USER MOD reduce.3.24.130724 H: found=0, std=0, add=874, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 872 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 96 ASN : amide:sc= -5.52 K(o=-6.6,f=-10!) USER MOD Set 1.2: A 97 LYS NZ :NH3+ -165:sc= 0 (180deg=0) USER MOD Set 1.3: A 98 HIS :FLIP no HD1:sc= -1.05 F(o=-7.6,f=-6.6) USER MOD Set 2.1: A 53 SER OG : rot -40:sc= 0.183 USER MOD Set 2.2: A 95 GLN : amide:sc= 0.167 X(o=0.35,f=0.6) USER MOD Set 3.1: A 35 LYS NZ :NH3+ -178:sc= 0.00428 (180deg=0) USER MOD Set 3.2: A 78 THR OG1 : rot 180:sc= -0.0747 USER MOD Set 4.1: A 70 SER OG : rot 89:sc= 1.05 USER MOD Set 4.2: A 71 HIS :FLIP no HD1:sc= 0.852 F(o=-0.34,f=1.9) USER MOD Set 5.1: A 52 TYR OH : rot 180:sc= -0.309 USER MOD Set 5.2: A 75 MET CE :methyl -177:sc= -1.04 (180deg=-1.1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 12:sc= 0.331 USER MOD Single : A 5 SER OG : rot 180:sc= -0.184 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.485 X(o=-0.49,f=-0.56) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 168:sc= 0.892 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 26:sc= 0.199 USER MOD Single : A 40 THR OG1 : rot 177:sc= 0.0893 USER MOD Single : A 43 SER OG : rot 82:sc= 0.121 USER MOD Single : A 46 HIS : no HD1:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.0104 X(o=-0.01,f=-0.09) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.00448 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 167:sc= 0.731 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 THR OG1 : rot 124:sc= 1.22 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 GLN : amide:sc= -0.878 K(o=-0.88,f=-3.2!) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 MET CE :methyl -147:sc= 0 (180deg=-0.00401) USER MOD Single : A 86 THR OG1 : rot 68:sc= 0.429 USER MOD Single : A 88 TYR OH : rot 30:sc= -0.125 USER MOD Single : A 93 MET CE :methyl -109:sc= -2.71! (180deg=-5.27!) USER MOD Single : A 100 SER OG : rot 37:sc= 0.153 USER MOD Single : A 103 SER OG : rot 36:sc= 0.0354 USER MOD Single : A 104 SER OG : rot -110:sc= -1.95 USER MOD Single : A 111 THR OG1 : rot -157:sc= 2.02 USER MOD Single : A 112 GLN : amide:sc= -1.2 K(o=-1.2,f=-2.3) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.564 3.705 -39.674 1.00 0.00 N ATOM 2 CA GLY A 1 -2.129 3.924 -39.705 1.00 0.00 C ATOM 3 C GLY A 1 -1.421 3.294 -38.522 1.00 0.00 C ATOM 4 O GLY A 1 -1.678 3.653 -37.373 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.002 4.155 -40.503 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.760 2.684 -39.690 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.960 4.119 -38.806 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.722 3.514 -40.629 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.928 4.995 -39.716 1.00 0.00 H new ATOM 8 N SER A 2 -0.527 2.351 -38.802 1.00 0.00 N ATOM 9 CA SER A 2 0.216 1.666 -37.752 1.00 0.00 C ATOM 10 C SER A 2 0.813 2.667 -36.767 1.00 0.00 C ATOM 11 O SER A 2 0.987 3.842 -37.089 1.00 0.00 O ATOM 12 CB SER A 2 1.327 0.808 -38.361 1.00 0.00 C ATOM 13 OG SER A 2 0.801 -0.121 -39.293 1.00 0.00 O ATOM 0 H SER A 2 -0.300 2.044 -39.748 1.00 0.00 H new ATOM 0 HA SER A 2 -0.477 1.021 -37.212 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.057 1.450 -38.855 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.854 0.275 -37.570 1.00 0.00 H new ATOM 0 HG SER A 2 1.531 -0.656 -39.669 1.00 0.00 H new ATOM 19 N SER A 3 1.124 2.191 -35.566 1.00 0.00 N ATOM 20 CA SER A 3 1.698 3.044 -34.531 1.00 0.00 C ATOM 21 C SER A 3 2.576 2.233 -33.583 1.00 0.00 C ATOM 22 O SER A 3 2.126 1.256 -32.987 1.00 0.00 O ATOM 23 CB SER A 3 0.588 3.744 -33.744 1.00 0.00 C ATOM 24 OG SER A 3 0.045 4.826 -34.481 1.00 0.00 O ATOM 0 H SER A 3 0.988 1.220 -35.285 1.00 0.00 H new ATOM 0 HA SER A 3 2.318 3.796 -35.018 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.200 3.029 -33.507 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.984 4.108 -32.796 1.00 0.00 H new ATOM 0 HG SER A 3 0.367 4.786 -35.406 1.00 0.00 H new ATOM 30 N GLY A 4 3.832 2.647 -33.450 1.00 0.00 N ATOM 31 CA GLY A 4 4.754 1.948 -32.573 1.00 0.00 C ATOM 32 C GLY A 4 4.545 2.300 -31.114 1.00 0.00 C ATOM 33 O GLY A 4 3.414 2.325 -30.630 1.00 0.00 O ATOM 0 H GLY A 4 4.228 3.453 -33.933 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.632 0.873 -32.705 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.777 2.190 -32.859 1.00 0.00 H new ATOM 37 N SER A 5 5.640 2.570 -30.409 1.00 0.00 N ATOM 38 CA SER A 5 5.572 2.916 -28.994 1.00 0.00 C ATOM 39 C SER A 5 4.803 4.218 -28.789 1.00 0.00 C ATOM 40 O SER A 5 3.839 4.268 -28.026 1.00 0.00 O ATOM 41 CB SER A 5 6.980 3.045 -28.411 1.00 0.00 C ATOM 42 OG SER A 5 7.708 4.074 -29.058 1.00 0.00 O ATOM 0 H SER A 5 6.584 2.556 -30.795 1.00 0.00 H new ATOM 0 HA SER A 5 5.043 2.117 -28.475 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.917 3.256 -27.343 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.509 2.098 -28.518 1.00 0.00 H new ATOM 0 HG SER A 5 8.604 4.137 -28.666 1.00 0.00 H new ATOM 48 N SER A 6 5.238 5.268 -29.478 1.00 0.00 N ATOM 49 CA SER A 6 4.594 6.572 -29.369 1.00 0.00 C ATOM 50 C SER A 6 4.167 6.850 -27.931 1.00 0.00 C ATOM 51 O SER A 6 3.052 7.306 -27.679 1.00 0.00 O ATOM 52 CB SER A 6 3.379 6.643 -30.297 1.00 0.00 C ATOM 53 OG SER A 6 3.762 7.006 -31.612 1.00 0.00 O ATOM 0 H SER A 6 6.033 5.242 -30.117 1.00 0.00 H new ATOM 0 HA SER A 6 5.316 7.332 -29.668 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.875 5.677 -30.315 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.664 7.369 -29.910 1.00 0.00 H new ATOM 0 HG SER A 6 2.968 7.043 -32.186 1.00 0.00 H new ATOM 59 N GLY A 7 5.064 6.570 -26.990 1.00 0.00 N ATOM 60 CA GLY A 7 4.762 6.795 -25.588 1.00 0.00 C ATOM 61 C GLY A 7 5.295 8.123 -25.087 1.00 0.00 C ATOM 62 O GLY A 7 5.653 8.994 -25.879 1.00 0.00 O ATOM 0 H GLY A 7 5.993 6.192 -27.173 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.682 6.762 -25.442 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.189 5.988 -24.993 1.00 0.00 H new ATOM 66 N GLU A 8 5.344 8.279 -23.767 1.00 0.00 N ATOM 67 CA GLU A 8 5.835 9.511 -23.162 1.00 0.00 C ATOM 68 C GLU A 8 7.290 9.363 -22.727 1.00 0.00 C ATOM 69 O GLU A 8 7.581 9.199 -21.541 1.00 0.00 O ATOM 70 CB GLU A 8 4.968 9.896 -21.961 1.00 0.00 C ATOM 71 CG GLU A 8 3.504 10.104 -22.309 1.00 0.00 C ATOM 72 CD GLU A 8 3.250 11.432 -22.995 1.00 0.00 C ATOM 73 OE1 GLU A 8 3.727 12.466 -22.483 1.00 0.00 O ATOM 74 OE2 GLU A 8 2.574 11.437 -24.046 1.00 0.00 O ATOM 0 H GLU A 8 5.050 7.568 -23.097 1.00 0.00 H new ATOM 0 HA GLU A 8 5.778 10.301 -23.911 1.00 0.00 H new ATOM 0 HB2 GLU A 8 5.045 9.117 -21.203 1.00 0.00 H new ATOM 0 HB3 GLU A 8 5.361 10.811 -21.518 1.00 0.00 H new ATOM 0 HG2 GLU A 8 3.170 9.294 -22.958 1.00 0.00 H new ATOM 0 HG3 GLU A 8 2.907 10.050 -21.399 1.00 0.00 H new ATOM 81 N HIS A 9 8.200 9.420 -23.694 1.00 0.00 N ATOM 82 CA HIS A 9 9.625 9.292 -23.411 1.00 0.00 C ATOM 83 C HIS A 9 10.188 10.597 -22.856 1.00 0.00 C ATOM 84 O HIS A 9 10.777 11.391 -23.589 1.00 0.00 O ATOM 85 CB HIS A 9 10.383 8.893 -24.677 1.00 0.00 C ATOM 86 CG HIS A 9 9.845 9.526 -25.923 1.00 0.00 C ATOM 87 ND1 HIS A 9 8.996 8.873 -26.792 1.00 0.00 N ATOM 88 CD2 HIS A 9 10.037 10.760 -26.443 1.00 0.00 C ATOM 89 CE1 HIS A 9 8.691 9.679 -27.794 1.00 0.00 C ATOM 90 NE2 HIS A 9 9.310 10.831 -27.606 1.00 0.00 N ATOM 0 H HIS A 9 7.976 9.554 -24.680 1.00 0.00 H new ATOM 0 HA HIS A 9 9.753 8.513 -22.659 1.00 0.00 H new ATOM 0 HB2 HIS A 9 11.432 9.167 -24.564 1.00 0.00 H new ATOM 0 HB3 HIS A 9 10.347 7.809 -24.786 1.00 0.00 H new ATOM 0 HD2 HIS A 9 10.649 11.544 -26.022 1.00 0.00 H new ATOM 0 HE1 HIS A 9 8.045 9.437 -28.625 1.00 0.00 H new ATOM 0 HE2 HIS A 9 9.257 11.641 -28.224 1.00 0.00 H new ATOM 99 N ALA A 10 10.003 10.811 -21.558 1.00 0.00 N ATOM 100 CA ALA A 10 10.493 12.018 -20.905 1.00 0.00 C ATOM 101 C ALA A 10 11.519 11.682 -19.828 1.00 0.00 C ATOM 102 O ALA A 10 11.208 11.619 -18.639 1.00 0.00 O ATOM 103 CB ALA A 10 9.335 12.803 -20.307 1.00 0.00 C ATOM 0 H ALA A 10 9.517 10.164 -20.937 1.00 0.00 H new ATOM 0 HA ALA A 10 10.984 12.634 -21.658 1.00 0.00 H new ATOM 0 HB1 ALA A 10 9.716 13.702 -19.823 1.00 0.00 H new ATOM 0 HB2 ALA A 10 8.639 13.084 -21.098 1.00 0.00 H new ATOM 0 HB3 ALA A 10 8.818 12.186 -19.572 1.00 0.00 H new ATOM 109 N PRO A 11 12.772 11.460 -20.252 1.00 0.00 N ATOM 110 CA PRO A 11 13.869 11.126 -19.339 1.00 0.00 C ATOM 111 C PRO A 11 14.272 12.305 -18.460 1.00 0.00 C ATOM 112 O PRO A 11 15.206 12.209 -17.665 1.00 0.00 O ATOM 113 CB PRO A 11 15.014 10.748 -20.283 1.00 0.00 C ATOM 114 CG PRO A 11 14.714 11.471 -21.551 1.00 0.00 C ATOM 115 CD PRO A 11 13.215 11.518 -21.656 1.00 0.00 C ATOM 0 HA PRO A 11 13.592 10.334 -18.643 1.00 0.00 H new ATOM 0 HB2 PRO A 11 15.979 11.048 -19.875 1.00 0.00 H new ATOM 0 HB3 PRO A 11 15.057 9.671 -20.442 1.00 0.00 H new ATOM 0 HG2 PRO A 11 15.136 12.476 -21.536 1.00 0.00 H new ATOM 0 HG3 PRO A 11 15.149 10.955 -22.407 1.00 0.00 H new ATOM 0 HD2 PRO A 11 12.875 12.430 -22.147 1.00 0.00 H new ATOM 0 HD3 PRO A 11 12.826 10.680 -22.235 1.00 0.00 H new ATOM 123 N ALA A 12 13.560 13.418 -18.609 1.00 0.00 N ATOM 124 CA ALA A 12 13.841 14.615 -17.827 1.00 0.00 C ATOM 125 C ALA A 12 13.768 14.323 -16.332 1.00 0.00 C ATOM 126 O ALA A 12 12.686 14.305 -15.744 1.00 0.00 O ATOM 127 CB ALA A 12 12.872 15.728 -18.197 1.00 0.00 C ATOM 0 H ALA A 12 12.784 13.515 -19.264 1.00 0.00 H new ATOM 0 HA ALA A 12 14.855 14.940 -18.059 1.00 0.00 H new ATOM 0 HB1 ALA A 12 13.094 16.616 -17.605 1.00 0.00 H new ATOM 0 HB2 ALA A 12 12.975 15.963 -19.256 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.851 15.404 -17.995 1.00 0.00 H new ATOM 133 N THR A 13 14.926 14.095 -15.720 1.00 0.00 N ATOM 134 CA THR A 13 14.993 13.802 -14.294 1.00 0.00 C ATOM 135 C THR A 13 16.257 14.385 -13.672 1.00 0.00 C ATOM 136 O THR A 13 17.368 13.938 -13.960 1.00 0.00 O ATOM 137 CB THR A 13 14.958 12.285 -14.030 1.00 0.00 C ATOM 138 OG1 THR A 13 13.775 11.716 -14.602 1.00 0.00 O ATOM 139 CG2 THR A 13 14.995 11.995 -12.537 1.00 0.00 C ATOM 0 H THR A 13 15.831 14.108 -16.191 1.00 0.00 H new ATOM 0 HA THR A 13 14.119 14.264 -13.835 1.00 0.00 H new ATOM 0 HB THR A 13 15.837 11.837 -14.493 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.761 10.751 -14.431 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.969 10.917 -12.375 1.00 0.00 H new ATOM 0 HG22 THR A 13 15.910 12.405 -12.109 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.132 12.455 -12.056 1.00 0.00 H new ATOM 147 N THR A 14 16.081 15.387 -12.816 1.00 0.00 N ATOM 148 CA THR A 14 17.207 16.032 -12.153 1.00 0.00 C ATOM 149 C THR A 14 17.096 15.911 -10.638 1.00 0.00 C ATOM 150 O THR A 14 16.014 16.054 -10.071 1.00 0.00 O ATOM 151 CB THR A 14 17.304 17.522 -12.532 1.00 0.00 C ATOM 152 OG1 THR A 14 16.115 18.209 -12.125 1.00 0.00 O ATOM 153 CG2 THR A 14 17.503 17.688 -14.031 1.00 0.00 C ATOM 0 H THR A 14 15.169 15.769 -12.566 1.00 0.00 H new ATOM 0 HA THR A 14 18.108 15.520 -12.490 1.00 0.00 H new ATOM 0 HB THR A 14 18.165 17.949 -12.018 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.185 19.156 -12.368 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.569 18.749 -14.274 1.00 0.00 H new ATOM 0 HG22 THR A 14 18.424 17.189 -14.333 1.00 0.00 H new ATOM 0 HG23 THR A 14 16.660 17.246 -14.561 1.00 0.00 H new ATOM 161 N GLY A 15 18.224 15.647 -9.985 1.00 0.00 N ATOM 162 CA GLY A 15 18.231 15.511 -8.540 1.00 0.00 C ATOM 163 C GLY A 15 17.844 14.118 -8.087 1.00 0.00 C ATOM 164 O GLY A 15 17.390 13.289 -8.876 1.00 0.00 O ATOM 0 H GLY A 15 19.133 15.525 -10.431 1.00 0.00 H new ATOM 0 HA2 GLY A 15 19.224 15.750 -8.161 1.00 0.00 H new ATOM 0 HA3 GLY A 15 17.541 16.235 -8.107 1.00 0.00 H new ATOM 168 N PRO A 16 18.024 13.843 -6.786 1.00 0.00 N ATOM 169 CA PRO A 16 17.697 12.540 -6.200 1.00 0.00 C ATOM 170 C PRO A 16 16.194 12.290 -6.145 1.00 0.00 C ATOM 171 O PRO A 16 15.401 13.099 -6.628 1.00 0.00 O ATOM 172 CB PRO A 16 18.276 12.632 -4.786 1.00 0.00 C ATOM 173 CG PRO A 16 18.299 14.090 -4.480 1.00 0.00 C ATOM 174 CD PRO A 16 18.561 14.784 -5.788 1.00 0.00 C ATOM 0 HA PRO A 16 18.101 11.716 -6.788 1.00 0.00 H new ATOM 0 HB2 PRO A 16 17.661 12.087 -4.070 1.00 0.00 H new ATOM 0 HB3 PRO A 16 19.276 12.202 -4.739 1.00 0.00 H new ATOM 0 HG2 PRO A 16 17.351 14.413 -4.050 1.00 0.00 H new ATOM 0 HG3 PRO A 16 19.076 14.324 -3.752 1.00 0.00 H new ATOM 0 HD2 PRO A 16 18.061 15.751 -5.837 1.00 0.00 H new ATOM 0 HD3 PRO A 16 19.625 14.967 -5.940 1.00 0.00 H new ATOM 182 N LEU A 17 15.808 11.165 -5.553 1.00 0.00 N ATOM 183 CA LEU A 17 14.398 10.808 -5.434 1.00 0.00 C ATOM 184 C LEU A 17 14.001 10.640 -3.971 1.00 0.00 C ATOM 185 O LEU A 17 14.825 10.337 -3.109 1.00 0.00 O ATOM 186 CB LEU A 17 14.112 9.517 -6.204 1.00 0.00 C ATOM 187 CG LEU A 17 14.041 9.645 -7.726 1.00 0.00 C ATOM 188 CD1 LEU A 17 14.243 8.289 -8.385 1.00 0.00 C ATOM 189 CD2 LEU A 17 12.711 10.253 -8.148 1.00 0.00 C ATOM 0 H LEU A 17 16.451 10.485 -5.148 1.00 0.00 H new ATOM 0 HA LEU A 17 13.806 11.617 -5.861 1.00 0.00 H new ATOM 0 HB2 LEU A 17 14.886 8.791 -5.956 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.166 9.108 -5.849 1.00 0.00 H new ATOM 0 HG LEU A 17 14.841 10.308 -8.054 1.00 0.00 H new ATOM 0 HD11 LEU A 17 14.189 8.399 -9.468 