USER MOD reduce.3.24.130724 H: found=0, std=0, add=747, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 752 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 42 SER OG : rot -70:sc= 0.671 USER MOD Set 1.2: A 66 THR OG1 : rot 180:sc= 0.583 USER MOD Single : A 3 SER OG : rot 43:sc= 0.827 USER MOD Single : A 4 THR OG1 : rot 160:sc= -0.24 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= -0.819 USER MOD Single : A 11 GLN : amide:sc= -0.0378 K(o=-0.038,f=-0.83) USER MOD Single : A 12 SER OG : rot -170:sc= -0.95 USER MOD Single : A 20 LYS NZ :NH3+ 157:sc= -0.0776 (180deg=-0.46) USER MOD Single : A 21 MET CE :methyl -154:sc= -0.201 (180deg=-1.33) USER MOD Single : A 25 ASN : amide:sc= -5.92! C(o=-5.9!,f=-15!) USER MOD Single : A 27 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0362) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.286 X(o=-0.29,f=-0.027) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 159:sc= 1.58 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 165:sc= -0.634 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 169:sc= -0.175 USER MOD Single : A 87 TYR OH : rot 180:sc= -0.886 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 139:sc= 1.12 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc=-0.00134 K(o=-0.0013,f=-2.9!) USER MOD Single : A 116 ASN : amide:sc= -1.08 X(o=-1.1,f=-0.77) USER MOD Single : A 118 MET CE :methyl -146:sc= -0.229 (180deg=-1.32!) USER MOD Single : A 120 ASN : amide:sc= -0.627 K(o=-0.63,f=-5.3!) USER MOD Single : A 126 SER OG : rot 17:sc= 0.816 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 130 SER OG : rot 130:sc= -2.21 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 3 114.801 -16.883 12.280 1.00 0.00 N ATOM 28 CA SER A 3 114.843 -15.476 11.902 1.00 0.00 C ATOM 29 C SER A 3 114.843 -15.321 10.383 1.00 0.00 C ATOM 30 O SER A 3 115.383 -16.161 9.664 1.00 0.00 O ATOM 31 CB SER A 3 116.095 -14.817 12.482 1.00 0.00 C ATOM 32 OG SER A 3 116.062 -13.423 12.202 1.00 0.00 O ATOM 0 HA SER A 3 113.954 -14.989 12.303 1.00 0.00 H new ATOM 0 HB2 SER A 3 116.142 -14.983 13.558 1.00 0.00 H new ATOM 0 HB3 SER A 3 116.990 -15.266 12.051 1.00 0.00 H new ATOM 0 HG SER A 3 115.160 -13.078 12.366 1.00 0.00 H new ATOM 38 N THR A 4 114.232 -14.241 9.903 1.00 0.00 N ATOM 39 CA THR A 4 114.181 -13.963 8.470 1.00 0.00 C ATOM 40 C THR A 4 114.733 -12.569 8.182 1.00 0.00 C ATOM 41 O THR A 4 114.486 -11.627 8.934 1.00 0.00 O ATOM 42 CB THR A 4 112.738 -14.054 7.971 1.00 0.00 C ATOM 43 OG1 THR A 4 112.189 -15.310 8.345 1.00 0.00 O ATOM 44 CG2 THR A 4 112.709 -13.918 6.447 1.00 0.00 C ATOM 0 H THR A 4 113.766 -13.545 10.484 1.00 0.00 H new ATOM 0 HA THR A 4 114.791 -14.702 7.950 1.00 0.00 H new ATOM 0 HB THR A 4 112.150 -13.250 8.415 1.00 0.00 H new ATOM 0 HG1 THR A 4 111.211 -15.259 8.324 1.00 0.00 H new ATOM 0 HG21 THR A 4 111.679 -13.983 6.095 1.00 0.00 H new ATOM 0 HG22 THR A 4 113.130 -12.955 6.160 1.00 0.00 H new ATOM 0 HG23 THR A 4 113.297 -14.719 5.999 1.00 0.00 H new ATOM 52 N VAL A 5 115.483 -12.444 7.088 1.00 0.00 N ATOM 53 CA VAL A 5 116.074 -11.157 6.716 1.00 0.00 C ATOM 54 C VAL A 5 115.699 -10.804 5.278 1.00 0.00 C ATOM 55 O VAL A 5 115.920 -11.596 4.361 1.00 0.00 O ATOM 56 CB VAL A 5 117.602 -11.217 6.851 1.00 0.00 C ATOM 57 CG1 VAL A 5 118.206 -9.841 6.558 1.00 0.00 C ATOM 58 CG2 VAL A 5 117.982 -11.632 8.276 1.00 0.00 C ATOM 0 H VAL A 5 115.695 -13.210 6.448 1.00 0.00 H new ATOM 0 HA VAL A 5 115.687 -10.389 7.386 1.00 0.00 H new ATOM 0 HB VAL A 5 117.988 -11.947 6.139 1.00 0.00 H new ATOM 0 HG11 VAL A 5 119.290 -9.891 6.656 1.00 0.00 H new ATOM 0 HG12 VAL A 5 117.947 -9.538 5.543 1.00 0.00 H new ATOM 0 HG13 VAL A 5 117.811 -9.112 7.266 1.00 0.00 H new ATOM 0 HG21 VAL A 5 119.068 -11.673 8.366 1.00 0.00 H new ATOM 0 HG22 VAL A 5 117.586 -10.904 8.985 1.00 0.00 H new ATOM 0 HG23 VAL A 5 117.563 -12.615 8.493 1.00 0.00 H new ATOM 68 N THR A 6 115.133 -9.613 5.081 1.00 0.00 N ATOM 69 CA THR A 6 114.711 -9.188 3.746 1.00 0.00 C ATOM 70 C THR A 6 115.280 -7.813 3.414 1.00 0.00 C ATOM 71 O THR A 6 115.323 -6.926 4.264 1.00 0.00 O ATOM 72 CB THR A 6 113.182 -9.146 3.668 1.00 0.00 C ATOM 73 OG1 THR A 6 112.652 -10.354 4.195 1.00 0.00 O ATOM 74 CG2 THR A 6 112.745 -8.997 2.209 1.00 0.00 C ATOM 0 H THR A 6 114.957 -8.932 5.820 1.00 0.00 H new ATOM 0 HA THR A 6 115.090 -9.908 3.021 1.00 0.00 H new ATOM 0 HB THR A 6 112.813 -8.298 4.245 1.00 0.00 H new ATOM 0 HG1 THR A 6 111.673 -10.330 4.148 1.00 0.00 H new ATOM 0 HG21 THR A 6 111.657 -8.967 2.156 1.00 0.00 H new ATOM 0 HG22 THR A 6 113.153 -8.073 1.799 1.00 0.00 H new ATOM 0 HG23 THR A 6 113.113 -9.844 1.631 1.00 0.00 H new ATOM 82 N GLY A 7 115.706 -7.638 2.168 1.00 0.00 N ATOM 83 CA GLY A 7 116.156 -6.335 1.693 1.00 0.00 C ATOM 84 C GLY A 7 115.407 -6.005 0.413 1.00 0.00 C ATOM 85 O GLY A 7 115.187 -6.894 -0.409 1.00 0.00 O ATOM 0 H GLY A 7 115.749 -8.380 1.470 1.00 0.00 H new ATOM 0 HA2 GLY A 7 115.970 -5.571 2.448 1.00 0.00 H new ATOM 0 HA3 GLY A 7 117.231 -6.348 1.511 1.00 0.00 H new ATOM 89 N GLY A 8 115.018 -4.743 0.242 1.00 0.00 N ATOM 90 CA GLY A 8 114.167 -4.394 -0.891 1.00 0.00 C ATOM 91 C GLY A 8 114.163 -2.904 -1.190 1.00 0.00 C ATOM 92 O GLY A 8 114.897 -2.126 -0.579 1.00 0.00 O ATOM 0 H GLY A 8 115.270 -3.967 0.854 1.00 0.00 H new ATOM 0 HA2 GLY A 8 114.506 -4.936 -1.774 1.00 0.00 H new ATOM 0 HA3 GLY A 8 113.147 -4.722 -0.688 1.00 0.00 H new ATOM 96 N TYR A 9 113.287 -2.525 -2.114 1.00 0.00 N ATOM 97 CA TYR A 9 113.220 -1.152 -2.592 1.00 0.00 C ATOM 98 C TYR A 9 111.768 -0.698 -2.637 1.00 0.00 C ATOM 99 O TYR A 9 110.873 -1.492 -2.929 1.00 0.00 O ATOM 100 CB TYR A 9 113.834 -1.062 -3.990 1.00 0.00 C ATOM 101 CG TYR A 9 113.860 0.338 -4.556 1.00 0.00 C ATOM 102 CD1 TYR A 9 114.912 1.205 -4.236 1.00 0.00 C ATOM 103 CD2 TYR A 9 112.834 0.765 -5.406 1.00 0.00 C ATOM 104 CE1 TYR A 9 114.937 2.499 -4.768 1.00 0.00 C ATOM 105 CE2 TYR A 9 112.859 2.060 -5.938 1.00 0.00 C ATOM 106 CZ TYR A 9 113.910 2.928 -5.618 1.00 0.00 C ATOM 107 OH TYR A 9 113.935 4.203 -6.145 1.00 0.00 O ATOM 0 H TYR A 9 112.611 -3.154 -2.548 1.00 0.00 H new ATOM 0 HA TYR A 9 113.778 -0.506 -1.914 1.00 0.00 H new ATOM 0 HB2 TYR A 9 114.853 -1.448 -3.955 1.00 0.00 H new ATOM 0 HB3 TYR A 9 113.272 -1.707 -4.666 1.00 0.00 H new ATOM 0 HD1 TYR A 9 115.703 0.875 -3.579 1.00 0.00 H new ATOM 0 HD2 TYR A 9 112.023 0.096 -5.652 1.00 0.00 H new ATOM 0 HE1 TYR A 9 115.749 3.167 -4.523 1.00 0.00 H new ATOM 0 HE2 TYR A 9 112.068 2.389 -6.595 1.00 0.00 H new ATOM 0 HH TYR A 9 113.149 4.337 -6.714 1.00 0.00 H new ATOM 117 N ALA A 10 111.537 0.568 -2.319 1.00 0.00 N ATOM 118 CA ALA A 10 110.190 1.125 -2.330 1.00 0.00 C ATOM 119 C ALA A 10 110.160 2.413 -3.139 1.00 0.00 C ATOM 120 O ALA A 10 111.147 3.145 -3.186 1.00 0.00 O ATOM 121 CB ALA A 10 109.734 1.411 -0.897 1.00 0.00 C ATOM 0 H ALA A 10 112.265 1.230 -2.050 1.00 0.00 H new ATOM 0 HA ALA A 10 109.516 0.401 -2.788 1.00 0.00 H new ATOM 0 HB1 ALA A 10 108.727 1.827 -0.912 1.00 0.00 H new ATOM 0 HB2 ALA A 10 109.735 0.484 -0.323 1.00 0.00 H new ATOM 0 HB3 ALA A 10 110.415 2.125 -0.434 1.00 0.00 H new ATOM 127 N GLN A 11 109.017 2.682 -3.762 1.00 0.00 N ATOM 128 CA GLN A 11 108.835 3.907 -4.534 1.00 0.00 C ATOM 129 C GLN A 11 107.703 4.734 -3.932 1.00 0.00 C ATOM 130 O GLN A 11 106.674 4.184 -3.535 1.00 0.00 O ATOM 131 CB GLN A 11 108.544 3.557 -6.000 1.00 0.00 C ATOM 132 CG GLN A 11 107.212 2.806 -6.128 1.00 0.00 C ATOM 133 CD GLN A 11 107.075 2.223 -7.531 1.00 0.00 C ATOM 134 OE1 GLN A 11 108.042 1.700 -8.084 1.00 0.00 O ATOM 135 NE2 GLN A 11 105.924 2.282 -8.142 1.00 0.00 N ATOM 0 H GLN A 11 108.202 2.068 -3.748 1.00 0.00 H new ATOM 0 HA GLN A 11 109.748 4.501 -4.498 1.00 0.00 H new ATOM 0 HB2 GLN A 11 108.511 4.469 -6.596 1.00 0.00 H new ATOM 0 HB3 GLN A 11 109.352 2.944 -6.399 1.00 0.00 H new ATOM 0 HG2 GLN A 11 107.162 2.008 -5.387 1.00 0.00 H new ATOM 0 HG3 GLN A 11 106.382 3.483 -5.924 1.00 0.00 H new ATOM 0 HE21 GLN A 11 105.124 2.716 -7.682 1.00 0.00 H new ATOM 0 HE22 GLN A 11 105.824 1.894 -9.080 1.00 0.00 H new ATOM 144 N SER A 12 107.904 6.046 -3.861 1.00 0.00 N ATOM 145 CA SER A 12 106.900 6.943 -3.301 1.00 0.00 C ATOM 146 C SER A 12 106.315 7.806 -4.410 1.00 0.00 C ATOM 147 O SER A 12 107.055 8.305 -5.259 1.00 0.00 O ATOM 148 CB SER A 12 107.532 7.838 -2.236 1.00 0.00 C ATOM 149 OG SER A 12 106.527 8.662 -1.662 1.00 0.00 O ATOM 0 H SER A 12 108.752 6.511 -4.184 1.00 0.00 H new ATOM 0 HA SER A 12 106.108 6.350 -2.843 1.00 0.00 H new ATOM 0 HB2 SER A 12 108.004 7.229 -1.465 1.00 0.00 H new ATOM 0 HB3 SER A 12 108.315 8.454 -2.679 1.00 0.00 H new ATOM 0 HG SER A 12 106.946 9.343 -1.096 1.00 0.00 H new ATOM 155 N ASP A 13 105.003 8.023 -4.348 1.00 0.00 N ATOM 156 CA ASP A 13 104.290 8.679 -5.436 1.00 0.00 C ATOM 157 C ASP A 13 104.492 10.188 -5.400 1.00 0.00 C ATOM 158 O ASP A 13 104.286 10.838 -4.374 1.00 0.00 O ATOM 159 CB ASP A 13 102.796 8.363 -5.343 1.00 0.00 C ATOM 160 CG ASP A 13 102.066 8.933 -6.555 1.00 0.00 C ATOM 161 OD1 ASP A 13 102.050 8.269 -7.579 1.00 0.00 O ATOM 162 OD2 ASP A 13 101.533 10.025 -6.441 1.00 0.00 O ATOM 0 H ASP A 13 104.416 7.755 -3.558 1.00 0.00 H new ATOM 0 HA ASP A 13 104.691 8.301 -6.376 1.00 0.00 H new ATOM 0 HB2 ASP A 13 102.646 7.285 -5.292 1.00 0.00 H new ATOM 0 HB3 ASP A 13 102.383 8.786 -4.427 1.00 0.00 H new ATOM 167 N ALA A 14 104.896 10.729 -6.544 1.00 0.00 N ATOM 168 CA ALA A 14 105.188 12.150 -6.668 1.00 0.00 C ATOM 169 C ALA A 14 103.981 12.912 -7.207 1.00 0.00 C ATOM 170 O ALA A 14 103.242 12.414 -8.058 1.00 0.00 O ATOM 171 CB ALA A 14 106.394 12.355 -7.592 1.00 0.00 C ATOM 0 H ALA A 14 105.029 10.198 -7.405 1.00 0.00 H new ATOM 0 HA ALA A 14 105.421 12.540 -5.677 1.00 0.00 H new ATOM 0 HB1 ALA A 14 106.607 13.420 -7.681 1.00 0.00 H new ATOM 0 HB2 ALA A 14 107.262 11.844 -7.176 1.00 0.00 H new ATOM 0 HB3 ALA A 14 106.171 11.946 -8.578 1.00 0.00 H new ATOM 249 N LYS A 20 109.498 11.475 -8.346 1.00 0.00 N ATOM 250 CA LYS A 20 109.293 10.380 -7.399 1.00 0.00 C ATOM 251 C LYS A 20 110.502 10.215 -6.476 1.00 0.00 C ATOM 252 O LYS A 20 111.563 10.790 -6.723 1.00 0.00 O ATOM 253 CB LYS A 20 108.983 9.069 -8.147 1.00 0.00 C ATOM 254 CG LYS A 20 110.214 8.471 -8.852 1.00 0.00 C ATOM 255 CD LYS A 20 110.630 9.333 -10.048 1.00 0.00 C ATOM 256 CE LYS A 20 111.627 8.558 -10.911 1.00 0.00 C ATOM 257 NZ LYS A 20 110.917 7.461 -11.628 1.00 0.00 N ATOM 0 HA LYS A 20 108.434 10.627 -6.775 1.00 0.00 H new ATOM 0 HB2 LYS A 20 108.586 8.340 -7.441 1.00 0.00 H new ATOM 0 HB3 LYS A 20 108.203 9.255 -8.886 1.00 0.00 H new ATOM 0 HG2 LYS A 20 111.042 8.396 -8.147 1.00 0.00 H new ATOM 0 HG3 LYS A 20 109.990 7.459 -9.188 1.00 0.00 H new ATOM 0 HD2 LYS A 20 109.754 9.603 -10.638 1.00 0.00 H new ATOM 0 HD3 LYS A 20 111.079 10.264 -9.701 1.00 0.00 H new ATOM 0 HE2 LYS A 20 112.101 9.228 -11.628 1.00 0.00 H new ATOM 0 HE3 LYS A 20 112.420 8.145 -10.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 111.458 7.192 -12.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 110.826 6.637 -10.