USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=33 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 -46:sc= 0.265 USER MOD Set 1.2: A 127 THR OG1 : rot -160:sc= 0.56 USER MOD Set 2.1: A 27 THR OG1 : rot 75:sc= 1.05 USER MOD Set 2.2: A 140 GLN : amide:sc= 0.205 K(o=1.3,f=0.48) USER MOD Set 3.1: A 13 SER OG : rot 100:sc= 1.28 USER MOD Set 3.2: A 90 THR OG1 : rot -157:sc= 0.689 USER MOD Single : A 1 SER N :NH3+ 163:sc= 2.24 (180deg=1.89) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 130:sc= 0 USER MOD Single : A 8 SER OG : rot -63:sc= 0.494 USER MOD Single : A 10 TYR OH : rot -166:sc= -1.41! USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.57) USER MOD Single : A 22 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -166:sc=-0.00582 (180deg=-0.158) USER MOD Single : A 43 GLN : amide:sc= -1.59 X(o=-1.6,f=-1.8) USER MOD Single : A 52 CYS SG : rot -44:sc= 0.278 USER MOD Single : A 53 THR OG1 : rot -83:sc= 0.749 USER MOD Single : A 59 MET CE :methyl 178:sc= -4.26! (180deg=-4.43!) USER MOD Single : A 60 SER OG : rot 130:sc= -0.349 USER MOD Single : A 64 SER OG : rot -15:sc= 0.607 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.31) USER MOD Single : A 73 SER OG : rot 89:sc= 0.0495 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 73:sc= 0.81 USER MOD Single : A 80 ASN : amide:sc= 0.32 K(o=0.32,f=-5.2!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 GLN : amide:sc= -1.09 K(o=-1.1,f=0.32) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 154:sc= 1.21 (180deg=-0.403) USER MOD Single : A 107 ASN : amide:sc= -0.403 K(o=-0.4,f=-2.2!) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 41:sc= 0.808 USER MOD Single : A 120 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.082) USER MOD Single : A 121 GLN : amide:sc= -3.09! K(o=-3.1!,f=-0.2) USER MOD Single : A 122 THR OG1 : rot 39:sc= 0.607 USER MOD Single : A 126 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 128 TYR OH : rot 150:sc= -1.15 USER MOD Single : A 129 LYS NZ :NH3+ 177:sc= 0.323 (180deg=0.25) USER MOD Single : A 131 CYS SG : rot -70:sc= 0.00452 USER MOD Single : A 136 THR OG1 : rot 73:sc= 0.208 USER MOD Single : A 143 THR OG1 : rot 170:sc= 0.262 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 8.587 -7.583 4.074 1.00 75.13 N ATOM 2 CA SER A 1 7.215 -8.079 3.770 1.00 10.51 C ATOM 3 C SER A 1 6.167 -6.977 3.962 1.00 23.24 C ATOM 4 O SER A 1 6.409 -5.998 4.664 1.00 23.30 O ATOM 5 CB SER A 1 6.865 -9.286 4.656 1.00 63.32 C ATOM 6 OG SER A 1 7.701 -10.396 4.370 1.00 31.12 O ATOM 0 H1 SER A 1 9.225 -8.392 4.218 1.00 75.13 H new ATOM 0 H2 SER A 1 8.932 -7.007 3.280 1.00 75.13 H new ATOM 0 H3 SER A 1 8.563 -7.003 4.937 1.00 75.13 H new ATOM 0 HA SER A 1 7.204 -8.387 2.724 1.00 10.51 H new ATOM 0 HB2 SER A 1 6.968 -9.011 5.706 1.00 63.32 H new ATOM 0 HB3 SER A 1 5.823 -9.564 4.500 1.00 63.32 H new ATOM 0 HG SER A 1 7.457 -11.148 4.949 1.00 31.12 H new ATOM 14 N ILE A 2 5.002 -7.157 3.327 1.00 24.13 N ATOM 15 CA ILE A 2 3.868 -6.220 3.440 1.00 51.11 C ATOM 16 C ILE A 2 4.183 -4.831 2.847 1.00 74.15 C ATOM 17 O ILE A 2 5.002 -4.079 3.382 1.00 14.24 O ATOM 18 CB ILE A 2 3.393 -6.059 4.912 1.00 22.15 C ATOM 19 CG1 ILE A 2 2.986 -7.423 5.500 1.00 72.51 C ATOM 20 CG2 ILE A 2 2.233 -5.065 5.002 1.00 11.35 C ATOM 21 CD1 ILE A 2 1.868 -8.115 4.741 1.00 61.55 C ATOM 0 H ILE A 2 4.815 -7.955 2.720 1.00 24.13 H new ATOM 0 HA ILE A 2 3.063 -6.665 2.854 1.00 51.11 H new ATOM 0 HB ILE A 2 4.223 -5.666 5.498 1.00 22.15 H new ATOM 0 HG12 ILE A 2 3.859 -8.076 5.515 1.00 72.51 H new ATOM 0 HG13 ILE A 2 2.675 -7.282 6.535 1.00 72.51 H new ATOM 0 HG21 ILE A 2 1.917 -4.968 6.041 1.00 11.35 H new ATOM 0 HG22 ILE A 2 2.557 -4.093 4.629 1.00 11.35 H new ATOM 0 HG23 ILE A 2 1.398 -5.425 4.401 1.00 11.35 H new ATOM 0 HD11 ILE A 2 1.640 -9.068 5.218 1.00 61.55 H new ATOM 0 HD12 ILE A 2 0.979 -7.484 4.748 1.00 61.55 H new ATOM 0 HD13 ILE A 2 2.181 -8.290 3.712 1.00 61.55 H new ATOM 33 N GLY A 3 3.516 -4.498 1.743 1.00 4.44 N ATOM 34 CA GLY A 3 3.681 -3.185 1.130 1.00 0.03 C ATOM 35 C GLY A 3 2.994 -2.075 1.926 1.00 4.14 C ATOM 36 O GLY A 3 1.769 -1.933 1.888 1.00 71.15 O ATOM 0 H GLY A 3 2.862 -5.114 1.260 1.00 4.44 H new ATOM 0 HA2 GLY A 3 4.744 -2.960 1.042 1.00 0.03 H new ATOM 0 HA3 GLY A 3 3.275 -3.207 0.119 1.00 0.03 H new ATOM 40 N VAL A 4 3.782 -1.297 2.658 1.00 21.31 N ATOM 41 CA VAL A 4 3.256 -0.206 3.482 1.00 14.14 C ATOM 42 C VAL A 4 3.171 1.112 2.689 1.00 54.31 C ATOM 43 O VAL A 4 4.148 1.854 2.590 1.00 65.14 O ATOM 44 CB VAL A 4 4.135 0.005 4.743 1.00 71.12 C ATOM 45 CG1 VAL A 4 3.543 1.079 5.653 1.00 34.22 C ATOM 46 CG2 VAL A 4 4.318 -1.310 5.502 1.00 63.15 C ATOM 0 H VAL A 4 4.796 -1.400 2.700 1.00 21.31 H new ATOM 0 HA VAL A 4 2.249 -0.491 3.788 1.00 14.14 H new ATOM 0 HB VAL A 4 5.116 0.349 4.415 1.00 71.12 H new ATOM 0 HG11 VAL A 4 4.180 1.206 6.529 1.00 34.22 H new ATOM 0 HG12 VAL A 4 3.481 2.022 5.110 1.00 34.22 H new ATOM 0 HG13 VAL A 4 2.545 0.777 5.971 1.00 34.22 H new ATOM 0 HG21 VAL A 4 4.937 -1.139 6.382 1.00 63.15 H new ATOM 0 HG22 VAL A 4 3.344 -1.690 5.812 1.00 63.15 H new ATOM 0 HG23 VAL A 4 4.803 -2.040 4.854 1.00 63.15 H new ATOM 56 N PHE A 5 2.006 1.385 2.106 1.00 72.03 N ATOM 57 CA PHE A 5 1.798 2.606 1.313 1.00 50.23 C ATOM 58 C PHE A 5 1.312 3.773 2.193 1.00 40.40 C ATOM 59 O PHE A 5 0.231 3.711 2.779 1.00 71.41 O ATOM 60 CB PHE A 5 0.776 2.341 0.194 1.00 53.31 C ATOM 61 CG PHE A 5 1.210 1.309 -0.825 1.00 42.32 C ATOM 62 CD1 PHE A 5 1.310 -0.029 -0.479 1.00 11.31 C ATOM 63 CD2 PHE A 5 1.516 1.679 -2.128 1.00 35.15 C ATOM 64 CE1 PHE A 5 1.702 -0.974 -1.408 1.00 61.44 C ATOM 65 CE2 PHE A 5 1.906 0.738 -3.060 1.00 71.25 C ATOM 66 CZ PHE A 5 2.000 -0.590 -2.700 1.00 64.04 C ATOM 0 H PHE A 5 1.187 0.780 2.165 1.00 72.03 H new ATOM 0 HA PHE A 5 2.756 2.886 0.875 1.00 50.23 H new ATOM 0 HB2 PHE A 5 -0.161 2.015 0.646 1.00 53.31 H new ATOM 0 HB3 PHE A 5 0.571 3.279 -0.323 1.00 53.31 H new ATOM 0 HD1 PHE A 5 1.079 -0.337 0.530 1.00 11.31 H new ATOM 0 HD2 PHE A 5 1.448 2.718 -2.416 1.00 35.15 H new ATOM 0 HE1 PHE A 5 1.775 -2.013 -1.123 1.00 61.44 H new ATOM 0 HE2 PHE A 5 2.137 1.042 -4.070 1.00 71.25 H new ATOM 0 HZ PHE A 5 2.306 -1.328 -3.427 1.00 64.04 H new ATOM 76 N TYR A 6 2.110 4.841 2.283 1.00 12.45 N ATOM 77 CA TYR A 6 1.725 6.026 3.068 1.00 24.31 C ATOM 78 C TYR A 6 1.997 7.341 2.317 1.00 52.45 C ATOM 79 O TYR A 6 2.909 7.433 1.488 1.00 72.52 O ATOM 80 CB TYR A 6 2.431 6.032 4.432 1.00 23.31 C ATOM 81 CG TYR A 6 3.945 5.903 4.368 1.00 24.13 C ATOM 82 CD1 TYR A 6 4.752 7.014 4.151 1.00 1.55 C ATOM 83 CD2 TYR A 6 4.565 4.669 4.543 1.00 22.24 C ATOM 84 CE1 TYR A 6 6.128 6.899 4.104 1.00 3.33 C ATOM 85 CE2 TYR A 6 5.940 4.548 4.497 1.00 43.33 C ATOM 86 CZ TYR A 6 6.717 5.666 4.279 1.00 54.41 C ATOM 87 OH TYR A 6 8.089 5.552 4.241 1.00 50.54 O ATOM 0 H TYR A 6 3.020 4.913 1.828 1.00 12.45 H new ATOM 0 HA TYR A 6 0.649 5.961 3.228 1.00 24.31 H new ATOM 0 HB2 TYR A 6 2.181 6.958 4.950 1.00 23.31 H new ATOM 0 HB3 TYR A 6 2.036 5.213 5.033 1.00 23.31 H new ATOM 0 HD1 TYR A 6 4.296 7.984 4.017 1.00 1.55 H new ATOM 0 HD2 TYR A 6 3.960 3.791 4.718 1.00 22.24 H new ATOM 0 HE1 TYR A 6 6.739 7.772 3.931 1.00 3.33 H new ATOM 0 HE2 TYR A 6 6.404 3.582 4.631 1.00 43.33 H new ATOM 0 HH TYR A 6 8.398 5.054 5.027 1.00 50.54 H new ATOM 97 N VAL A 7 1.192 8.360 2.621 1.00 44.51 N ATOM 98 CA VAL A 7 1.293 9.666 1.961 1.00 52.23 C ATOM 99 C VAL A 7 2.137 10.650 2.785 1.00 22.22 C ATOM 100 O VAL A 7 1.645 11.267 3.729 1.00 4.34 O ATOM 101 CB VAL A 7 -0.107 10.282 1.717 1.00 21.11 C ATOM 102 CG1 VAL A 7 0.003 11.580 0.920 1.00 63.44 C ATOM 103 CG2 VAL A 7 -1.025 9.281 1.018 1.00 62.34 C ATOM 0 H VAL A 7 0.457 8.306 3.326 1.00 44.51 H new ATOM 0 HA VAL A 7 1.783 9.495 1.002 1.00 52.23 H new ATOM 0 HB VAL A 7 -0.548 10.521 2.685 1.00 21.11 H new ATOM 0 HG11 VAL A 7 -0.992 11.995 0.761 1.00 63.44 H new ATOM 0 HG12 VAL A 7 0.610 12.296 1.473 1.00 63.44 H new ATOM 0 HG13 VAL A 7 0.470 11.377 -0.044 1.00 63.44 H new ATOM 0 HG21 VAL A 7 -2.003 9.735 0.857 1.00 62.34 H new ATOM 0 HG22 VAL A 7 -0.593 9.000 0.058 1.00 62.34 H new ATOM 0 HG23 VAL A 7 -1.136 8.393 1.640 1.00 62.34 H new ATOM 113 N SER A 8 3.408 10.782 2.421 1.00 61.20 N ATOM 114 CA SER A 8 4.334 11.692 3.115 1.00 42.33 C ATOM 115 C SER A 8 4.014 13.170 2.838 1.00 41.03 C ATOM 116 O SER A 8 4.314 14.042 3.653 1.00 5.51 O ATOM 117 CB SER A 8 5.782 11.392 2.694 1.00 54.32 C ATOM 118 OG SER A 8 6.104 10.023 2.894 1.00 23.23 O ATOM 0 H SER A 8 3.829 10.270 1.646 1.00 61.20 H new ATOM 0 HA SER A 8 4.213 11.521 4.185 1.00 42.33 H new ATOM 0 HB2 SER A 8 5.919 11.650 1.644 1.00 54.32 H new ATOM 0 HB3 SER A 8 6.467 12.017 3.268 1.00 54.32 H new ATOM 0 HG SER A 8 6.046 9.809 3.849 1.00 23.23 H new ATOM 124 N GLU A 9 3.412 13.445 1.682 1.00 71.33 N ATOM 125 CA GLU A 9 3.106 14.822 1.266 1.00 51.01 C ATOM 126 C GLU A 9 1.980 15.458 2.102 1.00 72.10 C ATOM 127 O GLU A 9 2.063 16.625 2.487 1.00 60.43 O ATOM 128 CB GLU A 9 2.710 14.845 -0.219 1.00 3.31 C ATOM 129 CG GLU A 9 2.454 16.244 -0.769 1.00 74.33 C ATOM 130 CD GLU A 9 1.958 16.228 -2.207 1.00 74.30 C ATOM 131 OE1 GLU A 9 2.761 15.934 -3.117 1.00 55.04 O ATOM 132 OE2 GLU A 9 0.757 16.504 -2.430 1.00 44.11 O ATOM 0 H GLU A 9 3.124 12.733 1.011 1.00 71.33 H new ATOM 0 HA GLU A 9 4.009 15.410 1.428 1.00 51.01 H new ATOM 0 HB2 GLU A 9 3.501 14.375 -0.803 1.00 3.31 H new ATOM 0 HB3 GLU A 9 1.812 14.242 -0.355 1.00 3.31 H new ATOM 0 HG2 GLU A 9 1.719 16.748 -0.141 1.00 74.33 H new ATOM 0 HG3 GLU A 9 3.374 16.826 -0.713 1.00 74.33 H new ATOM 139 N TYR A 10 0.925 14.691 2.382 1.00 72.14 N ATOM 140 CA TYR A 10 -0.285 15.245 3.009 1.00 52.51 C ATOM 141 C TYR A 10 -0.513 14.756 4.452 1.00 34.21 C ATOM 142 O TYR A 10 -0.910 13.608 4.682 1.00 64.30 O ATOM 143 CB TYR A 10 -1.521 14.921 2.155 1.00 43.24 C ATOM 144 CG TYR A 10 -2.829 15.357 2.798 1.00 45.22 C ATOM 145 CD1 TYR A 10 -3.140 16.705 2.943 1.00 3.12 C ATOM 146 CD2 TYR A 10 -3.742 14.421 3.280 1.00 11.15 C ATOM 147 CE1 TYR A 10 -4.317 17.105 3.543 1.00 14.33 C ATOM 148 CE2 TYR A 10 -4.920 14.817 3.885 1.00 24.50 C ATOM 149 CZ TYR A 10 -5.203 16.160 4.012 1.00 53.33 C ATOM 150 OH TYR A 10 -6.369 16.561 4.621 1.00 41.35 O ATOM 0 H TYR A 10 0.880 13.691 2.188 1.00 72.14 H new ATOM 0 HA TYR A 10 -0.131 16.323 3.063 1.00 52.51 H new ATOM 0 HB2 TYR A 10 -1.421 15.408 1.185 1.00 43.24 H new ATOM 0 HB3 TYR A 10 -1.555 13.847 1.971 1.00 43.24 H new ATOM 0 HD1 TYR A 10 -2.449 17.451 2.580 1.00 3.12 H new ATOM 0 HD2 TYR A 10 -3.525 13.368 3.179 1.00 11.15 H new ATOM 0 HE1 TYR A 10 -4.543 18.156 3.645 1.00 14.33 H new ATOM 0 HE2 TYR A 10 -5.615 14.078 4.256 1.00 24.50 H new ATOM 0 HH TYR A 10 -6.776 15.798 5.083 1.00 41.35 H new ATOM 160 N GLY A 11 -0.274 15.653 5.409 1.00 12.41 N ATOM 161 CA GLY A 11 -0.699 15.446 6.792 1.00 40.11 C ATOM 162 C GLY A 11 -0.222 14.149 7.449 1.00 71.15 C ATOM 163 O GLY A 11 0.737 13.513 7.010 1.00 51.15 O ATOM 0 H GLY A 11 0.214 16.534 5.249 1.00 12.41 H new ATOM 0 HA2 GLY A 11 -0.345 16.286 7.390 1.00 40.11 H new ATOM 0 HA3 GLY A 11 -1.788 15.468 6.825 1.00 40.11 H new ATOM 167 N TYR A 12 -0.919 13.771 8.522 1.00 50.43 N ATOM 168 CA TYR A 12 -0.547 12.621 9.362 1.00 1.42 C ATOM 169 C TYR A 12 -0.592 11.280 8.609 1.00 53.02 C ATOM 170 O TYR A 12 -0.261 10.240 9.174 1.00 64.14 O ATOM 171 CB TYR A 12 -1.471 12.556 10.586 1.00 72.55 C ATOM 172 CG TYR A 12 -1.547 13.865 11.352 1.00 45.24 C ATOM 173 CD1 TYR A 12 -0.525 14.254 12.213 1.00 30.31 C ATOM 174 CD2 TYR A 12 -2.639 14.717 11.206 1.00 43.23 C ATOM 175 CE1 TYR A 12 -0.586 15.450 12.900 1.00 14.35 C ATOM 176 CE2 TYR A 12 -2.706 15.916 11.887 1.00 51.42 C ATOM 177 CZ TYR A 12 -1.679 16.277 12.734 1.00 63.51 C ATOM 178 OH TYR A 12 -1.741 17.475 13.414 1.00 0.24 O ATOM 0 H TYR A 12 -1.761 14.253 8.838 1.00 50.43 H new ATOM 0 HA TYR A 12 0.487 12.776 9.669 1.00 1.42 H new ATOM 0 HB2 TYR A 12 -2.473 12.274 10.262 1.00 72.55 H new ATOM 0 HB3 TYR A 12 -1.120 11.771 11.256 1.00 72.55 H new ATOM 0 HD1 TYR A 12 0.331 13.609 12.346 1.00 30.31 H new ATOM 0 HD2 TYR A 12 -3.448 14.435 10.548 1.00 43.23 H new ATOM 0 HE1 TYR A 12 0.217 15.737 13.563 1.00 14.35 H new ATOM 0 HE2 TYR A 12 -3.558 16.567 11.757 1.00 51.42 H new ATOM 0 HH TYR A 12 -2.574 17.938 13.186 1.00 0.24 H new ATOM 188 N SER A 13 -0.993 11.302 7.337 1.00 32.22 N ATOM 189 CA SER A 13 -1.036 10.087 6.506 1.00 3.42 C ATOM 190 C SER A 13 0.322 9.367 6.497 1.00 23.11 C ATOM 191 O SER A 13 0.395 8.141 6.385 1.00 72.11 O ATOM 192 CB SER A 13 -1.432 10.444 5.069 1.00 53.12 C ATOM 193 OG SER A 13 -2.600 11.247 5.038 1.00 33.23 O ATOM 0 H SER A 13 -1.295 12.148 6.854 1.00 32.22 H new ATOM 0 HA SER A 13 -1.780 9.417 6.937 1.00 3.42 H new ATOM 0 HB2 SER A 13 -0.612 10.974 4.585 1.00 53.12 H new ATOM 0 HB3 SER A 13 -1.602 9.530 4.499 1.00 53.12 H new ATOM 0 HG SER A 13 -2.348 12.187 4.920 1.00 33.23 H new ATOM 199 N ASP A 14 1.390 10.151 6.611 1.00 40.33 N ATOM 200 CA ASP A 14 2.755 9.629 6.706 1.00 5.04 C ATOM 201 C ASP A 14 2.974 8.834 8.012 1.00 45.41 C ATOM 202 O ASP A 14 3.743 7.873 8.047 1.00 41.32 O ATOM 203 CB ASP A 14 3.739 10.804 6.622 1.00 21.34 C ATOM 204 CG ASP A 14 5.189 10.391 6.804 1.00 40.14 C ATOM 205 OD1 ASP A 14 5.792 9.871 5.846 1.00 60.23 O ATOM 206 OD2 ASP A 14 5.729 10.592 7.912 1.00 34.21 O ATOM 0 H ASP A 14 1.336 11.169 6.640 1.00 40.33 H new ATOM 0 HA ASP A 14 2.925 8.938 5.880 1.00 5.04 H new ATOM 0 HB2 ASP A 14 3.627 11.293 5.654 1.00 21.34 H new ATOM 0 HB3 ASP A 14 3.480 11.540 7.383 1.00 21.34 H new ATOM 211 N ARG A 15 2.295 9.246 9.083 1.00 74.33 N ATOM 212 CA ARG A 15 2.452 8.605 10.399 1.00 5.02 C ATOM 213 C ARG A 15 1.393 7.513 10.652 1.00 24.32 C ATOM 214 O ARG A 15 1.614 6.612 11.458 1.00 14.53 O ATOM 215 CB ARG A 15 2.393 9.659 11.518 1.00 35.14 C ATOM 216 CG ARG A 15 3.501 10.718 11.461 1.00 45.21 C ATOM 217 CD ARG A 15 4.901 10.111 11.611 1.00 14.01 C ATOM 218 NE ARG A 15 5.360 9.451 10.389 1.00 34.01 N ATOM 219 CZ ARG A 15 6.269 8.512 10.342 1.00 2.22 C ATOM 220 NH1 ARG A 15 6.845 8.089 11.422 1.00 11.42 N ATOM 221 NH2 ARG A 15 6.607 8.005 9.202 1.00 74.25 N ATOM 0 H ARG A 15 1.630 10.020 9.070 1.00 74.33 H new ATOM 0 HA ARG A 15 3.429 8.121 10.402 1.00 5.02 H new ATOM 0 HB2 ARG A 15 1.427 10.161 11.475 1.00 35.14 H new ATOM 0 HB3 ARG A 15 2.445 9.150 12.481 1.00 35.14 H new ATOM 0 HG2 ARG A 15 3.440 11.253 10.513 1.00 45.21 H new ATOM 0 HG3 ARG A 15 3.340 11.451 12.251 1.00 45.21 H new ATOM 0 HD2 ARG A 15 5.607 10.896 11.883 1.00 14.01 H new ATOM 0 HD3 ARG A 15 4.895 9.390 12.429 1.00 14.01 H new ATOM 0 HE ARG A 15 4.940 9.745 9.507 1.00 34.01 H new ATOM 0 HH11 ARG A 15 6.591 8.489 12.325 1.00 11.42 H new ATOM 0 HH12 ARG A 15 7.552 7.356 11.369 1.00 11.42 H new ATOM 0 HH21 ARG A 15 6.165 8.338 8.345 1.00 74.25 H new ATOM 0 HH22 ARG A 15 7.315 7.272 9.160 1.00 74.25 H new ATOM 235 N LEU A 16 0.248 7.595 9.972 1.00 35.31 N ATOM 236 CA LEU A 16 -0.813 6.579 10.112 1.00 63.45 C ATOM 237 C LEU A 16 -0.274 5.163 9.838 1.00 12.11 C ATOM 238 O LEU A 16 -0.633 4.200 10.518 1.00 4.41 O ATOM 239 CB LEU A 16 -1.977 6.878 9.152 1.00 14.44 C ATOM 240 CG LEU A 16 -2.733 8.193 9.408 1.00 53.33 C ATOM 241 CD1 LEU A 16 -3.840 8.392 8.373 1.00 71.45 C ATOM 242 CD2 LEU A 16 -3.306 8.221 10.823 1.00 44.34 C ATOM 0 H LEU A 16 0.026 8.348 9.321 1.00 35.31 H new ATOM 0 HA LEU A 16 -1.171 6.621 11.141 1.00 63.45 H new ATOM 0 HB2 LEU A 16 -1.588 6.896 8.134 1.00 14.44 H new ATOM 0 HB3 LEU A 16 -2.689 6.055 9.206 1.00 14.44 H new ATOM 0 HG LEU A 16 -2.025 9.016 9.311 1.00 53.33 H new ATOM 0 HD11 LEU A 16 -4.361 9.328 8.573 1.00 71.45 H new ATOM 0 HD12 LEU A 16 -3.403 8.426 7.375 1.00 71.45 H new ATOM 0 HD13 LEU A 16 -4.546 7.564 8.432 1.00 71.45 H new ATOM 