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.220 7.892 -8.109 1.00 0.00 H new ATOM 0 HD13 LEU A 17 13.465 7.603 -8.051 1.00 0.00 H new ATOM 0 HD21 LEU A 17 12.678 10.337 -9.234 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.895 9.615 -7.808 1.00 0.00 H new ATOM 0 HD23 LEU A 17 12.606 11.243 -7.704 1.00 0.00 H new ATOM 201 N PRO A 18 12.706 10.840 -3.683 1.00 0.00 N ATOM 202 CA PRO A 18 12.168 10.713 -2.325 1.00 0.00 C ATOM 203 C PRO A 18 12.155 9.268 -1.839 1.00 0.00 C ATOM 204 O PRO A 18 12.682 8.375 -2.503 1.00 0.00 O ATOM 205 CB PRO A 18 10.740 11.246 -2.458 1.00 0.00 C ATOM 206 CG PRO A 18 10.387 11.033 -3.890 1.00 0.00 C ATOM 207 CD PRO A 18 11.667 11.204 -4.661 1.00 0.00 C ATOM 0 HA PRO A 18 12.772 11.252 -1.595 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.056 10.713 -1.798 1.00 0.00 H new ATOM 0 HB3 PRO A 18 10.685 12.301 -2.189 1.00 0.00 H new ATOM 0 HG2 PRO A 18 9.968 10.039 -4.045 1.00 0.00 H new ATOM 0 HG3 PRO A 18 9.635 11.751 -4.218 1.00 0.00 H new ATOM 0 HD2 PRO A 18 11.697 10.558 -5.538 1.00 0.00 H new ATOM 0 HD3 PRO A 18 11.789 12.228 -5.015 1.00 0.00 H new ATOM 215 N SER A 19 11.548 9.044 -0.678 1.00 0.00 N ATOM 216 CA SER A 19 11.468 7.707 -0.102 1.00 0.00 C ATOM 217 C SER A 19 10.016 7.295 0.116 1.00 0.00 C ATOM 218 O SER A 19 9.162 8.127 0.423 1.00 0.00 O ATOM 219 CB SER A 19 12.230 7.654 1.224 1.00 0.00 C ATOM 220 OG SER A 19 12.542 6.318 1.579 1.00 0.00 O ATOM 0 H SER A 19 11.104 9.772 -0.118 1.00 0.00 H new ATOM 0 HA SER A 19 11.924 7.008 -0.803 1.00 0.00 H new ATOM 0 HB2 SER A 19 13.148 8.236 1.143 1.00 0.00 H new ATOM 0 HB3 SER A 19 11.630 8.112 2.010 1.00 0.00 H new ATOM 0 HG SER A 19 13.030 6.311 2.429 1.00 0.00 H new ATOM 226 N ALA A 20 9.743 6.004 -0.045 1.00 0.00 N ATOM 227 CA ALA A 20 8.395 5.480 0.136 1.00 0.00 C ATOM 228 C ALA A 20 7.842 5.849 1.508 1.00 0.00 C ATOM 229 O ALA A 20 8.581 6.014 2.478 1.00 0.00 O ATOM 230 CB ALA A 20 8.387 3.970 -0.050 1.00 0.00 C ATOM 0 H ALA A 20 10.438 5.302 -0.300 1.00 0.00 H new ATOM 0 HA ALA A 20 7.752 5.932 -0.619 1.00 0.00 H new ATOM 0 HB1 ALA A 20 7.374 3.592 0.088 1.00 0.00 H new ATOM 0 HB2 ALA A 20 8.732 3.725 -1.055 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.049 3.510 0.683 1.00 0.00 H new ATOM 236 N PRO A 21 6.510 5.984 1.593 1.00 0.00 N ATOM 237 CA PRO A 21 5.828 6.335 2.843 1.00 0.00 C ATOM 238 C PRO A 21 5.879 5.208 3.868 1.00 0.00 C ATOM 239 O PRO A 21 6.112 4.050 3.520 1.00 0.00 O ATOM 240 CB PRO A 21 4.386 6.591 2.400 1.00 0.00 C ATOM 241 CG PRO A 21 4.224 5.790 1.154 1.00 0.00 C ATOM 242 CD PRO A 21 5.567 5.802 0.477 1.00 0.00 C ATOM 0 HA PRO A 21 6.295 7.188 3.336 1.00 0.00 H new ATOM 0 HB2 PRO A 21 3.676 6.280 3.166 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.211 7.651 2.215 1.00 0.00 H new ATOM 0 HG2 PRO A 21 3.911 4.771 1.383 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.458 6.221 0.509 1.00 0.00 H new ATOM 0 HD2 PRO A 21 5.755 4.872 -0.060 1.00 0.00 H new ATOM 0 HD3 PRO A 21 5.643 6.611 -0.250 1.00 0.00 H new ATOM 250 N ARG A 22 5.658 5.553 5.132 1.00 0.00 N ATOM 251 CA ARG A 22 5.679 4.569 6.208 1.00 0.00 C ATOM 252 C ARG A 22 4.274 4.328 6.752 1.00 0.00 C ATOM 253 O ARG A 22 3.297 4.874 6.239 1.00 0.00 O ATOM 254 CB ARG A 22 6.601 5.036 7.336 1.00 0.00 C ATOM 255 CG ARG A 22 7.756 5.902 6.860 1.00 0.00 C ATOM 256 CD ARG A 22 8.972 5.753 7.761 1.00 0.00 C ATOM 257 NE ARG A 22 9.692 4.507 7.508 1.00 0.00 N ATOM 258 CZ ARG A 22 10.694 4.071 8.263 1.00 0.00 C ATOM 259 NH1 ARG A 22 11.093 4.775 9.313 1.00 0.00 N ATOM 260 NH2 ARG A 22 11.299 2.927 7.968 1.00 0.00 N ATOM 0 H ARG A 22 5.462 6.507 5.436 1.00 0.00 H new ATOM 0 HA ARG A 22 6.058 3.631 5.802 1.00 0.00 H new ATOM 0 HB2 ARG A 22 6.015 5.596 8.065 1.00 0.00 H new ATOM 0 HB3 ARG A 22 7.001 4.163 7.852 1.00 0.00 H new ATOM 0 HG2 ARG A 22 8.022 5.627 5.839 1.00 0.00 H new ATOM 0 HG3 ARG A 22 7.444 6.946 6.838 1.00 0.00 H new ATOM 0 HD2 ARG A 22 9.644 6.597 7.606 1.00 0.00 H new ATOM 0 HD3 ARG A 22 8.656 5.784 8.804 1.00 0.00 H new ATOM 0 HE ARG A 22 9.410 3.941 6.708 1.00 0.00 H new ATOM 0 HH11 ARG A 22 10.630 5.654 9.543 1.00 0.00 H new ATOM 0 HH12 ARG A 22 11.863 4.437 9.891 1.00 0.00 H new ATOM 0 HH21 ARG A 22 10.994 2.382 7.161 1.00 0.00 H new ATOM 0 HH22 ARG A 22 12.068 2.593 8.548 1.00 0.00 H new ATOM 274 N ASP A 23 4.181 3.507 7.791 1.00 0.00 N ATOM 275 CA ASP A 23 2.896 3.193 8.405 1.00 0.00 C ATOM 276 C ASP A 23 1.885 2.749 7.353 1.00 0.00 C ATOM 277 O ASP A 23 0.694 3.046 7.456 1.00 0.00 O ATOM 278 CB ASP A 23 2.360 4.407 9.165 1.00 0.00 C ATOM 279 CG ASP A 23 1.226 4.048 10.105 1.00 0.00 C ATOM 280 OD1 ASP A 23 1.230 2.917 10.634 1.00 0.00 O ATOM 281 OD2 ASP A 23 0.334 4.897 10.311 1.00 0.00 O ATOM 0 H ASP A 23 4.980 3.046 8.226 1.00 0.00 H new ATOM 0 HA ASP A 23 3.047 2.372 9.106 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.170 4.862 9.735 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.014 5.155 8.451 1.00 0.00 H new ATOM 286 N VAL A 24 2.367 2.038 6.339 1.00 0.00 N ATOM 287 CA VAL A 24 1.506 1.553 5.267 1.00 0.00 C ATOM 288 C VAL A 24 0.567 0.461 5.768 1.00 0.00 C ATOM 289 O VAL A 24 0.968 -0.692 5.928 1.00 0.00 O ATOM 290 CB VAL A 24 2.332 1.004 4.088 1.00 0.00 C ATOM 291 CG1 VAL A 24 1.416 0.460 3.002 1.00 0.00 C ATOM 292 CG2 VAL A 24 3.249 2.083 3.533 1.00 0.00 C ATOM 0 H VAL A 24 3.350 1.785 6.237 1.00 0.00 H new ATOM 0 HA VAL A 24 0.918 2.404 4.923 1.00 0.00 H new ATOM 0 HB VAL A 24 2.952 0.184 4.451 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.017 0.077 2.177 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.805 -0.345 3.411 1.00 0.00 H new ATOM 0 HG13 VAL A 24 0.769 1.258 2.639 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.825 1.678 2.701 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.651 2.925 3.185 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.929 2.420 4.315 1.00 0.00 H new ATOM 302 N VAL A 25 -0.686 0.831 6.012 1.00 0.00 N ATOM 303 CA VAL A 25 -1.683 -0.117 6.493 1.00 0.00 C ATOM 304 C VAL A 25 -3.038 0.133 5.841 1.00 0.00 C ATOM 305 O VAL A 25 -3.216 1.106 5.109 1.00 0.00 O ATOM 306 CB VAL A 25 -1.840 -0.038 8.024 1.00 0.00 C ATOM 307 CG1 VAL A 25 -0.486 -0.155 8.706 1.00 0.00 C ATOM 308 CG2 VAL A 25 -2.538 1.254 8.422 1.00 0.00 C ATOM 0 H VAL A 25 -1.035 1.781 5.884 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.330 -1.112 6.222 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.458 -0.873 8.352 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.617 -0.097 9.787 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -0.029 -1.110 8.446 1.00 0.00 H new ATOM 0 HG13 VAL A 25 0.160 0.658 8.375 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -2.640 1.293 9.506 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -1.948 2.106 8.082 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.526 1.290 7.963 1.00 0.00 H new ATOM 318 N ALA A 26 -3.992 -0.752 6.113 1.00 0.00 N ATOM 319 CA ALA A 26 -5.332 -0.627 5.554 1.00 0.00 C ATOM 320 C ALA A 26 -6.332 -0.189 6.619 1.00 0.00 C ATOM 321 O ALA A 26 -6.751 -0.988 7.456 1.00 0.00 O ATOM 322 CB ALA A 26 -5.768 -1.943 4.927 1.00 0.00 C ATOM 0 H ALA A 26 -3.861 -1.563 6.717 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.306 0.140 4.780 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.771 -1.835 4.514 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.075 -2.214 4.131 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.771 -2.725 5.687 1.00 0.00 H new ATOM 328 N SER A 27 -6.709 1.085 6.583 1.00 0.00 N ATOM 329 CA SER A 27 -7.657 1.630 7.548 1.00 0.00 C ATOM 330 C SER A 27 -8.940 0.805 7.575 1.00 0.00 C ATOM 331 O SER A 27 -9.583 0.669 8.617 1.00 0.00 O ATOM 332 CB SER A 27 -7.981 3.086 7.210 1.00 0.00 C ATOM 333 OG SER A 27 -9.153 3.516 7.879 1.00 0.00 O ATOM 0 H SER A 27 -6.372 1.759 5.896 1.00 0.00 H new ATOM 0 HA SER A 27 -7.197 1.587 8.535 1.00 0.00 H new ATOM 0 HB2 SER A 27 -7.143 3.723 7.492 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.114 3.192 6.133 1.00 0.00 H new ATOM 0 HG SER A 27 -9.338 4.450 7.648 1.00 0.00 H new ATOM 339 N LEU A 28 -9.306 0.255 6.423 1.00 0.00 N ATOM 340 CA LEU A 28 -10.513 -0.558 6.313 1.00 0.00 C ATOM 341 C LEU A 28 -10.395 -1.555 5.165 1.00 0.00 C ATOM 342 O LEU A 28 -9.684 -1.313 4.189 1.00 0.00 O ATOM 343 CB LEU A 28 -11.736 0.336 6.103 1.00 0.00 C ATOM 344 CG LEU A 28 -12.978 -0.349 5.531 1.00 0.00 C ATOM 345 CD1 LEU A 28 -14.242 0.328 6.039 1.00 0.00 C ATOM 346 CD2 LEU A 28 -12.940 -0.340 4.010 1.00 0.00 C ATOM 0 H LEU A 28 -8.785 0.357 5.552 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.633 -1.115 7.243 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -12.002 0.785 7.060 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -11.455 1.151 5.436 1.00 0.00 H new ATOM 0 HG LEU A 28 -12.985 -1.386 5.867 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -15.116 -0.173 5.622 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -14.275 0.268 7.127 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -14.243 1.374 5.733 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -13.832 -0.832 3.621 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -12.908 0.689 3.653 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -12.053 -0.871 3.665 1.00 0.00 H new ATOM 358 N VAL A 29 -11.098 -2.677 5.287 1.00 0.00 N ATOM 359 CA VAL A 29 -11.074 -3.710 4.258 1.00 0.00 C ATOM 360 C VAL A 29 -12.485 -4.053 3.792 1.00 0.00 C ATOM 361 O VAL A 29 -13.195 -4.819 4.443 1.00 0.00 O ATOM 362 CB VAL A 29 -10.387 -4.991 4.765 1.00 0.00 C ATOM 363 CG1 VAL A 29 -10.571 -6.126 3.770 1.00 0.00 C ATOM 364 CG2 VAL A 29 -8.910 -4.735 5.027 1.00 0.00 C ATOM 0 H VAL A 29 -11.691 -2.894 6.088 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.504 -3.309 3.419 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.854 -5.285 5.705 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -10.079 -7.023 4.146 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.634 -6.325 3.637 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.132 -5.845 2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.440 -5.651 5.385 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -8.427 -4.416 4.104 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -8.804 -3.955 5.781 1.00 0.00 H new ATOM 374 N SER A 30 -12.884 -3.481 2.661 1.00 0.00 N ATOM 375 CA SER A 30 -14.211 -3.724 2.108 1.00 0.00 C ATOM 376 C SER A 30 -14.216 -4.977 1.238 1.00 0.00 C ATOM 377 O SER A 30 -13.168 -5.435 0.781 1.00 0.00 O ATOM 378 CB SER A 30 -14.674 -2.518 1.289 1.00 0.00 C ATOM 379 OG SER A 30 -15.546 -2.915 0.245 1.00 0.00 O ATOM 0 H SER A 30 -12.307 -2.846 2.109 1.00 0.00 H new ATOM 0 HA SER A 30 -14.901 -3.877 2.938 1.00 0.00 H new ATOM 0 HB2 SER A 30 -15.181 -1.806 1.940 1.00 0.00 H new ATOM 0 HB3 SER A 30 -13.808 -2.006 0.869 1.00 0.00 H new ATOM 0 HG SER A 30 -15.978 -2.124 -0.139 1.00 0.00 H new ATOM 385 N THR A 31 -15.405 -5.527 1.011 1.00 0.00 N ATOM 386 CA THR A 31 -15.549 -6.727 0.197 1.00 0.00 C ATOM 387 C THR A 31 -15.331 -6.419 -1.280 1.00 0.00 C ATOM 388 O THR A 31 -15.002 -7.306 -2.068 1.00 0.00 O ATOM 389 CB THR A 31 -16.939 -7.366 0.377 1.00 0.00 C ATOM 390 OG1 THR A 31 -17.960 -6.392 0.135 1.00 0.00 O ATOM 391 CG2 THR A 31 -17.096 -7.934 1.779 1.00 0.00 C ATOM 0 H THR A 31 -16.282 -5.160 1.380 1.00 0.00 H new ATOM 0 HA THR A 31 -14.788 -7.431 0.535 1.00 0.00 H new ATOM 0 HB THR A 31 -17.036 -8.181 -0.341 1.00 0.00 H new ATOM 0 HG1 THR A 31 -18.841 -6.806 0.250 1.00 0.00 H new ATOM 0 HG21 THR A 31 -18.085 -8.380 1.882 1.00 0.00 H new ATOM 0 HG22 THR A 31 -16.335 -8.695 1.950 1.00 0.00 H new ATOM 0 HG23 THR A 31 -16.980 -7.134 2.511 1.00 0.00 H new ATOM 399 N ARG A 32 -15.517 -5.156 -1.650 1.00 0.00 N ATOM 400 CA ARG A 32 -15.342 -4.731 -3.033 1.00 0.00 C ATOM 401 C ARG A 32 -14.214 -3.709 -3.149 1.00 0.00 C ATOM 402 O ARG A 32 -13.877 -3.263 -4.246 1.00 0.00 O ATOM 403 CB ARG A 32 -16.642 -4.135 -3.575 1.00 0.00 C ATOM 404 CG ARG A 32 -17.757 -5.154 -3.741 1.00 0.00 C ATOM 405 CD ARG A 32 -18.863 -4.629 -4.642 1.00 0.00 C ATOM 406 NE ARG A 32 -18.523 -4.752 -6.056 1.00 0.00 N ATOM 407 CZ ARG A 32 -19.398 -4.580 -7.041 1.00 0.00 C ATOM 408 NH1 ARG A 32 -20.659 -4.277 -6.766 1.00 0.00 N ATOM 409 NH2 ARG A 32 -19.011 -4.709 -8.304 1.00 0.00 N ATOM 0 H ARG A 32 -15.789 -4.409 -1.011 1.00 0.00 H new ATOM 0 HA ARG A 32 -15.078 -5.607 -3.625 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -16.979 -3.347 -2.901 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -16.443 -3.667 -4.539 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -17.351 -6.074 -4.161 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -18.170 -5.405 -2.764 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -19.784 -5.177 -4.442 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -19.057 -3.583 -4.406 1.00 0.00 H new ATOM 0 HE ARG A 32 -17.560 -4.983 -6.302 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -20.959 -4.175 -5.797 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -21.329 -4.145 -7.524 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -18.041 -4.940 -8.519 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -19.683 -4.577 -9.059 1.00 0.00 H new ATOM 423 N PHE A 33 -13.635 -3.342 -2.011 1.00 0.00 N ATOM 424 CA PHE A 33 -12.547 -2.372 -1.984 1.00 0.00 C ATOM 425 C PHE