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 109.971 7.787 -11.911 1.00 0.00 H new ATOM 271 N MET A 21 110.339 9.429 -5.412 1.00 0.00 N ATOM 272 CA MET A 21 111.429 9.218 -4.456 1.00 0.00 C ATOM 273 C MET A 21 111.675 7.728 -4.258 1.00 0.00 C ATOM 274 O MET A 21 110.770 6.921 -4.469 1.00 0.00 O ATOM 275 CB MET A 21 111.075 9.861 -3.112 1.00 0.00 C ATOM 276 CG MET A 21 110.948 11.376 -3.289 1.00 0.00 C ATOM 277 SD MET A 21 110.747 12.167 -1.672 1.00 0.00 S ATOM 278 CE MET A 21 109.216 11.334 -1.186 1.00 0.00 C ATOM 0 H MET A 21 109.475 8.933 -5.191 1.00 0.00 H new ATOM 0 HA MET A 21 112.334 9.679 -4.851 1.00 0.00 H new ATOM 0 HB2 MET A 21 110.139 9.448 -2.735 1.00 0.00 H new ATOM 0 HB3 MET A 21 111.844 9.634 -2.374 1.00 0.00 H new ATOM 0 HG2 MET A 21 111.834 11.769 -3.789 1.00 0.00 H new ATOM 0 HG3 MET A 21 110.094 11.607 -3.926 1.00 0.00 H new ATOM 0 HE1 MET A 21 108.669 11.960 -0.481 1.00 0.00 H new ATOM 0 HE2 MET A 21 108.601 11.159 -2.069 1.00 0.00 H new ATOM 0 HE3 MET A 21 109.454 10.380 -0.715 1.00 0.00 H new ATOM 288 N GLY A 22 112.886 7.358 -3.838 1.00 0.00 N ATOM 289 CA GLY A 22 113.217 5.945 -3.659 1.00 0.00 C ATOM 290 C GLY A 22 113.755 5.691 -2.258 1.00 0.00 C ATOM 291 O GLY A 22 114.363 6.569 -1.658 1.00 0.00 O ATOM 0 H GLY A 22 113.643 8.006 -3.619 1.00 0.00 H new ATOM 0 HA2 GLY A 22 112.330 5.334 -3.830 1.00 0.00 H new ATOM 0 HA3 GLY A 22 113.959 5.644 -4.399 1.00 0.00 H new ATOM 295 N GLY A 23 113.516 4.494 -1.738 1.00 0.00 N ATOM 296 CA GLY A 23 114.017 4.136 -0.416 1.00 0.00 C ATOM 297 C GLY A 23 114.485 2.686 -0.380 1.00 0.00 C ATOM 298 O GLY A 23 113.885 1.821 -1.012 1.00 0.00 O ATOM 0 H GLY A 23 112.984 3.760 -2.206 1.00 0.00 H new ATOM 0 HA2 GLY A 23 114.843 4.795 -0.146 1.00 0.00 H new ATOM 0 HA3 GLY A 23 113.233 4.287 0.326 1.00 0.00 H new ATOM 302 N PHE A 24 115.561 2.429 0.358 1.00 0.00 N ATOM 303 CA PHE A 24 116.080 1.071 0.506 1.00 0.00 C ATOM 304 C PHE A 24 115.893 0.617 1.947 1.00 0.00 C ATOM 305 O PHE A 24 116.099 1.409 2.867 1.00 0.00 O ATOM 306 CB PHE A 24 117.561 1.025 0.132 1.00 0.00 C ATOM 307 CG PHE A 24 118.152 -0.365 0.182 1.00 0.00 C ATOM 308 CD1 PHE A 24 118.044 -1.212 -0.927 1.00 0.00 C ATOM 309 CD2 PHE A 24 118.807 -0.804 1.338 1.00 0.00 C ATOM 310 CE1 PHE A 24 118.590 -2.500 -0.879 1.00 0.00 C ATOM 311 CE2 PHE A 24 119.354 -2.092 1.386 1.00 0.00 C ATOM 312 CZ PHE A 24 119.247 -2.940 0.278 1.00 0.00 C ATOM 0 H PHE A 24 116.090 3.141 0.862 1.00 0.00 H new ATOM 0 HA PHE A 24 115.534 0.403 -0.161 1.00 0.00 H new ATOM 0 HB2 PHE A 24 117.687 1.429 -0.873 1.00 0.00 H new ATOM 0 HB3 PHE A 24 118.119 1.673 0.808 1.00 0.00 H new ATOM 0 HD1 PHE A 24 117.540 -0.872 -1.819 1.00 0.00 H new ATOM 0 HD2 PHE A 24 118.891 -0.149 2.193 1.00 0.00 H new ATOM 0 HE1 PHE A 24 118.505 -3.155 -1.734 1.00 0.00 H new ATOM 0 HE2 PHE A 24 119.859 -2.431 2.279 1.00 0.00 H new ATOM 0 HZ PHE A 24 119.670 -3.933 0.314 1.00 0.00 H new ATOM 322 N ASN A 25 115.494 -0.642 2.145 1.00 0.00 N ATOM 323 CA ASN A 25 115.145 -1.120 3.484 1.00 0.00 C ATOM 324 C ASN A 25 115.831 -2.438 3.839 1.00 0.00 C ATOM 325 O ASN A 25 116.044 -3.290 2.975 1.00 0.00 O ATOM 326 CB ASN A 25 113.625 -1.297 3.581 1.00 0.00 C ATOM 327 CG ASN A 25 113.141 -2.409 2.650 1.00 0.00 C ATOM 328 OD1 ASN A 25 113.723 -2.627 1.587 1.00 0.00 O ATOM 329 ND2 ASN A 25 112.113 -3.135 2.993 1.00 0.00 N ATOM 0 H ASN A 25 115.405 -1.340 1.406 1.00 0.00 H new ATOM 0 HA ASN A 25 115.494 -0.371 4.195 1.00 0.00 H new ATOM 0 HB2 ASN A 25 113.348 -1.532 4.609 1.00 0.00 H new ATOM 0 HB3 ASN A 25 113.129 -0.361 3.323 1.00 0.00 H new ATOM 0 HD21 ASN A 25 111.791 -3.884 2.380 1.00 0.00 H new ATOM 0 HD22 ASN A 25 111.632 -2.954 3.874 1.00 0.00 H new ATOM 336 N LEU A 26 116.139 -2.585 5.127 1.00 0.00 N ATOM 337 CA LEU A 26 116.607 -3.855 5.677 1.00 0.00 C ATOM 338 C LEU A 26 115.582 -4.361 6.690 1.00 0.00 C ATOM 339 O LEU A 26 115.017 -3.562 7.438 1.00 0.00 O ATOM 340 CB LEU A 26 117.967 -3.670 6.360 1.00 0.00 C ATOM 341 CG LEU A 26 118.975 -3.087 5.365 1.00 0.00 C ATOM 342 CD1 LEU A 26 120.297 -2.813 6.084 1.00 0.00 C ATOM 343 CD2 LEU A 26 119.220 -4.089 4.232 1.00 0.00 C ATOM 0 H LEU A 26 116.072 -1.833 5.813 1.00 0.00 H new ATOM 0 HA LEU A 26 116.722 -4.580 4.871 1.00 0.00 H new ATOM 0 HB2 LEU A 26 117.865 -3.006 7.219 1.00 0.00 H new ATOM 0 HB3 LEU A 26 118.327 -4.627 6.738 1.00 0.00 H new ATOM 0 HG LEU A 26 118.578 -2.159 4.953 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.016 -2.398 5.378 1.00 0.00 H new ATOM 0 HD12 LEU A 26 120.131 -2.101 6.893 1.00 0.00 H new ATOM 0 HD13 LEU A 26 120.688 -3.744 6.495 1.00 0.00 H new ATOM 0 HD21 LEU A 26 119.938 -3.671 3.526 1.00 0.00 H new ATOM 0 HD22 LEU A 26 119.616 -5.016 4.646 1.00 0.00 H new ATOM 0 HD23 LEU A 26 118.281 -4.293 3.717 1.00 0.00 H new ATOM 355 N LYS A 27 115.355 -5.674 6.729 1.00 0.00 N ATOM 356 CA LYS A 27 114.259 -6.229 7.521 1.00 0.00 C ATOM 357 C LYS A 27 114.739 -7.366 8.417 1.00 0.00 C ATOM 358 O LYS A 27 115.584 -8.168 8.017 1.00 0.00 O ATOM 359 CB LYS A 27 113.193 -6.765 6.565 1.00 0.00 C ATOM 360 CG LYS A 27 111.935 -7.165 7.337 1.00 0.00 C ATOM 361 CD LYS A 27 111.161 -5.907 7.742 1.00 0.00 C ATOM 362 CE LYS A 27 109.822 -6.283 8.391 1.00 0.00 C ATOM 363 NZ LYS A 27 108.740 -6.201 7.370 1.00 0.00 N ATOM 0 H LYS A 27 115.910 -6.367 6.226 1.00 0.00 H new ATOM 0 HA LYS A 27 113.855 -5.442 8.158 1.00 0.00 H new ATOM 0 HB2 LYS A 27 112.946 -6.005 5.823 1.00 0.00 H new ATOM 0 HB3 LYS A 27 113.583 -7.626 6.022 1.00 0.00 H new ATOM 0 HG2 LYS A 27 111.307 -7.808 6.721 1.00 0.00 H new ATOM 0 HG3 LYS A 27 112.207 -7.739 8.223 1.00 0.00 H new ATOM 0 HD2 LYS A 27 111.756 -5.316 8.438 1.00 0.00 H new ATOM 0 HD3 LYS A 27 110.984 -5.284 6.865 1.00 0.00 H new ATOM 0 HE2 LYS A 27 109.874 -7.291 8.802 1.00 0.00 H new ATOM 0 HE3 LYS A 27 109.606 -5.611 9.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 107.862 -6.599 7.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 108.583 -5.206 7.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 109.018 -6.740 6.525 1.00 0.00 H new ATOM 377 N TYR A 28 114.198 -7.437 9.634 1.00 0.00 N ATOM 378 CA TYR A 28 114.491 -8.550 10.532 1.00 0.00 C ATOM 379 C TYR A 28 113.203 -9.073 11.159 1.00 0.00 C ATOM 380 O TYR A 28 112.272 -8.306 11.405 1.00 0.00 O ATOM 381 CB TYR A 28 115.479 -8.113 11.617 1.00 0.00 C ATOM 382 CG TYR A 28 114.916 -7.116 12.603 1.00 0.00 C ATOM 383 CD1 TYR A 28 114.987 -5.744 12.328 1.00 0.00 C ATOM 384 CD2 TYR A 28 114.328 -7.560 13.793 1.00 0.00 C ATOM 385 CE1 TYR A 28 114.471 -4.819 13.242 1.00 0.00 C ATOM 386 CE2 TYR A 28 113.810 -6.635 14.708 1.00 0.00 C ATOM 387 CZ TYR A 28 113.881 -5.264 14.431 1.00 0.00 C ATOM 388 OH TYR A 28 113.373 -4.351 15.333 1.00 0.00 O ATOM 0 H TYR A 28 113.559 -6.741 10.017 1.00 0.00 H new ATOM 0 HA TYR A 28 114.948 -9.355 9.956 1.00 0.00 H new ATOM 0 HB2 TYR A 28 115.816 -8.995 12.162 1.00 0.00 H new ATOM 0 HB3 TYR A 28 116.357 -7.678 11.139 1.00 0.00 H new ATOM 0 HD1 TYR A 28 115.440 -5.400 11.410 1.00 0.00 H new ATOM 0 HD2 TYR A 28 114.274 -8.617 14.006 1.00 0.00 H new ATOM 0 HE1 TYR A 28 114.528 -3.761 13.030 1.00 0.00 H new ATOM 0 HE2 TYR A 28 113.356 -6.978 15.626 1.00 0.00 H new ATOM 0 HH TYR A 28 112.998 -4.826 16.104 1.00 0.00 H new ATOM 398 N ARG A 29 113.164 -10.377 11.419 1.00 0.00 N ATOM 399 CA ARG A 29 111.956 -11.023 11.924 1.00 0.00 C ATOM 400 C ARG A 29 112.308 -12.132 12.911 1.00 0.00 C ATOM 401 O ARG A 29 113.316 -12.818 12.747 1.00 0.00 O ATOM 402 CB ARG A 29 111.163 -11.608 10.750 1.00 0.00 C ATOM 403 CG ARG A 29 109.846 -12.211 11.246 1.00 0.00 C ATOM 404 CD ARG A 29 109.093 -12.828 10.067 1.00 0.00 C ATOM 405 NE ARG A 29 107.776 -13.306 10.496 1.00 0.00 N ATOM 406 CZ ARG A 29 106.950 -14.011 9.708 1.00 0.00 C ATOM 407 NH1 ARG A 29 107.264 -14.331 8.474 1.00 0.00 N ATOM 408 NH2 ARG A 29 105.797 -14.393 10.182 1.00 0.00 N ATOM 0 H ARG A 29 113.955 -11.007 11.288 1.00 0.00 H new ATOM 0 HA ARG A 29 111.352 -10.279 12.443 1.00 0.00 H new ATOM 0 HB2 ARG A 29 110.960 -10.829 10.015 1.00 0.00 H new ATOM 0 HB3 ARG A 29 111.755 -12.373 10.248 1.00 0.00 H new ATOM 0 HG2 ARG A 29 110.043 -12.970 12.003 1.00 0.00 H new ATOM 0 HG3 ARG A 29 109.236 -11.441 11.718 1.00 0.00 H new ATOM 0 HD2 ARG A 29 108.978 -12.089 9.274 1.00 0.00 H new ATOM 0 HD3 ARG A 29 109.669 -13.655 9.652 1.00 0.00 H new ATOM 0 HE ARG A 29 107.471 -13.091 11.445 1.00 0.00 H new ATOM 0 HH11 ARG A 29 108.162 -14.042 8.085 1.00 0.00 H new ATOM 0 HH12 ARG A 29 106.610 -14.868 7.904 1.00 0.00 H new ATOM 0 HH21 ARG A 29 105.535 -14.155 11.139 1.00 0.00 H new ATOM 0 HH22 ARG A 29 105.157 -14.930 9.596 1.00 0.00 H new ATOM 422 N TYR A 30 111.481 -12.298 13.942 1.00 0.00 N ATOM 423 CA TYR A 30 111.664 -13.392 14.892 1.00 0.00 C ATOM 424 C TYR A 30 110.543 -14.411 14.726 1.00 0.00 C ATOM 425 O TYR A 30 109.389 -14.039 14.507 1.00 0.00 O ATOM 426 CB TYR A 30 111.663 -12.846 16.321 1.00 0.00 C ATOM 427 CG TYR A 30 112.819 -11.918 16.608 1.00 0.00 C ATOM 428 CD1 TYR A 30 114.030 -12.435 17.084 1.00 0.00 C ATOM 429 CD2 TYR A 30 112.682 -10.540 16.395 1.00 0.00 C ATOM 430 CE1 TYR A 30 115.102 -11.576 17.348 1.00 0.00 C ATOM 431 CE2 TYR A 30 113.756 -9.681 16.658 1.00 0.00 C ATOM 432 CZ TYR A 30 114.966 -10.198 17.137 1.00 0.00 C ATOM 433 OH TYR A 30 116.024 -9.352 17.397 1.00 0.00 O ATOM 0 H TYR A 30 110.684 -11.693 14.139 1.00 0.00 H new ATOM 0 HA TYR A 30 112.620 -13.878 14.698 1.00 0.00 H new ATOM 0 HB2 TYR A 30 110.728 -12.315 16.499 1.00 0.00 H new ATOM 0 HB3 TYR A 30 111.694 -13.681 17.021 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.136 -13.497 17.247 1.00 0.00 H new ATOM 0 HD2 TYR A 30 111.748 -10.140 16.028 1.00 0.00 H new ATOM 0 HE1 TYR A 30 116.036 -11.976 17.715 1.00 0.00 H new ATOM 0 HE2 TYR A 30 113.651 -8.619 16.491 1.00 0.00 H new ATOM 0 HH TYR A 30 115.762 -8.429 17.196 1.00 0.00 H new ATOM 443 N GLU A 31 110.882 -15.693 14.830 1.00 0.00 N ATOM 444 CA GLU A 31 109.890 -16.744 14.629 1.00 0.00 C ATOM 445 C GLU A 31 109.264 -17.151 15.958 1.00 0.00 C ATOM 446 O GLU A 31 109.960 -17.506 16.909 1.00 0.00 O ATOM 447 CB GLU A 31 110.546 -17.961 13.971 1.00 0.00 C ATOM 448 CG GLU A 31 109.474 -19.004 13.635 1.00 0.00 C ATOM 449 CD GLU A 31 108.559 -18.509 12.513 1.00 0.00 C ATOM 450 OE1 GLU A 31 108.992 -17.678 11.728 1.00 0.00 O ATOM 451 OE2 GLU A 31 107.432 -18.971 12.457 1.00 0.00 O ATOM 0 H GLU A 31 111.821 -16.026 15.049 1.00 0.00 H new ATOM 0 HA GLU A 31 109.105 -16.360 13.977 1.00 0.00 H new ATOM 0 HB2 GLU A 31 111.070 -17.658 13.064 1.00 0.00 H new ATOM 0 HB3 GLU A 31 111.290 -18.392 14.641 1.00 0.00 H new ATOM 0 HG2 GLU A 31 109.951 -19.937 13.335 1.00 0.00 H new ATOM 0 HG3 GLU A 31 108.881 -19.220 14.524 1.00 0.00 H new ATOM 458 N GLU A 32 107.937 -17.094 16.006 1.00 0.00 N ATOM 459 CA GLU A 32 107.202 -17.423 17.219 1.00 0.00 C ATOM 460 C GLU A 32 105.878 -18.105 16.883 1.00 0.00 C ATOM 461 O GLU A 32 105.315 -17.902 15.808 1.00 0.00 O ATOM 462 CB GLU A 32 106.959 -16.172 18.066 1.00 0.00 C ATOM 463 CG GLU A 32 108.311 -15.596 18.505 1.00 0.00 C ATOM 464 CD GLU A 32 108.149 -14.418 19.470 1.00 0.00 C ATOM 465 OE1 GLU A 32 107.031 -13.977 19.693 1.00 0.00 O ATOM 466 OE2 GLU A 32 109.161 -13.966 19.979 1.00 0.00 O ATOM 0 H GLU A 32 107.350 -16.823 15.218 1.00 0.00 H new ATOM 0 HA GLU A 32 107.808 -18.117 17.800 1.00 0.00 H new ATOM 0 HB2 GLU A 32 106.403 -15.431 17.492 1.00 0.00 H new ATOM 0 HB3 GLU A 32 106.354 -16.420 18.938 1.00 0.00 H new ATOM 0 HG2 GLU A 32 108.900 -16.378 18.984 1.00 0.00 H new ATOM 0 HG3 GLU A 32 108.868 -15.271 17.627 1.00 0.00 H new ATOM 473 N ASP A 33 105.396 -18.912 17.819 1.00 0.00 N ATOM 474 CA ASP A 33 104.205 -19.724 17.604 1.00 0.00 C ATOM 475 C ASP A 33 102.942 -18.867 17.648 1.00 