0 HD21 LEU A 16 -3.836 9.160 10.982 1.00 44.34 H new ATOM 0 HD22 LEU A 16 -3.997 7.388 10.952 1.00 44.34 H new ATOM 0 HD23 LEU A 16 -2.495 8.136 11.546 1.00 44.34 H new ATOM 254 N ALA A 17 0.591 5.051 8.834 1.00 62.53 N ATOM 255 CA ALA A 17 1.196 3.767 8.470 1.00 74.12 C ATOM 256 C ALA A 17 2.205 3.283 9.523 1.00 35.11 C ATOM 257 O ALA A 17 2.481 2.088 9.623 1.00 42.45 O ATOM 258 CB ALA A 17 1.866 3.876 7.111 1.00 40.34 C ATOM 0 H ALA A 17 0.891 5.835 8.254 1.00 62.53 H new ATOM 0 HA ALA A 17 0.396 3.028 8.424 1.00 74.12 H new ATOM 0 HB1 ALA A 17 2.313 2.917 6.848 1.00 40.34 H new ATOM 0 HB2 ALA A 17 1.124 4.149 6.360 1.00 40.34 H new ATOM 0 HB3 ALA A 17 2.642 4.640 7.148 1.00 40.34 H new ATOM 264 N GLN A 18 2.747 4.213 10.313 1.00 45.43 N ATOM 265 CA GLN A 18 3.720 3.871 11.359 1.00 1.13 C ATOM 266 C GLN A 18 3.095 2.934 12.406 1.00 22.05 C ATOM 267 O GLN A 18 3.763 2.049 12.942 1.00 62.41 O ATOM 268 CB GLN A 18 4.251 5.144 12.034 1.00 40.22 C ATOM 269 CG GLN A 18 5.365 4.885 13.046 1.00 41.24 C ATOM 270 CD GLN A 18 5.891 6.158 13.691 1.00 5.44 C ATOM 271 OE1 GLN A 18 5.163 7.130 13.878 1.00 54.23 O ATOM 272 NE2 GLN A 18 7.164 6.170 14.028 1.00 4.21 N ATOM 0 H GLN A 18 2.530 5.208 10.250 1.00 45.43 H new ATOM 0 HA GLN A 18 4.553 3.349 10.888 1.00 1.13 H new ATOM 0 HB2 GLN A 18 4.621 5.824 11.267 1.00 40.22 H new ATOM 0 HB3 GLN A 18 3.426 5.649 12.537 1.00 40.22 H new ATOM 0 HG2 GLN A 18 4.994 4.217 13.823 1.00 41.24 H new ATOM 0 HG3 GLN A 18 6.187 4.370 12.549 1.00 41.24 H new ATOM 0 HE21 GLN A 18 7.744 5.348 13.860 1.00 4.21 H new ATOM 0 HE22 GLN A 18 7.570 7.002 14.457 1.00 4.21 H new ATOM 281 N ALA A 19 1.805 3.131 12.682 1.00 32.24 N ATOM 282 CA ALA A 19 1.056 2.238 13.575 1.00 73.43 C ATOM 283 C ALA A 19 1.004 0.809 13.010 1.00 34.24 C ATOM 284 O ALA A 19 1.141 -0.172 13.744 1.00 73.41 O ATOM 285 CB ALA A 19 -0.350 2.781 13.792 1.00 4.34 C ATOM 0 H ALA A 19 1.255 3.901 12.301 1.00 32.24 H new ATOM 0 HA ALA A 19 1.571 2.197 14.535 1.00 73.43 H new ATOM 0 HB1 ALA A 19 -0.900 2.113 14.455 1.00 4.34 H new ATOM 0 HB2 ALA A 19 -0.292 3.772 14.242 1.00 4.34 H new ATOM 0 HB3 ALA A 19 -0.866 2.847 12.834 1.00 4.34 H new ATOM 291 N ILE A 20 0.807 0.706 11.694 1.00 32.35 N ATOM 292 CA ILE A 20 0.841 -0.585 10.996 1.00 73.02 C ATOM 293 C ILE A 20 2.234 -1.225 11.110 1.00 31.14 C ATOM 294 O ILE A 20 2.373 -2.371 11.541 1.00 55.20 O ATOM 295 CB ILE A 20 0.477 -0.414 9.497 1.00 53.01 C ATOM 296 CG1 ILE A 20 -0.911 0.231 9.355 1.00 61.42 C ATOM 297 CG2 ILE A 20 0.532 -1.755 8.765 1.00 24.31 C ATOM 298 CD1 ILE A 20 -1.327 0.496 7.922 1.00 74.45 C ATOM 0 H ILE A 20 0.621 1.504 11.086 1.00 32.35 H new ATOM 0 HA ILE A 20 0.105 -1.236 11.468 1.00 73.02 H new ATOM 0 HB ILE A 20 1.213 0.246 9.038 1.00 53.01 H new ATOM 0 HG12 ILE A 20 -1.651 -0.418 9.823 1.00 61.42 H new ATOM 0 HG13 ILE A 20 -0.920 1.172 9.905 1.00 61.42 H new ATOM 0 HG21 ILE A 20 0.273 -1.608 7.716 1.00 24.31 H new ATOM 0 HG22 ILE A 20 1.539 -2.167 8.836 1.00 24.31 H new ATOM 0 HG23 ILE A 20 -0.176 -2.447 9.220 1.00 24.31 H new ATOM 0 HD11 ILE A 20 -2.317 0.952 7.909 1.00 74.45 H new ATOM 0 HD12 ILE A 20 -0.611 1.171 7.454 1.00 74.45 H new ATOM 0 HD13 ILE A 20 -1.353 -0.444 7.371 1.00 74.45 H new ATOM 310 N ILE A 21 3.261 -0.459 10.735 1.00 1.12 N ATOM 311 CA ILE A 21 4.657 -0.904 10.840 1.00 71.34 C ATOM 312 C ILE A 21 4.980 -1.392 12.260 1.00 21.15 C ATOM 313 O ILE A 21 5.617 -2.432 12.442 1.00 72.45 O ATOM 314 CB ILE A 21 5.635 0.240 10.457 1.00 51.25 C ATOM 315 CG1 ILE A 21 5.419 0.661 8.992 1.00 23.33 C ATOM 316 CG2 ILE A 21 7.087 -0.178 10.698 1.00 74.11 C ATOM 317 CD1 ILE A 21 6.269 1.840 8.560 1.00 64.31 C ATOM 0 H ILE A 21 3.153 0.480 10.353 1.00 1.12 H new ATOM 0 HA ILE A 21 4.784 -1.733 10.144 1.00 71.34 H new ATOM 0 HB ILE A 21 5.426 1.099 11.095 1.00 51.25 H new ATOM 0 HG12 ILE A 21 5.637 -0.188 8.344 1.00 23.33 H new ATOM 0 HG13 ILE A 21 4.368 0.911 8.847 1.00 23.33 H new ATOM 0 HG21 ILE A 21 7.752 0.640 10.422 1.00 74.11 H new ATOM 0 HG22 ILE A 21 7.226 -0.419 11.752 1.00 74.11 H new ATOM 0 HG23 ILE A 21 7.319 -1.054 10.092 1.00 74.11 H new ATOM 0 HD11 ILE A 21 6.060 2.076 7.517 1.00 64.31 H new ATOM 0 HD12 ILE A 21 6.035 2.704 9.182 1.00 64.31 H new ATOM 0 HD13 ILE A 21 7.324 1.588 8.671 1.00 64.31 H new ATOM 329 N ASN A 22 4.525 -0.636 13.257 1.00 63.15 N ATOM 330 CA ASN A 22 4.750 -0.976 14.665 1.00 10.31 C ATOM 331 C ASN A 22 4.206 -2.375 14.996 1.00 10.34 C ATOM 332 O ASN A 22 4.903 -3.197 15.588 1.00 62.44 O ATOM 333 CB ASN A 22 4.093 0.074 15.570 1.00 61.14 C ATOM 334 CG ASN A 22 4.393 -0.146 17.041 1.00 3.11 C ATOM 335 OD1 ASN A 22 5.440 -0.675 17.404 1.00 64.21 O ATOM 336 ND2 ASN A 22 3.488 0.266 17.903 1.00 4.13 N ATOM 0 H ASN A 22 3.994 0.223 13.116 1.00 63.15 H new ATOM 0 HA ASN A 22 5.825 -0.983 14.843 1.00 10.31 H new ATOM 0 HB2 ASN A 22 4.438 1.066 15.278 1.00 61.14 H new ATOM 0 HB3 ASN A 22 3.014 0.054 15.417 1.00 61.14 H new ATOM 0 HD21 ASN A 22 3.647 0.149 18.904 1.00 4.13 H new ATOM 0 HD22 ASN A 22 2.628 0.702 17.570 1.00 4.13 H new ATOM 343 N GLY A 23 2.964 -2.645 14.595 1.00 70.04 N ATOM 344 CA GLY A 23 2.360 -3.950 14.845 1.00 24.21 C ATOM 345 C GLY A 23 3.090 -5.093 14.141 1.00 20.33 C ATOM 346 O GLY A 23 3.310 -6.159 14.725 1.00 25.04 O ATOM 0 H GLY A 23 2.363 -1.985 14.101 1.00 70.04 H new ATOM 0 HA2 GLY A 23 2.350 -4.140 15.918 1.00 24.21 H new ATOM 0 HA3 GLY A 23 1.321 -3.932 14.515 1.00 24.21 H new ATOM 350 N ILE A 24 3.476 -4.867 12.886 1.00 72.23 N ATOM 351 CA ILE A 24 4.182 -5.881 12.093 1.00 43.55 C ATOM 352 C ILE A 24 5.575 -6.194 12.677 1.00 30.43 C ATOM 353 O ILE A 24 5.935 -7.361 12.867 1.00 31.40 O ATOM 354 CB ILE A 24 4.323 -5.431 10.615 1.00 63.31 C ATOM 355 CG1 ILE A 24 2.937 -5.155 10.009 1.00 50.25 C ATOM 356 CG2 ILE A 24 5.069 -6.483 9.794 1.00 25.23 C ATOM 357 CD1 ILE A 24 2.980 -4.639 8.585 1.00 21.10 C ATOM 0 H ILE A 24 3.313 -3.989 12.393 1.00 72.23 H new ATOM 0 HA ILE A 24 3.582 -6.790 12.133 1.00 43.55 H new ATOM 0 HB ILE A 24 4.905 -4.510 10.590 1.00 63.31 H new ATOM 0 HG12 ILE A 24 2.351 -6.074 10.034 1.00 50.25 H new ATOM 0 HG13 ILE A 24 2.417 -4.428 10.633 1.00 50.25 H new ATOM 0 HG21 ILE A 24 5.155 -6.145 8.761 1.00 25.23 H new ATOM 0 HG22 ILE A 24 6.065 -6.631 10.212 1.00 25.23 H new ATOM 0 HG23 ILE A 24 4.520 -7.424 9.823 1.00 25.23 H new ATOM 0 HD11 ILE A 24 1.964 -4.469 8.229 1.00 21.10 H new ATOM 0 HD12 ILE A 24 3.537 -3.703 8.554 1.00 21.10 H new ATOM 0 HD13 ILE A 24 3.470 -5.374 7.946 1.00 21.10 H new ATOM 369 N THR A 25 6.352 -5.150 12.979 1.00 74.52 N ATOM 370 CA THR A 25 7.699 -5.331 13.550 1.00 52.32 C ATOM 371 C THR A 25 7.628 -5.895 14.978 1.00 65.13 C ATOM 372 O THR A 25 8.475 -6.692 15.384 1.00 1.15 O ATOM 373 CB THR A 25 8.525 -4.017 13.556 1.00 74.35 C ATOM 374 OG1 THR A 25 9.878 -4.288 13.957 1.00 52.55 O ATOM 375 CG2 THR A 25 7.924 -2.972 14.492 1.00 21.41 C ATOM 0 H THR A 25 6.079 -4.177 12.841 1.00 74.52 H new ATOM 0 HA THR A 25 8.207 -6.046 12.902 1.00 52.32 H new ATOM 0 HB THR A 25 8.507 -3.617 12.542 1.00 74.35 H new ATOM 0 HG1 THR A 25 10.393 -3.454 13.957 1.00 52.55 H new ATOM 0 HG21 THR A 25 8.532 -2.068 14.467 1.00 21.41 H new ATOM 0 HG22 THR A 25 6.910 -2.736 14.170 1.00 21.41 H new ATOM 0 HG23 THR A 25 7.900 -3.365 15.509 1.00 21.41 H new ATOM 383 N LYS A 26 6.602 -5.488 15.729 1.00 52.14 N ATOM 384 CA LYS A 26 6.335 -6.040 17.066 1.00 23.44 C ATOM 385 C LYS A 26 6.012 -7.540 16.976 1.00 62.43 C ATOM 386 O LYS A 26 6.315 -8.318 17.881 1.00 22.25 O ATOM 387 CB LYS A 26 5.177 -5.270 17.720 1.00 55.32 C ATOM 388 CG LYS A 26 4.742 -5.798 19.084 1.00 4.32 C ATOM 389 CD LYS A 26 3.708 -4.874 19.730 1.00 43.54 C ATOM 390 CE LYS A 26 3.126 -5.471 21.006 1.00 60.31 C ATOM 391 NZ LYS A 26 2.297 -6.675 20.729 1.00 42.14 N ATOM 0 H LYS A 26 5.937 -4.773 15.434 1.00 52.14 H new ATOM 0 HA LYS A 26 7.226 -5.927 17.683 1.00 23.44 H new ATOM 0 HB2 LYS A 26 5.470 -4.226 17.828 1.00 55.32 H new ATOM 0 HB3 LYS A 26 4.319 -5.293 17.048 1.00 55.32 H new ATOM 0 HG2 LYS A 26 4.322 -6.797 18.973 1.00 4.32 H new ATOM 0 HG3 LYS A 26 5.611 -5.888 19.736 1.00 4.32 H new ATOM 0 HD2 LYS A 26 4.172 -3.914 19.958 1.00 43.54 H new ATOM 0 HD3 LYS A 26 2.903 -4.679 19.021 1.00 43.54 H new ATOM 0 HE2 LYS A 26 3.937 -5.737 21.685 1.00 60.31 H new ATOM 0 HE3 LYS A 26 2.519 -4.721 21.513 1.00 60.31 H new ATOM 0 HZ1 LYS A 26 1.734 -6.910 21.571 1.00 42.14 H new ATOM 0 HZ2 LYS A 26 1.661 -6.482 19.929 1.00 42.14 H new ATOM 0 HZ3 LYS A 26 2.917 -7.476 20.493 1.00 42.14 H new ATOM 405 N THR A 27 5.394 -7.935 15.865 1.00 21.51 N ATOM 406 CA THR A 27 5.141 -9.352 15.569 1.00 31.34 C ATOM 407 C THR A 27 6.434 -10.067 15.121 1.00 75.00 C ATOM 408 O THR A 27 6.505 -11.296 15.093 1.00 41.41 O ATOM 409 CB THR A 27 4.046 -9.498 14.481 1.00 23.24 C ATOM 410 OG1 THR A 27 2.817 -8.921 14.954 1.00 44.04 O ATOM 411 CG2 THR A 27 3.810 -10.959 14.098 1.00 10.04 C ATOM 0 H THR A 27 5.056 -7.293 15.148 1.00 21.51 H new ATOM 0 HA THR A 27 4.789 -9.824 16.486 1.00 31.34 H new ATOM 0 HB THR A 27 4.392 -8.973 13.591 1.00 23.24 H new ATOM 0 HG1 THR A 27 2.879 -7.944 14.918 1.00 44.04 H new ATOM 0 HG21 THR A 27 3.035 -11.014 13.333 1.00 10.04 H new ATOM 0 HG22 THR A 27 4.734 -11.387 13.710 1.00 10.04 H new ATOM 0 HG23 THR A 27 3.492 -11.519 14.978 1.00 10.04 H new ATOM 419 N GLY A 28 7.458 -9.283 14.786 1.00 21.43 N ATOM 420 CA GLY A 28 8.761 -9.839 14.416 1.00 13.01 C ATOM 421 C GLY A 28 8.957 -9.999 12.910 1.00 65.31 C ATOM 422 O GLY A 28 9.734 -10.847 12.466 1.00 71.43 O ATOM 0 H GLY A 28 7.412 -8.264 14.763 1.00 21.43 H new ATOM 0 HA2 GLY A 28 9.546 -9.193 14.809 1.00 13.01 H new ATOM 0 HA3 GLY A 28 8.880 -10.811 14.894 1.00 13.01 H new ATOM 426 N VAL A 29 8.265 -9.179 12.122 1.00 24.43 N ATOM 427 CA VAL A 29 8.342 -9.250 10.657 1.00 21.54 C ATOM 428 C VAL A 29 8.877 -7.938 10.053 1.00 51.42 C ATOM 429 O VAL A 29 8.563 -6.848 10.533 1.00 50.00 O ATOM 430 CB VAL A 29 6.950 -9.565 10.048 1.00 60.52 C ATOM 431 CG1 VAL A 29 7.033 -9.749 8.532 1.00 42.41 C ATOM 432 CG2 VAL A 29 6.338 -10.797 10.714 1.00 25.45 C ATOM 0 H VAL A 29 7.640 -8.453 12.472 1.00 24.43 H new ATOM 0 HA VAL A 29 9.036 -10.054 10.412 1.00 21.54 H new ATOM 0 HB VAL A 29 6.300 -8.711 10.240 1.00 60.52 H new ATOM 0 HG11 VAL A 29 6.041 -9.968 8.137 1.00 42.41 H new ATOM 0 HG12 VAL A 29 7.412 -8.835 8.075 1.00 42.41 H new ATOM 0 HG13 VAL A 29 7.706 -10.575 8.302 1.00 42.41 H new ATOM 0 HG21 VAL A 29 5.362 -11.002 10.273 1.00 25.45 H new ATOM 0 HG22 VAL A 29 6.992 -11.656 10.562 1.00 25.45 H new ATOM 0 HG23 VAL A 29 6.222 -10.614 11.782 1.00 25.45 H new ATOM 442 N GLY A 30 9.689 -8.054 9.001 1.00 40.40 N ATOM 443 CA GLY A 30 10.220 -6.873 8.327 1.00 13.53 C ATOM 444 C GLY A 30 9.200 -6.207 7.405 1.00 2.52 C ATOM 445 O GLY A 30 8.441 -6.888 6.712 1.00 21.51 O ATOM 0 H GLY A 30 9.989 -8.944 8.602 1.00 40.40 H new ATOM 0 HA2 GLY A 30 10.552 -6.152 9.075 1.00 13.53 H new ATOM 0 HA3 GLY A 30 11.098 -7.156 7.746 1.00 13.53 H new ATOM 449 N VAL A 31 9.187 -4.876 7.387 1.00 14.43 N ATOM 450 CA VAL A 31 8.215 -4.118 6.586 1.00 61.21 C ATOM 451 C VAL A 31 8.862 -3.483 5.347 1.00 24.13 C ATOM 452 O VAL A 31 10.024 -3.073 5.381 1.00 21.23 O ATOM 453 CB VAL A 31 7.545 -2.999 7.425 1.00 71.44 C ATOM 454 CG1 VAL A 31 6.806 -3.588 8.624 1.00 42.33 C ATOM 455 CG2 VAL A 31 8.574 -1.961 7.878 1.00 51.34 C ATOM 0 H VAL A 31 9.837 -4.295 7.917 1.00 14.43 H new ATOM 0 HA VAL A 31 7.461 -4.836 6.263 1.00 61.21 H new ATOM 0 HB VAL A 31 6.816 -2.495 6.790 1.00 71.44 H new ATOM 0 HG11 VAL A 31 6.344 -2.784 9.197 1.00 42.33 H new ATOM 0 HG12 VAL A 31 6.034 -4.274 8.275 1.00 42.33 H new ATOM 0 HG13 VAL A 31 7.511 -4.127 9.257 1.00 42.33 H new ATOM 0 HG21 VAL A 31 8.077 -1.188 8.464 1.00 51.34 H new ATOM 0 HG22 VAL A 31 9.336 -2.446 8.488 1.00 51.34 H new ATOM 0 HG23 VAL A 31 9.043 -1.508 7.004 1.00 51.34 H new ATOM 465 N ASP A 32 8.108 -3.411 4.255 1.00 53.13 N ATOM 466 CA ASP A 32 8.554 -2.712 3.048 1.00 21.42 C ATOM 467 C ASP A 32 7.785 -1.390 2.886 1.00 35.45 C ATOM 468 O ASP A 32 6.585 -1.386 2.613 1.00 15.21 O ATOM 469 CB ASP A 32 8.357 -3.601 1.818 1.00 0.00 C ATOM 470 CG ASP A 32 9.139 -4.900 1.908 1.00 31.43 C ATOM 471 OD1 ASP A 32 10.379 -4.849 2.068 1.00 70.41 O ATOM 472 OD2 ASP A 32 8.526 -5.984 1.813 1.00 25.02 O ATOM 0 H ASP A 32 7.181 -3.829 4.178 1.00 53.13 H new ATOM 0 HA ASP A 32 9.616 -2.486 3.145 1.00 21.42 H new ATOM 0 HB2 ASP A 32 7.297 -3.826 1.703 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.666 -3.056 0.926 1.00 0.00 H new ATOM 477 N VAL A 33 8.478 -0.268 3.066 1.00 2.12 N ATOM 478 CA VAL A 33 7.823 1.046 3.082 1.00 51.13 C ATOM 479 C VAL A 33 7.720 1.679 1.680 1.00 33.13 C ATOM 480 O VAL A 33 8.723 2.026 1.054 1.00 33.33 O ATOM 481 CB VAL A 33 8.544 2.021 4.055 1.00 70.44 C ATOM 482 CG1 VAL A 33 8.411 1.536 5.500 1.00 23.41 C ATOM 483 CG2 VAL A 33 10.018 2.192 3.684 1.00 75.31 C ATOM 0 H VAL A 33 9.488 -0.238 3.203 1.00 2.12 H new ATOM 0 HA VAL A 33 6.807 0.874 3.437 1.00 51.13 H new ATOM 0 HB VAL A 33 8.061 2.994 3.966 1.00 70.44 H new ATOM 0 HG11 VAL A 33 8.922 2.232 6.166 1.00 23.41 H new ATOM 0 HG12 VAL A 33 7.356 1.483 5.770 1.00 23.41 H new ATOM 0 HG13 VAL A 33 8.860 0.547 5.595 1.00 23.41 H new ATOM 0 HG21 VAL A 33 10.492 2.880 4.384 1.00 75.31 H new ATOM 0 HG22 VAL A 33 10.519 1.225 3.730 1.00 75.31 H new ATOM 0 HG23 VAL A 33 10.095 2.593 2.673 1.00 75.31 H new ATOM 493 N VAL A 34 6.491 1.822 1.192 1.00 23.03 N ATOM 494 CA VAL A 34 6.233 2.469 -0.097 1.00 11.23 C ATOM 495 C VAL A 34 5.732 3.910 0.102 1.00 74.23 C ATOM 496 O VAL A 34 4.532 4.152 0.286 1.00 32.22 O ATOM 497 CB VAL A 34 5.194 1.684 -0.936 1.00 31.14 C ATOM 498 CG1 VAL A 34 5.054 2.290 -2.332 1.00 41.22 C ATOM 499 CG2 VAL A 34 5.566 0.206 -1.016 1.00 51.21 C ATOM 0 H VAL A 34 5.651 1.497 1.671 1.00 23.03 H new ATOM 0 HA VAL A 34 7.180 2.483 -0.637 1.00 11.23 H new ATOM 0 HB VAL A 34 4.228 1.761 -0.438 1.00 31.14 H new ATOM 0 HG11 VAL A 34 4.319 1.722 -2.903 1.00 41.22 H new ATOM 0 HG12 VAL A 34 4.726 3.326 -2.248 1.00 41.22 H new ATOM 0 HG13 VAL A 34 6.016 2.254 -2.842 1.00 41.22 H new ATOM 0 HG21 VAL A 34 4.822 -0.325 -1.610 1.00 51.21 H new ATOM 0 HG22 VAL A 34 6.545 0.102 -1.484 1.00 51.21 H new ATOM 0 HG23 VAL A 34 5.597 -0.216 -0.012 1.00 51.21 H new ATOM 509 N ASP A 35 6.655 4.863 0.081 1.00 64.03 N ATOM 510 CA ASP A 35 6.317 6.275 0.276 1.00 14.10 C ATOM 511 C ASP A 35 5.739 6.905 -1.004 1.00 24.43 C ATOM 512 O ASP A 35 6.373 7.735 -1.657 1.00 53.35 O ATOM 513 CB ASP A 35 7.552 7.052 0.770 1.00 35.20 C ATOM 514 CG ASP A 35 8.772 6.899 -0.135 1.00 44.24 C ATOM 515 OD1 ASP A 35 9.122 5.753 -0.492 1.00 53.01 O ATOM 516 OD2 ASP A 35 9.414 7.921 -0.463 1.00 1.20 O ATOM 0 H ASP A 35 7.648 4.687 -0.069 1.00 64.03 H new ATOM 0 HA ASP A 35 5.540 6.334 1.038 1.00 14.10 H new ATOM 0 HB2 ASP A 35 7.298 8.109 0.848 1.00 35.20 H new ATOM 0 HB3 ASP A 35 7.809 6.711 1.773 1.00 35.20 H new ATOM 521 N LEU A 36 4.514 6.509 -1.355 1.00 53.10 N ATOM 522 CA LEU A 36 3.850 7.036 -2.553 1.00 2.22 C ATOM 523 C LEU A 36 3.569 8.543 -2.429 1.00 14.32 C ATOM 524 O LEU A 36 3.458 9.250 -3.432 1.00 11.31 O ATOM 525 CB LEU A 36 2.561 6.246 -2.873 1.00 10.33 C ATOM 526 CG LEU A 36 1.621 5.912 -1.690 1.00 11.42 C ATOM 527 CD1 LEU A 36 1.066 7.169 -1.029 1.00 52.53 C ATOM 528 CD2 LEU A 36 0.477 5.011 -2.159 1.00 41.34 C ATOM 0 H LEU A 36 3.963 5.829 -0.831 1.00 53.10 H new ATOM 0 HA LEU A 36 4.535 6.903 -3.390 1.00 2.22 H new ATOM 0 HB2 LEU A 36 1.990 6.815 -3.607 1.00 10.33 H new ATOM 0 HB3 LEU A 36 2.849 5.309 -3.350 1.00 10.33 H new ATOM 0 HG LEU A 36 2.212 5.383 -0.943 1.00 11.42 H new ATOM 0 HD11 LEU A 36 0.411 6.888 -0.204 1.00 52.53 H new ATOM 0 HD12 LEU A 36 1.889 7.774 -0.649 1.00 52.53 H new ATOM 