A 33 -11.770 -2.462 -0.674 1.00 0.00 C ATOM 426 O PHE A 33 -12.108 -3.254 0.207 1.00 0.00 O ATOM 427 CB PHE A 33 -13.094 -0.955 -2.170 1.00 0.00 C ATOM 428 CG PHE A 33 -13.516 -0.302 -0.885 1.00 0.00 C ATOM 429 CD1 PHE A 33 -12.597 0.379 -0.104 1.00 0.00 C ATOM 430 CD2 PHE A 33 -14.833 -0.370 -0.458 1.00 0.00 C ATOM 431 CE1 PHE A 33 -12.982 0.982 1.079 1.00 0.00 C ATOM 432 CE2 PHE A 33 -15.224 0.231 0.723 1.00 0.00 C ATOM 433 CZ PHE A 33 -14.298 0.906 1.493 1.00 0.00 C ATOM 0 H PHE A 33 -13.901 -3.702 -1.095 1.00 0.00 H new ATOM 0 HA PHE A 33 -11.868 -2.602 -2.805 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.332 -0.340 -2.648 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -13.947 -0.989 -2.848 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -11.567 0.440 -0.423 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -15.561 -0.899 -1.055 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -12.256 1.511 1.678 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -16.254 0.173 1.044 1.00 0.00 H new ATOM 0 HZ PHE A 33 -14.602 1.374 2.418 1.00 0.00 H new ATOM 443 N ILE A 34 -10.730 -1.645 -0.553 1.00 0.00 N ATOM 444 CA ILE A 34 -9.906 -1.631 0.650 1.00 0.00 C ATOM 445 C ILE A 34 -9.340 -0.240 0.912 1.00 0.00 C ATOM 446 O ILE A 34 -8.720 0.366 0.038 1.00 0.00 O ATOM 447 CB ILE A 34 -8.742 -2.635 0.546 1.00 0.00 C ATOM 448 CG1 ILE A 34 -9.278 -4.045 0.287 1.00 0.00 C ATOM 449 CG2 ILE A 34 -7.904 -2.606 1.815 1.00 0.00 C ATOM 450 CD1 ILE A 34 -8.209 -5.030 -0.129 1.00 0.00 C ATOM 0 H ILE A 34 -10.437 -0.984 -1.273 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.552 -1.920 1.479 1.00 0.00 H new ATOM 0 HB ILE A 34 -8.107 -2.348 -0.292 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.766 -4.411 1.190 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -10.040 -3.998 -0.491 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.085 -3.320 1.727 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.498 -1.605 1.960 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.527 -2.872 2.669 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.660 -6.008 -0.296 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.736 -4.687 -1.049 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.458 -5.106 0.658 1.00 0.00 H new ATOM 462 N LYS A 35 -9.556 0.262 2.124 1.00 0.00 N ATOM 463 CA LYS A 35 -9.065 1.581 2.505 1.00 0.00 C ATOM 464 C LYS A 35 -7.612 1.510 2.963 1.00 0.00 C ATOM 465 O LYS A 35 -7.265 0.713 3.837 1.00 0.00 O ATOM 466 CB LYS A 35 -9.934 2.169 3.619 1.00 0.00 C ATOM 467 CG LYS A 35 -9.681 3.645 3.873 1.00 0.00 C ATOM 468 CD LYS A 35 -10.330 4.513 2.808 1.00 0.00 C ATOM 469 CE LYS A 35 -9.624 5.854 2.676 1.00 0.00 C ATOM 470 NZ LYS A 35 -10.555 6.931 2.240 1.00 0.00 N ATOM 0 H LYS A 35 -10.068 -0.225 2.859 1.00 0.00 H new ATOM 0 HA LYS A 35 -9.120 2.228 1.630 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -10.984 2.028 3.362 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -9.754 1.614 4.540 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -10.070 3.918 4.854 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.608 3.833 3.893 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -10.308 3.993 1.850 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -11.378 4.676 3.059 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -9.178 6.125 3.633 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -8.809 5.766 1.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -10.029 7.821 2.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -10.988 6.669 1.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -11.300 7.056 2.955 1.00 0.00 H new ATOM 484 N LEU A 36 -6.768 2.347 2.371 1.00 0.00 N ATOM 485 CA LEU A 36 -5.352 2.379 2.720 1.00 0.00 C ATOM 486 C LEU A 36 -5.003 3.668 3.458 1.00 0.00 C ATOM 487 O LEU A 36 -5.635 4.705 3.254 1.00 0.00 O ATOM 488 CB LEU A 36 -4.493 2.250 1.461 1.00 0.00 C ATOM 489 CG LEU A 36 -4.121 0.827 1.045 1.00 0.00 C ATOM 490 CD1 LEU A 36 -3.390 0.115 2.173 1.00 0.00 C ATOM 491 CD2 LEU A 36 -5.363 0.048 0.638 1.00 0.00 C ATOM 0 H LEU A 36 -7.039 3.013 1.647 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.146 1.536 3.380 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -5.023 2.722 0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.573 2.815 1.614 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.454 0.884 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.133 -0.897 1.859 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.479 0.661 2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.033 0.070 3.052 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.079 -0.963 0.345 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.055 0.001 1.479 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.846 0.547 -0.202 1.00 0.00 H new ATOM 503 N THR A 37 -3.989 3.597 4.315 1.00 0.00 N ATOM 504 CA THR A 37 -3.555 4.757 5.083 1.00 0.00 C ATOM 505 C THR A 37 -2.085 4.641 5.470 1.00 0.00 C ATOM 506 O THR A 37 -1.655 3.624 6.015 1.00 0.00 O ATOM 507 CB THR A 37 -4.398 4.934 6.360 1.00 0.00 C ATOM 508 OG1 THR A 37 -4.242 3.794 7.211 1.00 0.00 O ATOM 509 CG2 THR A 37 -5.868 5.120 6.016 1.00 0.00 C ATOM 0 H THR A 37 -3.453 2.748 4.494 1.00 0.00 H new ATOM 0 HA THR A 37 -3.692 5.629 4.443 1.00 0.00 H new ATOM 0 HB THR A 37 -4.048 5.825 6.880 1.00 0.00 H new ATOM 0 HG1 THR A 37 -3.374 3.373 7.038 1.00 0.00 H new ATOM 0 HG21 THR A 37 -6.444 5.243 6.933 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.986 6.006 5.392 1.00 0.00 H new ATOM 0 HG23 THR A 37 -6.229 4.245 5.476 1.00 0.00 H new ATOM 517 N TRP A 38 -1.319 5.688 5.186 1.00 0.00 N ATOM 518 CA TRP A 38 0.104 5.703 5.506 1.00 0.00 C ATOM 519 C TRP A 38 0.538 7.082 5.992 1.00 0.00 C ATOM 520 O TRP A 38 -0.206 8.055 5.871 1.00 0.00 O ATOM 521 CB TRP A 38 0.927 5.297 4.283 1.00 0.00 C ATOM 522 CG TRP A 38 0.670 6.156 3.082 1.00 0.00 C ATOM 523 CD1 TRP A 38 1.276 7.341 2.776 1.00 0.00 C ATOM 524 CD2 TRP A 38 -0.263 5.897 2.027 1.00 0.00 C ATOM 525 NE1 TRP A 38 0.776 7.834 1.596 1.00 0.00 N ATOM 526 CE2 TRP A 38 -0.169 6.966 1.116 1.00 0.00 C ATOM 527 CE3 TRP A 38 -1.168 4.865 1.763 1.00 0.00 C ATOM 528 CZ2 TRP A 38 -0.946 7.032 -0.038 1.00 0.00 C ATOM 529 CZ3 TRP A 38 -1.939 4.931 0.618 1.00 0.00 C ATOM 530 CH2 TRP A 38 -1.823 6.008 -0.271 1.00 0.00 C ATOM 0 H TRP A 38 -1.659 6.537 4.735 1.00 0.00 H new ATOM 0 HA TRP A 38 0.279 4.985 6.307 1.00 0.00 H new ATOM 0 HB2 TRP A 38 1.986 5.345 4.535 1.00 0.00 H new ATOM 0 HB3 TRP A 38 0.705 4.260 4.033 1.00 0.00 H new ATOM 0 HD1 TRP A 38 2.037 7.820 3.374 1.00 0.00 H new ATOM 0 HE1 TRP A 38 1.062 8.705 1.149 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -1.263 4.031 2.442 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.859 7.862 -0.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -2.642 4.140 0.405 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -2.438 6.030 -1.158 1.00 0.00 H new ATOM 541 N ARG A 39 1.746 7.158 6.541 1.00 0.00 N ATOM 542 CA ARG A 39 2.278 8.418 7.045 1.00 0.00 C ATOM 543 C ARG A 39 3.215 9.059 6.026 1.00 0.00 C ATOM 544 O ARG A 39 3.464 8.501 4.957 1.00 0.00 O ATOM 545 CB ARG A 39 3.020 8.192 8.364 1.00 0.00 C ATOM 546 CG ARG A 39 2.148 7.603 9.460 1.00 0.00 C ATOM 547 CD ARG A 39 1.446 8.690 10.258 1.00 0.00 C ATOM 548 NE ARG A 39 0.162 9.060 9.668 1.00 0.00 N ATOM 549 CZ ARG A 39 -0.789 9.712 10.326 1.00 0.00 C ATOM 550 NH1 ARG A 39 -0.602 10.065 11.590 1.00 0.00 N ATOM 551 NH2 ARG A 39 -1.931 10.013 9.721 1.00 0.00 N ATOM 0 H ARG A 39 2.375 6.362 6.648 1.00 0.00 H new ATOM 0 HA ARG A 39 1.440 9.093 7.218 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.865 7.526 8.186 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.429 9.142 8.708 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.406 6.938 9.018 1.00 0.00 H new ATOM 0 HG3 ARG A 39 2.761 6.998 10.128 1.00 0.00 H new ATOM 0 HD2 ARG A 39 1.289 8.345 11.280 1.00 0.00 H new ATOM 0 HD3 ARG A 39 2.087 9.570 10.313 1.00 0.00 H new ATOM 0 HE ARG A 39 -0.014 8.803 8.697 1.00 0.00 H new ATOM 0 HH11 ARG A 39 0.274 9.836 12.059 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -1.334 10.566 12.093 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -2.079 9.743 8.749 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -2.660 10.514 10.228 1.00 0.00 H new ATOM 565 N THR A 40 3.732 10.237 6.363 1.00 0.00 N ATOM 566 CA THR A 40 4.640 10.955 5.477 1.00 0.00 C ATOM 567 C THR A 40 6.014 10.296 5.446 1.00 0.00 C ATOM 568 O THR A 40 6.507 9.784 6.451 1.00 0.00 O ATOM 569 CB THR A 40 4.798 12.426 5.908 1.00 0.00 C ATOM 570 OG1 THR A 40 4.642 12.540 7.327 1.00 0.00 O ATOM 571 CG2 THR A 40 3.776 13.308 5.208 1.00 0.00 C ATOM 0 H THR A 40 3.537 10.714 7.243 1.00 0.00 H new ATOM 0 HA THR A 40 4.202 10.921 4.480 1.00 0.00 H new ATOM 0 HB THR A 40 5.796 12.759 5.625 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.792 13.469 7.599 1.00 0.00 H new ATOM 0 HG21 THR A 40 3.907 14.342 5.528 1.00 0.00 H new ATOM 0 HG22 THR A 40 3.916 13.242 4.129 1.00 0.00 H new ATOM 0 HG23 THR A 40 2.771 12.974 5.464 1.00 0.00 H new ATOM 579 N PRO A 41 6.649 10.307 4.264 1.00 0.00 N ATOM 580 CA PRO A 41 7.977 9.715 4.074 1.00 0.00 C ATOM 581 C PRO A 41 9.071 10.506 4.782 1.00 0.00 C ATOM 582 O PRO A 41 8.995 11.730 4.889 1.00 0.00 O ATOM 583 CB PRO A 41 8.174 9.767 2.557 1.00 0.00 C ATOM 584 CG PRO A 41 7.308 10.890 2.101 1.00 0.00 C ATOM 585 CD PRO A 41 6.121 10.899 3.024 1.00 0.00 C ATOM 0 HA PRO A 41 8.039 8.710 4.491 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.218 9.943 2.299 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.883 8.827 2.088 1.00 0.00 H new ATOM 0 HG2 PRO A 41 7.844 11.838 2.145 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.997 10.747 1.066 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.748 11.910 3.189 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.294 10.315 2.620 1.00 0.00 H new ATOM 593 N ALA A 42 10.089 9.799 5.263 1.00 0.00 N ATOM 594 CA ALA A 42 11.201 10.437 5.958 1.00 0.00 C ATOM 595 C ALA A 42 11.760 11.601 5.147 1.00 0.00 C ATOM 596 O ALA A 42 12.130 12.635 5.702 1.00 0.00 O ATOM 597 CB ALA A 42 12.294 9.419 6.248 1.00 0.00 C ATOM 0 H ALA A 42 10.167 8.785 5.184 1.00 0.00 H new ATOM 0 HA ALA A 42 10.829 10.833 6.903 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.118 9.908 6.767 1.00 0.00 H new ATOM 0 HB2 ALA A 42 11.892 8.622 6.874 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.655 8.996 5.311 1.00 0.00 H new ATOM 603 N SER A 43 11.820 11.424 3.831 1.00 0.00 N ATOM 604 CA SER A 43 12.339 12.459 2.944 1.00 0.00 C ATOM 605 C SER A 43 11.428 13.683 2.945 1.00 0.00 C ATOM 606 O SER A 43 11.897 14.819 3.022 1.00 0.00 O ATOM 607 CB SER A 43 12.480 11.916 1.520 1.00 0.00 C ATOM 608 OG SER A 43 11.211 11.685 0.934 1.00 0.00 O ATOM 0 H SER A 43 11.516 10.574 3.356 1.00 0.00 H new ATOM 0 HA SER A 43 13.321 12.758 3.311 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.041 12.625 0.911 1.00 0.00 H new ATOM 0 HB3 SER A 43 13.051 10.988 1.536 1.00 0.00 H new ATOM 0 HG SER A 43 10.856 12.527 0.579 1.00 0.00 H new ATOM 614 N ASP A 44 10.125 13.442 2.860 1.00 0.00 N ATOM 615 CA ASP A 44 9.147 14.524 2.853 1.00 0.00 C ATOM 616 C ASP A 44 8.151 14.364 3.997 1.00 0.00 C ATOM 617 O ASP A 44 7.151 13.654 3.888 1.00 0.00 O ATOM 618 CB ASP A 44 8.404 14.560 1.516 1.00 0.00 C ATOM 619 CG ASP A 44 9.231 15.189 0.412 1.00 0.00 C ATOM 620 OD1 ASP A 44 10.088 14.485 -0.163 1.00 0.00 O ATOM 621 OD2 ASP A 44 9.020 16.385 0.121 1.00 0.00 O ATOM 0 H ASP A 44 9.721 12.508 2.795 1.00 0.00 H new ATOM 0 HA ASP A 44 9.682 15.464 2.989 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.131 13.545 1.228 1.00 0.00 H new ATOM 0 HB3 ASP A 44 7.476 15.119 1.634 1.00 0.00 H new ATOM 626 N PRO A 45 8.429 15.039 5.123 1.00 0.00 N ATOM 627 CA PRO A 45 7.571 14.987 6.310 1.00 0.00 C ATOM 628 C PRO A 45 6.241 15.701 6.095 1.00 0.00 C ATOM 629 O PRO A 45 5.360 15.667 6.955 1.00 0.00 O ATOM 630 CB PRO A 45 8.398 15.707 7.378 1.00 0.00 C ATOM 631 CG PRO A 45 9.297 16.615 6.612 1.00 0.00 C ATOM 632 CD PRO A 45 9.604 15.904 5.323 1.00 0.00 C ATOM 0 HA PRO A 45 7.305 13.964 6.576 1.00 0.00 H new ATOM 0 HB2 PRO A 45 7.760 16.266 8.062 1.00 0.00 H new ATOM 0 HB3 PRO A 45 8.969 15.000 7.980 1.00 0.00 H new ATOM 0 HG2 PRO A 45 8.814 17.574 6.423 1.00 0.00 H new ATOM 0 HG3 PRO A 45 10.210 16.822 7.170 1.00 0.00 H new ATOM 0 HD2 PRO A 45 9.732 16.605 4.498 1.00 0.00 H new ATOM 0 HD3 PRO A 45 10.524 15.323 5.394 1.00 0.00 H new ATOM 640 N HIS A 46 6.101 16.348 4.942 1.00 0.00 N ATOM 641 CA HIS A 46 4.877 17.070 4.613 1.00 0.00 C ATOM 642 C HIS A 46 4.218 16.483 3.368 1.00 0.00 C ATOM 643 O HIS A 46 3.005 16.586 3.189 1.00 0.00 O ATOM 644 CB HIS A 46 5.178 18.553 4.395 1.00 0.00 C ATOM 645 CG HIS A 46 5.738 19.235 5.605 1.00 0.00 C ATOM 646 ND1 HIS A 46 4.959 19.643 6.667 1.00 0.00 N ATOM 647 CD2 HIS A 46 7.009 19.578 5.918 1.00 0.00 C ATOM 648 CE1 HIS A 46 5.727 20.210 7.580 1.00 0.00 C ATOM 649 NE2 HIS A 46 6.976 20.183 7.151 1.00 0.00 N ATOM 0 H HIS A 46 6.820 16.387 4.220 1.00 0.00 H new ATOM 0 HA HIS A 46 4.187 16.967 5.450 1.00 0.00 H new ATOM 0 HB2 HIS A 46 5.885 18.655 3.571 1.00 0.00 H new ATOM 0 HB3 HIS A 46 4.262 19.061 4.093 1.00 0.00 H new ATOM 0 HD2 HIS A 46 7.886 19.408 5.311 1.00 0.00 H new ATOM 0 