0.00 C ATOM 476 O ASP A 33 103.007 -17.642 17.708 1.00 0.00 O ATOM 477 CB ASP A 33 104.118 -20.816 18.673 1.00 0.00 C ATOM 478 CG ASP A 33 105.307 -21.768 18.564 1.00 0.00 C ATOM 479 OD1 ASP A 33 105.787 -21.970 17.459 1.00 0.00 O ATOM 480 OD2 ASP A 33 105.721 -22.283 19.589 1.00 0.00 O ATOM 0 H ASP A 33 105.816 -19.022 18.742 1.00 0.00 H new ATOM 0 HA ASP A 33 104.280 -20.181 16.617 1.00 0.00 H new ATOM 0 HB2 ASP A 33 104.098 -20.362 19.664 1.00 0.00 H new ATOM 0 HB3 ASP A 33 103.188 -21.372 18.558 1.00 0.00 H new ATOM 485 N ASN A 34 101.797 -19.517 17.494 1.00 0.00 N ATOM 486 CA ASN A 34 100.523 -18.811 17.464 1.00 0.00 C ATOM 487 C ASN A 34 100.320 -17.905 18.682 1.00 0.00 C ATOM 488 O ASN A 34 99.721 -16.836 18.547 1.00 0.00 O ATOM 489 CB ASN A 34 99.377 -19.822 17.394 1.00 0.00 C ATOM 490 CG ASN A 34 99.491 -20.653 16.120 1.00 0.00 C ATOM 491 OD1 ASN A 34 99.365 -21.876 16.162 1.00 0.00 O ATOM 492 ND2 ASN A 34 99.720 -20.057 14.982 1.00 0.00 N ATOM 0 H ASN A 34 101.723 -20.529 17.388 1.00 0.00 H new ATOM 0 HA ASN A 34 100.531 -18.175 16.579 1.00 0.00 H new ATOM 0 HB2 ASN A 34 99.403 -20.474 18.267 1.00 0.00 H new ATOM 0 HB3 ASN A 34 98.420 -19.301 17.414 1.00 0.00 H new ATOM 0 HD21 ASN A 34 99.795 -20.605 14.125 1.00 0.00 H new ATOM 0 HD22 ASN A 34 99.824 -19.043 14.949 1.00 0.00 H new ATOM 499 N SER A 35 100.810 -18.309 19.860 1.00 0.00 N ATOM 500 CA SER A 35 100.463 -17.581 21.085 1.00 0.00 C ATOM 501 C SER A 35 101.430 -16.443 21.421 1.00 0.00 C ATOM 502 O SER A 35 101.036 -15.488 22.089 1.00 0.00 O ATOM 503 CB SER A 35 100.416 -18.560 22.258 1.00 0.00 C ATOM 504 OG SER A 35 99.458 -18.106 23.205 1.00 0.00 O ATOM 0 H SER A 35 101.428 -19.110 19.990 1.00 0.00 H new ATOM 0 HA SER A 35 99.489 -17.124 20.909 1.00 0.00 H new ATOM 0 HB2 SER A 35 100.153 -19.557 21.905 1.00 0.00 H new ATOM 0 HB3 SER A 35 101.398 -18.636 22.724 1.00 0.00 H new ATOM 0 HG SER A 35 99.422 -18.731 23.959 1.00 0.00 H new ATOM 510 N PRO A 36 102.668 -16.498 20.996 1.00 0.00 N ATOM 511 CA PRO A 36 103.525 -15.283 20.926 1.00 0.00 C ATOM 512 C PRO A 36 103.652 -14.766 19.491 1.00 0.00 C ATOM 513 O PRO A 36 104.015 -15.511 18.582 1.00 0.00 O ATOM 514 CB PRO A 36 104.878 -15.762 21.477 1.00 0.00 C ATOM 515 CG PRO A 36 104.800 -17.255 21.581 1.00 0.00 C ATOM 516 CD PRO A 36 103.510 -17.692 20.884 1.00 0.00 C ATOM 0 HA PRO A 36 103.114 -14.446 21.490 1.00 0.00 H new ATOM 0 HB2 PRO A 36 105.692 -15.463 20.817 1.00 0.00 H new ATOM 0 HB3 PRO A 36 105.078 -15.317 22.452 1.00 0.00 H new ATOM 0 HG2 PRO A 36 105.667 -17.719 21.111 1.00 0.00 H new ATOM 0 HG3 PRO A 36 104.798 -17.568 22.625 1.00 0.00 H new ATOM 0 HD2 PRO A 36 103.685 -17.969 19.844 1.00 0.00 H new ATOM 0 HD3 PRO A 36 103.057 -18.555 21.372 1.00 0.00 H new ATOM 524 N LEU A 37 103.357 -13.484 19.304 1.00 0.00 N ATOM 525 CA LEU A 37 103.339 -12.889 17.968 1.00 0.00 C ATOM 526 C LEU A 37 104.755 -12.648 17.453 1.00 0.00 C ATOM 527 O LEU A 37 105.684 -12.446 18.233 1.00 0.00 O ATOM 528 CB LEU A 37 102.578 -11.561 17.996 1.00 0.00 C ATOM 529 CG LEU A 37 101.158 -11.780 18.528 1.00 0.00 C ATOM 530 CD1 LEU A 37 100.448 -10.430 18.653 1.00 0.00 C ATOM 531 CD2 LEU A 37 100.379 -12.673 17.557 1.00 0.00 C ATOM 0 H LEU A 37 103.127 -12.836 20.058 1.00 0.00 H new ATOM 0 HA LEU A 37 102.839 -13.587 17.297 1.00 0.00 H new ATOM 0 HB2 LEU A 37 103.104 -10.844 18.626 1.00 0.00 H new ATOM 0 HB3 LEU A 37 102.538 -11.135 16.994 1.00 0.00 H new ATOM 0 HG LEU A 37 101.208 -12.260 19.505 1.00 0.00 H new ATOM 0 HD11 LEU A 37 99.437 -10.584 19.031 1.00 0.00 H new ATOM 0 HD12 LEU A 37 101.000 -9.791 19.342 1.00 0.00 H new ATOM 0 HD13 LEU A 37 100.400 -9.952 17.675 1.00 0.00 H new ATOM 0 HD21 LEU A 37 99.369 -12.828 17.936 1.00 0.00 H new ATOM 0 HD22 LEU A 37 100.330 -12.192 16.580 1.00 0.00 H new ATOM 0 HD23 LEU A 37 100.883 -13.635 17.463 1.00 0.00 H new ATOM 543 N GLY A 38 104.907 -12.643 16.132 1.00 0.00 N ATOM 544 CA GLY A 38 106.225 -12.475 15.524 1.00 0.00 C ATOM 545 C GLY A 38 106.625 -11.005 15.530 1.00 0.00 C ATOM 546 O GLY A 38 105.791 -10.139 15.274 1.00 0.00 O ATOM 0 H GLY A 38 104.142 -12.752 15.466 1.00 0.00 H new ATOM 0 HA2 GLY A 38 106.963 -13.062 16.071 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.212 -12.852 14.501 1.00 0.00 H new ATOM 550 N VAL A 39 107.896 -10.719 15.805 1.00 0.00 N ATOM 551 CA VAL A 39 108.347 -9.330 15.892 1.00 0.00 C ATOM 552 C VAL A 39 109.122 -8.962 14.633 1.00 0.00 C ATOM 553 O VAL A 39 110.091 -9.631 14.274 1.00 0.00 O ATOM 554 CB VAL A 39 109.236 -9.137 17.128 1.00 0.00 C ATOM 555 CG1 VAL A 39 109.628 -7.663 17.261 1.00 0.00 C ATOM 556 CG2 VAL A 39 108.474 -9.564 18.385 1.00 0.00 C ATOM 0 H VAL A 39 108.622 -11.417 15.969 1.00 0.00 H new ATOM 0 HA VAL A 39 107.477 -8.680 15.982 1.00 0.00 H new ATOM 0 HB VAL A 39 110.133 -9.746 17.016 1.00 0.00 H new ATOM 0 HG11 VAL A 39 110.259 -7.532 18.140 1.00 0.00 H new ATOM 0 HG12 VAL A 39 110.175 -7.350 16.372 1.00 0.00 H new ATOM 0 HG13 VAL A 39 108.729 -7.055 17.366 1.00 0.00 H new ATOM 0 HG21 VAL A 39 109.109 -9.425 19.260 1.00 0.00 H new ATOM 0 HG22 VAL A 39 107.575 -8.957 18.489 1.00 0.00 H new ATOM 0 HG23 VAL A 39 108.195 -10.614 18.302 1.00 0.00 H new ATOM 566 N ILE A 40 108.696 -7.893 13.963 1.00 0.00 N ATOM 567 CA ILE A 40 109.367 -7.445 12.747 1.00 0.00 C ATOM 568 C ILE A 40 109.770 -5.984 12.876 1.00 0.00 C ATOM 569 O ILE A 40 109.077 -5.204 13.527 1.00 0.00 O ATOM 570 CB ILE A 40 108.436 -7.618 11.544 1.00 0.00 C ATOM 571 CG1 ILE A 40 107.136 -6.838 11.770 1.00 0.00 C ATOM 572 CG2 ILE A 40 108.111 -9.100 11.357 1.00 0.00 C ATOM 573 CD1 ILE A 40 106.368 -6.739 10.453 1.00 0.00 C ATOM 0 H ILE A 40 107.895 -7.325 14.240 1.00 0.00 H new ATOM 0 HA ILE A 40 110.263 -8.048 12.599 1.00 0.00 H new ATOM 0 HB ILE A 40 108.934 -7.236 10.653 1.00 0.00 H new ATOM 0 HG12 ILE A 40 106.526 -7.337 12.523 1.00 0.00 H new ATOM 0 HG13 ILE A 40 107.359 -5.841 12.150 1.00 0.00 H new ATOM 0 HG21 ILE A 40 107.448 -9.222 10.500 1.00 0.00 H new ATOM 0 HG22 ILE A 40 109.033 -9.656 11.185 1.00 0.00 H new ATOM 0 HG23 ILE A 40 107.620 -9.481 12.253 1.00 0.00 H new ATOM 0 HD11 ILE A 40 105.443 -6.185 10.612 1.00 0.00 H new ATOM 0 HD12 ILE A 40 106.979 -6.221 9.714 1.00 0.00 H new ATOM 0 HD13 ILE A 40 106.133 -7.741 10.093 1.00 0.00 H new ATOM 585 N GLY A 41 110.883 -5.624 12.247 1.00 0.00 N ATOM 586 CA GLY A 41 111.329 -4.238 12.251 1.00 0.00 C ATOM 587 C GLY A 41 112.105 -3.931 10.979 1.00 0.00 C ATOM 588 O GLY A 41 112.779 -4.806 10.438 1.00 0.00 O ATOM 0 H GLY A 41 111.487 -6.266 11.733 1.00 0.00 H new ATOM 0 HA2 GLY A 41 110.470 -3.572 12.331 1.00 0.00 H new ATOM 0 HA3 GLY A 41 111.957 -4.053 13.122 1.00 0.00 H new ATOM 592 N SER A 42 112.005 -2.693 10.503 1.00 0.00 N ATOM 593 CA SER A 42 112.686 -2.312 9.272 1.00 0.00 C ATOM 594 C SER A 42 113.240 -0.898 9.374 1.00 0.00 C ATOM 595 O SER A 42 112.644 -0.033 10.017 1.00 0.00 O ATOM 596 CB SER A 42 111.716 -2.390 8.093 1.00 0.00 C ATOM 597 OG SER A 42 110.826 -1.284 8.142 1.00 0.00 O ATOM 0 H SER A 42 111.467 -1.947 10.944 1.00 0.00 H new ATOM 0 HA SER A 42 113.514 -3.004 9.115 1.00 0.00 H new ATOM 0 HB2 SER A 42 112.268 -2.386 7.153 1.00 0.00 H new ATOM 0 HB3 SER A 42 111.156 -3.324 8.130 1.00 0.00 H new ATOM 0 HG SER A 42 110.213 -1.391 8.899 1.00 0.00 H new ATOM 603 N PHE A 43 114.381 -0.681 8.731 1.00 0.00 N ATOM 604 CA PHE A 43 114.988 0.645 8.667 1.00 0.00 C ATOM 605 C PHE A 43 115.105 1.066 7.209 1.00 0.00 C ATOM 606 O PHE A 43 115.636 0.312 6.396 1.00 0.00 O ATOM 607 CB PHE A 43 116.376 0.615 9.309 1.00 0.00 C ATOM 608 CG PHE A 43 116.356 0.239 10.772 1.00 0.00 C ATOM 609 CD1 PHE A 43 116.460 -1.105 11.150 1.00 0.00 C ATOM 610 CD2 PHE A 43 116.236 1.234 11.749 1.00 0.00 C ATOM 611 CE1 PHE A 43 116.442 -1.453 12.507 1.00 0.00 C ATOM 612 CE2 PHE A 43 116.218 0.886 13.105 1.00 0.00 C ATOM 613 CZ PHE A 43 116.320 -0.457 13.484 1.00 0.00 C ATOM 0 H PHE A 43 114.907 -1.408 8.245 1.00 0.00 H new ATOM 0 HA PHE A 43 114.366 1.358 9.208 1.00 0.00 H new ATOM 0 HB2 PHE A 43 117.002 -0.095 8.768 1.00 0.00 H new ATOM 0 HB3 PHE A 43 116.839 1.596 9.201 1.00 0.00 H new ATOM 0 HD1 PHE A 43 116.554 -1.873 10.396 1.00 0.00 H new ATOM 0 HD2 PHE A 43 116.157 2.271 11.457 1.00 0.00 H new ATOM 0 HE1 PHE A 43 116.522 -2.489 12.800 1.00 0.00 H new ATOM 0 HE2 PHE A 43 116.125 1.654 13.858 1.00 0.00 H new ATOM 0 HZ PHE A 43 116.305 -0.726 14.530 1.00 0.00 H new ATOM 623 N THR A 44 114.599 2.253 6.876 1.00 0.00 N ATOM 624 CA THR A 44 114.613 2.714 5.487 1.00 0.00 C ATOM 625 C THR A 44 115.209 4.114 5.376 1.00 0.00 C ATOM 626 O THR A 44 114.981 4.960 6.238 1.00 0.00 O ATOM 627 CB THR A 44 113.186 2.739 4.918 1.00 0.00 C ATOM 628 OG1 THR A 44 112.445 3.762 5.567 1.00 0.00 O ATOM 629 CG2 THR A 44 112.479 1.392 5.129 1.00 0.00 C ATOM 0 H THR A 44 114.180 2.906 7.538 1.00 0.00 H new ATOM 0 HA THR A 44 115.229 2.018 4.918 1.00 0.00 H new ATOM 0 HB THR A 44 113.245 2.931 3.847 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.534 3.784 5.207 1.00 0.00 H new ATOM 0 HG21 THR A 44 111.472 1.441 4.716 1.00 0.00 H new ATOM 0 HG22 THR A 44 113.039 0.604 4.626 1.00 0.00 H new ATOM 0 HG23 THR A 44 112.424 1.173 6.195 1.00 0.00 H new ATOM 637 N TYR A 45 115.958 4.347 4.299 1.00 0.00 N ATOM 638 CA TYR A 45 116.506 5.673 4.012 1.00 0.00 C ATOM 639 C TYR A 45 116.135 6.092 2.593 1.00 0.00 C ATOM 640 O TYR A 45 116.194 5.275 1.674 1.00 0.00 O ATOM 641 CB TYR A 45 118.026 5.687 4.196 1.00 0.00 C ATOM 642 CG TYR A 45 118.786 4.865 3.184 1.00 0.00 C ATOM 643 CD1 TYR A 45 119.057 3.517 3.441 1.00 0.00 C ATOM 644 CD2 TYR A 45 119.226 5.453 1.992 1.00 0.00 C ATOM 645 CE1 TYR A 45 119.772 2.755 2.508 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.938 4.692 1.058 1.00 0.00 C ATOM 647 CZ TYR A 45 120.211 3.343 1.316 1.00 0.00 C ATOM 648 OH TYR A 45 120.915 2.593 0.396 1.00 0.00 O ATOM 0 H TYR A 45 116.200 3.635 3.610 1.00 0.00 H new ATOM 0 HA TYR A 45 116.076 6.386 4.715 1.00 0.00 H new ATOM 0 HB2 TYR A 45 118.376 6.718 4.145 1.00 0.00 H new ATOM 0 HB3 TYR A 45 118.262 5.320 5.195 1.00 0.00 H new ATOM 0 HD1 TYR A 45 118.715 3.063 4.359 1.00 0.00 H new ATOM 0 HD2 TYR A 45 119.016 6.494 1.793 1.00 0.00 H new ATOM 0 HE1 TYR A 45 119.984 1.715 2.708 1.00 0.00 H new ATOM 0 HE2 TYR A 45 120.277 5.145 0.138 1.00 0.00 H new ATOM 0 HH TYR A 45 121.144 3.152 -0.376 1.00 0.00 H new ATOM 658 N THR A 46 115.736 7.353 2.415 1.00 0.00 N ATOM 659 CA THR A 46 115.252 7.806 1.116 1.00 0.00 C ATOM 660 C THR A 46 116.351 8.517 0.333 1.00 0.00 C ATOM 661 O THR A 46 117.221 9.171 0.909 1.00 0.00 O ATOM 662 CB THR A 46 114.069 8.753 1.313 1.00 0.00 C ATOM 663 OG1 THR A 46 113.161 8.172 2.238 1.00 0.00 O ATOM 664 CG2 THR A 46 113.362 8.980 -0.024 1.00 0.00 C ATOM 0 H THR A 46 115.739 8.067 3.144 1.00 0.00 H new ATOM 0 HA THR A 46 114.938 6.932 0.545 1.00 0.00 H new ATOM 0 HB THR A 46 114.425 9.710 1.695 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.596 8.873 2.625 1.00 0.00 H new ATOM 0 HG21 THR A 46 112.519 9.656 0.120 1.00 0.00 H new ATOM 0 HG22 THR A 46 114.061 9.419 -0.735 1.00 0.00 H new ATOM 0 HG23 THR A 46 113.001 8.027 -0.411 1.00 0.00 H new ATOM 672 N GLU A 47 116.299 8.378 -0.988 1.00 0.00 N ATOM 673 CA GLU A 47 117.329 8.922 -1.863 1.00 0.00 C ATOM 674 C GLU A 47 116.685 9.729 -2.985 1.00 0.00 C ATOM 675 O GLU A 47 115.574 9.417 -3.424 1.00 0.00 O ATOM 676 CB GLU A 47 118.164 7.782 -2.450 1.00 