0 HD13 LEU A 36 0.500 7.745 -1.761 1.00 52.53 H new ATOM 0 HD21 LEU A 36 -0.176 4.784 -1.316 1.00 41.34 H new ATOM 0 HD22 LEU A 36 -0.094 5.522 -2.934 1.00 41.34 H new ATOM 0 HD23 LEU A 36 0.885 4.084 -2.561 1.00 41.34 H new ATOM 540 N GLY A 37 3.484 9.029 -1.190 1.00 34.01 N ATOM 541 CA GLY A 37 3.286 10.455 -0.948 1.00 53.03 C ATOM 542 C GLY A 37 4.549 11.278 -1.184 1.00 55.22 C ATOM 543 O GLY A 37 4.548 12.491 -0.997 1.00 42.22 O ATOM 0 H GLY A 37 3.549 8.460 -0.346 1.00 34.01 H new ATOM 0 HA2 GLY A 37 2.492 10.822 -1.599 1.00 53.03 H new ATOM 0 HA3 GLY A 37 2.950 10.601 0.079 1.00 53.03 H new ATOM 547 N ALA A 38 5.634 10.604 -1.561 1.00 61.14 N ATOM 548 CA ALA A 38 6.886 11.270 -1.937 1.00 61.42 C ATOM 549 C ALA A 38 7.273 10.918 -3.381 1.00 14.04 C ATOM 550 O ALA A 38 8.417 11.122 -3.799 1.00 20.22 O ATOM 551 CB ALA A 38 7.995 10.877 -0.967 1.00 4.02 C ATOM 0 H ALA A 38 5.673 9.586 -1.615 1.00 61.14 H new ATOM 0 HA ALA A 38 6.742 12.349 -1.882 1.00 61.42 H new ATOM 0 HB1 ALA A 38 8.921 11.375 -1.252 1.00 4.02 H new ATOM 0 HB2 ALA A 38 7.718 11.177 0.043 1.00 4.02 H new ATOM 0 HB3 ALA A 38 8.139 9.797 -0.998 1.00 4.02 H new ATOM 557 N ALA A 39 6.291 10.407 -4.133 1.00 4.41 N ATOM 558 CA ALA A 39 6.485 9.965 -5.521 1.00 32.42 C ATOM 559 C ALA A 39 7.420 8.745 -5.617 1.00 34.13 C ATOM 560 O ALA A 39 8.644 8.879 -5.590 1.00 34.01 O ATOM 561 CB ALA A 39 6.997 11.108 -6.396 1.00 73.33 C ATOM 0 H ALA A 39 5.336 10.288 -3.796 1.00 4.41 H new ATOM 0 HA ALA A 39 5.509 9.656 -5.894 1.00 32.42 H new ATOM 0 HB1 ALA A 39 7.131 10.752 -7.417 1.00 73.33 H new ATOM 0 HB2 ALA A 39 6.274 11.924 -6.388 1.00 73.33 H new ATOM 0 HB3 ALA A 39 7.951 11.464 -6.007 1.00 73.33 H new ATOM 567 N VAL A 40 6.833 7.551 -5.712 1.00 5.25 N ATOM 568 CA VAL A 40 7.606 6.313 -5.907 1.00 14.11 C ATOM 569 C VAL A 40 7.939 6.090 -7.390 1.00 53.53 C ATOM 570 O VAL A 40 7.234 6.582 -8.277 1.00 24.02 O ATOM 571 CB VAL A 40 6.857 5.070 -5.359 1.00 74.04 C ATOM 572 CG1 VAL A 40 6.733 5.143 -3.838 1.00 0.51 C ATOM 573 CG2 VAL A 40 5.481 4.925 -6.014 1.00 63.34 C ATOM 0 H VAL A 40 5.824 7.410 -5.658 1.00 5.25 H new ATOM 0 HA VAL A 40 8.532 6.437 -5.345 1.00 14.11 H new ATOM 0 HB VAL A 40 7.441 4.184 -5.611 1.00 74.04 H new ATOM 0 HG11 VAL A 40 6.205 4.262 -3.473 1.00 0.51 H new ATOM 0 HG12 VAL A 40 7.727 5.180 -3.393 1.00 0.51 H new ATOM 0 HG13 VAL A 40 6.178 6.039 -3.561 1.00 0.51 H new ATOM 0 HG21 VAL A 40 4.977 4.046 -5.612 1.00 63.34 H new ATOM 0 HG22 VAL A 40 4.884 5.813 -5.806 1.00 63.34 H new ATOM 0 HG23 VAL A 40 5.601 4.813 -7.092 1.00 63.34 H new ATOM 583 N ASP A 41 8.999 5.330 -7.653 1.00 20.14 N ATOM 584 CA ASP A 41 9.495 5.141 -9.020 1.00 40.12 C ATOM 585 C ASP A 41 9.456 3.653 -9.432 1.00 71.34 C ATOM 586 O ASP A 41 9.059 2.786 -8.650 1.00 52.42 O ATOM 587 CB ASP A 41 10.921 5.705 -9.118 1.00 62.44 C ATOM 588 CG ASP A 41 11.275 6.162 -10.521 1.00 44.45 C ATOM 589 OD1 ASP A 41 11.738 5.331 -11.330 1.00 43.45 O ATOM 590 OD2 ASP A 41 11.087 7.358 -10.825 1.00 74.12 O ATOM 0 H ASP A 41 9.533 4.834 -6.940 1.00 20.14 H new ATOM 0 HA ASP A 41 8.846 5.678 -9.712 1.00 40.12 H new ATOM 0 HB2 ASP A 41 11.023 6.544 -8.430 1.00 62.44 H new ATOM 0 HB3 ASP A 41 11.632 4.943 -8.798 1.00 62.44 H new ATOM 595 N LEU A 42 9.879 3.364 -10.665 1.00 75.45 N ATOM 596 CA LEU A 42 9.851 1.998 -11.213 1.00 73.21 C ATOM 597 C LEU A 42 10.715 1.019 -10.391 1.00 40.11 C ATOM 598 O LEU A 42 10.514 -0.197 -10.451 1.00 51.25 O ATOM 599 CB LEU A 42 10.320 2.001 -12.683 1.00 50.22 C ATOM 600 CG LEU A 42 9.319 2.567 -13.717 1.00 33.13 C ATOM 601 CD1 LEU A 42 8.033 1.747 -13.731 1.00 55.30 C ATOM 602 CD2 LEU A 42 9.018 4.042 -13.452 1.00 22.33 C ATOM 0 H LEU A 42 10.249 4.062 -11.311 1.00 75.45 H new ATOM 0 HA LEU A 42 8.819 1.653 -11.157 1.00 73.21 H new ATOM 0 HB2 LEU A 42 11.242 2.578 -12.747 1.00 50.22 H new ATOM 0 HB3 LEU A 42 10.564 0.977 -12.967 1.00 50.22 H new ATOM 0 HG LEU A 42 9.783 2.495 -14.701 1.00 33.13 H new ATOM 0 HD11 LEU A 42 7.344 2.164 -14.466 1.00 55.30 H new ATOM 0 HD12 LEU A 42 8.263 0.714 -13.994 1.00 55.30 H new ATOM 0 HD13 LEU A 42 7.572 1.776 -12.744 1.00 55.30 H new ATOM 0 HD21 LEU A 42 8.311 4.409 -14.197 1.00 22.33 H new ATOM 0 HD22 LEU A 42 8.587 4.152 -12.457 1.00 22.33 H new ATOM 0 HD23 LEU A 42 9.941 4.618 -13.513 1.00 22.33 H new ATOM 614 N GLN A 43 11.668 1.552 -9.621 1.00 11.20 N ATOM 615 CA GLN A 43 12.572 0.720 -8.808 1.00 32.14 C ATOM 616 C GLN A 43 11.804 -0.149 -7.791 1.00 13.01 C ATOM 617 O GLN A 43 12.255 -1.236 -7.430 1.00 55.22 O ATOM 618 CB GLN A 43 13.610 1.588 -8.074 1.00 4.22 C ATOM 619 CG GLN A 43 14.628 2.271 -8.989 1.00 13.24 C ATOM 620 CD GLN A 43 14.040 3.421 -9.796 1.00 33.33 C ATOM 621 OE1 GLN A 43 14.045 4.565 -9.358 1.00 15.25 O ATOM 622 NE2 GLN A 43 13.527 3.130 -10.974 1.00 71.11 N ATOM 0 H GLN A 43 11.837 2.555 -9.541 1.00 11.20 H new ATOM 0 HA GLN A 43 13.088 0.053 -9.498 1.00 32.14 H new ATOM 0 HB2 GLN A 43 13.085 2.353 -7.501 1.00 4.22 H new ATOM 0 HB3 GLN A 43 14.145 0.964 -7.358 1.00 4.22 H new ATOM 0 HG2 GLN A 43 15.454 2.646 -8.385 1.00 13.24 H new ATOM 0 HG3 GLN A 43 15.044 1.532 -9.674 1.00 13.24 H new ATOM 0 HE21 GLN A 43 13.538 2.167 -11.311 1.00 71.11 H new ATOM 0 HE22 GLN A 43 13.119 3.867 -11.549 1.00 71.11 H new ATOM 631 N GLU A 44 10.651 0.333 -7.327 1.00 33.30 N ATOM 632 CA GLU A 44 9.803 -0.445 -6.411 1.00 72.23 C ATOM 633 C GLU A 44 8.856 -1.378 -7.183 1.00 71.05 C ATOM 634 O GLU A 44 8.704 -2.551 -6.836 1.00 33.43 O ATOM 635 CB GLU A 44 9.001 0.496 -5.494 1.00 12.53 C ATOM 636 CG GLU A 44 7.955 -0.205 -4.621 1.00 43.54 C ATOM 637 CD GLU A 44 8.514 -1.380 -3.826 1.00 54.51 C ATOM 638 OE1 GLU A 44 9.551 -1.211 -3.150 1.00 33.20 O ATOM 639 OE2 GLU A 44 7.917 -2.480 -3.874 1.00 64.22 O ATOM 0 H GLU A 44 10.280 1.253 -7.566 1.00 33.30 H new ATOM 0 HA GLU A 44 10.455 -1.065 -5.796 1.00 72.23 H new ATOM 0 HB2 GLU A 44 9.696 1.031 -4.847 1.00 12.53 H new ATOM 0 HB3 GLU A 44 8.500 1.243 -6.110 1.00 12.53 H new ATOM 0 HG2 GLU A 44 7.526 0.520 -3.929 1.00 43.54 H new ATOM 0 HG3 GLU A 44 7.143 -0.560 -5.255 1.00 43.54 H new ATOM 646 N LEU A 45 8.244 -0.859 -8.247 1.00 2.23 N ATOM 647 CA LEU A 45 7.267 -1.628 -9.029 1.00 50.33 C ATOM 648 C LEU A 45 7.828 -2.978 -9.512 1.00 11.45 C ATOM 649 O LEU A 45 7.073 -3.937 -9.694 1.00 25.31 O ATOM 650 CB LEU A 45 6.767 -0.803 -10.223 1.00 35.02 C ATOM 651 CG LEU A 45 5.961 0.458 -9.857 1.00 53.44 C ATOM 652 CD1 LEU A 45 5.499 1.189 -11.115 1.00 32.44 C ATOM 653 CD2 LEU A 45 4.765 0.102 -8.972 1.00 1.41 C ATOM 0 H LEU A 45 8.405 0.088 -8.589 1.00 2.23 H new ATOM 0 HA LEU A 45 6.431 -1.847 -8.365 1.00 50.33 H new ATOM 0 HB2 LEU A 45 7.626 -0.504 -10.823 1.00 35.02 H new ATOM 0 HB3 LEU A 45 6.146 -1.442 -10.851 1.00 35.02 H new ATOM 0 HG LEU A 45 6.615 1.125 -9.294 1.00 53.44 H new ATOM 0 HD11 LEU A 45 4.932 2.076 -10.833 1.00 32.44 H new ATOM 0 HD12 LEU A 45 6.367 1.485 -11.703 1.00 32.44 H new ATOM 0 HD13 LEU A 45 4.867 0.528 -11.709 1.00 32.44 H new ATOM 0 HD21 LEU A 45 4.211 1.008 -8.727 1.00 1.41 H new ATOM 0 HD22 LEU A 45 4.112 -0.590 -9.504 1.00 1.41 H new ATOM 0 HD23 LEU A 45 5.119 -0.367 -8.054 1.00 1.41 H new ATOM 665 N ARG A 46 9.146 -3.060 -9.710 1.00 0.15 N ATOM 666 CA ARG A 46 9.786 -4.322 -10.111 1.00 20.21 C ATOM 667 C ARG A 46 9.578 -5.418 -9.044 1.00 62.23 C ATOM 668 O ARG A 46 9.449 -6.599 -9.372 1.00 41.32 O ATOM 669 CB ARG A 46 11.287 -4.114 -10.374 1.00 41.42 C ATOM 670 CG ARG A 46 12.102 -3.815 -9.120 1.00 22.14 C ATOM 671 CD ARG A 46 13.584 -3.615 -9.426 1.00 42.15 C ATOM 672 NE ARG A 46 14.366 -3.484 -8.199 1.00 13.30 N ATOM 673 CZ ARG A 46 15.419 -2.723 -8.067 1.00 43.01 C ATOM 674 NH1 ARG A 46 15.869 -2.031 -9.066 1.00 4.54 N ATOM 675 NH2 ARG A 46 16.029 -2.661 -6.926 1.00 5.21 N ATOM 0 H ARG A 46 9.789 -2.276 -9.601 1.00 0.15 H new ATOM 0 HA ARG A 46 9.313 -4.652 -11.036 1.00 20.21 H new ATOM 0 HB2 ARG A 46 11.689 -5.008 -10.851 1.00 41.42 H new ATOM 0 HB3 ARG A 46 11.411 -3.293 -11.080 1.00 41.42 H new ATOM 0 HG2 ARG A 46 11.709 -2.920 -8.639 1.00 22.14 H new ATOM 0 HG3 ARG A 46 11.987 -4.635 -8.411 1.00 22.14 H new ATOM 0 HD2 ARG A 46 13.955 -4.459 -10.008 1.00 42.15 H new ATOM 0 HD3 ARG A 46 13.714 -2.723 -10.040 1.00 42.15 H new ATOM 0 HE ARG A 46 14.068 -4.026 -7.388 1.00 13.30 H new ATOM 0 HH11 ARG A 46 15.400 -2.076 -9.970 1.00 4.54 H new ATOM 0 HH12 ARG A 46 16.693 -1.441 -8.948 1.00 4.54 H new ATOM 0 HH21 ARG A 46 15.687 -3.206 -6.134 1.00 5.21 H new ATOM 0 HH22 ARG A 46 16.852 -2.068 -6.819 1.00 5.21 H new ATOM 689 N GLU A 47 9.530 -5.010 -7.772 1.00 43.20 N ATOM 690 CA GLU A 47 9.288 -5.938 -6.654 1.00 75.13 C ATOM 691 C GLU A 47 7.821 -5.912 -6.189 1.00 15.14 C ATOM 692 O GLU A 47 7.459 -6.591 -5.223 1.00 31.23 O ATOM 693 CB GLU A 47 10.212 -5.613 -5.461 1.00 53.11 C ATOM 694 CG GLU A 47 11.446 -6.510 -5.352 1.00 23.32 C ATOM 695 CD GLU A 47 12.457 -6.291 -6.467 1.00 22.43 C ATOM 696 OE1 GLU A 47 13.344 -5.423 -6.305 1.00 55.42 O ATOM 697 OE2 GLU A 47 12.383 -6.995 -7.496 1.00 52.10 O ATOM 0 H GLU A 47 9.656 -4.039 -7.486 1.00 43.20 H new ATOM 0 HA GLU A 47 9.510 -6.939 -7.023 1.00 75.13 H new ATOM 0 HB2 GLU A 47 10.538 -4.576 -5.542 1.00 53.11 H new ATOM 0 HB3 GLU A 47 9.636 -5.695 -4.539 1.00 53.11 H new ATOM 0 HG2 GLU A 47 11.931 -6.332 -4.392 1.00 23.32 H new ATOM 0 HG3 GLU A 47 11.129 -7.553 -5.360 1.00 23.32 H new ATOM 704 N LEU A 48 6.977 -5.138 -6.870 1.00 32.24 N ATOM 705 CA LEU A 48 5.546 -5.077 -6.537 1.00 35.32 C ATOM 706 C LEU A 48 4.926 -6.488 -6.590 1.00 24.35 C ATOM 707 O LEU A 48 4.056 -6.828 -5.790 1.00 34.34 O ATOM 708 CB LEU A 48 4.818 -4.104 -7.493 1.00 21.53 C ATOM 709 CG LEU A 48 3.428 -3.590 -7.044 1.00 53.11 C ATOM 710 CD1 LEU A 48 2.351 -4.666 -7.179 1.00 74.30 C ATOM 711 CD2 LEU A 48 3.486 -3.065 -5.606 1.00 33.44 C ATOM 0 H LEU A 48 7.253 -4.545 -7.653 1.00 32.24 H new ATOM 0 HA LEU A 48 5.430 -4.699 -5.521 1.00 35.32 H new ATOM 0 HB2 LEU A 48 5.463 -3.240 -7.654 1.00 21.53 H new ATOM 0 HB3 LEU A 48 4.701 -4.599 -8.457 1.00 21.53 H new ATOM 0 HG LEU A 48 3.155 -2.769 -7.707 1.00 53.11 H new ATOM 0 HD11 LEU A 48 1.392 -4.264 -6.853 1.00 74.30 H new ATOM 0 HD12 LEU A 48 2.278 -4.979 -8.220 1.00 74.30 H new ATOM 0 HD13 LEU A 48 2.614 -5.523 -6.559 1.00 74.30 H new ATOM 0 HD21 LEU A 48 2.500 -2.708 -5.309 1.00 33.44 H new ATOM 0 HD22 LEU A 48 3.798 -3.868 -4.938 1.00 33.44 H new ATOM 0 HD23 LEU A 48 4.201 -2.245 -5.547 1.00 33.44 H new ATOM 723 N VAL A 49 5.418 -7.315 -7.517 1.00 72.30 N ATOM 724 CA VAL A 49 4.985 -8.717 -7.632 1.00 14.42 C ATOM 725 C VAL A 49 5.217 -9.499 -6.318 1.00 1.34 C ATOM 726 O VAL A 49 4.574 -10.518 -6.059 1.00 60.41 O ATOM 727 CB VAL A 49 5.726 -9.429 -8.798 1.00 61.31 C ATOM 728 CG1 VAL A 49 7.231 -9.511 -8.532 1.00 52.54 C ATOM 729 CG2 VAL A 49 5.137 -10.818 -9.058 1.00 63.24 C ATOM 0 H VAL A 49 6.120 -7.039 -8.203 1.00 72.30 H new ATOM 0 HA VAL A 49 3.915 -8.704 -7.838 1.00 14.42 H new ATOM 0 HB VAL A 49 5.581 -8.830 -9.697 1.00 61.31 H new ATOM 0 HG11 VAL A 49 7.721 -10.014 -9.366 1.00 52.54 H new ATOM 0 HG12 VAL A 49 7.637 -8.505 -8.426 1.00 52.54 H new ATOM 0 HG13 VAL A 49 7.408 -10.072 -7.615 1.00 52.54 H new ATOM 0 HG21 VAL A 49 5.674 -11.293 -9.879 1.00 63.24 H new ATOM 0 HG22 VAL A 49 5.233 -11.428 -8.160 1.00 63.24 H new ATOM 0 HG23 VAL A 49 4.083 -10.723 -9.321 1.00 63.24 H new ATOM 739 N GLY A 50 6.153 -9.020 -5.498 1.00 20.21 N ATOM 740 CA GLY A 50 6.403 -9.625 -4.194 1.00 30.42 C ATOM 741 C GLY A 50 5.537 -9.019 -3.092 1.00 32.41 C ATOM 742 O GLY A 50 5.014 -9.731 -2.231 1.00 52.45 O ATOM 0 H GLY A 50 6.747 -8.219 -5.714 1.00 20.21 H new ATOM 0 HA2 GLY A 50 6.214 -10.697 -4.252 1.00 30.42 H new ATOM 0 HA3 GLY A 50 7.454 -9.501 -3.935 1.00 30.42 H new ATOM 746 N ARG A 51 5.375 -7.696 -3.127 1.00 23.05 N ATOM 747 CA ARG A 51 4.556 -6.989 -2.132 1.00 2.32 C ATOM 748 C ARG A 51 3.048 -7.164 -2.388 1.00 1.42 C ATOM 749 O ARG A 51 2.235 -6.896 -1.507 1.00 12.12 O ATOM 750 CB ARG A 51 4.916 -5.490 -2.084 1.00 63.14 C ATOM 751 CG ARG A 51 6.190 -5.173 -1.294 1.00 61.11 C ATOM 752 CD ARG A 51 7.464 -5.616 -2.012 1.00 2.41 C ATOM 753 NE ARG A 51 8.653 -5.431 -1.176 1.00 43.52 N ATOM 754 CZ ARG A 51 9.680 -4.683 -1.497 1.00 1.23 C ATOM 755 NH1 ARG A 51 9.670 -3.974 -2.578 1.00 51.53 N ATOM 756 NH2 ARG A 51 10.701 -4.611 -0.701 1.00 74.14 N ATOM 0 H ARG A 51 5.797 -7.090 -3.830 1.00 23.05 H new ATOM 0 HA ARG A 51 4.781 -7.438 -1.165 1.00 2.32 H new ATOM 0 HB2 ARG A 51 5.034 -5.124 -3.104 1.00 63.14 H new ATOM 0 HB3 ARG A 51 4.083 -4.942 -1.643 1.00 63.14 H new ATOM 0 HG2 ARG A 51 6.238 -4.100 -1.109 1.00 61.11 H new ATOM 0 HG3 ARG A 51 6.139 -5.662 -0.321 1.00 61.11 H new ATOM 0 HD2 ARG A 51 7.377 -6.666 -2.292 1.00 2.41 H new ATOM 0 HD3 ARG A 51 7.577 -5.048 -2.935 1.00 2.41 H new ATOM 0 HE ARG A 51 8.684 -5.919 -0.281 1.00 43.52 H new ATOM 0 HH11 ARG A 51 8.856 -3.993 -3.193 1.00 51.53 H new ATOM 0 HH12 ARG A 51 10.476 -3.396 -2.816 1.00 51.53 H new ATOM 0 HH21 ARG A 51 10.704 -5.136 0.173 1.00 74.14 H new ATOM 0 HH22 ARG A 51 11.501 -4.029 -0.949 1.00 74.14 H new ATOM 770 N CYS A 52 2.673 -7.623 -3.584 1.00 12.52 N ATOM 771 CA CYS A 52 1.252 -7.836 -3.914 1.00 63.01 C ATOM 772 C CYS A 52 0.648 -9.014 -3.129 1.00 14.35 C ATOM 773 O CYS A 52 -0.559 -9.248 -3.184 1.00 31.52 O ATOM 774 CB CYS A 52 1.062 -8.063 -5.421 1.00 34.25 C ATOM 775 SG CYS A 52 1.799 -9.588 -6.051 1.00 15.43 S ATOM 0 H CYS A 52 3.322 -7.854 -4.337 1.00 12.52 H new ATOM 0 HA CYS A 52 0.723 -6.929 -3.622 1.00 63.01 H new ATOM 0 HB2 CYS A 52 -0.005 -8.073 -5.642 1.00 34.25 H new ATOM 0 HB3 CYS A 52 1.491 -7.218 -5.959 1.00 34.25 H new ATOM 0 HG CYS A 52 2.990 -9.733 -5.551 1.00 15.43 H new ATOM 781 N THR A 53 1.495 -9.757 -2.409 1.00 51.34 N ATOM 782 CA THR A 53 1.028 -10.838 -1.517 1.00 2.14 C ATOM 783 C THR A 53 0.308 -10.265 -0.286 1.00 73.42 C ATOM 784 O THR A 53 -0.549 -10.914 0.314 1.00 2.53 O ATOM 785 CB THR A 53 2.199 -11.739 -1.043 1.00 2.32 C ATOM 786 OG1 THR A 53 3.186 -10.959 -0.343 1.00 4.21 O ATOM 787 CG2 THR A 53 2.860 -12.448 -2.224 1.00 70.33 C ATOM 0 H THR A 53 2.508 -9.634 -2.422 1.00 51.34 H new ATOM 0 HA THR A 53 0.332 -11.443 -2.098 1.00 2.14 H new ATOM 0 HB THR A 53 1.785 -12.489 -0.369 1.00 2.32 H new ATOM 0 HG1 THR A 53 3.789 -10.537 -0.990 1.00 4.21 H new ATOM 0 HG21 THR A 53 3.677 -13.072 -1.863 1.00 70.33 H new ATOM 0 HG22 THR A 53 2.124 -13.071 -2.732 1.00 70.33 H new ATOM 0 HG23 THR A 53 3.251 -11.707 -2.921 1.00 70.33 H new ATOM 795 N GLY A 54 0.674 -9.043 0.082 1.00 2.11 N ATOM 796 CA GLY A 54 -0.003 -8.337 1.159 1.00 53.13 C ATOM 797 C GLY A 54 0.435 -6.882 1.244 1.00 73.42 C ATOM 798 O GLY A 54 1.630 -6.585 1.189 1.00 50.54 O ATOM 0 H GLY A 54 1.436 -8.522 -0.351 1.00 2.11 H new ATOM 0 HA2 GLY A 54 -1.081 -8.384 1.003 1.00 53.13 H new ATOM 0 HA3 GLY A 54 0.204 -8.835 2.106 1.00 53.13 H new ATOM 802 N LEU A 55 -0.521 -5.972 1.411 1.00 52.51 N ATOM 803 CA LEU A 55 -0.227 -4.534 1.383 1.00 61.01 C ATOM 804 C LEU A 55 -1.418 -3.707 1.884 1.00 71.04 C ATOM 805 O LEU A 55 -2.521 -4.226 2.051 1.00 70.22 O ATOM 806 CB LEU A 55 0.164 -4.081 -0.042 1.00 23.43 C ATOM 807 CG LEU A 55 -0.943 -4.175 -1.118 1.00 32.23 C ATOM 808 CD1 LEU A 55 -0.503 -3.481 -2.406 1.00 73.11 C ATOM 809 CD2 LEU A 55 -1.320 -5.626 -1.411 1.00 2.20 C ATOM 0 H LEU A 55 -1.503 -6.199 1.567 1.00 52.51 H new ATOM 0 HA LEU A 55 0.615 -4.363 2.054 1.00 61.01 H new ATOM 0 HB2 LEU A 55 0.505 -3.047 0.009 1.00 23.43 H new ATOM 0 HB3 LEU A 55 1.013 -4.680 -0.371 1.00 23.43 H new ATOM 0 HG LEU A 55 -1.824 -3.669 -0.723 1.00 32.23 H new ATOM 0 HD11 LEU A 55 -1.296 -3.558 -3.150 1.00 73.11 H new ATOM 0 HD12 LEU A 55 -0.299 -2.430 -2.202 1.00 73.11 H new ATOM 0 HD13 LEU A 55 0.400 -3.959 -2.787 1.00 73.11 H new ATOM 0 