HE1 HIS A 46 5.391 20.625 8.518 1.00 0.00 H new ATOM 0 HE2 HIS A 46 7.784 20.551 7.653 1.00 0.00 H new ATOM 658 N GLY A 47 5.026 15.869 2.510 1.00 0.00 N ATOM 659 CA GLY A 47 4.504 15.277 1.293 1.00 0.00 C ATOM 660 C GLY A 47 3.312 16.036 0.743 1.00 0.00 C ATOM 661 O GLY A 47 2.332 15.434 0.306 1.00 0.00 O ATOM 0 H GLY A 47 6.033 15.771 2.636 1.00 0.00 H new ATOM 0 HA2 GLY A 47 5.291 15.249 0.540 1.00 0.00 H new ATOM 0 HA3 GLY A 47 4.214 14.245 1.490 1.00 0.00 H new ATOM 665 N ASP A 48 3.396 17.362 0.767 1.00 0.00 N ATOM 666 CA ASP A 48 2.316 18.205 0.268 1.00 0.00 C ATOM 667 C ASP A 48 2.553 18.586 -1.190 1.00 0.00 C ATOM 668 O ASP A 48 1.645 19.054 -1.875 1.00 0.00 O ATOM 669 CB ASP A 48 2.188 19.466 1.123 1.00 0.00 C ATOM 670 CG ASP A 48 0.868 20.179 0.910 1.00 0.00 C ATOM 671 OD1 ASP A 48 -0.178 19.623 1.305 1.00 0.00 O ATOM 672 OD2 ASP A 48 0.880 21.295 0.348 1.00 0.00 O ATOM 0 H ASP A 48 4.200 17.876 1.127 1.00 0.00 H new ATOM 0 HA ASP A 48 1.387 17.638 0.330 1.00 0.00 H new ATOM 0 HB2 ASP A 48 2.288 19.200 2.175 1.00 0.00 H new ATOM 0 HB3 ASP A 48 3.007 20.146 0.887 1.00 0.00 H new ATOM 677 N ASN A 49 3.780 18.382 -1.658 1.00 0.00 N ATOM 678 CA ASN A 49 4.138 18.705 -3.034 1.00 0.00 C ATOM 679 C ASN A 49 4.475 17.442 -3.820 1.00 0.00 C ATOM 680 O ASN A 49 5.115 17.503 -4.871 1.00 0.00 O ATOM 681 CB ASN A 49 5.326 19.669 -3.062 1.00 0.00 C ATOM 682 CG ASN A 49 6.601 19.029 -2.548 1.00 0.00 C ATOM 683 OD1 ASN A 49 7.307 18.345 -3.289 1.00 0.00 O ATOM 684 ND2 ASN A 49 6.902 19.250 -1.274 1.00 0.00 N ATOM 0 H ASN A 49 4.544 17.994 -1.104 1.00 0.00 H new ATOM 0 HA ASN A 49 3.279 19.185 -3.503 1.00 0.00 H new ATOM 0 HB2 ASN A 49 5.484 20.018 -4.083 1.00 0.00 H new ATOM 0 HB3 ASN A 49 5.093 20.546 -2.458 1.00 0.00 H new ATOM 0 HD21 ASN A 49 7.748 18.846 -0.872 1.00 0.00 H new ATOM 0 HD22 ASN A 49 6.287 19.824 -0.697 1.00 0.00 H new ATOM 691 N LEU A 50 4.041 16.297 -3.304 1.00 0.00 N ATOM 692 CA LEU A 50 4.296 15.018 -3.957 1.00 0.00 C ATOM 693 C LEU A 50 3.085 14.098 -3.844 1.00 0.00 C ATOM 694 O LEU A 50 2.525 13.920 -2.762 1.00 0.00 O ATOM 695 CB LEU A 50 5.522 14.344 -3.340 1.00 0.00 C ATOM 696 CG LEU A 50 5.695 14.516 -1.830 1.00 0.00 C ATOM 697 CD1 LEU A 50 4.906 13.457 -1.078 1.00 0.00 C ATOM 698 CD2 LEU A 50 7.168 14.457 -1.452 1.00 0.00 C ATOM 0 H LEU A 50 3.511 16.228 -2.435 1.00 0.00 H new ATOM 0 HA LEU A 50 4.487 15.209 -5.013 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.475 13.278 -3.561 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.412 14.733 -3.834 1.00 0.00 H new ATOM 0 HG LEU A 50 5.308 15.495 -1.548 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.041 13.596 -0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.848 13.548 -1.325 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.262 12.467 -1.364 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.272 14.581 -0.374 1.00 0.00 H new ATOM 0 HD22 LEU A 50 7.581 13.493 -1.748 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.707 15.255 -1.963 1.00 0.00 H new ATOM 710 N THR A 51 2.685 13.513 -4.970 1.00 0.00 N ATOM 711 CA THR A 51 1.541 12.611 -4.998 1.00 0.00 C ATOM 712 C THR A 51 1.922 11.225 -4.489 1.00 0.00 C ATOM 713 O THR A 51 3.084 10.965 -4.177 1.00 0.00 O ATOM 714 CB THR A 51 0.962 12.482 -6.419 1.00 0.00 C ATOM 715 OG1 THR A 51 1.169 13.699 -7.144 1.00 0.00 O ATOM 716 CG2 THR A 51 -0.525 12.163 -6.370 1.00 0.00 C ATOM 0 H THR A 51 3.137 13.649 -5.874 1.00 0.00 H new ATOM 0 HA THR A 51 0.783 13.041 -4.343 1.00 0.00 H new ATOM 0 HB THR A 51 1.477 11.665 -6.925 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.800 13.609 -8.047 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.912 12.077 -7.385 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.678 11.222 -5.842 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.051 12.962 -5.848 1.00 0.00 H new ATOM 724 N TYR A 52 0.936 10.338 -4.409 1.00 0.00 N ATOM 725 CA TYR A 52 1.168 8.978 -3.937 1.00 0.00 C ATOM 726 C TYR A 52 0.484 7.962 -4.845 1.00 0.00 C ATOM 727 O TYR A 52 -0.715 8.056 -5.108 1.00 0.00 O ATOM 728 CB TYR A 52 0.660 8.821 -2.503 1.00 0.00 C ATOM 729 CG TYR A 52 1.485 9.572 -1.482 1.00 0.00 C ATOM 730 CD1 TYR A 52 2.834 9.287 -1.305 1.00 0.00 C ATOM 731 CD2 TYR A 52 0.916 10.566 -0.695 1.00 0.00 C ATOM 732 CE1 TYR A 52 3.591 9.971 -0.373 1.00 0.00 C ATOM 733 CE2 TYR A 52 1.666 11.255 0.238 1.00 0.00 C ATOM 734 CZ TYR A 52 3.003 10.954 0.395 1.00 0.00 C ATOM 735 OH TYR A 52 3.753 11.637 1.325 1.00 0.00 O ATOM 0 H TYR A 52 -0.031 10.536 -4.665 1.00 0.00 H new ATOM 0 HA TYR A 52 2.242 8.791 -3.958 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -0.371 9.170 -2.452 1.00 0.00 H new ATOM 0 HB3 TYR A 52 0.652 7.762 -2.243 1.00 0.00 H new ATOM 0 HD1 TYR A 52 3.298 8.519 -1.906 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -0.131 10.804 -0.815 1.00 0.00 H new ATOM 0 HE1 TYR A 52 4.638 9.737 -0.247 1.00 0.00 H new ATOM 0 HE2 TYR A 52 1.208 12.025 0.841 1.00 0.00 H new ATOM 0 HH TYR A 52 3.188 12.296 1.780 1.00 0.00 H new ATOM 745 N SER A 53 1.255 6.990 -5.322 1.00 0.00 N ATOM 746 CA SER A 53 0.725 5.956 -6.204 1.00 0.00 C ATOM 747 C SER A 53 0.549 4.640 -5.453 1.00 0.00 C ATOM 748 O SER A 53 1.403 4.246 -4.659 1.00 0.00 O ATOM 749 CB SER A 53 1.654 5.753 -7.402 1.00 0.00 C ATOM 750 OG SER A 53 1.527 6.815 -8.332 1.00 0.00 O ATOM 0 H SER A 53 2.249 6.897 -5.113 1.00 0.00 H new ATOM 0 HA SER A 53 -0.251 6.283 -6.562 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.686 5.688 -7.059 1.00 0.00 H new ATOM 0 HB3 SER A 53 1.420 4.807 -7.891 1.00 0.00 H new ATOM 0 HG SER A 53 0.583 7.063 -8.419 1.00 0.00 H new ATOM 756 N VAL A 54 -0.565 3.963 -5.712 1.00 0.00 N ATOM 757 CA VAL A 54 -0.854 2.689 -5.063 1.00 0.00 C ATOM 758 C VAL A 54 -1.027 1.576 -6.089 1.00 0.00 C ATOM 759 O VAL A 54 -1.970 1.587 -6.881 1.00 0.00 O ATOM 760 CB VAL A 54 -2.126 2.776 -4.198 1.00 0.00 C ATOM 761 CG1 VAL A 54 -2.464 1.416 -3.607 1.00 0.00 C ATOM 762 CG2 VAL A 54 -1.953 3.816 -3.100 1.00 0.00 C ATOM 0 H VAL A 54 -1.282 4.275 -6.367 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.002 2.460 -4.423 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.956 3.086 -4.833 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.365 1.497 -2.999 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.633 0.701 -4.412 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.637 1.074 -2.985 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.861 3.864 -2.498 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.111 3.538 -2.465 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.763 4.791 -3.549 1.00 0.00 H new ATOM 772 N PHE A 55 -0.110 0.614 -6.071 1.00 0.00 N ATOM 773 CA PHE A 55 -0.159 -0.508 -7.001 1.00 0.00 C ATOM 774 C PHE A 55 -0.723 -1.752 -6.322 1.00 0.00 C ATOM 775 O PHE A 55 -0.139 -2.272 -5.370 1.00 0.00 O ATOM 776 CB PHE A 55 1.237 -0.802 -7.553 1.00 0.00 C ATOM 777 CG PHE A 55 1.928 0.408 -8.112 1.00 0.00 C ATOM 778 CD1 PHE A 55 2.605 1.283 -7.278 1.00 0.00 C ATOM 779 CD2 PHE A 55 1.900 0.671 -9.472 1.00 0.00 C ATOM 780 CE1 PHE A 55 3.242 2.398 -7.790 1.00 0.00 C ATOM 781 CE2 PHE A 55 2.536 1.784 -9.990 1.00 0.00 C ATOM 782 CZ PHE A 55 3.207 2.649 -9.148 1.00 0.00 C ATOM 0 H PHE A 55 0.676 0.589 -5.422 1.00 0.00 H new ATOM 0 HA PHE A 55 -0.817 -0.236 -7.826 1.00 0.00 H new ATOM 0 HB2 PHE A 55 1.851 -1.226 -6.759 1.00 0.00 H new ATOM 0 HB3 PHE A 55 1.158 -1.559 -8.334 1.00 0.00 H new ATOM 0 HD1 PHE A 55 2.635 1.092 -6.215 1.00 0.00 H new ATOM 0 HD2 PHE A 55 1.375 -0.001 -10.135 1.00 0.00 H new ATOM 0 HE1 PHE A 55 3.766 3.072 -7.129 1.00 0.00 H new ATOM 0 HE2 PHE A 55 2.508 1.977 -11.052 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.703 3.520 -9.550 1.00 0.00 H new ATOM 792 N TYR A 56 -1.862 -2.225 -6.817 1.00 0.00 N ATOM 793 CA TYR A 56 -2.507 -3.406 -6.257 1.00 0.00 C ATOM 794 C TYR A 56 -2.489 -4.561 -7.254 1.00 0.00 C ATOM 795 O TYR A 56 -2.520 -4.351 -8.467 1.00 0.00 O ATOM 796 CB TYR A 56 -3.948 -3.085 -5.858 1.00 0.00 C ATOM 797 CG TYR A 56 -4.733 -2.379 -6.940 1.00 0.00 C ATOM 798 CD1 TYR A 56 -4.654 -1.001 -7.096 1.00 0.00 C ATOM 799 CD2 TYR A 56 -5.555 -3.090 -7.806 1.00 0.00 C ATOM 800 CE1 TYR A 56 -5.370 -0.351 -8.082 1.00 0.00 C ATOM 801 CE2 TYR A 56 -6.273 -2.449 -8.796 1.00 0.00 C ATOM 802 CZ TYR A 56 -6.178 -1.079 -8.931 1.00 0.00 C ATOM 803 OH TYR A 56 -6.893 -0.437 -9.915 1.00 0.00 O ATOM 0 H TYR A 56 -2.357 -1.808 -7.605 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.950 -3.707 -5.370 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -4.459 -4.012 -5.596 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -3.938 -2.463 -4.963 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -4.021 -0.428 -6.434 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -5.634 -4.162 -7.703 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -5.298 0.721 -8.188 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -6.906 -3.017 -9.462 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.410 -1.095 -10.425 1.00 0.00 H new ATOM 813 N THR A 57 -2.438 -5.783 -6.733 1.00 0.00 N ATOM 814 CA THR A 57 -2.415 -6.972 -7.575 1.00 0.00 C ATOM 815 C THR A 57 -2.622 -8.236 -6.748 1.00 0.00 C ATOM 816 O THR A 57 -2.161 -8.328 -5.610 1.00 0.00 O ATOM 817 CB THR A 57 -1.086 -7.089 -8.346 1.00 0.00 C ATOM 818 OG1 THR A 57 -0.829 -8.459 -8.674 1.00 0.00 O ATOM 819 CG2 THR A 57 0.067 -6.534 -7.524 1.00 0.00 C ATOM 0 H THR A 57 -2.412 -5.975 -5.732 1.00 0.00 H new ATOM 0 HA THR A 57 -3.233 -6.870 -8.288 1.00 0.00 H new ATOM 0 HB THR A 57 -1.171 -6.506 -9.263 1.00 0.00 H new ATOM 0 HG1 THR A 57 -0.111 -8.507 -9.339 1.00 0.00 H new ATOM 0 HG21 THR A 57 0.995 -6.627 -8.089 1.00 0.00 H new ATOM 0 HG22 THR A 57 -0.118 -5.483 -7.301 1.00 0.00 H new ATOM 0 HG23 THR A 57 0.152 -7.093 -6.592 1.00 0.00 H new ATOM 827 N LYS A 58 -3.317 -9.209 -7.327 1.00 0.00 N ATOM 828 CA LYS A 58 -3.584 -10.470 -6.644 1.00 0.00 C ATOM 829 C LYS A 58 -2.329 -11.334 -6.587 1.00 0.00 C ATOM 830 O LYS A 58 -1.519 -11.329 -7.514 1.00 0.00 O ATOM 831 CB LYS A 58 -4.708 -11.229 -7.353 1.00 0.00 C ATOM 832 CG LYS A 58 -5.122 -12.506 -6.642 1.00 0.00 C ATOM 833 CD LYS A 58 -6.445 -13.034 -7.170 1.00 0.00 C ATOM 834 CE LYS A 58 -6.299 -13.600 -8.574 1.00 0.00 C ATOM 835 NZ LYS A 58 -7.577 -13.531 -9.335 1.00 0.00 N ATOM 0 H LYS A 58 -3.706 -9.149 -8.268 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.894 -10.244 -5.624 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.576 -10.576 -7.443 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.387 -11.474 -8.365 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.349 -13.263 -6.772 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.206 -12.317 -5.572 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.822 -13.808 -6.502 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.182 -12.231 -7.175 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.527 -13.048 -9.110 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.967 -14.636 -8.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.436 -13.926 -10.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.307 -14.079 -8.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.881 -12.540 -9.413 1.00 0.00 H new ATOM 849 N GLU A 59 -2.175 -12.076 -5.495 1.00 0.00 N ATOM 850 CA GLU A 59 -1.019 -12.947 -5.320 1.00 0.00 C ATOM 851 C GLU A 59 -0.643 -13.624 -6.634 1.00 0.00 C ATOM 852 O GLU A 59 -1.498 -14.169 -7.331 1.00 0.00 O ATOM 853 CB GLU A 59 -1.305 -14.004 -4.252 1.00 0.00 C ATOM 854 CG GLU A 59 -0.059 -14.503 -3.540 1.00 0.00 C ATOM 855 CD GLU A 59 0.578 -15.688 -4.240 1.00 0.00 C ATOM 856 OE1 GLU A 59 -0.169 -16.539 -4.765 1.00 0.00 O ATOM 857 OE2 GLU A 59 1.825 -15.763 -4.262 1.00 0.00 O ATOM 0 H GLU A 59 -2.836 -12.091 -4.718 1.00 0.00 H new ATOM 0 HA GLU A 59 -0.180 -12.332 -4.996 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.992 -13.587 -3.515 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -1.811 -14.850 -4.717 1.00 0.00 H new ATOM 0 HG2 GLU A 59 0.666 -13.692 -3.474 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.317 -14.784 -2.519 1.00 0.00 H new ATOM 864 N GLY A 60 0.644 -13.585 -6.968 1.00 0.00 N ATOM 865 CA GLY A 60 1.110 -14.198 -8.198 1.00 0.00 C ATOM 866 C GLY A 60 0.990 -13.269 -9.390 1.00 0.00 C ATOM 867 O GLY A 60 1.938 -13.110 -10.159 1.00 0.00 O ATOM 0 H GLY A 60 1.372 -13.140 -6.409 1.00 0.00 H new ATOM 0 HA2 GLY A 60 2.151 -14.499 -8.079 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.536 -15.105 -8.389 1.00 0.00 H new ATOM 871 N ILE A 61 -0.179 -12.657 -9.545 1.00 0.00 N ATOM 872 CA ILE A 61 -0.420 -11.741 -10.653 1.00 0.00 C ATOM 873 C ILE A 61 0.703 -10.715 -10.772 1.00 0.00 C ATOM 874 O ILE A 61 0.733 -9.725 -10.041 1.00 0.00 O ATOM 875 CB ILE A 61 -1.761 -11.001 -10.490 1.00 0.00 C ATOM 876 CG1 ILE A 61 -2.923 -11.996 -10.506 1.00 0.00 C ATOM 877 CG2 ILE A 61 -1.930 -9.963 -11.590 1.00 0.00 C ATOM 878 CD1 ILE A 61 -3.014 -12.798 -11.785 1.00 0.00 C ATOM 0 H ILE A 61 -0.974 -12.779 -8.918 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.455 -12.345 -11.560 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.761 -10.487 -9.529 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -2.816 -12.680 -9.664 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.857 -11.454 -10.359 