00 33.13 C ATOM 1023 O LEU A 72 -2.632 -0.035 -11.574 1.00 65.24 O ATOM 1024 CB LEU A 72 -2.765 2.978 -10.108 1.00 0.21 C ATOM 1025 CG LEU A 72 -4.148 2.413 -9.713 1.00 15.14 C ATOM 1026 CD1 LEU A 72 -4.800 3.287 -8.643 1.00 43.32 C ATOM 1027 CD2 LEU A 72 -5.072 2.307 -10.930 1.00 52.23 C ATOM 0 H LEU A 72 -0.540 3.686 -10.828 1.00 62.13 H new ATOM 0 HA LEU A 72 -1.491 1.269 -9.773 1.00 11.13 H new ATOM 0 HB2 LEU A 72 -2.358 3.511 -9.249 1.00 0.21 H new ATOM 0 HB3 LEU A 72 -2.912 3.713 -10.899 1.00 0.21 H new ATOM 0 HG LEU A 72 -3.992 1.412 -9.310 1.00 15.14 H new ATOM 0 HD11 LEU A 72 -5.773 2.873 -8.378 1.00 43.32 H new ATOM 0 HD12 LEU A 72 -4.164 3.314 -7.758 1.00 43.32 H new ATOM 0 HD13 LEU A 72 -4.929 4.298 -9.028 1.00 43.32 H new ATOM 0 HD21 LEU A 72 -6.037 1.906 -10.620 1.00 52.23 H new ATOM 0 HD22 LEU A 72 -5.213 3.296 -11.367 1.00 52.23 H new ATOM 0 HD23 LEU A 72 -4.624 1.643 -11.670 1.00 52.23 H new ATOM 1039 N SER A 73 -2.206 1.692 -12.963 1.00 14.44 N ATOM 1040 CA SER A 73 -2.603 0.968 -14.184 1.00 30.34 C ATOM 1041 C SER A 73 -1.835 -0.358 -14.316 1.00 73.41 C ATOM 1042 O SER A 73 -2.366 -1.359 -14.800 1.00 2.01 O ATOM 1043 CB SER A 73 -2.354 1.839 -15.426 1.00 22.44 C ATOM 1044 OG SER A 73 -2.725 1.162 -16.617 1.00 62.11 O ATOM 0 H SER A 73 -1.915 2.656 -13.124 1.00 14.44 H new ATOM 0 HA SER A 73 -3.667 0.744 -14.109 1.00 30.34 H new ATOM 0 HB2 SER A 73 -2.921 2.766 -15.341 1.00 22.44 H new ATOM 0 HB3 SER A 73 -1.300 2.113 -15.475 1.00 22.44 H new ATOM 0 HG SER A 73 -2.556 1.742 -17.389 1.00 62.11 H new ATOM 1050 N THR A 74 -0.584 -0.357 -13.859 1.00 61.51 N ATOM 1051 CA THR A 74 0.258 -1.559 -13.886 1.00 12.24 C ATOM 1052 C THR A 74 -0.027 -2.467 -12.677 1.00 74.22 C ATOM 1053 O THR A 74 -0.115 -3.691 -12.812 1.00 55.43 O ATOM 1054 CB THR A 74 1.765 -1.187 -13.907 1.00 73.44 C ATOM 1055 OG1 THR A 74 2.068 -0.421 -15.087 1.00 64.24 O ATOM 1056 CG2 THR A 74 2.651 -2.430 -13.870 1.00 63.42 C ATOM 0 H THR A 74 -0.127 0.465 -13.464 1.00 61.51 H new ATOM 0 HA THR A 74 0.013 -2.100 -14.800 1.00 12.24 H new ATOM 0 HB THR A 74 1.970 -0.593 -13.016 1.00 73.44 H new ATOM 0 HG1 THR A 74 3.020 -0.189 -15.091 1.00 64.24 H new ATOM 0 HG21 THR A 74 3.699 -2.130 -13.886 1.00 63.42 H new ATOM 0 HG22 THR A 74 2.449 -2.994 -12.960 1.00 63.42 H new ATOM 0 HG23 THR A 74 2.439 -3.054 -14.738 1.00 63.42 H new ATOM 1064 N ILE A 75 -0.193 -1.856 -11.502 1.00 43.41 N ATOM 1065 CA ILE A 75 -0.443 -2.597 -10.255 1.00 4.32 C ATOM 1066 C ILE A 75 -1.698 -3.484 -10.352 1.00 2.43 C ATOM 1067 O ILE A 75 -1.682 -4.642 -9.932 1.00 33.52 O ATOM 1068 CB ILE A 75 -0.594 -1.628 -9.050 1.00 12.14 C ATOM 1069 CG1 ILE A 75 0.684 -0.787 -8.871 1.00 70.12 C ATOM 1070 CG2 ILE A 75 -0.912 -2.400 -7.764 1.00 33.41 C ATOM 1071 CD1 ILE A 75 0.576 0.269 -7.789 1.00 72.01 C ATOM 0 H ILE A 75 -0.159 -0.843 -11.384 1.00 43.41 H new ATOM 0 HA ILE A 75 0.423 -3.240 -10.098 1.00 4.32 H new ATOM 0 HB ILE A 75 -1.426 -0.956 -9.257 1.00 12.14 H new ATOM 0 HG12 ILE A 75 1.515 -1.452 -8.635 1.00 70.12 H new ATOM 0 HG13 ILE A 75 0.923 -0.301 -9.817 1.00 70.12 H new ATOM 0 HG21 ILE A 75 -1.013 -1.700 -6.935 1.00 33.41 H new ATOM 0 HG22 ILE A 75 -1.845 -2.949 -7.891 1.00 33.41 H new ATOM 0 HG23 ILE A 75 -0.104 -3.100 -7.551 1.00 33.41 H new ATOM 0 HD11 ILE A 75 1.514 0.819 -7.723 1.00 72.01 H new ATOM 0 HD12 ILE A 75 -0.233 0.958 -8.033 1.00 72.01 H new ATOM 0 HD13 ILE A 75 0.368 -0.210 -6.832 1.00 72.01 H new ATOM 1083 N LEU A 76 -2.774 -2.946 -10.927 1.00 32.32 N ATOM 1084 CA LEU A 76 -4.039 -3.689 -11.060 1.00 10.23 C ATOM 1085 C LEU A 76 -3.884 -4.958 -11.922 1.00 44.34 C ATOM 1086 O LEU A 76 -4.714 -5.868 -11.856 1.00 44.30 O ATOM 1087 CB LEU A 76 -5.129 -2.787 -11.654 1.00 40.15 C ATOM 1088 CG LEU A 76 -5.493 -1.546 -10.820 1.00 72.24 C ATOM 1089 CD1 LEU A 76 -6.660 -0.794 -11.458 1.00 1.11 C ATOM 1090 CD2 LEU A 76 -5.817 -1.936 -9.378 1.00 53.33 C ATOM 0 H LEU A 76 -2.801 -2.001 -11.309 1.00 32.32 H new ATOM 0 HA LEU A 76 -4.330 -4.004 -10.058 1.00 10.23 H new ATOM 0 HB2 LEU A 76 -4.804 -2.457 -12.641 1.00 40.15 H new ATOM 0 HB3 LEU A 76 -6.030 -3.383 -11.798 1.00 40.15 H new ATOM 0 HG LEU A 76 -4.630 -0.881 -10.801 1.00 72.24 H new ATOM 0 HD11 LEU A 76 -6.903 0.080 -10.854 1.00 1.11 H new ATOM 0 HD12 LEU A 76 -6.382 -0.475 -12.463 1.00 1.11 H new ATOM 0 HD13 LEU A 76 -7.529 -1.450 -11.513 1.00 1.11 H new ATOM 0 HD21 LEU A 76 -6.071 -1.043 -8.808 1.00 53.33 H new ATOM 0 HD22 LEU A 76 -6.661 -2.625 -9.368 1.00 53.33 H new ATOM 0 HD23 LEU A 76 -4.950 -2.419 -8.928 1.00 53.33 H new ATOM 1102 N GLY A 77 -2.829 -5.006 -12.736 1.00 71.31 N ATOM 1103 CA GLY A 77 -2.544 -6.200 -13.531 1.00 10.52 C ATOM 1104 C GLY A 77 -1.731 -7.237 -12.760 1.00 42.01 C ATOM 1105 O GLY A 77 -1.645 -8.402 -13.159 1.00 62.44 O ATOM 0 H GLY A 77 -2.165 -4.242 -12.861 1.00 71.31 H new ATOM 0 HA2 GLY A 77 -3.483 -6.648 -13.856 1.00 10.52 H new ATOM 0 HA3 GLY A 77 -2.000 -5.912 -14.430 1.00 10.52 H new ATOM 1109 N SER A 78 -1.133 -6.809 -11.649 1.00 2.45 N ATOM 1110 CA SER A 78 -0.314 -7.692 -10.805 1.00 64.35 C ATOM 1111 C SER A 78 -1.103 -8.223 -9.596 1.00 14.12 C ATOM 1112 O SER A 78 -0.916 -9.368 -9.181 1.00 11.31 O ATOM 1113 CB SER A 78 0.943 -6.955 -10.317 1.00 42.32 C ATOM 1114 OG SER A 78 1.764 -6.561 -11.406 1.00 62.15 O ATOM 0 H SER A 78 -1.198 -5.850 -11.307 1.00 2.45 H new ATOM 0 HA SER A 78 -0.022 -8.544 -11.419 1.00 64.35 H new ATOM 0 HB2 SER A 78 0.652 -6.076 -9.742 1.00 42.32 H new ATOM 0 HB3 SER A 78 1.509 -7.602 -9.647 1.00 42.32 H new ATOM 0 HG SER A 78 2.555 -6.093 -11.067 1.00 62.15 H new ATOM 1120 N VAL A 79 -1.970 -7.386 -9.024 1.00 63.01 N ATOM 1121 CA VAL A 79 -2.772 -7.778 -7.854 1.00 2.21 C ATOM 1122 C VAL A 79 -4.248 -8.031 -8.221 1.00 70.43 C ATOM 1123 O VAL A 79 -4.924 -7.167 -8.782 1.00 14.23 O ATOM 1124 CB VAL A 79 -2.688 -6.718 -6.722 1.00 54.43 C ATOM 1125 CG1 VAL A 79 -1.259 -6.601 -6.201 1.00 33.45 C ATOM 1126 CG2 VAL A 79 -3.207 -5.357 -7.192 1.00 73.35 C ATOM 0 H VAL A 79 -2.138 -6.433 -9.348 1.00 63.01 H new ATOM 0 HA VAL A 79 -2.345 -8.713 -7.492 1.00 2.21 H new ATOM 0 HB VAL A 79 -3.328 -7.051 -5.905 1.00 54.43 H new ATOM 0 HG11 VAL A 79 -1.221 -5.854 -5.409 1.00 33.45 H new ATOM 0 HG12 VAL A 79 -0.935 -7.564 -5.807 1.00 33.45 H new ATOM 0 HG13 VAL A 79 -0.598 -6.301 -7.015 1.00 33.45 H new ATOM 0 HG21 VAL A 79 -3.134 -4.638 -6.376 1.00 73.35 H new ATOM 0 HG22 VAL A 79 -2.609 -5.011 -8.035 1.00 73.35 H new ATOM 0 HG23 VAL A 79 -4.248 -5.451 -7.501 1.00 73.35 H new ATOM 1136 N ASN A 80 -4.737 -9.232 -7.911 1.00 72.23 N ATOM 1137 CA ASN A 80 -6.121 -9.615 -8.215 1.00 72.02 C ATOM 1138 C ASN A 80 -6.581 -10.818 -7.369 1.00 44.05 C ATOM 1139 O ASN A 80 -5.889 -11.253 -6.445 1.00 34.31 O ATOM 1140 CB ASN A 80 -6.257 -9.946 -9.710 1.00 72.44 C ATOM 1141 CG ASN A 80 -5.316 -11.058 -10.148 1.00 35.44 C ATOM 1142 OD1 ASN A 80 -4.188 -10.809 -10.564 1.00 50.15 O ATOM 1143 ND2 ASN A 80 -5.766 -12.296 -10.064 1.00 21.42 N ATOM 0 H ASN A 80 -4.195 -9.961 -7.448 1.00 72.23 H new ATOM 0 HA ASN A 80 -6.761 -8.769 -7.966 1.00 72.02 H new ATOM 0 HB2 ASN A 80 -7.285 -10.240 -9.922 1.00 72.44 H new ATOM 0 HB3 ASN A 80 -6.054 -9.050 -10.297 1.00 72.44 H new ATOM 0 HD21 ASN A 80 -5.172 -13.075 -10.349 1.00 21.42 H new ATOM 0 HD22 ASN A 80 -6.708 -12.474 -9.715 1.00 21.42 H new ATOM 1150 N GLU A 81 -7.771 -11.330 -7.689 1.00 11.41 N ATOM 1151 CA GLU A 81 -8.290 -12.580 -7.115 1.00 61.22 C ATOM 1152 C GLU A 81 -8.659 -12.465 -5.619 1.00 3.04 C ATOM 1153 O GLU A 81 -9.810 -12.184 -5.286 1.00 35.53 O ATOM 1154 CB GLU A 81 -7.296 -13.729 -7.347 1.00 1.34 C ATOM 1155 CG GLU A 81 -7.812 -15.094 -6.913 1.00 45.04 C ATOM 1156 CD GLU A 81 -6.779 -16.186 -7.110 1.00 64.13 C ATOM 1157 OE1 GLU A 81 -6.729 -16.771 -8.211 1.00 51.52 O ATOM 1158 OE2 GLU A 81 -5.995 -16.450 -6.174 1.00 53.43 O ATOM 0 H GLU A 81 -8.406 -10.891 -8.355 1.00 11.41 H new ATOM 0 HA GLU A 81 -9.222 -12.797 -7.638 1.00 61.22 H new ATOM 0 HB2 GLU A 81 -7.043 -13.768 -8.407 1.00 1.34 H new ATOM 0 HB3 GLU A 81 -6.374 -13.512 -6.807 1.00 1.34 H new ATOM 0 HG2 GLU A 81 -8.100 -15.054 -5.863 1.00 45.04 H new ATOM 0 HG3 GLU A 81 -8.710 -15.339 -7.481 1.00 45.04 H new ATOM 1165 N LYS A 82 -7.694 -12.673 -4.716 1.00 65.23 N ATOM 1166 CA LYS A 82 -8.019 -12.780 -3.281 1.00 74.23 C ATOM 1167 C LYS A 82 -6.841 -12.422 -2.351 1.00 24.24 C ATOM 1168 O LYS A 82 -6.950 -12.570 -1.129 