USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1069 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 77 TYR OH : rot -11:sc= 0.682 USER MOD Set 1.2: A 120 ASN : amide:sc= 0.652 X(o=1.4,f=1.2) USER MOD Set 1.3: A 124 GLN : amide:sc= 0.0514 X(o=1.4,f=1.3) USER MOD Set 2.1: A 51 SER OG : rot -155:sc= 1.28 USER MOD Set 2.2: A 126 HIS : no HE2:sc= 1.07 K(o=2.4,f=-2.7!) USER MOD Set 3.1: A 44 THR OG1 : rot -160:sc= 0.801 USER MOD Set 3.2: A 63 LYS NZ :NH3+ 146:sc= 0.908 (180deg=0) USER MOD Set 4.1: A 27 SER OG : rot 180:sc= 0.339 USER MOD Set 4.2: A 28 ASN : amide:sc= 0.355 X(o=0.69,f=0.78) USER MOD Set 5.1: A -1 ASN : amide:sc= 0.761 X(o=1.4,f=1.3) USER MOD Set 5.2: A -3 SER OG : rot -150:sc= 0.685 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -4 GLY N :NH3+ -120:sc= 0.0658 (180deg=0) USER MOD Single : A 12 CYS SG : rot 180:sc= -1.17 USER MOD Single : A 14 LYS NZ :NH3+ -171:sc= 2.47 (180deg=2.43) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 30:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 160:sc= 1.13 (180deg=1.06) USER MOD Single : A 40 GLN : amide:sc= -0.319 X(o=-0.32,f=-0.39) USER MOD Single : A 50 THR OG1 : rot 39:sc= 1.01 USER MOD Single : A 52 LYS NZ :NH3+ 179:sc= 1.04 (180deg=1.04) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 67:sc= 0.013 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -165:sc= 0.654 (180deg=-0.13!) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0.742 K(o=0.74,f=-0.22) USER MOD Single : A 76 GLN : amide:sc= 0.199 X(o=0.2,f=-0.15) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 74:sc= 1.19 USER MOD Single : A 89 SER OG : rot -116:sc= 0.783 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0.976 K(o=0.98,f=0) USER MOD Single : A 100 THR OG1 : rot -36:sc= 0.323 USER MOD Single : A 103 SER OG : rot -77:sc= 0.54 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 83:sc= 1.19 USER MOD Single : A 128 LYS NZ :NH3+ 169:sc= 1.25 (180deg=1.14) USER MOD Single : A 131 LYS NZ :NH3+ 177:sc= 1.31 (180deg=1.28) USER MOD Single : A 132 GLN : amide:sc= 0.825 K(o=0.83,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -0.082 32.341 8.239 1.00 0.00 N ATOM 2 CA GLY A -4 -1.419 32.046 8.803 1.00 0.00 C ATOM 3 C GLY A -4 -1.730 32.907 10.021 1.00 0.00 C ATOM 4 O GLY A -4 -0.960 33.802 10.379 1.00 0.00 O ATOM 0 H1 GLY A -4 -0.183 32.662 7.255 1.00 0.00 H new ATOM 0 H2 GLY A -4 0.375 33.087 8.801 1.00 0.00 H new ATOM 0 H3 GLY A -4 0.503 31.481 8.264 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -2.179 32.211 8.039 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -1.470 30.993 9.081 1.00 0.00 H new ATOM 10 N SER A -3 -2.869 32.647 10.671 1.00 0.00 N ATOM 11 CA SER A -3 -3.304 33.351 11.893 1.00 0.00 C ATOM 12 C SER A -3 -2.533 32.884 13.152 1.00 0.00 C ATOM 13 O SER A -3 -1.929 31.805 13.131 1.00 0.00 O ATOM 14 CB SER A -3 -4.826 33.204 12.063 1.00 0.00 C ATOM 15 OG SER A -3 -5.175 31.989 12.706 1.00 0.00 O ATOM 0 H SER A -3 -3.528 31.932 10.363 1.00 0.00 H new ATOM 0 HA SER A -3 -3.066 34.408 11.777 1.00 0.00 H new ATOM 0 HB2 SER A -3 -5.209 34.044 12.643 1.00 0.00 H new ATOM 0 HB3 SER A -3 -5.306 33.247 11.085 1.00 0.00 H new ATOM 0 HG SER A -3 -6.056 31.695 12.393 1.00 0.00 H new ATOM 21 N PRO A -2 -2.548 33.646 14.268 1.00 0.00 N ATOM 22 CA PRO A -2 -1.878 33.261 15.519 1.00 0.00 C ATOM 23 C PRO A -2 -2.628 32.183 16.336 1.00 0.00 C ATOM 24 O PRO A -2 -2.179 31.817 17.426 1.00 0.00 O ATOM 25 CB PRO A -2 -1.718 34.574 16.293 1.00 0.00 C ATOM 26 CG PRO A -2 -2.947 35.374 15.869 1.00 0.00 C ATOM 27 CD PRO A -2 -3.107 34.988 14.400 1.00 0.00 C ATOM 0 HA PRO A -2 -0.923 32.779 15.310 1.00 0.00 H new ATOM 0 HB2 PRO A -2 -1.696 34.408 17.370 1.00 0.00 H new ATOM 0 HB3 PRO A -2 -0.792 35.087 16.031 1.00 0.00 H new ATOM 0 HG2 PRO A -2 -3.826 35.108 16.456 1.00 0.00 H new ATOM 0 HG3 PRO A -2 -2.795 36.446 15.992 1.00 0.00 H new ATOM 0 HD2 PRO A -2 -4.156 35.003 14.106 1.00 0.00 H new ATOM 0 HD3 PRO A -2 -2.584 35.693 13.753 1.00 0.00 H new ATOM 35 N ASN A -1 -3.768 31.677 15.847 1.00 0.00 N ATOM 36 CA ASN A -1 -4.576 30.650 16.518 1.00 0.00 C ATOM 37 C ASN A -1 -3.918 29.252 16.482 1.00 0.00 C ATOM 38 O ASN A -1 -3.029 28.974 15.671 1.00 0.00 O ATOM 39 CB ASN A -1 -5.984 30.626 15.893 1.00 0.00 C ATOM 40 CG ASN A -1 -6.725 31.943 16.052 1.00 0.00 C ATOM 41 OD1 ASN A -1 -7.245 32.267 17.112 1.00 0.00 O ATOM 42 ND2 ASN A -1 -6.786 32.750 15.018 1.00 0.00 N ATOM 0 H ASN A -1 -4.162 31.976 14.955 1.00 0.00 H new ATOM 0 HA ASN A -1 -4.650 30.913 17.573 1.00 0.00 H new ATOM 0 HB2 ASN A -1 -5.901 30.387 14.833 1.00 0.00 H new ATOM 0 HB3 ASN A -1 -6.567 29.829 16.354 1.00 0.00 H new ATOM 0 HD21 ASN A -1 -7.266 33.646 15.098 1.00 0.00 H new ATOM 0 HD22 ASN A -1 -6.353 32.481 14.135 1.00 0.00 H new ATOM 49 N SER A 0 -4.393 28.343 17.342 1.00 0.00 N ATOM 50 CA SER A 0 -3.941 26.940 17.421 1.00 0.00 C ATOM 51 C SER A 0 -4.394 26.059 16.241 1.00 0.00 C ATOM 52 O SER A 0 -3.847 24.972 16.038 1.00 0.00 O ATOM 53 CB SER A 0 -4.417 26.328 18.745 1.00 0.00 C ATOM 54 OG SER A 0 -5.830 26.434 18.865 1.00 0.00 O ATOM 0 H SER A 0 -5.121 28.564 18.021 1.00 0.00 H new ATOM 0 HA SER A 0 -2.853 26.964 17.369 1.00 0.00 H new ATOM 0 HB2 SER A 0 -4.120 25.281 18.796 1.00 0.00 H new ATOM 0 HB3 SER A 0 -3.936 26.836 19.581 1.00 0.00 H new ATOM 0 HG SER A 0 -6.117 26.037 19.714 1.00 0.00 H new ATOM 60 N MET A 1 -5.361 26.530 15.445 1.00 0.00 N ATOM 61 CA MET A 1 -5.870 25.900 14.219 1.00 0.00 C ATOM 62 C MET A 1 -5.942 26.907 13.058 1.00 0.00 C ATOM 63 O MET A 1 -6.126 28.107 13.273 1.00 0.00 O ATOM 64 CB MET A 1 -7.257 25.285 14.483 1.00 0.00 C ATOM 65 CG MET A 1 -7.178 23.913 15.159 1.00 0.00 C ATOM 66 SD MET A 1 -6.524 22.599 14.088 1.00 0.00 S ATOM 67 CE MET A 1 -6.642 21.197 15.232 1.00 0.00 C ATOM 0 H MET A 1 -5.836 27.409 15.649 1.00 0.00 H new ATOM 0 HA MET A 1 -5.176 25.111 13.929 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.836 25.962 15.111 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.793 25.190 13.539 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.549 