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.882 -9.448 -11.461 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.116 -9.240 -11.536 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.913 -10.456 -12.562 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -3.860 -13.482 -11.726 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.152 -12.122 -12.629 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.095 -13.368 -11.923 1.00 0.00 H new ATOM 890 N ALA A 62 1.623 -10.959 -11.699 1.00 0.00 N ATOM 891 CA ALA A 62 2.746 -10.055 -11.916 1.00 0.00 C ATOM 892 C ALA A 62 2.263 -8.675 -12.352 1.00 0.00 C ATOM 893 O ALA A 62 2.969 -7.680 -12.188 1.00 0.00 O ATOM 894 CB ALA A 62 3.697 -10.635 -12.953 1.00 0.00 C ATOM 0 H ALA A 62 1.613 -11.775 -12.312 1.00 0.00 H new ATOM 0 HA ALA A 62 3.279 -9.943 -10.972 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.531 -9.950 -13.105 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.076 -11.595 -12.603 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.166 -10.776 -13.895 1.00 0.00 H new ATOM 900 N ARG A 63 1.057 -8.624 -12.908 1.00 0.00 N ATOM 901 CA ARG A 63 0.482 -7.366 -13.369 1.00 0.00 C ATOM 902 C ARG A 63 -0.271 -6.667 -12.241 1.00 0.00 C ATOM 903 O ARG A 63 -1.084 -7.282 -11.552 1.00 0.00 O ATOM 904 CB ARG A 63 -0.460 -7.614 -14.549 1.00 0.00 C ATOM 905 CG ARG A 63 -1.735 -8.348 -14.167 1.00 0.00 C ATOM 906 CD ARG A 63 -2.705 -8.426 -15.336 1.00 0.00 C ATOM 907 NE ARG A 63 -3.106 -7.102 -15.803 1.00 0.00 N ATOM 908 CZ ARG A 63 -4.136 -6.890 -16.615 1.00 0.00 C ATOM 909 NH1 ARG A 63 -4.865 -7.910 -17.046 1.00 0.00 N ATOM 910 NH2 ARG A 63 -4.438 -5.656 -16.997 1.00 0.00 N ATOM 0 H ARG A 63 0.460 -9.438 -13.050 1.00 0.00 H new ATOM 0 HA ARG A 63 1.297 -6.719 -13.693 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.723 -6.657 -15.000 1.00 0.00 H new ATOM 0 HB3 ARG A 63 0.067 -8.191 -15.309 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -1.489 -9.355 -13.829 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.213 -7.839 -13.330 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -2.241 -8.975 -16.156 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -3.590 -8.988 -15.036 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.566 -6.296 -15.489 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.636 -8.860 -16.754 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.655 -7.745 -17.669 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.879 -4.869 -16.667 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.229 -5.494 -17.620 1.00 0.00 H new ATOM 924 N GLU A 64 0.006 -5.380 -12.060 1.00 0.00 N ATOM 925 CA GLU A 64 -0.645 -4.599 -11.015 1.00 0.00 C ATOM 926 C GLU A 64 -1.108 -3.248 -11.554 1.00 0.00 C ATOM 927 O GLU A 64 -0.490 -2.683 -12.456 1.00 0.00 O ATOM 928 CB GLU A 64 0.308 -4.390 -9.836 1.00 0.00 C ATOM 929 CG GLU A 64 1.422 -3.397 -10.122 1.00 0.00 C ATOM 930 CD GLU A 64 2.283 -3.810 -11.300 1.00 0.00 C ATOM 931 OE1 GLU A 64 2.897 -4.895 -11.236 1.00 0.00 O ATOM 932 OE2 GLU A 64 2.341 -3.047 -12.287 1.00 0.00 O ATOM 0 H GLU A 64 0.676 -4.856 -12.623 1.00 0.00 H new ATOM 0 HA GLU A 64 -1.519 -5.154 -10.673 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.264 -4.044 -8.975 1.00 0.00 H new ATOM 0 HB3 GLU A 64 0.749 -5.348 -9.562 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.988 -2.417 -10.320 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.049 -3.295 -9.236 1.00 0.00 H new ATOM 939 N ARG A 65 -2.200 -2.738 -10.994 1.00 0.00 N ATOM 940 CA ARG A 65 -2.748 -1.455 -11.419 1.00 0.00 C ATOM 941 C ARG A 65 -2.441 -0.367 -10.395 1.00 0.00 C ATOM 942 O ARG A 65 -2.556 -0.584 -9.189 1.00 0.00 O ATOM 943 CB ARG A 65 -4.260 -1.565 -11.624 1.00 0.00 C ATOM 944 CG ARG A 65 -4.655 -2.499 -12.756 1.00 0.00 C ATOM 945 CD ARG A 65 -4.763 -1.756 -14.079 1.00 0.00 C ATOM 946 NE ARG A 65 -5.240 -2.621 -15.155 1.00 0.00 N ATOM 947 CZ ARG A 65 -5.737 -2.165 -16.299 1.00 0.00 C ATOM 948 NH1 ARG A 65 -5.823 -0.859 -16.514 1.00 0.00 N ATOM 949 NH2 ARG A 65 -6.150 -3.015 -17.230 1.00 0.00 N ATOM 0 H ARG A 65 -2.723 -3.193 -10.245 1.00 0.00 H new ATOM 0 HA ARG A 65 -2.279 -1.183 -12.364 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.719 -1.914 -10.699 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -4.664 -0.573 -11.825 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -3.918 -3.297 -12.845 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -5.610 -2.971 -12.523 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -5.442 -0.911 -13.966 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -3.788 -1.349 -14.347 1.00 0.00 H new ATOM 0 HE ARG A 65 -5.189 -3.631 -15.020 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -5.507 -0.203 -15.800 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -6.205 -0.511 -17.393 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -6.086 -4.020 -17.068 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -6.532 -2.664 -18.108 1.00 0.00 H new ATOM 963 N VAL A 66 -2.048 0.805 -10.884 1.00 0.00 N ATOM 964 CA VAL A 66 -1.724 1.928 -10.013 1.00 0.00 C ATOM 965 C VAL A 66 -2.925 2.851 -9.836 1.00 0.00 C ATOM 966 O VAL A 66 -3.736 3.011 -10.747 1.00 0.00 O ATOM 967 CB VAL A 66 -0.540 2.744 -10.565 1.00 0.00 C ATOM 968 CG1 VAL A 66 -0.952 3.500 -11.819 1.00 0.00 C ATOM 969 CG2 VAL A 66 -0.012 3.699 -9.505 1.00 0.00 C ATOM 0 H VAL A 66 -1.946 1.001 -11.880 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.446 1.508 -9.046 1.00 0.00 H new ATOM 0 HB VAL A 66 0.262 2.055 -10.832 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.103 4.071 -12.195 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.279 2.791 -12.580 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.770 4.180 -11.582 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.824 4.268 -9.912 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.805 4.384 -9.205 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.324 3.130 -8.638 1.00 0.00 H new ATOM 979 N GLU A 67 -3.031 3.455 -8.657 1.00 0.00 N ATOM 980 CA GLU A 67 -4.134 4.362 -8.361 1.00 0.00 C ATOM 981 C GLU A 67 -3.621 5.657 -7.737 1.00 0.00 C ATOM 982 O GLU A 67 -3.216 5.681 -6.576 1.00 0.00 O ATOM 983 CB GLU A 67 -5.137 3.692 -7.419 1.00 0.00 C ATOM 984 CG GLU A 67 -6.557 4.208 -7.576 1.00 0.00 C ATOM 985 CD GLU A 67 -6.753 5.577 -6.954 1.00 0.00 C ATOM 986 OE1 GLU A 67 -6.699 5.676 -5.710 1.00 0.00 O ATOM 987 OE2 GLU A 67 -6.960 6.548 -7.710 1.00 0.00 O ATOM 0 H GLU A 67 -2.368 3.333 -7.892 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.633 4.603 -9.299 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.128 2.617 -7.598 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.815 3.847 -6.389 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.807 4.256 -8.636 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -7.249 3.502 -7.117 1.00 0.00 H new ATOM 994 N ASN A 68 -3.642 6.732 -8.519 1.00 0.00 N ATOM 995 CA ASN A 68 -3.178 8.031 -8.044 1.00 0.00 C ATOM 996 C ASN A 68 -4.196 8.660 -7.098 1.00 0.00 C ATOM 997 O ASN A 68 -5.369 8.813 -7.441 1.00 0.00 O ATOM 998 CB ASN A 68 -2.919 8.966 -9.227 1.00 0.00 C ATOM 999 CG ASN A 68 -1.760 8.502 -10.088 1.00 0.00 C ATOM 1000 OD1 ASN A 68 -0.603 8.819 -9.814 1.00 0.00 O ATOM 1001 ND2 ASN A 68 -2.068 7.747 -11.137 1.00 0.00 N ATOM 0 H ASN A 68 -3.975 6.729 -9.483 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.247 7.879 -7.498 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.819 9.031 -9.839 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -2.713 9.970 -8.855 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -1.331 7.405 -11.754 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.042 7.509 -11.326 1.00 0.00 H new ATOM 1008 N THR A 69 -3.740 9.023 -5.903 1.00 0.00 N ATOM 1009 CA THR A 69 -4.610 9.635 -4.907 1.00 0.00 C ATOM 1010 C THR A 69 -5.318 10.860 -5.472 1.00 0.00 C ATOM 1011 O THR A 69 -4.676 11.789 -5.963 1.00 0.00 O ATOM 1012 CB THR A 69 -3.821 10.047 -3.649 1.00 0.00 C ATOM 1013 OG1 THR A 69 -2.807 10.997 -3.997 1.00 0.00 O ATOM 1014 CG2 THR A 69 -3.182 8.834 -2.990 1.00 0.00 C ATOM 0 H THR A 69 -2.773 8.904 -5.602 1.00 0.00 H new ATOM 0 HA THR A 69 -5.352 8.885 -4.633 1.00 0.00 H new ATOM 0 HB THR A 69 -4.516 10.500 -2.942 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.919 11.807 -3.457 1.00 0.00 H new ATOM 0 HG21 THR A 69 -2.630 9.149 -2.104 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.958 8.126 -2.701 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.498 8.356 -3.692 1.00 0.00 H new ATOM 1022 N SER A 70 -6.645 10.857 -5.401 1.00 0.00 N ATOM 1023 CA SER A 70 -7.441 11.968 -5.909 1.00 0.00 C ATOM 1024 C SER A 70 -6.716 13.295 -5.702 1.00 0.00 C ATOM 1025 O SER A 70 -6.773 14.185 -6.551 1.00 0.00 O ATOM 1026 CB SER A 70 -8.804 12.005 -5.217 1.00 0.00 C ATOM 1027 OG SER A 70 -8.660 12.053 -3.808 1.00 0.00 O ATOM 0 H SER A 70 -7.192 10.097 -4.996 1.00 0.00 H new ATOM 0 HA SER A 70 -7.589 11.818 -6.978 1.00 0.00 H new ATOM 0 HB2 SER A 70 -9.365 12.875 -5.558 1.00 0.00 H new ATOM 0 HB3 SER A 70 -9.381 11.124 -5.497 1.00 0.00 H new ATOM 0 HG SER A 70 -8.606 12.987 -3.516 1.00 0.00 H new ATOM 1033 N HIS A 71 -6.036 13.419 -4.567 1.00 0.00 N ATOM 1034 CA HIS A 71 -5.299 14.637 -4.248 1.00 0.00 C ATOM 1035 C HIS A 71 -3.875 14.310 -3.808 1.00 0.00 C ATOM 1036 O HIS A 71 -3.612 13.282 -3.183 1.00 0.00 O ATOM 1037 CB HIS A 71 -6.017 15.419 -3.148 1.00 0.00 C ATOM 1038 CG HIS A 71 -7.477 15.623 -3.415 1.00 0.00 C ATOM 1039 ND1 HIS A 71 -8.559 14.921 -3.003 1.00 0.00 N flip ATOM 1040 CD2 HIS A 71 -7.963 16.652 -4.193 1.00 0.00 C flip ATOM 1041 CE1 HIS A 71 -9.668 15.534 -3.533 1.00 0.00 C flip ATOM 1042 NE2 HIS A 71 -9.281 16.576 -4.247 1.00 0.00 N flip ATOM 0 H HIS A 71 -5.980 12.692 -3.853 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.252 15.250 -5.148 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.899 14.891 -2.202 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.538 16.391 -3.032 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -7.360 17.403 -4.682 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.690 15.216 -3.389 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -9.895 17.213 -4.754 1.00 0.00 H new ATOM 1051 N PRO A 72 -2.932 15.204 -4.142 1.00 0.00 N ATOM 1052 CA PRO A 72 -1.519 15.032 -3.792 1.00 0.00 C ATOM 1053 C PRO A 72 -1.270 15.183 -2.295 1.00 0.00 C ATOM 1054 O PRO A 72 -1.732 16.138 -1.672 1.00 0.00 O ATOM 1055 CB PRO A 72 -0.823 16.155 -4.565 1.00 0.00 C ATOM 1056 CG PRO A 72 -1.873 17.195 -4.750 1.00 0.00 C ATOM 1057 CD PRO A 72 -3.173 16.451 -4.886 1.00 0.00 C ATOM 0 HA PRO A 72 -1.156 14.035 -4.042 1.00 0.00 H new ATOM 0 HB2 PRO A 72 0.030 16.548 -4.011 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -0.444 15.800 -5.523 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.901 17.877 -3.900 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.674 17.798 -5.636 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.005 17.016 -4.465 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -3.417 16.255 -5.930 1.00 0.00 H new ATOM 1065 N GLY A 73 -0.536 14.233 -1.723 1.00 0.00 N ATOM 1066 CA GLY A 73 -0.239 14.279 -0.303 1.00 0.00 C ATOM 1067 C GLY A 73 -1.163 13.395 0.512 1.00 0.00 C ATOM 1068 O GLY A 73 -0.770 12.872 1.554 1.00 0.00 O ATOM 0 H GLY A 73 -0.142 13.433 -2.218 1.00 0.00 H new ATOM 0 HA2 GLY A 73 0.793 13.968 -0.141 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -0.321 15.307 0.049 1.00 0.00 H new ATOM 1072 N GLU A 74 -2.393 13.231 0.037 1.00 0.00 N ATOM 1073 CA GLU A 74 -3.375 12.407 0.731 1.00 0.00 C ATOM 1074 C GLU A 74 -2.704 11.216 1.411 1.00 0.00 C ATOM 1075 O GLU A 74 -1.999 10.439 0.769 1.00 0.00 O ATOM 1076 CB GLU A 74 -4.443 11.913 -0.248 1.00 0.00 C ATOM 1077 CG GLU A 74 -5.799 11.681 0.397 1.00 0.00 C ATOM 1078 CD GLU A 74 -6.256 12.858 1.237 1.00 0.00 C ATOM 1079 OE1 GLU A 74 -6.210 13.999 0.731 1.00 0.00 O ATOM 1080 OE2 GLU A 74 -6.658 12.639 2.398 1.00 0.00 O ATOM 0 H GLU A 74 -2.733 13.657 -0.825 1.00 0.00 H new ATOM 0 HA GLU A 74 -3.849 13.021 1.497 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -4.552 12.641 -1.052 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -4.103 10.983 -0.704 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -6.538 11.486 -0.380 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -5.752 10.790 1.023 1.00 0.00 H new ATOM 1087 N MET A 75 -2.929 11.082 2.713 1.00 0.00 N ATOM 1088 CA MET A 75 -2.346 9.987 3.480 1.00 0.00 C ATOM 1089 C MET A 75 -3.274 8.776 3.489 1.00 0.00 C ATOM 1090 O MET A 75 -3.012 7.788 4.175 1.00 0.00 O ATOM 1091 CB MET A 75 -2.061 10.436 4.915 1.00 0.00 C ATOM 1092 CG MET A 75 -0.939 11.455 5.021 1.00 0.00 C ATOM 1093 SD MET A 75 0.679 10.688 5.227 1.00 0.00 S ATOM 1094 CE MET A 75 1.263 10.669 3.534 1.00 0.00 C ATOM 0 H MET A 75 -3.510 11.717 3.259 1.00 0.00 H new ATOM 0 HA MET A 75 -1.408 9.701 3.003 1.00 0.00 H new ATOM 0 HB2 MET A 75 -2.969 10.862 5.341 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.806 9.563 5.516 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.931 12.075 4.125 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.133 12.117 5.865 1.00 0.00 H new ATOM 0 HE1 MET A 75 2.233 10.174 3.489 1.00 0.00 H new ATOM 0 HE2 MET A 75 0.551 10.129 2.910 1.00 0.00 