1.00 33.51 O ATOM 1169 CB LYS A 82 -8.506 -14.208 -2.982 1.00 71.22 C ATOM 1170 CG LYS A 82 -7.450 -15.285 -3.235 1.00 70.02 C ATOM 1171 CD LYS A 82 -8.069 -16.666 -3.446 1.00 64.13 C ATOM 1172 CE LYS A 82 -8.875 -17.142 -2.244 1.00 2.34 C ATOM 1173 NZ LYS A 82 -9.475 -18.482 -2.485 1.00 63.52 N ATOM 0 H LYS A 82 -6.704 -12.769 -4.941 1.00 65.23 H new ATOM 0 HA LYS A 82 -8.801 -12.049 -3.075 1.00 74.23 H new ATOM 0 HB2 LYS A 82 -8.825 -14.263 -1.941 1.00 71.22 H new ATOM 0 HB3 LYS A 82 -9.382 -14.419 -3.596 1.00 71.22 H new ATOM 0 HG2 LYS A 82 -6.862 -15.015 -4.112 1.00 70.02 H new ATOM 0 HG3 LYS A 82 -6.763 -15.323 -2.390 1.00 70.02 H new ATOM 0 HD2 LYS A 82 -8.715 -16.639 -4.323 1.00 64.13 H new ATOM 0 HD3 LYS A 82 -7.278 -17.386 -3.655 1.00 64.13 H new ATOM 0 HE2 LYS A 82 -8.230 -17.184 -1.366 1.00 2.34 H new ATOM 0 HE3 LYS A 82 -9.664 -16.423 -2.026 1.00 2.34 H new ATOM 0 HZ1 LYS A 82 -10.017 -18.776 -1.647 1.00 63.52 H new ATOM 0 HZ2 LYS A 82 -10.109 -18.436 -3.308 1.00 63.52 H new ATOM 0 HZ3 LYS A 82 -8.719 -19.173 -2.668 1.00 63.52 H new ATOM 1187 N GLN A 83 -5.728 -11.937 -2.910 1.00 30.52 N ATOM 1188 CA GLN A 83 -4.555 -11.568 -2.094 1.00 2.41 C ATOM 1189 C GLN A 83 -4.854 -10.378 -1.152 1.00 12.42 C ATOM 1190 O GLN A 83 -5.960 -9.828 -1.154 1.00 42.15 O ATOM 1191 CB GLN A 83 -3.331 -11.303 -2.996 1.00 21.21 C ATOM 1192 CG GLN A 83 -3.640 -10.519 -4.267 1.00 30.32 C ATOM 1193 CD GLN A 83 -2.527 -10.606 -5.305 1.00 64.33 C ATOM 1194 OE1 GLN A 83 -2.779 -10.607 -6.502 1.00 62.31 O ATOM 1195 NE2 GLN A 83 -1.288 -10.656 -4.863 1.00 64.22 N ATOM 0 H GLN A 83 -5.609 -11.790 -3.912 1.00 30.52 H new ATOM 0 HA GLN A 83 -4.316 -12.413 -1.448 1.00 2.41 H new ATOM 0 HB2 GLN A 83 -2.583 -10.758 -2.421 1.00 21.21 H new ATOM 0 HB3 GLN A 83 -2.886 -12.259 -3.273 1.00 21.21 H new ATOM 0 HG2 GLN A 83 -4.566 -10.894 -4.703 1.00 30.32 H new ATOM 0 HG3 GLN A 83 -3.809 -9.473 -4.010 1.00 30.32 H new ATOM 0 HE21 GLN A 83 -1.104 -10.654 -3.860 1.00 64.22 H new ATOM 0 HE22 GLN A 83 -0.512 -10.697 -5.524 1.00 64.22 H new ATOM 1204 N ALA A 84 -3.870 -9.992 -0.341 1.00 13.11 N ATOM 1205 CA ALA A 84 -4.100 -9.054 0.769 1.00 74.04 C ATOM 1206 C ALA A 84 -3.916 -7.576 0.371 1.00 4.53 C ATOM 1207 O ALA A 84 -2.859 -7.172 -0.113 1.00 71.12 O ATOM 1208 CB ALA A 84 -3.179 -9.406 1.931 1.00 61.11 C ATOM 0 H ALA A 84 -2.905 -10.311 -0.427 1.00 13.11 H new ATOM 0 HA ALA A 84 -5.143 -9.161 1.066 1.00 74.04 H new ATOM 0 HB1 ALA A 84 -3.349 -8.711 2.753 1.00 61.11 H new ATOM 0 HB2 ALA A 84 -3.387 -10.422 2.265 1.00 61.11 H new ATOM 0 HB3 ALA A 84 -2.141 -9.337 1.606 1.00 61.11 H new ATOM 1214 N VAL A 85 -4.956 -6.773 0.613 1.00 33.12 N ATOM 1215 CA VAL A 85 -4.920 -5.326 0.356 1.00 73.42 C ATOM 1216 C VAL A 85 -5.431 -4.520 1.572 1.00 72.34 C ATOM 1217 O VAL A 85 -6.635 -4.433 1.832 1.00 31.40 O ATOM 1218 CB VAL A 85 -5.741 -4.949 -0.911 1.00 33.22 C ATOM 1219 CG1 VAL A 85 -5.035 -5.435 -2.175 1.00 30.23 C ATOM 1220 CG2 VAL A 85 -7.161 -5.519 -0.839 1.00 51.32 C ATOM 0 H VAL A 85 -5.844 -7.103 0.991 1.00 33.12 H new ATOM 0 HA VAL A 85 -3.876 -5.065 0.182 1.00 73.42 H new ATOM 0 HB VAL A 85 -5.814 -3.862 -0.950 1.00 33.22 H new ATOM 0 HG11 VAL A 85 -5.625 -5.161 -3.050 1.00 30.23 H new ATOM 0 HG12 VAL A 85 -4.050 -4.972 -2.243 1.00 30.23 H new ATOM 0 HG13 VAL A 85 -4.925 -6.519 -2.136 1.00 30.23 H new ATOM 0 HG21 VAL A 85 -7.711 -5.240 -1.738 1.00 51.32 H new ATOM 0 HG22 VAL A 85 -7.114 -6.605 -0.766 1.00 51.32 H new ATOM 0 HG23 VAL A 85 -7.670 -5.118 0.037 1.00 51.32 H new ATOM 1230 N GLY A 86 -4.500 -3.943 2.331 1.00 32.44 N ATOM 1231 CA GLY A 86 -4.858 -3.154 3.508 1.00 0.12 C ATOM 1232 C GLY A 86 -4.920 -1.657 3.219 1.00 55.41 C ATOM 1233 O GLY A 86 -3.908 -0.969 3.264 1.00 44.15 O ATOM 0 H GLY A 86 -3.498 -4.007 2.153 1.00 32.44 H new ATOM 0 HA2 GLY A 86 -5.826 -3.488 3.883 1.00 0.12 H new ATOM 0 HA3 GLY A 86 -4.130 -3.337 4.298 1.00 0.12 H new ATOM 1237 N ILE A 87 -6.109 -1.150 2.916 1.00 21.24 N ATOM 1238 CA ILE A 87 -6.283 0.269 2.579 1.00 61.34 C ATOM 1239 C ILE A 87 -6.797 1.092 3.777 1.00 54.55 C ATOM 1240 O ILE A 87 -7.657 0.637 4.535 1.00 75.24 O ATOM 1241 CB ILE A 87 -7.250 0.434 1.375 1.00 63.35 C ATOM 1242 CG1 ILE A 87 -7.403 1.919 0.993 1.00 24.44 C ATOM 1243 CG2 ILE A 87 -8.613 -0.192 1.682 1.00 33.11 C ATOM 1244 CD1 ILE A 87 -8.280 2.157 -0.219 1.00 54.45 C ATOM 0 H ILE A 87 -6.971 -1.695 2.895 1.00 21.24 H new ATOM 0 HA ILE A 87 -5.299 0.652 2.307 1.00 61.34 H new ATOM 0 HB ILE A 87 -6.820 -0.091 0.522 1.00 63.35 H new ATOM 0 HG12 ILE A 87 -7.820 2.461 1.842 1.00 24.44 H new ATOM 0 HG13 ILE A 87 -6.415 2.338 0.802 1.00 24.44 H new ATOM 0 HG21 ILE A 87 -9.274 -0.064 0.824 1.00 33.11 H new ATOM 0 HG22 ILE A 87 -8.487 -1.255 1.888 1.00 33.11 H new ATOM 0 HG23 ILE A 87 -9.050 0.297 2.553 1.00 33.11 H new ATOM 0 HD11 ILE A 87 -8.337 3.226 -0.422 1.00 54.45 H new ATOM 0 HD12 ILE A 87 -7.854 1.646 -1.082 1.00 54.45 H new ATOM 0 HD13 ILE A 87 -9.281 1.771 -0.026 1.00 54.45 H new ATOM 1256 N PHE A 88 -6.246 2.297 3.945 1.00 71.10 N ATOM 1257 CA PHE A 88 -6.715 3.248 4.964 1.00 41.24 C ATOM 1258 C PHE A 88 -6.792 4.667 4.373 1.00 35.43 C ATOM 1259 O PHE A 88 -6.495 4.869 3.195 1.00 52.51 O ATOM 1260 CB PHE A 88 -5.810 3.221 6.212 1.00 71.31 C ATOM 1261 CG PHE A 88 -4.394 3.697 5.986 1.00 31.55 C ATOM 1262 CD1 PHE A 88 -3.418 2.825 5.526 1.00 40.15 C ATOM 1263 CD2 PHE A 88 -4.037 5.013 6.252 1.00 0.54 C ATOM 1264 CE1 PHE A 88 -2.120 3.256 5.332 1.00 31.15 C ATOM 1265 CE2 PHE A 88 -2.739 5.446 6.061 1.00 31.02 C ATOM 1266 CZ PHE A 88 -1.780 4.568 5.601 1.00 11.32 C ATOM 0 H PHE A 88 -5.467 2.642 3.384 1.00 71.10 H new ATOM 0 HA PHE A 88 -7.715 2.947 5.276 1.00 41.24 H new ATOM 0 HB2 PHE A 88 -6.266 3.839 6.986 1.00 71.31 H new ATOM 0 HB3 PHE A 88 -5.777 2.202 6.596 1.00 71.31 H new ATOM 0 HD1 PHE A 88 -3.676 1.797 5.317 1.00 40.15 H new ATOM 0 HD2 PHE A 88 -4.783 5.706 6.612 1.00 0.54 H new ATOM 0 HE1 PHE A 88 -1.371 2.567 4.970 1.00 31.15 H new ATOM 0 HE2 PHE A 88 -2.475 6.472 6.272 1.00 31.02 H new ATOM 0 HZ PHE A 88 -0.765 4.905 5.451 1.00 11.32 H new ATOM 1276 N GLU A 89 -7.191 5.647 5.183 1.00 73.31 N ATOM 1277 CA GLU A 89 -7.433 7.010 4.681 1.00 51.52 C ATOM 1278 C GLU A 89 -6.428 8.046 5.218 1.00 20.41 C ATOM 1279 O GLU A 89 -6.130 8.086 6.414 1.00 23.13 O ATOM 1280 CB GLU A 89 -8.851 7.461 5.051 1.00 33.34 C ATOM 1281 CG GLU A 89 -9.953 6.547 4.528 1.00 12.31 C ATOM 1282 CD GLU A 89 -11.335 7.022 4.938 1.00 34.23 C ATOM 1283 OE1 GLU A 89 -11.750 6.748 6.083 1.00 24.15 O ATOM 1284 OE2 GLU A 89 -12.010 7.688 4.125 1.00 55.34 O ATOM 0 H GLU A 89 -7.354 5.530 6.183 1.00 73.31 H new ATOM 0 HA GLU A 89 -7.308 6.962 3.599 1.00 51.52 H new ATOM 0 HB2 GLU A 89 -8.929 7.522 6.136 1.00 33.34 H new ATOM 0 HB3 GLU A 89 -9.013 8.467 4.663 1.00 33.34 H new ATOM 0 HG2 GLU A 89 -9.896 6.497 3.441 1.00 12.31 H new ATOM 0 HG3 GLU A 89 -9.792 5.536 4.902 1.00 12.31 H new ATOM 1291 N THR A 90 -5.920 8.886 4.313 1.00 33.01 N ATOM 1292 CA THR A 90 -5.129 10.070 4.681 1.00 51.01 C ATOM 1293 C THR A 90 -5.216 11.149 3.587 1.00 11.22 C ATOM 1294 O THR A 90 -5.051 10.861 2.402 1.00 44.33 O ATOM 1295 CB THR A 90 -3.635 9.732 4.947 1.00 20.33 C ATOM 1296 OG1 THR A 90 -2.902 10.933 5.252 1.00 50.30 O ATOM 1297 CG2 THR A 90 -2.991 9.033 3.751 1.00 50.03 C ATOM 0 H THR A 90 -6.043 8.768 3.307 1.00 33.01 H new ATOM 0 HA THR A 90 -5.559 10.447 5.609 1.00 51.01 H new ATOM 0 HB THR A 90 -3.600 9.051 5.798 1.00 20.33 H new ATOM 0 HG1 THR A 90 -2.073 10.700 5.721 1.00 50.30 H new ATOM 0 HG21 THR A 90 -1.947 8.814 3.976 1.00 50.03 H new ATOM 0 HG22 THR A 90 -3.521 8.103 3.544 1.00 50.03 H new ATOM 0 HG23 THR A 90 -3.045 9.683 2.878 1.00 50.03 H new ATOM 1305 N GLY A 91 -5.509 12.389 3.981 1.00 52.11 N ATOM 1306 CA GLY A 91 -5.595 13.488 3.017 1.00 32.45 C ATOM 1307 C GLY A 91 -6.977 13.633 2.377 1.00 72.34 C ATOM 1308 O GLY A 91 -7.607 14.687 2.479 1.00 30.31 O ATOM 0 H GLY A 91 -5.689 12.656 4.949 1.00 52.11 H new ATOM 0 HA2 GLY A 91 -5.336 14.421 3.518 1.00 32.45 H new ATOM 0 HA3 GLY A 91 -4.855 13.331 2.232 1.00 32.45 H new ATOM 1312 N GLY A 92 -7.438 12.580 1.703 1.00 74.41 N ATOM 1313 CA GLY A 92 -8.765 12.590 1.081 1.00 3.41 C ATOM 1314 C GLY A 92 -8.917 13.665 0.004 1.00 11.00 C ATOM 1315 O GLY A 92 -8.505 13.471 -1.139 1.00 32.03 O ATOM 0 H GLY A 92 -6.917 11.713 1.573 1.00 74.41 H new ATOM 0 HA2 GLY A 92 -8.960 11.613 