HD21 LEU A 55 -2.100 -5.653 -2.172 1.00 2.20 H new ATOM 0 HD22 LEU A 55 -0.443 -6.164 -1.772 1.00 2.20 H new ATOM 0 HD23 LEU A 55 -1.686 -6.098 -0.499 1.00 2.20 H new ATOM 821 N VAL A 56 -1.193 -2.416 2.113 1.00 63.42 N ATOM 822 CA VAL A 56 -2.246 -1.519 2.602 1.00 23.41 C ATOM 823 C VAL A 56 -2.260 -0.190 1.824 1.00 43.40 C ATOM 824 O VAL A 56 -1.232 0.465 1.675 1.00 21.15 O ATOM 825 CB VAL A 56 -2.085 -1.245 4.121 1.00 41.34 C ATOM 826 CG1 VAL A 56 -0.736 -0.593 4.427 1.00 33.13 C ATOM 827 CG2 VAL A 56 -3.242 -0.394 4.647 1.00 14.21 C ATOM 0 H VAL A 56 -0.290 -1.963 1.969 1.00 63.42 H new ATOM 0 HA VAL A 56 -3.199 -2.021 2.437 1.00 23.41 H new ATOM 0 HB VAL A 56 -2.111 -2.204 4.638 1.00 41.34 H new ATOM 0 HG11 VAL A 56 -0.653 -0.414 5.499 1.00 33.13 H new ATOM 0 HG12 VAL A 56 0.069 -1.255 4.107 1.00 33.13 H new ATOM 0 HG13 VAL A 56 -0.661 0.355 3.894 1.00 33.13 H new ATOM 0 HG21 VAL A 56 -3.107 -0.215 5.714 1.00 14.21 H new ATOM 0 HG22 VAL A 56 -3.262 0.559 4.119 1.00 14.21 H new ATOM 0 HG23 VAL A 56 -4.183 -0.919 4.483 1.00 14.21 H new ATOM 837 N ILE A 57 -3.435 0.189 1.314 1.00 70.11 N ATOM 838 CA ILE A 57 -3.592 1.414 0.518 1.00 73.31 C ATOM 839 C ILE A 57 -4.472 2.447 1.248 1.00 1.52 C ATOM 840 O ILE A 57 -5.528 2.111 1.795 1.00 21.34 O ATOM 841 CB ILE A 57 -4.227 1.117 -0.877 1.00 32.34 C ATOM 842 CG1 ILE A 57 -3.366 0.128 -1.695 1.00 65.33 C ATOM 843 CG2 ILE A 57 -4.441 2.414 -1.664 1.00 35.42 C ATOM 844 CD1 ILE A 57 -3.479 -1.320 -1.256 1.00 23.13 C ATOM 0 H ILE A 57 -4.299 -0.338 1.439 1.00 70.11 H new ATOM 0 HA ILE A 57 -2.590 1.821 0.378 1.00 73.31 H new ATOM 0 HB ILE A 57 -5.196 0.650 -0.701 1.00 32.34 H new ATOM 0 HG12 ILE A 57 -3.652 0.199 -2.744 1.00 65.33 H new ATOM 0 HG13 ILE A 57 -2.322 0.434 -1.628 1.00 65.33 H new ATOM 0 HG21 ILE A 57 -4.884 2.183 -2.633 1.00 35.42 H new ATOM 0 HG22 ILE A 57 -5.108 3.072 -1.107 1.00 35.42 H new ATOM 0 HG23 ILE A 57 -3.483 2.911 -1.813 1.00 35.42 H new ATOM 0 HD11 ILE A 57 -2.842 -1.942 -1.885 1.00 23.13 H new ATOM 0 HD12 ILE A 57 -3.163 -1.411 -0.217 1.00 23.13 H new ATOM 0 HD13 ILE A 57 -4.514 -1.649 -1.351 1.00 23.13 H new ATOM 856 N GLY A 58 -4.035 3.705 1.247 1.00 5.35 N ATOM 857 CA GLY A 58 -4.814 4.782 1.858 1.00 21.53 C ATOM 858 C GLY A 58 -5.298 5.815 0.840 1.00 4.34 C ATOM 859 O GLY A 58 -4.526 6.269 -0.006 1.00 74.04 O ATOM 0 H GLY A 58 -3.152 4.003 0.833 1.00 5.35 H new ATOM 0 HA2 GLY A 58 -5.675 4.355 2.372 1.00 21.53 H new ATOM 0 HA3 GLY A 58 -4.206 5.280 2.613 1.00 21.53 H new ATOM 863 N MET A 59 -6.577 6.185 0.919 1.00 4.43 N ATOM 864 CA MET A 59 -7.164 7.172 -0.004 1.00 54.11 C ATOM 865 C MET A 59 -6.546 8.572 0.189 1.00 43.43 C ATOM 866 O MET A 59 -6.773 9.222 1.207 1.00 44.03 O ATOM 867 CB MET A 59 -8.684 7.242 0.198 1.00 15.21 C ATOM 868 CG MET A 59 -9.383 8.257 -0.701 1.00 64.54 C ATOM 869 SD MET A 59 -11.138 8.432 -0.320 1.00 24.20 S ATOM 870 CE MET A 59 -11.059 8.878 1.414 1.00 64.23 C ATOM 0 H MET A 59 -7.231 5.819 1.611 1.00 4.43 H new ATOM 0 HA MET A 59 -6.944 6.846 -1.021 1.00 54.11 H new ATOM 0 HB2 MET A 59 -9.110 6.256 0.015 1.00 15.21 H new ATOM 0 HB3 MET A 59 -8.891 7.491 1.239 1.00 15.21 H new ATOM 0 HG2 MET A 59 -8.894 9.226 -0.597 1.00 64.54 H new ATOM 0 HG3 MET A 59 -9.270 7.953 -1.742 1.00 64.54 H new ATOM 0 HE1 MET A 59 -12.066 9.056 1.790 1.00 64.23 H new ATOM 0 HE2 MET A 59 -10.600 8.066 1.978 1.00 64.23 H new ATOM 0 HE3 MET A 59 -10.463 9.783 1.530 1.00 64.23 H new ATOM 880 N SER A 60 -5.769 9.022 -0.795 1.00 43.25 N ATOM 881 CA SER A 60 -5.095 10.333 -0.734 1.00 13.34 C ATOM 882 C SER A 60 -5.800 11.384 -1.608 1.00 5.41 C ATOM 883 O SER A 60 -6.356 11.051 -2.654 1.00 75.11 O ATOM 884 CB SER A 60 -3.640 10.196 -1.202 1.00 3.03 C ATOM 885 OG SER A 60 -3.569 9.791 -2.562 1.00 15.33 O ATOM 0 H SER A 60 -5.585 8.500 -1.652 1.00 43.25 H new ATOM 0 HA SER A 60 -5.132 10.667 0.303 1.00 13.34 H new ATOM 0 HB2 SER A 60 -3.125 11.148 -1.077 1.00 3.03 H new ATOM 0 HB3 SER A 60 -3.122 9.469 -0.577 1.00 3.03 H new ATOM 0 HG SER A 60 -2.962 10.386 -3.049 1.00 15.33 H new ATOM 891 N PRO A 61 -5.763 12.674 -1.202 1.00 51.24 N ATOM 892 CA PRO A 61 -6.328 13.785 -2.002 1.00 12.41 C ATOM 893 C PRO A 61 -5.652 13.921 -3.380 1.00 14.21 C ATOM 894 O PRO A 61 -4.526 13.458 -3.572 1.00 61.33 O ATOM 895 CB PRO A 61 -6.053 15.029 -1.136 1.00 21.40 C ATOM 896 CG PRO A 61 -4.948 14.620 -0.220 1.00 14.14 C ATOM 897 CD PRO A 61 -5.178 13.161 0.062 1.00 11.10 C ATOM 0 HA PRO A 61 -7.384 13.631 -2.222 1.00 12.41 H new ATOM 0 HB2 PRO A 61 -5.763 15.882 -1.750 1.00 21.40 H new ATOM 0 HB3 PRO A 61 -6.940 15.326 -0.577 1.00 21.40 H new ATOM 0 HG2 PRO A 61 -3.975 14.781 -0.683 1.00 14.14 H new ATOM 0 HG3 PRO A 61 -4.964 15.205 0.700 1.00 14.14 H new ATOM 0 HD2 PRO A 61 -4.249 12.644 0.304 1.00 11.10 H new ATOM 0 HD3 PRO A 61 -5.854 13.013 0.904 1.00 11.10 H new ATOM 905 N ALA A 62 -6.332 14.582 -4.321 1.00 23.03 N ATOM 906 CA ALA A 62 -5.851 14.698 -5.711 1.00 54.14 C ATOM 907 C ALA A 62 -4.391 15.183 -5.801 1.00 63.50 C ATOM 908 O ALA A 62 -3.614 14.682 -6.615 1.00 3.00 O ATOM 909 CB ALA A 62 -6.767 15.623 -6.506 1.00 4.24 C ATOM 0 H ALA A 62 -7.222 15.049 -4.149 1.00 23.03 H new ATOM 0 HA ALA A 62 -5.876 13.697 -6.142 1.00 54.14 H new ATOM 0 HB1 ALA A 62 -6.404 15.702 -7.531 1.00 4.24 H new ATOM 0 HB2 ALA A 62 -7.779 15.218 -6.510 1.00 4.24 H new ATOM 0 HB3 ALA A 62 -6.774 16.611 -6.046 1.00 4.24 H new ATOM 915 N ALA A 63 -4.026 16.149 -4.956 1.00 44.13 N ATOM 916 CA ALA A 63 -2.662 16.700 -4.935 1.00 34.32 C ATOM 917 C ALA A 63 -1.593 15.601 -4.801 1.00 25.53 C ATOM 918 O ALA A 63 -0.660 15.523 -5.602 1.00 52.23 O ATOM 919 CB ALA A 63 -2.529 17.704 -3.797 1.00 71.12 C ATOM 0 H ALA A 63 -4.656 16.570 -4.273 1.00 44.13 H new ATOM 0 HA ALA A 63 -2.493 17.200 -5.889 1.00 34.32 H new ATOM 0 HB1 ALA A 63 -1.517 18.109 -3.786 1.00 71.12 H new ATOM 0 HB2 ALA A 63 -3.243 18.515 -3.942 1.00 71.12 H new ATOM 0 HB3 ALA A 63 -2.732 17.207 -2.848 1.00 71.12 H new ATOM 925 N SER A 64 -1.744 14.754 -3.785 1.00 11.11 N ATOM 926 CA SER A 64 -0.803 13.652 -3.541 1.00 64.24 C ATOM 927 C SER A 64 -1.080 12.469 -4.476 1.00 25.02 C ATOM 928 O SER A 64 -0.165 11.753 -4.883 1.00 73.14 O ATOM 929 CB SER A 64 -0.900 13.188 -2.081 1.00 63.34 C ATOM 930 OG SER A 64 -0.680 14.263 -1.178 1.00 42.35 O ATOM 0 H SER A 64 -2.510 14.806 -3.113 1.00 11.11 H new ATOM 0 HA SER A 64 0.203 14.021 -3.740 1.00 64.24 H new ATOM 0 HB2 SER A 64 -1.884 12.755 -1.900 1.00 63.34 H new ATOM 0 HB3 SER A 64 -0.167 12.402 -1.898 1.00 63.34 H new ATOM 0 HG SER A 64 -0.285 15.020 -1.660 1.00 42.35 H new ATOM 936 N ALA A 65 -2.354 12.283 -4.821 1.00 52.41 N ATOM 937 CA ALA A 65 -2.775 11.194 -5.708 1.00 32.33 C ATOM 938 C ALA A 65 -2.087 11.285 -7.075 1.00 45.34 C ATOM 939 O ALA A 65 -1.883 10.274 -7.740 1.00 11.15 O ATOM 940 CB ALA A 65 -4.291 11.200 -5.872 1.00 33.52 C ATOM 0 H ALA A 65 -3.119 12.876 -4.498 1.00 52.41 H new ATOM 0 HA ALA A 65 -2.473 10.253 -5.248 1.00 32.33 H new ATOM 0 HB1 ALA A 65 -4.589 10.386 -6.533 1.00 33.52 H new ATOM 0 HB2 ALA A 65 -4.763 11.068 -4.898 1.00 33.52 H new ATOM 0 HB3 ALA A 65 -4.607 12.151 -6.302 1.00 33.52 H new ATOM 946 N ALA A 66 -1.719 12.498 -7.482 1.00 14.22 N ATOM 947 CA ALA A 66 -1.011 12.711 -8.752 1.00 61.43 C ATOM 948 C ALA A 66 0.297 11.895 -8.835 1.00 14.44 C ATOM 949 O ALA A 66 0.721 11.495 -9.919 1.00 71.23 O ATOM 950 CB ALA A 66 -0.725 14.196 -8.946 1.00 43.40 C ATOM 0 H ALA A 66 -1.897 13.352 -6.953 1.00 14.22 H new ATOM 0 HA ALA A 66 -1.660 12.358 -9.554 1.00 61.43 H new ATOM 0 HB1 ALA A 66 -0.200 14.345 -9.890 1.00 43.40 H new ATOM 0 HB2 ALA A 66 -1.665 14.748 -8.962 1.00 43.40 H new ATOM 0 HB3 ALA A 66 -0.106 14.558 -8.125 1.00 43.40 H new ATOM 956 N SER A 67 0.924 11.640 -7.684 1.00 74.43 N ATOM 957 CA SER A 67 2.171 10.855 -7.626 1.00 1.24 C ATOM 958 C SER A 67 1.893 9.342 -7.652 1.00 70.34 C ATOM 959 O SER A 67 2.787 8.536 -7.915 1.00 73.35 O ATOM 960 CB SER A 67 2.960 11.198 -6.353 1.00 70.41 C ATOM 961 OG SER A 67 3.247 12.585 -6.269 1.00 2.22 O ATOM 0 H SER A 67 0.592 11.964 -6.776 1.00 74.43 H new ATOM 0 HA SER A 67 2.757 11.115 -8.508 1.00 1.24 H new ATOM 0 HB2 SER A 67 2.388 10.891 -5.477 1.00 70.41 H new ATOM 0 HB3 SER A 67 3.892 10.632 -6.339 1.00 70.41 H new ATOM 0 HG SER A 67 3.748 12.766 -5.446 1.00 2.22 H new ATOM 967 N ILE A 68 0.649 8.969 -7.360 1.00 3.14 N ATOM 968 CA ILE A 68 0.252 7.557 -7.250 1.00 64.45 C ATOM 969 C ILE A 68 -0.465 7.055 -8.516 1.00 14.43 C ATOM 970 O ILE A 68 -0.140 5.995 -9.052 1.00 5.12 O ATOM 971 CB ILE A 68 -0.708 7.358 -6.048 1.00 44.43 C ATOM 972 CG1 ILE A 68 -0.152 8.049 -4.791 1.00 34.34 C ATOM 973 CG2 ILE A 68 -0.949 5.870 -5.785 1.00 40.32 C ATOM 974 CD1 ILE A 68 -1.122 8.067 -3.630 1.00 74.44 C ATOM 0 H ILE A 68 -0.112 9.628 -7.193 1.00 3.14 H new ATOM 0 HA ILE A 68 1.171 6.987 -7.112 1.00 64.45 H new ATOM 0 HB ILE A 68 -1.665 7.817 -6.297 1.00 44.43 H new ATOM 0 HG12 ILE A 68 0.762 7.542 -4.482 1.00 34.34 H new ATOM 0 HG13 ILE A 68 0.121 9.074 -5.041 1.00 34.34 H new ATOM 0 HG21 ILE A 68 -1.625 5.755 -4.938 1.00 40.32 H new ATOM 0 HG22 ILE A 68 -1.393 5.412 -6.669 1.00 40.32 H new ATOM 0 HG23 ILE A 68 -0.001 5.382 -5.561 1.00 40.32 H new ATOM 0 HD11 ILE A 68 -0.662 8.570 -2.779 1.00 74.44 H new ATOM 0 HD12 ILE A 68 -2.027 8.600 -3.920 1.00 74.44 H new ATOM 0 HD13 ILE A 68 -1.377 7.044 -3.353 1.00 74.44 H new ATOM 986 N GLN A 69 -1.433 7.847 -8.977 1.00 34.12 N ATOM 987 CA GLN A 69 -2.404 7.454 -10.012 1.00 52.03 C ATOM 988 C GLN A 69 -1.759 6.736 -11.219 1.00 1.34 C ATOM 989 O GLN A 69 -2.264 5.709 -11.680 1.00 14.33 O ATOM 990 CB GLN A 69 -3.158 8.710 -10.477 1.00 13.00 C ATOM 991 CG GLN A 69 -4.500 8.436 -11.145 1.00 2.02 C ATOM 992 CD GLN A 69 -5.219 9.717 -11.536 1.00 52.34 C ATOM 993 OE1 GLN A 69 -5.065 10.217 -12.645 1.00 1.43 O ATOM 994 NE2 GLN A 69 -5.997 10.273 -10.623 1.00 71.32 N ATOM 0 H GLN A 69 -1.571 8.799 -8.638 1.00 34.12 H new ATOM 0 HA GLN A 69 -3.088 6.731 -9.568 1.00 52.03 H new ATOM 0 HB2 GLN A 69 -3.322 9.358 -9.616 1.00 13.00 H new ATOM 0 HB3 GLN A 69 -2.526 9.259 -11.174 1.00 13.00 H new ATOM 0 HG2 GLN A 69 -4.344 7.824 -12.033 1.00 2.02 H new ATOM 0 HG3 GLN A 69 -5.130 7.860 -10.468 1.00 2.02 H new ATOM 0 HE21 GLN A 69 -6.105 9.833 -9.709 1.00 71.32 H new ATOM 0 HE22 GLN A 69 -6.489 11.142 -10.833 1.00 71.32 H new ATOM 1003 N GLY A 70 -0.650 7.275 -11.720 1.00 42.14 N ATOM 1004 CA GLY A 70 0.049 6.654 -12.844 1.00 15.41 C ATOM 1005 C GLY A 70 0.542 5.238 -12.539 1.00 71.35 C ATOM 1006 O GLY A 70 0.083 4.266 -13.145 1.00 2.44 O ATOM 0 H GLY A 70 -0.219 8.131 -11.371 1.00 42.14 H new ATOM 0 HA2 GLY A 70 -0.618 6.622 -13.705 1.00 15.41 H new ATOM 0 HA3 GLY A 70 0.900 7.276 -13.123 1.00 15.41 H new ATOM 1010 N ALA A 71 1.461 5.120 -11.582 1.00 15.42 N ATOM 1011 CA ALA A 71 2.047 3.822 -11.207 1.00 23.50 C ATOM 1012 C ALA A 71 0.991 2.845 -10.656 1.00 33.34 C ATOM 1013 O ALA A 71 1.126 1.623 -10.781 1.00 15.42 O ATOM 1014 CB ALA A 71 3.159 4.032 -10.186 1.00 63.40 C ATOM 0 H ALA A 71 1.821 5.909 -11.046 1.00 15.42 H new ATOM 0 HA ALA A 71 2.460 3.372 -12.110 1.00 23.50 H new ATOM 0 HB1 ALA A 71 3.589 3.068 -9.912 1.00 63.40 H new ATOM 0 HB2 ALA A 71 3.934 4.666 -10.617 1.00 63.40 H new ATOM 0 HB3 ALA A 71 2.751 4.513 -9.297 1.00 63.40 H new ATOM 1020 N LEU A 72 -0.059 3.398 -10.050 1.00 54.12 N ATOM 1021 CA LEU A 72 -1.160 2.607 -9.486 1.00 34.22 C ATOM 1022 C LEU A 72 -1.774 1.670 -10.540 1.00 32.30 C ATOM 1023 O LEU A 72 -2.199 0.552 -10.225 1.00 54.50 O ATOM 1024 CB LEU A 72 -2.217 3.567 -8.902 1.00 3.32 C ATOM 1025 CG LEU A 72 -3.489 2.923 -8.310 1.00 11.11 C ATOM 1026 CD1 LEU A 72 -4.049 3.778 -7.175 1.00 41.34 C ATOM 1027 CD2 LEU A 72 -4.556 2.727 -9.390 1.00 33.44 C ATOM 0 H LEU A 72 -0.173 4.405 -9.935 1.00 54.12 H new ATOM 0 HA LEU A 72 -0.774 1.971 -8.689 1.00 34.22 H new ATOM 0 HB2 LEU A 72 -1.742 4.161 -8.121 1.00 3.32 H new ATOM 0 HB3 LEU A 72 -2.520 4.258 -9.689 1.00 3.32 H new ATOM 0 HG LEU A 72 -3.213 1.946 -7.912 1.00 11.11 H new ATOM 0 HD11 LEU A 72 -4.945 3.306 -6.772 1.00 41.34 H new ATOM 0 HD12 LEU A 72 -3.302 3.871 -6.387 1.00 41.34 H new ATOM 0 HD13 LEU A 72 -4.300 4.768 -7.555 1.00 41.34 H new ATOM 0 HD21 LEU A 72 -5.442 2.272 -8.948 1.00 33.44 H new ATOM 0 HD22 LEU A 72 -4.820 3.693 -9.820 1.00 33.44 H new ATOM 0 HD23 LEU A 72 -4.166 2.076 -10.173 1.00 33.44 H new ATOM 1039 N SER A 73 -1.792 2.126 -11.790 1.00 64.52 N ATOM 1040 CA SER A 73 -2.322 1.333 -12.910 1.00 65.41 C ATOM 1041 C SER A 73 -1.642 -0.042 -13.000 1.00 54.14 C ATOM 1042 O SER A 73 -2.288 -1.051 -13.283 1.00 13.30 O ATOM 1043 CB SER A 73 -2.132 2.087 -14.233 1.00 24.24 C ATOM 1044 OG SER A 73 -2.725 3.378 -14.185 1.00 45.32 O ATOM 0 H SER A 73 -1.444 3.046 -12.060 1.00 64.52 H new ATOM 0 HA SER A 73 -3.385 1.177 -12.727 1.00 65.41 H new ATOM 0 HB2 SER A 73 -1.068 2.182 -14.450 1.00 24.24 H new ATOM 0 HB3 SER A 73 -2.573 1.512 -15.047 1.00 24.24 H new ATOM 0 HG SER A 73 -2.073 4.025 -13.845 1.00 45.32 H new ATOM 1050 N THR A 74 -0.333 -0.074 -12.755 1.00 50.13 N ATOM 1051 CA THR A 74 0.434 -1.326 -12.784 1.00 24.20 C ATOM 1052 C THR A 74 0.135 -2.193 -11.549 1.00 44.33 C ATOM 1053 O THR A 74 0.031 -3.418 -11.645 1.00 42.33 O ATOM 1054 CB THR A 74 1.961 -1.052 -12.856 1.00 2.44 C ATOM 1055 OG1 THR A 74 2.265 -0.257 -14.014 1.00 64.33 O ATOM 1056 CG2 THR A 74 2.764 -2.352 -12.910 1.00 25.20 C ATOM 0 H THR A 74 0.223 0.752 -12.534 1.00 50.13 H new ATOM 0 HA THR A 74 0.126 -1.864 -13.681 1.00 24.20 H new ATOM 0 HB THR A 74 2.242 -0.513 -11.951 1.00 2.44 H new ATOM 0 HG1 THR A 74 3.230 -0.088 -14.050 1.00 64.33 H new ATOM 0 HG21 THR A 74 3.828 -2.121 -12.960 1.00 25.20 H new ATOM 0 HG22 THR A 74 2.562 -2.942 -12.016 1.00 25.20 H new ATOM 0 HG23 THR A 74 2.475 -2.922 -13.793 1.00 25.20 H new ATOM 1064 N ILE A 75 -0.027 -1.546 -10.395 1.00 30.24 N ATOM 1065 CA ILE A 75 -0.284 -2.249 -9.130 1.00 73.32 C ATOM 1066 C ILE A 75 -1.584 -3.073 -9.186 1.00 2.25 C ATOM 1067 O ILE A 75 -1.567 -4.295 -9.011 1.00 54.43 O ATOM 1068 CB ILE A 75 -0.359 -1.251 -7.945 1.00 64.24 C ATOM 1069 CG1 ILE A 75 0.944 -0.435 -7.856 1.00 63.33 C ATOM 1070 CG2 ILE A 75 -0.637 -1.983 -6.627 1.00 60.13 C ATOM 1071 CD1 ILE A 75 0.935 0.627 -6.774 1.00 4.33 C ATOM 0 H ILE A 75 0.015 -0.531 -10.306 1.00 30.24 H new ATOM 0 HA ILE A 75 0.551 -2.932 -8.975 1.00 73.32 H new ATOM 0 HB ILE A 75 -1.187 -0.565 -8.123 1.00 64.24 H new ATOM 0 HG12 ILE A 75 1.775 -1.116 -7.675 1.00 63.33 H new ATOM 0 HG13 ILE A 75 1.127 0.043 -8.818 1.00 63.33 H new ATOM 0 HG21 ILE A 75 -0.685 -1.260 -5.812 1.00 60.13 H new ATOM 0 HG22 ILE A 75 -1.587 -2.513 -6.698 1.00 60.13 H new ATOM 0 HG23 ILE A 75 0.163 -2.697 -6.432 1.00 60.13 H new ATOM 0 HD11 ILE A 75 1.888 1.157 -6.776 1.00 4.33 H new ATOM 0 HD12 ILE A 75 0.126 1.333 -6.964 1.00 4.33 H new ATOM 0 HD13 ILE A 75 0.785 0.156 -5.803 1.00 4.33 H new ATOM 1083 N LEU A 76 -2.705 -2.402 -9.460 1.00 54.25 N ATOM 1084 CA LEU A 76 -4.024 -3.061 -9.508 1.00 72.22 C ATOM 1085 C LEU A 76 -4.097 -4.162 -10.587 1.00 34.03 C ATOM 1086 O LEU A 76 -5.049 -4.947 -10.617 1.00 63.13 O ATOM 1087 CB LEU A 76 -5.134 -2.021 -9.738 1.00 12.25 C ATOM 1088 CG LEU A 76 -5.598 -1.254 -8.481 1.00 61.44 C ATOM 1089 CD1 LEU A 76 -4.431 -0.539 -7.803 1.00 52.31 C ATOM 1090 CD2 LEU A 76 -6.710 -0.264 -8.833 1.00 24.13 C ATOM 0 H LEU A 76 -2.732 -1.401 -9.653 1.00 54.25 H new ATOM 0 HA LEU A 76 -4.172 -3.545 -8.543 1.00 72.22 H new ATOM 0 HB2 LEU A 76 -4.783 -1.298 -10.474 1.00 12.25 H new ATOM 0 HB3 LEU A 76 -5.996 -2.526 -10.173 1.00 12.25 H new ATOM 0 HG LEU A 76 -5.996 -1.982 -7.774 1.00 61.44 H new ATOM 0 HD11 LEU A 76 -4.792 -0.009 -6.922 1.00 52.31 H new ATOM 0 HD12 LEU A 76 -3.680 -1.271 -7.504 1.00 52.31 H new