H new ATOM 0 HE3 MET A 75 1.361 11.692 3.171 1.00 0.00 H new ATOM 1104 N GLN A 76 -4.357 8.860 2.723 1.00 0.00 N ATOM 1105 CA GLN A 76 -5.322 7.771 2.644 1.00 0.00 C ATOM 1106 C GLN A 76 -5.902 7.658 1.238 1.00 0.00 C ATOM 1107 O GLN A 76 -6.162 8.665 0.579 1.00 0.00 O ATOM 1108 CB GLN A 76 -6.448 7.984 3.657 1.00 0.00 C ATOM 1109 CG GLN A 76 -5.975 8.569 4.978 1.00 0.00 C ATOM 1110 CD GLN A 76 -7.077 9.297 5.722 1.00 0.00 C ATOM 1111 OE1 GLN A 76 -7.995 8.676 6.259 1.00 0.00 O ATOM 1112 NE2 GLN A 76 -6.991 10.622 5.758 1.00 0.00 N ATOM 0 H GLN A 76 -4.588 9.671 2.149 1.00 0.00 H new ATOM 0 HA GLN A 76 -4.803 6.842 2.879 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.196 8.647 3.222 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -6.940 7.030 3.847 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.585 7.768 5.607 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -5.151 9.258 4.792 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -6.213 11.095 5.299 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -7.703 11.166 6.245 1.00 0.00 H new ATOM 1121 N VAL A 77 -6.103 6.425 0.782 1.00 0.00 N ATOM 1122 CA VAL A 77 -6.653 6.180 -0.546 1.00 0.00 C ATOM 1123 C VAL A 77 -7.508 4.918 -0.562 1.00 0.00 C ATOM 1124 O VAL A 77 -7.296 4.000 0.231 1.00 0.00 O ATOM 1125 CB VAL A 77 -5.537 6.045 -1.599 1.00 0.00 C ATOM 1126 CG1 VAL A 77 -4.873 4.680 -1.502 1.00 0.00 C ATOM 1127 CG2 VAL A 77 -6.092 6.279 -2.996 1.00 0.00 C ATOM 0 H VAL A 77 -5.893 5.580 1.313 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.275 7.040 -0.795 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.781 6.805 -1.401 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.087 4.603 -2.254 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.439 4.556 -0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.616 3.901 -1.673 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.290 6.180 -3.727 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.868 5.544 -3.207 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.516 7.281 -3.056 1.00 0.00 H new ATOM 1137 N THR A 78 -8.476 4.878 -1.472 1.00 0.00 N ATOM 1138 CA THR A 78 -9.364 3.729 -1.593 1.00 0.00 C ATOM 1139 C THR A 78 -9.162 3.014 -2.924 1.00 0.00 C ATOM 1140 O THR A 78 -9.021 3.654 -3.967 1.00 0.00 O ATOM 1141 CB THR A 78 -10.842 4.145 -1.466 1.00 0.00 C ATOM 1142 OG1 THR A 78 -11.021 4.971 -0.310 1.00 0.00 O ATOM 1143 CG2 THR A 78 -11.742 2.923 -1.368 1.00 0.00 C ATOM 0 H THR A 78 -8.665 5.629 -2.136 1.00 0.00 H new ATOM 0 HA THR A 78 -9.114 3.050 -0.778 1.00 0.00 H new ATOM 0 HB THR A 78 -11.116 4.707 -2.359 1.00 0.00 H new ATOM 0 HG1 THR A 78 -11.963 5.233 -0.237 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.780 3.242 -1.279 1.00 0.00 H new ATOM 0 HG22 THR A 78 -11.625 2.312 -2.263 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.466 2.337 -0.491 1.00 0.00 H new ATOM 1151 N ILE A 79 -9.148 1.686 -2.881 1.00 0.00 N ATOM 1152 CA ILE A 79 -8.964 0.886 -4.086 1.00 0.00 C ATOM 1153 C ILE A 79 -10.214 0.072 -4.400 1.00 0.00 C ATOM 1154 O ILE A 79 -10.392 -1.033 -3.889 1.00 0.00 O ATOM 1155 CB ILE A 79 -7.764 -0.070 -3.949 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -6.563 0.667 -3.351 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -7.406 -0.667 -5.301 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -6.011 1.751 -4.250 1.00 0.00 C ATOM 0 H ILE A 79 -9.262 1.142 -2.026 1.00 0.00 H new ATOM 0 HA ILE A 79 -8.772 1.583 -4.902 1.00 0.00 H new ATOM 0 HB ILE A 79 -8.040 -0.882 -3.277 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.856 1.110 -2.399 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -5.774 -0.054 -3.138 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.556 -1.340 -5.188 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -8.259 -1.222 -5.691 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.145 0.133 -5.994 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.162 2.231 -3.763 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.687 1.311 -5.193 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -6.786 2.493 -4.443 1.00 0.00 H new ATOM 1170 N GLN A 80 -11.077 0.625 -5.247 1.00 0.00 N ATOM 1171 CA GLN A 80 -12.310 -0.051 -5.631 1.00 0.00 C ATOM 1172 C GLN A 80 -12.047 -1.088 -6.718 1.00 0.00 C ATOM 1173 O GLN A 80 -10.898 -1.360 -7.064 1.00 0.00 O ATOM 1174 CB GLN A 80 -13.343 0.966 -6.120 1.00 0.00 C ATOM 1175 CG GLN A 80 -13.464 2.189 -5.224 1.00 0.00 C ATOM 1176 CD GLN A 80 -12.577 3.333 -5.675 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -12.036 3.315 -6.781 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -12.424 4.336 -4.819 1.00 0.00 N ATOM 0 H GLN A 80 -10.945 1.539 -5.680 1.00 0.00 H new ATOM 0 HA GLN A 80 -12.702 -0.564 -4.753 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.075 1.288 -7.126 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -14.316 0.479 -6.189 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -14.502 2.523 -5.209 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -13.203 1.913 -4.202 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -12.891 4.309 -3.913 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -11.839 5.134 -5.067 1.00 0.00 H new ATOM 1187 N ASN A 81 -13.119 -1.664 -7.251 1.00 0.00 N ATOM 1188 CA ASN A 81 -13.004 -2.673 -8.298 1.00 0.00 C ATOM 1189 C ASN A 81 -12.138 -3.841 -7.835 1.00 0.00 C ATOM 1190 O ASN A 81 -11.230 -4.275 -8.545 1.00 0.00 O ATOM 1191 CB ASN A 81 -12.411 -2.056 -9.566 1.00 0.00 C ATOM 1192 CG ASN A 81 -13.127 -0.785 -9.980 1.00 0.00 C ATOM 1193 OD1 ASN A 81 -14.311 -0.808 -10.318 1.00 0.00 O ATOM 1194 ND2 ASN A 81 -12.411 0.333 -9.956 1.00 0.00 N ATOM 0 H ASN A 81 -14.077 -1.450 -6.975 1.00 0.00 H new ATOM 0 HA ASN A 81 -14.003 -3.049 -8.517 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.356 -1.838 -9.401 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -12.464 -2.781 -10.378 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -12.839 1.219 -10.224 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -11.433 0.306 -9.669 1.00 0.00 H new ATOM 1201 N LEU A 82 -12.426 -4.346 -6.641 1.00 0.00 N ATOM 1202 CA LEU A 82 -11.675 -5.465 -6.082 1.00 0.00 C ATOM 1203 C LEU A 82 -12.587 -6.663 -5.834 1.00 0.00 C ATOM 1204 O LEU A 82 -13.810 -6.530 -5.811 1.00 0.00 O ATOM 1205 CB LEU A 82 -10.997 -5.048 -4.776 1.00 0.00 C ATOM 1206 CG LEU A 82 -9.942 -3.946 -4.890 1.00 0.00 C ATOM 1207 CD1 LEU A 82 -9.279 -3.701 -3.543 1.00 0.00 C ATOM 1208 CD2 LEU A 82 -8.903 -4.309 -5.940 1.00 0.00 C ATOM 0 H LEU A 82 -13.174 -3.999 -6.041 1.00 0.00 H new ATOM 0 HA LEU A 82 -10.912 -5.755 -6.804 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.767 -4.716 -4.080 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.528 -5.928 -4.336 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.437 -3.026 -5.201 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.531 -2.914 -3.643 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -10.032 -3.396 -2.817 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -8.797 -4.618 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.161 -3.514 -6.007 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.412 -5.241 -5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.391 -4.433 -6.907 1.00 0.00 H new ATOM 1220 N MET A 83 -11.982 -7.832 -5.649 1.00 0.00 N ATOM 1221 CA MET A 83 -12.739 -9.053 -5.399 1.00 0.00 C ATOM 1222 C MET A 83 -12.673 -9.442 -3.926 1.00 0.00 C ATOM 1223 O MET A 83 -11.618 -9.395 -3.293 1.00 0.00 O ATOM 1224 CB MET A 83 -12.204 -10.196 -6.265 1.00 0.00 C ATOM 1225 CG MET A 83 -13.000 -11.484 -6.129 1.00 0.00 C ATOM 1226 SD MET A 83 -14.403 -11.557 -7.259 1.00 0.00 S ATOM 1227 CE MET A 83 -13.587 -12.027 -8.782 1.00 0.00 C ATOM 0 H MET A 83 -10.970 -7.959 -5.668 1.00 0.00 H new ATOM 0 HA MET A 83 -13.780 -8.865 -5.660 1.00 0.00 H new ATOM 0 HB2 MET A 83 -12.210 -9.883 -7.309 1.00 0.00 H new ATOM 0 HB3 MET A 83 -11.166 -10.390 -5.996 1.00 0.00 H new ATOM 0 HG2 MET A 83 -12.343 -12.334 -6.316 1.00 0.00 H new ATOM 0 HG3 MET A 83 -13.359 -11.578 -5.104 1.00 0.00 H new ATOM 0 HE1 MET A 83 -14.106 -11.574 -9.627 1.00 0.00 H new ATOM 0 HE2 MET A 83 -12.554 -11.681 -8.763 1.00 0.00 H new ATOM 0 HE3 MET A 83 -13.605 -13.112 -8.884 1.00 0.00 H new ATOM 1237 N PRO A 84 -13.827 -9.835 -3.365 1.00 0.00 N ATOM 1238 CA PRO A 84 -13.926 -10.239 -1.959 1.00 0.00 C ATOM 1239 C PRO A 84 -13.228 -11.568 -1.688 1.00 0.00 C ATOM 1240 O PRO A 84 -13.022 -12.369 -2.599 1.00 0.00 O ATOM 1241 CB PRO A 84 -15.434 -10.372 -1.734 1.00 0.00 C ATOM 1242 CG PRO A 84 -15.996 -10.655 -3.084 1.00 0.00 C ATOM 1243 CD PRO A 84 -15.123 -9.914 -4.059 1.00 0.00 C ATOM 0 HA PRO A 84 -13.443 -9.523 -1.294 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -15.660 -11.177 -1.035 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -15.854 -9.458 -1.314 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -15.992 -11.725 -3.292 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -17.031 -10.320 -3.154 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -15.039 -10.445 -5.007 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -15.520 -8.924 -4.282 1.00 0.00 H new ATOM 1251 N ALA A 85 -12.866 -11.795 -0.430 1.00 0.00 N ATOM 1252 CA ALA A 85 -12.194 -13.028 -0.039 1.00 0.00 C ATOM 1253 C ALA A 85 -11.018 -13.329 -0.962 1.00 0.00 C ATOM 1254 O ALA A 85 -10.784 -14.480 -1.332 1.00 0.00 O ATOM 1255 CB ALA A 85 -13.178 -14.188 -0.039 1.00 0.00 C ATOM 0 H ALA A 85 -13.027 -11.141 0.336 1.00 0.00 H new ATOM 0 HA ALA A 85 -11.805 -12.896 0.971 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -12.663 -15.102 0.255 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -13.983 -13.982 0.667 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -13.595 -14.312 -1.039 1.00 0.00 H new ATOM 1261 N THR A 86 -10.280 -12.286 -1.332 1.00 0.00 N ATOM 1262 CA THR A 86 -9.130 -12.439 -2.214 1.00 0.00 C ATOM 1263 C THR A 86 -7.974 -11.550 -1.769 1.00 0.00 C ATOM 1264 O THR A 86 -8.121 -10.333 -1.657 1.00 0.00 O ATOM 1265 CB THR A 86 -9.491 -12.098 -3.673 1.00 0.00 C ATOM 1266 OG1 THR A 86 -10.505 -12.992 -4.147 1.00 0.00 O ATOM 1267 CG2 THR A 86 -8.266 -12.191 -4.569 1.00 0.00 C ATOM 0 H THR A 86 -10.459 -11.327 -1.034 1.00 0.00 H new ATOM 0 HA THR A 86 -8.825 -13.484 -2.157 1.00 0.00 H new ATOM 0 HB THR A 86 -9.866 -11.075 -3.703 1.00 0.00 H new ATOM 0 HG1 THR A 86 -11.342 -12.822 -3.666 1.00 0.00 H new ATOM 0 HG21 THR A 86 -8.545 -11.946 -5.594 1.00 0.00 H new ATOM 0 HG22 THR A 86 -7.507 -11.489 -4.222 1.00 0.00 H new ATOM 0 HG23 THR A 86 -7.866 -13.204 -4.534 1.00 0.00 H new ATOM 1275 N VAL A 87 -6.824 -12.167 -1.515 1.00 0.00 N ATOM 1276 CA VAL A 87 -5.642 -11.431 -1.084 1.00 0.00 C ATOM 1277 C VAL A 87 -5.151 -10.488 -2.177 1.00 0.00 C ATOM 1278 O VAL A 87 -5.266 -10.786 -3.366 1.00 0.00 O ATOM 1279 CB VAL A 87 -4.498 -12.386 -0.693 1.00 0.00 C ATOM 1280 CG1 VAL A 87 -3.255 -11.600 -0.303 1.00 0.00 C ATOM 1281 CG2 VAL A 87 -4.934 -13.305 0.437 1.00 0.00 C ATOM 0 H VAL A 87 -6.686 -13.174 -1.600 1.00 0.00 H new ATOM 0 HA VAL A 87 -5.934 -10.848 -0.210 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.252 -13.003 -1.557 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.458 -12.292 -0.030 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.932 -10.988 -1.145 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.483 -10.956 0.546 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -4.114 -13.973 0.700 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.209 -12.708 1.306 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -5.793 -13.895 0.116 1.00 0.00 H new ATOM 1291 N TYR A 88 -4.604 -9.350 -1.766 1.00 0.00 N ATOM 1292 CA TYR A 88 -4.097 -8.361 -2.711 1.00 0.00 C ATOM 1293 C TYR A 88 -2.855 -7.668 -2.160 1.00 0.00 C ATOM 1294 O TYR A 88 -2.847 -7.195 -1.023 1.00 0.00 O ATOM 1295 CB TYR A 88 -5.177 -7.324 -3.024 1.00 0.00 C ATOM 1296 CG TYR A 88 -6.230 -7.819 -3.989 1.00 0.00 C ATOM 1297 CD1 TYR A 88 -5.934 -8.015 -5.332 1.00 0.00 C ATOM 1298 CD2 TYR A 88 -7.522 -8.093 -3.557 1.00 0.00 C ATOM 1299 CE1 TYR A 88 -6.894 -8.467 -6.217 1.00 0.00 C ATOM 1300 CE2 TYR A 88 -8.488 -8.547 -4.434 1.00 0.00 C ATOM 1301 CZ TYR A 88 -8.169 -8.731 -5.763 1.00 0.00 C ATOM 1302 OH TYR A 88 -9.128 -9.183 -6.641 1.00 0.00 O ATOM 0 H TYR A 88 -4.500 -9.089 -0.785 1.00 0.00 H new ATOM 0 HA TYR A 88 -3.824 -8.880 -3.630 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -5.661 -7.023 -2.095 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -4.705 -6.434 -3.440 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -4.936 -7.811 -5.691 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -7.775 -7.948 -2.517 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -6.647 -8.613 -7.258 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -9.487 -8.757 -4.081 1.00 0.00 H new ATOM 0 HH TYR A 88 -8.700 -9.699 -7.355 1.00 0.00 H new ATOM 1312 N ILE A 89 -1.806 -7.612 -2.974 1.00 0.00 N ATOM 1313 CA ILE A 89 -0.559 -6.975 -2.570 1.00 0.00 C ATOM 1314 C ILE A 89 -0.533 -5.507 -2.980 1.00 0.00 C ATOM 1315 O ILE A 89 -0.314 -5.181 -4.147 1.00 0.00 O ATOM 1316 CB ILE A 89 0.661 -7.689 -3.181 1.00 0.00 C ATOM 1317 CG1 ILE A 89 0.420 -9.199 -3.240 1.00 0.00 C ATOM 1318 CG2 ILE A 89 1.914 -7.379 -2.376 1.00 0.00 C