23.992 16.046 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.174 23.629 15.499 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.280 20.294 14.740 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.036 21.397 16.116 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.681 21.056 15.529 1.00 0.00 H new ATOM 77 N ALA A 2 -5.810 26.403 11.825 1.00 0.00 N ATOM 78 CA ALA A 2 -5.851 27.202 10.590 1.00 0.00 C ATOM 79 C ALA A 2 -6.439 26.427 9.390 1.00 0.00 C ATOM 80 O ALA A 2 -7.341 26.929 8.715 1.00 0.00 O ATOM 81 CB ALA A 2 -4.431 27.703 10.288 1.00 0.00 C ATOM 0 H ALA A 2 -5.669 25.408 11.652 1.00 0.00 H new ATOM 0 HA ALA A 2 -6.523 28.046 10.748 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.442 28.298 9.375 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -4.078 28.317 11.117 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -3.764 26.850 10.158 1.00 0.00 H new ATOM 87 N THR A 3 -5.975 25.191 9.148 1.00 0.00 N ATOM 88 CA THR A 3 -6.563 24.277 8.139 1.00 0.00 C ATOM 89 C THR A 3 -7.806 23.572 8.692 1.00 0.00 C ATOM 90 O THR A 3 -8.800 23.402 7.987 1.00 0.00 O ATOM 91 CB THR A 3 -5.520 23.255 7.646 1.00 0.00 C ATOM 92 OG1 THR A 3 -4.423 23.928 7.060 1.00 0.00 O ATOM 93 CG2 THR A 3 -6.055 22.300 6.576 1.00 0.00 C ATOM 0 H THR A 3 -5.179 24.790 9.645 1.00 0.00 H new ATOM 0 HA THR A 3 -6.874 24.878 7.284 1.00 0.00 H new ATOM 0 HB THR A 3 -5.241 22.681 8.530 1.00 0.00 H new ATOM 0 HG1 THR A 3 -3.764 23.272 6.751 1.00 0.00 H new ATOM 0 HG21 THR A 3 -5.266 21.610 6.277 1.00 0.00 H new ATOM 0 HG22 THR A 3 -6.897 21.737 6.979 1.00 0.00 H new ATOM 0 HG23 THR A 3 -6.384 22.873 5.709 1.00 0.00 H new ATOM 101 N GLU A 4 -7.756 23.228 9.981 1.00 0.00 N ATOM 102 CA GLU A 4 -8.856 22.747 10.828 1.00 0.00 C ATOM 103 C GLU A 4 -9.713 21.622 10.210 1.00 0.00 C ATOM 104 O GLU A 4 -10.857 21.829 9.792 1.00 0.00 O ATOM 105 CB GLU A 4 -9.683 23.940 11.339 1.00 0.00 C ATOM 106 CG GLU A 4 -10.443 23.543 12.609 1.00 0.00 C ATOM 107 CD GLU A 4 -11.382 24.673 13.074 1.00 0.00 C ATOM 108 OE1 GLU A 4 -10.918 25.606 13.776 1.00 0.00 O ATOM 109 OE2 GLU A 4 -12.595 24.637 12.749 1.00 0.00 O ATOM 0 H GLU A 4 -6.880 23.282 10.501 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.399 22.251 11.684 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -9.027 24.786 11.547 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -10.385 24.262 10.570 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -11.023 22.639 12.421 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.733 23.307 13.402 1.00 0.00 H new ATOM 116 N LEU A 5 -9.161 20.404 10.199 1.00 0.00 N ATOM 117 CA LEU A 5 -9.917 19.170 9.965 1.00 0.00 C ATOM 118 C LEU A 5 -9.652 18.116 11.047 1.00 0.00 C ATOM 119 O LEU A 5 -8.545 17.997 11.576 1.00 0.00 O ATOM 120 CB LEU A 5 -9.748 18.672 8.521 1.00 0.00 C ATOM 121 CG LEU A 5 -8.350 18.203 8.098 1.00 0.00 C ATOM 122 CD1 LEU A 5 -8.122 16.724 8.407 1.00 0.00 C ATOM 123 CD2 LEU A 5 -8.150 18.400 6.596 1.00 0.00 C ATOM 0 H LEU A 5 -8.165 20.246 10.354 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.979 19.395 10.064 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -10.442 17.846 8.365 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -10.052 19.475 7.849 1.00 0.00 H new ATOM 0 HG LEU A 5 -7.640 18.803 8.666 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -7.119 16.437 8.090 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.226 16.556 9.479 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -8.858 16.123 7.872 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.153 18.062 6.314 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.897 17.823 6.051 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.258 19.456 6.350 1.00 0.00 H new ATOM 135 N GLU A 6 -10.693 17.347 11.359 1.00 0.00 N ATOM 136 CA GLU A 6 -10.676 16.220 12.304 1.00 0.00 C ATOM 137 C GLU A 6 -11.305 14.966 11.658 1.00 0.00 C ATOM 138 O GLU A 6 -12.208 14.332 12.209 1.00 0.00 O ATOM 139 CB GLU A 6 -11.327 16.662 13.631 1.00 0.00 C ATOM 140 CG GLU A 6 -10.963 15.749 14.812 1.00 0.00 C ATOM 141 CD GLU A 6 -11.613 16.251 16.116 1.00 0.00 C ATOM 142 OE1 GLU A 6 -12.765 15.853 16.422 1.00 0.00 O ATOM 143 OE2 GLU A 6 -10.975 17.040 16.856 1.00 0.00 O ATOM 0 H GLU A 6 -11.614 17.494 10.945 1.00 0.00 H new ATOM 0 HA GLU A 6 -9.655 15.927 12.548 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -11.018 17.682 13.859 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -12.410 16.677 13.511 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -11.293 14.731 14.605 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -9.880 15.715 14.930 1.00 0.00 H new ATOM 150 N TYR A 7 -10.859 14.640 10.438 1.00 0.00 N ATOM 151 CA TYR A 7 -11.343 13.515 9.641 1.00 0.00 C ATOM 152 C TYR A 7 -10.227 12.833 8.840 1.00 0.00 C ATOM 153 O TYR A 7 -9.199 13.422 8.506 1.00 0.00 O ATOM 154 CB TYR A 7 -12.516 13.950 8.749 1.00 0.00 C ATOM 155 CG TYR A 7 -12.303 15.180 7.888 1.00 0.00 C ATOM 156 CD1 TYR A 7 -11.464 15.128 6.757 1.00 0.00 C ATOM 157 CD2 TYR A 7 -12.980 16.375 8.206 1.00 0.00 C ATOM 158 CE1 TYR A 7 -11.283 16.283 5.969 1.00 0.00 C ATOM 159 CE2 TYR A 7 -12.842 17.510 7.385 1.00 0.00 C ATOM 160 CZ TYR A 7 -11.993 17.467 6.259 1.00 0.00 C ATOM 161 OH TYR A 7 -11.842 18.577 5.484 1.00 0.00 O ATOM 0 H TYR A 7 -10.127 15.172 9.967 1.00 0.00 H new ATOM 0 HA TYR A 7 -11.710 12.758 10.334 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -12.771 13.117 8.094 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -13.380 14.129 9.388 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -10.962 14.208 6.495 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -13.608 16.420 9.084 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -10.595 16.261 5.137 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -13.386 18.414 7.617 1.00 0.00 H new ATOM 0 HH TYR A 7 -12.408 19.298 5.831 1.00 0.00 H new ATOM 171 N GLU A 8 -10.465 11.554 8.569 1.00 0.00 N ATOM 172 CA GLU A 8 -9.610 10.555 7.913 1.00 0.00 C ATOM 173 C GLU A 8 -10.493 9.304 7.767 1.00 0.00 C ATOM 174 O GLU A 8 -10.506 