ATOM 0 HD13 LEU A 76 -3.987 0.173 -8.499 1.00 52.31 H new ATOM 0 HD21 LEU A 76 -7.023 0.266 -7.934 1.00 24.13 H new ATOM 0 HD22 LEU A 76 -6.341 0.452 -9.567 1.00 24.13 H new ATOM 0 HD23 LEU A 76 -7.560 -0.805 -9.250 1.00 24.13 H new ATOM 1102 N GLY A 77 -3.107 -4.202 -11.475 1.00 33.45 N ATOM 1103 CA GLY A 77 -3.022 -5.271 -12.466 1.00 60.02 C ATOM 1104 C GLY A 77 -2.075 -6.395 -12.045 1.00 54.22 C ATOM 1105 O GLY A 77 -2.278 -7.558 -12.404 1.00 15.32 O ATOM 0 H GLY A 77 -2.358 -3.512 -11.529 1.00 33.45 H new ATOM 0 HA2 GLY A 77 -4.017 -5.684 -12.634 1.00 60.02 H new ATOM 0 HA3 GLY A 77 -2.685 -4.854 -13.415 1.00 60.02 H new ATOM 1109 N SER A 78 -1.044 -6.047 -11.271 1.00 65.32 N ATOM 1110 CA SER A 78 -0.042 -7.026 -10.810 1.00 40.34 C ATOM 1111 C SER A 78 -0.556 -7.851 -9.620 1.00 31.33 C ATOM 1112 O SER A 78 -0.080 -8.961 -9.374 1.00 74.41 O ATOM 1113 CB SER A 78 1.268 -6.320 -10.421 1.00 72.21 C ATOM 1114 OG SER A 78 1.838 -5.630 -11.526 1.00 73.25 O ATOM 0 H SER A 78 -0.876 -5.094 -10.947 1.00 65.32 H new ATOM 0 HA SER A 78 0.146 -7.707 -11.640 1.00 40.34 H new ATOM 0 HB2 SER A 78 1.076 -5.616 -9.611 1.00 72.21 H new ATOM 0 HB3 SER A 78 1.980 -7.054 -10.043 1.00 72.21 H new ATOM 0 HG SER A 78 1.310 -4.827 -11.718 1.00 73.25 H new ATOM 1120 N VAL A 79 -1.518 -7.302 -8.871 1.00 74.51 N ATOM 1121 CA VAL A 79 -2.121 -8.024 -7.739 1.00 20.22 C ATOM 1122 C VAL A 79 -2.883 -9.280 -8.200 1.00 61.32 C ATOM 1123 O VAL A 79 -3.330 -9.368 -9.347 1.00 12.33 O ATOM 1124 CB VAL A 79 -3.079 -7.119 -6.919 1.00 51.10 C ATOM 1125 CG1 VAL A 79 -2.325 -5.935 -6.320 1.00 24.43 C ATOM 1126 CG2 VAL A 79 -4.246 -6.642 -7.782 1.00 20.33 C ATOM 0 H VAL A 79 -1.896 -6.367 -9.024 1.00 74.51 H new ATOM 0 HA VAL A 79 -1.291 -8.329 -7.101 1.00 20.22 H new ATOM 0 HB VAL A 79 -3.486 -7.710 -6.099 1.00 51.10 H new ATOM 0 HG11 VAL A 79 -3.016 -5.314 -5.750 1.00 24.43 H new ATOM 0 HG12 VAL A 79 -1.537 -6.301 -5.661 1.00 24.43 H new ATOM 0 HG13 VAL A 79 -1.882 -5.343 -7.121 1.00 24.43 H new ATOM 0 HG21 VAL A 79 -4.904 -6.009 -7.186 1.00 20.33 H new ATOM 0 HG22 VAL A 79 -3.863 -6.072 -8.629 1.00 20.33 H new ATOM 0 HG23 VAL A 79 -4.804 -7.504 -8.148 1.00 20.33 H new ATOM 1136 N ASN A 80 -3.028 -10.249 -7.298 1.00 42.34 N ATOM 1137 CA ASN A 80 -3.695 -11.516 -7.620 1.00 32.33 C ATOM 1138 C ASN A 80 -5.229 -11.376 -7.580 1.00 63.04 C ATOM 1139 O ASN A 80 -5.763 -10.443 -6.979 1.00 24.42 O ATOM 1140 CB ASN A 80 -3.238 -12.604 -6.638 1.00 71.02 C ATOM 1141 CG ASN A 80 -3.774 -13.980 -7.000 1.00 21.12 C ATOM 1142 OD1 ASN A 80 -4.844 -14.379 -6.562 1.00 24.12 O ATOM 1143 ND2 ASN A 80 -3.039 -14.708 -7.815 1.00 64.14 N ATOM 0 H ASN A 80 -2.693 -10.184 -6.337 1.00 42.34 H new ATOM 0 HA ASN A 80 -3.416 -11.798 -8.635 1.00 32.33 H new ATOM 0 HB2 ASN A 80 -2.149 -12.636 -6.618 1.00 71.02 H new ATOM 0 HB3 ASN A 80 -3.568 -12.343 -5.632 1.00 71.02 H new ATOM 0 HD21 ASN A 80 -3.358 -15.634 -8.099 1.00 64.14 H new ATOM 0 HD22 ASN A 80 -2.151 -14.345 -8.162 1.00 64.14 H new ATOM 1150 N GLU A 81 -5.924 -12.314 -8.230 1.00 11.35 N ATOM 1151 CA GLU A 81 -7.395 -12.346 -8.247 1.00 60.03 C ATOM 1152 C GLU A 81 -7.987 -12.351 -6.825 1.00 42.23 C ATOM 1153 O GLU A 81 -9.032 -11.752 -6.569 1.00 22.00 O ATOM 1154 CB GLU A 81 -7.864 -13.589 -9.014 1.00 43.30 C ATOM 1155 CG GLU A 81 -9.380 -13.724 -9.128 1.00 5.53 C ATOM 1156 CD GLU A 81 -9.796 -15.006 -9.829 1.00 24.20 C ATOM 1157 OE1 GLU A 81 -9.802 -15.033 -11.080 1.00 33.11 O ATOM 1158 OE2 GLU A 81 -10.109 -15.998 -9.138 1.00 22.25 O ATOM 0 H GLU A 81 -5.488 -13.070 -8.758 1.00 11.35 H new ATOM 0 HA GLU A 81 -7.748 -11.442 -8.743 1.00 60.03 H new ATOM 0 HB2 GLU A 81 -7.437 -13.565 -10.017 1.00 43.30 H new ATOM 0 HB3 GLU A 81 -7.468 -14.477 -8.520 1.00 43.30 H new ATOM 0 HG2 GLU A 81 -9.820 -13.699 -8.131 1.00 5.53 H new ATOM 0 HG3 GLU A 81 -9.778 -12.869 -9.674 1.00 5.53 H new ATOM 1165 N LYS A 82 -7.314 -13.043 -5.912 1.00 2.54 N ATOM 1166 CA LYS A 82 -7.716 -13.084 -4.505 1.00 22.13 C ATOM 1167 C LYS A 82 -6.483 -12.991 -3.591 1.00 61.43 C ATOM 1168 O LYS A 82 -5.564 -13.808 -3.680 1.00 74.32 O ATOM 1169 CB LYS A 82 -8.512 -14.366 -4.218 1.00 71.23 C ATOM 1170 CG LYS A 82 -7.766 -15.660 -4.545 1.00 1.32 C ATOM 1171 CD LYS A 82 -8.640 -16.890 -4.308 1.00 4.12 C ATOM 1172 CE LYS A 82 -9.153 -16.961 -2.871 1.00 42.25 C ATOM 1173 NZ LYS A 82 -10.054 -18.124 -2.656 1.00 55.15 N ATOM 0 H LYS A 82 -6.479 -13.589 -6.122 1.00 2.54 H new ATOM 0 HA LYS A 82 -8.357 -12.227 -4.298 1.00 22.13 H new ATOM 0 HB2 LYS A 82 -8.790 -14.378 -3.164 1.00 71.23 H new ATOM 0 HB3 LYS A 82 -9.438 -14.340 -4.792 1.00 71.23 H new ATOM 0 HG2 LYS A 82 -7.440 -15.640 -5.585 1.00 1.32 H new ATOM 0 HG3 LYS A 82 -6.868 -15.728 -3.931 1.00 1.32 H new ATOM 0 HD2 LYS A 82 -9.487 -16.871 -4.994 1.00 4.12 H new ATOM 0 HD3 LYS A 82 -8.068 -17.790 -4.533 1.00 4.12 H new ATOM 0 HE2 LYS A 82 -8.307 -17.027 -2.187 1.00 42.25 H new ATOM 0 HE3 LYS A 82 -9.686 -16.041 -2.631 1.00 42.25 H new ATOM 0 HZ1 LYS A 82 -10.379 -18.134 -1.668 1.00 55.15 H new ATOM 0 HZ2 LYS A 82 -10.875 -18.049 -3.290 1.00 55.15 H new ATOM 0 HZ3 LYS A 82 -9.539 -19.004 -2.860 1.00 55.15 H new ATOM 1187 N GLN A 83 -6.458 -11.983 -2.721 1.00 35.41 N ATOM 1188 CA GLN A 83 -5.299 -11.743 -1.854 1.00 24.11 C ATOM 1189 C GLN A 83 -5.666 -10.802 -0.690 1.00 74.34 C ATOM 1190 O GLN A 83 -6.740 -10.194 -0.684 1.00 22.24 O ATOM 1191 CB GLN A 83 -4.151 -11.138 -2.687 1.00 73.22 C ATOM 1192 CG GLN A 83 -2.759 -11.364 -2.106 1.00 10.04 C ATOM 1193 CD GLN A 83 -2.350 -12.834 -2.079 1.00 34.53 C ATOM 1194 OE1 GLN A 83 -1.596 -13.266 -1.218 1.00 35.32 O ATOM 1195 NE2 GLN A 83 -2.843 -13.617 -3.021 1.00 71.20 N ATOM 0 H GLN A 83 -7.223 -11.320 -2.596 1.00 35.41 H new ATOM 0 HA GLN A 83 -4.978 -12.694 -1.428 1.00 24.11 H new ATOM 0 HB2 GLN A 83 -4.185 -11.562 -3.691 1.00 73.22 H new ATOM 0 HB3 GLN A 83 -4.319 -10.066 -2.788 1.00 73.22 H new ATOM 0 HG2 GLN A 83 -2.032 -10.802 -2.692 1.00 10.04 H new ATOM 0 HG3 GLN A 83 -2.727 -10.966 -1.092 1.00 10.04 H new ATOM 0 HE21 GLN A 83 -3.470 -13.232 -3.728 1.00 71.20 H new ATOM 0 HE22 GLN A 83 -2.597 -14.607 -3.042 1.00 71.20 H new ATOM 1204 N ALA A 84 -4.761 -10.670 0.282 1.00 41.52 N ATOM 1205 CA ALA A 84 -5.006 -9.830 1.462 1.00 72.22 C ATOM 1206 C ALA A 84 -4.547 -8.380 1.236 1.00 5.32 C ATOM 1207 O ALA A 84 -3.377 -8.042 1.435 1.00 55.13 O ATOM 1208 CB ALA A 84 -4.316 -10.425 2.687 1.00 13.44 C ATOM 0 H ALA A 84 -3.852 -11.132 0.278 1.00 41.52 H new ATOM 0 HA ALA A 84 -6.082 -9.808 1.635 1.00 72.22 H new ATOM 0 HB1 ALA A 84 -4.506 -9.793 3.554 1.00 13.44 H new ATOM 0 HB2 ALA A 84 -4.707 -11.425 2.875 1.00 13.44 H new ATOM 0 HB3 ALA A 84 -3.242 -10.483 2.508 1.00 13.44 H new ATOM 1214 N VAL A 85 -5.476 -7.532 0.803 1.00 63.32 N ATOM 1215 CA VAL A 85 -5.193 -6.108 0.584 1.00 21.43 C ATOM 1216 C VAL A 85 -5.860 -5.238 1.663 1.00 2.44 C ATOM 1217 O VAL A 85 -6.916 -5.586 2.195 1.00 35.22 O ATOM 1218 CB VAL A 85 -5.665 -5.647 -0.821 1.00 63.55 C ATOM 1219 CG1 VAL A 85 -4.918 -6.406 -1.918 1.00 14.53 C ATOM 1220 CG2 VAL A 85 -7.176 -5.821 -0.980 1.00 44.14 C ATOM 0 H VAL A 85 -6.437 -7.804 0.595 1.00 63.32 H new ATOM 0 HA VAL A 85 -4.112 -5.983 0.647 1.00 21.43 H new ATOM 0 HB VAL A 85 -5.436 -4.586 -0.919 1.00 63.55 H new ATOM 0 HG11 VAL A 85 -5.264 -6.068 -2.895 1.00 14.53 H new ATOM 0 HG12 VAL A 85 -3.848 -6.218 -1.827 1.00 14.53 H new ATOM 0 HG13 VAL A 85 -5.109 -7.474 -1.816 1.00 14.53 H new ATOM 0 HG21 VAL A 85 -7.478 -5.490 -1.974 1.00 44.14 H new ATOM 0 HG22 VAL A 85 -7.437 -6.872 -0.853 1.00 44.14 H new ATOM 0 HG23 VAL A 85 -7.692 -5.225 -0.227 1.00 44.14 H new ATOM 1230 N GLY A 86 -5.231 -4.114 1.993 1.00 74.32 N ATOM 1231 CA GLY A 86 -5.779 -3.203 2.995 1.00 74.14 C ATOM 1232 C GLY A 86 -6.284 -1.891 2.400 1.00 34.13 C ATOM 1233 O GLY A 86 -5.721 -1.386 1.432 1.00 42.42 O ATOM 0 H GLY A 86 -4.346 -3.812 1.584 1.00 74.32 H new ATOM 0 HA2 GLY A 86 -6.598 -3.697 3.517 1.00 74.14 H new ATOM 0 HA3 GLY A 86 -5.012 -2.986 3.738 1.00 74.14 H new ATOM 1237 N ILE A 87 -7.345 -1.339 2.988 1.00 4.12 N ATOM 1238 CA ILE A 87 -7.941 -0.072 2.532 1.00 74.43 C ATOM 1239 C ILE A 87 -8.379 0.784 3.733 1.00 44.25 C ATOM 1240 O ILE A 87 -9.019 0.277 4.653 1.00 12.21 O ATOM 1241 CB ILE A 87 -9.184 -0.321 1.624 1.00 31.24 C ATOM 1242 CG1 ILE A 87 -8.793 -1.056 0.327 1.00 74.22 C ATOM 1243 CG2 ILE A 87 -9.893 0.995 1.298 1.00 23.10 C ATOM 1244 CD1 ILE A 87 -7.873 -0.262 -0.581 1.00 60.01 C ATOM 0 H ILE A 87 -7.818 -1.752 3.792 1.00 4.12 H new ATOM 0 HA ILE A 87 -7.176 0.452 1.958 1.00 74.43 H new ATOM 0 HB ILE A 87 -9.873 -0.958 2.178 1.00 31.24 H new ATOM 0 HG12 ILE A 87 -8.306 -1.996 0.587 1.00 74.22 H new ATOM 0 HG13 ILE A 87 -9.700 -1.308 -0.223 1.00 74.22 H new ATOM 0 HG21 ILE A 87 -10.757 0.796 0.664 1.00 23.10 H new ATOM 0 HG22 ILE A 87 -10.223 1.469 2.222 1.00 23.10 H new ATOM 0 HG23 ILE A 87 -9.205 1.659 0.776 1.00 23.10 H new ATOM 0 HD11 ILE A 87 -7.645 -0.849 -1.471 1.00 60.01 H new ATOM 0 HD12 ILE A 87 -8.363 0.666 -0.874 1.00 60.01 H new ATOM 0 HD13 ILE A 87 -6.948 -0.032 -0.051 1.00 60.01 H new ATOM 1256 N PHE A 88 -8.026 2.072 3.725 1.00 1.32 N ATOM 1257 CA PHE A 88 -8.494 3.009 4.760 1.00 2.10 C ATOM 1258 C PHE A 88 -8.564 4.449 4.219 1.00 42.30 C ATOM 1259 O PHE A 88 -7.918 4.785 3.221 1.00 72.32 O ATOM 1260 CB PHE A 88 -7.588 2.953 6.005 1.00 21.24 C ATOM 1261 CG PHE A 88 -6.182 3.463 5.783 1.00 40.02 C ATOM 1262 CD1 PHE A 88 -5.206 2.640 5.239 1.00 63.21 C ATOM 1263 CD2 PHE A 88 -5.839 4.764 6.128 1.00 32.02 C ATOM 1264 CE1 PHE A 88 -3.919 3.105 5.040 1.00 3.13 C ATOM 1265 CE2 PHE A 88 -4.555 5.233 5.933 1.00 25.42 C ATOM 1266 CZ PHE A 88 -3.592 4.403 5.388 1.00 62.15 C ATOM 0 H PHE A 88 -7.421 2.492 3.019 1.00 1.32 H new ATOM 0 HA PHE A 88 -9.500 2.702 5.048 1.00 2.10 H new ATOM 0 HB2 PHE A 88 -8.051 3.536 6.801 1.00 21.24 H new ATOM 0 HB3 PHE A 88 -7.536 1.922 6.354 1.00 21.24 H new ATOM 0 HD1 PHE A 88 -5.454 1.625 4.968 1.00 63.21 H new ATOM 0 HD2 PHE A 88 -6.586 5.417 6.554 1.00 32.02 H new ATOM 0 HE1 PHE A 88 -3.170 2.455 4.613 1.00 3.13 H new ATOM 0 HE2 PHE A 88 -4.303 6.247 6.206 1.00 25.42 H new ATOM 0 HZ PHE A 88 -2.587 4.768 5.235 1.00 62.15 H new ATOM 1276 N GLU A 89 -9.349 5.298 4.883 1.00 0.40 N ATOM 1277 CA GLU A 89 -9.486 6.702 4.477 1.00 24.44 C ATOM 1278 C GLU A 89 -8.689 7.639 5.403 1.00 1.25 C ATOM 1279 O GLU A 89 -8.656 7.452 6.618 1.00 22.24 O ATOM 1280 CB GLU A 89 -10.970 7.122 4.452 1.00 72.54 C ATOM 1281 CG GLU A 89 -11.649 7.145 5.820 1.00 60.12 C ATOM 1282 CD GLU A 89 -13.067 7.712 5.768 1.00 31.53 C ATOM 1283 OE1 GLU A 89 -13.229 8.876 5.344 1.00 61.25 O ATOM 1284 OE2 GLU A 89 -14.021 6.999 6.151 1.00 64.11 O ATOM 0 H GLU A 89 -9.899 5.041 5.703 1.00 0.40 H new ATOM 0 HA GLU A 89 -9.076 6.790 3.471 1.00 24.44 H new ATOM 0 HB2 GLU A 89 -11.045 8.114 4.007 1.00 72.54 H new ATOM 0 HB3 GLU A 89 -11.516 6.439 3.802 1.00 72.54 H new ATOM 0 HG2 GLU A 89 -11.682 6.132 6.221 1.00 60.12 H new ATOM 0 HG3 GLU A 89 -11.049 7.741 6.508 1.00 60.12 H new ATOM 1291 N THR A 90 -8.028 8.635 4.812 1.00 73.53 N ATOM 1292 CA THR A 90 -7.325 9.677 5.584 1.00 4.54 C ATOM 1293 C THR A 90 -7.879 11.069 5.245 1.00 40.43 C ATOM 1294 O THR A 90 -7.393 12.090 5.729 1.00 1.05 O ATOM 1295 CB THR A 90 -5.795 9.652 5.320 1.00 52.23 C ATOM 1296 OG1 THR A 90 -5.123 10.596 6.166 1.00 13.13 O ATOM 1297 CG2 THR A 90 -5.475 9.964 3.860 1.00 13.12 C ATOM 0 H THR A 90 -7.961 8.748 3.800 1.00 73.53 H new ATOM 0 HA THR A 90 -7.496 9.465 6.639 1.00 4.54 H new ATOM 0 HB THR A 90 -5.443 8.645 5.545 1.00 52.23 H new ATOM 0 HG1 THR A 90 -4.265 10.845 5.762 1.00 13.13 H new ATOM 0 HG21 THR A 90 -4.396 9.938 3.711 1.00 13.12 H new ATOM 0 HG22 THR A 90 -5.948 9.222 3.217 1.00 13.12 H new ATOM 0 HG23 THR A 90 -5.852 10.955 3.609 1.00 13.12 H new ATOM 1305 N GLY A 91 -8.917 11.089 4.410 1.00 3.05 N ATOM 1306 CA GLY A 91 -9.537 12.339 3.993 1.00 1.21 C ATOM 1307 C GLY A 91 -11.060 12.281 4.057 1.00 74.51 C ATOM 1308 O GLY A 91 -11.649 12.560 5.098 1.00 21.43 O ATOM 0 H GLY A 91 -9.344 10.253 4.011 1.00 3.05 H new ATOM 0 HA2 GLY A 91 -9.180 13.149 4.629 1.00 1.21 H new ATOM 0 HA3 GLY A 91 -9.227 12.573 2.975 1.00 1.21 H new ATOM 1312 N GLY A 92 -11.695 11.928 2.938 1.00 2.01 N ATOM 1313 CA GLY A 92 -13.151 11.799 2.902 1.00 11.32 C ATOM 1314 C GLY A 92 -13.738 11.929 1.496 1.00 63.44 C ATOM 1315 O GLY A 92 -14.419 12.913 1.184 1.00 41.42 O ATOM 0 H GLY A 92 -11.229 11.728 2.053 1.00 2.01 H new ATOM 0 HA2 GLY A 92 -13.433 10.831 3.317 1.00 11.32 H new ATOM 0 HA3 GLY A 92 -13.592 12.562 3.544 1.00 11.32 H new ATOM 1319 N GLY A 93 -13.496 10.925 0.653 1.00 64.45 N ATOM 1320 CA GLY A 93 -13.973 10.956 -0.730 1.00 12.13 C ATOM 1321 C GLY A 93 -13.028 11.692 -1.674 1.00 60.05 C ATOM 1322 O GLY A 93 -13.442 12.587 -2.410 1.00 21.20 O ATOM 0 H GLY A 93 -12.975 10.084 0.902 1.00 64.45 H new ATOM 0 HA2 GLY A 93 -14.107 9.934 -1.084 1.00 12.13 H new ATOM 0 HA3 GLY A 93 -14.952 11.435 -0.760 1.00 12.13 H new ATOM 1326 N ASP A 94 -11.761 11.295 -1.669 1.00 64.12 N ATOM 1327 CA ASP A 94 -10.723 11.979 -2.449 1.00 71.24 C ATOM 1328 C ASP A 94 -10.469 11.299 -3.809 1.00 32.45 C ATOM 1329 O ASP A 94 -11.073 10.273 -4.126 1.00 51.31 O ATOM 1330 CB ASP A 94 -9.434 12.033 -1.630 1.00 51.45 C ATOM 1331 CG ASP A 94 -9.653 12.700 -0.284 1.00 21.44 C ATOM 1332 OD1 ASP A 94 -9.562 13.943 -0.210 1.00 63.03 O ATOM 1333 OD2 ASP A 94 -9.937 11.981 0.698 1.00 74.04 O ATOM 0 H ASP A 94 -11.421 10.498 -1.131 1.00 64.12 H new ATOM 0 HA ASP A 94 -11.072 12.989 -2.664 1.00 71.24 H new ATOM 0 HB2 ASP A 94 -9.056 11.022 -1.478 1.00 51.45 H new ATOM 0 HB3 ASP A 94 -8.671 12.578 -2.187 1.00 51.45 H new ATOM 1338 N ASP A 95 -9.578 11.903 -4.607 1.00 54.53 N ATOM 1339 CA ASP A 95 -9.222 11.406 -5.950 1.00 53.23 C ATOM 1340 C ASP A 95 -10.423 11.453 -6.925 1.00 13.11 C ATOM 1341 O ASP A 95 -11.580 11.536 -6.512 1.00 32.22 O ATOM 1342 CB ASP A 95 -8.629 9.988 -5.871 1.00 42.53 C ATOM 1343 CG ASP A 95 -8.183 9.469 -7.230 1.00 3.04 C ATOM 1344 OD1 ASP A 95 -7.341 10.137 -7.875 1.00 42.41 O ATOM 1345 OD2 ASP A 95 -8.685 8.414 -7.666 1.00 21.42 O ATOM 0 H ASP A 95 -9.080 12.753 -4.342 1.00 54.53 H new ATOM 0 HA ASP A 95 -8.460 12.075 -6.350 1.00 53.23 H new ATOM 0 HB2 ASP A 95 -7.779 9.990 -5.189 1.00 42.53 H new ATOM 0 HB3 ASP A 95 -9.372 9.309 -5.452 1.00 42.53 H new ATOM 1350 N GLU A 96 -10.139 11.414 -8.228 1.00 70.22 N ATOM 1351 CA GLU A 96 -11.189 11.521 -9.254 1.00 62.43 C ATOM 1352 C GLU A 96 -11.551 10.148 -9.867 1.00 43.13 C ATOM 1353 O GLU A 96 -12.728 9.777 -9.889 1.00 14.24 O ATOM 1354 CB GLU A 96 -10.773 12.514 -10.349 1.00 53.12 C ATOM 1355 CG GLU A 96 -10.491 13.918 -9.830 1.00 65.23 C ATOM 1356 CD GLU A 96 -10.049 14.865 -10.931 1.00 41.51 C ATOM 1357 OE1 GLU A 96 -10.920 15.503 -11.560 1.00 60.23 O ATOM 1358 OE2 GLU A 96 -8.831 14.980 -11.175 1.00 35.24 O ATOM 0 H GLU A 96 -9.196 11.310 -8.601 1.00 70.22 H new ATOM 0 HA GLU A 96 -12.086 11.896 -8.761 1.00 62.43 H new ATOM 0 HB2 GLU A 96 -9.882 12.136 -10.850 1.00 53.12 H new ATOM 0 HB3 GLU A 96 -11.562 12.566 -11.099 1.00 53.12 H new ATOM 0 HG2 GLU A 96 -11.388 14.313 -9.353 1.00 65.23 H new ATOM 0 HG3 GLU A 96 -9.718 13.870 -9.063 1.00 65.23 H new ATOM 1365 N PRO A 97 -10.569 9.369 -10.390 1.00 33.32 N ATOM 1366 CA PRO A 97 -10.827 8.008 -10.902 1.00 63.01 C ATOM 1367 C PRO A 97 -11.028 6.968 -9.777 1.00 5.43 C ATOM 1368 O PRO A 97 -10.856 5.766 -9.995 1.00 60.42 O ATOM 1369 CB PRO A 97 -9.560 7.678 -11.726 1.00 74.34 C ATOM 1370 CG PRO A 97 -8.792 8.959 -11.809 1.00 34.35 C ATOM 1371 CD PRO A 97 -9.156 9.728 -10.572 1.00 41.23 C ATOM 0 HA PRO A 97 -11.750 7.970 -11.481 1.00 63.01 H new ATOM 0 HB2 PRO A 97 -8.971 6.898 -11.244 1.00 74.34 H new ATOM 0 HB3 PRO A 