ATOM 1319 CD1 ILE A 89 0.281 -9.842 -1.878 1.00 0.00 C ATOM 0 H ILE A 89 -1.795 -8.000 -3.917 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.506 -7.047 -1.484 1.00 0.00 H new ATOM 0 HB ILE A 89 0.805 -7.323 -4.198 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -0.484 -9.392 -3.818 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.246 -9.670 -3.773 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.768 -7.891 -2.820 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.093 -6.304 -2.381 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.781 -7.720 -1.349 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.112 -10.912 -1.996 1.00 0.00 H new ATOM 0 HD12 ILE A 89 1.194 -9.680 -1.304 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.563 -9.398 -1.350 1.00 0.00 H new ATOM 1331 N PHE A 90 -0.756 -4.624 -2.013 1.00 0.00 N ATOM 1332 CA PHE A 90 -0.757 -3.189 -2.273 1.00 0.00 C ATOM 1333 C PHE A 90 0.618 -2.586 -2.003 1.00 0.00 C ATOM 1334 O PHE A 90 1.330 -3.019 -1.097 1.00 0.00 O ATOM 1335 CB PHE A 90 -1.811 -2.493 -1.408 1.00 0.00 C ATOM 1336 CG PHE A 90 -3.218 -2.911 -1.725 1.00 0.00 C ATOM 1337 CD1 PHE A 90 -3.773 -4.032 -1.128 1.00 0.00 C ATOM 1338 CD2 PHE A 90 -3.986 -2.184 -2.619 1.00 0.00 C ATOM 1339 CE1 PHE A 90 -5.067 -4.420 -1.417 1.00 0.00 C ATOM 1340 CE2 PHE A 90 -5.282 -2.566 -2.912 1.00 0.00 C ATOM 1341 CZ PHE A 90 -5.823 -3.686 -2.311 1.00 0.00 C ATOM 0 H PHE A 90 -0.938 -4.877 -1.042 1.00 0.00 H new ATOM 0 HA PHE A 90 -1.001 -3.036 -3.324 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -1.605 -2.704 -0.359 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.723 -1.415 -1.539 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -3.187 -4.609 -0.428 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.568 -1.308 -3.093 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.487 -5.296 -0.945 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -5.871 -1.989 -3.610 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.835 -3.987 -2.539 1.00 0.00 H new ATOM 1351 N ARG A 91 0.984 -1.584 -2.795 1.00 0.00 N ATOM 1352 CA ARG A 91 2.274 -0.922 -2.644 1.00 0.00 C ATOM 1353 C ARG A 91 2.133 0.589 -2.803 1.00 0.00 C ATOM 1354 O ARG A 91 1.653 1.073 -3.829 1.00 0.00 O ATOM 1355 CB ARG A 91 3.273 -1.463 -3.669 1.00 0.00 C ATOM 1356 CG ARG A 91 3.830 -2.831 -3.314 1.00 0.00 C ATOM 1357 CD ARG A 91 4.904 -3.268 -4.297 1.00 0.00 C ATOM 1358 NE ARG A 91 5.836 -4.222 -3.702 1.00 0.00 N ATOM 1359 CZ ARG A 91 6.675 -4.970 -4.410 1.00 0.00 C ATOM 1360 NH1 ARG A 91 6.699 -4.874 -5.732 1.00 0.00 N ATOM 1361 NH2 ARG A 91 7.493 -5.815 -3.796 1.00 0.00 N ATOM 0 H ARG A 91 0.405 -1.213 -3.548 1.00 0.00 H new ATOM 0 HA ARG A 91 2.645 -1.131 -1.641 1.00 0.00 H new ATOM 0 HB2 ARG A 91 2.786 -1.520 -4.643 1.00 0.00 H new ATOM 0 HB3 ARG A 91 4.099 -0.758 -3.766 1.00 0.00 H new ATOM 0 HG2 ARG A 91 4.246 -2.805 -2.307 1.00 0.00 H new ATOM 0 HG3 ARG A 91 3.022 -3.563 -3.307 1.00 0.00 H new ATOM 0 HD2 ARG A 91 4.434 -3.718 -5.171 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.454 -2.394 -4.646 1.00 0.00 H new ATOM 0 HE ARG A 91 5.843 -4.319 -2.687 1.00 0.00 H new ATOM 0 HH11 ARG A 91 6.072 -4.225 -6.208 1.00 0.00 H new ATOM 0 HH12 ARG A 91 7.344 -5.449 -6.273 1.00 0.00 H new ATOM 0 HH21 ARG A 91 7.478 -5.891 -2.779 1.00 0.00 H new ATOM 0 HH22 ARG A 91 8.137 -6.389 -4.341 1.00 0.00 H new ATOM 1375 N VAL A 92 2.553 1.329 -1.782 1.00 0.00 N ATOM 1376 CA VAL A 92 2.473 2.785 -1.809 1.00 0.00 C ATOM 1377 C VAL A 92 3.801 3.400 -2.238 1.00 0.00 C ATOM 1378 O VAL A 92 4.868 2.944 -1.830 1.00 0.00 O ATOM 1379 CB VAL A 92 2.079 3.351 -0.432 1.00 0.00 C ATOM 1380 CG1 VAL A 92 1.619 4.795 -0.560 1.00 0.00 C ATOM 1381 CG2 VAL A 92 0.997 2.493 0.206 1.00 0.00 C ATOM 0 H VAL A 92 2.952 0.944 -0.926 1.00 0.00 H new ATOM 0 HA VAL A 92 1.703 3.047 -2.535 1.00 0.00 H new ATOM 0 HB VAL A 92 2.956 3.330 0.215 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.345 5.178 0.423 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.427 5.399 -0.972 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.755 4.844 -1.223 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.730 2.907 1.178 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.117 2.480 -0.437 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.368 1.476 0.334 1.00 0.00 H new ATOM 1391 N MET A 93 3.726 4.438 -3.064 1.00 0.00 N ATOM 1392 CA MET A 93 4.923 5.117 -3.547 1.00 0.00 C ATOM 1393 C MET A 93 4.695 6.623 -3.634 1.00 0.00 C ATOM 1394 O MET A 93 3.596 7.077 -3.948 1.00 0.00 O ATOM 1395 CB MET A 93 5.326 4.571 -4.918 1.00 0.00 C ATOM 1396 CG MET A 93 6.729 4.975 -5.344 1.00 0.00 C ATOM 1397 SD MET A 93 7.480 3.789 -6.475 1.00 0.00 S ATOM 1398 CE MET A 93 6.179 3.613 -7.694 1.00 0.00 C ATOM 0 H MET A 93 2.850 4.827 -3.413 1.00 0.00 H new ATOM 0 HA MET A 93 5.729 4.929 -2.838 1.00 0.00 H new ATOM 0 HB2 MET A 93 5.259 3.483 -4.901 1.00 0.00 H new ATOM 0 HB3 MET A 93 4.613 4.922 -5.664 1.00 0.00 H new ATOM 0 HG2 MET A 93 6.692 5.954 -5.822 1.00 0.00 H new ATOM 0 HG3 MET A 93 7.358 5.076 -4.460 1.00 0.00 H new ATOM 0 HE1 MET A 93 5.721 2.628 -7.598 1.00 0.00 H new ATOM 0 HE2 MET A 93 5.423 4.382 -7.533 1.00 0.00 H new ATOM 0 HE3 MET A 93 6.600 3.722 -8.694 1.00 0.00 H new ATOM 1408 N ALA A 94 5.742 7.392 -3.352 1.00 0.00 N ATOM 1409 CA ALA A 94 5.656 8.847 -3.400 1.00 0.00 C ATOM 1410 C ALA A 94 6.161 9.382 -4.736 1.00 0.00 C ATOM 1411 O ALA A 94 6.999 8.761 -5.387 1.00 0.00 O ATOM 1412 CB ALA A 94 6.444 9.460 -2.252 1.00 0.00 C ATOM 0 H ALA A 94 6.659 7.032 -3.088 1.00 0.00 H new ATOM 0 HA ALA A 94 4.608 9.129 -3.298 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.371 10.547 -2.300 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.036 9.111 -1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.490 9.163 -2.329 1.00 0.00 H new ATOM 1418 N GLN A 95 5.643 10.539 -5.137 1.00 0.00 N ATOM 1419 CA GLN A 95 6.041 11.157 -6.397 1.00 0.00 C ATOM 1420 C GLN A 95 6.060 12.677 -6.275 1.00 0.00 C ATOM 1421 O GLN A 95 5.062 13.292 -5.900 1.00 0.00 O ATOM 1422 CB GLN A 95 5.091 10.735 -7.519 1.00 0.00 C ATOM 1423 CG GLN A 95 5.540 9.484 -8.258 1.00 0.00 C ATOM 1424 CD GLN A 95 4.376 8.674 -8.794 1.00 0.00 C ATOM 1425 OE1 GLN A 95 3.484 9.208 -9.452 1.00 0.00 O ATOM 1426 NE2 GLN A 95 4.380 7.376 -8.514 1.00 0.00 N ATOM 0 H GLN A 95 4.948 11.067 -4.609 1.00 0.00 H new ATOM 0 HA GLN A 95 7.048 10.817 -6.637 1.00 0.00 H new ATOM 0 HB2 GLN A 95 4.100 10.563 -7.099 1.00 0.00 H new ATOM 0 HB3 GLN A 95 4.997 11.554 -8.232 1.00 0.00 H new ATOM 0 HG2 GLN A 95 6.191 9.769 -9.085 1.00 0.00 H new ATOM 0 HG3 GLN A 95 6.132 8.862 -7.586 1.00 0.00 H new ATOM 0 HE21 GLN A 95 5.140 6.975 -7.965 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.623 6.780 -8.848 1.00 0.00 H new ATOM 1435 N ASN A 96 7.202 13.278 -6.594 1.00 0.00 N ATOM 1436 CA ASN A 96 7.350 14.726 -6.520 1.00 0.00 C ATOM 1437 C ASN A 96 7.736 15.304 -7.878 1.00 0.00 C ATOM 1438 O ASN A 96 7.790 14.588 -8.878 1.00 0.00 O ATOM 1439 CB ASN A 96 8.405 15.099 -5.476 1.00 0.00 C ATOM 1440 CG ASN A 96 9.817 14.830 -5.961 1.00 0.00 C ATOM 1441 OD1 ASN A 96 10.568 15.757 -6.266 1.00 0.00 O ATOM 1442 ND2 ASN A 96 10.185 13.556 -6.034 1.00 0.00 N ATOM 0 H ASN A 96 8.038 12.784 -6.906 1.00 0.00 H new ATOM 0 HA ASN A 96 6.390 15.149 -6.225 1.00 0.00 H new ATOM 0 HB2 ASN A 96 8.305 16.155 -5.223 1.00 0.00 H new ATOM 0 HB3 ASN A 96 8.224 14.534 -4.562 1.00 0.00 H new ATOM 0 HD21 ASN A 96 11.123 13.314 -6.353 1.00 0.00 H new ATOM 0 HD22 ASN A 96 9.530 12.820 -5.771 1.00 0.00 H new ATOM 1449 N LYS A 97 8.004 16.605 -7.907 1.00 0.00 N ATOM 1450 CA LYS A 97 8.386 17.281 -9.141 1.00 0.00 C ATOM 1451 C LYS A 97 9.364 16.431 -9.946 1.00 0.00 C ATOM 1452 O LYS A 97 9.470 16.575 -11.164 1.00 0.00 O ATOM 1453 CB LYS A 97 9.014 18.641 -8.828 1.00 0.00 C ATOM 1454 CG LYS A 97 10.292 18.548 -8.012 1.00 0.00 C ATOM 1455 CD LYS A 97 10.523 19.806 -7.191 1.00 0.00 C ATOM 1456 CE LYS A 97 11.313 20.844 -7.973 1.00 0.00 C ATOM 1457 NZ LYS A 97 12.782 20.646 -7.830 1.00 0.00 N ATOM 0 H LYS A 97 7.964 17.213 -7.089 1.00 0.00 H new ATOM 0 HA LYS A 97 7.486 17.432 -9.737 1.00 0.00 H new ATOM 0 HB2 LYS A 97 9.227 19.157 -9.764 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.290 19.250 -8.286 1.00 0.00 H new ATOM 0 HG2 LYS A 97 10.239 17.684 -7.349 1.00 0.00 H new ATOM 0 HG3 LYS A 97 11.139 18.387 -8.679 1.00 0.00 H new ATOM 0 HD2 LYS A 97 9.564 20.227 -6.891 1.00 0.00 H new ATOM 0 HD3 LYS A 97 11.059 19.552 -6.277 1.00 0.00 H new ATOM 0 HE2 LYS A 97 11.040 20.790 -9.027 1.00 0.00 H new ATOM 0 HE3 LYS A 97 11.045 21.842 -7.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 13.281 21.499 -8.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 13.013 20.469 -6.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 13.080 19.831 -8.404 1.00 0.00 H new ATOM 1471 N HIS A 98 10.075 15.543 -9.258 1.00 0.00 N ATOM 1472 CA HIS A 98 11.043 14.668 -9.910 1.00 0.00 C ATOM 1473 C HIS A 98 10.340 13.512 -10.616 1.00 0.00 C ATOM 1474 O HIS A 98 10.287 13.463 -11.844 1.00 0.00 O ATOM 1475 CB HIS A 98 12.041 14.125 -8.888 1.00 0.00 C ATOM 1476 CG HIS A 98 12.743 15.195 -8.109 1.00 0.00 C ATOM 1477 ND1 HIS A 98 13.227 15.197 -6.845 1.00 0.00 N flip ATOM 1478 CD2 HIS A 98 13.015 16.445 -8.624 1.00 0.00 C flip ATOM 1479 CE1 HIS A 98 13.778 16.434 -6.622 1.00 0.00 C flip ATOM 1480 NE2 HIS A 98 13.638 17.169 -7.711 1.00 0.00 N flip ATOM 0 H HIS A 98 9.999 15.410 -8.250 1.00 0.00 H new ATOM 0 HA HIS A 98 11.581 15.254 -10.656 1.00 0.00 H new ATOM 0 HB2 HIS A 98 11.517 13.467 -8.195 1.00 0.00 H new ATOM 0 HB3 HIS A 98 12.783 13.517 -9.405 1.00 0.00 H new ATOM 0 HD2 HIS A 98 12.759 16.780 -9.618 1.00 0.00 H new ATOM 0 HE1 HIS A 98 14.250 16.755 -5.705 1.00 0.00 H new ATOM 0 HE2 HIS A 98 13.956 18.131 -7.827 1.00 0.00 H new ATOM 1489 N GLY A 99 9.804 12.583 -9.831 1.00 0.00 N ATOM 1490 CA GLY A 99 9.113 11.441 -10.399 1.00 0.00 C ATOM 1491 C GLY A 99 8.841 10.359 -9.372 1.00 0.00 C ATOM 1492 O GLY A 99 8.562 10.653 -8.210 1.00 0.00 O ATOM 0 H GLY A 99 9.836 12.601 -8.812 1.00 0.00 H new ATOM 0 HA2 GLY A 99 8.169 11.770 -10.834 1.00 0.00 H new ATOM 0 HA3 GLY A 99 9.710 11.026 -11.211 1.00 0.00 H new ATOM 1496 N SER A 100 8.919 9.104 -9.803 1.00 0.00 N ATOM 1497 CA SER A 100 8.673 7.974 -8.914 1.00 0.00 C ATOM 1498 C SER A 100 9.933 7.613 -8.133 1.00 0.00 C ATOM 1499 O SER A 100 10.949 7.231 -8.713 1.00 0.00 O ATOM 1500 CB SER A 100 8.192 6.763 -9.715 1.00 0.00 C ATOM 1501 OG SER A 100 9.024 6.530 -10.837 1.00 0.00 O ATOM 0 H SER A 100 9.150 8.844 -10.762 1.00 0.00 H new ATOM 0 HA SER A 100 7.897 8.263 -8.205 1.00 0.00 H new ATOM 0 HB2 SER A 100 8.183 5.880 -9.075 1.00 0.00 H new ATOM 0 HB3 SER A 100 7.167 6.927 -10.047 1.00 0.00 H new ATOM 0 HG SER A 100 9.954 6.729 -10.602 1.00 0.00 H new ATOM 1507 N GLY A 101 9.859 7.738 -6.811 1.00 0.00 N ATOM 1508 CA GLY A 101 10.999 7.422 -5.971 1.00 0.00 C ATOM 1509 C GLY A 101 11.079 5.946 -5.633 1.00 0.00 C ATOM 1510 O GLY A 101 11.166 5.104 -6.526 1.00 0.00 O ATOM 0 H GLY A 101 9.030 8.052 -6.307 1.00 0.00 H new ATOM 0 HA2 GLY A 101 11.915 7.726 -6.478 1.00 0.00 H new ATOM 0 HA3 GLY A 101 10.938 8.000 -5.049 1.00 0.00 H new ATOM 1514 N GLU A 102 11.052 5.634 -4.341 1.00 0.00 N ATOM 1515 CA GLU A 102 11.125 4.249 -3.889 1.00 0.00 C ATOM 1516 C GLU A 102 9.736 3.711 -3.558 1.00 0.00 C ATOM 1517 O GLU A 102 8.917 4.406 -2.956 1.00 0.00 O ATOM 1518 CB GLU A 102 12.034 4.137 -2.664 1.00 0.00 C ATOM 1519 CG GLU A 102 12.088 2.738 -2.072 1.00 0.00 C ATOM 1520 CD GLU A 102 13.010 1.814 -2.843 1.00 0.00 C ATOM 1521 OE1 GLU A 102 12.905 1.775 -4.087 1.00 0.00 O ATOM 1522 OE2 GLU A 102 13.835 1.129 -2.204 1.00 0.00 O ATOM 0 H GLU A 102 10.980 6.320 -3.590 1.00 0.00 H new ATOM 0 HA GLU A 102 11.543 3.650 -4.698 1.00 0.00 H new ATOM 0 HB2 GLU A 102 13.042 4.444 -2.941 1.00 0.00 H new ATOM 0 HB3 GLU A 102 11.687 4.833 -1.900 1.00 0.00 H new ATOM 0 HG2 GLU A 102 12.423 2.798 -1.037 1.00 0.00 H new ATOM 0 HG3 GLU A 102 11.084 2.314 -2.058 1.00 0.00 H new ATOM 1529 N SER A 103 9.478 2.469 -3.955 1.00 0.00 N ATOM 1530 CA SER A 103 8.188 1.839 -3.704 1.00 0.00 C ATOM 1531 C SER A 103 8.167 1.170 -2.333 1.00 0.00 C ATOM 1532 O SER A 103 9.074 0.415 -1.985 1.00 0.00 O ATOM 1533 CB SER A 103 7.880 0.808 -4.792 1.00 0.00 C ATOM 1534 OG SER A 103 8.913 -0.159 -4.885 1.00 0.00 O ATOM 0 H SER A 103 10.146 1.879 -4.452 1.00 0.00 H new ATOM 0 HA SER A 103 7.423 2.615 -3.722 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.934 0.314 -4.572 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.761 1.311 -5.751 1.00 0.00 H new ATOM 0 HG SER A 103 9.267 -0.347 -3.991 1.00 0.00 H new ATOM 1540 N SER A 104 7.124 1.454 -1.559 1.00 0.00 N ATOM 1541 CA SER A 104 6.986 0.884 -0.224 1.00 0.00 C ATOM 1542 C SER A 104 6.904 -0.638 -0.289 1.00 0.00 C ATOM 1543 O SER A 104 6.823 -1.220 -1.370 1.00 0.00 O ATOM 1544 CB SER A 104 5.740 1.444 0.466 1.00 0.00 C ATOM 1545 OG SER A 104 5.377 0.652 1.584 1.00 0.00 O ATOM 0 H SER A 104 6.363 2.075 -1.833 1.00 0.00 H new ATOM 0 HA SER A 104 7.868 1.159 0.355 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.928 2.468 0.788 1.00 0.00 H new ATOM 0 HB3 SER A 104 4.913 1.479 -0.243 1.00 0.00 H new ATOM 0 HG SER A 104 4.545 0.172 1.389 1.00 0.00 H new ATOM 1551 N