8.402 8.606 1.00 0.00 O ATOM 175 CB GLU A 8 -8.347 10.296 8.762 1.00 0.00 C ATOM 176 CG GLU A 8 -7.131 9.870 7.932 1.00 0.00 C ATOM 177 CD GLU A 8 -5.817 10.320 8.589 1.00 0.00 C ATOM 178 OE1 GLU A 8 -5.222 9.562 9.388 1.00 0.00 O ATOM 179 OE2 GLU A 8 -5.320 11.424 8.264 1.00 0.00 O ATOM 0 H GLU A 8 -11.360 11.141 8.831 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.245 10.881 6.939 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.100 11.201 9.317 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -8.565 9.521 9.497 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -7.129 8.786 7.817 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -7.204 10.297 6.932 1.00 0.00 H new ATOM 186 N SER A 9 -11.375 9.329 6.770 1.00 0.00 N ATOM 187 CA SER A 9 -12.524 8.427 6.674 1.00 0.00 C ATOM 188 C SER A 9 -12.070 7.015 6.294 1.00 0.00 C ATOM 189 O SER A 9 -11.502 6.811 5.223 1.00 0.00 O ATOM 190 CB SER A 9 -13.516 8.993 5.651 1.00 0.00 C ATOM 191 OG SER A 9 -14.839 8.629 6.009 1.00 0.00 O ATOM 0 H SER A 9 -11.312 9.987 5.993 1.00 0.00 H new ATOM 0 HA SER A 9 -13.019 8.355 7.642 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.427 10.079 5.608 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.282 8.614 4.656 1.00 0.00 H new ATOM 0 HG SER A 9 -15.468 8.995 5.353 1.00 0.00 H new ATOM 197 N VAL A 10 -12.257 6.046 7.192 1.00 0.00 N ATOM 198 CA VAL A 10 -11.684 4.690 7.076 1.00 0.00 C ATOM 199 C VAL A 10 -12.440 3.854 6.032 1.00 0.00 C ATOM 200 O VAL A 10 -13.655 3.987 5.870 1.00 0.00 O ATOM 201 CB VAL A 10 -11.642 3.987 8.453 1.00 0.00 C ATOM 202 CG1 VAL A 10 -10.952 2.617 8.396 1.00 0.00 C ATOM 203 CG2 VAL A 10 -10.879 4.821 9.494 1.00 0.00 C ATOM 0 H VAL A 10 -12.817 6.176 8.034 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.656 4.787 6.727 1.00 0.00 H new ATOM 0 HB VAL A 10 -12.687 3.868 8.737 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -10.951 2.169 9.390 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -11.490 1.967 7.705 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -9.925 2.741 8.053 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -10.871 4.294 10.448 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -9.854 4.975 9.156 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.369 5.787 9.617 1.00 0.00 H new ATOM 213 N LEU A 11 -11.710 2.984 5.325 1.00 0.00 N ATOM 214 CA LEU A 11 -12.184 2.209 4.168 1.00 0.00 C ATOM 215 C LEU A 11 -11.823 0.720 4.290 1.00 0.00 C ATOM 216 O LEU A 11 -12.643 -0.141 3.972 1.00 0.00 O ATOM 217 CB LEU A 11 -11.575 2.803 2.879 1.00 0.00 C ATOM 218 CG LEU A 11 -12.003 4.246 2.547 1.00 0.00 C ATOM 219 CD1 LEU A 11 -11.217 4.753 1.338 1.00 0.00 C ATOM 220 CD2 LEU A 11 -13.494 4.349 2.225 1.00 0.00 C ATOM 0 H LEU A 11 -10.734 2.791 5.550 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.271 2.275 4.132 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.489 2.775 2.965 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.845 2.161 2.041 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.797 4.850 3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.523 5.773 1.107 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.151 4.736 1.564 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.416 4.111 0.480 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.746 5.385 1.998 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.724 3.722 1.364 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -14.076 4.014 3.084 1.00 0.00 H new ATOM 232 N CYS A 12 -10.618 0.420 4.784 1.00 0.00 N ATOM 233 CA CYS A 12 -10.131 -0.935 5.048 1.00 0.00 C ATOM 234 C CYS A 12 -9.167 -0.933 6.236 1.00 0.00 C ATOM 235 O CYS A 12 -8.349 -0.026 6.377 1.00 0.00 O ATOM 236 CB CYS A 12 -9.439 -1.468 3.788 1.00 0.00 C ATOM 237 SG CYS A 12 -9.079 -3.239 3.935 1.00 0.00 S ATOM 0 H CYS A 12 -9.933 1.138 5.018 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.970 -1.584 5.301 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -10.075 -1.295 2.920 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.513 -0.919 3.619 1.00 0.00 H new ATOM 0 HG CYS A 12 -8.496 -3.655 2.850 1.00 0.00 H new ATOM 243 N VAL A 13 -9.242 -1.966 7.068 1.00 0.00 N ATOM 244 CA VAL A 13 -8.275 -2.260 8.137 1.00 0.00 C ATOM 245 C VAL A 13 -7.967 -3.761 8.128 1.00 0.00 C ATOM 246 O VAL A 13 -8.891 -4.578 8.162 1.00 0.00 O ATOM 247 CB VAL A 13 -8.800 -1.792 9.511 1.00 0.00 C ATOM 248 CG1 VAL A 13 -7.786 -2.061 10.632 1.00 0.00 C ATOM 249 CG2 VAL A 13 -9.099 -0.284 9.521 1.00 0.00 C ATOM 0 H VAL A 13 -9.999 -2.648 7.021 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.353 -1.708 7.954 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.713 -2.361 9.685 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.194 -1.717 11.582 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.583 -3.130 10.690 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.860 -1.527 10.421 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.466 0.008 10.505 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.187 0.269 9.296 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.856 -0.058 8.770 1.00 0.00 H new ATOM 259 N LYS A 14 -6.679 -4.127 8.076 1.00 0.00 N ATOM 260 CA LYS A 14 -6.188 -5.523 8.111 1.00 0.00 C ATOM 261 C LYS A 14 -5.044 -5.683 9.133 1.00 0.00 C ATOM 262 O LYS A 14 -4.176 -4.809 9.195 1.00 0.00 O ATOM 263 CB LYS A 14 -5.752 -6.021 6.712 1.00 0.00 C ATOM 264 CG LYS A 14 -6.832 -5.925 5.620 1.00 0.00 C ATOM 265 CD LYS A 14 -7.971 -6.938 5.785 1.00 0.00 C ATOM 266 CE LYS A 14 -9.084 -6.618 4.791 1.00 0.00 C ATOM 267 NZ LYS A 14 -10.193 -7.593 4.882 1.00 0.00 N ATOM 0 H LYS A 14 -5.924 -3.445 8.006 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.022 -6.147 8.431 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.883 -5.446 6.393 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.433 -7.060 6.796 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.250 -4.918 5.623 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.365 -6.073 4.646 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.600 -7.949 5.618 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.358 -6.904 6.804 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.465 -5.614 4.981 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.680 -6.619 3.