0.640 1.00 3.41 H new ATOM 0 HA3 GLY A 92 -9.519 12.748 1.852 1.00 3.41 H new ATOM 1319 N GLY A 93 -9.517 14.797 0.370 1.00 2.23 N ATOM 1320 CA GLY A 93 -9.657 15.916 -0.560 1.00 34.44 C ATOM 1321 C GLY A 93 -10.601 15.634 -1.731 1.00 72.21 C ATOM 1322 O GLY A 93 -11.749 15.224 -1.536 1.00 31.10 O ATOM 0 H GLY A 93 -9.911 14.963 1.296 1.00 2.23 H new ATOM 0 HA2 GLY A 93 -10.021 16.786 -0.014 1.00 34.44 H new ATOM 0 HA3 GLY A 93 -8.674 16.175 -0.953 1.00 34.44 H new ATOM 1326 N ASP A 94 -10.125 15.870 -2.953 1.00 63.23 N ATOM 1327 CA ASP A 94 -10.946 15.684 -4.158 1.00 73.33 C ATOM 1328 C ASP A 94 -10.298 14.701 -5.147 1.00 30.22 C ATOM 1329 O ASP A 94 -9.093 14.770 -5.408 1.00 14.33 O ATOM 1330 CB ASP A 94 -11.171 17.032 -4.852 1.00 61.42 C ATOM 1331 CG ASP A 94 -11.901 18.028 -3.968 1.00 31.32 C ATOM 1332 OD1 ASP A 94 -13.148 18.020 -3.964 1.00 75.10 O ATOM 1333 OD2 ASP A 94 -11.234 18.826 -3.280 1.00 43.13 O ATOM 0 H ASP A 94 -9.175 16.191 -3.139 1.00 63.23 H new ATOM 0 HA ASP A 94 -11.901 15.264 -3.842 1.00 73.33 H new ATOM 0 HB2 ASP A 94 -10.208 17.450 -5.147 1.00 61.42 H new ATOM 0 HB3 ASP A 94 -11.744 16.875 -5.766 1.00 61.42 H new ATOM 1338 N ASP A 95 -11.111 13.797 -5.696 1.00 42.10 N ATOM 1339 CA ASP A 95 -10.661 12.854 -6.726 1.00 64.22 C ATOM 1340 C ASP A 95 -11.860 12.137 -7.369 1.00 2.12 C ATOM 1341 O ASP A 95 -12.864 11.875 -6.705 1.00 44.14 O ATOM 1342 CB ASP A 95 -9.683 11.827 -6.145 1.00 31.21 C ATOM 1343 CG ASP A 95 -9.152 10.888 -7.214 1.00 25.54 C ATOM 1344 OD1 ASP A 95 -8.240 11.298 -7.968 1.00 2.11 O ATOM 1345 OD2 ASP A 95 -9.675 9.761 -7.331 1.00 35.43 O ATOM 0 H ASP A 95 -12.094 13.696 -5.443 1.00 42.10 H new ATOM 0 HA ASP A 95 -10.141 13.426 -7.495 1.00 64.22 H new ATOM 0 HB2 ASP A 95 -8.850 12.346 -5.670 1.00 31.21 H new ATOM 0 HB3 ASP A 95 -10.182 11.248 -5.368 1.00 31.21 H new ATOM 1350 N GLU A 96 -11.757 11.844 -8.664 1.00 72.21 N ATOM 1351 CA GLU A 96 -12.836 11.167 -9.403 1.00 73.11 C ATOM 1352 C GLU A 96 -12.533 9.669 -9.658 1.00 24.51 C ATOM 1353 O GLU A 96 -13.426 8.828 -9.510 1.00 24.44 O ATOM 1354 CB GLU A 96 -13.123 11.883 -10.734 1.00 74.40 C ATOM 1355 CG GLU A 96 -13.720 13.283 -10.587 1.00 40.34 C ATOM 1356 CD GLU A 96 -12.748 14.296 -10.001 1.00 62.11 C ATOM 1357 OE1 GLU A 96 -11.757 14.633 -10.682 1.00 33.14 O ATOM 1358 OE2 GLU A 96 -12.968 14.765 -8.864 1.00 61.31 O ATOM 0 H GLU A 96 -10.937 12.063 -9.230 1.00 72.21 H new ATOM 0 HA GLU A 96 -13.723 11.217 -8.772 1.00 73.11 H new ATOM 0 HB2 GLU A 96 -12.194 11.956 -11.300 1.00 74.40 H new ATOM 0 HB3 GLU A 96 -13.807 11.270 -11.321 1.00 74.40 H new ATOM 0 HG2 GLU A 96 -14.052 13.633 -11.564 1.00 40.34 H new ATOM 0 HG3 GLU A 96 -14.603 13.228 -9.951 1.00 40.34 H new ATOM 1365 N PRO A 97 -11.289 9.303 -10.082 1.00 14.41 N ATOM 1366 CA PRO A 97 -10.875 7.886 -10.227 1.00 31.21 C ATOM 1367 C PRO A 97 -11.158 7.015 -8.983 1.00 41.11 C ATOM 1368 O PRO A 97 -11.094 5.782 -9.053 1.00 43.40 O ATOM 1369 CB PRO A 97 -9.364 7.983 -10.478 1.00 52.33 C ATOM 1370 CG PRO A 97 -9.183 9.307 -11.136 1.00 45.25 C ATOM 1371 CD PRO A 97 -10.207 10.220 -10.509 1.00 70.44 C ATOM 0 HA PRO A 97 -11.437 7.397 -11.023 1.00 31.21 H new ATOM 0 HB2 PRO A 97 -8.802 7.922 -9.546 1.00 52.33 H new ATOM 0 HB3 PRO A 97 -9.014 7.171 -11.115 1.00 52.33 H new ATOM 0 HG2 PRO A 97 -8.173 9.686 -10.980 1.00 45.25 H new ATOM 0 HG3 PRO A 97 -9.333 9.232 -12.213 1.00 45.25 H new ATOM 0 HD2 PRO A 97 -9.790 10.767 -9.663 1.00 70.44 H new ATOM 0 HD3 PRO A 97 -10.570 10.962 -11.221 1.00 70.44 H new ATOM 1379 N ILE A 98 -11.461 7.655 -7.855 1.00 42.14 N ATOM 1380 CA ILE A 98 -11.850 6.948 -6.630 1.00 42.32 C ATOM 1381 C ILE A 98 -12.992 5.939 -6.877 1.00 33.34 C ATOM 1382 O ILE A 98 -12.997 4.848 -6.304 1.00 62.43 O ATOM 1383 CB ILE A 98 -12.275 7.948 -5.518 1.00 65.21 C ATOM 1384 CG1 ILE A 98 -12.579 7.213 -4.201 1.00 30.51 C ATOM 1385 CG2 ILE A 98 -13.481 8.777 -5.960 1.00 42.54 C ATOM 1386 CD1 ILE A 98 -11.395 6.462 -3.625 1.00 20.42 C ATOM 0 H ILE A 98 -11.445 8.671 -7.761 1.00 42.14 H new ATOM 0 HA ILE A 98 -10.971 6.394 -6.301 1.00 42.32 H new ATOM 0 HB ILE A 98 -11.439 8.626 -5.344 1.00 65.21 H new ATOM 0 HG12 ILE A 98 -12.929 7.937 -3.465 1.00 30.51 H new ATOM 0 HG13 ILE A 98 -13.395 6.510 -4.369 1.00 30.51 H new ATOM 0 HG21 ILE A 98 -13.758 9.469 -5.164 1.00 42.54 H new ATOM 0 HG22 ILE A 98 -13.226 9.340 -6.858 1.00 42.54 H new ATOM 0 HG23 ILE A 98 -14.320 8.114 -6.173 1.00 42.54 H new ATOM 0 HD11 ILE A 98 -11.691 5.971 -2.698 1.00 20.42 H new ATOM 0 HD12 ILE A 98 -11.057 5.712 -4.340 1.00 20.42 H new ATOM 0 HD13 ILE A 98 -10.584 7.162 -3.422 1.00 20.42 H new ATOM 1398 N ASP A 99 -13.949 6.296 -7.742 1.00 33.25 N ATOM 1399 CA ASP A 99 -15.089 5.415 -8.033 1.00 14.24 C ATOM 1400 C ASP A 99 -14.643 4.090 -8.701 1.00 44.53 C ATOM 1401 O ASP A 99 -14.956 3.009 -8.191 1.00 34.31 O ATOM 1402 CB ASP A 99 -16.138 6.140 -8.890 1.00 72.52 C ATOM 1403 CG ASP A 99 -16.715 7.356 -8.192 1.00 33.22 C ATOM 1404 OD1 ASP A 99 -16.134 8.451 -8.313 1.00 15.33 O ATOM 1405 OD2 ASP A 99 -17.762 7.225 -7.523 1.00 41.32 O ATOM 0 H ASP A 99 -13.958 7.181 -8.249 1.00 33.25 H new ATOM 0 HA ASP A 99 -15.548 5.154 -7.079 1.00 14.24 H new ATOM 0 HB2 ASP A 99 -15.684 6.447 -9.832 1.00 72.52 H new ATOM 0 HB3 ASP A 99 -16.944 5.448 -9.135 1.00 72.52 H new ATOM 1410 N PRO A 100 -13.919 4.133 -9.855 1.00 53.34 N ATOM 1411 CA PRO A 100 -13.316 2.922 -10.446 1.00 32.22 C ATOM 1412 C PRO A 100 -12.405 2.171 -9.458 1.00 52.52 C ATOM 1413 O PRO A 100 -12.370 0.940 -9.444 1.00 32.33 O ATOM 1414 CB PRO A 100 -12.489 3.467 -11.621 1.00 24.34 C ATOM 1415 CG PRO A 100 -13.146 4.753 -11.982 1.00 33.43 C ATOM 1416 CD PRO A 100 -13.668 5.328 -10.692 1.00 5.00 C ATOM 0 HA PRO A 100 -14.076 2.198 -10.738 1.00 32.22 H new ATOM 0 HB2 PRO A 100 -11.448 3.621 -11.335 1.00 24.34 H new ATOM 0 HB3 PRO A 100 -12.490 2.773 -12.461 1.00 24.34 H new ATOM 0 HG2 PRO A 100 -12.438 5.434 -12.455 1.00 33.43 H new ATOM 0 HG3 PRO A 100 -13.956 4.591 -12.693 1.00 33.43 H new ATOM 0 HD2 PRO A 100 -12.943 5.997 -10.229 1.00 5.00 H new ATOM 0 HD3 PRO A 100 -14.579 5.905 -10.850 1.00 5.00 H new ATOM 1424 N LEU A 101 -11.679 2.925 -8.629 1.00 22.24 N ATOM 1425 CA LEU A 101 -10.775 2.344 -7.624 1.00 63.21 C ATOM 1426 C LEU A 101 -11.540 1.450 -6.634 1.00 33.42 C ATOM 1427 O LEU A 101 -11.246 0.260 -6.499 1.00 14.31 O ATOM 1428 CB LEU A 101 -10.044 3.464 -6.870 1.00 11.12 C ATOM 1429 CG LEU A 101 -8.986 3.000 -5.853 1.00 52.31 C ATOM 1430 CD1 LEU A 101 -7.852 2.252 -6.551 1.00 21.43 C ATOM 1431 CD2 LEU A 101 -8.444 4.187 -5.057 1.00 34.23 C ATOM 0 H LEU A 101 -11.698 3.945 -8.632 1.00 22.24 H new ATOM 0 HA LEU A 101 -10.046 1.721 -8.142 1.00 63.21 H new ATOM 0 HB2 LEU A 101 -9.560 4.113 -7.600 1.00 11.12 H new ATOM 0 HB3 LEU A 101 -10.785 4.069 -6.347 1.00 11.12 H new ATOM 0 HG LEU A 101 -9.465 2.313 -5.155 1.00 52.31 H new ATOM 0 HD11 LEU A 101 -7.117 1.934 -5.812 1.00 21.43 H new ATOM 0 HD12 LEU A 101 -8.254 1.377 -7.063 1.00 21.43 H new ATOM 0 HD13 LEU A 101 -7.375 2.910 -7.277 1.00 21.43 H new ATOM 0 HD21 LEU A 101 -7.698 3.837 -4.344 1.00 34.23 H new ATOM 0 HD22 LEU A 101 -7.986 4.904 -5.739 1.00 34.23 H new ATOM 0 HD23 LEU A 101 -9.261 4.668 -4.520 1.00 34.23 H new ATOM 1443 N LEU A 102 -12.529 2.026 -5.947 1.00 32.43 N ATOM 1444 CA LEU A 102 -13.368 1.266 -5.009 1.00 54.30 C ATOM 1445 C LEU A 102 -14.064 0.094 -5.716 1.00 24.32 C ATOM 1446 O LEU A 102 -14.162 -1.011 -5.174 1.00 51.21 O ATOM 1447 CB LEU A 102 -14.412 2.188 -4.361 1.00 2.03 C ATOM 1448 CG LEU A 102 -13.837 3.332 -3.505 1.00 42.33 C ATOM 1449 CD1 LEU A 102 -14.956 4.187 -2.915 1.00 42.53 C ATOM 1450 CD2 LEU A 102 -12.937 2.780 -2.400 1.00 51.32 C ATOM 0 H LEU A 102 -12.771 3.014 -6.020 1.00 32.43 H new ATOM 0 HA LEU A 102 -12.722 0.859 -4.231 1.00 54.30 H new ATOM 0 HB2 LEU A 102 -15.030 2.620 -5.148 1.00 2.03 H new ATOM 0 HB3 LEU A 102 -15.069 1.583 -3.736 1.00 2.03 H new ATOM 0 HG LEU A 102 -13.232 3.968 -4.152 1.00 42.33 H new ATOM 0 HD11 LEU A 102 -14.524 4.988 -2.315 1.00 42.53 H new ATOM 0 HD12 LEU A 102 -15.549 4.618 -3.722 1.00 42.53 H new ATOM 0 HD13 LEU A 102 -15.595 3.567 -2.286 1.00 42.53 H new ATOM 0 HD21 LEU A 102 -12.541 3.605 -1.807 1.00 51.32 H new ATOM 0 HD22 LEU A 102 -13.515 2.116 -1.758 1.00 51.32 H new ATOM 0 HD23 LEU A 102 -12.112 2.225 -2.846 1.00 51.32 H new ATOM 1462 N SER A 103 -14.539 0.350 -6.935 