97 -9.822 7.312 -12.719 1.00 74.34 H new ATOM 0 HG2 PRO A 97 -7.719 8.771 -11.852 1.00 34.35 H new ATOM 0 HG3 PRO A 97 -9.054 9.516 -12.708 1.00 34.35 H new ATOM 0 HD2 PRO A 97 -8.548 9.435 -9.716 1.00 41.23 H new ATOM 0 HD3 PRO A 97 -9.022 10.801 -10.705 1.00 41.23 H new ATOM 1379 N ILE A 98 -11.415 7.433 -8.589 1.00 64.11 N ATOM 1380 CA ILE A 98 -11.685 6.549 -7.447 1.00 40.52 C ATOM 1381 C ILE A 98 -12.684 5.423 -7.799 1.00 34.01 C ATOM 1382 O ILE A 98 -12.550 4.294 -7.320 1.00 25.13 O ATOM 1383 CB ILE A 98 -12.219 7.368 -6.239 1.00 42.21 C ATOM 1384 CG1 ILE A 98 -12.470 6.455 -5.023 1.00 41.12 C ATOM 1385 CG2 ILE A 98 -13.487 8.134 -6.624 1.00 12.24 C ATOM 1386 CD1 ILE A 98 -12.927 7.200 -3.783 1.00 15.33 C ATOM 0 H ILE A 98 -11.550 8.424 -8.388 1.00 64.11 H new ATOM 0 HA ILE A 98 -10.739 6.079 -7.180 1.00 40.52 H new ATOM 0 HB ILE A 98 -11.458 8.095 -5.957 1.00 42.21 H new ATOM 0 HG12 ILE A 98 -13.222 5.712 -5.287 1.00 41.12 H new ATOM 0 HG13 ILE A 98 -11.553 5.912 -4.792 1.00 41.12 H new ATOM 0 HG21 ILE A 98 -13.845 8.701 -5.764 1.00 12.24 H new ATOM 0 HG22 ILE A 98 -13.264 8.818 -7.443 1.00 12.24 H new ATOM 0 HG23 ILE A 98 -14.256 7.429 -6.939 1.00 12.24 H new ATOM 0 HD11 ILE A 98 -13.083 6.491 -2.970 1.00 15.33 H new ATOM 0 HD12 ILE A 98 -12.166 7.924 -3.492 1.00 15.33 H new ATOM 0 HD13 ILE A 98 -13.861 7.721 -3.995 1.00 15.33 H new ATOM 1398 N ASP A 99 -13.674 5.724 -8.648 1.00 73.23 N ATOM 1399 CA ASP A 99 -14.692 4.732 -9.029 1.00 62.43 C ATOM 1400 C ASP A 99 -14.081 3.568 -9.854 1.00 44.44 C ATOM 1401 O ASP A 99 -14.268 2.403 -9.492 1.00 21.54 O ATOM 1402 CB ASP A 99 -15.851 5.402 -9.788 1.00 32.11 C ATOM 1403 CG ASP A 99 -16.444 6.567 -9.015 1.00 75.23 C ATOM 1404 OD1 ASP A 99 -17.271 6.330 -8.111 1.00 51.11 O ATOM 1405 OD2 ASP A 99 -16.086 7.726 -9.306 1.00 33.34 O ATOM 0 H ASP A 99 -13.793 6.639 -9.083 1.00 73.23 H new ATOM 0 HA ASP A 99 -15.091 4.301 -8.111 1.00 62.43 H new ATOM 0 HB2 ASP A 99 -15.494 5.754 -10.756 1.00 32.11 H new ATOM 0 HB3 ASP A 99 -16.629 4.664 -9.984 1.00 32.11 H new ATOM 1410 N PRO A 100 -13.360 3.847 -10.977 1.00 32.44 N ATOM 1411 CA PRO A 100 -12.599 2.812 -11.708 1.00 65.24 C ATOM 1412 C PRO A 100 -11.672 1.990 -10.795 1.00 13.35 C ATOM 1413 O PRO A 100 -11.625 0.761 -10.885 1.00 4.25 O ATOM 1414 CB PRO A 100 -11.770 3.623 -12.711 1.00 51.54 C ATOM 1415 CG PRO A 100 -12.572 4.853 -12.954 1.00 51.31 C ATOM 1416 CD PRO A 100 -13.270 5.160 -11.654 1.00 73.45 C ATOM 0 HA PRO A 100 -13.262 2.078 -12.166 1.00 65.24 H new ATOM 0 HB2 PRO A 100 -10.786 3.864 -12.309 1.00 51.54 H new ATOM 0 HB3 PRO A 100 -11.609 3.066 -13.634 1.00 51.54 H new ATOM 0 HG2 PRO A 100 -11.932 5.682 -13.258 1.00 51.31 H new ATOM 0 HG3 PRO A 100 -13.293 4.696 -13.756 1.00 51.31 H new ATOM 0 HD2 PRO A 100 -12.707 5.878 -11.058 1.00 73.45 H new ATOM 0 HD3 PRO A 100 -14.257 5.590 -11.823 1.00 73.45 H new ATOM 1424 N LEU A 101 -10.934 2.679 -9.921 1.00 32.31 N ATOM 1425 CA LEU A 101 -10.048 2.015 -8.951 1.00 44.33 C ATOM 1426 C LEU A 101 -10.820 0.997 -8.095 1.00 45.33 C ATOM 1427 O LEU A 101 -10.495 -0.193 -8.084 1.00 24.11 O ATOM 1428 CB LEU A 101 -9.363 3.058 -8.047 1.00 50.11 C ATOM 1429 CG LEU A 101 -8.056 3.672 -8.592 1.00 10.14 C ATOM 1430 CD1 LEU A 101 -8.236 4.213 -10.007 1.00 73.03 C ATOM 1431 CD2 LEU A 101 -7.553 4.774 -7.658 1.00 65.54 C ATOM 0 H LEU A 101 -10.930 3.697 -9.862 1.00 32.31 H new ATOM 0 HA LEU A 101 -9.285 1.475 -9.512 1.00 44.33 H new ATOM 0 HB2 LEU A 101 -10.070 3.866 -7.858 1.00 50.11 H new ATOM 0 HB3 LEU A 101 -9.149 2.591 -7.086 1.00 50.11 H new ATOM 0 HG LEU A 101 -7.310 2.878 -8.634 1.00 10.14 H new ATOM 0 HD11 LEU A 101 -7.295 4.637 -10.357 1.00 73.03 H new ATOM 0 HD12 LEU A 101 -8.538 3.403 -10.671 1.00 73.03 H new ATOM 0 HD13 LEU A 101 -9.004 4.986 -10.006 1.00 73.03 H new ATOM 0 HD21 LEU A 101 -6.631 5.196 -8.057 1.00 65.54 H new ATOM 0 HD22 LEU A 101 -8.307 5.557 -7.580 1.00 65.54 H new ATOM 0 HD23 LEU A 101 -7.362 4.355 -6.670 1.00 65.54 H new ATOM 1443 N LEU A 102 -11.851 1.470 -7.393 1.00 62.42 N ATOM 1444 CA LEU A 102 -12.686 0.597 -6.557 1.00 73.32 C ATOM 1445 C LEU A 102 -13.369 -0.496 -7.392 1.00 62.15 C ATOM 1446 O LEU A 102 -13.587 -1.607 -6.912 1.00 35.55 O ATOM 1447 CB LEU A 102 -13.740 1.420 -5.801 1.00 14.24 C ATOM 1448 CG LEU A 102 -13.180 2.445 -4.800 1.00 24.52 C ATOM 1449 CD1 LEU A 102 -14.315 3.205 -4.115 1.00 12.52 C ATOM 1450 CD2 LEU A 102 -12.282 1.762 -3.766 1.00 2.41 C ATOM 0 H LEU A 102 -12.130 2.451 -7.385 1.00 62.42 H new ATOM 0 HA LEU A 102 -12.031 0.110 -5.834 1.00 73.32 H new ATOM 0 HB2 LEU A 102 -14.356 1.947 -6.529 1.00 14.24 H new ATOM 0 HB3 LEU A 102 -14.396 0.734 -5.265 1.00 14.24 H new ATOM 0 HG LEU A 102 -12.573 3.163 -5.352 1.00 24.52 H new ATOM 0 HD11 LEU A 102 -13.898 3.925 -3.411 1.00 12.52 H new ATOM 0 HD12 LEU A 102 -14.905 3.731 -4.865 1.00 12.52 H new ATOM 0 HD13 LEU A 102 -14.953 2.502 -3.580 1.00 12.52 H new ATOM 0 HD21 LEU A 102 -11.898 2.507 -3.069 1.00 2.41 H new ATOM 0 HD22 LEU A 102 -12.859 1.017 -3.219 1.00 2.41 H new ATOM 0 HD23 LEU A 102 -11.449 1.275 -4.273 1.00 2.41 H new ATOM 1462 N SER A 103 -13.693 -0.178 -8.643 1.00 72.43 N ATOM 1463 CA SER A 103 -14.294 -1.156 -9.563 1.00 65.14 C ATOM 1464 C SER A 103 -13.337 -2.323 -9.830 1.00 32.35 C ATOM 1465 O SER A 103 -13.758 -3.474 -9.933 1.00 3.20 O ATOM 1466 CB SER A 103 -14.679 -0.494 -10.895 1.00 30.31 C ATOM 1467 OG SER A 103 -15.274 -1.428 -11.785 1.00 61.21 O ATOM 0 H SER A 103 -13.552 0.747 -9.048 1.00 72.43 H new ATOM 0 HA SER A 103 -15.195 -1.541 -9.084 1.00 65.14 H new ATOM 0 HB2 SER A 103 -15.373 0.326 -10.708 1.00 30.31 H new ATOM 0 HB3 SER A 103 -13.792 -0.062 -11.358 1.00 30.31 H new ATOM 0 HG SER A 103 -15.509 -0.977 -12.623 1.00 61.21 H new ATOM 1473 N LYS A 104 -12.042 -2.022 -9.931 1.00 33.34 N ATOM 1474 CA LYS A 104 -11.025 -3.057 -10.149 1.00 75.44 C ATOM 1475 C LYS A 104 -10.954 -4.022 -8.952 1.00 30.44 C ATOM 1476 O LYS A 104 -10.839 -5.236 -9.128 1.00 11.30 O ATOM 1477 CB LYS A 104 -9.653 -2.412 -10.406 1.00 21.44 C ATOM 1478 CG LYS A 104 -8.557 -3.402 -10.803 1.00 10.42 C ATOM 1479 CD LYS A 104 -8.926 -4.188 -12.064 1.00 50.12 C ATOM 1480 CE LYS A 104 -7.761 -5.026 -12.581 1.00 62.25 C ATOM 1481 NZ LYS A 104 -7.245 -5.969 -11.554 1.00 51.22 N ATOM 0 H LYS A 104 -11.671 -1.074 -9.866 1.00 33.34 H new ATOM 0 HA LYS A 104 -11.309 -3.634 -11.029 1.00 75.44 H new ATOM 0 HB2 LYS A 104 -9.757 -1.667 -11.195 1.00 21.44 H new ATOM 0 HB3 LYS A 104 -9.339 -1.882 -9.507 1.00 21.44 H new ATOM 0 HG2 LYS A 104 -7.625 -2.863 -10.971 1.00 10.42 H new ATOM 0 HG3 LYS A 104 -8.380 -4.096 -9.981 1.00 10.42 H new ATOM 0 HD2 LYS A 104 -9.773 -4.840 -11.849 1.00 50.12 H new ATOM 0 HD3 LYS A 104 -9.246 -3.495 -12.842 1.00 50.12 H new ATOM 0 HE2 LYS A 104 -8.082 -5.588 -13.458 1.00 62.25 H new ATOM 0 HE3 LYS A 104 -6.956 -4.366 -12.902 1.00 62.25 H new ATOM 0 HZ1 LYS A 104 -6.799 -6.783 -12.023 1.00 51.22 H new ATOM 0 HZ2 LYS A 104 -6.543 -5.484 -10.959 1.00 51.22 H new ATOM 0 HZ3 LYS A 104 -8.032 -6.300 -10.960 1.00 51.22 H new ATOM 1495 N PHE A 105 -11.025 -3.476 -7.737 1.00 54.42 N ATOM 1496 CA PHE A 105 -11.066 -4.302 -6.522 1.00 13.23 C ATOM 1497 C PHE A 105 -12.391 -5.082 -6.434 1.00 21.11 C ATOM 1498 O PHE A 105 -12.407 -6.274 -6.119 1.00 31.44 O ATOM 1499 CB PHE A 105 -10.903 -3.428 -5.268 1.00 32.23 C ATOM 1500 CG PHE A 105 -9.584 -2.697 -5.187 1.00 44.51 C ATOM 1501 CD1 PHE A 105 -8.426 -3.362 -4.810 1.00 52.44 C ATOM 1502 CD2 PHE A 105 -9.506 -1.340 -5.472 1.00 72.31 C ATOM 1503 CE1 PHE A 105 -7.220 -2.693 -4.724 1.00 71.31 C ATOM 1504 CE2 PHE A 105 -8.302 -0.668 -5.388 1.00 61.31 C ATOM 1505 CZ PHE A 105 -7.159 -1.344 -5.011 1.00 31.33 C ATOM 0 H PHE A 105 -11.055 -2.471 -7.565 1.00 54.42 H new ATOM 0 HA PHE A 105 -10.240 -5.011 -6.575 1.00 13.23 H new ATOM 0 HB2 PHE A 105 -11.712 -2.698 -5.241 1.00 32.23 H new ATOM 0 HB3 PHE A 105 -11.011 -4.057 -4.384 1.00 32.23 H new ATOM 0 HD1 PHE A 105 -8.468 -4.417 -4.581 1.00 52.44 H new ATOM 0 HD2 PHE A 105 -10.397 -0.804 -5.763 1.00 72.31 H new ATOM 0 HE1 PHE A 105 -6.326 -3.225 -4.433 1.00 71.31 H new ATOM 0 HE2 PHE A 105 -8.255 0.386 -5.617 1.00 61.31 H new ATOM 0 HZ PHE A 105 -6.218 -0.818 -4.941 1.00 31.33 H new ATOM 1515 N ARG A 106 -13.494 -4.393 -6.725 1.00 53.12 N ATOM 1516 CA ARG A 106 -14.842 -4.976 -6.660 1.00 2.15 C ATOM 1517 C ARG A 106 -15.029 -6.102 -7.694 1.00 62.43 C ATOM 1518 O ARG A 106 -15.662 -7.119 -7.411 1.00 41.55 O ATOM 1519 CB ARG A 106 -15.886 -3.871 -6.891 1.00 74.03 C ATOM 1520 CG ARG A 106 -17.334 -4.319 -6.704 1.00 63.53 C ATOM 1521 CD ARG A 106 -18.317 -3.193 -7.015 1.00 41.23 C ATOM 1522 NE ARG A 106 -19.703 -3.589 -6.769 1.00 3.53 N ATOM 1523 CZ ARG A 106 -20.739 -3.050 -7.353 1.00 13.24 C ATOM 1524 NH1 ARG A 106 -20.592 -2.115 -8.237 1.00 31.33 N ATOM 1525 NH2 ARG A 106 -21.931 -3.452 -7.059 1.00 13.31 N ATOM 0 H ARG A 106 -13.483 -3.415 -7.013 1.00 53.12 H new ATOM 0 HA ARG A 106 -14.975 -5.415 -5.671 1.00 2.15 H new ATOM 0 HB2 ARG A 106 -15.682 -3.047 -6.207 1.00 74.03 H new ATOM 0 HB3 ARG A 106 -15.767 -3.482 -7.902 1.00 74.03 H new ATOM 0 HG2 ARG A 106 -17.538 -5.170 -7.353 1.00 63.53 H new ATOM 0 HG3 ARG A 106 -17.481 -4.658 -5.678 1.00 63.53 H new ATOM 0 HD2 ARG A 106 -18.075 -2.323 -6.405 1.00 41.23 H new ATOM 0 HD3 ARG A 106 -18.206 -2.893 -8.057 1.00 41.23 H new ATOM 0 HE ARG A 106 -19.872 -4.337 -6.096 1.00 3.53 H new ATOM 0 HH11 ARG A 106 -19.657 -1.790 -8.485 1.00 31.33 H new ATOM 0 HH12 ARG A 106 -21.411 -1.703 -8.685 1.00 31.33 H new ATOM 0 HH21 ARG A 106 -22.064 -4.192 -6.369 1.00 13.31 H new ATOM 0 HH22 ARG A 106 -22.739 -3.030 -7.516 1.00 13.31 H new ATOM 1539 N ASN A 107 -14.474 -5.909 -8.890 1.00 11.52 N ATOM 1540 CA ASN A 107 -14.580 -6.897 -9.974 1.00 41.44 C ATOM 1541 C ASN A 107 -13.914 -8.227 -9.581 1.00 74.14 C ATOM 1542 O ASN A 107 -14.509 -9.297 -9.717 1.00 64.43 O ATOM 1543 CB ASN A 107 -13.947 -6.328 -11.256 1.00 51.41 C ATOM 1544 CG ASN A 107 -14.222 -7.168 -12.495 1.00 35.31 C ATOM 1545 OD1 ASN A 107 -14.301 -8.392 -12.442 1.00 10.13 O ATOM 1546 ND2 ASN A 107 -14.382 -6.509 -13.626 1.00 52.31 N ATOM 0 H ASN A 107 -13.943 -5.074 -9.138 1.00 11.52 H new ATOM 0 HA ASN A 107 -15.635 -7.101 -10.158 1.00 41.44 H new ATOM 0 HB2 ASN A 107 -14.324 -5.319 -11.420 1.00 51.41 H new ATOM 0 HB3 ASN A 107 -12.869 -6.247 -11.114 1.00 51.41 H new ATOM 0 HD21 ASN A 107 -14.577 -7.017 -14.489 1.00 52.31 H new ATOM 0 HD22 ASN A 107 -14.310 -5.492 -13.638 1.00 52.31 H new ATOM 1553 N LEU A 108 -12.678 -8.152 -9.092 1.00 33.11 N ATOM 1554 CA LEU A 108 -11.961 -9.346 -8.619 1.00 10.53 C ATOM 1555 C LEU A 108 -12.514 -9.824 -7.264 1.00 3.44 C ATOM 1556 O LEU A 108 -12.393 -10.997 -6.908 1.00 2.03 O ATOM 1557 CB LEU A 108 -10.451 -9.064 -8.496 1.00 54.31 C ATOM 1558 CG LEU A 108 -9.663 -8.992 -9.822 1.00 73.31 C ATOM 1559 CD1 LEU A 108 -10.197 -7.887 -10.732 1.00 45.54 C ATOM 1560 CD2 LEU A 108 -8.174 -8.791 -9.548 1.00 14.31 C ATOM 0 H LEU A 108 -12.149 -7.283 -9.011 1.00 33.11 H new ATOM 0 HA LEU A 108 -12.115 -10.135 -9.355 1.00 10.53 H new ATOM 0 HB2 LEU A 108 -10.320 -8.120 -7.968 1.00 54.31 H new ATOM 0 HB3 LEU A 108 -10.006 -9.841 -7.874 1.00 54.31 H new ATOM 0 HG LEU A 108 -9.798 -9.941 -10.341 1.00 73.31 H new ATOM 0 HD11 LEU A 108 -9.619 -7.865 -11.656 1.00 45.54 H new ATOM 0 HD12 LEU A 108 -11.244 -8.081 -10.964 1.00 45.54 H new ATOM 0 HD13 LEU A 108 -10.109 -6.925 -10.227 1.00 45.54 H new ATOM 0 HD21 LEU A 108 -7.633 -8.742 -10.493 1.00 14.31 H new ATOM 0 HD22 LEU A 108 -8.027 -7.861 -8.998 1.00 14.31 H new ATOM 0 HD23 LEU A 108 -7.797 -9.626 -8.957 1.00 14.31 H new ATOM 1572 N GLY A 109 -13.123 -8.906 -6.517 1.00 53.43 N ATOM 1573 CA GLY A 109 -13.662 -9.238 -5.202 1.00 52.21 C ATOM 1574 C GLY A 109 -12.588 -9.264 -4.121 1.00 4.23 C ATOM 1575 O GLY A 109 -12.560 -10.164 -3.279 1.00 62.25 O ATOM 0 H GLY A 109 -13.255 -7.934 -6.797 1.00 53.43 H new ATOM 0 HA2 GLY A 109 -14.427 -8.510 -4.932 1.00 52.21 H new ATOM 0 HA3 GLY A 109 -14.150 -10.211 -5.248 1.00 52.21 H new ATOM 1579 N LEU A 110 -11.703 -8.270 -4.142 1.00 54.33 N ATOM 1580 CA LEU A 110 -10.591 -8.195 -3.188 1.00 43.44 C ATOM 1581 C LEU A 110 -11.055 -7.712 -1.802 1.00 2.11 C ATOM 1582 O LEU A 110 -12.081 -7.044 -1.670 1.00 4.01 O ATOM 1583 CB LEU A 110 -9.483 -7.280 -3.733 1.00 22.13 C ATOM 1584 CG LEU A 110 -8.803 -7.776 -5.023 1.00 4.10 C ATOM 1585 CD1 LEU A 110 -7.752 -6.778 -5.504 1.00 42.03 C ATOM 1586 CD2 LEU A 110 -8.178 -9.154 -4.808 1.00 71.10 C ATOM 0 H LEU A 110 -11.732 -7.501 -4.811 1.00 54.33 H new ATOM 0 HA LEU A 110 -10.194 -9.203 -3.065 1.00 43.44 H new ATOM 0 HB2 LEU A 110 -9.907 -6.293 -3.920 1.00 22.13 H new ATOM 0 HB3 LEU A 110 -8.721 -7.159 -2.963 1.00 22.13 H new ATOM 0 HG LEU A 110 -9.567 -7.862 -5.796 1.00 4.10 H new ATOM 0 HD11 LEU A 110 -7.286 -7.151 -6.416 1.00 42.03 H new ATOM 0 HD12 LEU A 110 -8.227 -5.818 -5.706 1.00 42.03 H new ATOM 0 HD13 LEU A 110 -6.991 -6.651 -4.734 1.00 42.03 H new ATOM 0 HD21 LEU A 110 -7.703 -9.486 -5.731 1.00 71.10 H new ATOM 0 HD22 LEU A 110 -7.431 -9.095 -4.016 1.00 71.10 H new ATOM 0 HD23 LEU A 110 -8.954 -9.865 -4.523 1.00 71.10 H new ATOM 1598 N THR A 111 -10.282 -8.056 -0.776 1.00 64.42 N ATOM 1599 CA THR A 111 -10.645 -7.759 0.618 1.00 63.13 C ATOM 1600 C THR A 111 -10.641 -6.253 0.926 1.00 60.24 C ATOM 1601 O THR A 111 -9.586 -5.629 1.038 1.00 11.10 O ATOM 1602 CB THR A 111 -9.689 -8.473 1.604 1.00 65.02 C ATOM 1603 OG1 THR A 111 -9.698 -9.888 1.360 1.00 53.53 O ATOM 1604 CG2 THR A 111 -10.079 -8.202 3.056 1.00 44.13 C ATOM 0 H THR A 111 -9.393 -8.545 -0.879 1.00 64.42 H new ATOM 0 HA THR A 111 -11.662 -8.130 0.747 1.00 63.13 H new ATOM 0 HB THR A 111 -8.687 -8.078 1.440 1.00 65.02 H new ATOM 0 HG1 THR A 111 -9.089 -10.332 1.987 1.00 53.53 H new ATOM 0 HG21 THR A 111 -9.387 -8.718 3.721 1.00 44.13 H new ATOM 0 HG22 THR A 111 -10.037 -7.130 3.250 1.00 44.13 H new ATOM 0 HG23 THR A 111 -11.092 -8.564 3.234 1.00 44.13 H new ATOM 1612 N THR A 112 -11.827 -5.672 1.065 1.00 64.14 N ATOM 1613 CA THR A 112 -11.956 -4.264 1.451 1.00 34.51 C ATOM 1614 C THR A 112 -11.881 -4.099 2.978 1.00 61.34 C ATOM 1615 O THR A 112 -12.883 -4.257 3.679 1.00 5.41 O ATOM 1616 CB THR A 112 -13.282 -3.649 0.935 1.00 54.13 C ATOM 1617 OG1 THR A 112 -14.411 -4.365 1.468 1.00 2.13 O ATOM 1618 CG2 THR A 112 -13.339 -3.675 -0.590 1.00 11.43 C ATOM 0 H THR A 112 -12.716 -6.151 0.917 1.00 64.14 H new ATOM 0 HA THR A 112 -11.122 -3.734 0.991 1.00 34.51 H new ATOM 0 HB THR A 112 -13.320 -2.613 1.271 1.00 54.13 H new ATOM 0 HG1 THR A 112 -14.247 -4.581 2.410 1.00 2.13 H new ATOM 0 HG21 THR A 112 -14.279 -3.238 -0.926 1.00 11.43 H new ATOM 0 HG22 THR A 112 -12.506 -3.100 -0.995 1.00 11.43 H new ATOM 0 HG23 THR A 112 -13.272 -4.705 -0.939 1.00 11.43 H new ATOM 1626 N ALA A 113 -10.683 -3.803 3.492 1.00 61.40 N ATOM 1627 CA ALA A 113 -10.475 -3.637 4.941 1.00 22.13 C ATOM 1628 C ALA A 113 -11.447 -2.611 5.555 1.00 2.01 C ATOM 1629 O ALA A 113 -12.357 -2.978 6.296 1.00 33.50 O ATOM 1630 CB ALA A 113 -9.030 -3.239 5.225 1.00 73.43 C ATOM 0 H ALA A 113 -9.842 -3.673 2.930 1.00 61.40 H new ATOM 0 HA ALA A 113 -10.682 -4.598 5.412 1.00 22.13 H new ATOM 0 HB1 ALA A 113 -8.890 -3.120 6.299 1.00 73.43 H new ATOM 0 HB2 ALA A 113 -8.360 -4.015 4.856 1.00 73.43 H new ATOM 0 HB3 ALA A 113 -8.807 -2.298 4.723 1.00 73.43 H new ATOM 1636 N PHE A 114 -11.254 -1.329 5.246 1.00 3.20 N ATOM 1637 CA PHE A 114 -12.152 -0.271 5.730 1.00 5.44 C ATOM 1638 C PHE A 114 -12.697 0.569 4.561 1.00 3.43 C ATOM 1639 O PHE A 114 -12.077 1.549 4.144 1.00 42.20 O ATOM 1640 CB PHE A 114 -11.416 0.623 6.744 1.00 75.50 C ATOM 1641 CG PHE A 114 -12.277 1.701 7.361 1.00 43.33 C ATOM 1642 CD1 PHE A 114 -13.209 1.388 