USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 106 SER OG : rot -36:sc= 0.93 USER MOD Set 1.2: A 118 ASN : amide:sc= 0.813 X(o=1.7,f=1.3) USER MOD Set 2.1: A 89 HIS : no HE2:sc= -4.25! C(o=-3.7!,f=-7.2!) USER MOD Set 2.2: A 110 THR OG1 : rot -35:sc= 0.535 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 164:sc= 1.27 (180deg=0.833) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= -0.19 K(o=-0.19,f=-5.3!) USER MOD Single : A 5 ASN :FLIP amide:sc= -0.374 F(o=-1.9,f=-0.37) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0139) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 71:sc= 1.34 USER MOD Single : A 29 SER OG : rot 41:sc= 0.856 USER MOD Single : A 30 THR OG1 : rot 92:sc= 1.21 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0.218 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -172:sc=-0.00437 (180deg=-0.105) USER MOD Single : A 56 ASN : amide:sc= 0.0129 K(o=0.013,f=-8.5!) USER MOD Single : A 65 GLN : amide:sc=-0.00624 X(o=-0.0062,f=-0.34) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 166:sc= 0.0894 USER MOD Single : A 73 HIS : no HE2:sc= 0.314 K(o=0.31,f=-5.1!) USER MOD Single : A 76 SER OG : rot 108:sc= 0.116 USER MOD Single : A 84 THR OG1 : rot 149:sc= 0.0826 USER MOD Single : A 86 SER OG : rot -120:sc= 0 USER MOD Single : A 95 ASN : amide:sc= 0.874 K(o=0.87,f=-1.4) USER MOD Single : A 108 ASN : amide:sc= -1.52! C(o=-1.5!,f=-5.4!) USER MOD Single : A 111 TYR OH : rot 30:sc= -0.323 USER MOD Single : A 113 ASN : amide:sc= 0.983 K(o=0.98,f=-3!) USER MOD Single : A 120 GLN : amide:sc=-0.00572 K(o=-0.0057,f=-1.1) USER MOD Single : A 122 MET CE :methyl -119:sc= -1.21 (180deg=-3.25!) USER MOD Single : A 123 GLN : amide:sc=-0.00873 X(o=-0.0087,f=-0.39) USER MOD Single : A 124 THR OG1 : rot 180:sc= -0.255 USER MOD Single : A 129 GLN : amide:sc= 0.0424 X(o=0.042,f=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 26.833 17.796 -17.834 1.00 11.00 N ATOM 2 CA MET A 1 27.013 18.383 -16.517 1.00 43.05 C ATOM 3 C MET A 1 26.688 17.339 -15.471 1.00 1.33 C ATOM 4 O MET A 1 25.523 17.123 -15.123 1.00 73.21 O ATOM 5 CB MET A 1 26.142 19.645 -16.326 1.00 10.40 C ATOM 6 CG MET A 1 26.512 20.828 -17.224 1.00 0.10 C ATOM 7 SD MET A 1 26.272 20.499 -18.987 1.00 63.25 S ATOM 8 CE MET A 1 26.814 22.057 -19.694 1.00 13.41 C ATOM 0 H1 MET A 1 26.785 18.551 -18.547 1.00 11.00 H new ATOM 0 H2 MET A 1 27.635 17.169 -18.047 1.00 11.00 H new ATOM 0 H3 MET A 1 25.950 17.247 -17.852 1.00 11.00 H new ATOM 0 HA MET A 1 28.050 18.702 -16.412 1.00 43.05 H new ATOM 0 HB2 MET A 1 25.101 19.381 -16.510 1.00 10.40 H new ATOM 0 HB3 MET A 1 26.212 19.962 -15.286 1.00 10.40 H new ATOM 0 HG2 MET A 1 25.912 21.692 -16.939 1.00 0.10 H new ATOM 0 HG3 MET A 1 27.555 21.093 -17.051 1.00 0.10 H new ATOM 0 HE1 MET A 1 26.726 22.014 -20.780 1.00 13.41 H new ATOM 0 HE2 MET A 1 26.192 22.866 -19.312 1.00 13.41 H new ATOM 0 HE3 MET A 1 27.853 22.239 -19.421 1.00 13.41 H new ATOM 20 N SER A 2 27.704 16.659 -15.009 1.00 74.05 N ATOM 21 CA SER A 2 27.533 15.568 -14.094 1.00 22.25 C ATOM 22 C SER A 2 27.437 16.051 -12.656 1.00 43.14 C ATOM 23 O SER A 2 28.202 16.929 -12.219 1.00 23.33 O ATOM 24 CB SER A 2 28.693 14.596 -14.256 1.00 72.15 C ATOM 25 OG SER A 2 28.822 14.222 -15.619 1.00 62.00 O ATOM 0 H SER A 2 28.675 16.849 -15.259 1.00 74.05 H new ATOM 0 HA SER A 2 26.595 15.064 -14.325 1.00 22.25 H new ATOM 0 HB2 SER A 2 29.617 15.057 -13.907 1.00 72.15 H new ATOM 0 HB3 SER A 2 28.526 13.711 -13.641 1.00 72.15 H new ATOM 0 HG SER A 2 29.571 13.598 -15.717 1.00 62.00 H new ATOM 31 N ASP A 3 26.502 15.481 -11.934 1.00 10.34 N ATOM 32 CA ASP A 3 26.309 15.788 -10.538 1.00 32.13 C ATOM 33 C ASP A 3 27.327 15.054 -9.721 1.00 62.12 C ATOM 34 O ASP A 3 27.210 13.842 -9.495 1.00 44.45 O ATOM 35 CB ASP A 3 24.907 15.404 -10.040 1.00 41.23 C ATOM 36 CG ASP A 3 23.804 16.299 -10.532 1.00 22.52 C ATOM 37 OD1 ASP A 3 23.547 17.339 -9.894 1.00 61.00 O ATOM 38 OD2 ASP A 3 23.139 15.963 -11.540 1.00 43.44 O ATOM 0 H ASP A 3 25.850 14.787 -12.301 1.00 10.34 H new ATOM 0 HA ASP A 3 26.421 16.867 -10.427 1.00 32.13 H new ATOM 0 HB2 ASP A 3 24.693 14.381 -10.349 1.00 41.23 H new ATOM 0 HB3 ASP A 3 24.907 15.414 -8.950 1.00 41.23 H new ATOM 43 N ASN A 4 28.326 15.752 -9.301 1.00 14.34 N ATOM 44 CA ASN A 4 29.375 15.183 -8.494 1.00 63.43 C ATOM 45 C ASN A 4 29.527 16.093 -7.297 1.00 41.52 C ATOM 46 O ASN A 4 29.387 17.307 -7.436 1.00 22.14 O ATOM 47 CB ASN A 4 30.686 15.112 -9.313 1.00 51.13 C ATOM 48 CG ASN A 4 31.797 14.292 -8.654 1.00 43.33 C ATOM 49 OD1 ASN A 4 31.894 14.190 -7.433 1.00 32.15 O ATOM 50 ND2 ASN A 4 32.645 13.708 -9.462 1.00 63.52 N ATOM 0 H ASN A 4 28.448 16.744 -9.505 1.00 14.34 H new ATOM 0 HA ASN A 4 29.140 14.167 -8.176 1.00 63.43 H new ATOM 0 HB2 ASN A 4 30.467 14.684 -10.291 1.00 51.13 H new ATOM 0 HB3 ASN A 4 31.050 16.125 -9.482 1.00 51.13 H new ATOM 0 HD21 ASN A 4 33.410 13.151 -9.082 1.00 63.52 H new ATOM 0 HD22 ASN A 4 32.540 13.810 -10.471 1.00 63.52 H new ATOM 57 N ASN A 5 29.775 15.542 -6.141 1.00 43.12 N ATOM 58 CA ASN A 5 29.879 16.349 -4.941 1.00 55.44 C ATOM 59 C ASN A 5 30.882 15.735 -3.996 1.00 51.31 C ATOM 60 O ASN A 5 31.348 14.617 -4.235 1.00 52.34 O ATOM 61 CB ASN A 5 28.514 16.582 -4.220 1.00 22.43 C ATOM 62 CG ASN A 5 27.889 15.349 -3.530 1.00 74.23 C ATOM 63 OD1 ASN A 5 27.902 14.212 -4.164 1.00 21.40 O flip ATOM 64 ND2 ASN A 5 27.308 15.470 -2.453 1.00 24.44 N flip ATOM 0 H ASN A 5 29.910 14.541 -5.997 1.00 43.12 H new ATOM 0 HA ASN A 5 30.220 17.335 -5.257 1.00 55.44 H new ATOM 0 HB2 ASN A 5 28.651 17.362 -3.471 1.00 22.43 H new ATOM 0 HB3 ASN A 5 27.801 16.964 -4.951 1.00 22.43 H new ATOM 0 HD21 ASN A 5 27.309 16.369 -1.971 1.00 24.44 H new ATOM 0 HD22 ASN A 5 26.825 14.671 -2.041 1.00 24.44 H new ATOM 71 N GLY A 6 31.214 16.452 -2.939 1.00 33.34 N ATOM 72 CA GLY A 6 32.188 15.973 -1.986 1.00 21.45 C ATOM 73 C GLY A 6 31.673 14.830 -1.158 1.00 53.12 C ATOM 74 O GLY A 6 32.096 13.689 -1.330 1.00 75.51 O ATOM 0 H GLY A 6 30.822 17.368 -2.722 1.00 33.34 H new ATOM 0 HA2 GLY A 6 33.085 15.656 -2.517 1.00 21.45 H new ATOM 0 HA3 GLY A 6 32.479 16.791 -1.328 1.00 21.45 H new ATOM 78 N THR A 7 30.768 15.109 -0.286 1.00 21.31 N ATOM 79 CA THR A 7 30.231 14.098 0.557 1.00 13.21 C ATOM 80 C THR A 7 28.713 14.128 0.515 1.00 41.12 C ATOM 81 O THR A 7 28.095 15.106 0.950 1.00 31.13 O ATOM 82 CB THR A 7 30.743 14.273 2.005 1.00 74.50 C ATOM 83 OG1 THR A 7 32.186 14.210 2.004 1.00 12.10 O ATOM 84 CG2 THR A 7 30.190 13.189 2.925 1.00 24.14 C ATOM 0 H THR A 7 30.380 16.041 -0.137 1.00 21.31 H new ATOM 0 HA THR A 7 30.565 13.126 0.193 1.00 13.21 H new ATOM 0 HB THR A 7 30.403 15.239 2.377 1.00 74.50 H new ATOM 0 HG1 THR A 7 32.519 14.322 2.919 1.00 12.10 H new ATOM 0 HG21 THR A 7 30.569 13.341 3.935 1.00 24.14 H new ATOM 0 HG22 THR A 7 29.101 13.240 2.935 1.00 24.14 H new ATOM 0 HG23 THR A 7 30.504 12.210 2.563 1.00 24.14 H new ATOM 92 N PRO A 8 28.087 13.100 -0.077 1.00 11.42 N ATOM 93 CA PRO A 8 26.643 12.976 -0.053 1.00 64.43 C ATOM 94 C PRO A 8 26.189 12.702 1.374 1.00 32.25 C ATOM 95 O PRO A 8 26.750 11.840 2.060 1.00 62.44 O ATOM 96 CB PRO A 8 26.357 11.750 -0.936 1.00 64.31 C ATOM 97 CG PRO A 8 27.617 11.498 -1.691 1.00 32.33 C ATOM 98 CD PRO A 8 28.728 12.007 -0.826 1.00 14.54 C ATOM 0 HA PRO A 8 26.129 13.872 -0.401 1.00 64.43 H new ATOM 0 HB2 PRO A 8 26.083 10.886 -0.330 1.00 64.31 H new ATOM 0 HB3 PRO A 8 25.525 11.941 -1.614 1.00 64.31 H new ATOM 0 HG2 PRO A 8 27.741 10.435 -1.899 1.00 32.33 H new ATOM 0 HG3 PRO A 8 27.605 12.012 -2.652 1.00 32.33 H new ATOM 0 HD2 PRO A 8 29.110 11.232 -0.162 1.00 14.54 H new ATOM 0 HD3 PRO A 8 29.571 12.363 -1.419 1.00 14.54 H new ATOM 106 N GLU A 9 25.217 13.423 1.820 1.00 53.33 N ATOM 107 CA GLU A 9 24.706 13.262 3.157 1.00 51.10 C ATOM 108 C GLU A 9 23.321 12.673 3.080 1.00 25.15 C ATOM 109 O GLU A 9 22.658 12.836 2.047 1.00 13.41 O ATOM 110 CB GLU A 9 24.637 14.607 3.885 1.00 55.32 C ATOM 111 CG GLU A 9 25.955 15.346 4.005 1.00 43.43 C ATOM 112 CD GLU A 9 25.808 16.611 4.806 1.00 75.51 C ATOM 113 OE1 GLU A 9 25.257 17.598 4.288 1.00 15.33 O ATOM 114 OE2 GLU A 9 26.234 16.638 5.982 1.00 62.41 O ATOM 0 H GLU A 9 24.747 14.145 1.274 1.00 53.33 H new ATOM 0 HA GLU A 9 25.375 12.603 3.710 1.00 51.10 H new ATOM 0 HB2 GLU A 9 23.926 15.248 3.364 1.00 55.32 H new ATOM 0 HB3 GLU A 9 24.240 14.440 4.886 1.00 55.32 H new ATOM 0 HG2 GLU A 9 26.694 14.699 4.477 1.00 43.43 H new ATOM 0 HG3 GLU A 9 26.331 15.586 3.010 1.00 43.43 H new ATOM 121 N PRO A 10 22.898 11.883 4.100 1.00 54.21 N ATOM 122 CA PRO A 10 21.511 11.428 4.210 1.00 2.10 C ATOM 123 C PRO A 10 20.602 12.639 4.021 1.00 4.55 C ATOM 124 O PRO A 10 20.703 13.632 4.776 1.00 14.20 O ATOM 125 CB PRO A 10 21.428 10.919 5.651 1.00 5.31 C ATOM 126 CG PRO A 10 22.810 10.460 5.967 1.00 40.41 C ATOM 127 CD PRO A 10 23.742 11.360 5.197 1.00 32.10 C ATOM 0 HA PRO A 10 21.219 10.671 3.482 1.00 2.10 H new ATOM 0 HB2 PRO A 10 21.106 11.707 6.332 1.00 5.31 H new ATOM 0 HB3 PRO A 10 20.709 10.105 5.743 1.00 5.31 H new ATOM 0 HG2 PRO A 10 23.005 10.523 7.038 1.00 40.41 H new ATOM 0 HG3 PRO A 10 22.949 9.418 5.678 1.00 40.41 H new ATOM 0 HD2 PRO A 10 24.129 12.164 5.822 1.00 32.10 H new ATOM 0 HD3 PRO A 10 24.602 10.812 4.814 1.00 32.10 H new ATOM 135 N GLN A 11 19.733 12.581 3.052 1.00 4.24 N ATOM 136 CA GLN A 11 19.025 13.764 2.665 1.00 53.32 C ATOM 137 C GLN A 11 17.729 13.920 3.403 1.00 74.43 C ATOM 138 O GLN A 11 16.941 12.982 3.551 1.00 42.40 O ATOM 139 CB GLN A 11 18.814 13.825 1.139 1.00 4.02 C ATOM 140 CG GLN A 11 18.051 12.646 0.548 1.00 31.44 C ATOM 141 CD GLN A 11 17.855 12.770 -0.945 1.00 73.41 C ATOM 142 OE1 GLN A 11 18.675 12.313 -1.731 1.00 42.20 O ATOM 143 NE2 GLN A 11 16.774 13.377 -1.348 1.00 54.34 N ATOM 0 H GLN A 11 19.501 11.740 2.523 1.00 4.24 H new ATOM 0 HA GLN A 11 19.653 14.609 2.947 1.00 53.32 H new ATOM 0 HB2 GLN A 11 18.278 14.743 0.898 1.00 4.02 H new ATOM 0 HB3 GLN A 11 19.788 13.888 0.655 1.00 4.02 H new ATOM 0 HG2 GLN A 11 18.590 11.724 0.765 1.00 31.44 H new ATOM 0 HG3 GLN A 11 17.078 12.568 1.033 1.00 31.44 H new ATOM 0 HE21 GLN A 11 16.112 13.746 -0.666 1.00 54.34 H new ATOM 0 HE22 GLN A 11 16.590 13.483 -2.346 1.00 54.34 H new ATOM 152 N VAL A 12 17.529 15.101 3.886 1.00 51.25 N ATOM 153 CA VAL A 12 16.342 15.453 4.570 1.00 44.42 C ATOM 154 C VAL A 12 15.592 16.359 3.650 1.00 41.33 C ATOM 155 O VAL A 12 16.096 17.409 3.246 1.00 75.22 O ATOM 156 CB VAL A 12 16.648 16.218 5.889 1.00 71.21 C ATOM 157 CG1 VAL A 12 15.366 16.575 6.627 1.00 5.23 C ATOM 158 CG2 VAL A 12 17.573 15.417 6.789 1.00 71.22 C ATOM 0 H VAL A 12 18.205 15.861 3.811 1.00 51.25 H new ATOM 0 HA VAL A 12 15.780 14.558 4.835 1.00 44.42 H new ATOM 0 HB VAL A 12 17.156 17.144 5.618 1.00 71.21 H new ATOM 0 HG11 VAL A 12 15.611 17.109 7.545 1.00 5.23 H new ATOM 0 HG12 VAL A 12 14.746 17.209 5.993 1.00 5.23 H new ATOM 0 HG13 VAL A 12 14.821 15.663 6.872 1.00 5.23 H new ATOM 0 HG21 VAL A 12 17.768 15.979 7.703 1.00 71.22 H new ATOM 0 HG22 VAL A 12 17.103 14.467 7.041 1.00 71.22 H new ATOM 0 HG23 VAL A 12 18.513 15.230 6.270 1.00 71.22 H new ATOM 168 N GLU A 13 14.419 15.975 3.310 1.00 14.13 N ATOM 169 CA GLU A 13 13.647 16.739 2.406 1.00 34.25 C ATOM 170 C GLU A 13 12.474 17.321 3.158 1.00 74.31 C ATOM 171 O GLU A 13 12.059 16.770 4.185 1.00 11.23 O ATOM 172 CB GLU A 13 13.244 15.884 1.191 1.00 45.31 C ATOM 173 CG GLU A 13 12.516 16.645 0.098 1.00 63.40 C ATOM 174 CD GLU A 13 13.230 17.899 -0.337 1.00 45.42 C ATOM 175 OE1 GLU A 13 14.118 17.848 -1.208 1.00 33.10 O ATOM 176 OE2 GLU A 13 12.880 18.982 0.179 1.00 62.33 O ATOM 0 H GLU A 13 13.968 15.125 3.649 1.00 14.13 H new ATOM 0 HA GLU A 13 14.223 17.570 1.999 1.00 34.25 H new ATOM 0 HB2 GLU A 13 14.141 15.433 0.766 1.00 45.31 H new ATOM 0 HB3 GLU A 13 12.608 15.067 1.533 1.00 45.31 H new ATOM 0 HG2 GLU A 13 12.387 15.992 -0.765 1.00 63.40 H new ATOM 0 HG3 GLU A 13 11.519 16.908 0.451 1.00 63.40 H new ATOM 183 N THR A 14 11.973 18.407 2.670 1.00 50.30 N ATOM 184 CA THR A 14 10.965 19.167 3.317 1.00 70.32 C ATOM 185 C THR A 14 9.602 18.450 3.321 1.00 74.23 C ATOM 186 O THR A 14 8.996 18.218 2.270 1.00 43.14 O ATOM 187 CB THR A 14 10.867 20.535 2.609 1.00 2.13 C ATOM 188 OG1 THR A 14 12.175 21.148 2.612 1.00 22.01 O ATOM 189 CG2 THR A 14 9.887 21.458 3.301 1.00 35.32 C ATOM 0 H THR A 14 12.268 18.801 1.776 1.00 50.30 H new ATOM 0 HA THR A 14 11.238 19.299 4.364 1.00 70.32 H new ATOM 0 HB THR A 14 10.511 20.371 1.592 1.00 2.13 H new ATOM 0 HG1 THR A 14 12.129 22.018 2.164 1.00 22.01 H new ATOM 0 HG21 THR A 14 9.848 22.410 2.771 1.00 35.32 H new ATOM 0 HG22 THR A 14 8.897 21.002 3.302 1.00 35.32 H new ATOM 0 HG23 THR A 14 10.210 21.627 4.328 1.00 35.32 H new HETATM 197 N TPO A 15 9.160 18.069 4.504 1.00 24.35 N HETATM 198 CA TPO A 15 7.838 17.539 4.675 1.00 44.23 C HETATM 199 CB TPO A 15 7.810 16.242 5.548 1.00 12.34 C HETATM 200 CG2 TPO A 15 6.366 15.840 5.897 1.00 4.52 C HETATM 201 OG1 TPO A 15 8.430 15.120 4.838 1.00 51.33 O HETATM 202 P TPO A 15 8.254 13.522 5.197 1.00 53.43 P HETATM 203 O1P TPO A 15 8.432 13.264 6.680 1.00 12.41 O HETATM 204 O2P TPO A 15 9.303 12.696 4.468 1.00 74.11 O HETATM 205 O3P TPO A 15 6.865 13.021 4.765 1.00 52.24 O HETATM 206 C TPO A 15 6.956 18.585 5.339 1.00 73.02 C HETATM 207 O TPO A 15 7.210 19.021 6.466 1.00 51.54 O HETATM 0 HG23 TPO A 15 5.889 16.646 6.455 1.00 4.52 H new HETATM 0 HG22 TPO A 15 5.808 15.654 4.979 1.00 4.52 H new HETATM 0 HG21 TPO A 15 6.377 14.935 6.504 1.00 4.52 H new HETATM 0 HB TPO A 15 8.365 16.463 6.460 1.00 12.34 H new HETATM 0 HA TPO A 15 7.471 17.281 3.682 1.00 44.23 H new HETATM 0 H TPO A 15 9.957 17.600 4.934 1.00 24.35 H new ATOM 214 N SER A 16 5.956 18.991 4.623 1.00 73.44 N ATOM 215 CA SER A 16 4.934 19.852 5.111 1.00 72.53 C ATOM 216 C SER A 16 3.790 18.935 5.519 1.00 1.23 C ATOM 217 O SER A 16 3.681 17.832 4.976 1.00 35.40 O ATOM 218 CB SER A 16 4.495 20.782 3.979 1.00 11.31 C ATOM 219 OG SER A 16 5.624 21.427 3.395 1.00 14.12 O ATOM 0 H SER A 16 5.827 18.721 3.648 1.00 73.44 H new ATOM 0 HA SER A 16 5.263 20.468 5.948 1.00 72.53 H new ATOM 0 HB2 SER A 16 3.961 20.212 3.219 1.00 11.31 H new ATOM 0 HB3 SER A 16 3.801 21.529 4.363 1.00 11.31 H new ATOM 0 HG SER A 16 5.326 22.017 2.672 1.00 14.12 H new ATOM 225 N VAL A 17 2.976 19.339 6.453 1.00 2.33 N ATOM 226 CA VAL A 17 1.902 18.479 6.892 1.00 41.02 C ATOM 227 C VAL A 17 0.730 18.616 5.942 1.00 73.20 C ATOM 228 O VAL A 17 0.101 19.694 5.846 1.00 21.22 O ATOM 229 CB VAL A 17 1.453 18.818 8.341 1.00 24.24 C ATOM 230 CG1 VAL A 17 0.288 17.941 8.787 1.00 61.01 C ATOM 231 CG2 VAL A 17 2.621 18.679 9.300 1.00 35.31 C ATOM 0 H VAL A 17 3.029 20.243 6.922 1.00 2.33 H new ATOM 0 HA VAL A 17 2.265 17.451 6.891 1.00 41.02 H new ATOM 0 HB VAL A 17 1.109 19.852 8.350 1.00 24.24 H new ATOM 0 HG11 VAL A 17 0.001 18.207 9.805 1.00 61.01 H new ATOM 0 HG12 VAL A 17 -0.560 18.095 8.119 1.00 61.01 H new ATOM 0 HG13 VAL A 17 0.588 16.894 8.756 1.00 61.01 H new ATOM 0 HG21 VAL A 17 2.292 18.919 10.311 1.00 35.31 H new ATOM 0 HG22 VAL A 17 2.994 17.655 9.273 1.00 35.31 H new ATOM 0 HG23 VAL A 17 3.417 19.363 9.005 1.00 35.31 H new ATOM 241 N PHE A 18 0.435 17.543 5.252 1.00 22.34 N ATOM 242 CA PHE A 18 -0.639 