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.856 -7.439 4.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.811 -8.559 4.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.692 -7.468 5.786 1.00 0.00 H new ATOM 281 N PRO A 15 -5.009 -6.772 9.923 1.00 0.00 N ATOM 282 CA PRO A 15 -4.091 -6.912 11.061 1.00 0.00 C ATOM 283 C PRO A 15 -2.660 -7.352 10.712 1.00 0.00 C ATOM 284 O PRO A 15 -1.770 -7.215 11.550 1.00 0.00 O ATOM 285 CB PRO A 15 -4.742 -7.960 11.964 1.00 0.00 C ATOM 286 CG PRO A 15 -5.503 -8.845 10.978 1.00 0.00 C ATOM 287 CD PRO A 15 -5.991 -7.849 9.935 1.00 0.00 C ATOM 0 HA PRO A 15 -3.957 -5.933 11.520 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -3.998 -8.527 12.524 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.410 -7.503 12.694 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -4.859 -9.607 10.539 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.331 -9.366 11.458 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -6.069 -8.317 8.954 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -6.982 -7.472 10.188 1.00 0.00 H new ATOM 295 N ASP A 16 -2.429 -7.902 9.515 1.00 0.00 N ATOM 296 CA ASP A 16 -1.144 -8.490 9.116 1.00 0.00 C ATOM 297 C ASP A 16 -0.714 -8.002 7.726 1.00 0.00 C ATOM 298 O ASP A 16 -1.270 -8.409 6.700 1.00 0.00 O ATOM 299 CB ASP A 16 -1.228 -10.023 9.163 1.00 0.00 C ATOM 300 CG ASP A 16 -1.209 -10.565 10.603 1.00 0.00 C ATOM 301 OD1 ASP A 16 -2.277 -10.972 11.118 1.00 0.00 O ATOM 302 OD2 ASP A 16 -0.111 -10.618 11.208 1.00 0.00 O ATOM 0 H ASP A 16 -3.139 -7.952 8.785 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.382 -8.162 9.823 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -2.141 -10.350 8.666 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.393 -10.448 8.606 1.00 0.00 H new ATOM 307 N VAL A 17 0.302 -7.137 7.706 1.00 0.00 N ATOM 308 CA VAL A 17 0.974 -6.638 6.498 1.00 0.00 C ATOM 309 C VAL A 17 2.476 -6.461 6.758 1.00 0.00 C ATOM 310 O VAL A 17 2.889 -6.070 7.855 1.00 0.00 O ATOM 311 CB VAL A 17 0.294 -5.354 5.967 1.00 0.00 C ATOM 312 CG1 VAL A 17 0.461 -4.135 6.880 1.00 0.00 C ATOM 313 CG2 VAL A 17 0.789 -4.970 4.571 1.00 0.00 C ATOM 0 H VAL A 17 0.697 -6.748 8.562 1.00 0.00 H new ATOM 0 HA VAL A 17 0.874 -7.379 5.705 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.763 -5.617 5.934 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.044 -3.277 6.437 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.025 -4.349 7.856 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.521 -3.911 6.998 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.282 -4.063 4.242 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.864 -4.794 4.602 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.573 -5.779 3.873 1.00 0.00 H new ATOM 323 N SER A 18 3.296 -6.764 5.751 1.00 0.00 N ATOM 324 CA SER A 18 4.762 -6.826 5.861 1.00 0.00 C ATOM 325 C SER A 18 5.440 -5.949 4.811 1.00 0.00 C ATOM 326 O SER A 18 5.134 -6.082 3.629 1.00 0.00 O ATOM 327 CB SER A 18 5.228 -8.278 5.694 1.00 0.00 C ATOM 328 OG SER A 18 4.638 -9.120 6.674 1.00 0.00 O ATOM 0 H SER A 18 2.956 -6.979 4.813 1.00 0.00 H new ATOM 0 HA SER A 18 5.043 -6.453 6.846 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.966 -8.635 4.698 1.00 0.00 H new ATOM 0 HB3 SER A 18 6.314 -8.326 5.775 1.00 0.00 H new ATOM 0 HG SER A 18 4.950 -10.040 6.545 1.00 0.00 H new ATOM 334 N VAL A 19 6.356 -5.067 5.223 1.00 0.00 N ATOM 335 CA VAL A 19 7.090 -4.133 4.347 1.00 0.00 C ATOM 336 C VAL A 19 8.428 -4.697 3.905 1.00 0.00 C ATOM 337 O VAL A 19 9.211 -5.196 4.715 1.00 0.00 O ATOM 338 CB VAL A 19 7.282 -2.747 4.994 1.00 0.00 C ATOM 339 CG1 VAL A 19 8.205 -1.810 4.193 1.00 0.00 C ATOM 340 CG2 VAL A 19 5.937 -2.031 5.111 1.00 0.00 C ATOM 0 H VAL A 19 6.619 -4.976 6.204 1.00 0.00 H new ATOM 0 HA VAL A 19 6.467 -4.004 3.462 1.00 0.00 H new ATOM 0 HB VAL A 19 7.737 -2.947 5.964 1.00 0.00 H new ATOM 0 HG11 VAL A 19 8.291 -0.855 4.711 1.00 0.00 H new ATOM 0 HG12 VAL A 19 9.192 -2.263 4.101 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.786 -1.648 3.200 1.00 0.00 H new ATOM 0 HG21 VAL A 19 6.084 -1.053 5.569 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.504 -1.905 4.119 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.262 -2.623 5.729 1.00 0.00 H new ATOM 350 N TYR A 20 8.722 -4.504 2.624 1.00 0.00 N ATOM 351 CA TYR A 20 10.028 -4.728 2.024 1.00 0.00 C ATOM 352 C TYR A 20 10.425 -3.487 1.216 1.00 0.00 C ATOM 353 O TYR A 20 9.693 -3.044 0.327 1.00 0.00 O ATOM 354 CB TYR A 20 10.021 -5.996 1.151 1.00 0.00 C ATOM 355 CG TYR A 20 8.994 -7.054 1.517 1.00 0.00 C ATOM 356 CD1 TYR A 20 9.278 -8.007 2.510 1.00 0.00 C ATOM 357 CD2 TYR A 20 7.738 -7.057 0.882 1.00 0.00 C ATOM 358 CE1 TYR A 20 8.309 -8.958 2.881 1.00 0.00 C ATOM 359 CE2 TYR A 20 6.768 -8.012 1.240 1.00 0.00 C ATOM 360 CZ TYR A 20 7.048 -8.962 2.245 1.00 0.00 C ATOM 361 OH TYR A 20 6.105 -9.885 2.585 1.00 0.00 O ATOM 0 H TYR A 20 8.030 -4.175 1.951 1.00 0.00 H new ATOM 0 HA TYR A 20 10.768 -4.889 2.808 1.00 0.00 H new ATOM 0 HB2 TYR A 20 9.853 -5.699 0.116 1.00 0.00 H new ATOM 0 HB3 TYR A 20 11.011 -6.449 1.196 1.00 0.00 H new ATOM 0 HD1 TYR A 20 10.245 -8.010 2.991 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.518 -6.325 0.119 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.529 -9.683 3.650 1.00 0.00 H new ATOM 0 HE2 TYR A 20 5.808 -8.018 0.745 1.00 0.00 H new ATOM 0 HH TYR A 20 6.218 -10.137 3.525 1.00 0.00 H new ATOM 371 N ARG A 21 11.595 -2.918 1.503 1.00 0.00 N ATOM 372 CA ARG A 21 12.208 -1.862 0.679 1.00 0.00 C ATOM 373 C ARG A 21 12.692 -2.461 -0.651 1.00 0.00 C ATOM 374 O ARG A 21 13.637 -3.251 -0.684 1.00 0.00 O ATOM 375 CB ARG A 21 13.333 -1.151 1.455 1.00 0.00 C ATOM 376 CG ARG A 21 12.870 -0.425 2.734 1.00 0.00 C ATOM 377 CD ARG A 21 11.759 0.604 2.479 1.00 0.00 C ATOM 378 NE ARG A 21 11.468 1.406 3.686 