8.343 1.00 3.40 C ATOM 1643 CD2 PHE A 114 -12.151 3.028 6.964 1.00 53.25 C ATOM 1644 CE1 PHE A 114 -13.993 2.374 8.916 1.00 32.04 C ATOM 1645 CE2 PHE A 114 -12.935 4.014 7.533 1.00 74.24 C ATOM 1646 CZ PHE A 114 -13.857 3.688 8.508 1.00 74.43 C ATOM 0 H PHE A 114 -10.486 -0.994 4.664 1.00 3.20 H new ATOM 0 HA PHE A 114 -13.001 -0.741 6.227 1.00 5.44 H new ATOM 0 HB2 PHE A 114 -11.014 -0.004 7.539 1.00 75.50 H new ATOM 0 HB3 PHE A 114 -10.566 1.092 6.248 1.00 75.50 H new ATOM 0 HD1 PHE A 114 -13.323 0.363 8.663 1.00 3.40 H new ATOM 0 HD2 PHE A 114 -11.432 3.291 6.202 1.00 53.25 H new ATOM 0 HE1 PHE A 114 -14.711 2.117 9.681 1.00 32.04 H new ATOM 0 HE2 PHE A 114 -12.826 5.040 7.215 1.00 74.24 H new ATOM 0 HZ PHE A 114 -14.471 4.458 8.951 1.00 74.43 H new ATOM 1656 N PRO A 115 -13.847 0.168 3.986 1.00 14.33 N ATOM 1657 CA PRO A 115 -14.481 0.907 2.891 1.00 70.32 C ATOM 1658 C PRO A 115 -15.423 2.018 3.388 1.00 35.40 C ATOM 1659 O PRO A 115 -16.570 1.757 3.768 1.00 10.24 O ATOM 1660 CB PRO A 115 -15.257 -0.194 2.162 1.00 23.11 C ATOM 1661 CG PRO A 115 -15.657 -1.154 3.241 1.00 22.41 C ATOM 1662 CD PRO A 115 -14.613 -1.046 4.338 1.00 63.44 C ATOM 0 HA PRO A 115 -13.760 1.434 2.266 1.00 70.32 H new ATOM 0 HB2 PRO A 115 -16.129 0.210 1.648 1.00 23.11 H new ATOM 0 HB3 PRO A 115 -14.639 -0.681 1.407 1.00 23.11 H new ATOM 0 HG2 PRO A 115 -16.648 -0.911 3.626 1.00 22.41 H new ATOM 0 HG3 PRO A 115 -15.706 -2.172 2.854 1.00 22.41 H new ATOM 0 HD2 PRO A 115 -15.075 -0.955 5.321 1.00 63.44 H new ATOM 0 HD3 PRO A 115 -13.972 -1.927 4.367 1.00 63.44 H new ATOM 1670 N ALA A 116 -14.931 3.256 3.406 1.00 32.42 N ATOM 1671 CA ALA A 116 -15.732 4.399 3.855 1.00 21.23 C ATOM 1672 C ALA A 116 -15.113 5.739 3.427 1.00 23.25 C ATOM 1673 O ALA A 116 -13.926 5.818 3.105 1.00 52.21 O ATOM 1674 CB ALA A 116 -15.910 4.359 5.373 1.00 25.42 C ATOM 0 H ALA A 116 -13.983 3.495 3.116 1.00 32.42 H new ATOM 0 HA ALA A 116 -16.708 4.321 3.376 1.00 21.23 H new ATOM 0 HB1 ALA A 116 -16.507 5.214 5.692 1.00 25.42 H new ATOM 0 HB2 ALA A 116 -16.417 3.437 5.656 1.00 25.42 H new ATOM 0 HB3 ALA A 116 -14.933 4.398 5.855 1.00 25.42 H new ATOM 1680 N ILE A 117 -15.944 6.784 3.403 1.00 32.22 N ATOM 1681 CA ILE A 117 -15.488 8.153 3.116 1.00 73.11 C ATOM 1682 C ILE A 117 -16.174 9.162 4.059 1.00 73.13 C ATOM 1683 O ILE A 117 -16.426 10.312 3.689 1.00 5.15 O ATOM 1684 CB ILE A 117 -15.751 8.570 1.633 1.00 55.05 C ATOM 1685 CG1 ILE A 117 -17.261 8.593 1.294 1.00 12.22 C ATOM 1686 CG2 ILE A 117 -14.998 7.652 0.670 1.00 40.31 C ATOM 1687 CD1 ILE A 117 -17.910 7.226 1.183 1.00 72.25 C ATOM 0 H ILE A 117 -16.946 6.710 3.580 1.00 32.22 H new ATOM 0 HA ILE A 117 -14.411 8.164 3.282 1.00 73.11 H new ATOM 0 HB ILE A 117 -15.376 9.586 1.514 1.00 55.05 H new ATOM 0 HG12 ILE A 117 -17.782 9.166 2.061 1.00 12.22 H new ATOM 0 HG13 ILE A 117 -17.399 9.123 0.351 1.00 12.22 H new ATOM 0 HG21 ILE A 117 -15.196 7.961 -0.356 1.00 40.31 H new ATOM 0 HG22 ILE A 117 -13.928 7.716 0.868 1.00 40.31 H new ATOM 0 HG23 ILE A 117 -15.333 6.624 0.811 1.00 40.31 H new ATOM 0 HD11 ILE A 117 -18.967 7.343 0.943 1.00 72.25 H new ATOM 0 HD12 ILE A 117 -17.420 6.654 0.395 1.00 72.25 H new ATOM 0 HD13 ILE A 117 -17.810 6.698 2.131 1.00 72.25 H new ATOM 1699 N ARG A 118 -16.432 8.737 5.295 1.00 25.32 N ATOM 1700 CA ARG A 118 -17.240 9.525 6.240 1.00 12.11 C ATOM 1701 C ARG A 118 -16.396 10.370 7.214 1.00 74.41 C ATOM 1702 O ARG A 118 -16.883 10.785 8.272 1.00 24.15 O ATOM 1703 CB ARG A 118 -18.195 8.600 7.010 1.00 72.12 C ATOM 1704 CG ARG A 118 -19.433 8.204 6.206 1.00 11.54 C ATOM 1705 CD ARG A 118 -20.340 7.249 6.979 1.00 61.12 C ATOM 1706 NE ARG A 118 -19.790 5.894 7.043 1.00 12.23 N ATOM 1707 CZ ARG A 118 -19.659 5.200 8.141 1.00 12.14 C ATOM 1708 NH1 ARG A 118 -19.974 5.704 9.290 1.00 31.41 N ATOM 1709 NH2 ARG A 118 -19.212 3.991 8.083 1.00 23.53 N ATOM 0 H ARG A 118 -16.095 7.851 5.671 1.00 25.32 H new ATOM 0 HA ARG A 118 -17.814 10.237 5.647 1.00 12.11 H new ATOM 0 HB2 ARG A 118 -17.658 7.698 7.304 1.00 72.12 H new ATOM 0 HB3 ARG A 118 -18.510 9.097 7.928 1.00 72.12 H new ATOM 0 HG2 ARG A 118 -19.994 9.100 5.940 1.00 11.54 H new ATOM 0 HG3 ARG A 118 -19.123 7.733 5.273 1.00 11.54 H new ATOM 0 HD2 ARG A 118 -20.486 7.628 7.990 1.00 61.12 H new ATOM 0 HD3 ARG A 118 -21.321 7.219 6.505 1.00 61.12 H new ATOM 0 HE ARG A 118 -19.488 5.462 6.170 1.00 12.23 H new ATOM 0 HH11 ARG A 118 -20.331 6.658 9.348 1.00 31.41 H new ATOM 0 HH12 ARG A 118 -19.865 5.148 10.138 1.00 31.41 H new ATOM 0 HH21 ARG A 118 -18.963 3.582 7.182 1.00 23.53 H new ATOM 0 HH22 ARG A 118 -19.108 3.444 8.938 1.00 23.53 H new ATOM 1723 N ILE A 119 -15.140 10.631 6.861 1.00 72.12 N ATOM 1724 CA ILE A 119 -14.331 11.637 7.561 1.00 3.32 C ATOM 1725 C ILE A 119 -14.303 12.945 6.747 1.00 42.33 C ATOM 1726 O ILE A 119 -14.420 12.919 5.522 1.00 3.21 O ATOM 1727 CB ILE A 119 -12.879 11.137 7.814 1.00 53.23 C ATOM 1728 CG1 ILE A 119 -12.897 9.866 8.685 1.00 72.14 C ATOM 1729 CG2 ILE A 119 -12.027 12.228 8.471 1.00 41.34 C ATOM 1730 CD1 ILE A 119 -11.520 9.315 8.998 1.00 53.43 C ATOM 0 H ILE A 119 -14.656 10.162 6.095 1.00 72.12 H new ATOM 0 HA ILE A 119 -14.792 11.818 8.532 1.00 3.32 H new ATOM 0 HB ILE A 119 -12.429 10.896 6.851 1.00 53.23 H new ATOM 0 HG12 ILE A 119 -13.411 10.086 9.621 1.00 72.14 H new ATOM 0 HG13 ILE A 119 -13.478 9.097 8.176 1.00 72.14 H new ATOM 0 HG21 ILE A 119 -11.018 11.851 8.636 1.00 41.34 H new ATOM 0 HG22 ILE A 119 -11.987 13.100 7.819 1.00 41.34 H new ATOM 0 HG23 ILE A 119 -12.470 12.510 9.426 1.00 41.34 H new ATOM 0 HD11 ILE A 119 -11.617 8.421 9.614 1.00 53.43 H new ATOM 0 HD12 ILE A 119 -11.010 9.061 8.069 1.00 53.43 H new ATOM 0 HD13 ILE A 119 -10.941 10.066 9.536 1.00 53.43 H new ATOM 1742 N LYS A 120 -14.191 14.089 7.423 1.00 12.32 N ATOM 1743 CA LYS A 120 -14.123 15.387 6.737 1.00 32.45 C ATOM 1744 C LYS A 120 -12.925 15.454 5.773 1.00 61.41 C ATOM 1745 O LYS A 120 -13.100 15.527 4.556 1.00 14.01 O ATOM 1746 CB LYS A 120 -14.040 16.532 7.761 1.00 61.24 C ATOM 1747 CG LYS A 120 -13.926 17.924 7.138 1.00 51.33 C ATOM 1748 CD LYS A 120 -15.114 18.252 6.233 1.00 1.13 C ATOM 1749 CE LYS A 120 -15.007 19.654 5.638 1.00 1.12 C ATOM 1750 NZ LYS A 120 -13.821 19.808 4.752 1.00 63.11 N ATOM 0 H LYS A 120 -14.145 14.147 8.440 1.00 12.32 H new ATOM 0 HA LYS A 120 -15.035 15.498 6.150 1.00 32.45 H new ATOM 0 HB2 LYS A 120 -14.926 16.502 8.395 1.00 61.24 H new ATOM 0 HB3 LYS A 120 -13.179 16.364 8.408 1.00 61.24 H new ATOM 0 HG2 LYS A 120 -13.858 18.670 7.930 1.00 51.33 H new ATOM 0 HG3 LYS A 120 -13.004 17.987 6.561 1.00 51.33 H new ATOM 0 HD2 LYS A 120 -15.170 17.519 5.428 1.00 1.13 H new ATOM 0 HD3 LYS A 120 -16.039 18.170 6.804 1.00 1.13 H new ATOM 0 HE2 LYS A 120 -15.911 19.874 5.071 1.00 1.12 H new ATOM 0 HE3 LYS A 120 -14.951 20.384 6.445 1.00 1.12 H new ATOM 0 HZ1 LYS A 120 -13.857 20.735 4.281 1.00 63.11 H new ATOM 0 HZ2 LYS A 120 -12.952 19.742 5.320 1.00 63.11 H new ATOM 0 HZ3 LYS A 120 -13.823 19.055 4.035 1.00 63.11 H new ATOM 1764 N GLN A 121 -11.714 15.419 6.326 1.00 64.43 N ATOM 1765 CA GLN A 121 -10.488 15.533 5.524 1.00 20.21 C ATOM 1766 C GLN A 121 -9.229 15.396 6.398 1.00 64.42 C ATOM 1767 O GLN A 121 -8.170 14.993 5.923 1.00 51.44 O ATOM 1768 CB GLN A 121 -10.467 16.876 4.765 1.00 14.42 C ATOM 1769 CG GLN A 121 -9.261 17.073 3.844 1.00 44.10 C ATOM 1770 CD GLN A 121 -9.332 16.314 2.517 1.00 54.12 C ATOM 1771 OE1 GLN A 121 -8.777 16.759 1.519 1.00 41.25 O ATOM 1772 NE2 GLN A 121 -10.012 15.183 2.477 1.00 53.14 N ATOM 0 H GLN A 121 -11.551 15.313 7.327 1.00 64.43 H new ATOM 0 HA GLN A 121 -10.485 14.716 4.802 1.00 20.21 H new ATOM 0 HB2 GLN A 121 -11.377 16.956 4.171 1.00 14.42 H new ATOM 0 HB3 GLN A 121 -10.488 17.688 5.491 1.00 14.42 H new ATOM 0 HG2 GLN A 121 -9.154 18.137 3.632 1.00 44.10 H new ATOM 0 HG3 GLN A 121 -8.362 16.762 4.376 1.00 44.10 H new ATOM 0 HE21 GLN A 121 -10.466 14.831 3.320 1.00 53.14 H new ATOM 0 HE22 GLN A 121 -10.083 14.661 1.603 1.00 53.14 H new ATOM 1781 N THR A 122 -9.351 15.749 7.674 1.00 30.33 N ATOM 1782 CA THR A 122 -8.235 15.643 8.625 1.00 64.24 C ATOM 1783 C THR A 122 -8.204 14.271 9.321 1.00 0.41 C ATOM 1784 O THR A 122 -9.146 13.915 10.036 1.00 65.24 O ATOM 1785 CB THR A 122 -8.323 16.741 9.713 1.00 60.23 C ATOM 1786 OG1 THR A 122 -9.561 16.623 10.431 1.00 50.11 O ATOM 1787 CG2 THR A 122 -8.220 18.134 9.093 1.00 62.02 C ATOM 0 H THR A 122 -10.213 16.113 8.080 1.00 30.33 H new ATOM 0 HA THR A 122 -7.323 15.770 8.042 1.00 64.24 H new ATOM 0 HB THR A 122 -7.489 16.605 10.401 1.00 60.23 H new ATOM 0 HG1 THR A 122 -9.768 15.676 10.572 1.00 50.11 H new ATOM 0 HG21 THR A 122 -8.285 18.887 9.878 1.00 62.02 H new ATOM 0 HG22 THR A 122 -7.267 18.232 8.574 1.00 62.02 H new ATOM 0 HG23 THR A 122 -9.035 18.278 8.384 1.00 62.02 H new ATOM 1795 N PRO A 123 -7.123 13.483 9.129 1.00 20.33 N ATOM 1796 CA PRO A 123 -6.949 12.190 9.821 1.00 12.12 C ATOM 1797 C PRO A 123 -6.831 12.367 11.345 1.00 13.43 C ATOM 1798 O PRO A 123 -6.097 13.236 11.820 1.00 1.44 O ATOM 1799 CB PRO A 123 -5.641 11.633 9.229 1.00 75.45 C ATOM 1800 CG PRO A 123 -4.923 12.828 8.694 1.00 44.02 C ATOM 1801 CD PRO A 123 -5.994 13.778 8.228 1.00 2.52 C ATOM 0 HA PRO A 123 -7.802 11.527 9.676 1.00 12.12 H new ATOM 0 HB2 PRO A 123 -5.049 11.123 9.989 1.00 75.45 H new ATOM 0 HB3 PRO A 123 -5.841 10.907 8.441 1.00 75.45 H new ATOM 0 HG2 PRO A 123 -4.301 13.287 9.463 1.00 44.02 H new ATOM 0 HG3 PRO A 123 -4.262 12.551 7.873 1.00 44.02 H new ATOM 0 HD2 PRO A 123 -5.674 14.817 8.310 1.00 2.52 H new ATOM 0 HD3 PRO A 123 -6.257 13.607 7.184 1.00 2.52 H new ATOM 1809 N THR A 124 -7.545 11.540 12.107 1.00 60.34 N ATOM 1810 CA THR A 124 -7.634 11.719 13.566 1.00 2.31 C ATOM 1811 C THR A 124 -6.705 10.774 14.336 1.00 12.34 C ATOM 1812 O THR A 124 -6.146 9.824 13.785 1.00 53.32 O ATOM 1813 CB THR A 124 -9.077 11.489 14.084 1.00 40.42 C ATOM 1814 OG1 THR A 124 -9.404 10.090 14.035 1.00 11.55 O ATOM 1815 CG2 THR A 124 -10.092 12.280 13.263 1.00 64.41 C ATOM 0 H THR A 124 -8.069 10.743 11.747 1.00 60.34 H new ATOM 0 HA THR A 124 -7.327 12.749 13.745 1.00 2.31 H new ATOM 0 HB THR A 124 -9.121 11.838 15.116 1.00 40.42 H new ATOM 0 HG1 THR A 124 -9.134 9.721 13.168 1.00 11.55 H new ATOM 0 HG21 THR A 124 -11.094 12.098 13.650 1.00 64.41 H new ATOM 0 HG22 THR A 124 -9.865 13.344 13.330 1.00 64.41 H new ATOM 0 HG23 THR A 124 -10.043 11.964 12.221 1.00 64.41 H new ATOM 1823 N GLU A 125 -6.561 11.046 15.630 1.00 45.30 N ATOM 1824 CA GLU A 125 -5.802 10.185 16.541 1.00 44.03 C ATOM 1825 C GLU A 125 -6.396 8.766 16.584 1.00 61.13 C ATOM 1826 O GLU A 125 -5.686 7.780 16.789 1.00 43.41 O ATOM 1827 CB GLU A 125 -5.810 10.814 17.940 1.00 72.34 C ATOM 1828 CG GLU A 125 -7.212 10.944 18.537 1.00 74.14 C ATOM 1829 CD GLU A 125 -7.322 12.032 19.594 1.00 5.11 C ATOM 1830 OE1 GLU A 125 -6.310 12.330 20.267 1.00 22.54 O ATOM 1831 OE2 GLU A 125 -8.419 12.611 19.739 1.00 10.41 O ATOM 0 H GLU A 125 -6.965 11.868 16.079 1.00 45.30 H new ATOM 0 HA GLU A 125 -4.776 10.100 16.182 1.00 44.03 H new ATOM 0 HB2 GLU A 125 -5.194 10.210 18.606 1.00 72.34 H new ATOM 0 HB3 GLU A 125 -5.351 11.801 17.889 1.00 72.34 H new ATOM 0 HG2 GLU A 125 -7.921 11.153 17.736 1.00 74.14 H new ATOM 0 HG3 GLU A 125 -7.501 9.990 18.978 1.00 74.14 H new ATOM 1838 N ASN A 126 -7.708 8.678 16.371 1.00 73.32 N ATOM 1839 CA ASN A 126 -8.407 7.394 16.330 1.00 2.10 C ATOM 1840 C ASN A 126 -8.083 6.632 15.034 1.00 53.51 C ATOM 1841 O ASN A 126 -8.042 5.399 15.021 1.00 63.35 O ATOM 1842 CB ASN A 126 -9.919 7.619 16.452 1.00 53.11 C ATOM 1843 CG ASN A 126 -10.302 8.298 17.759 1.00 13.21 C ATOM 1844 OD1 ASN A 126 -9.669 8.095 18.791 1.00 15.03 O ATOM 1845 ND2 ASN A 126 -11.339 9.109 17.730 1.00 34.44 N ATOM 0 H ASN A 126 -8.312 9.487 16.223 1.00 73.32 H new ATOM 0 HA ASN A 126 -8.067 6.789 17.170 1.00 2.10 H new ATOM 0 HB2 ASN A 126 -10.261 8.228 15.616 1.00 53.11 H new ATOM 0 HB3 ASN A 126 -10.433 6.661 16.380 1.00 53.11 H new ATOM 0 HD21 ASN A 126 -11.636 9.588 18.580 1.00 34.44 H new ATOM 0 HD22 ASN A 126 -11.846 9.258 16.857 1.00 34.44 H new ATOM 1852 N THR A 127 -7.847 7.374 13.947 1.00 52.14 N ATOM 1853 CA THR A 127 -7.449 6.770 12.664 1.00 0.24 C ATOM 1854 C THR A 127 -6.185 5.909 12.827 1.00 11.14 C ATOM 1855 O THR A 127 -6.044 4.867 12.187 1.00 43.02 O ATOM 1856 CB THR A 127 -7.188 7.847 11.575 1.00 3.44 C ATOM 1857 OG1 THR A 127 -8.328 8.716 11.451 1.00 4.12 O ATOM 1858 CG2 THR A 127 -6.890 7.207 10.219 1.00 20.31 C ATOM 0 H THR A 127 -7.923 8.391 13.926 1.00 52.14 H new ATOM 0 HA THR A 127 -8.281 6.142 12.345 1.00 0.24 H new ATOM 0 HB THR A 127 -6.317 8.425 11.885 1.00 3.44 H new ATOM 0 HG1 THR A 127 -8.300 9.171 10.583 1.00 4.12 H new ATOM 0 HG21 THR A 127 -6.712 7.988 9.479 1.00 20.31 H new ATOM 0 HG22 THR A 127 -6.005 6.576 10.301 1.00 20.31 H new ATOM 0 HG23 THR A 127 -7.740 6.600 9.908 1.00 20.31 H new ATOM 1866 N TYR A 128 -5.276 6.352 13.700 1.00 12.32 N ATOM 1867 CA TYR A 128 -4.066 5.582 14.018 1.00 53.41 C ATOM 1868 C TYR A 128 -4.409 4.165 14.505 1.00 33.21 C ATOM 1869 O TYR A 128 -3.839 3.186 14.030 1.00 44.41 O ATOM 1870 CB TYR A 128 -3.225 6.304 15.084 1.00 3.23 C ATOM 1871 CG TYR A 128 -2.513 7.548 14.582 1.00 70.01 C ATOM 1872 CD1 TYR A 128 -3.140 8.788 14.589 1.00 71.31 C ATOM 1873 CD2 TYR A 128 -1.208 7.479 14.103 1.00 3.44 C ATOM 1874 CE1 TYR A 128 -2.489 9.921 14.138 1.00 1.31 C ATOM 1875 CE2 TYR A 128 -0.552 8.607 13.652 1.00 23.45 C ATOM 1876 CZ TYR A 128 -1.197 9.824 13.670 1.00 61.44 C ATOM 1877 OH TYR A 128 -0.547 10.953 13.222 1.00 73.35 O ATOM 0 H TYR A 128 -5.353 7.238 14.199 1.00 12.32 H new ATOM 0 HA TYR A 128 -3.487 5.499 13.098 1.00 53.41 H new ATOM 0 HB2 TYR A 128 -3.874 6.581 15.915 1.00 3.23 H new ATOM 0 HB3 TYR A 128 -2.483 5.609 15.477 1.00 3.23 H new ATOM 0 HD1 TYR A 128 -4.154 8.868 14.953 1.00 71.31 H new ATOM 0 HD2 TYR A 128 -0.700 6.526 14.084 1.00 3.44 H new ATOM 0 HE1 TYR A 128 -2.991 10.877 14.152 1.00 1.31 H new ATOM 0 HE2 TYR A 128 0.462 8.536 13.287 1.00 23.45 H new ATOM 0 HH TYR A 128 0.416 10.860 13.378 1.00 73.35 H new ATOM 1887 N LYS A 129 -5.348 4.059 15.449 1.00 0.45 N ATOM 1888 CA LYS A 129 -5.762 2.753 15.987 1.00 63.33 C ATOM 1889 C LYS A 129 -6.486 1.903 14.935 1.00 54.44 C ATOM 1890 O LYS A 129 -6.379 0.675 14.943 1.00 31.44 O ATOM 1891 CB LYS A 129 -6.640 2.924 17.239 1.00 21.11 C ATOM 1892 CG LYS A 129 -5.844 2.971 18.543 1.00 11.24 C ATOM 1893 CD LYS A 129 -4.867 4.145 18.589 1.00 70.41 C ATOM 1894 CE LYS A 129 -3.952 4.063 19.805 1.00 53.55 C ATOM 1895 NZ LYS A 129 -3.053 2.878 19.757 1.00 72.53 N ATOM 0 H LYS A 129 -5.836 4.856 15.857 1.00 0.45 H new ATOM 0 HA LYS A 129 -4.853 2.222 16.271 1.00 63.33 H new ATOM 0 HB2 LYS A 129 -7.219 3.842 17.144 1.00 21.11 H new ATOM 0 HB3 LYS A 129 -7.353 2.101 17.288 1.00 21.11 H new ATOM 0 HG2 LYS A 129 -6.534 3.043 19.384 1.00 11.24 H new ATOM 0 HG3 LYS A 129 -5.293 2.038 18.662 1.00 11.24 H new ATOM 0 HD2 LYS A 129 -4.266 4.155 17.680 1.00 70.41 H new ATOM 0 HD3 LYS A 129 -5.423 5.082 18.614 1.00 70.41 H new ATOM 0 HE2 LYS A 129 -3.351 4.970 19.866 1.00 53.55 H new ATOM 0 HE3 LYS A 129 -4.558 4.020 20.710 1.00 53.55 H new ATOM 0 HZ1 LYS A 129 -2.415 2.892 20.578 1.00 72.53 H new ATOM 0 HZ2 LYS A 129 -3.623 2.009 19.777 1.00 72.53 H new ATOM 0 HZ3 LYS A 129 -2.491 2.904 18.882 1.00 72.53 H new ATOM 1909 N LEU A 130 -7.218 2.558 14.037 1.00 75.13 N ATOM 1910 CA LEU A 130 -7.854 1.866 12.910 1.00 15.22 C ATOM 1911 C LEU A 130 -6.802 1.114 12.078 1.00 74.22 C ATOM 1912 O LEU A 130 -6.916 -0.091 11.841 1.00 20.50 O ATOM 1913 CB LEU A 130 -8.604 2.876 12.028 1.00 3.14 C ATOM 1914 CG LEU A 130 -9.288 2.291 10.779 1.00 5.04 C ATOM 1915 CD1 LEU A 130 -10.379 1.294 11.168 1.00 