17.530 4.306 1.00 40.32 C ATOM 243 C PHE A 18 -1.636 16.437 4.639 1.00 71.42 C ATOM 244 O PHE A 18 -1.289 15.264 4.756 1.00 51.00 O ATOM 245 CB PHE A 18 -0.135 17.421 2.838 1.00 41.40 C ATOM 246 CG PHE A 18 0.571 16.134 2.476 1.00 4.12 C ATOM 247 CD1 PHE A 18 1.913 15.959 2.752 1.00 75.33 C ATOM 248 CD2 PHE A 18 -0.120 15.101 1.855 1.00 21.24 C ATOM 249 CE1 PHE A 18 2.551 14.785 2.422 1.00 21.10 C ATOM 250 CE2 PHE A 18 0.513 13.925 1.526 1.00 53.12 C ATOM 251 CZ PHE A 18 1.849 13.765 1.809 1.00 32.32 C ATOM 0 H PHE A 18 0.935 16.658 5.334 1.00 22.34 H new ATOM 0 HA PHE A 18 -1.151 18.489 4.383 1.00 40.32 H new ATOM 0 HB2 PHE A 18 -0.988 17.545 2.171 1.00 41.40 H new ATOM 0 HB3 PHE A 18 0.544 18.252 2.645 1.00 41.40 H new ATOM 0 HD1 PHE A 18 2.468 16.752 3.232 1.00 75.33 H new ATOM 0 HD2 PHE A 18 -1.169 15.223 1.627 1.00 21.24 H new ATOM 0 HE1 PHE A 18 3.601 14.661 2.642 1.00 21.10 H new ATOM 0 HE2 PHE A 18 -0.038 13.129 1.047 1.00 53.12 H new ATOM 0 HZ PHE A 18 2.349 12.843 1.552 1.00 32.32 H new ATOM 261 N ARG A 19 -2.843 16.838 4.870 1.00 41.50 N ATOM 262 CA ARG A 19 -3.935 15.934 5.092 1.00 60.22 C ATOM 263 C ARG A 19 -5.057 16.457 4.241 1.00 60.24 C ATOM 264 O ARG A 19 -5.781 17.352 4.641 1.00 2.33 O ATOM 265 CB ARG A 19 -4.346 15.901 6.569 1.00 22.22 C ATOM 266 CG ARG A 19 -3.219 15.566 7.524 1.00 14.21 C ATOM 267 CD ARG A 19 -3.697 15.545 8.955 1.00 23.21 C ATOM 268 NE ARG A 19 -2.588 15.363 9.894 1.00 52.42 N ATOM 269 CZ ARG A 19 -2.687 15.484 11.221 1.00 10.44 C ATOM 270 NH1 ARG A 19 -3.876 15.659 11.790 1.00 44.04 N ATOM 271 NH2 ARG A 19 -1.595 15.409 11.963 1.00 71.33 N ATOM 0 H ARG A 19 -3.108 17.822 4.912 1.00 41.50 H new ATOM 0 HA ARG A 19 -3.663 14.911 4.833 1.00 60.22 H new ATOM 0 HB2 ARG A 19 -4.759 16.872 6.840 1.00 22.22 H new ATOM 0 HB3 ARG A 19 -5.143 15.169 6.696 1.00 22.22 H new ATOM 0 HG2 ARG A 19 -2.798 14.595 7.265 1.00 14.21 H new ATOM 0 HG3 ARG A 19 -2.419 16.299 7.417 1.00 14.21 H new ATOM 0 HD2 ARG A 19 -4.215 16.478 9.179 1.00 23.21 H new ATOM 0 HD3 ARG A 19 -4.420 14.740 9.085 1.00 23.21 H new ATOM 0 HE ARG A 19 -1.674 15.127 9.507 1.00 52.42 H new ATOM 0 HH11 ARG A 19 -4.716 15.701 11.213 1.00 44.04 H new ATOM 0 HH12 ARG A 19 -3.948 15.751 12.803 1.00 44.04 H new ATOM 0 HH21 ARG A 19 -0.688 15.260 11.521 1.00 71.33 H new ATOM 0 HH22 ARG A 19 -1.660 15.500 12.977 1.00 71.33 H new ATOM 285 N ALA A 20 -5.161 15.955 3.047 1.00 70.52 N ATOM 286 CA ALA A 20 -6.052 16.559 2.075 1.00 21.21 C ATOM 287 C ALA A 20 -7.261 15.701 1.748 1.00 62.43 C ATOM 288 O ALA A 20 -8.015 16.000 0.809 1.00 70.55 O ATOM 289 CB ALA A 20 -5.270 16.891 0.819 1.00 62.22 C ATOM 0 H ALA A 20 -4.650 15.137 2.715 1.00 70.52 H new ATOM 0 HA ALA A 20 -6.451 17.470 2.521 1.00 21.21 H new ATOM 0 HB1 ALA A 20 -5.936 17.345 0.085 1.00 62.22 H new ATOM 0 HB2 ALA A 20 -4.469 17.589 1.063 1.00 62.22 H new ATOM 0 HB3 ALA A 20 -4.842 15.978 0.405 1.00 62.22 H new ATOM 295 N ASP A 21 -7.466 14.649 2.487 1.00 61.12 N ATOM 296 CA ASP A 21 -8.606 13.793 2.192 1.00 63.13 C ATOM 297 C ASP A 21 -9.725 13.931 3.222 1.00 1.20 C ATOM 298 O ASP A 21 -10.689 13.253 3.138 1.00 44.34 O ATOM 299 CB ASP A 21 -8.203 12.322 1.985 1.00 74.42 C ATOM 300 CG ASP A 21 -9.282 11.510 1.246 1.00 21.52 C ATOM 301 OD1 ASP A 21 -9.292 11.517 -0.026 1.00 60.31 O ATOM 302 OD2 ASP A 21 -10.128 10.864 1.886 1.00 23.44 O ATOM 0 H ASP A 21 -6.887 14.359 3.275 1.00 61.12 H new ATOM 0 HA ASP A 21 -9.005 14.148 1.242 1.00 63.13 H new ATOM 0 HB2 ASP A 21 -7.272 12.281 1.420 1.00 74.42 H new ATOM 0 HB3 ASP A 21 -8.008 11.863 2.954 1.00 74.42 H new ATOM 307 N LEU A 22 -9.636 14.888 4.141 1.00 23.20 N ATOM 308 CA LEU A 22 -10.606 14.998 5.247 1.00 4.44 C ATOM 309 C LEU A 22 -12.062 15.102 4.772 1.00 61.02 C ATOM 310 O LEU A 22 -12.967 14.569 5.421 1.00 24.21 O ATOM 311 CB LEU A 22 -10.252 16.194 6.120 1.00 70.43 C ATOM 312 CG LEU A 22 -9.131 16.009 7.149 1.00 35.13 C ATOM 313 CD1 LEU A 22 -9.580 15.106 8.281 1.00 30.23 C ATOM 314 CD2 LEU A 22 -7.855 15.460 6.536 1.00 22.21 C ATOM 0 H LEU A 22 -8.907 15.601 4.150 1.00 23.20 H new ATOM 0 HA LEU A 22 -10.537 14.075 5.823 1.00 4.44 H new ATOM 0 HB2 LEU A 22 -9.974 17.019 5.464 1.00 70.43 H new ATOM 0 HB3 LEU A 22 -11.152 16.500 6.654 1.00 70.43 H new ATOM 0 HG LEU A 22 -8.909 17.002 7.539 1.00 35.13 H new ATOM 0 HD11 LEU A 22 -8.767 14.990 8.998 1.00 30.23 H new ATOM 0 HD12 LEU A 22 -10.443 15.548 8.779 1.00 30.23 H new ATOM 0 HD13 LEU A 22 -9.853 14.129 7.881 1.00 30.23 H new ATOM 0 HD21 LEU A 22 -7.097 15.350 7.311 1.00 22.21 H new ATOM 0 HD22 LEU A 22 -8.057 14.488 6.085 1.00 22.21 H new ATOM 0 HD23 LEU A 22 -7.494 16.147 5.771 1.00 22.21 H new ATOM 326 N LEU A 23 -12.271 15.717 3.629 1.00 75.33 N ATOM 327 CA LEU A 23 -13.601 15.819 3.053 1.00 14.15 C ATOM 328 C LEU A 23 -14.097 14.431 2.605 1.00 62.11 C ATOM 329 O LEU A 23 -15.263 14.080 2.783 1.00 41.21 O ATOM 330 CB LEU A 23 -13.597 16.793 1.861 1.00 71.21 C ATOM 331 CG LEU A 23 -14.946 17.029 1.160 1.00 62.52 C ATOM 332 CD1 LEU A 23 -15.960 17.663 2.108 1.00 12.15 C ATOM 333 CD2 LEU A 23 -14.761 17.890 -0.080 1.00 2.11 C ATOM 0 H LEU A 23 -11.536 16.157 3.075 1.00 75.33 H new ATOM 0 HA LEU A 23 -14.279 16.204 3.814 1.00 14.15 H new ATOM 0 HB2 LEU A 23 -13.221 17.755 2.208 1.00 71.21 H new ATOM 0 HB3 LEU A 23 -12.888 16.422 1.120 1.00 71.21 H new ATOM 0 HG LEU A 23 -15.337 16.059 0.854 1.00 62.52 H new ATOM 0 HD11 LEU A 23 -16.903 17.817 1.583 1.00 12.15 H new ATOM 0 HD12 LEU A 23 -16.123 17.003 2.960 1.00 12.15 H new ATOM 0 HD13 LEU A 23 -15.580 18.622 2.459 1.00 12.15 H new ATOM 0 HD21 LEU A 23 -15.726 18.046 -0.562 1.00 2.11 H new ATOM 0 HD22 LEU A 23 -14.338 18.853 0.206 1.00 2.11 H new ATOM 0 HD23 LEU A 23 -14.086 17.389 -0.774 1.00 2.11 H new ATOM 345 N LYS A 24 -13.198 13.629 2.078 1.00 34.21 N ATOM 346 CA LYS A 24 -13.566 12.321 1.566 1.00 4.30 C ATOM 347 C LYS A 24 -13.440 11.256 2.634 1.00 31.24 C ATOM 348 O LYS A 24 -14.114 10.240 2.573 1.00 52.32 O ATOM 349 CB LYS A 24 -12.768 11.961 0.311 1.00 45.34 C ATOM 350 CG LYS A 24 -12.935 12.967 -0.813 1.00 55.20 C ATOM 351 CD LYS A 24 -14.390 13.095 -1.239 1.00 52.41 C ATOM 352 CE LYS A 24 -14.586 14.233 -2.220 1.00 44.51 C ATOM 353 NZ LYS A 24 -13.846 14.042 -3.479 1.00 53.24 N ATOM 0 H LYS A 24 -12.207 13.856 1.991 1.00 34.21 H new ATOM 0 HA LYS A 24 -14.615 12.368 1.275 1.00 4.30 H new ATOM 0 HB2 LYS A 24 -11.712 11.886 0.569 1.00 45.34 H new ATOM 0 HB3 LYS A 24 -13.080 10.978 -0.041 1.00 45.34 H new ATOM 0 HG2 LYS A 24 -12.563 13.939 -0.490 1.00 55.20 H new ATOM 0 HG3 LYS A 24 -12.331 12.662 -1.667 1.00 55.20 H new ATOM 0 HD2 LYS A 24 -14.720 12.161 -1.694 1.00 52.41 H new ATOM 0 HD3 LYS A 24 -15.014 13.260 -0.360 1.00 52.41 H new ATOM 0 HE2 LYS A 24 -15.648 14.335 -2.441 1.00 44.51 H new ATOM 0 HE3 LYS A 24 -14.266 15.165 -1.755 1.00 44.51 H new ATOM 0 HZ1 LYS A 24 -14.059 14.826 -4.129 1.00 53.24 H new ATOM 0 HZ2 LYS A 24 -12.825 14.023 -3.282 1.00 53.24 H new ATOM 0 HZ3 LYS A 24 -14.131 13.142 -3.916 1.00 53.24 H new ATOM 367 N GLU A 25 -12.595 11.495 3.608 1.00 24.11 N ATOM 368 CA GLU A 25 -12.459 10.624 4.755 1.00 54.23 C ATOM 369 C GLU A 25 -13.786 10.654 5.502 1.00 15.32 C ATOM 370 O GLU A 25 -14.336 9.612 5.843 1.00 65.52 O ATOM 371 CB GLU A 25 -11.265 11.093 5.631 1.00 4.45 C ATOM 372 CG GLU A 25 -10.788 10.122 6.731 1.00 1.35 C ATOM 373 CD GLU A 25 -11.713 10.015 7.927 1.00 24.44 C ATOM 374 OE1 GLU A 25 -11.630 10.870 8.829 1.00 55.31 O ATOM 375 OE2 GLU A 25 -12.509 9.080 8.008 1.00 1.44 O ATOM 0 H GLU A 25 -11.976 12.306 3.629 1.00 24.11 H new ATOM 0 HA GLU A 25 -12.240 9.597 4.464 1.00 54.23 H new ATOM 0 HB2 GLU A 25 -10.422 11.302 4.973 1.00 4.45 H new ATOM 0 HB3 GLU A 25 -11.540 12.035 6.105 1.00 4.45 H new ATOM 0 HG2 GLU A 25 -10.666 9.131 6.294 1.00 1.35 H new ATOM 0 HG3 GLU A 25 -9.805 10.441 7.077 1.00 1.35 H new ATOM 382 N MET A 26 -14.345 11.856 5.669 1.00 14.31 N ATOM 383 CA MET A 26 -15.659 12.004 6.296 1.00 14.54 C ATOM 384 C MET A 26 -16.746 11.307 5.485 1.00 65.42 C ATOM 385 O MET A 26 -17.666 10.724 6.050 1.00 13.31 O ATOM 386 CB MET A 26 -16.022 13.466 6.558 1.00 53.44 C ATOM 387 CG MET A 26 -15.239 14.098 7.694 1.00 2.52 C ATOM 388 SD MET A 26 -15.744 15.793 8.035 1.00 23.23 S ATOM 389 CE MET A 26 -14.702 16.152 9.452 1.00 31.32 C ATOM 0 H MET A 26 -13.912 12.733 5.381 1.00 14.31 H new ATOM 0 HA MET A 26 -15.594 11.514 7.268 1.00 14.54 H new ATOM 0 HB2 MET A 26 -15.852 14.041 5.648 1.00 53.44 H new ATOM 0 HB3 MET A 26 -17.087 13.532 6.782 1.00 53.44 H new ATOM 0 HG2 MET A 26 -15.367 13.498 8.595 1.00 2.52 H new ATOM 0 HG3 MET A 26 -14.177 14.083 7.449 1.00 2.52 H new ATOM 0 HE1 MET A 26 -14.889 17.170 9.793 1.00 31.32 H new ATOM 0 HE2 MET A 26 -14.929 15.453 10.257 1.00 31.32 H new ATOM 0 HE3 MET A 26 -13.654 16.051 9.168 1.00 31.32 H new ATOM 399 N GLU A 27 -16.611 11.336 4.176 1.00 33.33 N ATOM 400 CA GLU A 27 -17.536 10.647 3.281 1.00 23.05 C ATOM 401 C GLU A 27 -17.391 9.117 3.477 1.00 13.15 C ATOM 402 O GLU A 27 -18.376 8.384 3.628 1.00 75.04 O ATOM 403 CB GLU A 27 -17.207 11.027 1.835 1.00 33.01 C ATOM 404 CG GLU A 27 -18.177 10.501 0.802 1.00 34.44 C ATOM 405 CD GLU A 27 -17.768 10.863 -0.603 1.00 21.32 C ATOM 406 OE1 GLU A 27 -17.981 12.023 -1.024 1.00 3.44 O ATOM 407 OE2 GLU A 27 -17.258 9.996 -1.315 1.00 41.11 O ATOM 0 H GLU A 27 -15.861 11.835 3.697 1.00 33.33 H new ATOM 0 HA GLU A 27 -18.562 10.938 3.504 1.00 23.05 H new ATOM 0 HB2 GLU A 27 -17.172 12.114 1.759 1.00 33.01 H new ATOM 0 HB3 GLU A 27 -16.209 10.659 1.596 1.00 33.01 H new ATOM 0 HG2 GLU A 27 -18.246 9.417 0.890 1.00 34.44 H new ATOM 0 HG3 GLU A 27 -19.171 10.901 1.003 1.00 34.44 H new ATOM 414 N SER A 28 -16.149 8.680 3.545 1.00 32.52 N ATOM 415 CA SER A 28 -15.769 7.280 3.701 1.00 34.43 C ATOM 416 C SER A 28 -16.047 6.758 5.129 1.00 75.51 C ATOM 417 O SER A 28 -15.918 5.563 5.401 1.00 13.14 O ATOM 418 CB SER A 28 -14.301 7.100 3.320 1.00 65.14 C ATOM 419 OG SER A 28 -14.062 7.617 2.007 1.00 72.25 O ATOM 0 H SER A 28 -15.346 9.307 3.492 1.00 32.52 H new ATOM 0 HA SER A 28 -16.386 6.683 3.029 1.00 34.43 H new ATOM 0 HB2 SER A 28 -13.665 7.613 4.042 1.00 65.14 H new ATOM 0 HB3 SER A 28 -14.036 6.043 3.356 1.00 65.14 H new ATOM 0 HG SER A 28 -14.115 8.595 2.026 1.00 72.25 H new ATOM 425 N SER A 29 -16.371 7.667 6.046 1.00 31.44 N ATOM 426 CA SER A 29 -16.723 7.303 7.410 1.00 25.04 C ATOM 427 C SER A 29 -18.033 6.492 7.443 1.00 4.24 C ATOM 428 O SER A 29 -18.353 5.852 8.455 1.00 11.33 O ATOM 429 CB SER A 29 -16.828 8.550 8.277 1.00 32.22 C ATOM 430 OG SER A 29 -15.601 9.286 8.254 1.00 2.34 O ATOM 0 H SER A 29 -16.396 8.670 5.863 1.00 31.44 H new ATOM 0 HA SER A 29 -15.933 6.670 7.814 1.00 25.04 H new ATOM 0 HB2 SER A 29 -17.643 9.180 7.920 1.00 32.22 H new ATOM 0 HB3 SER A 29 -17.069 8.267 9.302 1.00 32.22 H new ATOM 0 HG SER A 29 -15.243 9.297 7.342 1.00 2.34 H new ATOM 436 N THR A 30 -18.791 6.564 6.341 1.00 1.31 N ATOM 437 CA THR A 30 -19.983 5.775 6.154 1.00 11.20 C ATOM 438 C THR A 30 -19.607 4.290 6.276 1.00 43.42 C ATOM 439 O THR A 30 -18.790 3.778 5.495 1.00 34.12 O ATOM 440 CB THR A 30 -20.575 6.067 4.760 1.00 74.25 C ATOM 441 OG1 THR A 30 -20.765 7.489 4.628 1.00 71.32 O ATOM 442 CG2 THR A 30 -21.911 5.367 4.570 1.00 52.11 C ATOM 0 H THR A 30 -18.580 7.181 5.557 1.00 1.31 H new ATOM 0 HA THR A 30 -20.729 6.024 6.908 1.00 11.20 H new ATOM 0 HB THR A 30 -19.884 5.695 4.003 1.00 74.25 H new ATOM 0 HG1 THR A 30 -19.965 7.890 4.229 1.00 71.32 H new ATOM 0 HG21 THR A 30 -22.302 5.593 3.578 1.00 52.11 H new ATOM 0 HG22 THR A 30 -21.775 4.290 4.670 1.00 52.11 H new ATOM 0 HG23 THR A 30 -22.615 5.716 5.325 1.00 52.11 H new ATOM 450 N GLY A 31 -20.172 3.646 7.276 1.00 23.21 N ATOM 451 CA GLY A 31 -19.833 2.290 7.629 1.00 52.02 C ATOM 452 C GLY A 31 -20.026 1.278 6.532 1.00 61.31 C ATOM 453 O GLY A 31 -21.123 1.132 5.983 1.00 24.10 O ATOM 0 H GLY A 31 -20.889 4.059 7.873 1.00 23.21 H new ATOM 0 HA2 GLY A 31 -18.791 2.264 7.947 1.00 52.02 H new ATOM 0 HA3 GLY A 31 -20.436 1.993 8.487 1.00 52.02 H new ATOM 457 N THR A 32 -18.951 0.643 6.173 1.00 52.41 N ATOM 458 CA THR A 32 -18.953 -0.447 5.255 1.00 64.31 C ATOM 459 C THR A 32 -18.465 -1.686 6.010 1.00 24.23 C ATOM 460 O THR A 32 -17.715 -1.551 6.992 1.00 4.52 O ATOM 461 CB THR A 32 -18.092 -0.156 3.971 1.00 15.10 C ATOM 462 OG1 THR A 32 -18.131 -1.269 3.064 1.00 4.22 O ATOM 463 CG2 THR A 32 -16.642 0.169 4.310 1.00 34.12 C ATOM 0 H THR A 32 -18.023 0.879 6.523 1.00 52.41 H new ATOM 0 HA THR A 32 -19.964 -0.611 4.881 1.00 64.31 H new ATOM 0 HB THR A 32 -18.534 0.719 3.494 1.00 15.10 H new ATOM 0 HG1 THR A 32 -17.590 -1.065 2.272 1.00 4.22 H new ATOM 0 HG21 THR A 32 -16.088 0.362 3.391 1.00 34.12 H new ATOM 0 HG22 THR A 32 -16.607 1.052 4.948 1.00 34.12 H new ATOM 0 HG23 THR A 32 -16.193 -0.675 4.834 1.00 34.12 H new ATOM 471 N ALA A 33 -18.933 -2.853 5.625 1.00 32.41 N ATOM 472 CA ALA A 33 -18.511 -4.085 6.262 1.00 22.42 C ATOM 473 C ALA A 33 -17.016 -4.323 6.006 1.00 55.15 C ATOM 474 O ALA A 33 -16.568 -4.256 4.850 1.00 21.42 O ATOM 475 CB ALA A 33 -19.330 -5.252 5.734 1.00 34.33 C ATOM 0 H ALA A 33 -19.609 -2.977 4.871 1.00 32.41 H new ATOM 0 HA ALA A 33 -18.673 -4.003 7.337 1.00 22.42 H new ATOM 0 HB1 ALA A 33 -19.006 -6.173 6.218 1.00 34.33 H new ATOM 0 HB2 ALA A 33 -20.385 -5.082 5.947 1.00 34.33 H new ATOM 0 HB3 ALA A 33 -19.187 -5.339 4.657 1.00 34.33 H new ATOM 481 N PRO A 34 -16.219 -4.557 7.069 1.00 45.45 N ATOM 482 CA PRO A 34 -14.787 -4.810 6.926 1.00 75.24 C ATOM 483 C PRO A 34 -14.545 -6.085 6.131 1.00 23.11 C ATOM 484 O PRO A 34 -15.270 -7.081 6.285 1.00 0.43 O ATOM 485 CB PRO A 34 -14.289 -4.967 8.372 1.00 3.33 C ATOM 486 CG PRO A 34 -15.507 -5.283 9.171 1.00 62.23 C ATOM 487 CD PRO A 34 -16.647 -4.593 8.483 1.00 74.40 C ATOM 0 HA PRO A 34 -14.271 -4.014 6.390 1.00 75.24 H new ATOM 0 HB2 PRO A 34 -13.549 -5.764 8.450 1.00 3.33 H new ATOM 0 HB3 PRO A 34 -13.812 -4.053 8.726 1.00 3.33 H new ATOM 0 HG2 PRO A 34 -15.674 -6.359 9.218 1.00 62.23 H new ATOM 0 HG3 PRO A 34 -15.401 -4.932 10.198 1.00 62.23 H new ATOM 0 HD2 PRO A 34 -17.582 -5.140 8.607 1.00 74.40 H new ATOM 0 HD3 PRO A 34 -16.809 -3.591 8.880 1.00 74.40 H new ATOM 495 N ALA A 35 -13.541 -6.076 5.319 1.00 53.24 N ATOM 496 CA ALA A 35 -13.281 -7.178 4.444 1.00 72.55 C ATOM 497 C ALA A 35 -12.128 -8.005 4.970 1.00 51.35 C ATOM 498 O ALA A 35 -11.441 -7.592 5.924 1.00 4.50 O ATOM 499 CB ALA A 35 -12.994 -6.665 3.040 1.00 64.44 C ATOM 0 H ALA A 35 -12.876 -5.307 5.241 1.00 53.24 H new ATOM 0 HA ALA A 35 -14.161 -7.820 4.402 1.00 72.55 H new ATOM 0 HB1 ALA A 35 -12.797 -7.508 2.378 1.00 64.44 H new ATOM 0 HB2 ALA A 35 -13.856 -6.109 2.672 1.00 64.44 H new ATOM 0 HB3 ALA A 35 -12.123 -6.010 3.063 1.00 64.44 H new ATOM 505 N SER A 36 -11.956 -9.169 4.388 1.00 22.35 N ATOM 506 CA SER A 36 -10.887 -10.069 4.705 1.00 71.11 C ATOM 507 C SER A 36 -10.979 -11.231 3.721 1.00 42.30 C ATOM 508 O SER A 36 -11.716 -11.128 2.734 1.00 72.51 O ATOM 509 CB SER A 36 -10.990 -10.579 6.159 1.00 71.40 C ATOM 510 OG SER A 36 -9.805 -11.282 6.543 1.00 5.03 O ATOM 0 H SER A 36 -12.578 -9.520 3.660 1.00 22.35 H new ATOM 0 HA SER A 36 -9.927 -9.559 4.622 1.00 71.11 H new ATOM 0 HB2 SER A 36 -11.152 -9.737 6.832 1.00 71.40 H new ATOM 0 