0.00 C ATOM 677 CG GLU A 47 119.378 8.351 -3.197 1.00 0.00 C ATOM 678 CD GLU A 47 120.206 7.249 -3.868 1.00 0.00 C ATOM 679 OE1 GLU A 47 119.836 6.086 -3.786 1.00 0.00 O ATOM 680 OE2 GLU A 47 121.214 7.590 -4.463 1.00 0.00 O ATOM 0 H GLU A 47 115.549 7.890 -1.477 1.00 0.00 H new ATOM 0 HA GLU A 47 117.979 9.578 -1.285 1.00 0.00 H new ATOM 0 HB2 GLU A 47 118.496 7.116 -1.654 1.00 0.00 H new ATOM 0 HB3 GLU A 47 117.555 7.187 -3.130 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.040 9.061 -3.952 1.00 0.00 H new ATOM 0 HG3 GLU A 47 120.007 8.903 -2.499 1.00 0.00 H new ATOM 897 N TYR A 62 114.498 11.359 4.039 1.00 0.00 N ATOM 898 CA TYR A 62 113.894 10.945 5.302 1.00 0.00 C ATOM 899 C TYR A 62 114.269 9.519 5.679 1.00 0.00 C ATOM 900 O TYR A 62 114.595 8.692 4.829 1.00 0.00 O ATOM 901 CB TYR A 62 112.371 11.095 5.241 1.00 0.00 C ATOM 902 CG TYR A 62 111.683 10.116 4.321 1.00 0.00 C ATOM 903 CD1 TYR A 62 111.325 8.845 4.788 1.00 0.00 C ATOM 904 CD2 TYR A 62 111.385 10.487 3.003 1.00 0.00 C ATOM 905 CE1 TYR A 62 110.670 7.945 3.939 1.00 0.00 C ATOM 906 CE2 TYR A 62 110.731 9.586 2.153 1.00 0.00 C ATOM 907 CZ TYR A 62 110.374 8.316 2.621 1.00 0.00 C ATOM 908 OH TYR A 62 109.729 7.429 1.783 1.00 0.00 O ATOM 0 HA TYR A 62 114.289 11.601 6.078 1.00 0.00 H new ATOM 0 HB2 TYR A 62 111.966 10.976 6.246 1.00 0.00 H new ATOM 0 HB3 TYR A 62 112.131 12.108 4.918 1.00 0.00 H new ATOM 0 HD1 TYR A 62 111.554 8.559 5.804 1.00 0.00 H new ATOM 0 HD2 TYR A 62 111.660 11.467 2.643 1.00 0.00 H new ATOM 0 HE1 TYR A 62 110.393 6.965 4.300 1.00 0.00 H new ATOM 0 HE2 TYR A 62 110.502 9.871 1.137 1.00 0.00 H new ATOM 0 HH TYR A 62 109.599 7.844 0.905 1.00 0.00 H new ATOM 918 N TYR A 63 114.210 9.255 6.980 1.00 0.00 N ATOM 919 CA TYR A 63 114.523 7.939 7.519 1.00 0.00 C ATOM 920 C TYR A 63 113.355 7.458 8.367 1.00 0.00 C ATOM 921 O TYR A 63 112.751 8.246 9.093 1.00 0.00 O ATOM 922 CB TYR A 63 115.789 8.007 8.376 1.00 0.00 C ATOM 923 CG TYR A 63 116.992 8.533 7.629 1.00 0.00 C ATOM 924 CD1 TYR A 63 117.263 9.907 7.616 1.00 0.00 C ATOM 925 CD2 TYR A 63 117.836 7.647 6.950 1.00 0.00 C ATOM 926 CE1 TYR A 63 118.379 10.394 6.925 1.00 0.00 C ATOM 927 CE2 TYR A 63 118.952 8.135 6.258 1.00 0.00 C ATOM 928 CZ TYR A 63 119.223 9.508 6.246 1.00 0.00 C ATOM 929 OH TYR A 63 120.322 9.988 5.564 1.00 0.00 O ATOM 0 H TYR A 63 113.946 9.943 7.685 1.00 0.00 H new ATOM 0 HA TYR A 63 114.694 7.244 6.697 1.00 0.00 H new ATOM 0 HB2 TYR A 63 115.600 8.644 9.240 1.00 0.00 H new ATOM 0 HB3 TYR A 63 116.014 7.011 8.757 1.00 0.00 H new ATOM 0 HD1 TYR A 63 116.611 10.591 8.139 1.00 0.00 H new ATOM 0 HD2 TYR A 63 117.627 6.587 6.959 1.00 0.00 H new ATOM 0 HE1 TYR A 63 118.589 11.453 6.916 1.00 0.00 H new ATOM 0 HE2 TYR A 63 119.603 7.452 5.734 1.00 0.00 H new ATOM 0 HH TYR A 63 120.802 9.241 5.149 1.00 0.00 H new ATOM 939 N GLY A 64 113.028 6.174 8.272 1.00 0.00 N ATOM 940 CA GLY A 64 111.875 5.636 8.988 1.00 0.00 C ATOM 941 C GLY A 64 112.235 4.363 9.741 1.00 0.00 C ATOM 942 O GLY A 64 112.954 3.509 9.224 1.00 0.00 O ATOM 0 H GLY A 64 113.539 5.491 7.712 1.00 0.00 H new ATOM 0 HA2 GLY A 64 111.499 6.382 9.689 1.00 0.00 H new ATOM 0 HA3 GLY A 64 111.071 5.428 8.282 1.00 0.00 H new ATOM 946 N ILE A 65 111.739 4.259 10.971 1.00 0.00 N ATOM 947 CA ILE A 65 111.914 3.048 11.768 1.00 0.00 C ATOM 948 C ILE A 65 110.540 2.501 12.127 1.00 0.00 C ATOM 949 O ILE A 65 109.756 3.186 12.783 1.00 0.00 O ATOM 950 CB ILE A 65 112.696 3.362 13.049 1.00 0.00 C ATOM 951 CG1 ILE A 65 114.041 4.003 12.693 1.00 0.00 C ATOM 952 CG2 ILE A 65 112.945 2.068 13.827 1.00 0.00 C ATOM 953 CD1 ILE A 65 114.744 4.461 13.972 1.00 0.00 C ATOM 0 H ILE A 65 111.213 4.998 11.437 1.00 0.00 H new ATOM 0 HA ILE A 65 112.474 2.310 11.193 1.00 0.00 H new ATOM 0 HB ILE A 65 112.116 4.053 13.661 1.00 0.00 H new ATOM 0 HG12 ILE A 65 114.666 3.288 12.158 1.00 0.00 H new ATOM 0 HG13 ILE A 65 113.886 4.852 12.027 1.00 0.00 H new ATOM 0 HG21 ILE A 65 113.501 2.292 14.737 1.00 0.00 H new ATOM 0 HG22 ILE A 65 111.990 1.611 14.088 1.00 0.00 H new ATOM 0 HG23 ILE A 65 113.521 1.378 13.211 1.00 0.00 H new ATOM 0 HD11 ILE A 65 115.701 4.917 13.718 1.00 0.00 H new ATOM 0 HD12 ILE A 65 114.120 5.190 14.489 1.00 0.00 H new ATOM 0 HD13 ILE A 65 114.912 3.602 14.622 1.00 0.00 H new ATOM 965 N THR A 66 110.234 1.288 11.670 1.00 0.00 N ATOM 966 CA THR A 66 108.904 0.714 11.889 1.00 0.00 C ATOM 967 C THR A 66 109.017 -0.625 12.611 1.00 0.00 C ATOM 968 O THR A 66 110.003 -1.340 12.442 1.00 0.00 O ATOM 969 CB THR A 66 108.166 0.505 10.554 1.00 0.00 C ATOM 970 OG1 THR A 66 108.721 -0.621 9.889 1.00 0.00 O ATOM 971 CG2 THR A 66 108.264 1.732 9.631 1.00 0.00 C ATOM 0 H THR A 66 110.878 0.689 11.153 1.00 0.00 H new ATOM 0 HA THR A 66 108.337 1.415 12.502 1.00 0.00 H new ATOM 0 HB THR A 66 107.112 0.346 10.781 1.00 0.00 H new ATOM 0 HG1 THR A 66 108.255 -0.761 9.038 1.00 0.00 H new ATOM 0 HG21 THR A 66 107.727 1.533 8.703 1.00 0.00 H new ATOM 0 HG22 THR A 66 107.823 2.597 10.127 1.00 0.00 H new ATOM 0 HG23 THR A 66 109.311 1.937 9.408 1.00 0.00 H new ATOM 979 N ALA A 67 107.998 -0.959 13.398 1.00 0.00 N ATOM 980 CA ALA A 67 107.949 -2.243 14.093 1.00 0.00 C ATOM 981 C ALA A 67 106.499 -2.702 14.179 1.00 0.00 C ATOM 982 O ALA A 67 105.600 -1.859 14.221 1.00 0.00 O ATOM 983 CB ALA A 67 108.535 -2.107 15.499 1.00 0.00 C ATOM 0 H ALA A 67 107.193 -0.357 13.571 1.00 0.00 H new ATOM 0 HA ALA A 67 108.538 -2.977 13.543 1.00 0.00 H new ATOM 0 HB1 ALA A 67 108.492 -3.071 16.006 1.00 0.00 H new ATOM 0 HB2 ALA A 67 109.572 -1.779 15.431 1.00 0.00 H new ATOM 0 HB3 ALA A 67 107.959 -1.374 16.064 1.00 0.00 H new ATOM 989 N GLY A 68 106.260 -4.015 14.174 1.00 0.00 N ATOM 990 CA GLY A 68 104.883 -4.504 14.204 1.00 0.00 C ATOM 991 C GLY A 68 104.784 -5.995 14.523 1.00 0.00 C ATOM 992 O GLY A 68 105.804 -6.684 14.579 1.00 0.00 O ATOM 0 H GLY A 68 106.979 -4.739 14.150 1.00 0.00 H new ATOM 0 HA2 GLY A 68 104.320 -3.941 14.948 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.415 -4.313 13.238 1.00 0.00 H new ATOM 996 N PRO A 69 103.591 -6.505 14.754 1.00 0.00 N ATOM 997 CA PRO A 69 103.374 -7.954 14.992 1.00 0.00 C ATOM 998 C PRO A 69 102.920 -8.697 13.733 1.00 0.00 C ATOM 999 O PRO A 69 102.013 -8.249 13.023 1.00 0.00 O ATOM 1000 CB PRO A 69 102.274 -7.962 16.057 1.00 0.00 C ATOM 1001 CG PRO A 69 101.552 -6.654 15.930 1.00 0.00 C ATOM 1002 CD PRO A 69 102.302 -5.808 14.896 1.00 0.00 C ATOM 0 HA PRO A 69 104.288 -8.465 15.294 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.592 -8.798 15.905 1.00 0.00 H new ATOM 0 HB3 PRO A 69 102.700 -8.075 17.054 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.520 -6.815 15.617 1.00 0.00 H new ATOM 0 HG3 PRO A 69 101.517 -6.141 16.891 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.764 -5.761 13.949 1.00 0.00 H new ATOM 0 HD3 PRO A 69 102.436 -4.782 15.238 1.00 0.00 H new ATOM 1010 N ALA A 70 103.644 -9.764 13.413 1.00 0.00 N ATOM 1011 CA ALA A 70 103.244 -10.697 12.364 1.00 0.00 C ATOM 1012 C ALA A 70 102.196 -11.677 12.889 1.00 0.00 C ATOM 1013 O ALA A 70 102.330 -12.188 14.002 1.00 0.00 O ATOM 1014 CB ALA A 70 104.463 -11.472 11.860 1.00 0.00 C ATOM 0 H ALA A 70 104.522 -10.007 13.871 1.00 0.00 H new ATOM 0 HA ALA A 70 102.812 -10.126 11.542 1.00 0.00 H new ATOM 0 HB1 ALA A 70 104.155 -12.166 11.078 1.00 0.00 H new ATOM 0 HB2 ALA A 70 105.197 -10.774 11.458 1.00 0.00 H new ATOM 0 HB3 ALA A 70 104.906 -12.029 12.685 1.00 0.00 H new ATOM 1020 N TYR A 71 101.197 -11.969 12.060 1.00 0.00 N ATOM 1021 CA TYR A 71 100.137 -12.903 12.422 1.00 0.00 C ATOM 1022 C TYR A 71 99.943 -13.906 11.292 1.00 0.00 C ATOM 1023 O TYR A 71 100.345 -13.644 10.157 1.00 0.00 O ATOM 1024 CB TYR A 71 98.822 -12.155 12.655 1.00 0.00 C ATOM 1025 CG TYR A 71 98.890 -11.118 13.750 1.00 0.00 C ATOM 1026 CD1 TYR A 71 99.255 -9.802 13.445 1.00 0.00 C ATOM 1027 CD2 TYR A 71 98.584 -11.471 15.071 1.00 0.00 C ATOM 1028 CE1 TYR A 71 99.311 -8.838 14.460 1.00 0.00 C ATOM 1029 CE2 TYR A 71 98.641 -10.507 16.084 1.00 0.00 C ATOM 1030 CZ TYR A 71 99.005 -9.191 15.779 1.00 0.00 C ATOM 1031 OH TYR A 71 99.060 -8.241 16.778 1.00 0.00 O ATOM 0 H TYR A 71 101.100 -11.568 11.127 1.00 0.00 H new ATOM 0 HA TYR A 71 100.421 -13.418 13.339 1.00 0.00 H new ATOM 0 HB2 TYR A 71 98.523 -11.669 11.726 1.00 0.00 H new ATOM 0 HB3 TYR A 71 98.044 -12.877 12.901 1.00 0.00 H new ATOM 0 HD1 TYR A 71 99.493 -9.530 12.427 1.00 0.00 H new ATOM 0 HD2 TYR A 71 98.304 -12.487 15.307 1.00 0.00 H new ATOM 0 HE1 TYR A 71 99.591 -7.822 14.224 1.00 0.00 H new ATOM 0 HE2 TYR A 71 98.404 -10.779 17.102 1.00 0.00 H new ATOM 0 HH TYR A 71 98.597 -8.576 17.574 1.00 0.00 H new ATOM 1144 N SER A 78 101.664 -15.137 5.298 1.00 0.00 N ATOM 1145 CA SER A 78 102.046 -14.116 6.269 1.00 0.00 C ATOM 1146 C SER A 78 101.156 -12.884 6.152 1.00 0.00 C ATOM 1147 O SER A 78 100.847 -12.439 5.047 1.00 0.00 O ATOM 1148 CB SER A 78 103.503 -13.707 6.061 1.00 0.00 C ATOM 1149 OG SER A 78 103.938 -12.943 7.178 1.00 0.00 O ATOM 0 HA SER A 78 101.923 -14.543 7.264 1.00 0.00 H new ATOM 0 HB2 SER A 78 104.129 -14.592 5.945 1.00 0.00 H new ATOM 0 HB3 SER A 78 103.602 -13.124 5.145 1.00 0.00 H new ATOM 0 HG SER A 78 104.873 -12.680 7.050 1.00 0.00 H new ATOM 1155 N ILE A 79 100.740 -12.333 7.290 1.00 0.00 N ATOM 1156 CA ILE A 79 100.102 -11.023 7.297 1.00 0.00 C ATOM 1157 C ILE A 79 100.628 -10.239 8.492 1.00 0.00 C ATOM 1158 O ILE A 79 100.653 -10.763 9.601 1.00 0.00 O ATOM 1159 CB ILE A 79 98.576 -11.166 7.365 1.00 0.00 C ATOM 1160 CG1 ILE A 79 97.927 -9.780 7.328 1.00 0.00 C ATOM 1161 CG2 ILE A 79 98.160 -11.886 8.651 1.00 0.00 C ATOM 1162 CD1 ILE A 79 96.438 -9.920 7.003 1.00 0.00 C ATOM 0 H ILE A 79 100.832 -12.768 8.208 1.00 0.00 H new ATOM 0 HA ILE A 79 100.338 -10.490 6.376 1.00 0.00 H new ATOM 0 HB ILE A 79 98.244 -11.753 6.509 1.00 0.00 H new ATOM 0 HG12 ILE A 79 98.055 -9.282 8.289 1.00 0.00 H new ATOM 0 HG13 ILE A 79 98.416 -9.158 6.579 1.00 0.00 H new ATOM 0 HG21 ILE A 79 97.074 -11.978 8.682 1.00 0.00 H new ATOM 0 HG22 ILE A 79 98.609 -12.879 8.674 1.00 0.00 H new ATOM 0 HG23 ILE A 79 98.500 -11.314 9.514 1.00 0.00 H new ATOM 0 HD11 ILE A 79 95.977 -8.933 6.977 1.00 0.00 H new ATOM 0 HD12 ILE A 79 96.321 -10.401 6.032 1.00 0.00 H new ATOM 0 HD13 ILE A 79 95.954 -10.526 7.769 1.00 0.00 H new ATOM 1174 N TYR A 80 101.074 -9.006 8.268 1.00 0.00 N ATOM 1175 CA TYR A 80 101.587 -8.195 9.370 1.00 0.00 C ATOM 1176 C TYR A 80 101.185 -6.733 9.233 1.00 0.00 C ATOM 1177 O TYR A 80 101.004 -6.228 8.124 1.00 0.00 O ATOM 1178 CB TYR A 80 103.113 -8.310 9.435 1.00 0.00 C ATOM 1179 CG TYR A 80 103.830 -7.677 8.262 1.00 0.00 C ATOM 1180 CD1 TYR A 80 104.137 -6.311 8.285 1.00 0.00 C ATOM 1181 CD2 TYR A 80 104.194 -8.457 7.160 1.00 0.00 C ATOM 1182 CE1 TYR A 80 104.809 -5.727 7.206 1.00 0.00 C ATOM 1183 CE2 TYR A 80 104.864 -7.872 6.079 1.00 0.00 C ATOM 1184 CZ TYR A 80 105.172 -6.507 6.103 1.00 0.00 C ATOM 1185 OH TYR A 80 105.834 -5.931 5.037 1.00 0.00 O ATOM 0 H TYR A 80 101.092 -8.553 7.354 1.00 0.00 H new ATOM 0 HA TYR A 80 101.148 -8.575 10.293 1.00 0.00 H new ATOM 0 HB2 TYR A 80 103.463 -7.844 10.356 1.00 0.00 H new ATOM 0 HB3 TYR A 80 103.385 -9.364 9.488 1.00 0.00 H new ATOM 0 HD1 TYR A 80 103.855 -5.708 9.136 1.00 0.00 H new ATOM 0 HD2 TYR A 80 103.958 -9.511 7.143 1.00 0.00 H new ATOM 0 HE1 TYR A 80 105.048 -4.674 7.225 1.00 0.00 H new ATOM 0 HE2 TYR A 80 105.143 -8.474 5.227 1.00 0.00 H new ATOM 0 HH TYR A 80 106.167 -6.634 4.441 1.00 0.00 H new ATOM 1195 N GLY A 81 101.090 -6.065 10.379 1.00 0.00 N ATOM 1196 CA GLY A 81 100.818 -4.631 10.414 1.00 0.00 C ATOM 1197 C GLY A 81 101.934 -3.927 11.174 1.00 0.00 C ATOM 1198 O GLY A 81 102.375 -4.415 12.214 1.00 0.00 O ATOM 0 H GLY A 81 101.198 -6.495 11.298 1.00 0.00 H new ATOM 0 HA2 GLY A 81 100.748 -4.237 9.400 1.00 0.00 H new ATOM 0 HA3 GLY A 81 99.859 -4.443 10.896 1.00 0.00 H new ATOM 1202 N VAL A 82 102.386 -2.781 10.669 1.00 0.00 N ATOM 1203 CA VAL A 82 103.571 -2.138 11.226 1.00 0.00 C ATOM 1204 C VAL A 82 103.374 -0.626 11.335 1.00 0.00 C ATOM 1205 O VAL A 82 102.745 -0.016 10.472 1.00 0.00 O ATOM 1206 CB VAL A 82 104.773 -2.499 10.338 1.00 0.00 C ATOM 1207 CG1 VAL A 82 104.649 -1.843 8.955 1.00 0.00 C ATOM 1208 CG2 VAL A 82 106.076 -2.066 11.014 1.00 0.00 C ATOM 0 H VAL A 82 101.957 -2.286 9.887 1.00 0.00 H new ATOM 0 HA VAL A 82 103.753 -2.496 12.239 1.00 0.00 H new ATOM 0 HB VAL A 82 104.786 -3.580 10.202 1.00 0.00 H new ATOM 0 HG11 VAL A 82 105.511 -2.113 8.345 1.00 0.00 H new ATOM 0 HG12 VAL A 82 103.737 -2.190 8.468 1.00 0.00 H new ATOM 0 HG13 VAL A 82 104.610 -0.760 9.068 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.921 -2.327 10.376 1.00 0.00 H new ATOM 0 HG22 VAL A 82 106.062 -0.988 11.175 1.00 0.00 H new ATOM 0 HG23 VAL A 82 106.175 -2.575 11.973 1.00 0.00 H new ATOM 1218 N VAL A 83 103.910 -0.032 12.400 1.00 0.00 N ATOM 1219 CA VAL A 83 103.828 1.413 12.593 1.00 0.00 C ATOM 1220 C VAL A 83 105.238 1.941 12.824 1.00 0.00 C ATOM 1221 O VAL A 83 106.033 1.285 13.497 1.00 0.00 O ATOM 1222 CB VAL A 83 102.945 1.744 13.804 1.00 0.00 C ATOM 1223 CG1 VAL A 83 102.829 3.264 13.963 1.00 0.00 C ATOM 1224 CG2 VAL A 83 101.542 1.163 13.609 1.00 0.00 C ATOM 0 H VAL A 83 104.405 -0.529 13.141 1.00 0.00 H new ATOM 0 HA VAL A 83 103.385 1.878 11.712 1.00 0.00 H new ATOM 0 HB VAL A 83 103.401 1.310 14.694 1.00 0.00 H new ATOM 0 HG11 VAL A 83 102.201 3.493 14.824 1.00 0.00 H new ATOM 0 HG12 VAL A 83 103.821 3.691 14.113 1.00 0.00 H new ATOM 0 HG13 VAL A 83 102.383 3.691 13.065 1.00 0.00 H new ATOM 0 HG21 VAL A 83 100.925 1.404 14.474 1.00 0.00 H new ATOM 0 HG22 VAL A 83 101.093 1.590 12.712 1.00 0.00 H new ATOM 0 HG23 VAL A 83 101.608 0.080 13.501 1.00 0.00 H new ATOM 1234 N GLY A 84 105.552 3.105 12.262 1.00 0.00 N ATOM 1235 CA GLY A 84 106.897 3.647 12.399 1.00 0.00 C ATOM 1236 C GLY A 84 106.884 5.165 12.447 1.00 0.00 C ATOM 1237 O GLY A 84 105.861 5.799 12.199 1.00 0.00 O ATOM 0 H GLY A 84 104.908 3.680 11.719 1.00 0.00 H new ATOM 0 HA2 GLY A 84 107.357 3.257 13.307 1.00 0.00 H new ATOM 0 HA3 GLY A 84 107.511 3.314 11.563 1.00 0.00 H new ATOM 1241 N VAL A 85 108.046 5.737 12.729 1.00 0.00 N ATOM 1242 CA VAL A 85 108.195 7.186 12.752 1.00 0.00 C ATOM 1243 C VAL A 85 109.147 7.592 11.638 1.00 0.00 C ATOM 1244 O VAL A 85 110.216 7.000 11.491 1.00 0.00 O ATOM 1245 CB VAL A 85 108.751 7.645 14.104 1.00 0.00 C ATOM 1246 CG1 VAL A 85 108.818 9.173 14.142 1.00 0.00 C ATOM 1247 CG2 VAL A 85 107.841 7.156 15.234 1.00 0.00 C ATOM 0 H VAL A 85 108.899 5.221 12.945 1.00 0.00 H new ATOM 0 HA VAL A 85 107.222 7.656 12.605 1.00 0.00 H new ATOM 0 HB VAL A 85 109.750 7.230 14.235 1.00 0.00 H new ATOM 0 HG11 VAL A 85 109.214 9.496 15.105 1.00 0.00 H new ATOM 0 HG12 VAL A 85 109.470 9.529 13.344 1.00 0.00 H new ATOM 0 HG13 VAL A 85 107.818 9.585 14.004 1.00 0.00 H new ATOM 0 HG21 VAL A 85 108.242 7.486 16.192 1.00 0.00 H new ATOM 0 HG22 VAL A 85 106.840 7.566 15.099 1.00 0.00 H new ATOM 0 HG23 VAL A 85 107.792 6.067 15.216 1.00 0.00 H new ATOM 1257 N GLY A 86 108.744 8.576 10.839 1.00 0.00 N ATOM 1258 CA GLY A 86 109.595 9.057 9.751 1.00 0.00 C ATOM 1259 C GLY A 86 109.980 10.515 9.971 1.00 0.00 C ATOM 1260 O GLY A 86 109.126 11.345 10.273 1.00 0.00 O ATOM 0 H GLY A 86 107.846 9.052 10.921 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.494 8.444 9.688 1.00 0.00 H new ATOM 0 HA3 GLY A 86 109.072 8.954 8.801 1.00 0.00 H new ATOM 1264 N TYR A 87 111.271 10.806 9.831 1.00 0.00 N ATOM 1265 CA TYR A 87 111.781 12.160 10.031 1.00 0.00 C ATOM 1266 C TYR A 87 112.381 12.689 8.734 1.00 0.00 C ATOM 1267 O TYR A 87 113.054 11.950 8.016 1.00 0.00 O ATOM 1268 CB TYR A 87 112.857 12.157 11.119 1.00 0.00 C ATOM 1269 CG TYR A 87 112.379 11.619 12.446 1.00 0.00 C ATOM 1270 CD1 TYR A 87 111.732 12.467 13.353 1.00 0.00 C ATOM 1271 CD2 TYR A 87 112.584 10.273 12.771 1.00 0.00 C ATOM 1272 CE1 TYR A 87 111.291 11.969 14.585 1.00 0.00 C ATOM 1273 CE2 TYR A 87 112.144 9.774 14.002 1.00 0.00 C ATOM 1274 CZ TYR A 87 111.497 10.622 14.910 1.00 0.00 C ATOM 1275 OH TYR A 87 111.063 10.132 16.125 1.00 0.00 O ATOM 0 H TYR A 87 111.984 10.121 9.579 1.00 0.00 H new ATOM 0 HA TYR A 87 110.955 12.802 10.337 1.00 0.00 H new ATOM 0 HB2 TYR A 87 113.703 11.560 10.779 1.00 0.00 H new ATOM 0 HB3 TYR A 87 113.221 13.175 11.260 1.00 0.00 H new ATOM 0 HD1 TYR A 87 111.573 13.505 13.102 1.00 0.00 H new ATOM 0 HD2 TYR A 87 113.082 9.619 12.071 1.00 0.00 H new ATOM 0 HE1 TYR A 87 110.792 12.623 15.285 1.00 0.00 H new ATOM 0 HE2 TYR A 87 112.303 8.735 14.252 1.00 0.00 H new ATOM 0 HH TYR A 87 111.283 9.179 16.191 1.00 0.00 H new ATOM 1285 N GLY A 88 112.142 13.965 8.448 1.00 0.00 N ATOM 1286 CA GLY A 88 112.639 14.577 7.218 1.00 0.00 C ATOM 1287 C GLY A 88 113.745 15.586 7.509 1.00 0.00 C ATOM 1288 O GLY A 88 113.767 16.213 8.568 1.00 0.00 O ATOM 0 H GLY A 88 111.609 14.595 9.048 1.00 0.00 H new ATOM 0 HA2 GLY A 88 113.017 13.802 6.551 1.00 0.00 H new ATOM 0 HA3 GLY A 88 111.819 15.073 6.699 1.00 0.00 H new ATOM 1540 N ASP A 104 111.035 17.584 11.018 1.00 0.00 N ATOM 1541 CA ASP A 104 109.630 17.291 11.275 1.00 0.00 C ATOM 1542 C ASP A 104 109.409 15.783 11.254 1.00 0.00 C ATOM 1543 O ASP A 104 110.188 15.052 10.647 1.00 0.00 O ATOM 1544 CB ASP A 104 108.746 17.971 10.222 1.00 0.00 C ATOM 1545 CG ASP A 104 109.114 17.530 8.802 1.00 0.00 C ATOM 1546 OD1 ASP A 104 109.781 16.519 8.648 1.00 0.00 O ATOM 1547 OD2 ASP A 104 108.718 18.223 7.878 1.00 0.00 O ATOM 0 HA ASP A 104 109.358 17.678 12.257 1.00 0.00 H new ATOM 0 HB2 ASP A 104 107.700 17.734 10.417 1.00 0.00 H new ATOM 0 HB3 ASP A 104 108.848 19.053 10.305 1.00 0.00 H new ATOM 1552 N TYR A 105 108.342 15.322 11.905 1.00 0.00 N ATOM 1553 CA TYR A 105 108.080 13.887 11.999 1.00 0.00 C ATOM 1554 C TYR A 105 106.626 13.560 11.670 1.00 0.00 C ATOM 1555 O TYR A 105 105.731 14.382 11.865 1.00 0.00 O ATOM 1556 CB TYR A 105 108.423 13.395 13.410 1.00 0.00 C ATOM 1557 CG TYR A 105 107.500 13.918 14.487 1.00 0.00 C ATOM 1558 CD1 TYR A 105 107.798 15.118 15.142 1.00 0.00 C ATOM 1559 CD2 TYR A 105 106.346 13.201 14.831 1.00 0.00 C ATOM 1560 CE1 TYR A 105 106.945 15.603 16.140 1.00 0.00 C ATOM 1561 CE2 TYR A 105 105.492 13.685 15.828 1.00 0.00 C ATOM 1562 CZ TYR A 105 105.792 14.887 16.484 1.00 0.00 C ATOM 1563 OH TYR A 105 104.950 15.364 17.467 1.00 0.00 O ATOM 0 H TYR A 105 107.653 15.913 12.370 1.00 0.00 H new ATOM 0 HA TYR A 105 108.708 13.377 11.268 1.00 0.00 H new ATOM 0 HB2 TYR A 105 108.395 12.305 13.420 1.00 0.00 H new ATOM 0 HB3 TYR A 105 109.445 13.690 13.648 1.00 0.00 H new ATOM 0 HD1 TYR A 105 108.687 15.671 14.877 1.00 0.00 H new ATOM 0 HD2 TYR A 105 106.116 12.274 14.326 1.00 0.00 H new ATOM 0 HE1 TYR A 105 107.176 16.529 16.645 1.00 0.00 H new ATOM 0 HE2 TYR A 105 104.602 13.133 16.092 1.00 0.00 H new ATOM 0 HH TYR A 105 104.197 14.747 17.581 1.00 0.00 H new ATOM 1573 N GLY A 106 106.405 12.350 11.166 1.00 0.00 N ATOM 1574 CA GLY A 106 105.056 11.879 10.874 1.00 0.00 C ATOM 1575 C GLY A 106 104.937 10.402 11.222 1.00 0.00 C ATOM 1576 O GLY A 106 105.946 9.724 11.407 1.00 0.00 O ATOM 0 H GLY A 106 107.142 11.678 10.951 1.00 0.00 H new ATOM 0 HA2 GLY A 106 104.328 12.456 11.445 1.00 0.00 H new ATOM 0 HA3 GLY A 106 104.828 12.033 9.819 1.00 0.00 H new ATOM 1580 N PHE A 107 103.708 9.896 11.286 1.00 0.00 N ATOM 1581 CA PHE A 107 103.491 8.493 11.627 1.00 0.00 C ATOM 1582 C PHE A 107 103.089 7.708 10.385 1.00 0.00 C ATOM 1583 O PHE A 107 102.134 8.069 9.695 1.00 0.00 O ATOM 1584 CB PHE A 107 102.391 8.378 12.686 1.00 0.00 C ATOM 1585 CG PHE A 107 102.774 8.988 14.013 1.00 0.00 C ATOM 1586 CD1 PHE A 107 103.413 8.206 14.983 1.00 0.00 C ATOM 1587 CD2 PHE A 107 102.492 10.334 14.274 1.00 0.00 C ATOM 1588 CE1 PHE A 107 103.769 8.771 16.214 1.00 0.00 C ATOM 1589 CE2 PHE A 107 102.848 10.899 15.503 1.00 0.00 C ATOM 1590 CZ PHE A 107 103.487 10.117 16.474 1.00 0.00 C ATOM 0 H PHE A 107 102.857 10.429 11.109 1.00 0.00 H new ATOM 0 HA PHE A 107 104.418 8.081 12.025 1.00 0.00 H new ATOM 0 HB2 PHE A 107 101.488 8.865 12.317 1.00 0.00 H new ATOM 0 HB3 PHE A 107 102.147 7.326 12.834 1.00 0.00 H new ATOM 0 HD1 PHE A 107 103.631 7.168 14.782 1.00 0.00 H new ATOM 0 HD2 PHE A 107 101.999 10.937 13.526 1.00 0.00 H new ATOM 0 HE1 PHE A 107 104.261 8.168 16.963 1.00 0.00 H new ATOM 0 HE2 PHE A 107 102.630 11.938 15.703 1.00 0.00 H new ATOM 0 HZ PHE A 107 103.762 10.553 17.423 1.00 0.00 H new ATOM 1600 N SER A 108 103.819 6.633 10.100 1.00 0.00 N ATOM 1601 CA SER A 108 103.513 5.807 8.932 1.00 0.00 C ATOM 1602 C SER A 108 102.898 4.477 9.353 1.00 0.00 C ATOM 1603 O SER A 108 103.273 3.909 10.378 1.00 0.00 O ATOM 1604 CB SER A 108 104.790 5.545 8.133 1.00 0.00 C ATOM 1605 OG SER A 108 105.629 4.666 8.869 1.00 0.00 O ATOM 0 H SER A 108 104.616 6.315 10.652 1.00 0.00 H new ATOM 0 HA SER A 108 102.794 6.344 8.313 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.545 5.108 7.165 1.00 0.00 H new ATOM 0 HB3 SER A 108 105.309 6.483 7.936 1.00 0.00 H new ATOM 0 HG SER A 108 106.032 4.013 8.260 1.00 0.00 H new ATOM 1611 N TYR A 109 101.959 3.987 8.546 1.00 0.00 N ATOM 1612 CA TYR A 109 101.310 2.705 8.807 1.00 0.00 C ATOM 1613 C TYR A 109 101.332 1.861 7.540 1.00 0.00 C ATOM 1614 O TYR A 109 101.079 2.383 6.456 1.00 0.00 O ATOM 1615 CB TYR A 109 99.861 2.934 9.245 1.00 0.00 C ATOM 1616 CG TYR A 109 99.092 1.656 9.492 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.121 1.050 10.753 1.00 0.00 C ATOM 1618 CD2 TYR A 109 98.351 1.078 8.455 1.00 0.00 C ATOM 1619 CE1 TYR A 109 98.407 -0.133 10.979 1.00 0.00 C ATOM 1620 CE2 TYR A 109 97.636 -0.106 8.680 1.00 0.00 C ATOM 1621 CZ TYR A 109 97.664 -0.711 9.942 1.00 0.00 C ATOM 1622 OH TYR A 109 96.962 -1.878 10.164 1.00 0.00 O ATOM 0 H TYR A 109 101.630 4.460 7.704 1.00 0.00 H new ATOM 0 HA TYR A 109 101.845 2.186 9.602 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.856 3.532 10.156 1.00 0.00 H new ATOM 0 HB3 TYR A 109 99.347 3.515 8.479 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.695 1.495 11.553 1.00 0.00 H new ATOM 0 HD2 TYR A 109 98.330 1.545 7.481 1.00 0.00 H new ATOM 0 HE1 TYR A 109 98.429 -0.600 11.953 1.00 0.00 H new ATOM 0 HE2 TYR A 109 97.064 -0.552 7.880 1.00 0.00 H new ATOM 0 HH TYR A 109 96.500 -2.143 9.341 1.00 0.00 H new ATOM 1632 N GLY A 110 101.643 0.572 7.668 1.00 0.00 N ATOM 1633 CA GLY A 110 101.730 -0.283 6.490 1.00 0.00 C ATOM 1634 C GLY A 110 101.318 -1.715 6.798 1.00 0.00 C ATOM 1635 O GLY A 110 101.210 -2.110 7.958 1.00 0.00 O ATOM 0 H GLY A 110 101.835 0.107 8.555 1.00 0.00 H new ATOM 0 HA2 GLY A 110 101.091 0.117 5.703 1.00 0.00 H new ATOM 0 HA3 GLY A 110 102.751 -0.273 6.108 1.00 0.00 H new ATOM 1639 N ALA A 111 101.105 -2.485 5.738 1.00 0.00 N ATOM 1640 CA ALA A 111 100.772 -3.897 5.871 1.00 0.00 C ATOM 1641 C ALA A 111 101.413 -4.677 4.730 1.00 0.00 C ATOM 1642 O ALA A 111 101.573 -4.149 3.630 1.00 0.00 O ATOM 1643 CB ALA A 111 99.255 -4.087 5.840 1.00 0.00 C ATOM 0 H ALA A 111 101.157 -2.154 4.775 1.00 0.00 H new ATOM 0 HA ALA A 111 101.152 -4.266 6.824 1.00 0.00 H new ATOM 0 HB1 ALA A 111 99.019 -5.146 5.940 1.00 0.00 H new ATOM 0 HB2 ALA A 111 98.802 -3.535 6.664 1.00 0.00 H new ATOM 0 HB3 ALA A 111 98.861 -3.715 4.894 1.00 0.00 H new ATOM 1649 N GLY A 112 101.770 -5.931 4.990 1.00 0.00 N ATOM 1650 CA GLY A 112 102.443 -6.733 3.972 1.00 0.00 C ATOM 1651 C GLY A 112 102.096 -8.212 4.081 1.00 0.00 C ATOM 1652 O GLY A 112 101.630 -8.678 5.121 1.00 0.00 O ATOM 0 H GLY A 112 101.609 -6.407 5.878 1.00 0.00 H new ATOM 0 HA2 GLY A 112 102.165 -6.369 2.983 1.00 0.00 H new ATOM 0 HA3 GLY A 112 103.521 -6.607 4.067 1.00 0.00 H new ATOM 1656 N LEU A 113 102.338 -8.932 2.987 1.00 0.00 N ATOM 1657 CA LEU A 113 102.090 -10.369 2.938 1.00 0.00 C ATOM 1658 C LEU A 113 103.300 -11.063 2.326 1.00 0.00 C ATOM 1659 O LEU A 113 104.048 -10.440 1.571 1.00 0.00 O ATOM 1660 CB LEU A 113 100.843 -10.675 2.103 1.00 0.00 C ATOM 1661 CG LEU A 113 99.628 -9.917 2.664 1.00 0.00 C ATOM 1662 CD1 LEU A 113 99.512 -8.545 1.993 1.00 0.00 C ATOM 1663 CD2 LEU A 113 98.345 -10.712 2.393 1.00 0.00 C ATOM 0 H LEU A 113 102.707 -8.541 2.120 1.00 0.00 H new ATOM 0 HA LEU A 113 101.923 -10.735 3.951 1.00 0.00 H new ATOM 0 HB2 LEU A 113 101.012 -10.388 1.065 1.00 0.00 H new ATOM 0 HB3 LEU A 113 100.646 -11.747 2.109 1.00 0.00 H new ATOM 0 HG LEU A 113 99.762 -9.790 3.738 1.00 0.00 H new ATOM 0 HD11 LEU A 113 98.649 -8.015 2.396 1.00 0.00 H new ATOM 0 HD12 LEU A 113 100.416 -7.968 2.187 1.00 0.00 H new ATOM 0 HD13 LEU A 113 99.388 -8.675 0.918 1.00 0.00 H new ATOM 0 HD21 LEU A 113 97.489 -10.169 2.793 1.00 0.00 H new ATOM 0 HD22 LEU A 113 98.220 -10.846 1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 113 98.413 -11.688 2.874 1.00 0.00 H new ATOM 1675 N GLN A 114 103.508 -12.339 2.655 1.00 0.00 N ATOM 1676 CA GLN A 114 104.678 -13.060 2.149 1.00 0.00 C ATOM 1677 C GLN A 114 104.292 -14.370 1.473 1.00 0.00 C ATOM 1678 O GLN A 114 103.323 -15.029 1.855 1.00 0.00 O ATOM 1679 CB GLN A 114 105.643 -13.377 3.295 1.00 0.00 C ATOM 1680 CG GLN A 114 106.134 -12.076 3.931 1.00 0.00 C ATOM 1681 CD GLN A 114 107.029 -12.369 5.132 1.00 0.00 C ATOM 1682 OE1 GLN A 114 107.007 -13.473 5.680 1.00 0.00 O ATOM 1683 NE2 GLN A 114 107.824 -11.435 5.581 1.00 0.00 N ATOM 0 H GLN A 114 102.894 -12.887 3.258 1.00 0.00 H new ATOM 0 HA GLN A 114 105.155 -12.411 1.414 1.00 0.00 H new ATOM 0 HB2 GLN A 114 105.144 -13.993 4.043 1.00 0.00 H new ATOM 0 HB3 GLN A 114 106.490 -13.953 2.921 1.00 0.00 H new ATOM 0 HG2 GLN A 114 106.684 -11.490 3.195 1.00 0.00 H new ATOM 0 HG3 GLN A 114 105.281 -11.474 4.245 1.00 0.00 H new ATOM 0 HE21 GLN A 114 107.843 -10.521 5.129 1.00 0.00 H new ATOM 0 HE22 GLN A 114 108.425 -11.620 6.384 1.00 0.00 H new ATOM 1692 N PHE A 115 105.072 -14.728 0.462 1.00 0.00 N ATOM 1693 CA PHE A 115 105.007 -16.056 -0.132 1.00 0.00 C ATOM 1694 C PHE A 115 106.428 -16.599 -0.138 1.00 0.00 C ATOM 1695 O PHE A 115 107.276 -16.090 -0.870 1.00 0.00 O ATOM 1696 CB PHE A 115 104.474 -15.977 -1.564 1.00 0.00 C ATOM 1697 CG PHE A 115 103.089 -15.382 -1.660 1.00 0.00 C ATOM 1698 CD1 PHE A 115 101.964 -16.185 -1.436 1.00 0.00 C ATOM 1699 CD2 PHE A 115 102.931 -14.027 -1.976 1.00 0.00 C ATOM 1700 CE1 PHE A 115 100.681 -15.630 -1.526 1.00 0.00 C ATOM 1701 CE2 PHE A 115 101.649 -13.474 -2.067 1.00 0.00 C ATOM 1702 CZ PHE A 115 100.523 -14.275 -1.841 1.00 0.00 C ATOM 0 H PHE A 115 105.762 -14.111 0.033 1.00 0.00 H new ATOM 0 HA PHE A 115 104.336 -16.702 0.434 1.00 0.00 H new ATOM 0 HB2 PHE A 115 105.160 -15.380 -2.166 1.00 0.00 H new ATOM 0 HB3 PHE A 115 104.461 -16.978 -1.994 1.00 0.00 H new ATOM 0 HD1 PHE A 115 102.085 -17.231 -1.194 1.00 0.00 H new ATOM 0 HD2 PHE A 115 103.799 -13.408 -2.150 1.00 0.00 H new ATOM 0 HE1 PHE A 115 99.813 -16.248 -1.352 1.00 0.00 H new ATOM 0 HE2 PHE A 115 101.528 -12.429 -2.312 1.00 0.00 H new ATOM 0 HZ PHE A 115 99.533 -13.848 -1.910 1.00 0.00 H new ATOM 1712 N ASN A 116 106.710 -17.602 0.694 1.00 0.00 N ATOM 1713 CA ASN A 116 108.101 -17.980 0.951 1.00 0.00 C ATOM 1714 C ASN A 116 108.405 -19.435 0.584 1.00 0.00 C ATOM 1715 O ASN A 116 107.739 -20.350 1.064 1.00 0.00 O ATOM 1716 CB ASN A 116 108.389 -17.790 2.441 1.00 0.00 C ATOM 1717 CG ASN A 116 107.434 -18.642 3.272 1.00 0.00 C ATOM 1718 OD1 ASN A 116 106.322 -18.210 3.576 1.00 0.00 O ATOM 1719 ND2 ASN A 116 107.804 -19.831 3.661 1.00 0.00 N ATOM 0 H ASN A 116 106.013 -18.156 1.191 1.00 0.00 H new ATOM 0 HA ASN A 116 108.730 -17.346 0.327 1.00 0.00 H new ATOM 0 HB2 ASN A 116 109.420 -18.068 2.658 1.00 0.00 H new ATOM 0 HB3 ASN A 116 108.279 -16.739 2.710 1.00 0.00 H new ATOM 0 HD21 ASN A 116 107.171 -20.405 4.218 1.00 0.00 H new ATOM 0 HD22 ASN A 116 108.726 -20.187 3.408 1.00 0.00 H new ATOM 1726 N PRO A 117 109.388 -19.666 -0.254 1.00 0.00 N ATOM 1727 CA PRO A 117 110.105 -20.964 -0.309 1.00 0.00 C ATOM 1728 C PRO A 117 111.397 -20.870 0.500 1.00 0.00 C ATOM 1729 O PRO A 117 111.729 -19.800 1.013 1.00 0.00 O ATOM 1730 CB PRO A 117 110.388 -21.168 -1.807 1.00 0.00 C ATOM 1731 CG PRO A 117 110.075 -19.867 -2.479 1.00 0.00 C ATOM 1732 CD PRO A 117 109.841 -18.836 -1.376 1.00 0.00 C ATOM 0 HA PRO A 117 109.539 -21.795 0.112 1.00 0.00 H new ATOM 0 HB2 PRO A 117 111.428 -21.449 -1.971 1.00 0.00 H new ATOM 0 HB3 PRO A 117 109.773 -21.972 -2.212 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.897 -19.560 -3.125 1.00 0.00 H new ATOM 0 HG3 PRO A 117 109.192 -19.962 -3.111 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.751 -18.288 -1.133 1.00 0.00 H new ATOM 0 HD3 PRO A 117 109.092 -18.098 -1.663 1.00 0.00 H new ATOM 1740 N MET A 118 112.119 -21.977 0.617 1.00 0.00 N ATOM 1741 CA MET A 118 113.348 -21.993 1.404 1.00 0.00 C ATOM 1742 C MET A 118 114.412 -21.084 0.786 1.00 0.00 C ATOM 1743 O MET A 118 114.555 -21.030 -0.433 1.00 0.00 O ATOM 1744 CB MET A 118 113.889 -23.421 1.482 1.00 0.00 C ATOM 1745 CG MET A 118 114.957 -23.511 2.572 1.00 0.00 C ATOM 1746 SD MET A 118 115.760 -25.132 2.499 1.00 0.00 S ATOM 1747 CE MET A 118 114.291 -26.132 2.838 1.00 0.00 C ATOM 0 H MET A 118 111.879 -22.868 0.182 1.00 0.00 H new ATOM 0 HA MET A 118 113.116 -21.625 2.403 1.00 0.00 H new ATOM 0 HB2 MET A 118 113.077 -24.116 1.697 1.00 0.00 H new ATOM 0 HB3 MET A 118 114.312 -23.713 0.521 1.00 0.00 H new ATOM 0 HG2 MET A 118 115.696 -22.721 2.438 1.00 0.00 H new ATOM 0 HG3 MET A 118 114.505 -23.361 3.552 1.00 0.00 H new ATOM 0 HE1 MET A 118 114.575 -27.012 3.414 1.00 0.00 H new ATOM 0 HE2 MET A 118 113.573 -25.542 3.407 1.00 0.00 H new ATOM 0 HE3 MET A 118 113.839 -26.445 1.897 1.00 0.00 H new ATOM 1757 N GLU A 119 115.162 -20.382 1.644 1.00 0.00 N ATOM 1758 CA GLU A 119 116.314 -19.558 1.238 1.00 0.00 C ATOM 1759 C GLU A 119 115.856 -18.202 0.665 1.00 0.00 C ATOM 1760 O GLU A 119 114.714 -17.794 0.872 1.00 0.00 O ATOM 1761 CB GLU A 119 117.209 -20.327 0.237 1.00 0.00 C ATOM 1762 CG GLU A 119 118.700 -20.077 0.518 1.00 0.00 C ATOM 1763 CD GLU A 119 119.134 -20.775 1.808 1.00 0.00 C ATOM 1764 OE1 GLU A 119 118.511 -21.757 2.181 1.00 0.00 O ATOM 1765 OE2 GLU A 119 120.093 -20.315 2.405 1.00 0.00 O ATOM 0 H GLU A 119 114.987 -20.368 2.649 1.00 0.00 H new ATOM 0 HA GLU A 119 116.911 -19.347 2.125 1.00 0.00 H new ATOM 0 HB2 GLU A 119 116.998 -21.394 0.302 1.00 0.00 H new ATOM 0 HB3 GLU A 119 116.971 -20.017 -0.780 1.00 0.00 H new ATOM 0 HG2 GLU A 119 119.298 -20.442 -0.317 1.00 0.00 H new ATOM 0 HG3 GLU A 119 118.885 -19.006 0.599 1.00 0.00 H new ATOM 1772 N ASN A 120 116.746 -17.512 -0.061 1.00 0.00 N ATOM 1773 CA ASN A 120 116.524 -16.138 -0.524 1.00 0.00 C ATOM 1774 C ASN A 120 115.291 -15.969 -1.421 1.00 0.00 C ATOM 1775 O ASN A 120 114.878 -14.843 -1.699 1.00 0.00 O ATOM 1776 CB ASN A 120 117.768 -15.650 -1.274 1.00 0.00 C ATOM 1777 CG ASN A 120 117.979 -16.460 -2.552 1.00 0.00 C ATOM 1778 OD1 ASN A 120 117.459 -17.568 -2.683 1.00 0.00 O ATOM 1779 ND2 ASN A 120 118.715 -15.966 -3.509 1.00 0.00 N ATOM 0 H ASN A 120 117.647 -17.896 -0.345 1.00 0.00 H new ATOM 0 HA ASN A 120 116.336 -15.540 0.368 1.00 0.00 H new ATOM 0 HB2 ASN A 120 117.659 -14.594 -1.520 1.00 0.00 H new ATOM 0 HB3 ASN A 120 118.644 -15.739 -0.632 1.00 0.00 H new ATOM 0 HD21 ASN A 120 118.860 -16.498 -4.367 1.00 0.00 H new ATOM 0 HD22 ASN A 120 119.145 -15.048 -3.399 1.00 0.00 H new ATOM 1786 N VAL A 121 114.709 -17.072 -1.871 1.00 0.00 N ATOM 1787 CA VAL A 121 113.641 -17.036 -2.868 1.00 0.00 C ATOM 1788 C VAL A 121 112.278 -16.661 -2.282 1.00 0.00 C ATOM 1789 O VAL A 121 111.256 -16.914 -2.923 1.00 0.00 O ATOM 1790 CB VAL A 121 113.531 -18.372 -3.618 1.00 0.00 C ATOM 1791 CG1 VAL A 121 114.736 -18.529 -4.551 1.00 0.00 C ATOM 1792 CG2 VAL A 121 113.480 -19.551 -2.636 1.00 0.00 C ATOM 0 H VAL A 121 114.959 -18.011 -1.560 1.00 0.00 H new ATOM 0 HA VAL A 121 113.922 -16.249 -3.567 1.00 0.00 H new ATOM 0 HB VAL A 121 112.608 -18.371 -4.198 1.00 0.00 H new ATOM 0 HG11 VAL A 121 114.662 -19.476 -5.085 1.00 0.00 H new ATOM 0 HG12 VAL A 121 114.750 -17.708 -5.268 1.00 0.00 H new ATOM 0 HG13 VAL A 121 115.655 -18.514 -3.964 1.00 0.00 H new ATOM 0 HG21 VAL A 121 113.402 -20.485 -3.193 1.00 0.00 H new ATOM 0 HG22 VAL A 121 114.388 -19.562 -2.033 1.00 0.00 H new ATOM 0 HG23 VAL A 121 112.613 -19.444 -1.984 1.00 0.00 H new ATOM 1802 N ALA A 122 112.239 -16.066 -1.085 1.00 0.00 N ATOM 1803 CA ALA A 122 110.959 -15.729 -0.461 1.00 0.00 C ATOM 1804 C ALA A 122 110.701 -14.229 -0.582 1.00 0.00 C ATOM 1805 O ALA A 122 111.593 -13.418 -0.335 1.00 0.00 O ATOM 1806 CB ALA A 122 110.996 -16.115 1.020 1.00 0.00 C ATOM 0 H ALA A 122 113.063 -15.813 -0.539 1.00 0.00 H new ATOM 0 HA ALA A 122 110.162 -16.275 -0.965 1.00 0.00 H new ATOM 0 HB1 ALA A 122 110.043 -15.864 1.485 1.00 0.00 H new ATOM 0 HB2 ALA A 122 111.174 -17.186 1.112 1.00 0.00 H new ATOM 0 HB3 ALA A 122 111.798 -15.570 1.518 1.00 0.00 H new ATOM 1812 N LEU A 123 109.475 -13.875 -0.973 1.00 0.00 N ATOM 1813 CA LEU A 123 109.156 -12.498 -1.350 1.00 0.00 C ATOM 1814 C LEU A 123 108.154 -11.862 -0.390 1.00 0.00 C ATOM 1815 O LEU A 123 107.235 -12.524 0.090 1.00 0.00 O ATOM 1816 CB LEU A 123 108.561 -12.473 -2.764 1.00 0.00 C ATOM 1817 CG LEU A 123 109.531 -13.120 -3.757 1.00 0.00 C ATOM 1818 CD1 LEU A 123 108.878 -13.184 -5.139 1.00 0.00 C ATOM 1819 CD2 LEU A 123 110.807 -12.283 -3.843 1.00 0.00 C ATOM 0 H LEU A 123 108.689 -14.522 -1.037 1.00 0.00 H new ATOM 0 HA LEU A 123 110.084 -11.927 -1.311 1.00 0.00 H new ATOM 0 HB2 LEU A 123 107.609 -13.004 -2.775 1.00 0.00 H new ATOM 0 HB3 LEU A 123 108.356 -11.445 -3.062 1.00 0.00 H new ATOM 0 HG LEU A 123 109.776 -14.127 -3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 123 109.568 -13.644 -5.846 1.00 0.00 H new ATOM 0 HD12 LEU A 123 107.966 -13.778 -5.083 1.00 0.00 H new ATOM 0 HD13 LEU A 123 108.635 -12.176 -5.474 1.00 0.00 H new ATOM 0 HD21 LEU A 123 111.497 -12.744 -4.550 1.00 0.00 H new ATOM 0 HD22 LEU A 123 110.560 -11.277 -4.181 1.00 0.00 H new ATOM 0 HD23 LEU A 123 111.275 -12.231 -2.860 1.00 0.00 H new ATOM 1831 N ASP A 124 108.333 -10.567 -0.145 1.00 0.00 N ATOM 1832 CA ASP A 124 107.406 -9.802 0.683 1.00 0.00 C ATOM 1833 C ASP A 124 107.016 -8.510 -0.033 1.00 0.00 C ATOM 1834 O ASP A 124 107.860 -7.875 -0.662 1.00 0.00 O ATOM 1835 CB