73.25 C ATOM 1916 CD2 LEU A 130 -9.858 3.406 9.906 1.00 31.25 C ATOM 0 H LEU A 130 -7.387 3.563 14.064 1.00 75.13 H new ATOM 0 HA LEU A 130 -8.567 1.141 13.303 1.00 15.22 H new ATOM 0 HB2 LEU A 130 -9.361 3.370 12.637 1.00 3.14 H new ATOM 0 HB3 LEU A 130 -7.900 3.645 11.708 1.00 3.14 H new ATOM 0 HG LEU A 130 -8.535 1.755 10.201 1.00 5.04 H new ATOM 0 HD11 LEU A 130 -10.846 0.896 10.267 1.00 73.25 H new ATOM 0 HD12 LEU A 130 -9.938 0.477 11.740 1.00 73.25 H new ATOM 0 HD13 LEU A 130 -11.132 1.797 11.775 1.00 73.25 H new ATOM 0 HD21 LEU A 130 -10.337 2.972 9.028 1.00 31.25 H new ATOM 0 HD22 LEU A 130 -10.592 3.975 10.476 1.00 31.25 H new ATOM 0 HD23 LEU A 130 -9.052 4.068 9.589 1.00 31.25 H new ATOM 1928 N CYS A 131 -5.770 1.840 11.653 1.00 64.32 N ATOM 1929 CA CYS A 131 -4.655 1.247 10.902 1.00 63.41 C ATOM 1930 C CYS A 131 -3.817 0.305 11.785 1.00 52.40 C ATOM 1931 O CYS A 131 -3.305 -0.712 11.316 1.00 54.10 O ATOM 1932 CB CYS A 131 -3.761 2.354 10.329 1.00 73.10 C ATOM 1933 SG CYS A 131 -4.614 3.491 9.215 1.00 20.53 S ATOM 0 H CYS A 131 -5.679 2.843 11.814 1.00 64.32 H new ATOM 0 HA CYS A 131 -5.077 0.659 10.087 1.00 63.41 H new ATOM 0 HB2 CYS A 131 -3.333 2.924 11.154 1.00 73.10 H new ATOM 0 HB3 CYS A 131 -2.930 1.894 9.794 1.00 73.10 H new ATOM 0 HG CYS A 131 -4.911 2.875 8.109 1.00 20.53 H new ATOM 1939 N GLU A 132 -3.696 0.653 13.064 1.00 72.31 N ATOM 1940 CA GLU A 132 -2.895 -0.115 14.030 1.00 63.42 C ATOM 1941 C GLU A 132 -3.381 -1.567 14.162 1.00 10.30 C ATOM 1942 O GLU A 132 -2.675 -2.505 13.786 1.00 24.02 O ATOM 1943 CB GLU A 132 -2.943 0.575 15.401 1.00 70.11 C ATOM 1944 CG GLU A 132 -2.158 -0.134 16.500 1.00 15.41 C ATOM 1945 CD GLU A 132 -2.226 0.605 17.828 1.00 51.24 C ATOM 1946 OE1 GLU A 132 -1.434 1.548 18.029 1.00 63.50 O ATOM 1947 OE2 GLU A 132 -3.084 0.261 18.672 1.00 73.43 O ATOM 0 H GLU A 132 -4.148 1.474 13.466 1.00 72.31 H new ATOM 0 HA GLU A 132 -1.870 -0.146 13.660 1.00 63.42 H new ATOM 0 HB2 GLU A 132 -2.558 1.589 15.296 1.00 70.11 H new ATOM 0 HB3 GLU A 132 -3.984 0.660 15.714 1.00 70.11 H new ATOM 0 HG2 GLU A 132 -2.548 -1.144 16.628 1.00 15.41 H new ATOM 0 HG3 GLU A 132 -1.116 -0.231 16.194 1.00 15.41 H new ATOM 1954 N GLU A 133 -4.588 -1.746 14.698 1.00 21.33 N ATOM 1955 CA GLU A 133 -5.135 -3.085 14.940 1.00 52.35 C ATOM 1956 C GLU A 133 -5.251 -3.892 13.638 1.00 62.33 C ATOM 1957 O GLU A 133 -4.836 -5.055 13.575 1.00 64.52 O ATOM 1958 CB GLU A 133 -6.506 -2.989 15.623 1.00 3.14 C ATOM 1959 CG GLU A 133 -7.130 -4.345 15.940 1.00 34.23 C ATOM 1960 CD GLU A 133 -8.459 -4.221 16.663 1.00 31.23 C ATOM 1961 OE1 GLU A 133 -8.463 -4.183 17.914 1.00 72.35 O ATOM 1962 OE2 GLU A 133 -9.507 -4.160 15.991 1.00 30.53 O ATOM 0 H GLU A 133 -5.207 -0.983 14.973 1.00 21.33 H new ATOM 0 HA GLU A 133 -4.443 -3.608 15.599 1.00 52.35 H new ATOM 0 HB2 GLU A 133 -6.402 -2.422 16.548 1.00 3.14 H new ATOM 0 HB3 GLU A 133 -7.184 -2.428 14.980 1.00 3.14 H new ATOM 0 HG2 GLU A 133 -7.275 -4.900 15.013 1.00 34.23 H new ATOM 0 HG3 GLU A 133 -6.440 -4.924 16.553 1.00 34.23 H new ATOM 1969 N ALA A 134 -5.805 -3.268 12.599 1.00 3.11 N ATOM 1970 CA ALA A 134 -5.950 -3.916 11.292 1.00 11.10 C ATOM 1971 C ALA A 134 -4.588 -4.354 10.727 1.00 72.10 C ATOM 1972 O ALA A 134 -4.409 -5.508 10.335 1.00 12.25 O ATOM 1973 CB ALA A 134 -6.656 -2.981 10.317 1.00 71.41 C ATOM 0 H ALA A 134 -6.162 -2.313 12.635 1.00 3.11 H new ATOM 0 HA ALA A 134 -6.556 -4.812 11.426 1.00 11.10 H new ATOM 0 HB1 ALA A 134 -6.758 -3.473 9.350 1.00 71.41 H new ATOM 0 HB2 ALA A 134 -7.644 -2.732 10.703 1.00 71.41 H new ATOM 0 HB3 ALA A 134 -6.071 -2.069 10.200 1.00 71.41 H new ATOM 1979 N GLY A 135 -3.631 -3.427 10.708 1.00 22.31 N ATOM 1980 CA GLY A 135 -2.293 -3.727 10.204 1.00 73.42 C ATOM 1981 C GLY A 135 -1.564 -4.791 11.019 1.00 21.34 C ATOM 1982 O GLY A 135 -0.843 -5.622 10.464 1.00 73.23 O ATOM 0 H GLY A 135 -3.756 -2.469 11.034 1.00 22.31 H new ATOM 0 HA2 GLY A 135 -2.369 -4.061 9.169 1.00 73.42 H new ATOM 0 HA3 GLY A 135 -1.700 -2.812 10.201 1.00 73.42 H new ATOM 1986 N THR A 136 -1.754 -4.768 12.340 1.00 22.21 N ATOM 1987 CA THR A 136 -1.134 -5.761 13.229 1.00 13.13 C ATOM 1988 C THR A 136 -1.639 -7.175 12.919 1.00 24.33 C ATOM 1989 O THR A 136 -0.854 -8.067 12.597 1.00 34.11 O ATOM 1990 CB THR A 136 -1.408 -5.453 14.728 1.00 52.40 C ATOM 1991 OG1 THR A 136 -0.856 -4.177 15.089 1.00 75.43 O ATOM 1992 CG2 THR A 136 -0.810 -6.532 15.634 1.00 53.35 C ATOM 0 H THR A 136 -2.330 -4.076 12.820 1.00 22.21 H new ATOM 0 HA THR A 136 -0.061 -5.705 13.047 1.00 13.13 H new ATOM 0 HB THR A 136 -2.489 -5.436 14.865 1.00 52.40 H new ATOM 0 HG1 THR A 136 -1.398 -3.462 14.694 1.00 75.43 H new ATOM 0 HG21 THR A 136 -1.018 -6.289 16.676 1.00 53.35 H new ATOM 0 HG22 THR A 136 -1.254 -7.498 15.391 1.00 53.35 H new ATOM 0 HG23 THR A 136 0.268 -6.579 15.481 1.00 53.35 H new ATOM 2000 N ASP A 137 -2.957 -7.371 13.002 1.00 53.24 N ATOM 2001 CA ASP A 137 -3.554 -8.690 12.770 1.00 2.34 C ATOM 2002 C ASP A 137 -3.314 -9.171 11.327 1.00 50.42 C ATOM 2003 O ASP A 137 -3.005 -10.341 11.102 1.00 74.24 O ATOM 2004 CB ASP A 137 -5.055 -8.657 13.089 1.00 64.10 C ATOM 2005 CG ASP A 137 -5.697 -10.036 13.021 1.00 43.33 C ATOM 2006 OD1 ASP A 137 -5.534 -10.823 13.982 1.00 63.15 O ATOM 2007 OD2 ASP A 137 -6.377 -10.335 12.020 1.00 70.43 O ATOM 0 H ASP A 137 -3.629 -6.637 13.227 1.00 53.24 H new ATOM 0 HA ASP A 137 -3.069 -9.402 13.438 1.00 2.34 H new ATOM 0 HB2 ASP A 137 -5.202 -8.240 14.085 1.00 64.10 H new ATOM 0 HB3 ASP A 137 -5.558 -7.991 12.388 1.00 64.10 H new ATOM 2012 N LEU A 138 -3.449 -8.259 10.356 1.00 44.11 N ATOM 2013 CA LEU A 138 -3.165 -8.577 8.946 1.00 61.12 C ATOM 2014 C LEU A 138 -1.704 -9.028 8.788 1.00 72.31 C ATOM 2015 O LEU A 138 -1.410 -10.004 8.093 1.00 54.20 O ATOM 2016 CB LEU A 138 -3.469 -7.349 8.056 1.00 42.03 C ATOM 2017 CG LEU A 138 -3.446 -7.576 6.524 1.00 53.15 C ATOM 2018 CD1 LEU A 138 -4.238 -6.478 5.812 1.00 40.10 C ATOM 2019 CD2 LEU A 138 -2.015 -7.617 5.983 1.00 61.31 C ATOM 0 H LEU A 138 -3.752 -7.298 10.517 1.00 44.11 H new ATOM 0 HA LEU A 138 -3.808 -9.397 8.626 1.00 61.12 H new ATOM 0 HB2 LEU A 138 -4.453 -6.967 8.328 1.00 42.03 H new ATOM 0 HB3 LEU A 138 -2.747 -6.569 8.295 1.00 42.03 H new ATOM 0 HG LEU A 138 -3.910 -8.542 6.328 1.00 53.15 H new ATOM 0 HD11 LEU A 138 -4.213 -6.651 4.736 1.00 40.10 H new ATOM 0 HD12 LEU A 138 -5.272 -6.492 6.158 1.00 40.10 H new ATOM 0 HD13 LEU A 138 -3.795 -5.507 6.034 1.00 40.10 H new ATOM 0 HD21 LEU A 138 -2.038 -7.778 4.905 1.00 61.31 H new ATOM 0 HD22 LEU A 138 -1.517 -6.671 6.198 1.00 61.31 H new ATOM 0 HD23 LEU A 138 -1.469 -8.431 6.460 1.00 61.31 H new ATOM 2031 N GLY A 139 -0.793 -8.317 9.448 1.00 12.01 N ATOM 2032 CA GLY A 139 0.611 -8.707 9.448 1.00 31.34 C ATOM 2033 C GLY A 139 0.830 -10.099 10.038 1.00 32.41 C ATOM 2034 O GLY A 139 1.551 -10.920 9.467 1.00 62.01 O ATOM 0 H GLY A 139 -1.001 -7.475 9.985 1.00 12.01 H new ATOM 0 HA2 GLY A 139 0.991 -8.685 8.427 1.00 31.34 H new ATOM 0 HA3 GLY A 139 1.187 -7.979 10.019 1.00 31.34 H new ATOM 2038 N GLN A 140 0.191 -10.366 11.179 1.00 62.03 N ATOM 2039 CA GLN A 140 0.277 -11.679 11.832 1.00 75.42 C ATOM 2040 C GLN A 140 -0.399 -12.769 10.980 1.00 4.52 C ATOM 2041 O GLN A 140 -0.021 -13.943 11.026 1.00 21.11 O ATOM 2042 CB GLN A 140 -0.365 -11.629 13.225 1.00 15.35 C ATOM 2043 CG GLN A 140 0.217 -10.554 14.138 1.00 11.03 C ATOM 2044 CD GLN A 140 -0.352 -10.592 15.546 1.00 50.23 C ATOM 2045 OE1 GLN A 140 -1.483 -11.012 15.768 1.00 72.21 O ATOM 2046 NE2 GLN A 140 0.430 -10.140 16.506 1.00 2.04 N ATOM 0 H GLN A 140 -0.393 -9.691 11.672 1.00 62.03 H new ATOM 0 HA GLN A 140 1.332 -11.931 11.936 1.00 75.42 H new ATOM 0 HB2 GLN A 140 -1.436 -11.457 13.114 1.00 15.35 H new ATOM 0 HB3 GLN A 140 -0.246 -12.601 13.704 1.00 15.35 H new ATOM 0 HG2 GLN A 140 1.299 -10.675 14.187 1.00 11.03 H new ATOM 0 HG3 GLN A 140 0.025 -9.574 13.702 1.00 11.03 H new ATOM 0 HE21 GLN A 140 1.365 -9.798 16.284 1.00 2.04 H new ATOM 0 HE22 GLN A 140 0.100 -10.132 17.471 1.00 2.04 H new ATOM 2055 N TRP A 141 -1.402 -12.366 10.210 1.00 2.51 N ATOM 2056 CA TRP A 141 -2.102 -13.265 9.290 1.00 35.23 C ATOM 2057 C TRP A 141 -1.153 -13.747 8.180 1.00 42.42 C ATOM 2058 O TRP A 141 -0.971 -14.949 7.980 1.00 30.45 O ATOM 2059 CB TRP A 141 -3.309 -12.526 8.683 1.00 24.33 C ATOM 2060 CG TRP A 141 -4.249 -13.389 7.883 1.00 64.32 C ATOM 2061 CD1 TRP A 141 -5.350 -14.050 8.350 1.00 13.11 C ATOM 2062 CD2 TRP A 141 -4.185 -13.666 6.476 1.00 50.22 C ATOM 2063 NE1 TRP A 141 -5.968 -14.723 7.323 1.00 34.13 N ATOM 2064 CE2 TRP A 141 -5.274 -14.501 6.164 1.00 70.12 C ATOM 2065 CE3 TRP A 141 -3.314 -13.288 5.452 1.00 45.40 C ATOM 2066 CZ2 TRP A 141 -5.513 -14.963 4.873 1.00 1.35 C ATOM 2067 CZ3 TRP A 141 -3.552 -13.747 4.171 1.00 51.31 C ATOM 2068 CH2 TRP A 141 -4.643 -14.578 3.890 1.00 54.41 C ATOM 0 H TRP A 141 -1.756 -11.409 10.203 1.00 2.51 H new ATOM 0 HA TRP A 141 -2.451 -14.141 9.837 1.00 35.23 H new ATOM 0 HB2 TRP A 141 -3.870 -12.055 9.490 1.00 24.33 H new ATOM 0 HB3 TRP A 141 -2.940 -11.725 8.042 1.00 24.33 H new ATOM 0 HD1 TRP A 141 -5.686 -14.044 9.376 1.00 13.11 H new ATOM 0 HE1 TRP A 141 -6.808 -15.295 7.410 1.00 34.13 H new ATOM 0 HE3 TRP A 141 -2.469 -12.648 5.658 1.00 45.40 H new ATOM 0 HZ2 TRP A 141 -6.355 -15.603 4.655 1.00 1.35 H new ATOM 0 HZ3 TRP A 141 -2.885 -13.460 3.372 1.00 51.31 H new ATOM 0 HH2 TRP A 141 -4.801 -14.922 2.878 1.00 54.41 H new ATOM 2079 N VAL A 142 -0.533 -12.793 7.482 1.00 70.25 N ATOM 2080 CA VAL A 142 0.356 -13.090 6.346 1.00 54.50 C ATOM 2081 C VAL A 142 1.639 -13.837 6.770 1.00 72.21 C ATOM 2082 O VAL A 142 2.015 -14.834 6.148 1.00 71.13 O ATOM 2083 CB VAL A 142 0.753 -11.792 5.592 1.00 3.14 C ATOM 2084 CG1 VAL A 142 1.658 -12.105 4.400 1.00 41.41 C ATOM 2085 CG2 VAL A 142 -0.489 -11.027 5.137 1.00 2.22 C ATOM 0 H VAL A 142 -0.629 -11.798 7.683 1.00 70.25 H new ATOM 0 HA VAL A 142 -0.214 -13.743 5.685 1.00 54.50 H new ATOM 0 HB VAL A 142 1.310 -11.161 6.284 1.00 3.14 H new ATOM 0 HG11 VAL A 142 1.921 -11.178 3.890 1.00 41.41 H new ATOM 0 HG12 VAL A 142 2.566 -12.596 4.751 1.00 41.41 H new ATOM 0 HG13 VAL A 142 1.133 -12.764 3.708 1.00 41.41 H new ATOM 0 HG21 VAL A 142 -0.186 -10.121 4.611 1.00 2.22 H new ATOM 0 HG22 VAL A 142 -1.078 -11.655 4.469 1.00 2.22 H new ATOM 0 HG23 VAL A 142 -1.090 -10.758 6.006 1.00 2.22 H new ATOM 2095 N THR A 143 2.303 -13.362 7.831 1.00 42.22 N ATOM 2096 CA THR A 143 3.583 -13.951 8.278 1.00 35.55 C ATOM 2097 C THR A 143 3.490 -15.467 8.505 1.00 45.12 C ATOM 2098 O THR A 143 4.454 -16.194 8.283 1.00 23.13 O ATOM 2099 CB THR A 143 4.114 -13.288 9.575 1.00 11.13 C ATOM 2100 OG1 THR A 143 5.301 -13.960 10.038 1.00 0.32 O ATOM 2101 CG2 THR A 143 3.069 -13.308 10.680 1.00 70.42 C ATOM 0 H THR A 143 1.982 -12.576 8.397 1.00 42.22 H new ATOM 0 HA THR A 143 4.281 -13.759 7.463 1.00 35.55 H new ATOM 0 HB THR A 143 4.349 -12.251 9.334 1.00 11.13 H new ATOM 0 HG1 THR A 143 5.713 -13.438 10.757 1.00 0.32 H new ATOM 0 HG21 THR A 143 3.476 -12.835 11.574 1.00 70.42 H new ATOM 0 HG22 THR A 143 2.183 -12.764 10.353 1.00 70.42 H new ATOM 0 HG23 THR A 143 2.798 -14.339 10.906 1.00 70.42 H new ATOM 2109 N ARG A 144 2.334 -15.941 8.956 1.00 72.24 N ATOM 2110 CA ARG A 144 2.115 -17.379 9.151 1.00 72.30 C ATOM 2111 C ARG A 144 1.334 -18.004 7.985 1.00 63.04 C ATOM 2112 O ARG A 144 1.363 -19.221 7.800 1.00 11.31 O ATOM 2113 CB ARG A 144 1.385 -17.640 10.480 1.00 44.32 C ATOM 2114 CG ARG A 144 2.312 -17.835 11.683 1.00 60.13 C ATOM 2115 CD ARG A 144 3.248 -16.653 11.914 1.00 70.22 C ATOM 2116 NE ARG A 144 4.000 -16.793 13.162 1.00 23.23 N ATOM 2117 CZ ARG A 144 4.900 -15.945 13.581 1.00 75.24 C ATOM 2118 NH1 ARG A 144 5.275 -14.949 12.842 1.00 71.51 N ATOM 2119 NH2 ARG A 144 5.449 -16.118 14.737 1.00 61.51 N ATOM 0 H ARG A 144 1.533 -15.356 9.194 1.00 72.24 H new ATOM 0 HA ARG A 144 3.096 -17.854 9.184 1.00 72.30 H new ATOM 0 HB2 ARG A 144 0.716 -16.804 10.684 1.00 44.32 H new ATOM 0 HB3 ARG A 144 0.761 -18.527 10.370 1.00 44.32 H new ATOM 0 HG2 ARG A 144 1.709 -17.994 12.577 1.00 60.13 H new ATOM 0 HG3 ARG A 144 2.905 -18.737 11.535 1.00 60.13 H new ATOM 0 HD2 ARG A 144 3.943 -16.570 11.078 1.00 70.22 H new ATOM 0 HD3 ARG A 144 2.669 -15.730 11.940 1.00 70.22 H new ATOM 0 HE ARG A 144 3.808 -17.608 13.744 1.00 23.23 H new ATOM 0 HH11 ARG A 144 4.866 -14.818 11.917 1.00 71.51 H new ATOM 0 HH12 ARG A 144 5.979 -14.296 13.185 1.00 71.51 H new ATOM 0 HH21 ARG A 144 5.179 -16.913 15.316 1.00 61.51 H new ATOM 0 HH22 ARG A 144 6.153 -15.460 15.071 1.00 61.51 H new ATOM 2133 N ASP A 145 0.642 -17.176 7.202 1.00 31.11 N ATOM 2134 CA ASP A 145 -0.164 -17.658 6.075 1.00 64.43 C ATOM 2135 C ASP A 145 0.673 -18.462 5.071 1.00 32.31 C ATOM 2136 O ASP A 145 0.432 -19.652 4.856 1.00 1.33 O ATOM 2137 CB ASP A 145 -0.844 -16.486 5.360 1.00 53.10 C ATOM 2138 CG ASP A 145 -1.634 -16.938 4.146 1.00 42.12 C ATOM 2139 OD1 ASP A 145 -2.720 -17.532 4.324 1.00 61.35 O ATOM 2140 OD2 ASP A 145 -1.164 -16.728 3.012 1.00 63.13 O ATOM 0 H ASP A 145 0.622 -16.164 7.327 1.00 31.11 H new ATOM 0 HA ASP A 145 -0.924 -18.323 6.487 1.00 64.43 H new ATOM 0 HB2 ASP A 145 -1.510 -15.975 6.055 1.00 53.10 H new ATOM 0 HB3 ASP A 145 -0.089 -15.763 5.052 1.00 53.10 H new ATOM 2145 N ARG A 146 1.660 -17.805 4.469 1.00 34.41 N ATOM 2146 CA ARG A 146 2.503 -18.431 3.443 1.00 34.54 C ATOM 2147 C ARG A 146 3.256 -19.661 3.986 1.00 12.23 C ATOM 2148 O ARG A 146 3.749 -20.491 3.218 1.00 71.23 O ATOM 2149 CB ARG A 146 3.491 -17.394 2.880 1.00 32.40 C ATOM 2150 CG ARG A 146 2.799 -16.194 2.227 1.00 45.33 C ATOM 2151 CD ARG A 146 3.790 -15.133 1.749 1.00 72.14 C ATOM 2152 NE ARG A 146 4.659 -15.617 0.676 1.00 1.43 N ATOM 2153 CZ ARG A 146 5.420 -14.843 -0.053 1.00 33.12 C ATOM 2154 NH1 ARG A 146 5.417 -13.558 0.114 1.00 21.50 N ATOM 2155 NH2 ARG A 146 6.175 -15.351 -0.965 1.00 51.11 N ATOM 0 H ARG A 146 1.900 -16.835 4.672 1.00 34.41 H new ATOM 0 HA ARG A 146 1.853 -18.784 2.642 1.00 34.54 H new ATOM 0 HB2 ARG A 146 4.134 -17.040 3.685 1.00 32.40 H new ATOM 0 HB3 ARG A 146 4.136 -17.877 2.146 1.00 32.40 H new ATOM 0 HG2 ARG A 146 2.205 -16.538 1.381 1.00 45.33 H new ATOM 0 HG3 ARG A 146 2.108 -15.745 2.940 1.00 45.33 H new ATOM 0 HD2 ARG A 146 3.240 -14.259 1.400 1.00 72.14 H new ATOM 0 HD3 ARG A 146 4.403 -14.809 2.590 1.00 72.14 H new ATOM 0 HE ARG A 146 4.672 -16.619 0.485 1.00 1.43 H new ATOM 0 HH11 ARG A 146 4.815 -13.137 0.822 1.00 21.50 H new ATOM 0 HH12 ARG A 146 6.016 -12.967 -0.463 1.00 21.50 H new ATOM 0 HH21 ARG A 146 6.180 -16.359 -1.120 1.00 51.11 H new ATOM 0 HH22 ARG A 146 6.768 -14.745 -1.532 1.00 51.11 H new ATOM 2169 N LEU A 147 3.328 -19.779 5.310 1.00 20.51 N ATOM 2170 CA LEU A 147 4.008 -20.907 5.956 1.00 44.54 C ATOM 2171 C LEU A 147 3.054 -22.089 6.206 1.00 51.00 C ATOM 2172 O LEU A 147 3.370 -23.228 5.863 1.00 71.02 O ATOM 2173 CB LEU A 147 4.654 -20.460 7.280 1.00 31.02 C ATOM 2174 CG LEU A 147 5.949 -19.634 7.146 1.00 12.01 C ATOM 2175 CD1 LEU A 147 7.027 -20.437 6.422 1.00 62.24 C ATOM 2176 CD2 LEU A 147 5.694 -18.309 6.428 1.00 61.43 C ATOM 0 H LEU A 147 2.923 -19.106 5.961 1.00 20.51 H new ATOM 0 HA LEU A 147 4.786 -21.249 5.274 1.00 44.54 H new ATOM 0 HB2 LEU A 147 3.926 -19.872 7.838 1.00 31.02 H new ATOM 0 HB3 LEU A 147 4.871 -21.347 7.875 1.00 31.02 H new ATOM 0 HG LEU A 147 6.302 -19.405 8.152 1.00 12.01 H new ATOM 0 HD11 LEU A 147 7.933 -19.837 6.338 1.00 62.24 H new ATOM 0 HD12 LEU A 147 7.244 -21.345 6.985 1.00 62.24 H new ATOM 0 HD13 LEU A 147 6.674 -20.704 5.426 1.00 62.24 H new ATOM 0 HD21 LEU A 147 6.628 -17.752 6.350 1.00 61.43 H new ATOM 0 HD22 LEU A 147 5.305 -18.506 5.429 1.00 61.43 H new ATOM 0 HD23 LEU A 147 4.968 -17.724 6.992 1.00 61.43 H new