HB3 SER A 36 -11.854 -11.236 6.257 1.00 71.40 H new ATOM 0 HG SER A 36 -9.894 -11.593 7.468 1.00 5.03 H new ATOM 516 N THR A 37 -10.236 -12.300 3.978 1.00 71.34 N ATOM 517 CA THR A 37 -10.233 -13.503 3.154 1.00 24.30 C ATOM 518 C THR A 37 -9.166 -14.477 3.658 1.00 63.15 C ATOM 519 O THR A 37 -9.319 -15.702 3.554 1.00 13.04 O ATOM 520 CB THR A 37 -10.060 -13.227 1.603 1.00 43.35 C ATOM 521 OG1 THR A 37 -10.241 -14.437 0.861 1.00 55.43 O ATOM 522 CG2 THR A 37 -8.692 -12.640 1.260 1.00 51.32 C ATOM 0 H THR A 37 -9.607 -12.357 4.779 1.00 71.34 H new ATOM 0 HA THR A 37 -11.222 -13.949 3.257 1.00 24.30 H new ATOM 0 HB THR A 37 -10.820 -12.495 1.332 1.00 43.35 H new ATOM 0 HG1 THR A 37 -10.133 -14.253 -0.096 1.00 55.43 H new ATOM 0 HG21 THR A 37 -8.628 -12.471 0.185 1.00 51.32 H new ATOM 0 HG22 THR A 37 -8.560 -11.694 1.785 1.00 51.32 H new ATOM 0 HG23 THR A 37 -7.911 -13.336 1.565 1.00 51.32 H new ATOM 530 N GLY A 38 -8.104 -13.941 4.232 1.00 64.02 N ATOM 531 CA GLY A 38 -7.060 -14.791 4.748 1.00 62.24 C ATOM 532 C GLY A 38 -5.713 -14.120 4.748 1.00 2.03 C ATOM 533 O GLY A 38 -4.795 -14.565 4.075 1.00 63.11 O ATOM 0 H GLY A 38 -7.947 -12.940 4.349 1.00 64.02 H new ATOM 0 HA2 GLY A 38 -7.311 -15.092 5.765 1.00 62.24 H new ATOM 0 HA3 GLY A 38 -7.008 -15.701 4.150 1.00 62.24 H new ATOM 537 N ALA A 39 -5.586 -13.058 5.511 1.00 1.12 N ATOM 538 CA ALA A 39 -4.330 -12.335 5.608 1.00 54.21 C ATOM 539 C ALA A 39 -3.404 -13.078 6.546 1.00 70.24 C ATOM 540 O ALA A 39 -2.260 -13.361 6.214 1.00 22.54 O ATOM 541 CB ALA A 39 -4.559 -10.914 6.108 1.00 30.44 C ATOM 0 H ALA A 39 -6.340 -12.671 6.078 1.00 1.12 H new ATOM 0 HA ALA A 39 -3.877 -12.272 4.618 1.00 54.21 H new ATOM 0 HB1 ALA A 39 -3.604 -10.393 6.172 1.00 30.44 H new ATOM 0 HB2 ALA A 39 -5.215 -10.386 5.416 1.00 30.44 H new ATOM 0 HB3 ALA A 39 -5.022 -10.946 7.094 1.00 30.44 H new ATOM 547 N GLU A 40 -3.953 -13.487 7.682 1.00 22.23 N ATOM 548 CA GLU A 40 -3.192 -14.183 8.722 1.00 64.13 C ATOM 549 C GLU A 40 -3.068 -15.663 8.396 1.00 21.44 C ATOM 550 O GLU A 40 -2.540 -16.454 9.173 1.00 35.20 O ATOM 551 CB GLU A 40 -3.866 -13.988 10.068 1.00 72.40 C ATOM 552 CG GLU A 40 -4.026 -12.532 10.436 1.00 2.10 C ATOM 553 CD GLU A 40 -4.642 -12.341 11.793 1.00 11.33 C ATOM 554 OE1 GLU A 40 -5.886 -12.285 11.890 1.00 4.14 O ATOM 555 OE2 GLU A 40 -3.902 -12.261 12.793 1.00 64.43 O ATOM 0 H GLU A 40 -4.937 -13.348 7.912 1.00 22.23 H new ATOM 0 HA GLU A 40 -2.187 -13.762 8.765 1.00 64.13 H new ATOM 0 HB2 GLU A 40 -4.847 -14.464 10.051 1.00 72.40 H new ATOM 0 HB3 GLU A 40 -3.281 -14.491 10.838 1.00 72.40 H new ATOM 0 HG2 GLU A 40 -3.050 -12.046 10.413 1.00 2.10 H new ATOM 0 HG3 GLU A 40 -4.646 -12.038 9.687 1.00 2.10 H new ATOM 562 N ASN A 41 -3.560 -16.008 7.241 1.00 43.40 N ATOM 563 CA ASN A 41 -3.497 -17.366 6.734 1.00 15.32 C ATOM 564 C ASN A 41 -2.218 -17.516 5.950 1.00 51.13 C ATOM 565 O ASN A 41 -1.638 -18.596 5.888 1.00 30.52 O ATOM 566 CB ASN A 41 -4.696 -17.666 5.811 1.00 11.30 C ATOM 567 CG ASN A 41 -4.677 -19.088 5.248 1.00 12.12 C ATOM 568 OD1 ASN A 41 -4.221 -20.025 5.892 1.00 12.52 O ATOM 569 ND2 ASN A 41 -5.163 -19.253 4.045 1.00 5.45 N ATOM 0 H ASN A 41 -4.023 -15.353 6.611 1.00 43.40 H new ATOM 0 HA ASN A 41 -3.527 -18.064 7.570 1.00 15.32 H new ATOM 0 HB2 ASN A 41 -5.622 -17.513 6.366 1.00 11.30 H new ATOM 0 HB3 ASN A 41 -4.699 -16.954 4.985 1.00 11.30 H new ATOM 0 HD21 ASN A 41 -5.169 -20.180 3.620 1.00 5.45 H new ATOM 0 HD22 ASN A 41 -5.536 -18.454 3.532 1.00 5.45 H new ATOM 576 N LEU A 42 -1.766 -16.384 5.392 1.00 42.32 N ATOM 577 CA LEU A 42 -0.583 -16.311 4.552 1.00 42.51 C ATOM 578 C LEU A 42 -0.704 -17.277 3.360 1.00 33.00 C ATOM 579 O LEU A 42 -0.181 -18.378 3.399 1.00 10.03 O ATOM 580 CB LEU A 42 0.689 -16.583 5.375 1.00 1.13 C ATOM 581 CG LEU A 42 0.966 -15.609 6.533 1.00 53.53 C ATOM 582 CD1 LEU A 42 2.180 -16.051 7.325 1.00 3.21 C ATOM 583 CD2 LEU A 42 1.168 -14.198 6.011 1.00 11.55 C ATOM 0 H LEU A 42 -2.227 -15.483 5.520 1.00 42.32 H new ATOM 0 HA LEU A 42 -0.504 -15.300 4.152 1.00 42.51 H new ATOM 0 HB2 LEU A 42 0.625 -17.592 5.783 1.00 1.13 H new ATOM 0 HB3 LEU A 42 1.545 -16.566 4.700 1.00 1.13 H new ATOM 0 HG LEU A 42 0.099 -15.614 7.193 1.00 53.53 H new ATOM 0 HD11 LEU A 42 2.359 -15.349 8.139 1.00 3.21 H new ATOM 0 HD12 LEU A 42 2.004 -17.045 7.735 1.00 3.21 H new ATOM 0 HD13 LEU A 42 3.051 -16.077 6.671 1.00 3.21 H new ATOM 0 HD21 LEU A 42 1.362 -13.525 6.846 1.00 11.55 H new ATOM 0 HD22 LEU A 42 2.016 -14.181 5.327 1.00 11.55 H new ATOM 0 HD23 LEU A 42 0.271 -13.873 5.485 1.00 11.55 H new ATOM 595 N PRO A 43 -1.451 -16.876 2.295 1.00 54.15 N ATOM 596 CA PRO A 43 -1.721 -17.747 1.138 1.00 11.21 C ATOM 597 C PRO A 43 -0.451 -18.307 0.488 1.00 71.21 C ATOM 598 O PRO A 43 -0.220 -19.514 0.507 1.00 64.23 O ATOM 599 CB PRO A 43 -2.488 -16.845 0.152 1.00 31.53 C ATOM 600 CG PRO A 43 -2.310 -15.452 0.664 1.00 11.10 C ATOM 601 CD PRO A 43 -2.106 -15.564 2.146 1.00 44.32 C ATOM 0 HA PRO A 43 -2.281 -18.631 1.442 1.00 11.21 H new ATOM 0 HB2 PRO A 43 -2.094 -16.945 -0.859 1.00 31.53 H new ATOM 0 HB3 PRO A 43 -3.543 -17.116 0.111 1.00 31.53 H new ATOM 0 HG2 PRO A 43 -1.454 -14.971 0.190 1.00 11.10 H new ATOM 0 HG3 PRO A 43 -3.184 -14.841 0.438 1.00 11.10 H new ATOM 0 HD2 PRO A 43 -1.482 -14.756 2.529 1.00 44.32 H new ATOM 0 HD3 PRO A 43 -3.051 -15.521 2.687 1.00 44.32 H new ATOM 609 N ALA A 44 0.374 -17.432 -0.054 1.00 1.40 N ATOM 610 CA ALA A 44 1.605 -17.853 -0.700 1.00 55.21 C ATOM 611 C ALA A 44 2.794 -17.102 -0.125 1.00 31.13 C ATOM 612 O ALA A 44 3.879 -17.101 -0.693 1.00 45.22 O ATOM 613 CB ALA A 44 1.510 -17.631 -2.194 1.00 41.42 C ATOM 0 H ALA A 44 0.215 -16.424 -0.061 1.00 1.40 H new ATOM 0 HA ALA A 44 1.751 -18.917 -0.513 1.00 55.21 H new ATOM 0 HB1 ALA A 44 2.438 -17.950 -2.669 1.00 41.42 H new ATOM 0 HB2 ALA A 44 0.679 -18.211 -2.596 1.00 41.42 H new ATOM 0 HB3 ALA A 44 1.345 -16.572 -2.395 1.00 41.42 H new ATOM 619 N GLY A 45 2.579 -16.452 1.001 1.00 23.05 N ATOM 620 CA GLY A 45 3.642 -15.697 1.649 1.00 3.12 C ATOM 621 C GLY A 45 3.824 -14.296 1.077 1.00 22.32 C ATOM 622 O GLY A 45 4.558 -13.497 1.623 1.00 71.02 O ATOM 0 H GLY A 45 1.683 -16.429 1.488 1.00 23.05 H new ATOM 0 HA2 GLY A 45 3.426 -15.621 2.715 1.00 3.12 H new ATOM 0 HA3 GLY A 45 4.579 -16.246 1.552 1.00 3.12 H new ATOM 626 N SER A 46 3.158 -14.005 -0.017 1.00 22.31 N ATOM 627 CA SER A 46 3.258 -12.708 -0.642 1.00 51.52 C ATOM 628 C SER A 46 1.905 -12.001 -0.585 1.00 44.12 C ATOM 629 O SER A 46 0.847 -12.656 -0.520 1.00 43.44 O ATOM 630 CB SER A 46 3.707 -12.877 -2.088 1.00 25.01 C ATOM 631 OG SER A 46 4.886 -13.682 -2.151 1.00 3.15 O ATOM 0 H SER A 46 2.536 -14.657 -0.495 1.00 22.31 H new ATOM 0 HA SER A 46 3.991 -12.101 -0.111 1.00 51.52 H new ATOM 0 HB2 SER A 46 2.911 -13.340 -2.671 1.00 25.01 H new ATOM 0 HB3 SER A 46 3.901 -11.901 -2.532 1.00 25.01 H new ATOM 0 HG SER A 46 5.163 -13.784 -3.086 1.00 3.15 H new ATOM 637 N ALA A 47 1.937 -10.691 -0.610 1.00 4.14 N ATOM 638 CA ALA A 47 0.754 -9.869 -0.504 1.00 42.33 C ATOM 639 C ALA A 47 0.937 -8.630 -1.347 1.00 34.22 C ATOM 640 O ALA A 47 2.069 -8.274 -1.661 1.00 33.02 O ATOM 641 CB ALA A 47 0.511 -9.502 0.938 1.00 33.31 C ATOM 0 H ALA A 47 2.800 -10.156 -0.706 1.00 4.14 H new ATOM 0 HA ALA A 47 -0.114 -10.420 -0.866 1.00 42.33 H new ATOM 0 HB1 ALA A 47 -0.383 -8.882 1.010 1.00 33.31 H new ATOM 0 HB2 ALA A 47 0.372 -10.409 1.526 1.00 33.31 H new ATOM 0 HB3 ALA A 47 1.368 -8.949 1.322 1.00 33.31 H new ATOM 647 N LEU A 48 -0.140 -7.998 -1.746 1.00 50.23 N ATOM 648 CA LEU A 48 -0.042 -6.816 -2.574 1.00 62.54 C ATOM 649 C LEU A 48 -1.032 -5.762 -2.138 1.00 61.14 C ATOM 650 O LEU A 48 -1.974 -6.053 -1.423 1.00 51.51 O ATOM 651 CB LEU A 48 -0.154 -7.155 -4.097 1.00 41.21 C ATOM 652 CG LEU A 48 -1.442 -7.850 -4.624 1.00 13.53 C ATOM 653 CD1 LEU A 48 -2.636 -6.902 -4.687 1.00 32.13 C ATOM 654 CD2 LEU A 48 -1.186 -8.470 -5.989 1.00 25.20 C ATOM 0 H LEU A 48 -1.092 -8.279 -1.513 1.00 50.23 H new ATOM 0 HA LEU A 48 0.954 -6.395 -2.433 1.00 62.54 H new ATOM 0 HB2 LEU A 48 -0.033 -6.224 -4.651 1.00 41.21 H new ATOM 0 HB3 LEU A 48 0.692 -7.792 -4.355 1.00 41.21 H new ATOM 0 HG LEU A 48 -1.696 -8.635 -3.911 1.00 13.53 H new ATOM 0 HD11 LEU A 48 -3.508 -7.439 -5.061 1.00 32.13 H new ATOM 0 HD12 LEU A 48 -2.848 -6.517 -3.690 1.00 32.13 H new ATOM 0 HD13 LEU A 48 -2.407 -6.072 -5.355 1.00 32.13 H new ATOM 0 HD21 LEU A 48 -2.096 -8.953 -6.346 1.00 25.20 H new ATOM 0 HD22 LEU A 48 -0.889 -7.692 -6.692 1.00 25.20 H new ATOM 0 HD23 LEU A 48 -0.390 -9.210 -5.909 1.00 25.20 H new ATOM 666 N LEU A 49 -0.801 -4.557 -2.538 1.00 63.00 N ATOM 667 CA LEU A 49 -1.691 -3.477 -2.240 1.00 71.21 C ATOM 668 C LEU A 49 -1.982 -2.687 -3.506 1.00 42.23 C ATOM 669 O LEU A 49 -1.136 -2.617 -4.410 1.00 62.23 O ATOM 670 CB LEU A 49 -1.150 -2.601 -1.064 1.00 32.34 C ATOM 671 CG LEU A 49 0.289 -2.035 -1.154 1.00 22.23 C ATOM 672 CD1 LEU A 49 0.410 -0.913 -2.172 1.00 1.33 C ATOM 673 CD2 LEU A 49 0.766 -1.573 0.216 1.00 63.25 C ATOM 0 H LEU A 49 0.016 -4.288 -3.086 1.00 63.00 H new ATOM 0 HA LEU A 49 -2.642 -3.875 -1.887 1.00 71.21 H new ATOM 0 HB2 LEU A 49 -1.829 -1.757 -0.942 1.00 32.34 H new ATOM 0 HB3 LEU A 49 -1.214 -3.196 -0.153 1.00 32.34 H new ATOM 0 HG LEU A 49 0.931 -2.845 -1.499 1.00 22.23 H new ATOM 0 HD11 LEU A 49 1.438 -0.552 -2.195 1.00 1.33 H new ATOM 0 HD12 LEU A 49 0.134 -1.285 -3.158 1.00 1.33 H new ATOM 0 HD13 LEU A 49 -0.255 -0.096 -1.893 1.00 1.33 H new ATOM 0 HD21 LEU A 49 1.779 -1.178 0.135 1.00 63.25 H new ATOM 0 HD22 LEU A 49 0.102 -0.794 0.589 1.00 63.25 H new ATOM 0 HD23 LEU A 49 0.760 -2.416 0.907 1.00 63.25 H new ATOM 685 N VAL A 50 -3.166 -2.152 -3.602 1.00 63.34 N ATOM 686 CA VAL A 50 -3.571 -1.388 -4.768 1.00 42.25 C ATOM 687 C VAL A 50 -4.046 -0.015 -4.323 1.00 2.15 C ATOM 688 O VAL A 50 -4.829 0.096 -3.370 1.00 3.11 O ATOM 689 CB VAL A 50 -4.733 -2.099 -5.546 1.00 22.41 C ATOM 690 CG1 VAL A 50 -5.106 -1.334 -6.816 1.00 71.23 C ATOM 691 CG2 VAL A 50 -4.377 -3.544 -5.883 1.00 23.33 C ATOM 0 H VAL A 50 -3.883 -2.228 -2.881 1.00 63.34 H new ATOM 0 HA VAL A 50 -2.712 -1.304 -5.434 1.00 42.25 H new ATOM 0 HB VAL A 50 -5.600 -2.107 -4.886 1.00 22.41 H new ATOM 0 HG11 VAL A 50 -5.914 -1.854 -7.330 1.00 71.23 H new ATOM 0 HG12 VAL A 50 -5.432 -0.328 -6.552 1.00 71.23 H new ATOM 0 HG13 VAL A 50 -4.238 -1.273 -7.472 1.00 71.23 H new ATOM 0 HG21 VAL A 50 -5.204 -4.006 -6.422 1.00 23.33 H new ATOM 0 HG22 VAL A 50 -3.483 -3.563 -6.506 1.00 23.33 H new ATOM 0 HG23 VAL A 50 -4.189 -4.097 -4.962 1.00 23.33 H new ATOM 701 N VAL A 51 -3.569 1.022 -4.977 1.00 32.11 N ATOM 702 CA VAL A 51 -4.012 2.363 -4.668 1.00 40.13 C ATOM 703 C VAL A 51 -5.343 2.564 -5.359 1.00 74.43 C ATOM 704 O VAL A 51 -5.426 2.495 -6.590 1.00 55.11 O ATOM 705 CB VAL A 51 -3.003 3.433 -5.174 1.00 62.31 C ATOM 706 CG1 VAL A 51 -3.398 4.828 -4.699 1.00 61.43 C ATOM 707 CG2 VAL A 51 -1.580 3.104 -4.740 1.00 53.40 C ATOM 0 H VAL A 51 -2.877 0.962 -5.724 1.00 32.11 H new ATOM 0 HA VAL A 51 -4.094 2.479 -3.587 1.00 40.13 H new ATOM 0 HB VAL A 51 -3.034 3.421 -6.263 1.00 62.31 H new ATOM 0 HG11 VAL A 51 -2.675 5.556 -5.067 1.00 61.43 H new ATOM 0 HG12 VAL A 51 -4.389 5.075 -5.080 1.00 61.43 H new ATOM 0 HG13 VAL A 51 -3.413 4.851 -3.609 1.00 61.43 H new ATOM 0 HG21 VAL A 51 -0.900 3.871 -5.110 1.00 53.40 H new ATOM 0 HG22 VAL A 51 -1.530 3.069 -3.652 1.00 53.40 H new ATOM 0 HG23 VAL A 51 -1.290 2.135 -5.147 1.00 53.40 H new ATOM 717 N LYS A 52 -6.373 2.796 -4.590 1.00 24.34 N ATOM 718 CA LYS A 52 -7.699 2.956 -5.155 1.00 12.04 C ATOM 719 C LYS A 52 -7.942 4.388 -5.538 1.00 33.44 C ATOM 720 O LYS A 52 -8.592 4.670 -6.538 1.00 5.11 O ATOM 721 CB LYS A 52 -8.789 2.468 -4.191 1.00 42.50 C ATOM 722 CG LYS A 52 -8.754 0.967 -3.887 1.00 1.53 C ATOM 723 CD LYS A 52 -9.017 0.090 -5.122 1.00 35.40 C ATOM 724 CE LYS A 52 -10.426 0.284 -5.695 1.00 75.21 C ATOM 725 NZ LYS A 52 -11.487 -0.067 -4.724 1.00 11.44 N ATOM 0 H LYS A 52 -6.327 2.879 -3.574 1.00 24.34 H new ATOM 0 HA LYS A 52 -7.749 2.339 -6.052 1.00 12.04 H new ATOM 0 HB2 LYS A 52 -8.697 3.016 -3.253 1.00 42.50 H new ATOM 0 HB3 LYS A 52 -9.764 2.716 -4.611 1.00 42.50 H new ATOM 0 HG2 LYS A 52 -7.781 0.711 -3.469 1.00 1.53 H new ATOM 0 HG3 LYS A 52 -9.499 0.740 -3.124 1.00 1.53 H new ATOM 0 HD2 LYS A 52 -8.281 0.323 -5.891 1.00 35.40 H new ATOM 0 HD3 LYS A 52 -8.879 -0.958 -4.855 1.00 35.40 H new ATOM 0 HE2 LYS A 52 -10.549 1.322 -6.003 1.00 75.21 H new ATOM 0 HE3 LYS A 52 -10.539 -0.330 -6.589 1.00 75.21 H new ATOM 0 HZ1 LYS A 52 -12.412 -0.049 -5.199 1.00 11.44 H new ATOM 0 HZ2 LYS A 52 -11.310 -1.019 -4.346 1.00 11.44 H new ATOM 0 HZ3 LYS A 52 -11.485 0.621 -3.944 1.00 11.44 H new ATOM 739 N ARG A 53 -7.385 5.288 -4.775 1.00 25.43 N ATOM 740 CA ARG A 53 -7.576 6.694 -5.023 1.00 14.51 C ATOM 741 C ARG A 53 -6.331 7.444 -4.636 1.00 41.02 C ATOM 742 O ARG A 53 -5.748 7.201 -3.568 1.00 70.30 O ATOM 743 CB ARG A 53 -8.802 7.234 -4.274 1.00 22.30 C ATOM 744 CG ARG A 53 -9.105 8.711 -4.515 1.00 13.23 C ATOM 745 CD ARG A 53 -9.420 9.013 -5.975 1.00 62.11 C ATOM 746 NE ARG A 53 -9.709 10.440 -6.179 1.00 42.33 N ATOM 747 CZ ARG A 53 -9.658 11.089 -7.359 1.00 41.42 C ATOM 748 NH1 ARG A 53 -9.353 10.436 -8.471 1.00 14.23 N ATOM 749 NH2 ARG A 53 -9.931 12.389 -7.422 1.00 23.35 N ATOM 0 H ARG A 53 -6.793 5.074 -3.973 1.00 25.43 H new ATOM 0 HA ARG A 53 -7.763 6.840 -6.087 1.00 14.51 H new ATOM 0 HB2 ARG A 53 -9.674 6.647 -4.564 1.00 22.30 H new ATOM 0 HB3 ARG A 53 -8.654 7.078 -3.205 1.00 22.30 H new ATOM 0 HG2 ARG A 53 -9.950 9.011 -3.895 1.00 13.23 H new ATOM 0 HG3 ARG A 53 -8.250 9.310 -4.200 1.00 13.23 H new ATOM 0 HD2 ARG A 53 -8.576 8.719 -6.599 1.00 62.11 H new ATOM 0 HD3 ARG A 53 -10.276 8.418 -6.295 1.00 62.11 H new ATOM 0 HE ARG A 53 -9.970 10.985 -5.358 1.00 42.33 H new ATOM 0 HH11 ARG A 53 -9.155 9.436 -8.437 1.00 14.23 H new ATOM 0 HH12 ARG A 53 -9.316 10.933 -9.361 1.00 14.23 H new ATOM 0 HH21 ARG A 53 -10.180 12.899 -6.575 1.00 23.35 H new ATOM 0 HH22 ARG A 53 -9.891 12.876 -8.317 1.00 23.35 H new ATOM 763 N GLY A 54 -5.929 8.309 -5.509 1.00 40.05 N ATOM 764 CA GLY A 54 -4.750 9.089 -5.355 1.00 22.30 C ATOM 765 C GLY A 54 -4.181 9.316 -6.729 1.00 23.03 C ATOM 766 O GLY A 54 -4.698 8.735 -7.683 1.00 20.52 O ATOM 0 H GLY A 54 -6.431 8.496 -6.377 1.00 40.05 H new ATOM 0 HA2 GLY A 54 -4.978 10.039 -4.872 1.00 22.30 H new ATOM 0 HA3 GLY A 54 -4.029 8.574 -4.721 1.00 22.30 H new ATOM 770 N PRO A 55 -3.161 10.154 -6.899 1.00 50.15 N ATOM 771 CA PRO A 55 -2.501 10.336 -8.207 1.00 33.23 C ATOM 772 C PRO A 55 -1.953 8.998 -8.749 1.00 3.14 C ATOM 773 O PRO A 55 -1.937 8.743 -9.962 1.00 12.42 O ATOM 774 CB PRO A 55 -1.346 11.289 -7.887 1.00 43.00 C ATOM 775 CG PRO A 55 -1.794 12.025 -6.671 1.00 21.41 C ATOM 776 CD PRO A 55 -2.617 11.058 -5.875 1.00 22.44 C ATOM 0 HA PRO A 55 -3.181 10.713 -8.971 1.00 33.23 H new ATOM 0 HB2 PRO A 55 -0.421 10.743 -7.702 1.00 43.00 H new ATOM 0 HB3 PRO A 55 -1.153 11.971 -8.715 1.00 43.00 H new ATOM 0 HG2 PRO A 55 -0.940 12.377 -6.093 1.00 21.41 H new ATOM 0 HG3 PRO A 55 -2.380 12.904 -6.942 1.00 21.41 H new ATOM 0 HD2 PRO A 55 -2.012 10.521 -5.145 1.00 22.44 H new ATOM 0 HD3 PRO A 55 -3.409 11.563 -5.323 1.00 22.44 H new ATOM 784 N ASN A 56 -1.550 