1.00 14.13 N ATOM 1463 CA SER A 103 -15.154 -0.687 -7.776 1.00 71.42 C ATOM 1464 C SER A 103 -14.200 -1.871 -8.002 1.00 34.45 C ATOM 1465 O SER A 103 -14.595 -3.031 -7.880 1.00 53.11 O ATOM 1466 CB SER A 103 -15.564 -0.086 -9.129 1.00 71.51 C ATOM 1467 OG SER A 103 -15.991 -1.085 -10.045 1.00 15.32 O ATOM 0 H SER A 103 -14.511 1.273 -7.368 1.00 14.13 H new ATOM 0 HA SER A 103 -16.036 -1.060 -7.255 1.00 71.42 H new ATOM 0 HB2 SER A 103 -16.367 0.635 -8.978 1.00 71.51 H new ATOM 0 HB3 SER A 103 -14.722 0.460 -9.554 1.00 71.51 H new ATOM 0 HG SER A 103 -16.245 -0.664 -10.893 1.00 15.32 H new ATOM 1473 N LYS A 104 -12.941 -1.564 -8.311 1.00 74.13 N ATOM 1474 CA LYS A 104 -11.918 -2.589 -8.548 1.00 25.24 C ATOM 1475 C LYS A 104 -11.799 -3.550 -7.350 1.00 65.12 C ATOM 1476 O LYS A 104 -11.819 -4.770 -7.513 1.00 44.11 O ATOM 1477 CB LYS A 104 -10.563 -1.914 -8.820 1.00 52.42 C ATOM 1478 CG LYS A 104 -9.473 -2.864 -9.313 1.00 32.34 C ATOM 1479 CD LYS A 104 -9.765 -3.387 -10.721 1.00 21.43 C ATOM 1480 CE LYS A 104 -8.627 -4.259 -11.244 1.00 12.21 C ATOM 1481 NZ LYS A 104 -8.852 -4.700 -12.646 1.00 62.03 N ATOM 0 H LYS A 104 -12.600 -0.607 -8.404 1.00 74.13 H new ATOM 0 HA LYS A 104 -12.216 -3.175 -9.418 1.00 25.24 H new ATOM 0 HB2 LYS A 104 -10.705 -1.127 -9.561 1.00 52.42 H new ATOM 0 HB3 LYS A 104 -10.221 -1.432 -7.904 1.00 52.42 H new ATOM 0 HG2 LYS A 104 -8.513 -2.348 -9.309 1.00 32.34 H new ATOM 0 HG3 LYS A 104 -9.386 -3.705 -8.625 1.00 32.34 H new ATOM 0 HD2 LYS A 104 -10.690 -3.963 -10.711 1.00 21.43 H new ATOM 0 HD3 LYS A 104 -9.920 -2.546 -11.397 1.00 21.43 H new ATOM 0 HE2 LYS A 104 -7.691 -3.704 -11.186 1.00 12.21 H new ATOM 0 HE3 LYS A 104 -8.519 -5.134 -10.603 1.00 12.21 H new ATOM 0 HZ1 LYS A 104 -8.053 -5.289 -12.957 1.00 62.03 H new ATOM 0 HZ2 LYS A 104 -9.731 -5.253 -12.699 1.00 62.03 H new ATOM 0 HZ3 LYS A 104 -8.929 -3.867 -13.264 1.00 62.03 H new ATOM 1495 N PHE A 105 -11.688 -2.988 -6.145 1.00 4.23 N ATOM 1496 CA PHE A 105 -11.595 -3.791 -4.916 1.00 0.51 C ATOM 1497 C PHE A 105 -12.878 -4.607 -4.665 1.00 40.51 C ATOM 1498 O PHE A 105 -12.819 -5.733 -4.159 1.00 71.20 O ATOM 1499 CB PHE A 105 -11.304 -2.893 -3.702 1.00 12.41 C ATOM 1500 CG PHE A 105 -9.922 -2.290 -3.704 1.00 62.43 C ATOM 1501 CD1 PHE A 105 -8.824 -3.046 -3.314 1.00 45.43 C ATOM 1502 CD2 PHE A 105 -9.716 -0.973 -4.091 1.00 45.24 C ATOM 1503 CE1 PHE A 105 -7.555 -2.502 -3.311 1.00 15.32 C ATOM 1504 CE2 PHE A 105 -8.448 -0.426 -4.089 1.00 64.55 C ATOM 1505 CZ PHE A 105 -7.367 -1.191 -3.699 1.00 34.43 C ATOM 0 H PHE A 105 -11.660 -1.980 -5.990 1.00 4.23 H new ATOM 0 HA PHE A 105 -10.771 -4.491 -5.052 1.00 0.51 H new ATOM 0 HB2 PHE A 105 -12.040 -2.090 -3.672 1.00 12.41 H new ATOM 0 HB3 PHE A 105 -11.433 -3.477 -2.791 1.00 12.41 H new ATOM 0 HD1 PHE A 105 -8.965 -4.073 -3.009 1.00 45.43 H new ATOM 0 HD2 PHE A 105 -10.557 -0.369 -4.397 1.00 45.24 H new ATOM 0 HE1 PHE A 105 -6.710 -3.102 -3.005 1.00 15.32 H new ATOM 0 HE2 PHE A 105 -8.302 0.600 -4.393 1.00 64.55 H new ATOM 0 HZ PHE A 105 -6.375 -0.764 -3.698 1.00 34.43 H new ATOM 1515 N ARG A 106 -14.035 -4.033 -5.014 1.00 5.14 N ATOM 1516 CA ARG A 106 -15.332 -4.706 -4.828 1.00 72.43 C ATOM 1517 C ARG A 106 -15.496 -5.908 -5.774 1.00 70.22 C ATOM 1518 O ARG A 106 -15.747 -7.029 -5.330 1.00 33.31 O ATOM 1519 CB ARG A 106 -16.493 -3.721 -5.058 1.00 32.31 C ATOM 1520 CG ARG A 106 -16.597 -2.605 -4.017 1.00 31.41 C ATOM 1521 CD ARG A 106 -16.774 -3.153 -2.602 1.00 63.51 C ATOM 1522 NE ARG A 106 -17.224 -2.125 -1.666 1.00 5.34 N ATOM 1523 CZ ARG A 106 -16.444 -1.261 -1.079 1.00 75.53 C ATOM 1524 NH1 ARG A 106 -15.171 -1.232 -1.332 1.00 33.32 N ATOM 1525 NH2 ARG A 106 -16.947 -0.416 -0.238 1.00 33.24 N ATOM 0 H ARG A 106 -14.103 -3.103 -5.427 1.00 5.14 H new ATOM 0 HA ARG A 106 -15.355 -5.070 -3.801 1.00 72.43 H new ATOM 0 HB2 ARG A 106 -16.380 -3.271 -6.044 1.00 32.31 H new ATOM 0 HB3 ARG A 106 -17.429 -4.279 -5.068 1.00 32.31 H new ATOM 0 HG2 ARG A 106 -15.699 -1.988 -4.057 1.00 31.41 H new ATOM 0 HG3 ARG A 106 -17.439 -1.958 -4.263 1.00 31.41 H new ATOM 0 HD2 ARG A 106 -17.496 -3.969 -2.618 1.00 63.51 H new ATOM 0 HD3 ARG A 106 -15.829 -3.570 -2.255 1.00 63.51 H new ATOM 0 HE ARG A 106 -18.221 -2.080 -1.457 1.00 5.34 H new ATOM 0 HH11 ARG A 106 -14.768 -1.891 -1.998 1.00 33.32 H new ATOM 0 HH12 ARG A 106 -14.574 -0.550 -0.865 1.00 33.32 H new ATOM 0 HH21 ARG A 106 -17.947 -0.429 -0.038 1.00 33.24 H new ATOM 0 HH22 ARG A 106 -16.343 0.263 0.225 1.00 33.24 H new ATOM 1539 N ASN A 107 -15.349 -5.666 -7.075 1.00 54.15 N ATOM 1540 CA ASN A 107 -15.566 -6.702 -8.095 1.00 51.25 C ATOM 1541 C ASN A 107 -14.604 -7.890 -7.927 1.00 55.43 C ATOM 1542 O ASN A 107 -15.008 -9.051 -8.034 1.00 53.45 O ATOM 1543 CB ASN A 107 -15.412 -6.099 -9.496 1.00 10.35 C ATOM 1544 CG ASN A 107 -16.336 -4.915 -9.737 1.00 65.25 C ATOM 1545 OD1 ASN A 107 -15.994 -3.988 -10.461 1.00 13.23 O ATOM 1546 ND2 ASN A 107 -17.518 -4.938 -9.149 1.00 13.43 N ATOM 0 H ASN A 107 -15.079 -4.758 -7.454 1.00 54.15 H new ATOM 0 HA ASN A 107 -16.580 -7.080 -7.966 1.00 51.25 H new ATOM 0 HB2 ASN A 107 -14.379 -5.782 -9.638 1.00 10.35 H new ATOM 0 HB3 ASN A 107 -15.614 -6.868 -10.241 1.00 10.35 H new ATOM 0 HD21 ASN A 107 -18.174 -4.170 -9.292 1.00 13.43 H new ATOM 0 HD22 ASN A 107 -17.775 -5.724 -8.551 1.00 13.43 H new ATOM 1553 N LEU A 108 -13.330 -7.600 -7.673 1.00 50.42 N ATOM 1554 CA LEU A 108 -12.327 -8.651 -7.454 1.00 41.44 C ATOM 1555 C LEU A 108 -12.498 -9.308 -6.071 1.00 73.15 C ATOM 1556 O LEU A 108 -12.316 -10.518 -5.924 1.00 12.33 O ATOM 1557 CB LEU A 108 -10.905 -8.084 -7.610 1.00 42.14 C ATOM 1558 CG LEU A 108 -10.433 -7.829 -9.058 1.00 12.25 C ATOM 1559 CD1 LEU A 108 -11.350 -6.845 -9.783 1.00 72.51 C ATOM 1560 CD2 LEU A 108 -8.993 -7.323 -9.066 1.00 33.35 C ATOM 0 H LEU A 108 -12.964 -6.650 -7.613 1.00 50.42 H new ATOM 0 HA LEU A 108 -12.480 -9.420 -8.211 1.00 41.44 H new ATOM 0 HB2 LEU A 108 -10.847 -7.145 -7.059 1.00 42.14 H new ATOM 0 HB3 LEU A 108 -10.206 -8.774 -7.137 1.00 42.14 H new ATOM 0 HG LEU A 108 -10.477 -8.777 -9.594 1.00 12.25 H new ATOM 0 HD11 LEU A 108 -10.987 -6.690 -10.799 1.00 72.51 H new ATOM 0 HD12 LEU A 108 -12.362 -7.248 -9.817 1.00 72.51 H new ATOM 0 HD13 LEU A 108 -11.356 -5.894 -9.251 1.00 72.51 H new ATOM 0 HD21 LEU A 108 -8.675 -7.148 -10.094 1.00 33.35 H new ATOM 0 HD22 LEU A 108 -8.932 -6.391 -8.503 1.00 33.35 H new ATOM 0 HD23 LEU A 108 -8.343 -8.068 -8.607 1.00 33.35 H new ATOM 1572 N GLY A 109 -12.849 -8.503 -5.067 1.00 72.51 N ATOM 1573 CA GLY A 109 -13.095 -9.026 -3.724 1.00 52.13 C ATOM 1574 C GLY A 109 -11.859 -9.621 -3.052 1.00 20.14 C ATOM 1575 O GLY A 109 -11.887 -10.760 -2.580 1.00 43.13 O ATOM 0 H GLY A 109 -12.968 -7.494 -5.158 1.00 72.51 H new ATOM 0 HA2 GLY A 109 -13.485 -8.223 -3.098 1.00 52.13 H new ATOM 0 HA3 GLY A 109 -13.869 -9.791 -3.780 1.00 52.13 H new ATOM 1579 N LEU A 110 -10.775 -8.850 -2.995 1.00 31.14 N ATOM 1580 CA LEU A 110 -9.540 -9.306 -2.343 1.00 23.04 C ATOM 1581 C LEU A 110 -9.660 -9.220 -0.813 1.00 24.30 C ATOM 1582 O LEU A 110 -10.640 -8.691 -0.285 1.00 53.35 O ATOM 1583 CB LEU A 110 -8.326 -8.474 -2.796 1.00 55.13 C ATOM 1584 CG LEU A 110 -8.105 -8.348 -4.315 1.00 72.33 C ATOM 1585 CD1 LEU A 110 -9.003 -7.265 -4.908 1.00 62.22 C ATOM 1586 CD2 LEU A 110 -6.634 -8.062 -4.625 1.00 70.33 C ATOM 0 H LEU A 110 -10.722 -7.911 -3.389 1.00 31.14 H new ATOM 0 HA LEU A 110 -9.391 -10.345 -2.638 1.00 23.04 H new ATOM 0 HB2 LEU A 110 -8.427 -7.471 -2.382 1.00 55.13 H new ATOM 0 HB3 LEU A 110 -7.430 -8.912 -2.356 1.00 55.13 H new ATOM 0 HG LEU A 110 -8.373 -9.299 -4.776 1.00 72.33 H new ATOM 0 HD11 LEU A 110 -8.828 -7.195 -5.982 1.00 62.22 H new ATOM 0 HD12 LEU A 110 -10.047 -7.518 -4.726 1.00 62.22 H new ATOM 0 HD13 LEU A 110 -8.775 -6.307 -4.440 1.00 62.22 H new ATOM 0 HD21 LEU A 110 -6.499 -7.977 -5.703 1.00 70.33 H new ATOM 0 HD22 LEU A 110 -6.336 -7.129 -4.147 1.00 70.33 H new ATOM 0 HD23 LEU A 110 -6.017 -8.877 -4.246 1.00 70.33 H new ATOM 1598 N THR A 111 -8.656 -9.732 -0.105 1.00 74.54 N ATOM 1599 CA THR A 111 -8.613 -9.618 1.359 1.00 54.21 C ATOM 1600 C THR A 111 -8.453 -8.145 1.771 1.00 61.11 C ATOM 1601 O THR A 111 -7.343 -7.622 1.838 1.00 64.44 O ATOM 1602 CB THR A 111 -7.460 -10.460 1.967 1.00 60.25 C ATOM 1603 OG1 THR A 111 -7.656 -11.857 1.672 1.00 4.45 O ATOM 1604 CG2 THR A 111 -7.365 -10.266 3.480 1.00 2.13 C ATOM 0 