1.00 0.00 N ATOM 379 CZ ARG A 21 11.986 2.578 4.015 1.00 0.00 C ATOM 380 NH1 ARG A 21 11.605 3.187 5.101 1.00 0.00 N ATOM 381 NH2 ARG A 21 12.889 3.173 3.286 1.00 0.00 N ATOM 0 H ARG A 21 12.153 -3.174 2.318 1.00 0.00 H new ATOM 0 HA ARG A 21 11.465 -1.100 0.445 1.00 0.00 H new ATOM 0 HB2 ARG A 21 14.091 -1.886 1.724 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.811 -0.427 0.795 1.00 0.00 H new ATOM 0 HG2 ARG A 21 12.515 -1.162 3.454 1.00 0.00 H new ATOM 0 HG3 ARG A 21 13.724 0.078 3.188 1.00 0.00 H new ATOM 0 HD2 ARG A 21 12.056 1.266 1.665 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.854 0.090 2.157 1.00 0.00 H new ATOM 0 HE ARG A 21 10.791 1.011 4.339 1.00 0.00 H new ATOM 0 HH11 ARG A 21 10.902 2.761 5.705 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.009 4.090 5.348 1.00 0.00 H new ATOM 0 HH21 ARG A 21 13.221 2.735 2.427 1.00 0.00 H new ATOM 0 HH22 ARG A 21 13.263 4.077 3.575 1.00 0.00 H new ATOM 395 N ILE A 22 12.000 -2.115 -1.737 1.00 0.00 N ATOM 396 CA ILE A 22 12.174 -2.707 -3.074 1.00 0.00 C ATOM 397 C ILE A 22 13.413 -2.170 -3.823 1.00 0.00 C ATOM 398 O ILE A 22 13.829 -1.030 -3.583 1.00 0.00 O ATOM 399 CB ILE A 22 10.901 -2.508 -3.935 1.00 0.00 C ATOM 400 CG1 ILE A 22 10.562 -1.014 -4.141 1.00 0.00 C ATOM 401 CG2 ILE A 22 9.719 -3.285 -3.332 1.00 0.00 C ATOM 402 CD1 ILE A 22 9.347 -0.787 -5.041 1.00 0.00 C ATOM 0 H ILE A 22 11.280 -1.393 -1.715 1.00 0.00 H new ATOM 0 HA ILE A 22 12.340 -3.772 -2.913 1.00 0.00 H new ATOM 0 HB ILE A 22 11.104 -2.913 -4.926 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.377 -0.554 -3.170 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.425 -0.509 -4.574 1.00 0.00 H new ATOM 0 HG21 ILE A 22 8.833 -3.135 -3.948 1.00 0.00 H new ATOM 0 HG22 ILE A 22 9.961 -4.347 -3.298 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.524 -2.924 -2.322 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.165 0.283 -5.143 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.537 -1.218 -6.024 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.472 -1.263 -4.598 1.00 0.00 H new ATOM 414 N PRO A 23 13.970 -2.933 -4.786 1.00 0.00 N ATOM 415 CA PRO A 23 14.808 -2.370 -5.847 1.00 0.00 C ATOM 416 C PRO A 23 13.977 -1.468 -6.793 1.00 0.00 C ATOM 417 O PRO A 23 12.750 -1.616 -6.860 1.00 0.00 O ATOM 418 CB PRO A 23 15.382 -3.586 -6.582 1.00 0.00 C ATOM 419 CG PRO A 23 14.279 -4.634 -6.433 1.00 0.00 C ATOM 420 CD PRO A 23 13.718 -4.348 -5.040 1.00 0.00 C ATOM 0 HA PRO A 23 15.597 -1.730 -5.454 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.588 -3.364 -7.629 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.319 -3.921 -6.137 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.516 -4.529 -7.204 1.00 0.00 H new ATOM 0 HG3 PRO A 23 14.673 -5.648 -6.509 1.00 0.00 H new ATOM 0 HD2 PRO A 23 12.651 -4.568 -4.997 1.00 0.00 H new ATOM 0 HD3 PRO A 23 14.203 -4.971 -4.289 1.00 0.00 H new ATOM 428 N PRO A 24 14.606 -0.550 -7.553 1.00 0.00 N ATOM 429 CA PRO A 24 13.910 0.264 -8.553 1.00 0.00 C ATOM 430 C PRO A 24 13.305 -0.599 -9.676 1.00 0.00 C ATOM 431 O PRO A 24 13.836 -1.662 -10.022 1.00 0.00 O ATOM 432 CB PRO A 24 14.958 1.251 -9.079 1.00 0.00 C ATOM 433 CG PRO A 24 16.278 0.507 -8.872 1.00 0.00 C ATOM 434 CD PRO A 24 16.035 -0.269 -7.579 1.00 0.00 C ATOM 0 HA PRO A 24 13.059 0.789 -8.120 1.00 0.00 H new ATOM 0 HB2 PRO A 24 14.792 1.492 -10.129 1.00 0.00 H new ATOM 0 HB3 PRO A 24 14.936 2.192 -8.529 1.00 0.00 H new ATOM 0 HG2 PRO A 24 16.502 -0.158 -9.706 1.00 0.00 H new ATOM 0 HG3 PRO A 24 17.119 1.195 -8.778 1.00 0.00 H new ATOM 0 HD2 PRO A 24 16.616 -1.191 -7.560 1.00 0.00 H new ATOM 0 HD3 PRO A 24 16.335 0.315 -6.709 1.00 0.00 H new ATOM 442 N ARG A 25 12.187 -0.143 -10.259 1.00 0.00 N ATOM 443 CA ARG A 25 11.441 -0.882 -11.296 1.00 0.00 C ATOM 444 C ARG A 25 12.246 -1.033 -12.591 1.00 0.00 C ATOM 445 O ARG A 25 12.985 -0.134 -13.001 1.00 0.00 O ATOM 446 CB ARG A 25 10.097 -0.184 -11.587 1.00 0.00 C ATOM 447 CG ARG A 25 9.005 -1.096 -12.187 1.00 0.00 C ATOM 448 CD ARG A 25 7.883 -0.322 -12.896 1.00 0.00 C ATOM 449 NE ARG A 25 7.214 0.670 -12.024 1.00 0.00 N ATOM 450 CZ ARG A 25 7.477 1.961 -11.924 1.00 0.00 C ATOM 451 NH1 ARG A 25 6.852 2.692 -11.052 1.00 0.00 N ATOM 452 NH2 ARG A 25 8.358 2.561 -12.678 1.00 0.00 N ATOM 0 H ARG A 25 11.769 0.757 -10.024 1.00 0.00 H new ATOM 0 HA ARG A 25 11.254 -1.883 -10.908 1.00 0.00 H new ATOM 0 HB2 ARG A 25 9.720 0.247 -10.659 1.00 0.00 H new ATOM 0 HB3 ARG A 25 10.276 0.644 -12.273 1.00 0.00 H new ATOM 0 HG2 ARG A 25 9.466 -1.783 -12.896 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.571 -1.702 -11.392 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.297 0.189 -13.765 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.141 -1.029 -13.266 1.00 0.00 H new ATOM 0 HE ARG A 25 6.463 0.316 -11.432 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.154 2.270 -10.440 1.00 0.00 H new ATOM 0 HH12 ARG A 25 7.059 3.688 -10.979 1.00 0.00 H new ATOM 0 HH21 ARG A 25 8.875 2.030 -13.379 1.00 0.00 H new ATOM 0 HH22 ARG A 25 8.529 3.560 -12.566 1.00 0.00 H new ATOM 466 N ALA A 26 12.014 -2.152 -13.268 1.00 0.00 N ATOM 467 CA ALA A 26 12.318 -2.338 -14.683 1.00 0.00 C ATOM 468 C ALA A 26 11.468 -1.424 -15.598 1.00 0.00 C ATOM 469 O ALA A 26 10.577 -0.697 -15.150 1.00 0.00 O ATOM 470 CB ALA A 26 12.056 -3.815 -14.986 1.00 0.00 C ATOM 0 H ALA A 26 11.598 -2.977 -12.837 1.00 0.00 H new ATOM 0 HA ALA A 26 13.353 -2.063 -14.884 1.00 0.00 H new ATOM 0 HB1 ALA A 26 12.268 -4.014 -16.037 1.00 0.00 H new ATOM 0 HB2 ALA A 26 12.701 -4.434 -14.362 1.00 0.00 H new ATOM 0 HB3 ALA A 26 11.013 -4.050 -14.775 1.00 0.00 H new ATOM 476 N SER A 27 11.720 -1.511 -16.903 1.00 0.00 N ATOM 477 CA SER A 27 11.020 -0.752 -17.956 1.00 0.00 C ATOM 478 C SER A 27 9.860 -1.541 -18.575 1.00 0.00 C ATOM 479 O SER A 27 8.796 -0.981 -18.847 1.00 0.00 O ATOM 480 CB SER A 27 12.028 -0.343 -19.037 1.00 0.00 C ATOM 481 OG SER A 27 12.635 -1.494 -19.615 1.00 0.00 O ATOM 0 H SER A 27 12.440 -2.130 -17.276 1.00 0.00 H new ATOM 0 HA SER A 27 10.583 0.135 -17.497 