8.139 -7.832 1.00 53.21 N ATOM 785 CA ASN A 56 -1.005 6.828 -8.154 1.00 1.53 C ATOM 786 C ASN A 56 -2.094 5.752 -8.128 1.00 22.52 C ATOM 787 O ASN A 56 -1.797 4.572 -8.025 1.00 74.24 O ATOM 788 CB ASN A 56 0.116 6.474 -7.163 1.00 2.50 C ATOM 789 CG ASN A 56 1.251 7.477 -7.199 1.00 14.13 C ATOM 790 OD1 ASN A 56 1.216 8.482 -6.507 1.00 14.21 O ATOM 791 ND2 ASN A 56 2.266 7.210 -7.975 1.00 72.05 N ATOM 0 H ASN A 56 -1.591 8.331 -6.831 1.00 53.21 H new ATOM 0 HA ASN A 56 -0.597 6.865 -9.164 1.00 1.53 H new ATOM 0 HB2 ASN A 56 -0.294 6.429 -6.154 1.00 2.50 H new ATOM 0 HB3 ASN A 56 0.503 5.482 -7.395 1.00 2.50 H new ATOM 0 HD21 ASN A 56 3.060 7.850 -8.015 1.00 72.05 H new ATOM 0 HD22 ASN A 56 2.266 6.362 -8.541 1.00 72.05 H new ATOM 798 N ALA A 57 -3.358 6.162 -8.246 1.00 52.30 N ATOM 799 CA ALA A 57 -4.475 5.212 -8.263 1.00 44.10 C ATOM 800 C ALA A 57 -4.365 4.280 -9.450 1.00 5.53 C ATOM 801 O ALA A 57 -3.998 4.707 -10.560 1.00 24.52 O ATOM 802 CB ALA A 57 -5.812 5.932 -8.302 1.00 54.11 C ATOM 0 H ALA A 57 -3.635 7.140 -8.331 1.00 52.30 H new ATOM 0 HA ALA A 57 -4.422 4.629 -7.343 1.00 44.10 H new ATOM 0 HB1 ALA A 57 -6.619 5.200 -8.314 1.00 54.11 H new ATOM 0 HB2 ALA A 57 -5.910 6.566 -7.421 1.00 54.11 H new ATOM 0 HB3 ALA A 57 -5.868 6.548 -9.200 1.00 54.11 H new ATOM 808 N GLY A 58 -4.649 3.025 -9.215 1.00 71.14 N ATOM 809 CA GLY A 58 -4.574 2.033 -10.254 1.00 33.12 C ATOM 810 C GLY A 58 -3.278 1.263 -10.198 1.00 73.00 C ATOM 811 O GLY A 58 -3.119 0.250 -10.875 1.00 3.03 O ATOM 0 H GLY A 58 -4.937 2.665 -8.305 1.00 71.14 H new ATOM 0 HA2 GLY A 58 -5.412 1.342 -10.159 1.00 33.12 H new ATOM 0 HA3 GLY A 58 -4.668 2.517 -11.226 1.00 33.12 H new ATOM 815 N ALA A 59 -2.352 1.740 -9.395 1.00 33.03 N ATOM 816 CA ALA A 59 -1.072 1.098 -9.259 1.00 34.22 C ATOM 817 C ALA A 59 -1.136 0.010 -8.214 1.00 10.34 C ATOM 818 O ALA A 59 -1.740 0.195 -7.138 1.00 42.22 O ATOM 819 CB ALA A 59 0.005 2.109 -8.910 1.00 45.52 C ATOM 0 H ALA A 59 -2.468 2.577 -8.824 1.00 33.03 H new ATOM 0 HA ALA A 59 -0.814 0.645 -10.216 1.00 34.22 H new ATOM 0 HB1 ALA A 59 0.964 1.600 -8.812 1.00 45.52 H new ATOM 0 HB2 ALA A 59 0.070 2.858 -9.699 1.00 45.52 H new ATOM 0 HB3 ALA A 59 -0.245 2.596 -7.967 1.00 45.52 H new ATOM 825 N ARG A 60 -0.553 -1.119 -8.532 1.00 13.43 N ATOM 826 CA ARG A 60 -0.492 -2.230 -7.630 1.00 2.31 C ATOM 827 C ARG A 60 0.958 -2.421 -7.249 1.00 10.24 C ATOM 828 O ARG A 60 1.835 -2.413 -8.116 1.00 62.42 O ATOM 829 CB ARG A 60 -0.974 -3.518 -8.313 1.00 71.12 C ATOM 830 CG ARG A 60 -2.271 -3.400 -9.099 1.00 32.23 C ATOM 831 CD ARG A 60 -2.703 -4.754 -9.654 1.00 4.31 C ATOM 832 NE ARG A 60 -1.628 -5.423 -10.417 1.00 70.04 N ATOM 833 CZ ARG A 60 -1.802 -6.328 -11.391 1.00 30.04 C ATOM 834 NH1 ARG A 60 -3.020 -6.594 -11.862 1.00 62.05 N ATOM 835 NH2 ARG A 60 -0.745 -6.943 -11.904 1.00 31.02 N ATOM 0 H ARG A 60 -0.105 -1.289 -9.433 1.00 13.43 H new ATOM 0 HA ARG A 60 -1.126 -2.031 -6.766 1.00 2.31 H new ATOM 0 HB2 ARG A 60 -0.191 -3.865 -8.988 1.00 71.12 H new ATOM 0 HB3 ARG A 60 -1.101 -4.287 -7.551 1.00 71.12 H new ATOM 0 HG2 ARG A 60 -3.055 -3.001 -8.455 1.00 32.23 H new ATOM 0 HG3 ARG A 60 -2.140 -2.693 -9.918 1.00 32.23 H new ATOM 0 HD2 ARG A 60 -3.014 -5.398 -8.831 1.00 4.31 H new ATOM 0 HD3 ARG A 60 -3.571 -4.618 -10.299 1.00 4.31 H new ATOM 0 HE ARG A 60 -0.667 -5.174 -10.181 1.00 70.04 H new ATOM 0 HH11 ARG A 60 -3.832 -6.107 -11.481 1.00 62.05 H new ATOM 0 HH12 ARG A 60 -3.141 -7.284 -12.603 1.00 62.05 H new ATOM 0 HH21 ARG A 60 0.189 -6.726 -11.557 1.00 31.02 H new ATOM 0 HH22 ARG A 60 -0.866 -7.633 -12.645 1.00 31.02 H new ATOM 849 N PHE A 61 1.211 -2.608 -6.002 1.00 12.44 N ATOM 850 CA PHE A 61 2.555 -2.829 -5.517 1.00 52.43 C ATOM 851 C PHE A 61 2.528 -4.069 -4.674 1.00 53.25 C ATOM 852 O PHE A 61 1.530 -4.321 -3.997 1.00 64.41 O ATOM 853 CB PHE A 61 3.044 -1.650 -4.672 1.00 14.52 C ATOM 854 CG PHE A 61 3.087 -0.314 -5.373 1.00 51.21 C ATOM 855 CD1 PHE A 61 4.168 0.036 -6.165 1.00 2.33 C ATOM 856 CD2 PHE A 61 2.051 0.595 -5.225 1.00 32.41 C ATOM 857 CE1 PHE A 61 4.214 1.264 -6.796 1.00 61.23 C ATOM 858 CE2 PHE A 61 2.093 1.824 -5.850 1.00 53.25 C ATOM 859 CZ PHE A 61 3.174 2.159 -6.637 1.00 50.31 C ATOM 0 H PHE A 61 0.497 -2.615 -5.274 1.00 12.44 H new ATOM 0 HA PHE A 61 3.236 -2.933 -6.361 1.00 52.43 H new ATOM 0 HB2 PHE A 61 2.398 -1.560 -3.799 1.00 14.52 H new ATOM 0 HB3 PHE A 61 4.045 -1.880 -4.306 1.00 14.52 H new ATOM 0 HD1 PHE A 61 4.985 -0.659 -6.291 1.00 2.33 H new ATOM 0 HD2 PHE A 61 1.200 0.338 -4.612 1.00 32.41 H new ATOM 0 HE1 PHE A 61 5.062 1.524 -7.413 1.00 61.23 H new ATOM 0 HE2 PHE A 61 1.280 2.523 -5.723 1.00 53.25 H new ATOM 0 HZ PHE A 61 3.208 3.120 -7.129 1.00 50.31 H new ATOM 869 N LEU A 62 3.570 -4.848 -4.699 1.00 74.53 N ATOM 870 CA LEU A 62 3.560 -6.067 -3.942 1.00 61.24 C ATOM 871 C LEU A 62 4.612 -6.069 -2.864 1.00 73.35 C ATOM 872 O LEU A 62 5.710 -5.535 -3.037 1.00 13.25 O ATOM 873 CB LEU A 62 3.653 -7.355 -4.815 1.00 35.23 C ATOM 874 CG LEU A 62 4.941 -7.605 -5.635 1.00 30.54 C ATOM 875 CD1 LEU A 62 4.961 -9.045 -6.119 1.00 51.12 C ATOM 876 CD2 LEU A 62 5.019 -6.678 -6.842 1.00 73.01 C ATOM 0 H LEU A 62 4.424 -4.667 -5.226 1.00 74.53 H new ATOM 0 HA LEU A 62 2.580 -6.095 -3.466 1.00 61.24 H new ATOM 0 HB2 LEU A 62 3.509 -8.212 -4.157 1.00 35.23 H new ATOM 0 HB3 LEU A 62 2.815 -7.344 -5.512 1.00 35.23 H new ATOM 0 HG LEU A 62 5.796 -7.407 -4.989 1.00 30.54 H new ATOM 0 HD11 LEU A 62 5.868 -9.222 -6.697 1.00 51.12 H new ATOM 0 HD12 LEU A 62 4.940 -9.717 -5.261 1.00 51.12 H new ATOM 0 HD13 LEU A 62 4.089 -9.230 -6.747 1.00 51.12 H new ATOM 0 HD21 LEU A 62 5.935 -6.879 -7.397 1.00 73.01 H new ATOM 0 HD22 LEU A 62 4.158 -6.849 -7.489 1.00 73.01 H new ATOM 0 HD23 LEU A 62 5.019 -5.641 -6.505 1.00 73.01 H new ATOM 888 N LEU A 63 4.257 -6.651 -1.753 1.00 64.41 N ATOM 889 CA LEU A 63 5.142 -6.827 -0.641 1.00 61.04 C ATOM 890 C LEU A 63 5.867 -8.124 -0.885 1.00 21.34 C ATOM 891 O LEU A 63 5.280 -9.210 -0.776 1.00 4.13 O ATOM 892 CB LEU A 63 4.371 -6.899 0.706 1.00 1.11 C ATOM 893 CG LEU A 63 3.592 -5.645 1.186 1.00 30.23 C ATOM 894 CD1 LEU A 63 4.481 -4.416 1.236 1.00 30.55 C ATOM 895 CD2 LEU A 63 2.335 -5.383 0.356 1.00 62.13 C ATOM 0 H LEU A 63 3.321 -7.024 -1.594 1.00 64.41 H new ATOM 0 HA LEU A 63 5.824 -5.981 -0.564 1.00 61.04 H new ATOM 0 HB2 LEU A 63 3.661 -7.723 0.637 1.00 1.11 H new ATOM 0 HB3 LEU A 63 5.088 -7.161 1.484 1.00 1.11 H new ATOM 0 HG LEU A 63 3.263 -5.860 2.203 1.00 30.23 H new ATOM 0 HD11 LEU A 63 3.899 -3.560 1.576 1.00 30.55 H new ATOM 0 HD12 LEU A 63 5.306 -4.592 1.926 1.00 30.55 H new ATOM 0 HD13 LEU A 63 4.877 -4.213 0.241 1.00 30.55 H new ATOM 0 HD21 LEU A 63 1.828 -4.495 0.734 1.00 62.13 H new ATOM 0 HD22 LEU A 63 2.613 -5.226 -0.686 1.00 62.13 H new ATOM 0 HD23 LEU A 63 1.666 -6.241 0.428 1.00 62.13 H new ATOM 907 N ASP A 64 7.102 -8.015 -1.274 1.00 12.42 N ATOM 908 CA ASP A 64 7.882 -9.176 -1.674 1.00 5.33 C ATOM 909 C ASP A 64 9.197 -9.208 -0.896 1.00 43.31 C ATOM 910 O ASP A 64 10.104 -9.988 -1.167 1.00 13.45 O ATOM 911 CB ASP A 64 8.117 -9.078 -3.197 1.00 64.34 C ATOM 912 CG ASP A 64 8.857 -10.241 -3.803 1.00 11.12 C ATOM 913 OD1 ASP A 64 8.280 -11.335 -3.917 1.00 25.22 O ATOM 914 OD2 ASP A 64 10.022 -10.060 -4.234 1.00 43.15 O ATOM 0 H ASP A 64 7.606 -7.130 -1.327 1.00 12.42 H new ATOM 0 HA ASP A 64 7.356 -10.104 -1.451 1.00 5.33 H new ATOM 0 HB2 ASP A 64 7.151 -8.983 -3.693 1.00 64.34 H new ATOM 0 HB3 ASP A 64 8.674 -8.164 -3.405 1.00 64.34 H new ATOM 919 N GLN A 65 9.265 -8.393 0.109 1.00 54.22 N ATOM 920 CA GLN A 65 10.447 -8.240 0.910 1.00 71.11 C ATOM 921 C GLN A 65 10.018 -7.948 2.322 1.00 22.14 C ATOM 922 O GLN A 65 8.915 -7.449 2.516 1.00 1.54 O ATOM 923 CB GLN A 65 11.345 -7.132 0.334 1.00 43.35 C ATOM 924 CG GLN A 65 10.619 -5.835 0.048 1.00 11.10 C ATOM 925 CD GLN A 65 11.497 -4.804 -0.619 1.00 41.43 C ATOM 926 OE1 GLN A 65 12.707 -4.739 -0.393 1.00 44.35 O ATOM 927 NE2 GLN A 65 10.913 -4.015 -1.461 1.00 71.33 N ATOM 0 H GLN A 65 8.488 -7.802 0.405 1.00 54.22 H new ATOM 0 HA GLN A 65 11.040 -9.154 0.903 1.00 71.11 H new ATOM 0 HB2 GLN A 65 12.156 -6.935 1.035 1.00 43.35 H new ATOM 0 HB3 GLN A 65 11.801 -7.492 -0.588 1.00 43.35 H new ATOM 0 HG2 GLN A 65 9.759 -6.039 -0.589 1.00 11.10 H new ATOM 0 HG3 GLN A 65 10.234 -5.427 0.982 1.00 11.10 H new ATOM 0 HE21 GLN A 65 9.909 -4.096 -1.624 1.00 71.33 H new ATOM 0 HE22 GLN A 65 11.456 -3.312 -1.962 1.00 71.33 H new ATOM 936 N PRO A 66 10.840 -8.279 3.331 1.00 2.31 N ATOM 937 CA PRO A 66 10.494 -8.044 4.732 1.00 62.21 C ATOM 938 C PRO A 66 10.326 -6.559 5.086 1.00 25.21 C ATOM 939 O PRO A 66 9.688 -6.226 6.086 1.00 51.54 O ATOM 940 CB PRO A 66 11.656 -8.663 5.524 1.00 72.15 C ATOM 941 CG PRO A 66 12.776 -8.776 4.554 1.00 61.21 C ATOM 942 CD PRO A 66 12.149 -8.959 3.201 1.00 60.54 C ATOM 0 HA PRO A 66 9.525 -8.486 4.965 1.00 62.21 H new ATOM 0 HB2 PRO A 66 11.932 -8.036 6.372 1.00 72.15 H new ATOM 0 HB3 PRO A 66 11.383 -9.639 5.925 1.00 72.15 H new ATOM 0 HG2 PRO A 66 13.400 -7.882 4.575 1.00 61.21 H new ATOM 0 HG3 PRO A 66 13.420 -9.620 4.801 1.00 61.21 H new ATOM 0 HD2 PRO A 66 12.756 -8.513 2.414 1.00 60.54 H new ATOM 0 HD3 PRO A 66 12.030 -10.014 2.953 1.00 60.54 H new ATOM 950 N THR A 67 10.897 -5.673 4.299 1.00 2.02 N ATOM 951 CA THR A 67 10.774 -4.263 4.564 1.00 60.24 C ATOM 952 C THR A 67 10.501 -3.493 3.264 1.00 64.15 C ATOM 953 O THR A 67 11.287 -3.542 2.318 1.00 2.31 O ATOM 954 CB THR A 67 12.069 -3.744 5.228 1.00 2.03 C ATOM 955 OG1 THR A 67 12.346 -4.548 6.388 1.00 3.32 O ATOM 956 CG2 THR A 67 11.933 -2.283 5.654 1.00 30.24 C ATOM 0 H THR A 67 11.449 -5.907 3.474 1.00 2.02 H new ATOM 0 HA THR A 67 9.934 -4.103 5.241 1.00 60.24 H new ATOM 0 HB THR A 67 12.881 -3.812 4.504 1.00 2.03 H new ATOM 0 HG1 THR A 67 13.167 -4.230 6.818 1.00 3.32 H new ATOM 0 HG21 THR A 67 12.862 -1.951 6.117 1.00 30.24 H new ATOM 0 HG22 THR A 67 11.723 -1.667 4.780 1.00 30.24 H new ATOM 0 HG23 THR A 67 11.116 -2.187 6.370 1.00 30.24 H new ATOM 964 N THR A 68 9.410 -2.795 3.238 1.00 44.44 N ATOM 965 CA THR A 68 9.013 -2.021 2.101 1.00 52.32 C ATOM 966 C THR A 68 8.665 -0.589 2.559 1.00 33.22 C ATOM 967 O THR A 68 7.767 -0.398 3.355 1.00 30.32 O ATOM 968 CB THR A 68 7.774 -2.682 1.456 1.00 1.20 C ATOM 969 OG1 THR A 68 8.062 -4.062 1.152 1.00 13.34 O ATOM 970 CG2 THR A 68 7.392 -1.977 0.184 1.00 21.15 C ATOM 0 H THR A 68 8.757 -2.745 4.020 1.00 44.44 H new ATOM 0 HA THR A 68 9.823 -1.977 1.373 1.00 52.32 H new ATOM 0 HB THR A 68 6.947 -2.615 2.163 1.00 1.20 H new ATOM 0 HG1 THR A 68 7.274 -4.479 0.745 1.00 13.34 H new ATOM 0 HG21 THR A 68 6.517 -2.460 -0.251 1.00 21.15 H new ATOM 0 HG22 THR A 68 7.160 -0.934 0.401 1.00 21.15 H new ATOM 0 HG23 THR A 68 8.222 -2.024 -0.521 1.00 21.15 H new ATOM 978 N THR A 69 9.380 0.395 2.077 1.00 24.41 N ATOM 979 CA THR A 69 9.135 1.767 2.474 1.00 42.21 C ATOM 980 C THR A 69 8.054 2.407 1.590 1.00 42.25 C ATOM 981 O THR A 69 7.887 2.013 0.436 1.00 11.44 O ATOM 982 CB THR A 69 10.442 2.556 2.373 1.00 34.12 C ATOM 983 OG1 THR A 69 11.102 2.207 1.139 1.00 54.32 O ATOM 984 CG2 THR A 69 11.360 2.242 3.549 1.00 44.42 C ATOM 0 H THR A 69 10.140 0.276 1.407 1.00 24.41 H new ATOM 0 HA THR A 69 8.776 1.783 3.503 1.00 42.21 H new ATOM 0 HB THR A 69 10.215 3.622 2.393 1.00 34.12 H new ATOM 0 HG1 THR A 69 11.807 2.861 0.949 1.00 54.32 H new ATOM 0 HG21 THR A 69 12.282 2.815 3.454 1.00 44.42 H new ATOM 0 HG22 THR A 69 10.862 2.509 4.481 1.00 44.42 H new ATOM 0 HG23 THR A 69 11.594 1.177 3.554 1.00 44.42 H new ATOM 992 N ALA A 70 7.310 3.359 2.129 1.00 11.54 N ATOM 993 CA ALA A 70 6.258 4.011 1.373 1.00 70.21 C ATOM 994 C ALA A 70 6.362 5.520 1.440 1.00 44.23 C ATOM 995 O ALA A 70 6.556 6.112 2.540 1.00 5.34 O ATOM 996 CB ALA A 70 4.898 3.566 1.863 1.00 65.02 C ATOM 0 H ALA A 70 7.416 3.696 3.086 1.00 11.54 H new ATOM 0 HA ALA A 70 6.381 3.715 0.331 1.00 70.21 H new ATOM 0 HB1 ALA A 70 4.121 4.066 1.284 1.00 65.02 H new ATOM 0 HB2 ALA A 70 4.803 2.487 1.742 1.00 65.02 H new ATOM 0 HB3 ALA A 70 4.788 3.824 2.916 1.00 65.02 H new ATOM 1002 N GLY A 71 6.202 6.136 0.288 1.00 13.14 N ATOM 1003 CA GLY A 71 6.271 7.551 0.171 1.00 2.41 C ATOM 1004 C GLY A 71 6.687 7.957 -1.225 1.00 0.03 C ATOM 1005 O GLY A 71 6.275 7.352 -2.198 1.00 62.41 O ATOM 0 H GLY A 71 6.020 5.653 -0.592 1.00 13.14 H new ATOM 0 HA2 GLY A 71 5.300 7.987 0.407 1.00 2.41 H new ATOM 0 HA3 GLY A 71 6.983 7.946 0.896 1.00 2.41 H new ATOM 1009 N ARG A 72 7.530 8.927 -1.304 1.00 12.23 N ATOM 1010 CA ARG A 72 8.000 9.492 -2.538 1.00 64.42 C ATOM 1011 C ARG A 72 9.512 9.288 -2.590 1.00 44.11 C ATOM 1012 O ARG A 72 10.130 9.145 -1.528 1.00 74.34 O ATOM 1013 CB ARG A 72 7.630 10.987 -2.600 1.00 14.01 C ATOM 1014 CG ARG A 72 7.726 11.612 -3.988 1.00 35.32 C ATOM 1015 CD ARG A 72 7.290 13.072 -3.965 1.00 70.15 C ATOM 1016 NE ARG A 72 7.219 13.651 -5.306 1.00 74.53 N ATOM 1017 CZ ARG A 72 7.316 14.952 -5.610 1.00 74.23 C ATOM 1018 NH1 ARG A 72 7.342 15.872 -4.645 1.00 54.43 N ATOM 1019 NH2 ARG A 72 7.318 15.323 -6.883 1.00 63.52 N ATOM 0 H ARG A 72 7.933 9.373 -0.480 1.00 12.23 H new ATOM 0 HA ARG A 72 7.537 9.007 -3.397 1.00 64.42 H new ATOM 0 HB2 ARG A 72 6.612 11.111 -2.231 1.00 14.01 H new ATOM 0 HB3 ARG A 72 8.284 11.537 -1.923 1.00 14.01 H new ATOM 0 HG2 ARG A 72 8.751 11.541 -4.352 1.00 35.32 H new ATOM 0 HG3 ARG A 72 7.101 11.054 -4.685 1.00 35.32 H new ATOM 0 HD2 ARG A 72 6.314 13.150 -3.486 1.00 70.15 H new ATOM 0 HD3 ARG A 72 7.989 13.648 -3.359 1.00 70.15 H new ATOM 0 HE ARG A 72 7.083 13.004 -6.082 1.00 74.53 H new ATOM 0 HH11 ARG A 72 7.288 15.587 -3.667 1.00 54.43 H new ATOM 0 HH12 ARG A 72 7.416 16.861 -4.885 1.00 54.43 H new ATOM 0 HH21 ARG A 72 7.246 14.621 -7.619 1.00 63.52 H new ATOM 0 HH22 ARG A 72 7.391 16.311 -7.126 1.00 63.52 H new ATOM 1033 N HIS A 73 10.071 9.183 -3.817 1.00 41.01 N ATOM 1034 CA HIS A 73 11.528 8.961 -4.087 1.00 61.40 C ATOM 1035 C HIS A 73 11.860 7.478 -4.145 1.00 44.45 C ATOM 1036 O HIS A 73 11.070 6.656 -3.699 1.00 23.21 O ATOM 1037 CB HIS A 73 12.481 9.660 -3.064 1.00 74.44 C ATOM 1038 CG HIS A 73 12.647 11.134 -3.188 1.00 41.33 C ATOM 1039 ND1 HIS A 73 13.547 11.843 -2.431 1.00 0.55 N ATOM 1040 CD2 HIS A 73 12.051 12.034 -4.007 1.00 75.23 C ATOM 1041 CE1 HIS A 73 13.490 13.115 -2.795 1.00 34.30 C ATOM 1042 NE2 HIS A 73 12.589 13.293 -3.756 1.00 2.23 N ATOM 0 H HIS A 73 9.518 9.250 -4.672 1.00 41.01 H new ATOM 0 HA HIS A 73 11.704 9.424 -5.058 1.00 61.40 H new ATOM 0 HB2 HIS A 73 12.116 9.444 -2.060 1.00 74.44 H new ATOM 0 HB3 HIS A 73 13.466 9.200 -3.151 1.00 74.44 H new ATOM 0 HD1 HIS A 73 14.156 11.456 -1.710 1.00 0.55 H new ATOM 0 HD2 HIS A 73 11.285 11.811 -4.735 1.00 75.23 H new ATOM 0 HE1 HIS A 73 14.094 13.902 -2.368 1.00 34.30 H new ATOM 1050 N PRO A 74 13.064 7.094 -4.697 1.00 45.23 N ATOM 1051 CA PRO A 74 13.547 5.685 -4.691 1.00 30.41 C ATOM 1052 C PRO A 74 13.862 5.216 -3.260 1.00 0.12 C ATOM 1053 O PRO A 74 14.244 4.069 -3.015 1.00 50.42 O ATOM 1054 CB PRO A 74 14.843 5.738 -5.522 1.00 40.43 C ATOM 1055 CG PRO A 74 14.750 7.004 -6.302 1.00 33.53 C ATOM 1056 CD PRO A 74 14.018 7.970 -5.422 1.00 71.35 C ATOM 0 HA PRO A 74 12.806 4.991 -5.088 1.00 30.41 H new ATOM 0 HB2 PRO A 74 15.724 5.734 -4.880 1.00 40.43 H new