H THR A 111 -7.864 -10.228 -0.514 1.00 74.54 H new ATOM 0 HA THR A 111 -9.555 -10.007 1.747 1.00 54.21 H new ATOM 0 HB THR A 111 -6.528 -10.118 1.518 1.00 60.25 H new ATOM 0 HG1 THR A 111 -7.410 -12.032 0.740 1.00 4.45 H new ATOM 0 HG21 THR A 111 -6.547 -10.870 3.874 1.00 2.13 H new ATOM 0 HG22 THR A 111 -7.179 -9.215 3.701 1.00 2.13 H new ATOM 0 HG23 THR A 111 -8.301 -10.575 3.946 1.00 2.13 H new ATOM 1612 N THR A 112 -9.577 -7.474 2.025 1.00 64.23 N ATOM 1613 CA THR A 112 -9.581 -6.021 2.259 1.00 74.43 C ATOM 1614 C THR A 112 -9.683 -5.671 3.752 1.00 4.31 C ATOM 1615 O THR A 112 -10.524 -6.210 4.467 1.00 5.30 O ATOM 1616 CB THR A 112 -10.754 -5.345 1.503 1.00 45.34 C ATOM 1617 OG1 THR A 112 -10.721 -5.713 0.111 1.00 73.53 O ATOM 1618 CG2 THR A 112 -10.690 -3.823 1.629 1.00 2.32 C ATOM 0 H THR A 112 -10.498 -7.909 2.075 1.00 64.23 H new ATOM 0 HA THR A 112 -8.630 -5.646 1.882 1.00 74.43 H new ATOM 0 HB THR A 112 -11.685 -5.690 1.953 1.00 45.34 H new ATOM 0 HG1 THR A 112 -10.854 -6.680 0.025 1.00 73.53 H new ATOM 0 HG21 THR A 112 -11.525 -3.378 1.089 1.00 2.32 H new ATOM 0 HG22 THR A 112 -10.747 -3.542 2.681 1.00 2.32 H new ATOM 0 HG23 THR A 112 -9.752 -3.462 1.208 1.00 2.32 H new ATOM 1626 N ALA A 113 -8.827 -4.753 4.209 1.00 15.33 N ATOM 1627 CA ALA A 113 -8.839 -4.299 5.609 1.00 24.11 C ATOM 1628 C ALA A 113 -10.166 -3.607 5.985 1.00 14.23 C ATOM 1629 O ALA A 113 -10.910 -4.086 6.843 1.00 50.12 O ATOM 1630 CB ALA A 113 -7.662 -3.361 5.862 1.00 35.52 C ATOM 0 H ALA A 113 -8.114 -4.307 3.631 1.00 15.33 H new ATOM 0 HA ALA A 113 -8.745 -5.181 6.242 1.00 24.11 H new ATOM 0 HB1 ALA A 113 -7.678 -3.029 6.900 1.00 35.52 H new ATOM 0 HB2 ALA A 113 -6.728 -3.887 5.663 1.00 35.52 H new ATOM 0 HB3 ALA A 113 -7.738 -2.496 5.203 1.00 35.52 H new ATOM 1636 N PHE A 114 -10.451 -2.472 5.346 1.00 34.13 N ATOM 1637 CA PHE A 114 -11.699 -1.736 5.593 1.00 51.42 C ATOM 1638 C PHE A 114 -12.162 -1.019 4.306 1.00 51.15 C ATOM 1639 O PHE A 114 -11.511 -0.088 3.837 1.00 2.01 O ATOM 1640 CB PHE A 114 -11.495 -0.727 6.738 1.00 13.13 C ATOM 1641 CG PHE A 114 -12.780 -0.240 7.359 1.00 20.22 C ATOM 1642 CD1 PHE A 114 -13.468 -1.035 8.268 1.00 33.21 C ATOM 1643 CD2 PHE A 114 -13.300 1.007 7.043 1.00 5.22 C ATOM 1644 CE1 PHE A 114 -14.646 -0.597 8.843 1.00 21.24 C ATOM 1645 CE2 PHE A 114 -14.477 1.448 7.618 1.00 25.30 C ATOM 1646 CZ PHE A 114 -15.150 0.646 8.518 1.00 3.32 C ATOM 0 H PHE A 114 -9.838 -2.040 4.654 1.00 34.13 H new ATOM 0 HA PHE A 114 -12.476 -2.441 5.887 1.00 51.42 H new ATOM 0 HB2 PHE A 114 -10.881 -1.189 7.511 1.00 13.13 H new ATOM 0 HB3 PHE A 114 -10.938 0.130 6.359 1.00 13.13 H new ATOM 0 HD1 PHE A 114 -13.077 -2.008 8.528 1.00 33.21 H new ATOM 0 HD2 PHE A 114 -12.779 1.640 6.340 1.00 5.22 H new ATOM 0 HE1 PHE A 114 -15.171 -1.227 9.546 1.00 21.24 H new ATOM 0 HE2 PHE A 114 -14.871 2.421 7.363 1.00 25.30 H new ATOM 0 HZ PHE A 114 -16.070 0.991 8.967 1.00 3.32 H new ATOM 1656 N PRO A 115 -13.290 -1.458 3.709 1.00 1.34 N ATOM 1657 CA PRO A 115 -13.736 -0.976 2.390 1.00 70.22 C ATOM 1658 C PRO A 115 -14.643 0.274 2.429 1.00 64.24 C ATOM 1659 O PRO A 115 -15.161 0.697 1.391 1.00 41.04 O ATOM 1660 CB PRO A 115 -14.514 -2.188 1.876 1.00 12.44 C ATOM 1661 CG PRO A 115 -15.158 -2.758 3.102 1.00 12.25 C ATOM 1662 CD PRO A 115 -14.219 -2.470 4.255 1.00 24.24 C ATOM 0 HA PRO A 115 -12.899 -0.648 1.773 1.00 70.22 H new ATOM 0 HB2 PRO A 115 -15.258 -1.898 1.134 1.00 12.44 H new ATOM 0 HB3 PRO A 115 -13.853 -2.912 1.400 1.00 12.44 H new ATOM 0 HG2 PRO A 115 -16.134 -2.304 3.274 1.00 12.25 H new ATOM 0 HG3 PRO A 115 -15.320 -3.830 2.992 1.00 12.25 H new ATOM 0 HD2 PRO A 115 -14.757 -2.091 5.124 1.00 24.24 H new ATOM 0 HD3 PRO A 115 -13.690 -3.368 4.574 1.00 24.24 H new ATOM 1670 N ALA A 116 -14.822 0.867 3.608 1.00 24.53 N ATOM 1671 CA ALA A 116 -15.734 2.014 3.771 1.00 45.10 C ATOM 1672 C ALA A 116 -14.990 3.284 4.227 1.00 34.15 C ATOM 1673 O ALA A 116 -14.050 3.214 5.012 1.00 3.25 O ATOM 1674 CB ALA A 116 -16.844 1.654 4.755 1.00 64.22 C ATOM 0 H ALA A 116 -14.352 0.578 4.466 1.00 24.53 H new ATOM 0 HA ALA A 116 -16.173 2.236 2.798 1.00 45.10 H new ATOM 0 HB1 ALA A 116 -17.516 2.504 4.873 1.00 64.22 H new ATOM 0 HB2 ALA A 116 -17.404 0.799 4.375 1.00 64.22 H new ATOM 0 HB3 ALA A 116 -16.406 1.401 5.721 1.00 64.22 H new ATOM 1680 N ILE A 117 -15.437 4.446 3.743 1.00 35.54 N ATOM 1681 CA ILE A 117 -14.744 5.720 3.997 1.00 53.42 C ATOM 1682 C ILE A 117 -15.309 6.480 5.217 1.00 62.41 C ATOM 1683 O ILE A 117 -16.455 6.268 5.627 1.00 50.54 O ATOM 1684 CB ILE A 117 -14.814 6.648 2.754 1.00 54.25 C ATOM 1685 CG1 ILE A 117 -16.274 7.012 2.430 1.00 52.21 C ATOM 1686 CG2 ILE A 117 -14.142 5.981 1.552 1.00 33.45 C ATOM 1687 CD1 ILE A 117 -16.427 7.979 1.272 1.00 54.12 C ATOM 0 H ILE A 117 -16.277 4.535 3.171 1.00 35.54 H new ATOM 0 HA ILE A 117 -13.708 5.456 4.212 1.00 53.42 H new ATOM 0 HB ILE A 117 -14.277 7.569 2.980 1.00 54.25 H new ATOM 0 HG12 ILE A 117 -16.823 6.099 2.202 1.00 52.21 H new ATOM 0 HG13 ILE A 117 -16.734 7.448 3.317 1.00 52.21 H new ATOM 0 HG21 ILE A 117 -14.199 6.644 0.689 1.00 33.45 H new ATOM 0 HG22 ILE A 117 -13.097 5.779 1.785 1.00 33.45 H new ATOM 0 HG23 ILE A 117 -14.651 5.044 1.324 1.00 33.45 H new ATOM 0 HD11 ILE A 117 -17.485 8.185 1.107 1.00 54.12 H new ATOM 0 HD12 ILE A 117 -15.908 8.909 1.504 1.00 54.12 H new ATOM 0 HD13 ILE A 117 -15.998 7.539 0.372 1.00 54.12 H new ATOM 1699 N ARG A 118 -14.480 7.357 5.791 1.00 0.35 N ATOM 1700 CA ARG A 118 -14.868 8.220 6.920 1.00 2.33 C ATOM 1701 C ARG A 118 -14.052 9.527 6.943 1.00 52.52 C ATOM 1702 O ARG A 118 -14.615 10.620 7.060 1.00 25.15 O ATOM 1703 CB ARG A 118 -14.678 7.485 8.262 1.00 25.21 C ATOM 1704 CG ARG A 118 -15.836 6.572 8.654 1.00 53.52 C ATOM 1705 CD ARG A 118 -17.120 7.362 8.904 1.00 0.11 C ATOM 1706 NE ARG A 118 -18.215 6.509 9.373 1.00 40.04 N ATOM 1707 CZ ARG A 118 -18.744 6.581 10.566 1.00 52.43 C ATOM 1708 NH1 ARG A 118 -18.295 7.431 11.434 1.00 53.13 N ATOM 1709 NH2 ARG A 118 -19.718 5.796 10.887 1.00 73.54 N ATOM 0 H ARG A 118 -13.516 7.492 5.487 1.00 0.35 H new ATOM 0 HA ARG A 118 -15.921 8.466 6.783 1.00 2.33 H new ATOM 0 HB2 ARG A 118 -13.765 6.891 8.210 1.00 25.21 H new ATOM 0 HB3 ARG A 118 -14.533 8.225 9.049 1.00 25.21 H new ATOM 0 HG2 ARG A 118 -16.007 5.841 7.864 1.00 53.52 H new ATOM 0 HG3 ARG A 118 -15.571 6.014 9.552 1.00 53.52 H new ATOM 0 HD2 ARG A 118 -16.927 8.141 9.642 1.00 0.11 H new ATOM 0 HD3 ARG A 118 -17.421 7.863 7.984 1.00 0.11 H new ATOM 0 HE ARG A 118 -18.589 5.814 8.727 1.00 40.04 H new ATOM 0 HH11 ARG A 118 -17.523 8.051 11.189 1.00 53.13 H new ATOM 0 HH12 ARG A 118 -18.714 7.481 12.363 1.00 53.13 H new ATOM 0 HH21 ARG A 118 -20.073 5.121 10.210 1.00 73.54 H new ATOM 0 HH22 ARG A 118 -20.132 5.851 11.818 1.00 73.54 H new ATOM 1723 N ILE A 119 -12.728 9.405 6.844 1.00 12.44 N ATOM 1724 CA ILE A 119 -11.824 10.559 6.929 1.00 3.25 C ATOM 1725 C ILE A 119 -11.894 11.431 5.661 1.00 31.33 C ATOM 1726 O ILE A 119 -11.467 11.021 4.578 1.00 22.24 O ATOM 1727 CB ILE A 119 -10.351 10.118 7.183 1.00 62.33 C ATOM 1728 CG1 ILE A 119 -10.171 9.564 8.613 1.00 34.05 C ATOM 1729 CG2 ILE A 119 -9.379 11.276 6.940 1.00 1.24 C ATOM 1730 CD1 ILE A 119 -10.923 8.278 8.895 1.00 61.51 C ATOM 0 H ILE A 119 -12.253 8.514 6.704 1.00 12.44 H new ATOM 0 HA ILE A 119 -12.160 11.154 7.778 1.00 3.25 H new ATOM 0 HB ILE A 119 -10.124 9.321 6.475 1.00 62.33 H new ATOM 0 HG12 ILE A 119 -9.109 9.394 8.791 1.00 34.05 H new ATOM 0 HG13 ILE A 119 -10.496 10.322 9.325 1.00 34.05 H new ATOM 0 HG21 ILE A 119 -8.359 10.940 7.125 1.00 1.24 H new ATOM 0 HG22 ILE A 119 -9.468 11.615 5.908 1.00 1.24 H new ATOM 0 HG23 ILE A 119 -9.617 12.099 7.614 1.00 1.24 H new ATOM 0 HD11 ILE A 119 -10.737 7.965 9.922 1.00 61.51 H new ATOM 0 HD12 ILE A 119 -11.991 8.443 8.754 1.00 61.51 H new ATOM 0 HD13 ILE A 119 -10.583 7.500 8.212 1.00 61.51 H new ATOM 1742 N LYS A 120 -12.423 12.642 5.810 1.00 10.02 N ATOM 1743 CA LYS A 120 -12.595 13.562 4.680 1.00 44.43 C ATOM 1744 C LYS A 120 -11.293 14.330 4.376 1.00 53.42 C ATOM 1745 O LYS A 120 -11.088 14.815 3.258 1.00 45.32 O ATOM 1746 CB LYS A 120 -13.742 14.539 4.984 1.00 61.54 C ATOM 1747 CG LYS A 120 -14.255 15.302 3.765 1.00 52.03 C ATOM 1748 CD LYS A 120 -15.455 16.181 4.113 1.00 40.15 C ATOM 1749 CE LYS A 120 -16.071 16.832 2.878 1.00 51.21 C ATOM 1750 NZ LYS A 120 -17.199 17.737 3.230 1.00 