ALA A 105 6.927 -1.276 0.876 1.00 0.00 N ATOM 1552 CA ALA A 105 6.853 -2.730 0.953 1.00 0.00 C ATOM 1553 C ALA A 105 5.478 -3.233 0.530 1.00 0.00 C ATOM 1554 O ALA A 105 4.459 -2.570 0.728 1.00 0.00 O ATOM 1555 CB ALA A 105 7.179 -3.201 2.363 1.00 0.00 C ATOM 0 H ALA A 105 6.996 -0.809 1.780 1.00 0.00 H new ATOM 0 HA ALA A 105 7.590 -3.144 0.264 1.00 0.00 H new ATOM 0 HB1 ALA A 105 7.120 -4.289 2.406 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.186 -2.881 2.630 1.00 0.00 H new ATOM 0 HB3 ALA A 105 6.464 -2.771 3.065 1.00 0.00 H new ATOM 1561 N PRO A 106 5.444 -4.433 -0.069 1.00 0.00 N ATOM 1562 CA PRO A 106 4.199 -5.052 -0.533 1.00 0.00 C ATOM 1563 C PRO A 106 3.306 -5.493 0.621 1.00 0.00 C ATOM 1564 O PRO A 106 3.582 -6.492 1.287 1.00 0.00 O ATOM 1565 CB PRO A 106 4.682 -6.266 -1.330 1.00 0.00 C ATOM 1566 CG PRO A 106 6.016 -6.592 -0.753 1.00 0.00 C ATOM 1567 CD PRO A 106 6.619 -5.278 -0.338 1.00 0.00 C ATOM 0 HA PRO A 106 3.591 -4.359 -1.114 1.00 0.00 H new ATOM 0 HB2 PRO A 106 3.992 -7.104 -1.231 1.00 0.00 H new ATOM 0 HB3 PRO A 106 4.756 -6.038 -2.393 1.00 0.00 H new ATOM 0 HG2 PRO A 106 5.919 -7.264 0.100 1.00 0.00 H new ATOM 0 HG3 PRO A 106 6.646 -7.096 -1.486 1.00 0.00 H new ATOM 0 HD2 PRO A 106 7.247 -5.386 0.546 1.00 0.00 H new ATOM 0 HD3 PRO A 106 7.245 -4.857 -1.125 1.00 0.00 H new ATOM 1575 N LEU A 107 2.233 -4.744 0.853 1.00 0.00 N ATOM 1576 CA LEU A 107 1.298 -5.059 1.928 1.00 0.00 C ATOM 1577 C LEU A 107 0.305 -6.130 1.489 1.00 0.00 C ATOM 1578 O LEU A 107 -0.333 -6.008 0.442 1.00 0.00 O ATOM 1579 CB LEU A 107 0.547 -3.799 2.363 1.00 0.00 C ATOM 1580 CG LEU A 107 -0.489 -3.984 3.472 1.00 0.00 C ATOM 1581 CD1 LEU A 107 0.189 -4.372 4.776 1.00 0.00 C ATOM 1582 CD2 LEU A 107 -1.310 -2.715 3.652 1.00 0.00 C ATOM 0 H LEU A 107 1.989 -3.915 0.311 1.00 0.00 H new ATOM 0 HA LEU A 107 1.870 -5.444 2.773 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.278 -3.061 2.695 1.00 0.00 H new ATOM 0 HB3 LEU A 107 0.045 -3.380 1.491 1.00 0.00 H new ATOM 0 HG LEU A 107 -1.163 -4.791 3.183 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -0.564 -4.499 5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.732 -5.307 4.640 1.00 0.00 H new ATOM 0 HD13 LEU A 107 0.886 -3.588 5.071 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -2.042 -2.865 4.445 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -0.650 -1.889 3.919 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -1.826 -2.481 2.721 1.00 0.00 H new ATOM 1594 N ARG A 108 0.177 -7.178 2.296 1.00 0.00 N ATOM 1595 CA ARG A 108 -0.739 -8.270 1.991 1.00 0.00 C ATOM 1596 C ARG A 108 -2.086 -8.056 2.676 1.00 0.00 C ATOM 1597 O ARG A 108 -2.225 -8.277 3.879 1.00 0.00 O ATOM 1598 CB ARG A 108 -0.138 -9.606 2.431 1.00 0.00 C ATOM 1599 CG ARG A 108 -0.923 -10.815 1.947 1.00 0.00 C ATOM 1600 CD ARG A 108 -0.023 -12.029 1.772 1.00 0.00 C ATOM 1601 NE ARG A 108 -0.777 -13.217 1.382 1.00 0.00 N ATOM 1602 CZ ARG A 108 -1.579 -13.883 2.206 1.00 0.00 C ATOM 1603 NH1 ARG A 108 -1.730 -13.479 3.460 1.00 0.00 N ATOM 1604 NH2 ARG A 108 -2.231 -14.955 1.776 1.00 0.00 N ATOM 0 H ARG A 108 0.696 -7.294 3.166 1.00 0.00 H new ATOM 0 HA ARG A 108 -0.897 -8.288 0.913 1.00 0.00 H new ATOM 0 HB2 ARG A 108 0.885 -9.675 2.060 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -0.084 -9.630 3.519 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -1.714 -11.047 2.661 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -1.408 -10.580 0.999 1.00 0.00 H new ATOM 0 HD2 ARG A 108 0.732 -11.814 1.016 1.00 0.00 H new ATOM 0 HD3 ARG A 108 0.506 -12.225 2.704 1.00 0.00 H new ATOM 0 HE ARG A 108 -0.683 -13.554 0.424 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -1.230 -12.655 3.794 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -2.346 -13.992 4.090 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -2.117 -15.269 0.812 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -2.846 -15.466 2.409 1.00 0.00 H new ATOM 1618 N VAL A 109 -3.076 -7.625 1.901 1.00 0.00 N ATOM 1619 CA VAL A 109 -4.412 -7.381 2.432 1.00 0.00 C ATOM 1620 C VAL A 109 -5.418 -8.377 1.865 1.00 0.00 C ATOM 1621 O VAL A 109 -5.430 -8.646 0.665 1.00 0.00 O ATOM 1622 CB VAL A 109 -4.889 -5.951 2.118 1.00 0.00 C ATOM 1623 CG1 VAL A 109 -6.224 -5.673 2.793 1.00 0.00 C ATOM 1624 CG2 VAL A 109 -3.843 -4.934 2.547 1.00 0.00 C ATOM 0 H VAL A 109 -2.978 -7.438 0.903 1.00 0.00 H new ATOM 0 HA VAL A 109 -4.351 -7.505 3.513 1.00 0.00 H new ATOM 0 HB VAL A 109 -5.028 -5.862 1.041 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -6.545 -4.658 2.560 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -6.969 -6.382 2.431 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -6.115 -5.780 3.872 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.197 -3.929 2.317 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -3.669 -5.021 3.619 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -2.912 -5.122 2.012 1.00 0.00 H new ATOM 1634 N GLU A 110 -6.262 -8.920 2.738 1.00 0.00 N ATOM 1635 CA GLU A 110 -7.272 -9.886 2.323 1.00 0.00 C ATOM 1636 C GLU A 110 -8.677 -9.341 2.562 1.00 0.00 C ATOM 1637 O GLU A 110 -9.036 -8.986 3.685 1.00 0.00 O ATOM 1638 CB GLU A 110 -7.089 -11.204 3.080 1.00 0.00 C ATOM 1639 CG GLU A 110 -7.984 -12.324 2.576 1.00 0.00 C ATOM 1640 CD GLU A 110 -7.832 -13.600 3.381 1.00 0.00 C ATOM 1641 OE1 GLU A 110 -8.461 -13.703 4.454 1.00 0.00 O ATOM 1642 OE2 GLU A 110 -7.082 -14.495 2.937 1.00 0.00 O ATOM 0 H GLU A 110 -6.266 -8.707 3.736 1.00 0.00 H new ATOM 0 HA GLU A 110 -7.148 -10.067 1.255 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -6.048 -11.518 3.000 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -7.291 -11.037 4.138 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -9.023 -11.998 2.612 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -7.750 -12.528 1.531 1.00 0.00 H new ATOM 1649 N THR A 111 -9.469 -9.276 1.496 1.00 0.00 N ATOM 1650 CA THR A 111 -10.833 -8.772 1.587 1.00 0.00 C ATOM 1651 C THR A 111 -11.716 -9.718 2.393 1.00 0.00 C ATOM 1652 O THR A 111 -11.250 -10.744 2.888 1.00 0.00 O ATOM 1653 CB THR A 111 -11.454 -8.574 0.191 1.00 0.00 C ATOM 1654 OG1 THR A 111 -11.047 -9.635 -0.681 1.00 0.00 O ATOM 1655 CG2 THR A 111 -11.037 -7.237 -0.402 1.00 0.00 C ATOM 0 H THR A 111 -9.188 -9.566 0.559 1.00 0.00 H new ATOM 0 HA THR A 111 -10.780 -7.808 2.093 1.00 0.00 H new ATOM 0 HB THR A 111 -12.539 -8.585 0.295 1.00 0.00 H new ATOM 0 HG1 THR A 111 -11.124 -9.341 -1.613 1.00 0.00 H new ATOM 0 HG21 THR A 111 -11.488 -7.120 -1.388 1.00 0.00 H new ATOM 0 HG22 THR A 111 -11.373 -6.430 0.249 1.00 0.00 H new ATOM 0 HG23 THR A 111 -9.951 -7.202 -0.493 1.00 0.00 H new ATOM 1663 N GLN A 112 -12.991 -9.366 2.521 1.00 0.00 N ATOM 1664 CA GLN A 112 -13.938 -10.185 3.268 1.00 0.00 C ATOM 1665 C GLN A 112 -14.921 -10.875 2.327 1.00 0.00 C ATOM 1666 O GLN A 112 -15.327 -10.326 1.303 1.00 0.00 O ATOM 1667 CB GLN A 112 -14.698 -9.328 4.281 1.00 0.00 C ATOM 1668 CG GLN A 112 -13.916 -8.117 4.762 1.00 0.00 C ATOM 1669 CD GLN A 112 -12.732 -8.494 5.630 1.00 0.00 C ATOM 1670 OE1 GLN A 112 -12.469 -9.675 5.862 1.00 0.00 O ATOM 1671 NE2 GLN A 112 -12.009 -7.492 6.115 1.00 0.00 N ATOM 0 H GLN A 112 -13.392 -8.519 2.117 1.00 0.00 H new ATOM 0 HA GLN A 112 -13.376 -10.951 3.802 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -15.632 -8.992 3.831 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -14.962 -9.944 5.140 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -13.564 -7.551 3.900 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -14.580 -7.461 5.325 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -12.263 -6.528 5.898 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -11.200 -7.686 6.705 1.00 0.00 H new ATOM 1680 N PRO A 113 -15.315 -12.107 2.682 1.00 0.00 N ATOM 1681 CA PRO A 113 -16.256 -12.898 1.883 1.00 0.00 C ATOM 1682 C PRO A 113 -17.670 -12.329 1.922 1.00 0.00 C ATOM 1683 O PRO A 113 -18.354 -12.414 2.941 1.00 0.00 O ATOM 1684 CB PRO A 113 -16.215 -14.276 2.549 1.00 0.00 C ATOM 1685 CG PRO A 113 -15.798 -14.006 3.953 1.00 0.00 C ATOM 1686 CD PRO A 113 -14.872 -12.823 3.890 1.00 0.00 C ATOM 0 HA PRO A 113 -15.984 -12.911 0.827 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -17.190 -14.763 2.512 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -15.509 -14.938 2.047 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -16.662 -13.792 4.582 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -15.296 -14.872 4.384 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.956 -12.199 4.780 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -13.830 -13.132 3.814 1.00 0.00 H new ATOM 1694 N GLU A 114 -18.101 -11.751 0.805 1.00 0.00 N ATOM 1695 CA GLU A 114 -19.434 -11.168 0.713 1.00 0.00 C ATOM 1696 C GLU A 114 -20.395 -12.116 0.001 1.00 0.00 C ATOM 1697 O GLU A 114 -21.556 -12.245 0.387 1.00 0.00 O ATOM 1698 CB GLU A 114 -19.380 -9.829 -0.026 1.00 0.00 C ATOM 1699 CG GLU A 114 -19.018 -9.960 -1.496 1.00 0.00 C ATOM 1700 CD GLU A 114 -20.224 -10.243 -2.371 1.00 0.00 C ATOM 1701 OE1 GLU A 114 -21.360 -10.011 -1.907 1.00 0.00 O ATOM 1702 OE2 GLU A 114 -20.031 -10.697 -3.518 1.00 0.00 O ATOM 0 H GLU A 114 -17.547 -11.674 -0.048 1.00 0.00 H new ATOM 0 HA GLU A 114 -19.800 -11.001 1.726 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -20.349 -9.337 0.059 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -18.651 -9.183 0.463 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -18.538 -9.041 -1.831 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -18.290 -10.762 -1.617 1.00 0.00 H new ATOM 1709 N SER A 115 -19.900 -12.777 -1.041 1.00 0.00 N ATOM 1710 CA SER A 115 -20.715 -13.711 -1.810 1.00 0.00 C ATOM 1711 C SER A 115 -20.972 -14.989 -1.017 1.00 0.00 C ATOM 1712 O SER A 115 -20.143 -15.898 -0.998 1.00 0.00 O ATOM 1713 CB SER A 115 -20.027 -14.048 -3.135 1.00 0.00 C ATOM 1714 OG SER A 115 -20.819 -14.931 -3.910 1.00 0.00 O ATOM 0 H SER A 115 -18.940 -12.683 -1.372 1.00 0.00 H new ATOM 0 HA SER A 115 -21.673 -13.235 -2.017 1.00 0.00 H new ATOM 0 HB2 SER A 115 -19.843 -13.132 -3.696 1.00 0.00 H new ATOM 0 HB3 SER A 115 -19.056 -14.502 -2.939 1.00 0.00 H new ATOM 0 HG SER A 115 -20.359 -15.130 -4.752 1.00 0.00 H new ATOM 1720 N GLY A 116 -22.128 -15.050 -0.364 1.00 0.00 N ATOM 1721 CA GLY A 116 -22.475 -16.219 0.422 1.00 0.00 C ATOM 1722 C GLY A 116 -23.692 -15.990 1.296 1.00 0.00 C ATOM 1723 O GLY A 116 -24.456 -15.045 1.099 1.00 0.00 O ATOM 0 H GLY A 116 -22.831 -14.311 -0.365 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -22.664 -17.059 -0.246 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -21.628 -16.496 1.050 1.00 0.00 H new ATOM 1727 N PRO A 117 -23.887 -16.871 2.289 1.00 0.00 N ATOM 1728 CA PRO A 117 -25.019 -16.781 3.216 1.00 0.00 C ATOM 1729 C PRO A 117 -24.900 -15.592 4.163 1.00 0.00 C ATOM 1730 O PRO A 117 -25.875 -14.880 4.405 1.00 0.00 O ATOM 1731 CB PRO A 117 -24.943 -18.096 3.997 1.00 0.00 C ATOM 1732 CG PRO A 117 -23.511 -18.499 3.921 1.00 0.00 C ATOM 1733 CD PRO A 117 -23.016 -18.021 2.583 1.00 0.00 C ATOM 0 HA PRO A 117 -25.964 -16.634 2.692 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -25.262 -17.962 5.031 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -25.592 -18.855 3.559 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -22.936 -18.052 4.732 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -23.404 -19.580 4.013 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -21.966 -17.730 2.623 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -23.103 -18.796 1.822 1.00 0.00 H new ATOM 1741 N SER A 118 -23.701 -15.383 4.695 1.00 0.00 N ATOM 1742 CA SER A 118 -23.456 -14.281 5.619 1.00 0.00 C ATOM 1743 C SER A 118 -24.650 -14.074 6.546 1.00 0.00 C ATOM 1744 O SER A 118 -25.031 -12.942 6.842 1.00 0.00 O ATOM 1745 CB SER A 118 -23.168 -12.993 4.844 1.00 0.00 C ATOM 1746 OG SER A 118 -21.986 -13.115 4.073 1.00 0.00 O ATOM 0 H SER A 118 -22.883 -15.962 4.503 1.00 0.00 H new ATOM 0 HA SER A 118 -22.587 -14.534 6.226 1.00 0.00 H new ATOM 0 HB2 SER A 118 -24.010 -12.762 4.191 1.00 0.00 H new ATOM 0 HB3 SER A 118 -23.067 -12.161 5.541 1.00 0.00 H new ATOM 0 HG SER A 118 -21.825 -12.280 3.586 1.00 0.00 H new ATOM 1752 N SER A 119 -25.235 -15.177 7.002 1.00 0.00 N ATOM 1753 CA SER A 119 -26.388 -15.118 7.893 1.00 0.00 C ATOM 1754 C SER A 119 -26.273 -16.162 9.000 1.00 0.00 C ATOM 1755 O SER A 119 -25.666 -17.216 8.814 1.00 0.00 O ATOM 1756 CB SER A 119 -27.680 -15.335 7.104 1.00 0.00 C ATOM 1757 OG SER A 119 -28.811 -15.297 7.957 1.00 0.00 O ATOM 0 H SER A 119 -24.930 -16.122 6.769 1.00 0.00 H new ATOM 0 HA SER A 119 -26.412 -14.129 8.351 1.00 0.00 H new ATOM 0 HB2 SER A 119 -27.774 -14.567 6.336 1.00 0.00 H new ATOM 0 HB3 SER A 119 -27.640 -16.296 6.591 1.00 0.00 H new ATOM 0 HG SER A 119 -29.624 -15.437 7.428 1.00 0.00 H new ATOM 1763 N GLY A 120 -26.861 -15.859 10.153 1.00 0.00 N ATOM 1764 CA GLY A 120 -26.813 -16.780 11.274 1.00 0.00 C ATOM 1765 C GLY A 120 -27.779 -17.937 11.115 1.00 0.00 C ATOM 1766 O GLY A 120 -28.902 -17.891 11.618 1.00 0.00 O ATOM 0 H GLY A 120 -27.369 -14.993 10.331 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -25.800 -17.168 11.378 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -27.044 -16.241 12.193 1.00 0.00 H new TER 1770 GLY A 120