ATOM 0 HB3 PRO A 74 14.925 4.874 -6.181 1.00 40.43 H new ATOM 0 HG2 PRO A 74 15.741 7.380 -6.557 1.00 33.53 H new ATOM 0 HG3 PRO A 74 14.217 6.848 -7.240 1.00 33.53 H new ATOM 0 HD2 PRO A 74 14.692 8.487 -4.739 1.00 71.35 H new ATOM 0 HD3 PRO A 74 13.503 8.736 -6.002 1.00 71.35 H new ATOM 1064 N GLU A 75 13.706 6.135 -2.326 1.00 32.32 N ATOM 1065 CA GLU A 75 13.851 5.885 -0.913 1.00 32.12 C ATOM 1066 C GLU A 75 12.639 5.088 -0.439 1.00 31.11 C ATOM 1067 O GLU A 75 12.694 4.355 0.556 1.00 61.42 O ATOM 1068 CB GLU A 75 13.928 7.221 -0.173 1.00 21.03 C ATOM 1069 CG GLU A 75 15.137 8.066 -0.556 1.00 75.32 C ATOM 1070 CD GLU A 75 15.164 9.434 0.105 1.00 65.12 C ATOM 1071 OE1 GLU A 75 15.372 9.508 1.340 1.00 2.42 O ATOM 1072 OE2 GLU A 75 14.991 10.454 -0.612 1.00 62.03 O ATOM 0 H GLU A 75 13.468 7.103 -2.541 1.00 32.32 H new ATOM 0 HA GLU A 75 14.761 5.319 -0.713 1.00 32.12 H new ATOM 0 HB2 GLU A 75 13.020 7.790 -0.374 1.00 21.03 H new ATOM 0 HB3 GLU A 75 13.954 7.031 0.900 1.00 21.03 H new ATOM 0 HG2 GLU A 75 16.045 7.526 -0.289 1.00 75.32 H new ATOM 0 HG3 GLU A 75 15.150 8.195 -1.638 1.00 75.32 H new ATOM 1079 N SER A 76 11.575 5.191 -1.192 1.00 24.32 N ATOM 1080 CA SER A 76 10.364 4.496 -0.919 1.00 2.45 C ATOM 1081 C SER A 76 10.127 3.443 -2.002 1.00 62.32 C ATOM 1082 O SER A 76 10.261 3.729 -3.194 1.00 4.14 O ATOM 1083 CB SER A 76 9.232 5.495 -0.873 1.00 74.03 C ATOM 1084 OG SER A 76 9.487 6.490 0.117 1.00 52.42 O ATOM 0 H SER A 76 11.535 5.775 -2.027 1.00 24.32 H new ATOM 0 HA SER A 76 10.423 3.986 0.043 1.00 2.45 H new ATOM 0 HB2 SER A 76 9.114 5.966 -1.849 1.00 74.03 H new ATOM 0 HB3 SER A 76 8.296 4.983 -0.651 1.00 74.03 H new ATOM 0 HG SER A 76 9.711 7.337 -0.321 1.00 52.42 H new ATOM 1090 N ASP A 77 9.850 2.220 -1.589 1.00 41.21 N ATOM 1091 CA ASP A 77 9.579 1.139 -2.536 1.00 12.44 C ATOM 1092 C ASP A 77 8.164 1.277 -3.079 1.00 53.33 C ATOM 1093 O ASP A 77 7.886 0.963 -4.238 1.00 30.52 O ATOM 1094 CB ASP A 77 9.789 -0.230 -1.896 1.00 5.43 C ATOM 1095 CG ASP A 77 9.793 -1.361 -2.914 1.00 44.22 C ATOM 1096 OD1 ASP A 77 10.816 -1.503 -3.633 1.00 10.25 O ATOM 1097 OD2 ASP A 77 8.816 -2.156 -2.982 1.00 73.33 O ATOM 0 H ASP A 77 9.805 1.945 -0.608 1.00 41.21 H new ATOM 0 HA ASP A 77 10.285 1.217 -3.363 1.00 12.44 H new ATOM 0 HB2 ASP A 77 10.735 -0.232 -1.354 1.00 5.43 H new ATOM 0 HB3 ASP A 77 9.001 -0.409 -1.164 1.00 5.43 H new ATOM 1102 N ILE A 78 7.272 1.757 -2.239 1.00 52.33 N ATOM 1103 CA ILE A 78 5.922 2.075 -2.652 1.00 4.23 C ATOM 1104 C ILE A 78 5.954 3.532 -3.056 1.00 24.54 C ATOM 1105 O ILE A 78 5.989 4.420 -2.192 1.00 64.24 O ATOM 1106 CB ILE A 78 4.879 1.914 -1.498 1.00 12.11 C ATOM 1107 CG1 ILE A 78 4.952 0.527 -0.837 1.00 33.14 C ATOM 1108 CG2 ILE A 78 3.461 2.190 -2.001 1.00 25.34 C ATOM 1109 CD1 ILE A 78 4.628 -0.633 -1.747 1.00 23.33 C ATOM 0 H ILE A 78 7.462 1.937 -1.253 1.00 52.33 H new ATOM 0 HA ILE A 78 5.619 1.398 -3.451 1.00 4.23 H new ATOM 0 HB ILE A 78 5.133 2.652 -0.737 1.00 12.11 H new ATOM 0 HG12 ILE A 78 5.956 0.385 -0.436 1.00 33.14 H new ATOM 0 HG13 ILE A 78 4.265 0.508 0.009 1.00 33.14 H new ATOM 0 HG21 ILE A 78 2.754 2.072 -1.180 1.00 25.34 H new ATOM 0 HG22 ILE A 78 3.403 3.208 -2.386 1.00 25.34 H new ATOM 0 HG23 ILE A 78 3.214 1.487 -2.797 1.00 25.34 H new ATOM 0 HD11 ILE A 78 4.707 -1.566 -1.189 1.00 23.33 H new ATOM 0 HD12 ILE A 78 3.613 -0.523 -2.129 1.00 23.33 H new ATOM 0 HD13 ILE A 78 5.330 -0.648 -2.581 1.00 23.33 H new ATOM 1121 N PHE A 79 6.006 3.773 -4.340 1.00 71.23 N ATOM 1122 CA PHE A 79 6.140 5.111 -4.845 1.00 41.12 C ATOM 1123 C PHE A 79 4.796 5.793 -5.029 1.00 23.13 C ATOM 1124 O PHE A 79 3.973 5.388 -5.861 1.00 41.31 O ATOM 1125 CB PHE A 79 6.952 5.131 -6.152 1.00 1.42 C ATOM 1126 CG PHE A 79 7.123 6.511 -6.743 1.00 71.14 C ATOM 1127 CD1 PHE A 79 8.009 7.416 -6.185 1.00 25.12 C ATOM 1128 CD2 PHE A 79 6.393 6.897 -7.858 1.00 41.41 C ATOM 1129 CE1 PHE A 79 8.158 8.677 -6.725 1.00 70.34 C ATOM 1130 CE2 PHE A 79 6.541 8.152 -8.400 1.00 14.14 C ATOM 1131 CZ PHE A 79 7.424 9.044 -7.833 1.00 42.10 C ATOM 0 H PHE A 79 5.957 3.052 -5.059 1.00 71.23 H new ATOM 0 HA PHE A 79 6.687 5.681 -4.094 1.00 41.12 H new ATOM 0 HB2 PHE A 79 7.936 4.702 -5.964 1.00 1.42 H new ATOM 0 HB3 PHE A 79 6.460 4.491 -6.884 1.00 1.42 H new ATOM 0 HD1 PHE A 79 8.589 7.133 -5.319 1.00 25.12 H new ATOM 0 HD2 PHE A 79 5.699 6.202 -8.307 1.00 41.41 H new ATOM 0 HE1 PHE A 79 8.850 9.377 -6.280 1.00 70.34 H new ATOM 0 HE2 PHE A 79 5.966 8.438 -9.268 1.00 14.14 H new ATOM 0 HZ PHE A 79 7.541 10.031 -8.256 1.00 42.10 H new ATOM 1141 N LEU A 80 4.599 6.802 -4.243 1.00 23.44 N ATOM 1142 CA LEU A 80 3.454 7.660 -4.284 1.00 63.14 C ATOM 1143 C LEU A 80 3.989 9.054 -4.565 1.00 60.33 C ATOM 1144 O LEU A 80 4.911 9.517 -3.882 1.00 70.43 O ATOM 1145 CB LEU A 80 2.747 7.639 -2.920 1.00 34.11 C ATOM 1146 CG LEU A 80 2.287 6.261 -2.409 1.00 45.15 C ATOM 1147 CD1 LEU A 80 1.692 6.381 -1.016 1.00 72.35 C ATOM 1148 CD2 LEU A 80 1.275 5.634 -3.364 1.00 53.52 C ATOM 0 H LEU A 80 5.266 7.065 -3.517 1.00 23.44 H new ATOM 0 HA LEU A 80 2.737 7.345 -5.042 1.00 63.14 H new ATOM 0 HB2 LEU A 80 3.420 8.071 -2.179 1.00 34.11 H new ATOM 0 HB3 LEU A 80 1.875 8.291 -2.977 1.00 34.11 H new ATOM 0 HG LEU A 80 3.160 5.611 -2.362 1.00 45.15 H new ATOM 0 HD11 LEU A 80 1.372 5.398 -0.671 1.00 72.35 H new ATOM 0 HD12 LEU A 80 2.442 6.779 -0.333 1.00 72.35 H new ATOM 0 HD13 LEU A 80 0.834 7.052 -1.044 1.00 72.35 H new ATOM 0 HD21 LEU A 80 0.966 4.662 -2.980 1.00 53.52 H new ATOM 0 HD22 LEU A 80 0.404 6.284 -3.449 1.00 53.52 H new ATOM 0 HD23 LEU A 80 1.731 5.508 -4.346 1.00 53.52 H new ATOM 1160 N ASP A 81 3.472 9.711 -5.556 1.00 54.24 N ATOM 1161 CA ASP A 81 4.001 11.006 -5.913 1.00 43.34 C ATOM 1162 C ASP A 81 3.040 12.083 -5.477 1.00 53.51 C ATOM 1163 O ASP A 81 1.893 12.158 -5.945 1.00 10.13 O ATOM 1164 CB ASP A 81 4.293 11.077 -7.416 1.00 21.32 C ATOM 1165 CG ASP A 81 5.037 12.333 -7.827 1.00 3.42 C ATOM 1166 OD1 ASP A 81 6.256 12.456 -7.529 1.00 11.20 O ATOM 1167 OD2 ASP A 81 4.443 13.205 -8.480 1.00 54.12 O ATOM 0 H ASP A 81 2.695 9.385 -6.130 1.00 54.24 H new ATOM 0 HA ASP A 81 4.947 11.165 -5.396 1.00 43.34 H new ATOM 0 HB2 ASP A 81 4.879 10.205 -7.706 1.00 21.32 H new ATOM 0 HB3 ASP A 81 3.352 11.025 -7.964 1.00 21.32 H new ATOM 1172 N ASP A 82 3.506 12.909 -4.584 1.00 21.03 N ATOM 1173 CA ASP A 82 2.688 13.936 -3.979 1.00 54.25 C ATOM 1174 C ASP A 82 3.292 15.295 -4.284 1.00 11.43 C ATOM 1175 O ASP A 82 4.335 15.378 -4.930 1.00 53.12 O ATOM 1176 CB ASP A 82 2.596 13.703 -2.443 1.00 4.23 C ATOM 1177 CG ASP A 82 1.669 14.690 -1.739 1.00 41.51 C ATOM 1178 OD1 ASP A 82 0.451 14.535 -1.851 1.00 72.53 O ATOM 1179 OD2 ASP A 82 2.174 15.668 -1.130 1.00 24.30 O ATOM 0 H ASP A 82 4.469 12.893 -4.249 1.00 21.03 H new ATOM 0 HA ASP A 82 1.679 13.897 -4.389 1.00 54.25 H new ATOM 0 HB2 ASP A 82 2.244 12.688 -2.257 1.00 4.23 H new ATOM 0 HB3 ASP A 82 3.593 13.779 -2.010 1.00 4.23 H new ATOM 1184 N VAL A 83 2.641 16.332 -3.847 1.00 14.43 N ATOM 1185 CA VAL A 83 3.107 17.682 -3.976 1.00 74.44 C ATOM 1186 C VAL A 83 4.323 17.852 -3.054 1.00 31.24 C ATOM 1187 O VAL A 83 5.302 18.532 -3.387 1.00 72.42 O ATOM 1188 CB VAL A 83 1.985 18.665 -3.527 1.00 3.03 C ATOM 1189 CG1 VAL A 83 2.400 20.112 -3.706 1.00 73.10 C ATOM 1190 CG2 VAL A 83 0.681 18.376 -4.260 1.00 0.15 C ATOM 0 H VAL A 83 1.740 16.259 -3.375 1.00 14.43 H new ATOM 0 HA VAL A 83 3.375 17.893 -5.011 1.00 74.44 H new ATOM 0 HB VAL A 83 1.819 18.504 -2.462 1.00 3.03 H new ATOM 0 HG11 VAL A 83 1.590 20.766 -3.382 1.00 73.10 H new ATOM 0 HG12 VAL A 83 3.289 20.312 -3.108 1.00 73.10 H new ATOM 0 HG13 VAL A 83 2.619 20.300 -4.757 1.00 73.10 H new ATOM 0 HG21 VAL A 83 -0.086 19.076 -3.928 1.00 0.15 H new ATOM 0 HG22 VAL A 83 0.834 18.488 -5.333 1.00 0.15 H new ATOM 0 HG23 VAL A 83 0.360 17.357 -4.044 1.00 0.15 H new ATOM 1200 N THR A 84 4.256 17.190 -1.932 1.00 53.35 N ATOM 1201 CA THR A 84 5.276 17.225 -0.937 1.00 72.13 C ATOM 1202 C THR A 84 6.171 15.986 -1.102 1.00 42.12 C ATOM 1203 O THR A 84 5.729 14.945 -1.619 1.00 33.35 O ATOM 1204 CB THR A 84 4.601 17.172 0.445 1.00 13.21 C ATOM 1205 OG1 THR A 84 3.475 18.063 0.444 1.00 52.33 O ATOM 1206 CG2 THR A 84 5.563 17.594 1.541 1.00 43.31 C ATOM 0 H THR A 84 3.465 16.596 -1.684 1.00 53.35 H new ATOM 0 HA THR A 84 5.875 18.131 -1.034 1.00 72.13 H new ATOM 0 HB THR A 84 4.285 16.147 0.639 1.00 13.21 H new ATOM 0 HG1 THR A 84 2.781 17.714 1.041 1.00 52.33 H new ATOM 0 HG21 THR A 84 5.058 17.547 2.506 1.00 43.31 H new ATOM 0 HG22 THR A 84 6.423 16.924 1.548 1.00 43.31 H new ATOM 0 HG23 THR A 84 5.899 18.614 1.357 1.00 43.31 H new ATOM 1214 N VAL A 85 7.426 16.080 -0.728 1.00 3.33 N ATOM 1215 CA VAL A 85 8.247 14.912 -0.782 1.00 32.23 C ATOM 1216 C VAL A 85 8.188 14.165 0.531 1.00 2.32 C ATOM 1217 O VAL A 85 8.854 14.518 1.515 1.00 11.40 O ATOM 1218 CB VAL A 85 9.722 15.176 -1.156 1.00 73.24 C ATOM 1219 CG1 VAL A 85 10.503 13.866 -1.160 1.00 54.25 C ATOM 1220 CG2 VAL A 85 9.845 15.845 -2.512 1.00 10.33 C ATOM 0 H VAL A 85 7.882 16.929 -0.394 1.00 3.33 H new ATOM 0 HA VAL A 85 7.831 14.310 -1.590 1.00 32.23 H new ATOM 0 HB VAL A 85 10.136 15.850 -0.407 1.00 73.24 H new ATOM 0 HG11 VAL A 85 11.542 14.063 -1.425 1.00 54.25 H new ATOM 0 HG12 VAL A 85 10.460 13.414 -0.169 1.00 54.25 H new ATOM 0 HG13 VAL A 85 10.066 13.184 -1.889 1.00 54.25 H new ATOM 0 HG21 VAL A 85 10.897 16.014 -2.740 1.00 10.33 H new ATOM 0 HG22 VAL A 85 9.407 15.202 -3.276 1.00 10.33 H new ATOM 0 HG23 VAL A 85 9.319 16.800 -2.496 1.00 10.33 H new ATOM 1230 N SER A 86 7.379 13.166 0.558 1.00 63.11 N ATOM 1231 CA SER A 86 7.331 12.293 1.666 1.00 40.32 C ATOM 1232 C SER A 86 8.377 11.215 1.449 1.00 33.44 C ATOM 1233 O SER A 86 8.073 10.138 0.991 1.00 45.44 O ATOM 1234 CB SER A 86 5.927 11.711 1.802 1.00 0.11 C ATOM 1235 OG SER A 86 4.986 12.766 1.844 1.00 61.23 O ATOM 0 H SER A 86 6.730 12.934 -0.194 1.00 63.11 H new ATOM 0 HA SER A 86 7.549 12.818 2.596 1.00 40.32 H new ATOM 0 HB2 SER A 86 5.712 11.050 0.963 1.00 0.11 H new ATOM 0 HB3 SER A 86 5.857 11.109 2.708 1.00 0.11 H new ATOM 0 HG SER A 86 4.491 12.729 2.689 1.00 61.23 H new ATOM 1241 N ARG A 87 9.628 11.574 1.714 1.00 11.35 N ATOM 1242 CA ARG A 87 10.796 10.700 1.500 1.00 32.01 C ATOM 1243 C ARG A 87 10.678 9.385 2.269 1.00 63.43 C ATOM 1244 O ARG A 87 11.304 8.386 1.906 1.00 65.32 O ATOM 1245 CB ARG A 87 12.092 11.436 1.887 1.00 33.34 C ATOM 1246 CG ARG A 87 12.081 11.954 3.313 1.00 2.12 C ATOM 1247 CD ARG A 87 13.355 12.665 3.694 1.00 62.31 C ATOM 1248 NE ARG A 87 13.251 13.224 5.055 1.00 21.41 N ATOM 1249 CZ ARG A 87 14.129 12.993 6.050 1.00 25.11 C ATOM 1250 NH1 ARG A 87 15.289 12.395 5.797 1.00 30.53 N ATOM 1251 NH2 ARG A 87 13.858 13.405 7.283 1.00 74.33 N ATOM 0 H ARG A 87 9.872 12.491 2.089 1.00 11.35 H new ATOM 0 HA ARG A 87 10.829 10.452 0.439 1.00 32.01 H new ATOM 0 HB2 ARG A 87 12.938 10.761 1.759 1.00 33.34 H new ATOM 0 HB3 ARG A 87 12.245 12.272 1.205 1.00 33.34 H new ATOM 0 HG2 ARG A 87 11.240 12.636 3.439 1.00 2.12 H new ATOM 0 HG3 ARG A 87 11.920 11.119 3.995 1.00 2.12 H new ATOM 0 HD2 ARG A 87 14.194 11.971 3.643 1.00 62.31 H new ATOM 0 HD3 ARG A 87 13.559 13.464 2.981 1.00 62.31 H new ATOM 0 HE ARG A 87 12.456 13.830 5.258 1.00 21.41 H new ATOM 0 HH11 ARG A 87 15.518 12.108 4.845 1.00 30.53 H new ATOM 0 HH12 ARG A 87 15.950 12.223 6.555 1.00 30.53 H new ATOM 0 HH21 ARG A 87 12.985 13.896 7.476 1.00 74.33 H new ATOM 0 HH22 ARG A 87 14.523 13.230 8.037 1.00 74.33 H new ATOM 1265 N ARG A 88 9.885 9.403 3.335 1.00 61.21 N ATOM 1266 CA ARG A 88 9.635 8.239 4.143 1.00 13.23 C ATOM 1267 C ARG A 88 8.550 8.577 5.161 1.00 73.54 C ATOM 1268 O ARG A 88 8.824 9.237 6.170 1.00 64.15 O ATOM 1269 CB ARG A 88 10.921 7.828 4.866 1.00 43.05 C ATOM 1270 CG ARG A 88 10.883 6.495 5.581 1.00 14.33 C ATOM 1271 CD ARG A 88 12.211 6.260 6.280 1.00 62.13 C ATOM 1272 NE ARG A 88 12.288 4.965 6.957 1.00 43.12 N ATOM 1273 CZ ARG A 88 13.270 4.609 7.796 1.00 75.13 C ATOM 1274 NH1 ARG A 88 14.236 5.477 8.118 1.00 21.11 N ATOM 1275 NH2 ARG A 88 13.285 3.392 8.306 1.00 0.51 N ATOM 0 H ARG A 88 9.398 10.240 3.656 1.00 61.21 H new ATOM 0 HA ARG A 88 9.306 7.411 3.515 1.00 13.23 H new ATOM 0 HB2 ARG A 88 11.732 7.804 4.138 1.00 43.05 H new ATOM 0 HB3 ARG A 88 11.168 8.601 5.593 1.00 43.05 H new ATOM 0 HG2 ARG A 88 10.070 6.482 6.307 1.00 14.33 H new ATOM 0 HG3 ARG A 88 10.687 5.693 4.869 1.00 14.33 H new ATOM 0 HD2 ARG A 88 13.016 6.328 5.548 1.00 62.13 H new ATOM 0 HD3 ARG A 88 12.375 7.054 7.009 1.00 62.13 H new ATOM 0 HE ARG A 88 11.545 4.289 6.778 1.00 43.12 H new ATOM 0 HH11 ARG A 88 14.228 6.418 7.724 1.00 21.11 H new ATOM 0 HH12 ARG A 88 14.980 5.198 8.758 1.00 21.11 H new ATOM 0 HH21 ARG A 88 12.551 2.727 8.061 1.00 0.51 H new ATOM 0 HH22 ARG A 88 14.030 3.116 8.945 1.00 0.51 H new ATOM 1289 N HIS A 89 7.319 8.214 4.861 1.00 31.53 N ATOM 1290 CA HIS A 89 6.226 8.422 5.812 1.00 13.20 C ATOM 1291 C HIS A 89 5.971 7.116 6.519 1.00 41.45 C ATOM 1292 O HIS A 89 6.010 7.040 7.743 1.00 1.13 O ATOM 1293 CB HIS A 89 4.924 8.901 5.086 1.00 43.41 C ATOM 1294 CG HIS A 89 3.670 9.146 5.970 1.00 24.22 C ATOM 1295 ND1 HIS A 89 2.701 10.045 5.590 1.00 13.53 N ATOM 1296 CD2 HIS A 89 3.236 8.515 7.107 1.00 34.32 C ATOM 1297 CE1 HIS A 89 1.720 9.922 6.486 1.00 62.35 C ATOM 1298 NE2 HIS A 89 2.012 9.014 7.409 1.00 72.41 N ATOM 0 H HIS A 89 7.044 7.779 3.980 1.00 31.53 H new ATOM 0 HA HIS A 89 6.507 9.198 6.524 1.00 13.20 H new ATOM 0 HB2 HIS A 89 5.152 9.827 4.558 1.00 43.41 H new ATOM 0 HB3 HIS A 89 4.666 8.159 4.330 1.00 43.41 H new ATOM 0 HD1 HIS A 89 2.727 10.676 4.789 1.00 13.53 H new ATOM 0 HD2 HIS A 89 3.771 7.758 7.661 1.00 34.32 H new ATOM 0 HE1 HIS A 89 0.802 10.491 6.463 1.00 62.35 H new ATOM 1306 N ALA A 90 5.787 6.076 5.751 1.00 40.41 N ATOM 1307 CA ALA A 90 5.427 4.816 6.314 1.00 65.15 C ATOM 1308 C ALA A 90 6.377 3.747 5.877 1.00 72.52 C ATOM 1309 O ALA A 90 7.050 3.871 4.844 1.00 40.22 O ATOM 1310 CB ALA A 90 3.995 4.454 5.942 1.00 10.51 C ATOM 0 H ALA A 90 5.882 6.083 4.735 1.00 40.41 H new ATOM 0 HA ALA A 90 5.488 4.897 7.399 1.00 65.15 H new ATOM 0 HB1 ALA A 90 3.738 3.490 6.380 1.00 10.51 H new ATOM 0 HB2 ALA A 90 3.316 5.218 6.322 1.00 10.51 H new ATOM 0 HB3 ALA A 90 3.905 4.395 4.857 1.00 10.51 H new ATOM 1316 N GLU A 91 6.461 2.738 6.665 1.00 42.14 N ATOM 1317 CA GLU A 91 7.247 1.601 6.374 1.00 15.23 C ATOM 1318 C GLU A 91 6.361 0.391 6.608 1.00 74.53 C ATOM 1319 O GLU A 91 5.708 0.282 7.651 1.00 13.55 O ATOM 1320 CB GLU A 91 8.488 1.601 7.296 1.00 33.12 C ATOM 1321 CG GLU A 91 9.511 0.506 7.033 1.00 72.04 C ATOM 1322 CD GLU A 91 10.761 0.671 7.882 1.00 1.14 C ATOM 1323 OE1 GLU A 91 11.620 1.504 7.532 1.00 42.24 O ATOM 1324 OE2 GLU A 91 10.929 -0.037 8.907 1.00 73.12 O ATOM 0 H GLU A 91 5.969 2.681 7.557 1.00 42.14 H new ATOM 0 HA GLU A 91 7.610 1.593 5.346 1.00 15.23 H new ATOM 0 HB2 GLU A 91 8.986 2.566 7.203 1.00 33.12 H new ATOM 0 HB3 GLU A 91 8.150 1.515 8.329 1.00 33.12 H new ATOM 0 HG2 GLU A 91 9.061 -0.466 7.237 1.00 72.04 H new ATOM 0 HG3 GLU A 91 9.787 0.514 5.978 1.00 72.04 H new ATOM 1331 N PHE A 92 6.311 -0.472 5.646 1.00 10.12 N ATOM 1332 CA PHE A 92 5.531 -1.670 5.720 1.00 43.04 C ATOM 1333 C PHE A 92 6.487 -2.787 5.939 1.00 21.30 C ATOM 