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.525 0.237 -19.811 1.00 0.00 H new ATOM 0 HB3 SER A 27 12.794 0.300 -18.604 1.00 0.00 H new ATOM 0 HG SER A 27 13.274 -1.216 -20.304 1.00 0.00 H new ATOM 487 N ASN A 28 10.059 -2.850 -18.772 1.00 0.00 N ATOM 488 CA ASN A 28 9.126 -3.770 -19.435 1.00 0.00 C ATOM 489 C ASN A 28 8.788 -5.022 -18.592 1.00 0.00 C ATOM 490 O ASN A 28 7.976 -5.843 -19.029 1.00 0.00 O ATOM 491 CB ASN A 28 9.721 -4.149 -20.808 1.00 0.00 C ATOM 492 CG ASN A 28 9.690 -3.009 -21.815 1.00 0.00 C ATOM 493 OD1 ASN A 28 8.783 -2.894 -22.628 1.00 0.00 O ATOM 494 ND2 ASN A 28 10.668 -2.130 -21.808 1.00 0.00 N ATOM 0 H ASN A 28 10.911 -3.317 -18.461 1.00 0.00 H new ATOM 0 HA ASN A 28 8.171 -3.260 -19.562 1.00 0.00 H new ATOM 0 HB2 ASN A 28 10.752 -4.475 -20.671 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.169 -4.997 -21.213 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.666 -1.360 -22.477 1.00 0.00 H new ATOM 0 HD22 ASN A 28 11.428 -2.218 -21.134 1.00 0.00 H new ATOM 501 N ARG A 29 9.396 -5.196 -17.403 1.00 0.00 N ATOM 502 CA ARG A 29 9.201 -6.377 -16.533 1.00 0.00 C ATOM 503 C ARG A 29 8.243 -6.122 -15.381 1.00 0.00 C ATOM 504 O ARG A 29 7.286 -6.880 -15.232 1.00 0.00 O ATOM 505 CB ARG A 29 10.539 -6.965 -16.037 1.00 0.00 C ATOM 506 CG ARG A 29 11.529 -7.326 -17.155 1.00 0.00 C ATOM 507 CD ARG A 29 10.853 -8.207 -18.208 1.00 0.00 C ATOM 508 NE ARG A 29 11.818 -8.718 -19.200 1.00 0.00 N ATOM 509 CZ ARG A 29 11.536 -9.404 -20.294 1.00 0.00 C ATOM 510 NH1 ARG A 29 12.489 -9.798 -21.088 1.00 0.00 N ATOM 511 NH2 ARG A 29 10.313 -9.713 -20.623 1.00 0.00 N ATOM 0 H ARG A 29 10.045 -4.513 -17.013 1.00 0.00 H new ATOM 0 HA ARG A 29 8.728 -7.129 -17.165 1.00 0.00 H new ATOM 0 HB2 ARG A 29 11.012 -6.246 -15.368 1.00 0.00 H new ATOM 0 HB3 ARG A 29 10.333 -7.859 -15.449 1.00 0.00 H new ATOM 0 HG2 ARG A 29 11.906 -6.416 -17.622 1.00 0.00 H new ATOM 0 HG3 ARG A 29 12.388 -7.848 -16.733 1.00 0.00 H new ATOM 0 HD2 ARG A 29 10.359 -9.045 -17.717 1.00 0.00 H new ATOM 0 HD3 ARG A 29 10.078 -7.634 -18.717 1.00 0.00 H new ATOM 0 HE ARG A 29 12.803 -8.522 -19.024 1.00 0.00 H new ATOM 0 HH11 ARG A 29 13.460 -9.578 -20.868 1.00 0.00 H new ATOM 0 HH12 ARG A 29 12.265 -10.327 -21.931 1.00 0.00 H new ATOM 0 HH21 ARG A 29 9.536 -9.424 -20.028 1.00 0.00 H new ATOM 0 HH22 ARG A 29 10.133 -10.244 -21.475 1.00 0.00 H new ATOM 525 N GLY A 30 8.460 -5.067 -14.589 1.00 0.00 N ATOM 526 CA GLY A 30 7.639 -4.804 -13.426 1.00 0.00 C ATOM 527 C GLY A 30 8.116 -5.589 -12.210 1.00 0.00 C ATOM 528 O GLY A 30 9.027 -6.423 -12.273 1.00 0.00 O ATOM 0 H GLY A 30 9.203 -4.385 -14.742 1.00 0.00 H new ATOM 0 HA2 GLY A 30 7.658 -3.738 -13.201 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.604 -5.065 -13.645 1.00 0.00 H new ATOM 532 N TYR A 31 7.497 -5.286 -11.080 1.00 0.00 N ATOM 533 CA TYR A 31 7.700 -5.976 -9.815 1.00 0.00 C ATOM 534 C TYR A 31 7.051 -7.364 -9.844 1.00 0.00 C ATOM 535 O TYR A 31 5.952 -7.523 -10.361 1.00 0.00 O ATOM 536 CB TYR A 31 7.090 -5.138 -8.694 1.00 0.00 C ATOM 537 CG TYR A 31 7.472 -3.669 -8.664 1.00 0.00 C ATOM 538 CD1 TYR A 31 6.496 -2.724 -8.298 1.00 0.00 C ATOM 539 CD2 TYR A 31 8.783 -3.244 -8.966 1.00 0.00 C ATOM 540 CE1 TYR A 31 6.826 -1.362 -8.199 1.00 0.00 C ATOM 541 CE2 TYR A 31 9.135 -1.895 -8.772 1.00 0.00 C ATOM 542 CZ TYR A 31 8.155 -0.943 -8.410 1.00 0.00 C ATOM 543 OH TYR A 31 8.495 0.367 -8.271 1.00 0.00 O ATOM 0 H TYR A 31 6.817 -4.528 -11.016 1.00 0.00 H new ATOM 0 HA TYR A 31 8.769 -6.106 -9.644 1.00 0.00 H new ATOM 0 HB2 TYR A 31 6.005 -5.207 -8.768 1.00 0.00 H new ATOM 0 HB3 TYR A 31 7.374 -5.584 -7.741 1.00 0.00 H new ATOM 0 HD1 TYR A 31 5.487 -3.048 -8.092 1.00 0.00 H new ATOM 0 HD2 TYR A 31 9.510 -3.948 -9.343 1.00 0.00 H new ATOM 0 HE1 TYR A 31 6.062 -0.637 -7.961 1.00 0.00 H new ATOM 0 HE2 TYR A 31 10.162 -1.585 -8.901 1.00 0.00 H new ATOM 0 HH TYR A 31 9.452 0.478 -8.452 1.00 0.00 H new ATOM 553 N ARG A 32 7.692 -8.369 -9.249 1.00 0.00 N ATOM 554 CA ARG A 32 7.275 -9.790 -9.329 1.00 0.00 C ATOM 555 C ARG A 32 7.178 -10.493 -7.981 1.00 0.00 C ATOM 556 O ARG A 32 7.174 -11.719 -7.938 1.00 0.00 O ATOM 557 CB ARG A 32 8.111 -10.577 -10.367 1.00 0.00 C ATOM 558 CG ARG A 32 9.641 -10.448 -10.260 1.00 0.00 C ATOM 559 CD ARG A 32 10.152 -9.208 -11.009 1.00 0.00 C ATOM 560 NE ARG A 32 11.615 -9.066 -10.950 1.00 0.00 N ATOM 561 CZ ARG A 32 12.334 -8.153 -11.574 1.00 0.00 C ATOM 562 NH1 ARG A 32 13.624 -8.162 -11.423 1.00 0.00 N ATOM 563 NH2 ARG A 32 11.804 -7.226 -12.321 1.00 0.00 N ATOM 0 H ARG A 32 8.531 -8.229 -8.686 1.00 0.00 H new ATOM 0 HA ARG A 32 6.248 -9.774 -9.693 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.851 -11.632 -10.284 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.811 -10.252 -11.363 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.930 -10.386 -9.211 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.113 -11.342 -10.668 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.839 -9.265 -12.052 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.688 -8.317 -10.585 1.00 0.00 H new ATOM 0 HE ARG A 32 12.121 -9.737 -10.372 1.00 0.00 H new ATOM 0 HH11 ARG A 32 14.063 -8.867 -10.830 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.198 -7.465 -11.897 1.00 0.00 H new ATOM 0 HH21 ARG A 32 10.792 -7.186 -12.443 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.401 -6.541 -12.784 1.00 0.00 H new ATOM 577 N ALA A 33 7.084 -9.716 -6.903 1.00 0.00 N ATOM 578 CA ALA A 33 7.091 -10.123 -5.494 1.00 0.00 C ATOM 579 C ALA A 33 8.348 -10.896 -5.033 1.00 0.00 C ATOM 580 O ALA A 33 8.990 -10.507 -4.059 1.00 0.00 O ATOM 581 CB ALA A 33 5.777 -10.862 -5.227 1.00 0.00 C ATOM 0 H ALA A 33 6.994 -8.704 -6.997 1.00 0.00 H new ATOM 0 HA ALA A 33 7.154 -9.228 -4.875 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.745 -11.182 -4.185 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.938 -10.196 -5.429 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.712 -11.735 -5.877 1.00 0.00 H new ATOM 587 N SER A 34 8.759 -11.938 -5.759 1.00 0.00 N ATOM 588 CA SER A 34 