54.15 N ATOM 0 H LYS A 120 -12.742 13.014 6.704 1.00 10.02 H new ATOM 0 HA LYS A 120 -12.843 12.979 3.793 1.00 44.43 H new ATOM 0 HB2 LYS A 120 -14.570 13.984 5.426 1.00 61.54 H new ATOM 0 HB3 LYS A 120 -13.404 15.256 5.732 1.00 61.54 H new ATOM 0 HG2 LYS A 120 -13.455 15.922 3.360 1.00 52.03 H new ATOM 0 HG3 LYS A 120 -14.536 14.595 2.985 1.00 52.03 H new ATOM 0 HD2 LYS A 120 -16.210 15.579 4.619 1.00 40.15 H new ATOM 0 HD3 LYS A 120 -15.144 16.956 4.813 1.00 40.15 H new ATOM 0 HE2 LYS A 120 -15.306 17.397 2.346 1.00 51.21 H new ATOM 0 HE3 LYS A 120 -16.426 16.057 2.198 1.00 51.21 H new ATOM 0 HZ1 LYS A 120 -17.589 18.159 2.363 1.00 54.15 H new ATOM 0 HZ2 LYS A 120 -17.941 17.194 3.715 1.00 54.15 H new ATOM 0 HZ3 LYS A 120 -16.856 18.492 3.858 1.00 54.15 H new ATOM 1764 N GLN A 121 -10.417 14.435 5.379 1.00 1.52 N ATOM 1765 CA GLN A 121 -9.120 15.107 5.211 1.00 14.12 C ATOM 1766 C GLN A 121 -8.116 14.687 6.299 1.00 73.21 C ATOM 1767 O GLN A 121 -7.117 14.017 6.022 1.00 0.04 O ATOM 1768 CB GLN A 121 -9.295 16.636 5.229 1.00 4.45 C ATOM 1769 CG GLN A 121 -7.986 17.408 5.075 1.00 31.12 C ATOM 1770 CD GLN A 121 -8.176 18.914 5.140 1.00 11.34 C ATOM 1771 OE1 GLN A 121 -8.384 19.573 4.126 1.00 41.20 O ATOM 1772 NE2 GLN A 121 -8.106 19.471 6.332 1.00 20.55 N ATOM 0 H GLN A 121 -10.579 14.065 6.315 1.00 1.52 H new ATOM 0 HA GLN A 121 -8.721 14.801 4.244 1.00 14.12 H new ATOM 0 HB2 GLN A 121 -9.973 16.924 4.425 1.00 4.45 H new ATOM 0 HB3 GLN A 121 -9.770 16.927 6.166 1.00 4.45 H new ATOM 0 HG2 GLN A 121 -7.294 17.100 5.859 1.00 31.12 H new ATOM 0 HG3 GLN A 121 -7.525 17.146 4.122 1.00 31.12 H new ATOM 0 HE21 GLN A 121 -7.932 18.894 7.155 1.00 20.55 H new ATOM 0 HE22 GLN A 121 -8.226 20.479 6.432 1.00 20.55 H new ATOM 1781 N THR A 122 -8.394 15.076 7.541 1.00 42.32 N ATOM 1782 CA THR A 122 -7.467 14.838 8.657 1.00 65.42 C ATOM 1783 C THR A 122 -7.758 13.511 9.375 1.00 61.23 C ATOM 1784 O THR A 122 -8.904 13.241 9.751 1.00 74.54 O ATOM 1785 CB THR A 122 -7.537 15.982 9.696 1.00 14.14 C ATOM 1786 OG1 THR A 122 -8.852 16.046 10.279 1.00 1.21 O ATOM 1787 CG2 THR A 122 -7.202 17.324 9.056 1.00 32.02 C ATOM 0 H THR A 122 -9.253 15.558 7.805 1.00 42.32 H new ATOM 0 HA THR A 122 -6.470 14.794 8.219 1.00 65.42 H new ATOM 0 HB THR A 122 -6.803 15.772 10.474 1.00 14.14 H new ATOM 0 HG1 THR A 122 -9.242 15.147 10.306 1.00 1.21 H new ATOM 0 HG21 THR A 122 -7.259 18.110 9.809 1.00 32.02 H new ATOM 0 HG22 THR A 122 -6.194 17.289 8.643 1.00 32.02 H new ATOM 0 HG23 THR A 122 -7.914 17.534 8.258 1.00 32.02 H new ATOM 1795 N PRO A 123 -6.726 12.663 9.573 1.00 21.21 N ATOM 1796 CA PRO A 123 -6.863 11.397 10.321 1.00 0.22 C ATOM 1797 C PRO A 123 -7.281 11.613 11.787 1.00 2.14 C ATOM 1798 O PRO A 123 -6.993 12.651 12.379 1.00 24.20 O ATOM 1799 CB PRO A 123 -5.454 10.777 10.245 1.00 54.42 C ATOM 1800 CG PRO A 123 -4.796 11.456 9.091 1.00 21.53 C ATOM 1801 CD PRO A 123 -5.351 12.852 9.072 1.00 71.10 C ATOM 0 HA PRO A 123 -7.644 10.765 9.900 1.00 0.22 H new ATOM 0 HB2 PRO A 123 -4.900 10.942 11.169 1.00 54.42 H new ATOM 0 HB3 PRO A 123 -5.505 9.699 10.092 1.00 54.42 H new ATOM 0 HG2 PRO A 123 -3.712 11.467 9.209 1.00 21.53 H new ATOM 0 HG3 PRO A 123 -5.010 10.937 8.157 1.00 21.53 H new ATOM 0 HD2 PRO A 123 -4.777 13.524 9.710 1.00 71.10 H new ATOM 0 HD3 PRO A 123 -5.341 13.278 8.069 1.00 71.10 H new ATOM 1809 N THR A 124 -7.956 10.620 12.370 1.00 72.14 N ATOM 1810 CA THR A 124 -8.452 10.724 13.753 1.00 14.20 C ATOM 1811 C THR A 124 -7.704 9.781 14.699 1.00 74.21 C ATOM 1812 O THR A 124 -7.008 8.864 14.259 1.00 42.12 O ATOM 1813 CB THR A 124 -9.959 10.381 13.848 1.00 72.35 C ATOM 1814 OG1 THR A 124 -10.160 8.980 13.585 1.00 63.21 O ATOM 1815 CG2 THR A 124 -10.779 11.212 12.866 1.00 10.13 C ATOM 0 H THR A 124 -8.174 9.735 11.911 1.00 72.14 H new ATOM 0 HA THR A 124 -8.283 11.759 14.049 1.00 14.20 H new ATOM 0 HB THR A 124 -10.296 10.616 14.858 1.00 72.35 H new ATOM 0 HG1 THR A 124 -11.115 8.769 13.648 1.00 63.21 H new ATOM 0 HG21 THR A 124 -11.833 10.948 12.957 1.00 10.13 H new ATOM 0 HG22 THR A 124 -10.650 12.271 13.089 1.00 10.13 H new ATOM 0 HG23 THR A 124 -10.441 11.012 11.849 1.00 10.13 H new ATOM 1823 N GLU A 125 -7.873 9.998 16.003 1.00 2.51 N ATOM 1824 CA GLU A 125 -7.300 9.118 17.028 1.00 61.32 C ATOM 1825 C GLU A 125 -7.741 7.658 16.818 1.00 51.01 C ATOM 1826 O GLU A 125 -6.977 6.718 17.054 1.00 11.13 O ATOM 1827 CB GLU A 125 -7.719 9.609 18.421 1.00 31.40 C ATOM 1828 CG GLU A 125 -7.205 8.751 19.574 1.00 73.05 C ATOM 1829 CD GLU A 125 -7.532 9.352 20.932 1.00 52.15 C ATOM 1830 OE1 GLU A 125 -6.731 10.172 21.430 1.00 64.54 O ATOM 1831 OE2 GLU A 125 -8.591 9.022 21.502 1.00 54.42 O ATOM 0 H GLU A 125 -8.406 10.782 16.379 1.00 2.51 H new ATOM 0 HA GLU A 125 -6.214 9.151 16.945 1.00 61.32 H new ATOM 0 HB2 GLU A 125 -7.361 10.630 18.556 1.00 31.40 H new ATOM 0 HB3 GLU A 125 -8.807 9.645 18.468 1.00 31.40 H new ATOM 0 HG2 GLU A 125 -7.642 7.755 19.505 1.00 73.05 H new ATOM 0 HG3 GLU A 125 -6.125 8.632 19.482 1.00 73.05 H new ATOM 1838 N ASN A 126 -8.973 7.486 16.347 1.00 15.33 N ATOM 1839 CA ASN A 126 -9.527 6.159 16.068 1.00 64.53 C ATOM 1840 C ASN A 126 -8.907 5.548 14.796 1.00 44.12 C ATOM 1841 O ASN A 126 -8.762 4.329 14.687 1.00 71.31 O ATOM 1842 CB ASN A 126 -11.051 6.253 15.919 1.00 72.11 C ATOM 1843 CG ASN A 126 -11.712 6.901 17.126 1.00 71.31 C ATOM 1844 OD1 ASN A 126 -11.217 6.817 18.244 1.00 30.31 O ATOM 1845 ND2 ASN A 126 -12.839 7.548 16.914 1.00 40.43 N ATOM 0 H ASN A 126 -9.614 8.255 16.148 1.00 15.33 H new ATOM 0 HA ASN A 126 -9.283 5.506 16.906 1.00 64.53 H new ATOM 0 HB2 ASN A 126 -11.291 6.827 15.024 1.00 72.11 H new ATOM 0 HB3 ASN A 126 -11.462 5.254 15.776 1.00 72.11 H new ATOM 0 HD21 ASN A 126 -13.324 7.996 17.692 1.00 40.43 H new ATOM 0 HD22 ASN A 126 -13.227 7.601 15.972 1.00 40.43 H new ATOM 1852 N THR A 127 -8.538 6.407 13.840 1.00 14.52 N ATOM 1853 CA THR A 127 -7.912 5.962 12.582 1.00 52.52 C ATOM 1854 C THR A 127 -6.652 5.124 12.848 1.00 41.51 C ATOM 1855 O THR A 127 -6.397 4.131 12.162 1.00 63.14 O ATOM 1856 CB THR A 127 -7.534 7.166 11.674 1.00 52.53 C ATOM 1857 OG1 THR A 127 -8.695 7.979 11.417 1.00 2.14 O ATOM 1858 CG2 THR A 127 -6.946 6.696 10.343 1.00 32.03 C ATOM 0 H THR A 127 -8.661 7.417 13.910 1.00 14.52 H new ATOM 0 HA THR A 127 -8.652 5.347 12.069 1.00 52.52 H new ATOM 0 HB THR A 127 -6.781 7.752 12.201 1.00 52.53 H new ATOM 0 HG1 THR A 127 -9.127 8.211 12.266 1.00 2.14 H new ATOM 0 HG21 THR A 127 -6.692 7.562 9.731 1.00 32.03 H new ATOM 0 HG22 THR A 127 -6.048 6.108 10.530 1.00 32.03 H new ATOM 0 HG23 THR A 127 -7.678 6.083 9.818 1.00 32.03 H new ATOM 1866 N TYR A 128 -5.876 5.521 13.857 1.00 54.42 N ATOM 1867 CA TYR A 128 -4.668 4.778 14.246 1.00 70.14 C ATOM 1868 C TYR A 128 -4.998 3.319 14.597 1.00 63.21 C ATOM 1869 O TYR A 128 -4.271 2.400 14.219 1.00 2.34 O ATOM 1870 CB TYR A 128 -3.978 5.455 15.440 1.00 64.52 C ATOM 1871 CG TYR A 128 -3.468 6.856 15.147 1.00 43.52 C ATOM 1872 CD1 TYR A 128 -4.282 7.966 15.337 1.00 32.24 C ATOM 1873 CD2 TYR A 128 -2.176 7.067 14.676 1.00 1.20 C ATOM 1874 CE1 TYR A 128 -3.827 9.242 15.070 1.00 5.42 C ATOM 1875 CE2 TYR A 128 -1.714 8.341 14.408 1.00 62.11 C ATOM 1876 CZ TYR A 128 -2.543 9.425 14.604 1.00 61.54 C ATOM 1877 OH TYR A 128 -2.087 10.696 14.335 1.00 13.01 O ATOM 0 H TYR A 128 -6.058 6.351 14.421 1.00 54.42 H new ATOM 0 HA TYR A 128 -3.991 4.782 13.392 1.00 70.14 H new ATOM 0 HB2 TYR A 128 -4.679 5.502 16.273 1.00 64.52 H new ATOM 0 HB3 TYR A 128 -3.141 4.835 15.762 1.00 64.52 H new ATOM 0 HD1 TYR A 128 -5.290 7.828 15.700 1.00 32.24 H new ATOM 0 HD2 TYR A 128 -1.524 6.221 14.517 1.00 1.20 H new ATOM 0 HE1 TYR A 128 -4.474 10.093 15.226 1.00 5.42 H new ATOM 0 HE2 TYR A 128 -0.707 8.487 14.046 1.00 62.11 H new ATOM 0 HH TYR A 128 -1.221 10.832 14.772 1.00 13.01 H new ATOM 1887 N LYS A 129 -6.114 3.111 15.301 1.00 51.20 N ATOM 1888 CA LYS A 129 -6.545 1.760 15.698 1.00 13.00 C ATOM 1889 C LYS A 129 -6.803 0.865 14.474 1.00 65.43 C ATOM 1890 O LYS A 129 -6.664 -0.359 14.541 1.00 44.14 O ATOM 1891 CB LYS A 129 -7.810 1.833 16.564 1.00 30.54 C ATOM 1892 CG LYS A 129 -7.623 2.604 17.868 1.00 32.23 C ATOM 1893 CD LYS A 129 -8.876 2.573 18.748 1.00 43.54 C ATOM 1894 CE LYS A 129 -9.105 1.214 19.419 1.00 42.52 C ATOM 1895 NZ LYS A 129 -9.400 0.129 18.444 1.00 20.51 N ATOM 0 H LYS A 129 -6.737 3.857 15.609 1.00 51.20 H new