1334 O PHE A 92 7.428 -2.967 5.158 1.00 1.35 O ATOM 1335 CB PHE A 92 4.774 -1.944 4.408 1.00 31.55 C ATOM 1336 CG PHE A 92 3.759 -0.913 4.007 1.00 14.45 C ATOM 1337 CD1 PHE A 92 2.608 -0.749 4.739 1.00 31.22 C ATOM 1338 CD2 PHE A 92 3.942 -0.138 2.875 1.00 54.23 C ATOM 1339 CE1 PHE A 92 1.651 0.174 4.361 1.00 63.33 C ATOM 1340 CE2 PHE A 92 2.989 0.788 2.494 1.00 0.22 C ATOM 1341 CZ PHE A 92 1.843 0.943 3.239 1.00 63.51 C ATOM 0 H PHE A 92 6.820 -0.364 4.769 1.00 10.12 H new ATOM 0 HA PHE A 92 4.796 -1.572 6.519 1.00 43.04 H new ATOM 0 HB2 PHE A 92 5.504 -2.039 3.604 1.00 31.55 H new ATOM 0 HB3 PHE A 92 4.270 -2.906 4.497 1.00 31.55 H new ATOM 0 HD1 PHE A 92 2.449 -1.350 5.622 1.00 31.22 H new ATOM 0 HD2 PHE A 92 4.838 -0.258 2.284 1.00 54.23 H new ATOM 0 HE1 PHE A 92 0.752 0.291 4.948 1.00 63.33 H new ATOM 0 HE2 PHE A 92 3.144 1.390 1.611 1.00 0.22 H new ATOM 0 HZ PHE A 92 1.097 1.666 2.943 1.00 63.51 H new ATOM 1351 N ARG A 93 6.312 -3.499 6.981 1.00 4.54 N ATOM 1352 CA ARG A 93 7.192 -4.574 7.260 1.00 31.05 C ATOM 1353 C ARG A 93 6.433 -5.841 7.434 1.00 14.42 C ATOM 1354 O ARG A 93 5.296 -5.853 7.906 1.00 54.24 O ATOM 1355 CB ARG A 93 8.053 -4.296 8.490 1.00 44.31 C ATOM 1356 CG ARG A 93 8.947 -3.087 8.335 1.00 62.02 C ATOM 1357 CD ARG A 93 9.840 -2.884 9.532 1.00 33.35 C ATOM 1358 NE ARG A 93 9.089 -2.699 10.773 1.00 14.11 N ATOM 1359 CZ ARG A 93 9.349 -1.778 11.689 1.00 41.13 C ATOM 1360 NH1 ARG A 93 10.147 -0.744 11.412 1.00 12.13 N ATOM 1361 NH2 ARG A 93 8.717 -1.828 12.832 1.00 53.23 N ATOM 0 H ARG A 93 5.565 -3.361 7.662 1.00 4.54 H new ATOM 0 HA ARG A 93 7.860 -4.679 6.405 1.00 31.05 H new ATOM 0 HB2 ARG A 93 7.404 -4.151 9.354 1.00 44.31 H new ATOM 0 HB3 ARG A 93 8.669 -5.170 8.698 1.00 44.31 H new ATOM 0 HG2 ARG A 93 9.560 -3.203 7.441 1.00 62.02 H new ATOM 0 HG3 ARG A 93 8.332 -2.199 8.187 1.00 62.02 H new ATOM 0 HD2 ARG A 93 10.501 -3.745 9.637 1.00 33.35 H new ATOM 0 HD3 ARG A 93 10.474 -2.014 9.363 1.00 33.35 H new ATOM 0 HE ARG A 93 8.305 -3.327 10.947 1.00 14.11 H new ATOM 0 HH11 ARG A 93 10.565 -0.656 10.486 1.00 12.13 H new ATOM 0 HH12 ARG A 93 10.339 -0.042 12.127 1.00 12.13 H new ATOM 0 HH21 ARG A 93 8.037 -2.568 13.007 1.00 53.23 H new ATOM 0 HH22 ARG A 93 8.904 -1.127 13.549 1.00 53.23 H new ATOM 1375 N ILE A 94 7.035 -6.885 7.021 1.00 74.02 N ATOM 1376 CA ILE A 94 6.508 -8.192 7.193 1.00 52.44 C ATOM 1377 C ILE A 94 7.337 -8.741 8.316 1.00 50.44 C ATOM 1378 O ILE A 94 8.542 -8.942 8.166 1.00 53.33 O ATOM 1379 CB ILE A 94 6.677 -9.049 5.873 1.00 11.52 C ATOM 1380 CG1 ILE A 94 5.782 -8.540 4.709 1.00 60.53 C ATOM 1381 CG2 ILE A 94 6.421 -10.523 6.102 1.00 1.51 C ATOM 1382 CD1 ILE A 94 6.131 -7.177 4.137 1.00 2.21 C ATOM 0 H ILE A 94 7.934 -6.862 6.539 1.00 74.02 H new ATOM 0 HA ILE A 94 5.439 -8.206 7.407 1.00 52.44 H new ATOM 0 HB ILE A 94 7.720 -8.921 5.584 1.00 11.52 H new ATOM 0 HG12 ILE A 94 5.823 -9.271 3.901 1.00 60.53 H new ATOM 0 HG13 ILE A 94 4.750 -8.510 5.059 1.00 60.53 H new ATOM 0 HG21 ILE A 94 6.550 -11.065 5.165 1.00 1.51 H new ATOM 0 HG22 ILE A 94 7.125 -10.904 6.842 1.00 1.51 H new ATOM 0 HG23 ILE A 94 5.403 -10.663 6.465 1.00 1.51 H new ATOM 0 HD11 ILE A 94 5.437 -6.931 3.333 1.00 2.21 H new ATOM 0 HD12 ILE A 94 6.058 -6.424 4.921 1.00 2.21 H new ATOM 0 HD13 ILE A 94 7.148 -7.196 3.746 1.00 2.21 H new ATOM 1394 N ASN A 95 6.721 -8.931 9.435 1.00 4.50 N ATOM 1395 CA ASN A 95 7.432 -9.237 10.647 1.00 32.44 C ATOM 1396 C ASN A 95 6.715 -10.300 11.434 1.00 50.33 C ATOM 1397 O ASN A 95 5.573 -10.109 11.834 1.00 72.33 O ATOM 1398 CB ASN A 95 7.536 -7.946 11.465 1.00 15.25 C ATOM 1399 CG ASN A 95 8.214 -8.091 12.809 1.00 11.13 C ATOM 1400 OD1 ASN A 95 9.107 -8.912 12.995 1.00 53.42 O ATOM 1401 ND2 ASN A 95 7.805 -7.279 13.747 1.00 51.24 N ATOM 0 H ASN A 95 5.708 -8.880 9.543 1.00 4.50 H new ATOM 0 HA ASN A 95 8.425 -9.621 10.411 1.00 32.44 H new ATOM 0 HB2 ASN A 95 8.080 -7.206 10.879 1.00 15.25 H new ATOM 0 HB3 ASN A 95 6.532 -7.552 11.623 1.00 15.25 H new ATOM 0 HD21 ASN A 95 8.231 -7.314 14.673 1.00 51.24 H new ATOM 0 HD22 ASN A 95 7.060 -6.610 13.553 1.00 51.24 H new ATOM 1408 N GLU A 96 7.387 -11.422 11.628 1.00 72.51 N ATOM 1409 CA GLU A 96 6.888 -12.567 12.404 1.00 1.11 C ATOM 1410 C GLU A 96 5.508 -13.043 11.919 1.00 2.42 C ATOM 1411 O GLU A 96 4.663 -13.483 12.708 1.00 51.24 O ATOM 1412 CB GLU A 96 6.889 -12.238 13.905 1.00 44.23 C ATOM 1413 CG GLU A 96 8.282 -11.922 14.438 1.00 4.23 C ATOM 1414 CD GLU A 96 8.323 -11.731 15.928 1.00 20.41 C ATOM 1415 OE1 GLU A 96 8.273 -12.732 16.658 1.00 3.44 O ATOM 1416 OE2 GLU A 96 8.470 -10.577 16.408 1.00 0.34 O ATOM 0 H GLU A 96 8.320 -11.575 11.244 1.00 72.51 H new ATOM 0 HA GLU A 96 7.569 -13.402 12.240 1.00 1.11 H new ATOM 0 HB2 GLU A 96 6.233 -11.386 14.086 1.00 44.23 H new ATOM 0 HB3 GLU A 96 6.476 -13.082 14.458 1.00 44.23 H new ATOM 0 HG2 GLU A 96 8.960 -12.731 14.164 1.00 4.23 H new ATOM 0 HG3 GLU A 96 8.652 -11.019 13.953 1.00 4.23 H new ATOM 1423 N GLY A 97 5.322 -13.003 10.609 1.00 11.12 N ATOM 1424 CA GLY A 97 4.087 -13.455 9.995 1.00 74.42 C ATOM 1425 C GLY A 97 3.011 -12.384 9.938 1.00 51.50 C ATOM 1426 O GLY A 97 1.930 -12.618 9.399 1.00 40.23 O ATOM 0 H GLY A 97 6.018 -12.659 9.947 1.00 11.12 H new ATOM 0 HA2 GLY A 97 4.299 -13.800 8.983 1.00 74.42 H new ATOM 0 HA3 GLY A 97 3.706 -14.312 10.551 1.00 74.42 H new ATOM 1430 N GLU A 98 3.291 -11.230 10.490 1.00 1.21 N ATOM 1431 CA GLU A 98 2.348 -10.144 10.509 1.00 2.44 C ATOM 1432 C GLU A 98 2.774 -9.094 9.515 1.00 50.14 C ATOM 1433 O GLU A 98 3.968 -8.945 9.236 1.00 31.31 O ATOM 1434 CB GLU A 98 2.315 -9.516 11.899 1.00 12.30 C ATOM 1435 CG GLU A 98 2.026 -10.501 13.003 1.00 73.23 C ATOM 1436 CD GLU A 98 2.012 -9.856 14.365 1.00 11.41 C ATOM 1437 OE1 GLU A 98 1.026 -9.187 14.720 1.00 31.33 O ATOM 1438 OE2 GLU A 98 2.997 -10.026 15.112 1.00 70.12 O ATOM 0 H GLU A 98 4.182 -11.018 10.939 1.00 1.21 H new ATOM 0 HA GLU A 98 1.360 -10.525 10.252 1.00 2.44 H new ATOM 0 HB2 GLU A 98 3.274 -9.036 12.094 1.00 12.30 H new ATOM 0 HB3 GLU A 98 1.558 -8.732 11.916 1.00 12.30 H new ATOM 0 HG2 GLU A 98 1.062 -10.975 12.819 1.00 73.23 H new ATOM 0 HG3 GLU A 98 2.777 -11.291 12.987 1.00 73.23 H new ATOM 1445 N PHE A 99 1.826 -8.391 8.967 1.00 10.22 N ATOM 1446 CA PHE A 99 2.129 -7.283 8.102 1.00 34.34 C ATOM 1447 C PHE A 99 1.862 -6.034 8.906 1.00 31.54 C ATOM 1448 O PHE A 99 0.715 -5.764 9.284 1.00 31.24 O ATOM 1449 CB PHE A 99 1.221 -7.287 6.860 1.00 70.25 C ATOM 1450 CG PHE A 99 1.345 -8.499 5.980 1.00 55.04 C ATOM 1451 CD1 PHE A 99 0.544 -9.611 6.187 1.00 21.24 C ATOM 1452 CD2 PHE A 99 2.250 -8.517 4.939 1.00 12.22 C ATOM 1453 CE1 PHE A 99 0.651 -10.717 5.370 1.00 3.22 C ATOM 1454 CE2 PHE A 99 2.363 -9.621 4.117 1.00 61.41 C ATOM 1455 CZ PHE A 99 1.563 -10.724 4.334 1.00 54.33 C ATOM 0 H PHE A 99 0.830 -8.565 9.103 1.00 10.22 H new ATOM 0 HA PHE A 99 3.161 -7.340 7.757 1.00 34.34 H new ATOM 0 HB2 PHE A 99 0.185 -7.200 7.187 1.00 70.25 H new ATOM 0 HB3 PHE A 99 1.443 -6.401 6.265 1.00 70.25 H new ATOM 0 HD1 PHE A 99 -0.171 -9.611 6.996 1.00 21.24 H new ATOM 0 HD2 PHE A 99 2.879 -7.656 4.765 1.00 12.22 H new ATOM 0 HE1 PHE A 99 0.021 -11.578 5.541 1.00 3.22 H new ATOM 0 HE2 PHE A 99 3.076 -9.621 3.306 1.00 61.41 H new ATOM 0 HZ PHE A 99 1.650 -11.590 3.695 1.00 54.33 H new ATOM 1465 N GLU A 100 2.874 -5.282 9.148 1.00 55.30 N ATOM 1466 CA GLU A 100 2.764 -4.132 9.992 1.00 44.10 C ATOM 1467 C GLU A 100 3.082 -2.865 9.243 1.00 55.54 C ATOM 1468 O GLU A 100 4.039 -2.806 8.459 1.00 33.24 O ATOM 1469 CB GLU A 100 3.676 -4.277 11.232 1.00 53.00 C ATOM 1470 CG GLU A 100 5.125 -4.624 10.896 1.00 43.33 C ATOM 1471 CD GLU A 100 6.039 -4.650 12.096 1.00 51.31 C ATOM 1472 OE1 GLU A 100 5.892 -5.526 12.960 1.00 53.25 O ATOM 1473 OE2 GLU A 100 6.951 -3.813 12.177 1.00 13.10 O ATOM 0 H GLU A 100 3.807 -5.441 8.769 1.00 55.30 H new ATOM 0 HA GLU A 100 1.729 -4.066 10.328 1.00 44.10 H new ATOM 0 HB2 GLU A 100 3.657 -3.344 11.796 1.00 53.00 H new ATOM 0 HB3 GLU A 100 3.269 -5.051 11.882 1.00 53.00 H new ATOM 0 HG2 GLU A 100 5.152 -5.599 10.409 1.00 43.33 H new ATOM 0 HG3 GLU A 100 5.505 -3.898 10.177 1.00 43.33 H new ATOM 1480 N VAL A 101 2.270 -1.876 9.448 1.00 24.54 N ATOM 1481 CA VAL A 101 2.529 -0.584 8.921 1.00 65.12 C ATOM 1482 C VAL A 101 3.021 0.216 10.091 1.00 63.31 C ATOM 1483 O VAL A 101 2.313 0.338 11.098 1.00 3.33 O ATOM 1484 CB VAL A 101 1.213 0.108 8.452 1.00 1.23 C ATOM 1485 CG1 VAL A 101 1.492 1.421 7.729 1.00 11.02 C ATOM 1486 CG2 VAL A 101 0.334 -0.814 7.622 1.00 61.41 C ATOM 0 H VAL A 101 1.408 -1.948 9.988 1.00 24.54 H new ATOM 0 HA VAL A 101 3.220 -0.650 8.080 1.00 65.12 H new ATOM 0 HB VAL A 101 0.650 0.345 9.354 1.00 1.23 H new ATOM 0 HG11 VAL A 101 0.550 1.872 7.418 1.00 11.02 H new ATOM 0 HG12 VAL A 101 2.016 2.101 8.400 1.00 11.02 H new ATOM 0 HG13 VAL A 101 2.109 1.229 6.851 1.00 11.02 H new ATOM 0 HG21 VAL A 101 -0.569 -0.283 7.321 1.00 61.41 H new ATOM 0 HG22 VAL A 101 0.879 -1.134 6.734 1.00 61.41 H new ATOM 0 HG23 VAL A 101 0.061 -1.687 8.215 1.00 61.41 H new ATOM 1496 N VAL A 102 4.189 0.722 9.997 1.00 12.15 N ATOM 1497 CA VAL A 102 4.696 1.592 10.996 1.00 13.31 C ATOM 1498 C VAL A 102 5.028 2.905 10.354 1.00 72.35 C ATOM 1499 O VAL A 102 5.634 2.934 9.276 1.00 25.22 O ATOM 1500 CB VAL A 102 5.928 1.010 11.760 1.00 24.24 C ATOM 1501 CG1 VAL A 102 5.538 -0.235 12.551 1.00 22.53 C ATOM 1502 CG2 VAL A 102 7.075 0.691 10.813 1.00 54.40 C ATOM 0 H VAL A 102 4.829 0.547 9.222 1.00 12.15 H new ATOM 0 HA VAL A 102 3.925 1.722 11.756 1.00 13.31 H new ATOM 0 HB VAL A 102 6.269 1.776 12.456 1.00 24.24 H new ATOM 0 HG11 VAL A 102 6.412 -0.622 13.074 1.00 22.53 H new ATOM 0 HG12 VAL A 102 4.765 0.022 13.276 1.00 22.53 H new ATOM 0 HG13 VAL A 102 5.157 -0.995 11.869 1.00 22.53 H new ATOM 0 HG21 VAL A 102 7.914 0.288 11.380 1.00 54.40 H new ATOM 0 HG22 VAL A 102 6.747 -0.045 10.079 1.00 54.40 H new ATOM 0 HG23 VAL A 102 7.387 1.601 10.300 1.00 54.40 H new ATOM 1512 N ASP A 103 4.600 3.974 10.913 1.00 43.01 N ATOM 1513 CA ASP A 103 4.996 5.229 10.341 1.00 50.13 C ATOM 1514 C ASP A 103 6.158 5.831 11.057 1.00 15.35 C ATOM 1515 O ASP A 103 6.466 5.490 12.204 1.00 5.04 O ATOM 1516 CB ASP A 103 3.881 6.264 10.203 1.00 74.03 C ATOM 1517 CG ASP A 103 3.421 6.912 11.491 1.00 40.02 C ATOM 1518 OD1 ASP A 103 4.168 7.719 12.086 1.00 10.50 O ATOM 1519 OD2 ASP A 103 2.296 6.667 11.890 1.00 3.11 O ATOM 0 H ASP A 103 3.998 4.021 11.735 1.00 43.01 H new ATOM 0 HA ASP A 103 5.288 4.963 9.325 1.00 50.13 H new ATOM 0 HB2 ASP A 103 4.220 7.047 9.525 1.00 74.03 H new ATOM 0 HB3 ASP A 103 3.022 5.785 9.733 1.00 74.03 H new ATOM 1524 N VAL A 104 6.821 6.683 10.349 1.00 33.34 N ATOM 1525 CA VAL A 104 7.892 7.501 10.849 1.00 13.13 C ATOM 1526 C VAL A 104 7.571 8.929 10.415 1.00 31.21 C ATOM 1527 O VAL A 104 8.437 9.815 10.342 1.00 45.24 O ATOM 1528 CB VAL A 104 9.286 7.055 10.293 1.00 71.42 C ATOM 1529 CG1 VAL A 104 9.663 5.674 10.816 1.00 74.35 C ATOM 1530 CG2 VAL A 104 9.295 7.048 8.774 1.00 13.01 C ATOM 0 H VAL A 104 6.627 6.840 9.360 1.00 33.34 H new ATOM 0 HA VAL A 104 7.963 7.412 11.933 1.00 13.13 H new ATOM 0 HB VAL A 104 10.023 7.779 10.642 1.00 71.42 H new ATOM 0 HG11 VAL A 104 10.635 5.386 10.416 1.00 74.35 H new ATOM 0 HG12 VAL A 104 9.711 5.698 11.905 1.00 74.35 H new ATOM 0 HG13 VAL A 104 8.912 4.949 10.502 1.00 74.35 H new ATOM 0 HG21 VAL A 104 10.276 6.734 8.417 1.00 13.01 H new ATOM 0 HG22 VAL A 104 8.537 6.355 8.409 1.00 13.01 H new ATOM 0 HG23 VAL A 104 9.078 8.050 8.404 1.00 13.01 H new ATOM 1540 N GLY A 105 6.288 9.137 10.176 1.00 24.40 N ATOM 1541 CA GLY A 105 5.777 10.385 9.698 1.00 3.53 C ATOM 1542 C GLY A 105 4.454 10.684 10.346 1.00 72.23 C ATOM 1543 O GLY A 105 3.423 10.818 9.679 1.00 74.04 O ATOM 0 H GLY A 105 5.571 8.425 10.314 1.00 24.40 H new ATOM 0 HA2 GLY A 105 6.486 11.184 9.915 1.00 3.53 H new ATOM 0 HA3 GLY A 105 5.660 10.348 8.615 1.00 3.53 H new ATOM 1547 N SER A 106 4.487 10.838 11.652 1.00 1.35 N ATOM 1548 CA SER A 106 3.290 11.019 12.453 1.00 10.15 C ATOM 1549 C SER A 106 2.661 12.397 12.219 1.00 31.44 C ATOM 1550 O SER A 106 1.552 12.680 12.712 1.00 71.10 O ATOM 1551 CB SER A 106 3.633 10.829 13.941 1.00 64.43 C ATOM 1552 OG SER A 106 2.467 10.783 14.762 1.00 43.32 O ATOM 0 H SER A 106 5.351 10.842 12.194 1.00 1.35 H new ATOM 0 HA SER A 106 2.557 10.271 12.151 1.00 10.15 H new ATOM 0 HB2 SER A 106 4.200 9.907 14.066 1.00 64.43 H new ATOM 0 HB3 SER A 106 4.275 11.645 14.271 1.00 64.43 H new ATOM 0 HG SER A 106 1.792 11.397 14.406 1.00 43.32 H new ATOM 1558 N LEU A 107 3.346 13.243 11.470 1.00 42.44 N ATOM 1559 CA LEU A 107 2.862 14.574 11.216 1.00 30.23 C ATOM 1560 C LEU A 107 1.728 14.539 10.207 1.00 71.40 C ATOM 1561 O LEU A 107 0.699 15.181 10.408 1.00 62.11 O ATOM 1562 CB LEU A 107 3.977 15.494 10.725 1.00 12.31 C ATOM 1563 CG LEU A 107 5.241 15.569 11.587 1.00 14.03 C ATOM 1564 CD1 LEU A 107 6.208 16.585 11.012 1.00 21.43 C ATOM 1565 CD2 LEU A 107 4.905 15.909 13.030 1.00 1.32 C ATOM 0 H LEU A 107 4.240 13.025 11.030 1.00 42.44 H new ATOM 0 HA LEU A 107 2.490 14.976 12.158 1.00 30.23 H new ATOM 0 HB2 LEU A 107 4.267 15.172 9.725 1.00 12.31 H new ATOM 0 HB3 LEU A 107 3.570 16.501 10.631 1.00 12.31 H new ATOM 0 HG LEU A 107 5.715 14.588 11.579 1.00 14.03 H new ATOM 0 HD11 LEU A 107 7.102 16.629 11.634 1.00 21.43 H new ATOM 0 HD12 LEU A 107 6.484 16.292 9.999 1.00 21.43 H new ATOM 0 HD13 LEU A 107 5.734 17.566 10.989 1.00 21.43 H new ATOM 0 HD21 LEU A 107 5.823 15.955 13.616 1.00 1.32 H new ATOM 0 HD22 LEU A 107 4.401 16.875 13.068 1.00 1.32 H new ATOM 0 HD23 LEU A 107 4.250 15.141 13.442 1.00 1.32 H new ATOM 1577 N ASN A 108 1.863 13.713 9.179 1.00 64.21 N ATOM 1578 CA ASN A 108 0.838 13.681 8.130 1.00 2.21 C ATOM 1579 C ASN A 108 -0.273 12.747 8.517 1.00 14.24 C ATOM 1580 O ASN A 108 -1.388 12.887 8.046 1.00 72.25 O ATOM 1581 CB ASN A 108 1.416 13.237 6.782 1.00 32.21 C ATOM 1582 CG ASN A 108 2.384 14.215 6.168 1.00 4.42 C ATOM 1583 OD1 ASN A 108 2.265 15.419 6.349 1.00 22.44 O ATOM 1584 ND2 ASN A 108 3.346 13.703 5.434 1.00 43.14 N ATOM 0 H ASN A 108 2.645 13.072 9.044 1.00 64.21 H new ATOM 0 HA ASN A 108 0.454 14.696 8.024 1.00 2.21 H new ATOM 0 HB2 ASN A 108 1.920 12.280 6.914 1.00 32.21 H new ATOM 0 HB3 ASN A 108 0.595 13.071 6.085 1.00 32.21 H new ATOM 0 HD21 ASN A 108 4.030 14.316 4.990 1.00 43.14 H new ATOM 0 HD22 ASN A 108 3.409 12.693 5.309 1.00 43.14 H new ATOM 1591 N GLY A 109 0.016 11.842 9.431 1.00 1.53 N ATOM 1592 CA GLY A 109 -1.016 10.987 9.959 1.00 1.21 C ATOM 1593 C GLY A 109 -1.321 9.796 9.080 1.00 52.21 C ATOM 1594 O GLY A 109 -1.845 9.930 7.976 1.00 32.23 O ATOM 0 H GLY A 109 0.947 11.684 9.817 1.00 1.53 H new ATOM 0 HA2 GLY A 109 -0.714 10.633 10.945 1.00 1.21 H new ATOM 0 HA3 GLY A 109 -1.926 11.571 10.095 1.00 1.21 H new ATOM 1598 N THR A 110 -0.951 8.650 9.544 1.00 44.12 N ATOM 1599 CA THR A 110 -1.267 7.427 8.884 1.00 22.22 C ATOM 1600 C THR A 110 -2.664 6.979 9.334 1.00 2.55 C ATOM 1601 O THR A 110 -2.963 6.960 10.539 1.00 4.41 O ATOM 1602 CB THR A 110 -0.248 6.376 9.310 1.00 3.13 C ATOM 1603 OG1 THR A 110 1.044 6.989 9.311 1.00 15.25 O ATOM 1604 CG2 THR A 110 -0.245 5.199 8.342 1.00 41.14 C ATOM 0 H THR A 110 -0.414 8.534 10.403 1.00 44.12 H new