ASP A 124 108.071 -9.468 2.025 1.00 0.00 C ATOM 1836 CG ASP A 124 107.123 -8.665 2.914 1.00 0.00 C ATOM 1837 OD1 ASP A 124 106.383 -9.276 3.664 1.00 0.00 O ATOM 1838 OD2 ASP A 124 107.154 -7.449 2.829 1.00 0.00 O ATOM 0 H ASP A 124 109.115 -10.024 -0.510 1.00 0.00 H new ATOM 0 HA ASP A 124 106.510 -10.396 0.861 1.00 0.00 H new ATOM 0 HB2 ASP A 124 108.360 -10.389 2.532 1.00 0.00 H new ATOM 0 HB3 ASP A 124 108.984 -8.899 1.852 1.00 0.00 H new ATOM 1843 N PHE A 125 105.743 -8.126 0.063 1.00 0.00 N ATOM 1844 CA PHE A 125 105.293 -6.870 -0.536 1.00 0.00 C ATOM 1845 C PHE A 125 104.388 -6.124 0.438 1.00 0.00 C ATOM 1846 O PHE A 125 103.531 -6.735 1.077 1.00 0.00 O ATOM 1847 CB PHE A 125 104.544 -7.147 -1.842 1.00 0.00 C ATOM 1848 CG PHE A 125 103.257 -7.917 -1.656 1.00 0.00 C ATOM 1849 CD1 PHE A 125 103.286 -9.310 -1.527 1.00 0.00 C ATOM 1850 CD2 PHE A 125 102.034 -7.236 -1.620 1.00 0.00 C ATOM 1851 CE1 PHE A 125 102.093 -10.023 -1.361 1.00 0.00 C ATOM 1852 CE2 PHE A 125 100.841 -7.949 -1.453 1.00 0.00 C ATOM 1853 CZ PHE A 125 100.871 -9.342 -1.324 1.00 0.00 C ATOM 0 H PHE A 125 105.016 -8.657 0.542 1.00 0.00 H new ATOM 0 HA PHE A 125 106.164 -6.252 -0.755 1.00 0.00 H new ATOM 0 HB2 PHE A 125 104.321 -6.198 -2.330 1.00 0.00 H new ATOM 0 HB3 PHE A 125 105.197 -7.705 -2.513 1.00 0.00 H new ATOM 0 HD1 PHE A 125 104.229 -9.835 -1.556 1.00 0.00 H new ATOM 0 HD2 PHE A 125 102.011 -6.161 -1.721 1.00 0.00 H new ATOM 0 HE1 PHE A 125 102.116 -11.098 -1.262 1.00 0.00 H new ATOM 0 HE2 PHE A 125 99.898 -7.424 -1.424 1.00 0.00 H new ATOM 0 HZ PHE A 125 99.950 -9.892 -1.196 1.00 0.00 H new ATOM 1863 N SER A 126 104.595 -4.814 0.565 1.00 0.00 N ATOM 1864 CA SER A 126 103.844 -4.030 1.541 1.00 0.00 C ATOM 1865 C SER A 126 103.452 -2.668 0.979 1.00 0.00 C ATOM 1866 O SER A 126 104.114 -2.144 0.083 1.00 0.00 O ATOM 1867 CB SER A 126 104.679 -3.837 2.807 1.00 0.00 C ATOM 1868 OG SER A 126 103.886 -3.192 3.795 1.00 0.00 O ATOM 0 H SER A 126 105.266 -4.281 0.013 1.00 0.00 H new ATOM 0 HA SER A 126 102.932 -4.578 1.778 1.00 0.00 H new ATOM 0 HB2 SER A 126 105.029 -4.801 3.177 1.00 0.00 H new ATOM 0 HB3 SER A 126 105.564 -3.240 2.586 1.00 0.00 H new ATOM 0 HG SER A 126 102.940 -3.259 3.550 1.00 0.00 H new ATOM 1874 N TYR A 127 102.370 -2.107 1.510 1.00 0.00 N ATOM 1875 CA TYR A 127 101.979 -0.738 1.193 1.00 0.00 C ATOM 1876 C TYR A 127 102.079 0.103 2.461 1.00 0.00 C ATOM 1877 O TYR A 127 101.724 -0.367 3.541 1.00 0.00 O ATOM 1878 CB TYR A 127 100.543 -0.706 0.669 1.00 0.00 C ATOM 1879 CG TYR A 127 100.332 -1.547 -0.567 1.00 0.00 C ATOM 1880 CD1 TYR A 127 100.555 -0.998 -1.836 1.00 0.00 C ATOM 1881 CD2 TYR A 127 99.910 -2.877 -0.445 1.00 0.00 C ATOM 1882 CE1 TYR A 127 100.357 -1.778 -2.982 1.00 0.00 C ATOM 1883 CE2 TYR A 127 99.712 -3.657 -1.590 1.00 0.00 C ATOM 1884 CZ TYR A 127 99.935 -3.108 -2.858 1.00 0.00 C ATOM 1885 OH TYR A 127 99.740 -3.876 -3.987 1.00 0.00 O ATOM 0 H TYR A 127 101.747 -2.581 2.164 1.00 0.00 H new ATOM 0 HA TYR A 127 102.639 -0.339 0.423 1.00 0.00 H new ATOM 0 HB2 TYR A 127 99.871 -1.053 1.454 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.269 0.325 0.448 1.00 0.00 H new ATOM 0 HD1 TYR A 127 100.880 0.028 -1.931 1.00 0.00 H new ATOM 0 HD2 TYR A 127 99.737 -3.301 0.533 1.00 0.00 H new ATOM 0 HE1 TYR A 127 100.529 -1.355 -3.960 1.00 0.00 H new ATOM 0 HE2 TYR A 127 99.387 -4.683 -1.495 1.00 0.00 H new ATOM 0 HH TYR A 127 99.449 -4.774 -3.725 1.00 0.00 H new ATOM 1895 N GLU A 128 102.569 1.333 2.333 1.00 0.00 N ATOM 1896 CA GLU A 128 102.769 2.190 3.499 1.00 0.00 C ATOM 1897 C GLU A 128 102.277 3.601 3.206 1.00 0.00 C ATOM 1898 O GLU A 128 102.561 4.159 2.147 1.00 0.00 O ATOM 1899 CB GLU A 128 104.254 2.221 3.865 1.00 0.00 C ATOM 1900 CG GLU A 128 104.446 2.935 5.209 1.00 0.00 C ATOM 1901 CD GLU A 128 105.929 3.066 5.580 1.00 0.00 C ATOM 1902 OE1 GLU A 128 106.780 2.657 4.804 1.00 0.00 O ATOM 1903 OE2 GLU A 128 106.194 3.576 6.656 1.00 0.00 O ATOM 0 H GLU A 128 102.833 1.756 1.443 1.00 0.00 H new ATOM 0 HA GLU A 128 102.199 1.788 4.337 1.00 0.00 H new ATOM 0 HB2 GLU A 128 104.644 1.205 3.924 1.00 0.00 H new ATOM 0 HB3 GLU A 128 104.819 2.734 3.087 1.00 0.00 H new ATOM 0 HG2 GLU A 128 103.995 3.926 5.161 1.00 0.00 H new ATOM 0 HG3 GLU A 128 103.923 2.384 5.991 1.00 0.00 H new ATOM 1910 N GLN A 129 101.543 4.183 4.151 1.00 0.00 N ATOM 1911 CA GLN A 129 100.947 5.499 3.947 1.00 0.00 C ATOM 1912 C GLN A 129 101.361 6.466 5.049 1.00 0.00 C ATOM 1913 O GLN A 129 101.369 6.114 6.229 1.00 0.00 O ATOM 1914 CB GLN A 129 99.421 5.374 3.926 1.00 0.00 C ATOM 1915 CG GLN A 129 98.799 6.722 3.548 1.00 0.00 C ATOM 1916 CD GLN A 129 97.275 6.617 3.463 1.00 0.00 C ATOM 1917 OE1 GLN A 129 96.710 5.524 3.536 1.00 0.00 O ATOM 1918 NE2 GLN A 129 96.570 7.704 3.309 1.00 0.00 N ATOM 0 H GLN A 129 101.348 3.766 5.061 1.00 0.00 H new ATOM 0 HA GLN A 129 101.302 5.891 2.994 1.00 0.00 H new ATOM 0 HB2 GLN A 129 99.119 4.609 3.210 1.00 0.00 H new ATOM 0 HB3 GLN A 129 99.059 5.057 4.904 1.00 0.00 H new ATOM 0 HG2 GLN A 129 99.075 7.474 4.287 1.00 0.00 H new ATOM 0 HG3 GLN A 129 99.198 7.055 2.590 1.00 0.00 H new ATOM 0 HE21 GLN A 129 97.036 8.610 3.248 1.00 0.00 H new ATOM 0 HE22 GLN A 129 95.553 7.648 3.249 1.00 0.00 H new ATOM 1927 N SER A 130 101.732 7.672 4.636 1.00 0.00 N ATOM 1928 CA SER A 130 101.976 8.769 5.562 1.00 0.00 C ATOM 1929 C SER A 130 100.712 9.618 5.631 1.00 0.00 C ATOM 1930 O SER A 130 100.112 9.892 4.585 1.00 0.00 O ATOM 1931 CB SER A 130 103.184 9.609 5.126 1.00 0.00 C ATOM 1932 OG SER A 130 102.790 10.613 4.197 1.00 0.00 O ATOM 0 H SER A 130 101.871 7.915 3.655 1.00 0.00 H new ATOM 0 HA SER A 130 102.213 8.373 6.549 1.00 0.00 H new ATOM 0 HB2 SER A 130 103.644 10.074 5.998 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.938 8.964 4.674 1.00 0.00 H new ATOM 0 HG SER A 130 103.141 11.481 4.485 1.00 0.00 H new ATOM 1938 N ARG A 131 100.415 10.160 6.807 1.00 0.00 N ATOM 1939 CA ARG A 131 99.078 10.656 7.113 1.00 0.00 C ATOM 1940 C ARG A 131 98.972 12.116 6.696 1.00 0.00 C ATOM 1941 O ARG A 131 99.940 12.872 6.782 1.00 0.00 O ATOM 1942 CB ARG A 131 98.772 10.482 8.607 1.00 0.00 C ATOM 1943 CG ARG A 131 99.715 11.342 9.459 1.00 0.00 C ATOM 1944 CD ARG A 131 99.512 11.010 10.938 1.00 0.00 C ATOM 1945 NE ARG A 131 100.309 11.916 11.773 1.00 0.00 N ATOM 1946 CZ ARG A 131 99.973 12.255 13.026 1.00 0.00 C ATOM 1947 NH1 ARG A 131 98.900 11.787 13.615 1.00 0.00 N ATOM 1948 NH2 ARG A 131 100.747 13.076 13.684 1.00 0.00 N ATOM 0 H ARG A 131 101.086 10.267 7.568 1.00 0.00 H new ATOM 0 HA ARG A 131 98.340 10.080 6.555 1.00 0.00 H new ATOM 0 HB2 ARG A 131 97.738 10.762 8.806 1.00 0.00 H new ATOM 0 HB3 ARG A 131 98.878 9.433 8.885 1.00 0.00 H new ATOM 0 HG2 ARG A 131 100.750 11.158 9.173 1.00 0.00 H new ATOM 0 HG3 ARG A 131 99.519 12.400 9.283 1.00 0.00 H new ATOM 0 HD2 ARG A 131 98.457 11.098 11.197 1.00 0.00 H new ATOM 0 HD3 ARG A 131 99.802 9.977 11.130 1.00 0.00 H new ATOM 0 HE ARG A 131 101.164 12.309 11.379 1.00 0.00 H new ATOM 0 HH11 ARG A 131 98.287 11.141 13.119 1.00 0.00 H new ATOM 0 HH12 ARG A 131 98.678 12.069 14.570 1.00 0.00 H new ATOM 0 HH21 ARG A 131 101.589 13.447 13.244 1.00 0.00 H new ATOM 0 HH22 ARG A 131 100.509 13.347 14.638 1.00 0.00 H new ATOM 1962 N ILE A 132 97.784 12.505 6.245 1.00 0.00 N ATOM 1963 CA ILE A 132 97.685 13.485 5.174 1.00 0.00 C ATOM 1964 C ILE A 132 97.673 14.941 5.657 1.00 0.00 C ATOM 1965 O ILE A 132 96.690 15.476 6.171 1.00 0.00 O ATOM 1966 CB ILE A 132 96.436 13.182 4.329 1.00 0.00 C ATOM 1967 CG1 ILE A 132 96.381 14.117 3.115 1.00 0.00 C ATOM 1968 CG2 ILE A 132 95.157 13.345 5.159 1.00 0.00 C ATOM 1969 CD1 ILE A 132 95.585 13.457 1.987 1.00 0.00 C ATOM 0 H ILE A 132 96.891 12.162 6.599 1.00 0.00 H new ATOM 0 HA ILE A 132 98.588 13.391 4.571 1.00 0.00 H new ATOM 0 HB ILE A 132 96.502 12.148 3.991 1.00 0.00 H new ATOM 0 HG12 ILE A 132 95.917 15.063 3.394 1.00 0.00 H new ATOM 0 HG13 ILE A 132 97.391 14.345 2.774 1.00 0.00 H new ATOM 0 HG21 ILE A 132 94.289 13.125 4.537 1.00 0.00 H new ATOM 0 HG22 ILE A 132 95.182 12.657 6.004 1.00 0.00 H new ATOM 0 HG23 ILE A 132 95.090 14.369 5.526 1.00 0.00 H new ATOM 0 HD11 ILE A 132 95.549 14.126 1.127 1.00 0.00 H new ATOM 0 HD12 ILE A 132 96.067 12.523 1.700 1.00 0.00 H new ATOM 0 HD13 ILE A 132 94.571 13.252 2.329 1.00 0.00 H new ATOM 1981 N ARG A 133 98.846 15.538 5.490 1.00 0.00 N ATOM 1982 CA ARG A 133 99.018 16.981 5.382 1.00 0.00 C ATOM 1983 C ARG A 133 98.902 17.343 3.899 1.00 0.00 C ATOM 1984 O ARG A 133 98.620 16.476 3.061 1.00 0.00 O ATOM 1985 CB ARG A 133 100.387 17.409 5.919 1.00 0.00 C ATOM 1986 CG ARG A 133 100.584 16.898 7.350 1.00 0.00 C ATOM 1987 CD ARG A 133 99.646 17.637 8.307 1.00 0.00 C ATOM 1988 NE ARG A 133 99.968 19.067 8.326 1.00 0.00 N ATOM 1989 CZ ARG A 133 100.903 19.605 9.123 1.00 0.00 C ATOM 1990 NH1 ARG A 133 101.606 18.883 9.962 1.00 0.00 N ATOM 1991 NH2 ARG A 133 101.121 20.890 9.063 1.00 0.00 N ATOM 0 H ARG A 133 99.723 15.022 5.424 1.00 0.00 H new ATOM 0 HA ARG A 133 98.259 17.495 5.972 1.00 0.00 H new ATOM 0 HB2 ARG A 133 101.175 17.019 5.275 1.00 0.00 H new ATOM 0 HB3 ARG A 133 100.469 18.496 5.900 1.00 0.00 H new ATOM 0 HG2 ARG A 133 100.388 15.827 7.392 1.00 0.00 H new ATOM 0 HG3 ARG A 133 101.619 17.045 7.658 1.00 0.00 H new ATOM 0 HD2 ARG A 133 98.611 17.494 7.997 1.00 0.00 H new ATOM 0 HD3 ARG A 133 99.738 17.222 9.311 1.00 0.00 H new ATOM 0 HE ARG A 133 99.453 19.686 7.700 1.00 0.00 H new ATOM 0 HH11 ARG A 133 101.450 17.877 10.024 1.00 0.00 H new ATOM 0 HH12 ARG A 133 102.309 19.327 10.553 1.00 0.00 H new ATOM 0 HH21 ARG A 133 100.584 21.469 8.417 1.00 0.00 H new ATOM 0 HH22 ARG A 133 101.828 21.316 9.662 1.00 0.00 H new ATOM 2005 N SER A 134 99.092 18.616 3.555 1.00 0.00 N ATOM 2006 CA SER A 134 98.888 19.050 2.168 1.00 0.00 C ATOM 2007 C SER A 134 99.669 18.182 1.164 1.00 0.00 C ATOM 2008 O SER A 134 99.382 18.224 -0.033 1.00 0.00 O ATOM 2009 CB SER A 134 99.320 20.508 2.017 1.00 0.00 C ATOM 2010 OG SER A 134 100.729 20.595 2.182 1.00 0.00 O ATOM 0 H SER A 134 99.380 19.353 4.199 1.00 0.00 H new ATOM 0 HA SER A 134 97.826 18.942 1.946 1.00 0.00 H new ATOM 0 HB2 SER A 134 99.032 20.886 1.036 1.00 0.00 H new ATOM 0 HB3 SER A 134 98.816 21.128 2.758 1.00 0.00 H new ATOM 0 HG SER A 134 101.013 21.528 2.085 1.00 0.00 H new ATOM 2016 N VAL A 135 100.644 17.397 1.631 1.00 0.00 N ATOM 2017 CA VAL A 135 101.261 16.361 0.802 1.00 0.00 C ATOM 2018 C VAL A 135 101.000 14.983 1.422 1.00 0.00 C ATOM 2019 O VAL A 135 101.248 14.773 2.609 1.00 0.00 O ATOM 2020 CB VAL A 135 102.771 16.600 0.686 1.00 0.00 C ATOM 2021 CG1 VAL A 135 103.388 15.564 -0.257 1.00 0.00 C ATOM 2022 CG2 VAL A 135 103.031 18.002 0.128 1.00 0.00 C ATOM 0 H VAL A 135 101.021 17.460 2.577 1.00 0.00 H new ATOM 0 HA VAL A 135 100.823 16.400 -0.195 1.00 0.00 H new ATOM 0 HB VAL A 135 103.221 16.509 1.675 1.00 0.00 H new ATOM 0 HG11 VAL A 135 104.461 15.738 -0.336 1.00 0.00 H new ATOM 0 HG12 VAL A 135 103.211 14.563 0.136 1.00 0.00 H new ATOM 0 HG13 VAL A 135 102.932 15.653 -1.243 1.00 0.00 H new ATOM 0 HG21 VAL A 135 104.105 18.168 0.047 1.00 0.00 H new ATOM 0 HG22 VAL A 135 102.575 18.092 -0.858 1.00 0.00 H new ATOM 0 HG23 VAL A 135 102.598 18.746 0.797 1.00 0.00 H new ATOM 2032 N ASP A 136 100.501 14.046 0.614 1.00 0.00 N ATOM 2033 CA ASP A 136 100.190 12.697 1.091 1.00 0.00 C ATOM 2034 C ASP A 136 101.113 11.670 0.437 