ATOM 0 HA LYS A 129 -5.736 1.317 16.278 1.00 13.00 H new ATOM 0 HB2 LYS A 129 -8.607 2.302 15.987 1.00 30.54 H new ATOM 0 HB3 LYS A 129 -8.139 0.820 16.796 1.00 30.54 H new ATOM 0 HG2 LYS A 129 -6.784 2.181 18.420 1.00 32.23 H new ATOM 0 HG3 LYS A 129 -7.366 3.639 17.642 1.00 32.23 H new ATOM 0 HD2 LYS A 129 -8.792 3.342 19.516 1.00 43.54 H new ATOM 0 HD3 LYS A 129 -9.746 2.823 18.141 1.00 43.54 H new ATOM 0 HE2 LYS A 129 -8.220 0.946 19.996 1.00 42.52 H new ATOM 0 HE3 LYS A 129 -9.932 1.297 20.124 1.00 42.52 H new ATOM 0 HZ1 LYS A 129 -10.042 -0.564 18.879 1.00 20.51 H new ATOM 0 HZ2 LYS A 129 -9.850 0.535 17.599 1.00 20.51 H new ATOM 0 HZ3 LYS A 129 -8.514 -0.343 18.171 1.00 20.51 H new ATOM 1909 N LEU A 130 -7.190 1.481 13.362 1.00 45.45 N ATOM 1910 CA LEU A 130 -7.370 0.755 12.102 1.00 55.11 C ATOM 1911 C LEU A 130 -6.009 0.324 11.539 1.00 51.42 C ATOM 1912 O LEU A 130 -5.813 -0.834 11.168 1.00 1.15 O ATOM 1913 CB LEU A 130 -8.115 1.631 11.085 1.00 64.32 C ATOM 1914 CG LEU A 130 -9.521 2.085 11.516 1.00 64.44 C ATOM 1915 CD1 LEU A 130 -10.148 2.986 10.455 1.00 51.31 C ATOM 1916 CD2 LEU A 130 -10.418 0.880 11.799 1.00 44.22 C ATOM 0 H LEU A 130 -7.386 2.480 13.304 1.00 45.45 H new ATOM 0 HA LEU A 130 -7.966 -0.137 12.295 1.00 55.11 H new ATOM 0 HB2 LEU A 130 -7.512 2.516 10.881 1.00 64.32 H new ATOM 0 HB3 LEU A 130 -8.200 1.080 10.148 1.00 64.32 H new ATOM 0 HG LEU A 130 -9.423 2.660 12.437 1.00 64.44 H new ATOM 0 HD11 LEU A 130 -11.141 3.295 10.781 1.00 51.31 H new ATOM 0 HD12 LEU A 130 -9.523 3.867 10.311 1.00 51.31 H new ATOM 0 HD13 LEU A 130 -10.228 2.440 9.515 1.00 51.31 H new ATOM 0 HD21 LEU A 130 -11.406 1.225 12.102 1.00 44.22 H new ATOM 0 HD22 LEU A 130 -10.506 0.272 10.898 1.00 44.22 H new ATOM 0 HD23 LEU A 130 -9.982 0.282 12.599 1.00 44.22 H new ATOM 1928 N CYS A 131 -5.067 1.267 11.498 1.00 72.23 N ATOM 1929 CA CYS A 131 -3.699 0.983 11.047 1.00 32.51 C ATOM 1930 C CYS A 131 -3.025 -0.075 11.935 1.00 3.15 C ATOM 1931 O CYS A 131 -2.220 -0.876 11.466 1.00 52.44 O ATOM 1932 CB CYS A 131 -2.863 2.270 11.050 1.00 50.12 C ATOM 1933 SG CYS A 131 -3.498 3.570 9.969 1.00 35.40 S ATOM 0 H CYS A 131 -5.224 2.237 11.772 1.00 72.23 H new ATOM 0 HA CYS A 131 -3.758 0.590 10.032 1.00 32.51 H new ATOM 0 HB2 CYS A 131 -2.811 2.654 12.069 1.00 50.12 H new ATOM 0 HB3 CYS A 131 -1.844 2.028 10.748 1.00 50.12 H new ATOM 0 HG CYS A 131 -4.605 4.041 10.461 1.00 35.40 H new ATOM 1939 N GLU A 132 -3.367 -0.069 13.222 1.00 12.51 N ATOM 1940 CA GLU A 132 -2.803 -1.024 14.180 1.00 11.41 C ATOM 1941 C GLU A 132 -3.550 -2.372 14.161 1.00 35.21 C ATOM 1942 O GLU A 132 -3.054 -3.354 13.609 1.00 2.32 O ATOM 1943 CB GLU A 132 -2.819 -0.423 15.597 1.00 11.25 C ATOM 1944 CG GLU A 132 -1.912 0.794 15.759 1.00 41.33 C ATOM 1945 CD GLU A 132 -1.979 1.409 17.150 1.00 64.14 C ATOM 1946 OE1 GLU A 132 -1.471 0.786 18.108 1.00 42.13 O ATOM 1947 OE2 GLU A 132 -2.533 2.517 17.295 1.00 33.00 O ATOM 0 H GLU A 132 -4.034 0.588 13.628 1.00 12.51 H new ATOM 0 HA GLU A 132 -1.773 -1.220 13.882 1.00 11.41 H new ATOM 0 HB2 GLU A 132 -3.841 -0.140 15.850 1.00 11.25 H new ATOM 0 HB3 GLU A 132 -2.515 -1.189 16.310 1.00 11.25 H new ATOM 0 HG2 GLU A 132 -0.883 0.504 15.546 1.00 41.33 H new ATOM 0 HG3 GLU A 132 -2.190 1.547 15.022 1.00 41.33 H new ATOM 1954 N GLU A 133 -4.751 -2.407 14.748 1.00 15.13 N ATOM 1955 CA GLU A 133 -5.508 -3.662 14.903 1.00 64.54 C ATOM 1956 C GLU A 133 -5.865 -4.308 13.550 1.00 44.25 C ATOM 1957 O GLU A 133 -5.572 -5.483 13.319 1.00 32.21 O ATOM 1958 CB GLU A 133 -6.786 -3.423 15.720 1.00 13.33 C ATOM 1959 CG GLU A 133 -7.673 -4.661 15.852 1.00 43.51 C ATOM 1960 CD GLU A 133 -8.904 -4.422 16.714 1.00 3.25 C ATOM 1961 OE1 GLU A 133 -9.782 -3.639 16.301 1.00 64.33 O ATOM 1962 OE2 GLU A 133 -9.000 -5.023 17.806 1.00 70.01 O ATOM 0 H GLU A 133 -5.222 -1.584 15.124 1.00 15.13 H new ATOM 0 HA GLU A 133 -4.858 -4.356 15.436 1.00 64.54 H new ATOM 0 HB2 GLU A 133 -6.510 -3.077 16.716 1.00 13.33 H new ATOM 0 HB3 GLU A 133 -7.361 -2.623 15.253 1.00 13.33 H new ATOM 0 HG2 GLU A 133 -7.988 -4.983 14.859 1.00 43.51 H new ATOM 0 HG3 GLU A 133 -7.089 -5.476 16.280 1.00 43.51 H new ATOM 1969 N ALA A 134 -6.502 -3.546 12.661 1.00 15.41 N ATOM 1970 CA ALA A 134 -6.900 -4.069 11.347 1.00 53.52 C ATOM 1971 C ALA A 134 -5.672 -4.411 10.489 1.00 14.45 C ATOM 1972 O ALA A 134 -5.646 -5.433 9.802 1.00 71.12 O ATOM 1973 CB ALA A 134 -7.805 -3.077 10.623 1.00 3.14 C ATOM 0 H ALA A 134 -6.754 -2.571 12.822 1.00 15.41 H new ATOM 0 HA ALA A 134 -7.460 -4.990 11.510 1.00 53.52 H new ATOM 0 HB1 ALA A 134 -8.088 -3.484 9.652 1.00 3.14 H new ATOM 0 HB2 ALA A 134 -8.701 -2.901 11.218 1.00 3.14 H new ATOM 0 HB3 ALA A 134 -7.273 -2.136 10.481 1.00 3.14 H new ATOM 1979 N GLY A 135 -4.652 -3.553 10.550 1.00 51.42 N ATOM 1980 CA GLY A 135 -3.402 -3.811 9.837 1.00 24.14 C ATOM 1981 C GLY A 135 -2.691 -5.082 10.309 1.00 53.34 C ATOM 1982 O GLY A 135 -1.935 -5.698 9.552 1.00 50.33 O ATOM 0 H GLY A 135 -4.667 -2.682 11.081 1.00 51.42 H new ATOM 0 HA2 GLY A 135 -3.610 -3.893 8.770 1.00 24.14 H new ATOM 0 HA3 GLY A 135 -2.734 -2.959 9.967 1.00 24.14 H new ATOM 1986 N THR A 136 -2.942 -5.480 11.559 1.00 32.34 N ATOM 1987 CA THR A 136 -2.329 -6.690 12.131 1.00 62.41 C ATOM 1988 C THR A 136 -2.708 -7.949 11.333 1.00 62.34 C ATOM 1989 O THR A 136 -1.838 -8.733 10.954 1.00 31.24 O ATOM 1990 CB THR A 136 -2.730 -6.890 13.618 1.00 53.24 C ATOM 1991 OG1 THR A 136 -2.385 -5.728 14.389 1.00 14.31 O ATOM 1992 CG2 THR A 136 -2.041 -8.110 14.224 1.00 64.20 C ATOM 0 H THR A 136 -3.565 -4.985 12.197 1.00 32.34 H new ATOM 0 HA THR A 136 -1.251 -6.543 12.072 1.00 62.41 H new ATOM 0 HB THR A 136 -3.808 -7.047 13.645 1.00 53.24 H new ATOM 0 HG1 THR A 136 -2.899 -4.958 14.068 1.00 14.31 H new ATOM 0 HG21 THR A 136 -2.345 -8.220 15.265 1.00 64.20 H new ATOM 0 HG22 THR A 136 -2.326 -9.003 13.667 1.00 64.20 H new ATOM 0 HG23 THR A 136 -0.960 -7.980 14.173 1.00 64.20 H new ATOM 2000 N ASP A 137 -4.006 -8.137 11.076 1.00 21.44 N ATOM 2001 CA ASP A 137 -4.487 -9.283 10.284 1.00 52.41 C ATOM 2002 C ASP A 137 -3.827 -9.319 8.895 1.00 64.42 C ATOM 2003 O ASP A 137 -3.291 -10.348 8.471 1.00 43.10 O ATOM 2004 CB ASP A 137 -6.015 -9.216 10.136 1.00 10.25 C ATOM 2005 CG ASP A 137 -6.565 -10.321 9.241 1.00 72.11 C ATOM 2006 OD1 ASP A 137 -6.752 -11.455 9.728 1.00 23.11 O ATOM 2007 OD2 ASP A 137 -6.806 -10.065 8.046 1.00 35.01 O ATOM 0 H ASP A 137 -4.745 -7.514 11.402 1.00 21.44 H new ATOM 0 HA ASP A 137 -4.213 -10.196 10.813 1.00 52.41 H new ATOM 0 HB2 ASP A 137 -6.476 -9.288 11.121 1.00 10.25 H new ATOM 0 HB3 ASP A 137 -6.295 -8.246 9.724 1.00 10.25 H new ATOM 2012 N LEU A 138 -3.871 -8.180 8.206 1.00 12.45 N ATOM 2013 CA LEU A 138 -3.287 -8.041 6.869 1.00 30.01 C ATOM 2014 C LEU A 138 -1.812 -8.488 6.863 1.00 11.10 C ATOM 2015 O LEU A 138 -1.393 -9.294 6.027 1.00 63.13 O ATOM 2016 CB LEU A 138 -3.414 -6.571 6.415 1.00 43.03 C ATOM 2017 CG LEU A 138 -3.457 -6.318 4.891 1.00 72.51 C ATOM 2018 CD1 LEU A 138 -2.143 -6.706 4.212 1.00 34.11 C ATOM 2019 CD2 LEU A 138 -4.639 -7.056 4.262 1.00 25.51 C ATOM 0 H LEU A 138 -4.311 -7.329 8.556 1.00 12.45 H new ATOM 0 HA LEU A 138 -3.826 -8.684 6.173 1.00 30.01 H new ATOM 0 HB2 LEU A 138 -4.321 -6.156 6.855 1.00 43.03 H new ATOM 0 HB3 LEU A 138 -2.574 -6.013 6.829 1.00 43.03 H new ATOM 0 HG LEU A 138 -3.593 -5.248 4.736 1.00 72.51 H new ATOM 0 HD11 LEU A 138 -2.215 -6.512 3.142 1.00 34.11 H new ATOM 0 HD12 LEU A 138 -1.328 -6.117 4.633 1.00 34.11 H new ATOM 0 HD13 LEU A 138 -1.947 -7.766 4.377 1.00 34.11 H new ATOM 0 HD21 LEU A 138 -4.656 -6.868 3.188 1.00 25.51 H new ATOM 0 HD22 LEU A 138 -4.537 -8.126 4.441 1.00 25.51 H new ATOM 0 HD23 LEU A 138 -5.568 -6.701 4.707 1.00 25.51 H new ATOM 2031 N GLY A 139 -1.036 -7.964 7.810 1.00 21.21 N ATOM 2032 CA GLY A 139 0.371 -8.332 7.924 1.00 23.44 C ATOM 2033 C GLY A 139 0.581 -9.801 8.288 1.00 11.22 C ATOM 2034 O GLY A 139 1.439 -10.474 7.710 1.00 2.55 O ATOM 0 H GLY A 139 -1.356 -7.288 8.504 1.00 21.21 H new ATOM 0 HA2 GLY A 139 0.872 -8.123 6.979 1.00 23.44 H new ATOM 0 HA3 GLY A 139 0.844 -7.706 8.681 1.00 23.44 H new ATOM 2038 N GLN A 140 -0.208 -10.301 9.245 1.00 44.32 N ATOM 2039 CA GLN A 140 -0.084 -11.692 9.707 1.00 14.12 C ATOM 2040 C GLN A 140 -0.274 -12.701 8.567 1.00 52.23 C ATOM 2041 O GLN A 140 0.558 -13.581 8.377 1.00 22.23 O ATOM 2042 CB GLN A 140 -1.088 -12.004 10.831 