ATOM 0 HA THR A 110 -1.246 7.556 7.802 1.00 22.22 H new ATOM 0 HB THR A 110 -0.505 6.001 10.301 1.00 3.13 H new ATOM 0 HG1 THR A 110 1.099 7.638 8.579 1.00 15.25 H new ATOM 0 HG21 THR A 110 0.490 4.463 8.667 1.00 41.14 H new ATOM 0 HG22 THR A 110 -1.234 4.741 8.323 1.00 41.14 H new ATOM 0 HG23 THR A 110 0.011 5.551 7.343 1.00 41.14 H new ATOM 1612 N TYR A 111 -3.515 6.652 8.402 1.00 54.24 N ATOM 1613 CA TYR A 111 -4.847 6.198 8.742 1.00 50.10 C ATOM 1614 C TYR A 111 -5.045 4.804 8.203 1.00 3.33 C ATOM 1615 O TYR A 111 -4.670 4.527 7.088 1.00 43.13 O ATOM 1616 CB TYR A 111 -5.926 7.120 8.143 1.00 4.12 C ATOM 1617 CG TYR A 111 -5.795 8.588 8.495 1.00 31.44 C ATOM 1618 CD1 TYR A 111 -6.229 9.072 9.720 1.00 22.41 C ATOM 1619 CD2 TYR A 111 -5.235 9.489 7.595 1.00 73.01 C ATOM 1620 CE1 TYR A 111 -6.112 10.409 10.039 1.00 11.44 C ATOM 1621 CE2 TYR A 111 -5.114 10.829 7.907 1.00 25.32 C ATOM 1622 CZ TYR A 111 -5.554 11.283 9.131 1.00 41.02 C ATOM 1623 OH TYR A 111 -5.431 12.617 9.455 1.00 74.52 O ATOM 0 H TYR A 111 -3.317 6.689 7.402 1.00 54.24 H new ATOM 0 HA TYR A 111 -4.945 6.212 9.828 1.00 50.10 H new ATOM 0 HB2 TYR A 111 -5.903 7.021 7.058 1.00 4.12 H new ATOM 0 HB3 TYR A 111 -6.904 6.770 8.475 1.00 4.12 H new ATOM 0 HD1 TYR A 111 -6.666 8.391 10.436 1.00 22.41 H new ATOM 0 HD2 TYR A 111 -4.889 9.134 6.635 1.00 73.01 H new ATOM 0 HE1 TYR A 111 -6.456 10.770 10.997 1.00 11.44 H new ATOM 0 HE2 TYR A 111 -4.678 11.516 7.197 1.00 25.32 H new ATOM 0 HH TYR A 111 -5.317 12.709 10.424 1.00 74.52 H new ATOM 1633 N VAL A 112 -5.585 3.928 9.000 1.00 73.13 N ATOM 1634 CA VAL A 112 -5.915 2.585 8.556 1.00 64.53 C ATOM 1635 C VAL A 112 -7.338 2.327 8.963 1.00 25.43 C ATOM 1636 O VAL A 112 -7.652 2.389 10.150 1.00 23.13 O ATOM 1637 CB VAL A 112 -4.995 1.495 9.166 1.00 13.23 C ATOM 1638 CG1 VAL A 112 -5.365 0.112 8.622 1.00 62.54 C ATOM 1639 CG2 VAL A 112 -3.523 1.801 8.898 1.00 20.23 C ATOM 0 H VAL A 112 -5.813 4.114 9.977 1.00 73.13 H new ATOM 0 HA VAL A 112 -5.774 2.529 7.477 1.00 64.53 H new ATOM 0 HB VAL A 112 -5.146 1.495 10.245 1.00 13.23 H new ATOM 0 HG11 VAL A 112 -4.709 -0.639 9.061 1.00 62.54 H new ATOM 0 HG12 VAL A 112 -6.400 -0.115 8.879 1.00 62.54 H new ATOM 0 HG13 VAL A 112 -5.250 0.105 7.538 1.00 62.54 H new ATOM 0 HG21 VAL A 112 -2.903 1.020 9.338 1.00 20.23 H new ATOM 0 HG22 VAL A 112 -3.349 1.840 7.823 1.00 20.23 H new ATOM 0 HG23 VAL A 112 -3.264 2.762 9.342 1.00 20.23 H new ATOM 1649 N ASN A 113 -8.193 2.059 7.987 1.00 0.23 N ATOM 1650 CA ASN A 113 -9.647 1.922 8.194 1.00 12.21 C ATOM 1651 C ASN A 113 -10.194 3.180 8.811 1.00 22.50 C ATOM 1652 O ASN A 113 -11.088 3.149 9.652 1.00 73.43 O ATOM 1653 CB ASN A 113 -10.032 0.673 9.010 1.00 2.11 C ATOM 1654 CG ASN A 113 -9.857 -0.596 8.216 1.00 21.15 C ATOM 1655 OD1 ASN A 113 -9.966 -0.587 6.979 1.00 64.15 O ATOM 1656 ND2 ASN A 113 -9.636 -1.690 8.892 1.00 4.44 N ATOM 0 H ASN A 113 -7.906 1.927 7.017 1.00 0.23 H new ATOM 0 HA ASN A 113 -10.103 1.777 7.215 1.00 12.21 H new ATOM 0 HB2 ASN A 113 -9.419 0.625 9.910 1.00 2.11 H new ATOM 0 HB3 ASN A 113 -11.069 0.757 9.335 1.00 2.11 H new ATOM 0 HD21 ASN A 113 -9.546 -2.581 8.404 1.00 4.44 H new ATOM 0 HD22 ASN A 113 -9.553 -1.654 9.908 1.00 4.44 H new ATOM 1663 N ARG A 114 -9.654 4.301 8.312 1.00 33.00 N ATOM 1664 CA ARG A 114 -9.993 5.658 8.728 1.00 61.52 C ATOM 1665 C ARG A 114 -9.681 5.948 10.200 1.00 72.41 C ATOM 1666 O ARG A 114 -10.080 6.983 10.746 1.00 54.32 O ATOM 1667 CB ARG A 114 -11.433 6.001 8.338 1.00 43.53 C ATOM 1668 CG ARG A 114 -11.606 6.225 6.833 1.00 21.14 C ATOM 1669 CD ARG A 114 -12.731 5.395 6.247 1.00 23.34 C ATOM 1670 NE ARG A 114 -12.411 3.962 6.224 1.00 34.32 N ATOM 1671 CZ ARG A 114 -13.306 2.966 6.297 1.00 2.43 C ATOM 1672 NH1 ARG A 114 -14.625 3.232 6.255 1.00 64.21 N ATOM 1673 NH2 ARG A 114 -12.885 1.702 6.338 1.00 73.33 N ATOM 0 H ARG A 114 -8.943 4.280 7.581 1.00 33.00 H new ATOM 0 HA ARG A 114 -9.335 6.332 8.179 1.00 61.52 H new ATOM 0 HB2 ARG A 114 -12.093 5.195 8.658 1.00 43.53 H new ATOM 0 HB3 ARG A 114 -11.745 6.899 8.872 1.00 43.53 H new ATOM 0 HG2 ARG A 114 -11.803 7.281 6.647 1.00 21.14 H new ATOM 0 HG3 ARG A 114 -10.674 5.980 6.323 1.00 21.14 H new ATOM 0 HD2 ARG A 114 -13.638 5.553 6.830 1.00 23.34 H new ATOM 0 HD3 ARG A 114 -12.940 5.735 5.233 1.00 23.34 H new ATOM 0 HE ARG A 114 -11.428 3.703 6.146 1.00 34.32 H new ATOM 0 HH11 ARG A 114 -14.948 4.195 6.167 1.00 64.21 H new ATOM 0 HH12 ARG A 114 -15.301 2.470 6.311 1.00 64.21 H new ATOM 0 HH21 ARG A 114 -11.886 1.496 6.314 1.00 73.33 H new ATOM 0 HH22 ARG A 114 -13.562 0.941 6.394 1.00 73.33 H new ATOM 1687 N GLU A 115 -8.892 5.080 10.798 1.00 24.10 N ATOM 1688 CA GLU A 115 -8.456 5.215 12.161 1.00 32.11 C ATOM 1689 C GLU A 115 -7.008 5.698 12.139 1.00 72.21 C ATOM 1690 O GLU A 115 -6.162 5.075 11.479 1.00 14.14 O ATOM 1691 CB GLU A 115 -8.500 3.842 12.853 1.00 45.41 C ATOM 1692 CG GLU A 115 -9.879 3.194 12.932 1.00 62.22 C ATOM 1693 CD GLU A 115 -10.817 3.926 13.850 1.00 5.33 C ATOM 1694 OE1 GLU A 115 -10.802 3.653 15.075 1.00 63.21 O ATOM 1695 OE2 GLU A 115 -11.575 4.777 13.392 1.00 43.21 O ATOM 0 H GLU A 115 -8.532 4.245 10.335 1.00 24.10 H new ATOM 0 HA GLU A 115 -9.099 5.914 12.696 1.00 32.11 H new ATOM 0 HB2 GLU A 115 -7.829 3.165 12.324 1.00 45.41 H new ATOM 0 HB3 GLU A 115 -8.110 3.951 13.865 1.00 45.41 H new ATOM 0 HG2 GLU A 115 -10.314 3.154 11.933 1.00 62.22 H new ATOM 0 HG3 GLU A 115 -9.772 2.165 13.275 1.00 62.22 H new ATOM 1702 N PRO A 116 -6.708 6.829 12.785 1.00 74.42 N ATOM 1703 CA PRO A 116 -5.338 7.331 12.888 1.00 25.20 C ATOM 1704 C PRO A 116 -4.474 6.381 13.710 1.00 60.40 C ATOM 1705 O PRO A 116 -4.803 6.054 14.851 1.00 4.41 O ATOM 1706 CB PRO A 116 -5.477 8.675 13.626 1.00 70.44 C ATOM 1707 CG PRO A 116 -6.930 9.003 13.600 1.00 72.42 C ATOM 1708 CD PRO A 116 -7.670 7.706 13.452 1.00 12.10 C ATOM 0 HA PRO A 116 -4.864 7.427 11.911 1.00 25.20 H new ATOM 0 HB2 PRO A 116 -5.112 8.599 14.650 1.00 70.44 H new ATOM 0 HB3 PRO A 116 -4.892 9.453 13.136 1.00 70.44 H new ATOM 0 HG2 PRO A 116 -7.226 9.514 14.516 1.00 72.42 H new ATOM 0 HG3 PRO A 116 -7.159 9.674 12.772 1.00 72.42 H new ATOM 0 HD2 PRO A 116 -7.972 7.305 14.420 1.00 12.10 H new ATOM 0 HD3 PRO A 116 -8.577 7.828 12.860 1.00 12.10 H new ATOM 1716 N ARG A 117 -3.394 5.929 13.131 1.00 54.15 N ATOM 1717 CA ARG A 117 -2.496 5.010 13.792 1.00 2.34 C ATOM 1718 C ARG A 117 -1.086 5.337 13.471 1.00 63.22 C ATOM 1719 O ARG A 117 -0.808 6.050 12.515 1.00 71.42 O ATOM 1720 CB ARG A 117 -2.767 3.550 13.402 1.00 43.11 C ATOM 1721 CG ARG A 117 -4.006 2.948 14.017 1.00 45.31 C ATOM 1722 CD ARG A 117 -3.870 2.804 15.526 1.00 41.25 C ATOM 1723 NE ARG A 117 -5.089 2.279 16.136 1.00 64.24 N ATOM 1724 CZ ARG A 117 -5.145 1.588 17.285 1.00 64.31 C ATOM 1725 NH1 ARG A 117 -4.035 1.325 17.978 1.00 10.43 N ATOM 1726 NH2 ARG A 117 -6.312 1.158 17.735 1.00 73.14 N ATOM 0 H ARG A 117 -3.108 6.186 12.186 1.00 54.15 H new ATOM 0 HA ARG A 117 -2.672 5.119 14.862 1.00 2.34 H new ATOM 0 HB2 ARG A 117 -2.851 3.489 12.317 1.00 43.11 H new ATOM 0 HB3 ARG A 117 -1.906 2.946 13.690 1.00 43.11 H new ATOM 0 HG2 ARG A 117 -4.868 3.574 13.787 1.00 45.31 H new ATOM 0 HG3 ARG A 117 -4.195 1.970 13.573 1.00 45.31 H new ATOM 0 HD2 ARG A 117 -3.036 2.141 15.753 1.00 41.25 H new ATOM 0 HD3 ARG A 117 -3.634 3.774 15.963 1.00 41.25 H new ATOM 0 HE ARG A 117 -5.969 2.452 15.649 1.00 64.24 H new ATOM 0 HH11 ARG A 117 -3.131 1.650 17.636 1.00 10.43 H new ATOM 0 HH12 ARG A 117 -4.091 0.799 18.850 1.00 10.43 H new ATOM 0 HH21 ARG A 117 -7.164 1.352 17.209 1.00 73.14 H new ATOM 0 HH22 ARG A 117 -6.360 0.632 18.608 1.00 73.14 H new ATOM 1740 N ASN A 118 -0.218 4.820 14.275 1.00 73.41 N ATOM 1741 CA ASN A 118 1.217 4.964 14.090 1.00 61.30 C ATOM 1742 C ASN A 118 1.822 3.621 13.784 1.00 61.43 C ATOM 1743 O ASN A 118 2.859 3.509 13.111 1.00 11.21 O ATOM 1744 CB ASN A 118 1.902 5.603 15.302 1.00 65.30 C ATOM 1745 CG ASN A 118 1.594 7.086 15.452 1.00 53.01 C ATOM 1746 OD1 ASN A 118 0.653 7.485 16.149 1.00 21.33 O ATOM 1747 ND2 ASN A 118 2.337 7.907 14.766 1.00 64.31 N ATOM 0 H ASN A 118 -0.474 4.274 15.098 1.00 73.41 H new ATOM 0 HA ASN A 118 1.379 5.639 13.250 1.00 61.30 H new ATOM 0 HB2 ASN A 118 1.589 5.080 16.206 1.00 65.30 H new ATOM 0 HB3 ASN A 118 2.980 5.470 15.214 1.00 65.30 H new ATOM 0 HD21 ASN A 118 2.150 8.909 14.794 1.00 64.31 H new ATOM 0 HD22 ASN A 118 3.106 7.548 14.200 1.00 64.31 H new ATOM 1754 N ALA A 119 1.201 2.605 14.310 1.00 71.22 N ATOM 1755 CA ALA A 119 1.530 1.249 14.001 1.00 4.42 C ATOM 1756 C ALA A 119 0.233 0.522 13.831 1.00 13.53 C ATOM 1757 O ALA A 119 -0.698 0.728 14.615 1.00 53.01 O ATOM 1758 CB ALA A 119 2.337 0.612 15.124 1.00 63.23 C ATOM 0 H ALA A 119 0.437 2.701 14.979 1.00 71.22 H new ATOM 0 HA ALA A 119 2.139 1.201 13.098 1.00 4.42 H new ATOM 0 HB1 ALA A 119 2.573 -0.419 14.862 1.00 63.23 H new ATOM 0 HB2 ALA A 119 3.262 1.171 15.270 1.00 63.23 H new ATOM 0 HB3 ALA A 119 1.754 0.628 16.045 1.00 63.23 H new ATOM 1764 N GLN A 120 0.135 -0.265 12.809 1.00 32.35 N ATOM 1765 CA GLN A 120 -1.089 -1.031 12.578 1.00 54.14 C ATOM 1766 C GLN A 120 -0.819 -2.305 11.792 1.00 20.30 C ATOM 1767 O GLN A 120 -0.036 -2.286 10.859 1.00 32.14 O ATOM 1768 CB GLN A 120 -2.102 -0.158 11.820 1.00 1.42 C ATOM 1769 CG GLN A 120 -3.437 -0.832 11.526 1.00 33.25 C ATOM 1770 CD GLN A 120 -4.203 -1.221 12.768 1.00 65.45 C ATOM 1771 OE1 GLN A 120 -4.096 -0.580 13.812 1.00 13.04 O ATOM 1772 NE2 GLN A 120 -4.979 -2.264 12.667 1.00 65.14 N ATOM 0 H GLN A 120 0.869 -0.407 12.116 1.00 32.35 H new ATOM 0 HA GLN A 120 -1.494 -1.320 13.548 1.00 54.14 H new ATOM 0 HB2 GLN A 120 -2.288 0.745 12.401 1.00 1.42 H new ATOM 0 HB3 GLN A 120 -1.655 0.156 10.877 1.00 1.42 H new ATOM 0 HG2 GLN A 120 -4.050 -0.159 10.927 1.00 33.25 H new ATOM 0 HG3 GLN A 120 -3.260 -1.723 10.924 1.00 33.25 H new ATOM 0 HE21 GLN A 120 -5.041 -2.770 11.783 1.00 65.14 H new ATOM 0 HE22 GLN A 120 -5.524 -2.574 13.472 1.00 65.14 H new ATOM 1781 N VAL A 121 -1.446 -3.398 12.173 1.00 75.54 N ATOM 1782 CA VAL A 121 -1.385 -4.599 11.369 1.00 45.13 C ATOM 1783 C VAL A 121 -2.470 -4.491 10.306 1.00 72.02 C ATOM 1784 O VAL A 121 -3.653 -4.303 10.626 1.00 35.45 O ATOM 1785 CB VAL A 121 -1.559 -5.901 12.203 1.00 21.20 C ATOM 1786 CG1 VAL A 121 -1.506 -7.136 11.302 1.00 4.41 C ATOM 1787 CG2 VAL A 121 -0.479 -5.991 13.269 1.00 62.51 C ATOM 0 H VAL A 121 -1.999 -3.479 13.026 1.00 75.54 H new ATOM 0 HA VAL A 121 -0.395 -4.673 10.919 1.00 45.13 H new ATOM 0 HB VAL A 121 -2.536 -5.867 12.686 1.00 21.20 H new ATOM 0 HG11 VAL A 121 -1.630 -8.034 11.908 1.00 4.41 H new ATOM 0 HG12 VAL A 121 -2.307 -7.083 10.564 1.00 4.41 H new ATOM 0 HG13 VAL A 121 -0.544 -7.173 10.791 1.00 4.41 H new ATOM 0 HG21 VAL A 121 -0.612 -6.906 13.845 1.00 62.51 H new ATOM 0 HG22 VAL A 121 0.502 -6.001 12.793 1.00 62.51 H new ATOM 0 HG23 VAL A 121 -0.551 -5.130 13.934 1.00 62.51 H new ATOM 1797 N MET A 122 -2.068 -4.572 9.072 1.00 22.43 N ATOM 1798 CA MET A 122 -2.963 -4.358 7.948 1.00 62.14 C ATOM 1799 C MET A 122 -3.615 -5.669 7.506 1.00 42.14 C ATOM 1800 O MET A 122 -2.937 -6.692 7.345 1.00 60.05 O ATOM 1801 CB MET A 122 -2.185 -3.676 6.796 1.00 32.35 C ATOM 1802 CG MET A 122 -1.033 -4.507 6.223 1.00 4.54 C ATOM 1803 SD MET A 122 0.204 -3.528 5.323 1.00 43.32 S ATOM 1804 CE MET A 122 -0.790 -2.693 4.100 1.00 64.44 C ATOM 0 H MET A 122 -1.108 -4.789 8.804 1.00 22.43 H new ATOM 0 HA MET A 122 -3.775 -3.697 8.252 1.00 62.14 H new ATOM 0 HB2 MET A 122 -2.883 -3.444 5.992 1.00 32.35 H new ATOM 0 HB3 MET A 122 -1.787 -2.727 7.156 1.00 32.35 H new ATOM 0 HG2 MET A 122 -0.540 -5.037 7.038 1.00 4.54 H new ATOM 0 HG3 MET A 122 -1.442 -5.263 5.552 1.00 4.54 H new ATOM 0 HE1 MET A 122 -0.459 -2.982 3.103 1.00 64.44 H new ATOM 0 HE2 MET A 122 -1.836 -2.971 4.230 1.00 64.44 H new ATOM 0 HE3 MET A 122 -0.684 -1.615 4.219 1.00 64.44 H new ATOM 1814 N GLN A 123 -4.920 -5.646 7.356 1.00 72.02 N ATOM 1815 CA GLN A 123 -5.672 -6.809 6.934 1.00 50.03 C ATOM 1816 C GLN A 123 -6.019 -6.675 5.467 1.00 74.22 C ATOM 1817 O GLN A 123 -6.036 -5.567 4.921 1.00 52.14 O ATOM 1818 CB GLN A 123 -6.973 -6.933 7.738 1.00 55.21 C ATOM 1819 CG GLN A 123 -6.779 -6.923 9.243 1.00 32.43 C ATOM 1820 CD GLN A 123 -5.952 -8.078 9.753 1.00 52.03 C ATOM 1821 OE1 GLN A 123 -5.963 -9.183 9.195 1.00 65.12 O ATOM 1822 NE2 GLN A 123 -5.222 -7.837 10.803 1.00 43.40 N ATOM 0 H GLN A 123 -5.493 -4.819 7.523 1.00 72.02 H new ATOM 0 HA GLN A 123 -5.062 -7.696 7.102 1.00 50.03 H new ATOM 0 HB2 GLN A 123 -7.636 -6.113 7.463 1.00 55.21 H new ATOM 0 HB3 GLN A 123 -7.475 -7.858 7.454 1.00 55.21 H new ATOM 0 HG2 GLN A 123 -6.300 -5.988 9.533 1.00 32.43 H new ATOM 0 HG3 GLN A 123 -7.755 -6.944 9.727 1.00 32.43 H new ATOM 0 HE21 GLN A 123 -5.240 -6.913 11.235 1.00 43.40 H new ATOM 0 HE22 GLN A 123 -4.632 -8.572 11.194 1.00 43.40 H new ATOM 1831 N THR A 124 -6.253 -7.786 4.821 1.00 44.10 N ATOM 1832 CA THR A 124 -6.677 -7.771 3.449 1.00 61.40 C ATOM 1833 C THR A 124 -8.086 -7.162 3.376 1.00 10.43 C ATOM 1834 O THR A 124 -8.993 -7.577 4.092 1.00 21.42 O ATOM 1835 CB THR A 124 -6.587 -9.204 2.801 1.00 11.24 C ATOM 1836 OG1 THR A 124 -7.059 -9.213 1.442 1.00 21.13 O ATOM 1837 CG2 THR A 124 -7.338 -10.248 3.611 1.00 31.20 C ATOM 0 H THR A 124 -6.156 -8.717 5.227 1.00 44.10 H new ATOM 0 HA THR A 124 -6.005 -7.148 2.858 1.00 61.40 H new ATOM 0 HB THR A 124 -5.529 -9.465 2.801 1.00 11.24 H new ATOM 0 HG1 THR A 124 -6.985 -10.119 1.076 1.00 21.13 H new ATOM 0 HG21 THR A 124 -7.248 -11.220 3.125 1.00 31.20 H new ATOM 0 HG22 THR A 124 -6.916 -10.303 4.614 1.00 31.20 H new ATOM 0 HG23 THR A 124 -8.390 -9.971 3.675 1.00 31.20 H new ATOM 1845 N GLY A 125 -8.230 -6.169 2.547 1.00 35.03 N ATOM 1846 CA GLY A 125 -9.458 -5.438 2.449 1.00 75.43 C ATOM 1847 C GLY A 125 -9.421 -4.115 3.214 1.00 55.20 C ATOM 1848 O GLY A 125 -10.361 -3.318 3.111 1.00 22.23 O ATOM 0 H GLY A 125 -7.496 -5.843 1.918 1.00 35.03 H new ATOM 0 HA2 GLY A 125 -9.675 -5.240 1.399 1.00 75.43 H new ATOM 0 HA3 GLY A 125 -10.273 -6.052 2.833 1.00 75.43 H new ATOM 1852 N ASP A 126 -8.346 -3.874 3.967 1.00 50.31 N ATOM 1853 CA ASP A 126 -8.185 -2.609 4.716 1.00 32.40 C ATOM 1854 C ASP A 126 -7.700 -1.507 3.821 1.00 34.23 C ATOM 1855 O ASP A 126 -6.984 -1.761 2.836 1.00 51.43 O ATOM 1856 CB ASP A 126 -7.174 -2.709 5.872 1.00 13.11 C ATOM 1857 CG ASP A 126 -7.651 -3.435 7.096 1.00 52.43 C ATOM 1858 OD1 ASP A 126 -8.867 -3.692 7.233 1.00 71.22 O ATOM 1859 OD2 ASP A 126 -6.803 -3.728 7.970 1.00 23.33 O ATOM 0 H ASP A 126 -7.573 -4.530 4.079 1.00 50.31 H new ATOM 0 HA ASP A 126 -9.177 -2.398 5.116 1.00 32.40 H new ATOM 0 HB2 ASP A 126 -6.277 -3.207 5.503 1.00 13.11 H new ATOM 0 HB3 ASP A 126 -6.881 -1.700 6.162 1.00 13.11 H new ATOM 1864 N GLU A 127 -8.053 -0.284 4.167 1.00 35.13 N ATOM 1865 CA GLU A 127 -7.566 0.864 3.453 1.00 75.44 C ATOM 1866 C GLU A 127 -6.637 1.679 4.332 1.00 42.24 C ATOM 1867 O GLU A 127 -6.942 1.975 5.492 1.00 12.04 O ATOM 1868 CB GLU A 127 -8.703 1.693 2.769 1.00 71.21 C ATOM 1869 CG GLU A 127 -9.865 2.201 3.645 1.00 13.45 C ATOM 1870 CD GLU A 127 -9.567 3.446 4.469 1.00 33.44 C ATOM 1871 OE1 GLU A 127 -9.223 4.496 3.890 1.00 61.44 O ATOM 1872 OE2 GLU A 127 -9.787 3.417 5.682 1.00 65.15 O ATOM 0 