1.00 0.00 C ATOM 2035 O ASP A 136 101.395 11.764 -0.757 1.00 0.00 O ATOM 2036 CB ASP A 136 98.728 12.352 0.776 1.00 0.00 C ATOM 2037 CG ASP A 136 98.479 12.335 -0.733 1.00 0.00 C ATOM 2038 OD1 ASP A 136 99.177 13.039 -1.445 1.00 0.00 O ATOM 2039 OD2 ASP A 136 97.591 11.612 -1.153 1.00 0.00 O ATOM 0 H ASP A 136 100.303 14.197 -0.375 1.00 0.00 H new ATOM 0 HA ASP A 136 100.343 12.670 2.170 1.00 0.00 H new ATOM 0 HB2 ASP A 136 98.482 11.378 1.199 1.00 0.00 H new ATOM 0 HB3 ASP A 136 98.069 13.081 1.248 1.00 0.00 H new ATOM 2044 N VAL A 137 101.587 10.686 1.210 1.00 0.00 N ATOM 2045 CA VAL A 137 102.572 9.731 0.683 1.00 0.00 C ATOM 2046 C VAL A 137 101.956 8.351 0.461 1.00 0.00 C ATOM 2047 O VAL A 137 101.235 7.833 1.315 1.00 0.00 O ATOM 2048 CB VAL A 137 103.774 9.611 1.630 1.00 0.00 C ATOM 2049 CG1 VAL A 137 104.854 8.729 0.993 1.00 0.00 C ATOM 2050 CG2 VAL A 137 104.368 10.997 1.900 1.00 0.00 C ATOM 0 H VAL A 137 101.313 10.530 2.180 1.00 0.00 H new ATOM 0 HA VAL A 137 102.909 10.116 -0.280 1.00 0.00 H new ATOM 0 HB VAL A 137 103.436 9.166 2.566 1.00 0.00 H new ATOM 0 HG11 VAL A 137 105.704 8.648 1.670 1.00 0.00 H new ATOM 0 HG12 VAL A 137 104.447 7.736 0.802 1.00 0.00 H new ATOM 0 HG13 VAL A 137 105.180 9.175 0.053 1.00 0.00 H new ATOM 0 HG21 VAL A 137 105.220 10.903 2.573 1.00 0.00 H new ATOM 0 HG22 VAL A 137 104.695 11.442 0.960 1.00 0.00 H new ATOM 0 HG23 VAL A 137 103.612 11.634 2.359 1.00 0.00 H new ATOM 2060 N GLY A 138 102.254 7.761 -0.695 1.00 0.00 N ATOM 2061 CA GLY A 138 101.893 6.372 -0.968 1.00 0.00 C ATOM 2062 C GLY A 138 103.144 5.599 -1.370 1.00 0.00 C ATOM 2063 O GLY A 138 103.849 6.012 -2.289 1.00 0.00 O ATOM 0 H GLY A 138 102.746 8.225 -1.459 1.00 0.00 H new ATOM 0 HA2 GLY A 138 101.440 5.921 -0.085 1.00 0.00 H new ATOM 0 HA3 GLY A 138 101.151 6.326 -1.765 1.00 0.00 H new ATOM 2067 N THR A 139 103.441 4.501 -0.670 1.00 0.00 N ATOM 2068 CA THR A 139 104.675 3.758 -0.923 1.00 0.00 C ATOM 2069 C THR A 139 104.388 2.285 -1.195 1.00 0.00 C ATOM 2070 O THR A 139 103.614 1.656 -0.475 1.00 0.00 O ATOM 2071 CB THR A 139 105.604 3.880 0.286 1.00 0.00 C ATOM 2072 OG1 THR A 139 105.784 5.251 0.605 1.00 0.00 O ATOM 2073 CG2 THR A 139 106.960 3.250 -0.041 1.00 0.00 C ATOM 0 H THR A 139 102.852 4.112 0.066 1.00 0.00 H new ATOM 0 HA THR A 139 105.152 4.183 -1.806 1.00 0.00 H new ATOM 0 HB THR A 139 105.161 3.362 1.137 1.00 0.00 H new ATOM 0 HG1 THR A 139 106.378 5.331 1.381 1.00 0.00 H new ATOM 0 HG21 THR A 139 107.620 3.338 0.822 1.00 0.00 H new ATOM 0 HG22 THR A 139 106.822 2.197 -0.286 1.00 0.00 H new ATOM 0 HG23 THR A 139 107.405 3.765 -0.892 1.00 0.00 H new ATOM 2081 N TRP A 140 105.020 1.744 -2.233 1.00 0.00 N ATOM 2082 CA TRP A 140 104.935 0.315 -2.525 1.00 0.00 C ATOM 2083 C TRP A 140 106.336 -0.283 -2.476 1.00 0.00 C ATOM 2084 O TRP A 140 107.243 0.234 -3.125 1.00 0.00 O ATOM 2085 CB TRP A 140 104.323 0.096 -3.910 1.00 0.00 C ATOM 2086 CG TRP A 140 104.235 -1.345 -4.304 1.00 0.00 C ATOM 2087 CD1 TRP A 140 103.454 -2.269 -3.696 1.00 0.00 C ATOM 2088 CD2 TRP A 140 104.934 -2.039 -5.377 1.00 0.00 C ATOM 2089 NE1 TRP A 140 103.631 -3.487 -4.328 1.00 0.00 N ATOM 2090 CE2 TRP A 140 104.532 -3.397 -5.370 1.00 0.00 C ATOM 2091 CE3 TRP A 140 105.866 -1.629 -6.345 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 105.040 -4.315 -6.293 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 106.379 -2.548 -7.273 1.00 0.00 C ATOM 2094 CH2 TRP A 140 105.967 -3.887 -7.249 1.00 0.00 C ATOM 0 H TRP A 140 105.597 2.273 -2.887 1.00 0.00 H new ATOM 0 HA TRP A 140 104.300 -0.172 -1.785 1.00 0.00 H new ATOM 0 HB2 TRP A 140 103.324 0.531 -3.930 1.00 0.00 H new ATOM 0 HB3 TRP A 140 104.918 0.631 -4.650 1.00 0.00 H new ATOM 0 HD1 TRP A 140 102.800 -2.085 -2.856 1.00 0.00 H new ATOM 0 HE1 TRP A 140 103.154 -4.347 -4.057 1.00 0.00 H new ATOM 0 HE3 TRP A 140 106.190 -0.599 -6.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 104.720 -5.346 -6.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 107.096 -2.221 -8.011 1.00 0.00 H new ATOM 0 HH2 TRP A 140 106.365 -4.588 -7.968 1.00 0.00 H new ATOM 2105 N ILE A 141 106.522 -1.354 -1.703 1.00 0.00 N ATOM 2106 CA ILE A 141 107.864 -1.890 -1.477 1.00 0.00 C ATOM 2107 C ILE A 141 107.909 -3.398 -1.716 1.00 0.00 C ATOM 2108 O ILE A 141 106.963 -4.111 -1.380 1.00 0.00 O ATOM 2109 CB ILE A 141 108.290 -1.558 -0.042 1.00 0.00 C ATOM 2110 CG1 ILE A 141 109.731 -2.017 0.193 1.00 0.00 C ATOM 2111 CG2 ILE A 141 107.364 -2.244 0.965 1.00 0.00 C ATOM 2112 CD1 ILE A 141 110.303 -1.327 1.436 1.00 0.00 C ATOM 0 H ILE A 141 105.773 -1.860 -1.230 1.00 0.00 H new ATOM 0 HA ILE A 141 108.555 -1.432 -2.185 1.00 0.00 H new ATOM 0 HB ILE A 141 108.224 -0.479 0.097 1.00 0.00 H new ATOM 0 HG12 ILE A 141 109.761 -3.099 0.321 1.00 0.00 H new ATOM 0 HG13 ILE A 141 110.343 -1.782 -0.678 1.00 0.00 H new ATOM 0 HG21 ILE A 141 107.681 -1.997 1.978 1.00 0.00 H new ATOM 0 HG22 ILE A 141 106.341 -1.900 0.811 1.00 0.00 H new ATOM 0 HG23 ILE A 141 107.409 -3.324 0.824 1.00 0.00 H new ATOM 0 HD11 ILE A 141 111.329 -1.659 1.597 1.00 0.00 H new ATOM 0 HD12 ILE A 141 110.289 -0.247 1.291 1.00 0.00 H new ATOM 0 HD13 ILE A 141 109.698 -1.584 2.306 1.00 0.00 H new ATOM 2124 N ALA A 142 109.021 -3.873 -2.274 1.00 0.00 N ATOM 2125 CA ALA A 142 109.207 -5.302 -2.505 1.00 0.00 C ATOM 2126 C ALA A 142 110.603 -5.711 -2.052 1.00 0.00 C ATOM 2127 O ALA A 142 111.576 -5.009 -2.323 1.00 0.00 O ATOM 2128 CB ALA A 142 109.031 -5.623 -3.991 1.00 0.00 C ATOM 0 H ALA A 142 109.803 -3.291 -2.573 1.00 0.00 H new ATOM 0 HA ALA A 142 108.461 -5.856 -1.935 1.00 0.00 H new ATOM 0 HB1 ALA A 142 109.172 -6.692 -4.152 1.00 0.00 H new ATOM 0 HB2 ALA A 142 108.028 -5.338 -4.309 1.00 0.00 H new ATOM 0 HB3 ALA A 142 109.767 -5.069 -4.573 1.00 0.00 H new ATOM 2134 N GLY A 143 110.696 -6.843 -1.359 1.00 0.00 N ATOM 2135 CA GLY A 143 111.967 -7.274 -0.788 1.00 0.00 C ATOM 2136 C GLY A 143 112.157 -8.783 -0.910 1.00 0.00 C ATOM 2137 O GLY A 143 111.185 -9.537 -0.956 1.00 0.00 O ATOM 0 H GLY A 143 109.914 -7.473 -1.181 1.00 0.00 H new ATOM 0 HA2 GLY A 143 112.786 -6.762 -1.294 1.00 0.00 H new ATOM 0 HA3 GLY A 143 112.011 -6.985 0.262 1.00 0.00 H new ATOM 2141 N VAL A 144 113.416 -9.206 -0.950 1.00 0.00 N ATOM 2142 CA VAL A 144 113.753 -10.624 -1.042 1.00 0.00 C ATOM 2143 C VAL A 144 114.506 -11.035 0.217 1.00 0.00 C ATOM 2144 O VAL A 144 115.334 -10.270 0.714 1.00 0.00 O ATOM 2145 CB VAL A 144 114.630 -10.876 -2.275 1.00 0.00 C ATOM 2146 CG1 VAL A 144 113.846 -10.529 -3.546 1.00 0.00 C ATOM 2147 CG2 VAL A 144 115.893 -10.007 -2.204 1.00 0.00 C ATOM 0 H VAL A 144 114.224 -8.584 -0.920 1.00 0.00 H new ATOM 0 HA VAL A 144 112.839 -11.211 -1.136 1.00 0.00 H new ATOM 0 HB VAL A 144 114.916 -11.928 -2.298 1.00 0.00 H new ATOM 0 HG11 VAL A 144 114.472 -10.709 -4.420 1.00 0.00 H new ATOM 0 HG12 VAL A 144 112.953 -11.152 -3.604 1.00 0.00 H new ATOM 0 HG13 VAL A 144 113.555 -9.479 -3.519 1.00 0.00 H new ATOM 0 HG21 VAL A 144 116.511 -10.191 -3.083 1.00 0.00 H new ATOM 0 HG22 VAL A 144 115.610 -8.955 -2.174 1.00 0.00 H new ATOM 0 HG23 VAL A 144 116.457 -10.257 -1.305 1.00 0.00 H new ATOM 2157 N GLY A 145 114.215 -12.223 0.739 1.00 0.00 N ATOM 2158 CA GLY A 145 114.857 -12.667 1.970 1.00 0.00 C ATOM 2159 C GLY A 145 114.899 -14.185 2.090 1.00 0.00 C ATOM 2160 O GLY A 145 114.365 -14.909 1.245 1.00 0.00 O ATOM 0 H GLY A 145 113.551 -12.885 0.337 1.00 0.00 H new ATOM 0 HA2 GLY A 145 115.873 -12.274 2.008 1.00 0.00 H new ATOM 0 HA3 GLY A 145 114.323 -12.253 2.825 1.00 0.00 H new ATOM 2164 N TYR A 146 115.527 -14.637 3.172 1.00 0.00 N ATOM 2165 CA TYR A 146 115.682 -16.060 3.444 1.00 0.00 C ATOM 2166 C TYR A 146 115.391 -16.347 4.913 1.00 0.00 C ATOM 2167 O TYR A 146 115.313 -15.425 5.725 1.00 0.00 O ATOM 2168 CB TYR A 146 117.106 -16.508 3.099 1.00 0.00 C ATOM 2169 CG TYR A 146 118.173 -15.881 3.968 1.00 0.00 C ATOM 2170 CD1 TYR A 146 118.704 -14.632 3.625 1.00 0.00 C ATOM 2171 CD2 TYR A 146 118.627 -16.545 5.112 1.00 0.00 C ATOM 2172 CE1 TYR A 146 119.691 -14.047 4.427 1.00 0.00 C ATOM 2173 CE2 TYR A 146 119.614 -15.960 5.915 1.00 0.00 C ATOM 2174 CZ TYR A 146 120.146 -14.711 5.573 1.00 0.00 C ATOM 2175 OH TYR A 146 121.118 -14.135 6.364 1.00 0.00 O ATOM 0 H TYR A 146 115.940 -14.030 3.880 1.00 0.00 H new ATOM 0 HA TYR A 146 114.975 -16.615 2.827 1.00 0.00 H new ATOM 0 HB2 TYR A 146 117.167 -17.592 3.191 1.00 0.00 H new ATOM 0 HB3 TYR A 146 117.311 -16.264 2.057 1.00 0.00 H new ATOM 0 HD1 TYR A 146 118.352 -14.120 2.742 1.00 0.00 H new ATOM 0 HD2 TYR A 146 118.217 -17.508 5.376 1.00 0.00 H new ATOM 0 HE1 TYR A 146 120.101 -13.084 4.162 1.00 0.00 H new ATOM 0 HE2 TYR A 146 119.965 -16.473 6.798 1.00 0.00 H new ATOM 0 HH TYR A 146 121.318 -14.727 7.119 1.00 0.00 H new ATOM 2185 N ARG A 147 115.264 -17.629 5.241 1.00 0.00 N ATOM 2186 CA ARG A 147 114.945 -18.045 6.604 1.00 0.00 C ATOM 2187 C ARG A 147 116.076 -18.891 7.177 1.00 0.00 C ATOM 2188 O ARG A 147 116.745 -19.626 6.450 1.00 0.00 O ATOM 2189 CB ARG A 147 113.652 -18.865 6.599 1.00 0.00 C ATOM 2190 CG ARG A 147 112.491 -17.992 6.122 1.00 0.00 C ATOM 2191 CD ARG A 147 111.207 -18.823 6.092 1.00 0.00 C ATOM 2192 NE ARG A 147 110.790 -19.165 7.456 1.00 0.00 N ATOM 2193 CZ ARG A 147 110.045 -18.359 8.225 1.00 0.00 C ATOM 2194 NH1 ARG A 147 109.632 -17.183 7.816 1.00 0.00 N ATOM 2195 NH2 ARG A 147 109.721 -18.758 9.425 1.00 0.00 N ATOM 0 H ARG A 147 115.377 -18.399 4.582 1.00 0.00 H new ATOM 0 HA ARG A 147 114.817 -17.156 7.222 1.00 0.00 H new ATOM 0 HB2 ARG A 147 113.761 -19.731 5.946 1.00 0.00 H new ATOM 0 HB3 ARG A 147 113.447 -19.245 7.600 1.00 0.00 H new ATOM 0 HG2 ARG A 147 112.368 -17.137 6.787 1.00 0.00 H new ATOM 0 HG3 ARG A 147 112.704 -17.596 5.129 1.00 0.00 H new ATOM 0 HD2 ARG A 147 110.416 -18.264 5.592 1.00 0.00 H new ATOM 0 HD3 ARG A 147 111.368 -19.733 5.515 1.00 0.00 H new ATOM 0 HE ARG A 147 111.082 -20.064 7.840 1.00 0.00 H new ATOM 0 HH11 ARG A 147 109.877 -16.853 6.882 1.00 0.00 H new ATOM 0 HH12 ARG A 147 109.066 -16.599 8.432 1.00 0.00 H new ATOM 0 HH21 ARG A 147 110.034 -19.668 9.762 1.00 0.00 H new ATOM 0 HH22 ARG A 147 109.155 -18.159 10.026 1.00 0.00 H new ATOM 2209 N PHE A 148 116.286 -18.781 8.485 1.00 0.00 N ATOM 2210 CA PHE A 148 117.350 -19.524 9.155 1.00 0.00 C ATOM 2211 C PHE A 148 116.768 -20.465 10.204 1.00 0.00 C ATOM 2212 O PHE A 148 116.856 -21.667 10.007 1.00 0.00 O ATOM 2213 CB PHE A 148 118.317 -18.548 9.828 1.00 0.00 C ATOM 2214 CG PHE A 148 119.526 -19.219 10.435 1.00 0.00 C ATOM 2215 CD1 PHE A 148 120.642 -19.504 9.640 1.00 0.00 C ATOM 2216 CD2 PHE A 148 119.530 -19.556 11.794 1.00 0.00 C ATOM 2217 CE1 PHE A 148 121.763 -20.125 10.203 1.00 0.00 C ATOM 2218 CE2 PHE A 148 120.651 -20.177 12.358 1.00 0.00 C ATOM 2219 CZ PHE A 148 121.768 -20.461 11.563 1.00 0.00 C ATOM 2220 OXT PHE A 148 116.242 -19.972 11.188 1.00 0.00 O ATOM 0 H PHE A 148 115.734 -18.185 9.102 1.00 0.00 H new ATOM 0 HA PHE A 148 117.883 -20.114 8.409 1.00 0.00 H new ATOM 0 HB2 PHE A 148 118.649 -17.814 9.094 1.00 0.00 H new ATOM 0 HB3 PHE A 148 117.785 -18.002 10.607 1.00 0.00 H new ATOM 0 HD1 PHE A 148 120.638 -19.245 8.592 1.00 0.00 H new ATOM 0 HD2 PHE A 148 118.668 -19.337 12.407 1.00 0.00 H new ATOM 0 HE1 PHE A 148 122.624 -20.345 9.589 1.00 0.00 H new ATOM 0 HE2 PHE A 148 120.654 -20.437 13.406 1.00 0.00 H new ATOM 0 HZ PHE A 148 122.633 -20.939 11.998 1.00 0.00 H new