1.00 1.31 C ATOM 2043 CG GLN A 140 -0.783 -11.316 12.156 1.00 14.24 C ATOM 2044 CD GLN A 140 -1.715 -11.760 13.272 1.00 51.45 C ATOM 2045 OE1 GLN A 140 -1.424 -12.705 14.003 1.00 41.30 O ATOM 2046 NE2 GLN A 140 -2.848 -11.099 13.401 1.00 42.14 N ATOM 0 H GLN A 140 -0.938 -9.766 9.715 1.00 44.32 H new ATOM 0 HA GLN A 140 0.931 -11.793 10.092 1.00 14.12 H new ATOM 0 HB2 GLN A 140 -2.085 -11.709 10.503 1.00 1.31 H new ATOM 0 HB3 GLN A 140 -1.111 -13.082 10.992 1.00 1.31 H new ATOM 0 HG2 GLN A 140 0.247 -11.527 12.442 1.00 14.24 H new ATOM 0 HG3 GLN A 140 -0.864 -10.237 12.028 1.00 14.24 H new ATOM 0 HE21 GLN A 140 -3.058 -10.320 12.777 1.00 42.14 H new ATOM 0 HE22 GLN A 140 -3.515 -11.367 14.125 1.00 42.14 H new ATOM 2055 N TRP A 141 -1.362 -12.569 7.812 1.00 43.35 N ATOM 2056 CA TRP A 141 -1.676 -13.528 6.743 1.00 4.44 C ATOM 2057 C TRP A 141 -0.521 -13.651 5.733 1.00 71.40 C ATOM 2058 O TRP A 141 -0.028 -14.746 5.465 1.00 31.21 O ATOM 2059 CB TRP A 141 -2.962 -13.112 6.018 1.00 31.42 C ATOM 2060 CG TRP A 141 -3.446 -14.129 5.023 1.00 14.31 C ATOM 2061 CD1 TRP A 141 -4.044 -15.326 5.300 1.00 21.40 C ATOM 2062 CD2 TRP A 141 -3.378 -14.038 3.593 1.00 4.43 C ATOM 2063 NE1 TRP A 141 -4.352 -15.980 4.133 1.00 40.24 N ATOM 2064 CE2 TRP A 141 -3.952 -15.212 3.073 1.00 54.04 C ATOM 2065 CE3 TRP A 141 -2.888 -13.075 2.702 1.00 42.31 C ATOM 2066 CZ2 TRP A 141 -4.047 -15.450 1.704 1.00 62.02 C ATOM 2067 CZ3 TRP A 141 -2.983 -13.314 1.345 1.00 51.14 C ATOM 2068 CH2 TRP A 141 -3.562 -14.492 0.857 1.00 62.14 C ATOM 0 H TRP A 141 -2.040 -11.814 7.915 1.00 43.35 H new ATOM 0 HA TRP A 141 -1.821 -14.503 7.207 1.00 4.44 H new ATOM 0 HB2 TRP A 141 -3.745 -12.936 6.756 1.00 31.42 H new ATOM 0 HB3 TRP A 141 -2.790 -12.166 5.504 1.00 31.42 H new ATOM 0 HD1 TRP A 141 -4.245 -15.703 6.292 1.00 21.40 H new ATOM 0 HE1 TRP A 141 -4.806 -16.891 4.067 1.00 40.24 H new ATOM 0 HE3 TRP A 141 -2.444 -12.162 3.069 1.00 42.31 H new ATOM 0 HZ2 TRP A 141 -4.488 -16.360 1.324 1.00 62.02 H new ATOM 0 HZ3 TRP A 141 -2.604 -12.580 0.649 1.00 51.14 H new ATOM 0 HH2 TRP A 141 -3.627 -14.647 -0.210 1.00 62.14 H new ATOM 2079 N VAL A 142 -0.081 -12.510 5.207 1.00 34.23 N ATOM 2080 CA VAL A 142 0.973 -12.472 4.185 1.00 2.14 C ATOM 2081 C VAL A 142 2.278 -13.135 4.663 1.00 34.33 C ATOM 2082 O VAL A 142 2.829 -14.006 3.986 1.00 1.52 O ATOM 2083 CB VAL A 142 1.270 -11.013 3.758 1.00 54.41 C ATOM 2084 CG1 VAL A 142 2.341 -10.965 2.666 1.00 54.10 C ATOM 2085 CG2 VAL A 142 -0.012 -10.321 3.298 1.00 53.22 C ATOM 0 H VAL A 142 -0.438 -11.592 5.471 1.00 34.23 H new ATOM 0 HA VAL A 142 0.598 -13.038 3.333 1.00 2.14 H new ATOM 0 HB VAL A 142 1.658 -10.477 4.624 1.00 54.41 H new ATOM 0 HG11 VAL A 142 2.529 -9.928 2.386 1.00 54.10 H new ATOM 0 HG12 VAL A 142 3.262 -11.413 3.040 1.00 54.10 H new ATOM 0 HG13 VAL A 142 1.996 -11.520 1.793 1.00 54.10 H new ATOM 0 HG21 VAL A 142 0.214 -9.297 3.001 1.00 53.22 H new ATOM 0 HG22 VAL A 142 -0.432 -10.860 2.449 1.00 53.22 H new ATOM 0 HG23 VAL A 142 -0.734 -10.311 4.115 1.00 53.22 H new ATOM 2095 N THR A 143 2.768 -12.728 5.830 1.00 21.30 N ATOM 2096 CA THR A 143 4.045 -13.247 6.343 1.00 22.54 C ATOM 2097 C THR A 143 3.913 -14.689 6.859 1.00 50.44 C ATOM 2098 O THR A 143 4.812 -15.511 6.672 1.00 51.21 O ATOM 2099 CB THR A 143 4.626 -12.350 7.467 1.00 10.31 C ATOM 2100 OG1 THR A 143 5.943 -12.803 7.825 1.00 61.41 O ATOM 2101 CG2 THR A 143 3.733 -12.348 8.707 1.00 73.24 C ATOM 0 H THR A 143 2.311 -12.048 6.437 1.00 21.30 H new ATOM 0 HA THR A 143 4.733 -13.239 5.498 1.00 22.54 H new ATOM 0 HB THR A 143 4.675 -11.331 7.083 1.00 10.31 H new ATOM 0 HG1 THR A 143 6.426 -12.080 8.278 1.00 61.41 H new ATOM 0 HG21 THR A 143 4.174 -11.708 9.472 1.00 73.24 H new ATOM 0 HG22 THR A 143 2.745 -11.970 8.443 1.00 73.24 H new ATOM 0 HG23 THR A 143 3.642 -13.364 9.092 1.00 73.24 H new ATOM 2109 N ARG A 144 2.781 -15.006 7.492 1.00 33.35 N ATOM 2110 CA ARG A 144 2.556 -16.353 8.030 1.00 62.01 C ATOM 2111 C ARG A 144 2.200 -17.352 6.922 1.00 40.22 C ATOM 2112 O ARG A 144 2.209 -18.558 7.148 1.00 3.20 O ATOM 2113 CB ARG A 144 1.484 -16.339 9.131 1.00 52.23 C ATOM 2114 CG ARG A 144 1.892 -15.506 10.344 1.00 5.41 C ATOM 2115 CD ARG A 144 0.862 -15.563 11.468 1.00 61.14 C ATOM 2116 NE ARG A 144 1.281 -14.764 12.622 1.00 41.24 N ATOM 2117 CZ ARG A 144 1.715 -15.268 13.749 1.00 43.45 C ATOM 2118 NH1 ARG A 144 1.715 -16.547 13.946 1.00 62.52 N ATOM 2119 NH2 ARG A 144 2.122 -14.487 14.697 1.00 74.40 N ATOM 0 H ARG A 144 2.011 -14.355 7.645 1.00 33.35 H new ATOM 0 HA ARG A 144 3.492 -16.685 8.479 1.00 62.01 H new ATOM 0 HB2 ARG A 144 0.554 -15.945 8.721 1.00 52.23 H new ATOM 0 HB3 ARG A 144 1.283 -17.362 9.449 1.00 52.23 H new ATOM 0 HG2 ARG A 144 2.852 -15.861 10.718 1.00 5.41 H new ATOM 0 HG3 ARG A 144 2.033 -14.470 10.038 1.00 5.41 H new ATOM 0 HD2 ARG A 144 -0.098 -15.199 11.102 1.00 61.14 H new ATOM 0 HD3 ARG A 144 0.714 -16.598 11.775 1.00 61.14 H new ATOM 0 HE ARG A 144 1.231 -13.748 12.542 1.00 41.24 H new ATOM 0 HH11 ARG A 144 1.374 -17.175 13.218 1.00 62.52 H new ATOM 0 HH12 ARG A 144 2.056 -16.927 14.829 1.00 62.52 H new ATOM 0 HH21 ARG A 144 2.105 -13.475 14.567 1.00 74.40 H new ATOM 0 HH22 ARG A 144 2.460 -14.883 15.574 1.00 74.40 H new ATOM 2133 N ASP A 145 1.877 -16.847 5.730 1.00 15.33 N ATOM 2134 CA ASP A 145 1.785 -17.689 4.535 1.00 50.25 C ATOM 2135 C ASP A 145 3.176 -18.211 4.150 1.00 15.14 C ATOM 2136 O ASP A 145 3.382 -19.414 3.961 1.00 74.31 O ATOM 2137 CB ASP A 145 1.176 -16.897 3.372 1.00 5.45 C ATOM 2138 CG ASP A 145 1.305 -17.630 2.047 1.00 32.21 C ATOM 2139 OD1 ASP A 145 0.576 -18.622 1.831 1.00 23.13 O ATOM 2140 OD2 ASP A 145 2.160 -17.240 1.224 1.00 63.42 O ATOM 0 H ASP A 145 1.675 -15.861 5.566 1.00 15.33 H new ATOM 0 HA ASP A 145 1.138 -18.539 4.754 1.00 50.25 H new ATOM 0 HB2 ASP A 145 0.123 -16.705 3.578 1.00 5.45 H new ATOM 0 HB3 ASP A 145 1.668 -15.927 3.298 1.00 5.45 H new ATOM 2145 N ARG A 146 4.127 -17.289 4.048 1.00 64.22 N ATOM 2146 CA ARG A 146 5.517 -17.623 3.725 1.00 60.43 C ATOM 2147 C ARG A 146 6.128 -18.519 4.818 1.00 41.11 C ATOM 2148 O ARG A 146 6.943 -19.403 4.543 1.00 14.40 O ATOM 2149 CB ARG A 146 6.333 -16.331 3.573 1.00 5.35 C ATOM 2150 CG ARG A 146 5.646 -15.278 2.707 1.00 12.13 C ATOM 2151 CD ARG A 146 6.443 -13.980 2.638 1.00 73.22 C ATOM 2152 NE ARG A 146 7.650 -14.113 1.828 1.00 52.52 N ATOM 2153 CZ ARG A 146 8.782 -13.514 2.081 1.00 64.34 C ATOM 2154 NH1 ARG A 146 8.931 -12.800 3.155 1.00 53.05 N ATOM 2155 NH2 ARG A 146 9.769 -13.648 1.255 1.00 12.50 N ATOM 0 H ARG A 146 3.961 -16.292 4.185 1.00 64.22 H new ATOM 0 HA ARG A 146 5.540 -18.174 2.785 1.00 60.43 H new ATOM 0 HB2 ARG A 146 6.522 -15.911 4.561 1.00 5.35 H new ATOM 0 HB3 ARG A 146 7.303 -16.572 3.138 1.00 5.35 H new ATOM 0 HG2 ARG A 146 5.508 -15.672 1.700 1.00 12.13 H new ATOM 0 HG3 ARG A 146 4.653 -15.072 3.107 1.00 12.13 H new ATOM 0 HD2 ARG A 146 5.815 -13.192 2.223 1.00 73.22 H new ATOM 0 HD3 ARG A 146 6.717 -13.671 3.647 1.00 73.22 H new ATOM 0 HE ARG A 146 7.606 -14.716 1.007 1.00 52.52 H new ATOM 0 HH11 ARG A 146 8.158 -12.702 3.813 1.00 53.05 H new ATOM 0 HH12 ARG A 146 9.821 -12.337 3.340 1.00 53.05 H new ATOM 0 HH21 ARG A 146 9.658 -14.217 0.416 1.00 12.50 H new ATOM 0 HH22 ARG A 146 10.658 -13.184 1.443 1.00 12.50 H new ATOM 2169 N LEU A 147 5.709 -18.283 6.060 1.00 61.13 N ATOM 2170 CA LEU A 147 6.153 -19.078 7.211 1.00 20.20 C ATOM 2171 C LEU A 147 5.411 -20.432 7.276 1.00 2.44 C ATOM 2172 O LEU A 147 5.999 -21.460 7.618 1.00 23.32 O ATOM 2173 CB LEU A 147 5.929 -18.253 8.499 1.00 22.22 C ATOM 2174 CG LEU A 147 6.557 -18.791 9.804 1.00 23.31 C ATOM 2175 CD1 LEU A 147 5.743 -19.944 10.391 1.00 32.50 C ATOM 2176 CD2 LEU A 147 8.007 -19.209 9.571 1.00 13.05 C ATOM 0 H LEU A 147 5.054 -17.539 6.300 1.00 61.13 H new ATOM 0 HA LEU A 147 7.214 -19.306 7.107 1.00 20.20 H new ATOM 0 HB2 LEU A 147 6.316 -17.249 8.328 1.00 22.22 H new ATOM 0 HB3 LEU A 147 4.855 -18.158 8.656 1.00 22.22 H new ATOM 0 HG LEU A 147 6.544 -17.982 10.534 1.00 23.31 H new ATOM 0 HD11 LEU A 147 6.217 -20.294 11.308 1.00 32.50 H new ATOM 0 HD12 LEU A 147 4.733 -19.600 10.614 1.00 32.50 H new ATOM 0 HD13 LEU A 147 5.698 -20.761 9.671 1.00 32.50 H new ATOM 0 HD21 LEU A 147 8.431 -19.585 10.502 1.00 13.05 H new ATOM 0 HD22 LEU A 147 8.043 -19.992 8.814 1.00 13.05 H new ATOM 0 HD23 LEU A 147 8.583 -18.349 9.231 1.00 13.05 H new