H GLU A 127 -8.679 -0.067 4.943 1.00 35.13 H new ATOM 0 HA GLU A 127 -6.970 0.511 2.612 1.00 75.44 H new ATOM 0 HB2 GLU A 127 -8.243 2.559 2.293 1.00 71.21 H new ATOM 0 HB3 GLU A 127 -9.129 1.081 1.974 1.00 71.21 H new ATOM 0 HG2 GLU A 127 -10.719 2.409 3.001 1.00 13.45 H new ATOM 0 HG3 GLU A 127 -10.164 1.401 4.322 1.00 13.45 H new ATOM 1879 N ILE A 128 -5.476 1.941 3.806 1.00 54.24 N ATOM 1880 CA ILE A 128 -4.440 2.661 4.488 1.00 52.54 C ATOM 1881 C ILE A 128 -4.210 3.966 3.749 1.00 72.24 C ATOM 1882 O ILE A 128 -3.925 3.965 2.548 1.00 32.03 O ATOM 1883 CB ILE A 128 -3.072 1.857 4.558 1.00 30.22 C ATOM 1884 CG1 ILE A 128 -3.200 0.485 5.284 1.00 11.13 C ATOM 1885 CG2 ILE A 128 -1.982 2.685 5.231 1.00 53.24 C ATOM 1886 CD1 ILE A 128 -3.904 -0.614 4.504 1.00 52.10 C ATOM 0 H ILE A 128 -5.216 1.651 2.863 1.00 54.24 H new ATOM 0 HA ILE A 128 -4.765 2.827 5.515 1.00 52.54 H new ATOM 0 HB ILE A 128 -2.797 1.655 3.523 1.00 30.22 H new ATOM 0 HG12 ILE A 128 -2.200 0.137 5.542 1.00 11.13 H new ATOM 0 HG13 ILE A 128 -3.735 0.640 6.221 1.00 11.13 H new ATOM 0 HG21 ILE A 128 -1.057 2.110 5.265 1.00 53.24 H new ATOM 0 HG22 ILE A 128 -1.819 3.601 4.664 1.00 53.24 H new ATOM 0 HG23 ILE A 128 -2.290 2.936 6.246 1.00 53.24 H new ATOM 0 HD11 ILE A 128 -3.936 -1.523 5.105 1.00 52.10 H new ATOM 0 HD12 ILE A 128 -4.920 -0.299 4.268 1.00 52.10 H new ATOM 0 HD13 ILE A 128 -3.361 -0.809 3.579 1.00 52.10 H new ATOM 1898 N GLN A 129 -4.357 5.052 4.445 1.00 62.21 N ATOM 1899 CA GLN A 129 -4.179 6.359 3.889 1.00 22.34 C ATOM 1900 C GLN A 129 -2.924 7.036 4.364 1.00 53.35 C ATOM 1901 O GLN A 129 -2.620 7.066 5.567 1.00 3.14 O ATOM 1902 CB GLN A 129 -5.366 7.257 4.149 1.00 1.00 C ATOM 1903 CG GLN A 129 -6.515 7.069 3.197 1.00 14.22 C ATOM 1904 CD GLN A 129 -7.642 7.995 3.526 1.00 72.23 C ATOM 1905 OE1 GLN A 129 -7.673 9.124 3.070 1.00 70.04 O ATOM 1906 NE2 GLN A 129 -8.608 7.512 4.254 1.00 61.33 N ATOM 0 H GLN A 129 -4.609 5.055 5.433 1.00 62.21 H new ATOM 0 HA GLN A 129 -4.087 6.198 2.815 1.00 22.34 H new ATOM 0 HB2 GLN A 129 -5.721 7.083 5.165 1.00 1.00 H new ATOM 0 HB3 GLN A 129 -5.037 8.295 4.100 1.00 1.00 H new ATOM 0 HG2 GLN A 129 -6.179 7.249 2.176 1.00 14.22 H new ATOM 0 HG3 GLN A 129 -6.863 6.037 3.241 1.00 14.22 H new ATOM 0 HE21 GLN A 129 -8.546 6.561 4.618 1.00 61.33 H new ATOM 0 HE22 GLN A 129 -9.427 8.084 4.460 1.00 61.33 H new ATOM 1915 N ILE A 130 -2.197 7.550 3.405 1.00 61.34 N ATOM 1916 CA ILE A 130 -1.020 8.347 3.625 1.00 24.51 C ATOM 1917 C ILE A 130 -1.319 9.731 3.047 1.00 41.52 C ATOM 1918 O ILE A 130 -1.349 9.890 1.819 1.00 14.22 O ATOM 1919 CB ILE A 130 0.263 7.744 2.902 1.00 70.12 C ATOM 1920 CG1 ILE A 130 0.717 6.383 3.490 1.00 34.44 C ATOM 1921 CG2 ILE A 130 1.431 8.720 2.888 1.00 24.50 C ATOM 1922 CD1 ILE A 130 -0.145 5.193 3.117 1.00 32.53 C ATOM 0 H ILE A 130 -2.416 7.420 2.417 1.00 61.34 H new ATOM 0 HA ILE A 130 -0.795 8.377 4.691 1.00 24.51 H new ATOM 0 HB ILE A 130 -0.054 7.567 1.874 1.00 70.12 H new ATOM 0 HG12 ILE A 130 1.738 6.187 3.162 1.00 34.44 H new ATOM 0 HG13 ILE A 130 0.741 6.466 4.577 1.00 34.44 H new ATOM 0 HG21 ILE A 130 2.282 8.262 2.384 1.00 24.50 H new ATOM 0 HG22 ILE A 130 1.141 9.627 2.358 1.00 24.50 H new ATOM 0 HG23 ILE A 130 1.708 8.971 3.912 1.00 24.50 H new ATOM 0 HD11 ILE A 130 0.259 4.292 3.579 1.00 32.53 H new ATOM 0 HD12 ILE A 130 -1.163 5.357 3.470 1.00 32.53 H new ATOM 0 HD13 ILE A 130 -0.151 5.074 2.034 1.00 32.53 H new ATOM 1934 N GLY A 131 -1.609 10.701 3.915 1.00 40.24 N ATOM 1935 CA GLY A 131 -1.916 12.079 3.482 1.00 11.22 C ATOM 1936 C GLY A 131 -3.293 12.201 2.814 1.00 64.44 C ATOM 1937 O GLY A 131 -4.185 12.915 3.301 1.00 61.45 O ATOM 0 H GLY A 131 -1.640 10.565 4.925 1.00 40.24 H new ATOM 0 HA2 GLY A 131 -1.876 12.743 4.345 1.00 11.22 H new ATOM 0 HA3 GLY A 131 -1.148 12.415 2.785 1.00 11.22 H new ATOM 1941 N LYS A 132 -3.421 11.561 1.671 1.00 63.15 N ATOM 1942 CA LYS A 132 -4.681 11.438 0.934 1.00 25.22 C ATOM 1943 C LYS A 132 -4.645 10.223 -0.016 1.00 22.41 C ATOM 1944 O LYS A 132 -5.566 10.013 -0.809 1.00 50.21 O ATOM 1945 CB LYS A 132 -4.994 12.702 0.118 1.00 74.40 C ATOM 1946 CG LYS A 132 -3.932 13.058 -0.919 1.00 23.31 C ATOM 1947 CD LYS A 132 -4.430 14.099 -1.915 1.00 71.13 C ATOM 1948 CE LYS A 132 -5.536 13.532 -2.805 1.00 32.30 C ATOM 1949 NZ LYS A 132 -6.014 14.506 -3.812 1.00 71.55 N ATOM 0 H LYS A 132 -2.638 11.097 1.209 1.00 63.15 H new ATOM 0 HA LYS A 132 -5.466 11.301 1.677 1.00 25.22 H new ATOM 0 HB2 LYS A 132 -5.949 12.566 -0.389 1.00 74.40 H new ATOM 0 HB3 LYS A 132 -5.113 13.542 0.802 1.00 74.40 H new ATOM 0 HG2 LYS A 132 -3.044 13.437 -0.413 1.00 23.31 H new ATOM 0 HG3 LYS A 132 -3.633 12.157 -1.455 1.00 23.31 H new ATOM 0 HD2 LYS A 132 -4.804 14.970 -1.377 1.00 71.13 H new ATOM 0 HD3 LYS A 132 -3.600 14.439 -2.535 1.00 71.13 H new ATOM 0 HE2 LYS A 132 -5.167 12.641 -3.314 1.00 32.30 H new ATOM 0 HE3 LYS A 132 -6.374 13.219 -2.182 1.00 32.30 H new ATOM 0 HZ1 LYS A 132 -6.763 14.071 -4.388 1.00 71.55 H new ATOM 0 HZ2 LYS A 132 -6.393 15.346 -3.330 1.00 71.55 H new ATOM 0 HZ3 LYS A 132 -5.223 14.786 -4.427 1.00 71.55 H new ATOM 1963 N PHE A 133 -3.587 9.437 0.055 1.00 4.12 N ATOM 1964 CA PHE A 133 -3.447 8.282 -0.799 1.00 72.14 C ATOM 1965 C PHE A 133 -4.036 7.109 -0.085 1.00 10.12 C ATOM 1966 O PHE A 133 -3.622 6.816 1.025 1.00 0.33 O ATOM 1967 CB PHE A 133 -1.965 7.971 -1.074 1.00 75.12 C ATOM 1968 CG PHE A 133 -1.206 8.999 -1.864 1.00 12.54 C ATOM 1969 CD1 PHE A 133 -0.735 10.156 -1.264 1.00 53.42 C ATOM 1970 CD2 PHE A 133 -0.931 8.787 -3.201 1.00 22.25 C ATOM 1971 CE1 PHE A 133 -0.013 11.081 -1.982 1.00 1.24 C ATOM 1972 CE2 PHE A 133 -0.210 9.711 -3.924 1.00 34.50 C ATOM 1973 CZ PHE A 133 0.250 10.858 -3.316 1.00 5.55 C ATOM 0 H PHE A 133 -2.810 9.582 0.700 1.00 4.12 H new ATOM 0 HA PHE A 133 -3.949 8.481 -1.746 1.00 72.14 H new ATOM 0 HB2 PHE A 133 -1.461 7.833 -0.117 1.00 75.12 H new ATOM 0 HB3 PHE A 133 -1.907 7.020 -1.604 1.00 75.12 H new ATOM 0 HD1 PHE A 133 -0.938 10.334 -0.218 1.00 53.42 H new ATOM 0 HD2 PHE A 133 -1.285 7.888 -3.684 1.00 22.25 H new ATOM 0 HE1 PHE A 133 0.346 11.979 -1.502 1.00 1.24 H new ATOM 0 HE2 PHE A 133 -0.005 9.536 -4.970 1.00 34.50 H new ATOM 0 HZ PHE A 133 0.816 11.582 -3.884 1.00 5.55 H new ATOM 1983 N ARG A 134 -4.971 6.436 -0.695 1.00 62.22 N ATOM 1984 CA ARG A 134 -5.547 5.274 -0.062 1.00 65.14 C ATOM 1985 C ARG A 134 -5.163 4.020 -0.792 1.00 25.44 C ATOM 1986 O ARG A 134 -5.473 3.830 -1.990 1.00 50.23 O ATOM 1987 CB ARG A 134 -7.073 5.385 0.110 1.00 75.24 C ATOM 1988 CG ARG A 134 -7.813 5.871 -1.113 1.00 74.31 C ATOM 1989 CD ARG A 134 -9.323 5.843 -0.910 1.00 12.21 C ATOM 1990 NE ARG A 134 -9.761 6.519 0.320 1.00 51.40 N ATOM 1991 CZ ARG A 134 -9.838 7.847 0.532 1.00 40.43 C ATOM 1992 NH1 ARG A 134 -9.396 8.728 -0.371 1.00 61.52 N ATOM 1993 NH2 ARG A 134 -10.364 8.282 1.654 1.00 10.53 N ATOM 0 H ARG A 134 -5.348 6.663 -1.615 1.00 62.22 H new ATOM 0 HA ARG A 134 -5.131 5.222 0.944 1.00 65.14 H new ATOM 0 HB2 ARG A 134 -7.465 4.407 0.390 1.00 75.24 H new ATOM 0 HB3 ARG A 134 -7.283 6.062 0.938 1.00 75.24 H new ATOM 0 HG2 ARG A 134 -7.497 6.887 -1.349 1.00 74.31 H new ATOM 0 HG3 ARG A 134 -7.550 5.249 -1.968 1.00 74.31 H new ATOM 0 HD2 ARG A 134 -9.806 6.314 -1.766 1.00 12.21 H new ATOM 0 HD3 ARG A 134 -9.659 4.806 -0.885 1.00 12.21 H new ATOM 0 HE ARG A 134 -10.036 5.918 1.096 1.00 51.40 H new ATOM 0 HH11 ARG A 134 -8.988 8.400 -1.246 1.00 61.52 H new ATOM 0 HH12 ARG A 134 -9.467 9.728 -0.185 1.00 61.52 H new ATOM 0 HH21 ARG A 134 -10.706 7.618 2.348 1.00 10.53 H new ATOM 0 HH22 ARG A 134 -10.430 9.284 1.831 1.00 10.53 H new ATOM 2007 N LEU A 135 -4.488 3.189 -0.068 1.00 21.12 N ATOM 2008 CA LEU A 135 -3.984 1.933 -0.529 1.00 2.24 C ATOM 2009 C LEU A 135 -4.806 0.855 0.116 1.00 75.34 C ATOM 2010 O LEU A 135 -5.057 0.910 1.306 1.00 31.45 O ATOM 2011 CB LEU A 135 -2.492 1.746 -0.101 1.00 5.24 C ATOM 2012 CG LEU A 135 -1.393 2.639 -0.756 1.00 75.41 C ATOM 2013 CD1 LEU A 135 -1.614 4.126 -0.520 1.00 62.51 C ATOM 2014 CD2 LEU A 135 -0.024 2.248 -0.230 1.00 33.32 C ATOM 0 H LEU A 135 -4.261 3.375 0.909 1.00 21.12 H new ATOM 0 HA LEU A 135 -4.042 1.890 -1.617 1.00 2.24 H new ATOM 0 HB2 LEU A 135 -2.439 1.898 0.977 1.00 5.24 H new ATOM 0 HB3 LEU A 135 -2.225 0.706 -0.290 1.00 5.24 H new ATOM 0 HG LEU A 135 -1.454 2.467 -1.831 1.00 75.41 H new ATOM 0 HD11 LEU A 135 -0.817 4.693 -1.000 1.00 62.51 H new ATOM 0 HD12 LEU A 135 -2.575 4.422 -0.941 1.00 62.51 H new ATOM 0 HD13 LEU A 135 -1.609 4.329 0.551 1.00 62.51 H new ATOM 0 HD21 LEU A 135 0.737 2.877 -0.693 1.00 33.32 H new ATOM 0 HD22 LEU A 135 0.002 2.383 0.851 1.00 33.32 H new ATOM 0 HD23 LEU A 135 0.173 1.203 -0.470 1.00 33.32 H new ATOM 2026 N VAL A 136 -5.229 -0.097 -0.638 1.00 53.25 N ATOM 2027 CA VAL A 136 -5.984 -1.193 -0.093 1.00 30.24 C ATOM 2028 C VAL A 136 -5.132 -2.425 -0.176 1.00 13.54 C ATOM 2029 O VAL A 136 -4.550 -2.716 -1.222 1.00 22.31 O ATOM 2030 CB VAL A 136 -7.348 -1.402 -0.828 1.00 72.52 C ATOM 2031 CG1 VAL A 136 -8.090 -2.627 -0.291 1.00 61.44 C ATOM 2032 CG2 VAL A 136 -8.221 -0.172 -0.660 1.00 14.53 C ATOM 0 H VAL A 136 -5.068 -0.148 -1.644 1.00 53.25 H new ATOM 0 HA VAL A 136 -6.237 -0.972 0.944 1.00 30.24 H new ATOM 0 HB VAL A 136 -7.135 -1.564 -1.885 1.00 72.52 H new ATOM 0 HG11 VAL A 136 -9.034 -2.743 -0.824 1.00 61.44 H new ATOM 0 HG12 VAL A 136 -7.478 -3.517 -0.439 1.00 61.44 H new ATOM 0 HG13 VAL A 136 -8.288 -2.495 0.773 1.00 61.44 H new ATOM 0 HG21 VAL A 136 -9.169 -0.326 -1.175 1.00 14.53 H new ATOM 0 HG22 VAL A 136 -8.407 -0.000 0.400 1.00 14.53 H new ATOM 0 HG23 VAL A 136 -7.714 0.695 -1.084 1.00 14.53 H new ATOM 2042 N PHE A 137 -5.019 -3.104 0.928 1.00 71.41 N ATOM 2043 CA PHE A 137 -4.184 -4.272 1.039 1.00 54.40 C ATOM 2044 C PHE A 137 -4.978 -5.498 0.651 1.00 4.21 C ATOM 2045 O PHE A 137 -6.110 -5.652 1.062 1.00 14.13 O ATOM 2046 CB PHE A 137 -3.678 -4.382 2.477 1.00 1.10 C ATOM 2047 CG PHE A 137 -2.766 -5.547 2.754 1.00 1.13 C ATOM 2048 CD1 PHE A 137 -1.479 -5.575 2.252 1.00 34.55 C ATOM 2049 CD2 PHE A 137 -3.191 -6.596 3.548 1.00 31.43 C ATOM 2050 CE1 PHE A 137 -0.640 -6.628 2.538 1.00 12.15 C ATOM 2051 CE2 PHE A 137 -2.360 -7.651 3.834 1.00 1.14 C ATOM 2052 CZ PHE A 137 -1.084 -7.668 3.329 1.00 74.45 C ATOM 0 H PHE A 137 -5.509 -2.862 1.789 1.00 71.41 H new ATOM 0 HA PHE A 137 -3.329 -4.192 0.368 1.00 54.40 H new ATOM 0 HB2 PHE A 137 -3.151 -3.462 2.730 1.00 1.10 H new ATOM 0 HB3 PHE A 137 -4.538 -4.450 3.143 1.00 1.10 H new ATOM 0 HD1 PHE A 137 -1.129 -4.764 1.630 1.00 34.55 H new ATOM 0 HD2 PHE A 137 -4.193 -6.585 3.950 1.00 31.43 H new ATOM 0 HE1 PHE A 137 0.365 -6.640 2.144 1.00 12.15 H new ATOM 0 HE2 PHE A 137 -2.709 -8.464 4.454 1.00 1.14 H new ATOM 0 HZ PHE A 137 -0.427 -8.496 3.551 1.00 74.45 H new ATOM 2062 N LEU A 138 -4.398 -6.337 -0.153 1.00 75.21 N ATOM 2063 CA LEU A 138 -5.032 -7.548 -0.613 1.00 1.31 C ATOM 2064 C LEU A 138 -4.090 -8.714 -0.447 1.00 23.21 C ATOM 2065 O LEU A 138 -2.867 -8.537 -0.294 1.00 42.11 O ATOM 2066 CB LEU A 138 -5.486 -7.491 -2.104 1.00 41.15 C ATOM 2067 CG LEU A 138 -6.635 -6.540 -2.507 1.00 34.41 C ATOM 2068 CD1 LEU A 138 -7.858 -6.705 -1.616 1.00 0.24 C ATOM 2069 CD2 LEU A 138 -6.186 -5.093 -2.593 1.00 34.24 C ATOM 0 H LEU A 138 -3.455 -6.202 -0.517 1.00 75.21 H new ATOM 0 HA LEU A 138 -5.927 -7.667 -0.003 1.00 1.31 H new ATOM 0 HB2 LEU A 138 -4.615 -7.224 -2.702 1.00 41.15 H new ATOM 0 HB3 LEU A 138 -5.777 -8.500 -2.397 1.00 41.15 H new ATOM 0 HG LEU A 138 -6.936 -6.833 -3.513 1.00 34.41 H new ATOM 0 HD11 LEU A 138 -8.639 -6.016 -1.938 1.00 0.24 H new ATOM 0 HD12 LEU A 138 -8.225 -7.729 -1.688 1.00 0.24 H new ATOM 0 HD13 LEU A 138 -7.587 -6.489 -0.583 1.00 0.24 H new ATOM 0 HD21 LEU A 138 -7.031 -4.466 -2.880 1.00 34.24 H new ATOM 0 HD22 LEU A 138 -5.808 -4.771 -1.623 1.00 34.24 H new ATOM 0 HD23 LEU A 138 -5.396 -5.001 -3.339 1.00 34.24 H new ATOM 2081 N ALA A 139 -4.645 -9.894 -0.459 1.00 54.55 N ATOM 2082 CA ALA A 139 -3.846 -11.089 -0.431 1.00 72.52 C ATOM 2083 C ALA A 139 -3.198 -11.215 -1.805 1.00 50.22 C ATOM 2084 O ALA A 139 -3.870 -11.054 -2.838 1.00 4.43 O ATOM 2085 CB ALA A 139 -4.720 -12.297 -0.132 1.00 73.43 C ATOM 0 H ALA A 139 -5.652 -10.055 -0.488 1.00 54.55 H new ATOM 0 HA ALA A 139 -3.086 -11.040 0.349 1.00 72.52 H new ATOM 0 HB1 ALA A 139 -4.104 -13.196 -0.113 1.00 73.43 H new ATOM 0 HB2 ALA A 139 -5.201 -12.167 0.837 1.00 73.43 H new ATOM 0 HB3 ALA A 139 -5.482 -12.395 -0.905 1.00 73.43 H new ATOM 2091 N GLY A 140 -1.905 -11.464 -1.811 1.00 63.30 N ATOM 2092 CA GLY A 140 -1.127 -11.379 -3.021 1.00 2.43 C ATOM 2093 C GLY A 140 -1.214 -12.563 -3.935 1.00 61.12 C ATOM 2094 O GLY A 140 -2.131 -13.390 -3.822 1.00 12.31 O ATOM 0 H GLY A 140 -1.371 -11.728 -0.983 1.00 63.30 H new ATOM 0 HA2 GLY A 140 -1.443 -10.494 -3.573 1.00 2.43 H new ATOM 0 HA3 GLY A 140 -0.082 -11.229 -2.749 1.00 2.43 H new ATOM 2098 N PRO A 141 -0.271 -12.664 -4.873 1.00 73.41 N ATOM 2099 CA PRO A 141 -0.247 -13.725 -5.854 1.00 44.32 C ATOM 2100 C PRO A 141 0.125 -15.061 -5.250 1.00 32.41 C ATOM 2101 O PRO A 141 0.925 -15.142 -4.307 1.00 72.31 O ATOM 2102 CB PRO A 141 0.822 -13.285 -6.868 1.00 23.34 C ATOM 2103 CG PRO A 141 1.175 -11.884 -6.497 1.00 61.14 C ATOM 2104 CD PRO A 141 0.878 -11.760 -5.040 1.00 32.53 C ATOM 0 HA PRO A 141 -1.231 -13.871 -6.300 1.00 44.32 H new ATOM 0 HB2 PRO A 141 1.696 -13.935 -6.823 1.00 23.34 H new ATOM 0 HB3 PRO A 141 0.440 -13.336 -7.887 1.00 23.34 H new ATOM 0 HG2 PRO A 141 2.226 -11.679 -6.700 1.00 61.14 H new ATOM 0 HG3 PRO A 141 0.593 -11.168 -7.077 1.00 61.14 H new ATOM 0 HD2 PRO A 141 1.726 -12.063 -4.426 1.00 32.53 H new ATOM 0 HD3 PRO A 141 0.632 -10.735 -4.761 1.00 32.53 H new ATOM 2112 N ALA A 142 -0.465 -16.090 -5.777 1.00 32.10 N ATOM 2113 CA ALA A 142 -0.168 -17.427 -5.386 1.00 71.42 C ATOM 2114 C ALA A 142 0.457 -18.118 -6.572 1.00 13.23 C ATOM 2115 O ALA A 142 -0.142 -18.974 -7.228 1.00 30.12 O ATOM 2116 CB ALA A 142 -1.412 -18.149 -4.883 1.00 32.15 C ATOM 0 H ALA A 142 -1.178 -16.019 -6.503 1.00 32.10 H new ATOM 0 HA ALA A 142 0.531 -17.435 -4.550 1.00 71.42 H new ATOM 0 HB1 ALA A 142 -1.150 -19.166 -4.593 1.00 32.15 H new ATOM 0 HB2 ALA A 142 -1.817 -17.619 -4.021 1.00 32.15 H new ATOM 0 HB3 ALA A 142 -2.160 -18.179 -5.675 1.00 32.15 H new ATOM 2122 N GLU A 143 1.611 -17.643 -6.918 1.00 33.03 N ATOM 2123 CA GLU A 143 2.329 -18.124 -8.054 1.00 21.23 C ATOM 2124 C GLU A 143 3.558 -18.882 -7.589 1.00 35.35 C ATOM 2125 O GLU A 143 3.578 -20.119 -7.678 1.00 37.79 O ATOM 2126 CB GLU A 143 2.721 -16.945 -8.953 1.00 43.40 C ATOM 2127 CG GLU A 143 3.253 -17.352 -10.310 1.00 41.24 C ATOM 2128 CD GLU A 143 2.217 -18.081 -11.125 1.00 72.23 C ATOM 2129 OE1 GLU A 143 2.043 -19.303 -10.950 1.00 52.22 O ATOM 2130 OE2 GLU A 143 1.548 -17.448 -11.959 1.00 41.50 O ATOM 2131 OXT GLU A 143 4.506 -18.243 -7.074 1.00 37.79 O ATOM 0 H GLU A 143 2.088 -16.898 -6.411 1.00 33.03 H new ATOM 0 HA GLU A 143 1.700 -18.802 -8.631 1.00 21.23 H new ATOM 0 HB2 GLU A 143 1.851 -16.304 -9.093 1.00 43.40 H new ATOM 0 HB3 GLU A 143 3.477 -16.348 -8.442 1.00 43.40 H new ATOM 0 HG2 GLU A 143 3.582 -16.465 -10.851 1.00 41.24 H new ATOM 0 HG3 GLU A 143 4.127 -17.990 -10.181 1.00 41.24 H new TER 2138 GLU A 143