9.905 -12.810 -5.458 1.00 0.00 C ATOM 589 C SER A 34 11.271 -12.110 -5.533 1.00 0.00 C ATOM 590 O SER A 34 12.262 -12.639 -5.026 1.00 0.00 O ATOM 591 CB SER A 34 9.905 -14.016 -6.405 1.00 0.00 C ATOM 592 OG SER A 34 8.698 -14.754 -6.275 1.00 0.00 O ATOM 0 H SER A 34 8.280 -12.213 -6.616 1.00 0.00 H new ATOM 0 HA SER A 34 9.774 -13.121 -4.422 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.021 -13.677 -7.434 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.757 -14.659 -6.183 1.00 0.00 H new ATOM 0 HG SER A 34 8.715 -15.519 -6.888 1.00 0.00 H new ATOM 598 N ASP A 35 11.337 -10.920 -6.138 1.00 0.00 N ATOM 599 CA ASP A 35 12.538 -10.069 -6.144 1.00 0.00 C ATOM 600 C ASP A 35 12.735 -9.301 -4.817 1.00 0.00 C ATOM 601 O ASP A 35 13.819 -8.774 -4.558 1.00 0.00 O ATOM 602 CB ASP A 35 12.468 -9.099 -7.339 1.00 0.00 C ATOM 603 CG ASP A 35 13.766 -9.116 -8.159 1.00 0.00 C ATOM 604 OD1 ASP A 35 13.799 -9.819 -9.197 1.00 0.00 O ATOM 605 OD2 ASP A 35 14.735 -8.407 -7.804 1.00 0.00 O ATOM 0 H ASP A 35 10.550 -10.513 -6.644 1.00 0.00 H new ATOM 0 HA ASP A 35 13.407 -10.718 -6.247 1.00 0.00 H new ATOM 0 HB2 ASP A 35 11.629 -9.370 -7.980 1.00 0.00 H new ATOM 0 HB3 ASP A 35 12.279 -8.088 -6.977 1.00 0.00 H new ATOM 610 N TRP A 36 11.697 -9.223 -3.973 1.00 0.00 N ATOM 611 CA TRP A 36 11.697 -8.520 -2.695 1.00 0.00 C ATOM 612 C TRP A 36 12.150 -9.442 -1.545 1.00 0.00 C ATOM 613 O TRP A 36 12.304 -10.657 -1.699 1.00 0.00 O ATOM 614 CB TRP A 36 10.290 -7.954 -2.428 1.00 0.00 C ATOM 615 CG TRP A 36 9.562 -7.202 -3.515 1.00 0.00 C ATOM 616 CD1 TRP A 36 10.060 -6.706 -4.677 1.00 0.00 C ATOM 617 CD2 TRP A 36 8.152 -6.819 -3.505 1.00 0.00 C ATOM 618 NE1 TRP A 36 9.057 -6.063 -5.383 1.00 0.00 N ATOM 619 CE2 TRP A 36 7.878 -6.054 -4.677 1.00 0.00 C ATOM 620 CE3 TRP A 36 7.080 -7.026 -2.610 1.00 0.00 C ATOM 621 CZ2 TRP A 36 6.627 -5.480 -4.922 1.00 0.00 C ATOM 622 CZ3 TRP A 36 5.819 -6.444 -2.840 1.00 0.00 C ATOM 623 CH2 TRP A 36 5.594 -5.675 -3.993 1.00 0.00 C ATOM 0 H TRP A 36 10.802 -9.668 -4.176 1.00 0.00 H new ATOM 0 HA TRP A 36 12.412 -7.699 -2.745 1.00 0.00 H new ATOM 0 HB2 TRP A 36 9.656 -8.789 -2.130 1.00 0.00 H new ATOM 0 HB3 TRP A 36 10.366 -7.289 -1.568 1.00 0.00 H new ATOM 0 HD1 TRP A 36 11.086 -6.799 -5.002 1.00 0.00 H new ATOM 0 HE1 TRP A 36 9.178 -5.650 -6.308 1.00 0.00 H new ATOM 0 HE3 TRP A 36 7.230 -7.641 -1.735 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 6.458 -4.895 -5.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 5.021 -6.590 -2.127 1.00 0.00 H new ATOM 0 HH2 TRP A 36 4.624 -5.233 -4.165 1.00 0.00 H new ATOM 634 N LYS A 37 12.336 -8.862 -0.356 1.00 0.00 N ATOM 635 CA LYS A 37 12.832 -9.540 0.860 1.00 0.00 C ATOM 636 C LYS A 37 11.756 -10.326 1.621 1.00 0.00 C ATOM 637 O LYS A 37 11.564 -10.142 2.822 1.00 0.00 O ATOM 638 CB LYS A 37 13.553 -8.530 1.763 1.00 0.00 C ATOM 639 CG LYS A 37 14.862 -8.025 1.147 1.00 0.00 C ATOM 640 CD LYS A 37 15.754 -7.314 2.170 1.00 0.00 C ATOM 641 CE LYS A 37 14.985 -6.283 3.002 1.00 0.00 C ATOM 642 NZ LYS A 37 15.892 -5.515 3.890 1.00 0.00 N ATOM 0 H LYS A 37 12.141 -7.873 -0.201 1.00 0.00 H new ATOM 0 HA LYS A 37 13.543 -10.298 0.532 1.00 0.00 H new ATOM 0 HB2 LYS A 37 12.894 -7.683 1.954 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.763 -8.994 2.727 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.406 -8.866 0.717 1.00 0.00 H new ATOM 0 HG3 LYS A 37 14.635 -7.341 0.329 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.199 -8.054 2.835 1.00 0.00 H new ATOM 0 HD3 LYS A 37 16.574 -6.818 1.650 1.00 0.00 H new ATOM 0 HE2 LYS A 37 14.458 -5.598 2.338 1.00 0.00 H new ATOM 0 HE3 LYS A 37 14.229 -6.789 3.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 15.429 -4.629 4.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 16.111 -6.080 4.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.773 -5.297 3.382 1.00 0.00 H new ATOM 656 N LEU A 38 11.073 -11.238 0.935 1.00 0.00 N ATOM 657 CA LEU A 38 9.902 -11.967 1.454 1.00 0.00 C ATOM 658 C LEU A 38 10.162 -12.821 2.713 1.00 0.00 C ATOM 659 O LEU A 38 9.212 -13.180 3.410 1.00 0.00 O ATOM 660 CB LEU A 38 9.315 -12.849 0.338 1.00 0.00 C ATOM 661 CG LEU A 38 8.908 -12.099 -0.942 1.00 0.00 C ATOM 662 CD1 LEU A 38 8.238 -13.094 -1.892 1.00 0.00 C ATOM 663 CD2 LEU A 38 7.941 -10.949 -0.670 1.00 0.00 C ATOM 0 H LEU A 38 11.318 -11.502 -0.019 1.00 0.00 H new ATOM 0 HA LEU A 38 9.196 -11.200 1.772 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.048 -13.612 0.076 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.440 -13.369 0.729 1.00 0.00 H new ATOM 0 HG LEU A 38 9.810 -11.669 -1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.942 -12.581 -2.807 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.938 -13.893 -2.135 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.356 -13.518 -1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.689 -10.456 -1.609 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.033 -11.338 -0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.410 -10.231 0.002 1.00 0.00 H new ATOM 675 N ASP A 39 11.426 -13.128 3.024 1.00 0.00 N ATOM 676 CA ASP A 39 11.831 -13.892 4.216 1.00 0.00 C ATOM 677 C ASP A 39 12.481 -13.011 5.309 1.00 0.00 C ATOM 678 O ASP A 39 12.780 -13.490 6.404 1.00 0.00 O ATOM 679 CB ASP A 39 12.724 -15.063 3.769 1.00 0.00 C ATOM 680 CG ASP A 39 12.939 -16.115 4.873 1.00 0.00 C ATOM 681 OD1 ASP A 39 14.108 -16.469 5.166 1.00 0.00 O ATOM 682 OD2 ASP A 39 11.937 -16.649 5.410 1.00 0.00 O ATOM 0 H ASP A 39 12.216 -12.847 2.443 1.00 0.00 H new ATOM 0 HA ASP A 39 10.940 -14.294 4.699 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.274 -15.544 2.900 1.00 0.00 H new ATOM 0 HB3 ASP A 39 13.692 -14.674 3.453 1.00 0.00 H new ATOM 687 N GLN A 40 12.673 -11.713 5.030 1.00 0.00 N ATOM 688 CA GLN A 40 13.217 -10.718 5.968 1.00 0.00 C ATOM 689 C GLN A 40 12.620 -9.309 5.728 1.00 0.00 C ATOM 690 O GLN A 40 13.320 -8.422 5.223 1.00 0.00 O ATOM 691 CB GLN A 40 14.767 -10.747 5.996 1.00 0.00 C ATOM 692 CG GLN A 40 15.539 -10.735 4.664 1.00 0.00 C ATOM 693 CD GLN A 40 15.510 -12.061 3.903 1.00 0.00 C ATOM 694 OE1 GLN A 40 15.728 -13.135 4.445 1.00 0.00 O ATOM 695 NE2 GLN A 40 15.268 -12.044 2.607 1.00 0.00 N ATOM 0 H GLN A 40 12.448 -11.314 4.119 1.00 0.00 H new ATOM 0 HA GLN A 40 12.900 -10.997 6.973 1.00 0.00 H new ATOM 0 HB2 GLN A 40 15.101 -9.888 6.578 1.00 0.00 H new ATOM 0 HB3 GLN A 40 15.069 -11.640 6.543 1.00 0.00 H new ATOM 0 HG2 GLN A 40 15.125 -9.955 4.025 1.00 0.00 H new ATOM 0 HG3 GLN A 40 16.577 -10.467 4.862 1.00 0.00 H new ATOM 0 HE21 GLN A 40 15.084 -11.159 2.134 1.00 0.00 H new ATOM 0 HE22 GLN A 40 15.265 -12.916 2.077 1.00 0.00 H new ATOM 704 N PRO A 41 11.333 -9.072 6.077 1.00 0.00 N ATOM 705 CA PRO A 41 10.719 -7.744 6.018 1.00 0.00 C ATOM 706 C PRO A 41 11.483 -6.709 6.851 1.00 0.00 C ATOM 707 O PRO A 41 11.992 -6.997 7.939 1.00 0.00 O ATOM 708 CB PRO A 41 9.267 -7.904 6.502 1.00 0.00 C ATOM 709 CG PRO A 41 9.313 -9.186 7.331 1.00 0.00 C ATOM 710 CD PRO A 41 10.382 -10.026 6.633 1.00 0.00 C ATOM 0 HA PRO A 41 10.748 -7.363 4.997 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.945 -7.050 7.099 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.572 -7.989 5.667 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.577 -8.983 8.369 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.348 -9.692 7.340 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.870 -10.701 7.336 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.944 -10.644 5.849 1.00 0.00 H new ATOM 718 N ASP A 42 11.531 -5.478 6.346 1.00 0.00 N ATOM 719 CA ASP A 42 12.122 -4.321 7.024 1.00 0.00 C ATOM 720 C ASP A 42 11.266 -3.860 8.217 1.00 0.00 C ATOM 721 O ASP A 42 11.793 -3.336 9.201 1.00 0.00 O ATOM 722 CB ASP A 42 12.285 -3.185 6.006 1.00 0.00 C ATOM 723 CG ASP A 42 13.319 -3.550 4.938 1.00 0.00 C ATOM 724 OD1 ASP A 42 14.536 -3.501 5.234 1.00 0.00 O ATOM 725 OD2 ASP A 42 12.923 -3.911 3.808 1.00 0.00 O ATOM 0 H ASP A 42 11.150 -5.249 5.428 1.00 0.00 H new ATOM 0 HA ASP A 42 13.095 -4.607 7.424 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.326 -2.976 5.532 1.00 0.00 H new ATOM 0 HB3 ASP A 42 12.593 -2.274 6.519 1.00 0.00 H new ATOM 730 N TRP A 43 9.951 -4.087 8.134 1.00 0.00 N ATOM 731 CA TRP A 43 8.969 -3.830 9.195 1.00 0.00 C ATOM 732 C TRP A 43 7.717 -4.702 8.994 1.00 0.00 C ATOM 733 O TRP A 43 7.384 -5.056 7.862 1.00 0.00 O ATOM 734 CB TRP A 43 8.615 -2.335 9.179 1.00 0.00 C ATOM 735 CG TRP A 43 7.455 -1.906 10.024 1.00 0.00 C ATOM 736 CD1 TRP A 43 7.516 -1.398 11.276 1.00 0.00 C ATOM 737 CD2 TRP A 43 6.043 -1.898 9.659 1.00 0.00 C ATOM 738 NE1 TRP A 43 6.244 -1.056 11.698 1.00 0.00 N ATOM 739 CE2 TRP A 43 5.301 -1.306 10.723 1.00 0.00 C ATOM 740 CE3 TRP A 43 5.320 -2.331 8.529 1.00 0.00 C ATOM 741 CZ2 TRP A 43 3.918 -1.093 10.638 1.00 0.00 C ATOM 742 CZ3 TRP A 43 3.933 -2.108 8.430 1.00 0.00 C ATOM 743 CH2 TRP A 43 3.230 -1.490 9.480 1.00 0.00 C ATOM 0 H TRP A 43 9.523 -4.471 7.291 1.00 0.00 H new ATOM 0 HA TRP A 43 9.391 -4.090 10.166 1.00 0.00 H new ATOM 0 HB2 TRP A 43 9.494 -1.775 9.499 1.00 0.00 H new ATOM 0 HB3 TRP A 43 8.410 -2.046 8.148 1.00 0.00 H new ATOM 0 HD1 TRP A 43 8.419 -1.278 11.857 1.00 0.00 H new ATOM 0 HE1 TRP A 43 6.030 -0.667 12.616 1.00 0.00 H new ATOM 0 HE3 TRP A 43 5.836 -2.840 7.729 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 3.387 -0.628 11.455 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.404 -2.414 7.540 1.00 0.00 H new ATOM 0 HH2 TRP A 43 2.167 -1.322 9.396 1.00 0.00 H new ATOM 754 N THR A 44 6.993 -5.023 10.071 1.00 0.00 N ATOM 755 CA THR A 44 5.662 -5.654 10.003 1.00 0.00 C ATOM 756 C THR A 44 4.664 -4.991 10.951 1.00 0.00 C ATOM 757 O THR A 44 5.030 -4.490 12.018 1.00 0.00 O ATOM 758 CB THR A 44 5.699 -7.164 10.281 1.00 0.00 C ATOM 759 OG1 THR A 44 6.180 -7.461 11.577 1.00 0.00 O ATOM 760 CG2 THR A 44 6.545 -7.937 9.284 1.00 0.00 C ATOM 0 H THR A 44 7.313 -4.853 11.024 1.00 0.00 H new ATOM 0 HA THR A 44 5.330 -5.507 8.975 1.00 0.00 H new ATOM 0 HB THR A 44 4.660 -7.479 10.187 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.486 -8.392 11.607 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.529 -8.997 9.538 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.143 -7.798 8.280 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.571 -7.572 9.318 1.00 0.00 H new ATOM 768 N GLY A 45 3.384 -5.015 10.577 1.00 0.00 N ATOM 769 CA GLY A 45 2.309 -4.387 11.347 1.00 0.00 C ATOM 770 C GLY A 45 0.937 -4.514 10.689 1.00 0.00 C ATOM 771 O GLY A 45 0.601 -5.562 10.136 1.00 0.00 O ATOM 0 H GLY A 45 3.062 -5.474 9.725 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.271 -4.838 12.339 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.541 -3.331 11.486 1.00 0.00 H new ATOM 775 N ARG A 46 0.144 -3.443 10.780 1.00 0.00 N ATOM 776 CA ARG A 46 -1.260 -3.350 10.353 1.00 0.00 C ATOM 777 C ARG A 46 -1.443 -2.390 9.176 1.00 0.00 C ATOM 778 O ARG A 46 -0.738 -1.385 9.055 1.00 0.00 O ATOM 779 CB ARG A 46 -2.134 -2.884 11.531 1.00 0.00 C ATOM 780 CG ARG A 46 -2.019 -3.765 12.787 1.00 0.00 C ATOM 781 CD ARG A 46 -2.984 -3.318 13.893 1.00 0.00 C ATOM 782 NE ARG A 46 -2.581 -2.023 14.475 1.00 0.00 N ATOM 783 CZ ARG A 46 -3.020 -0.818 14.169 1.00 0.00 C ATOM 784 NH1 ARG A 46 -2.466 0.213 14.718 1.00 0.00 N ATOM 785 NH2 ARG A 46 -3.962 -0.567 13.310 1.00 0.00 N ATOM 0 H ARG A 46 0.481 -2.566 11.176 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.566 -4.343 10.025 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.859 -1.862 11.791 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.175 -2.862 11.210 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.226 -4.802 12.523 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.996 -3.730 13.162 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -3.992 -3.237 13.486 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -3.016 -4.075 14.676 1.00 0.00 H new ATOM 0 HE ARG A 46 -1.872 -2.066 15.207 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -1.699 0.088 15.379 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -2.796 1.151 14.490 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -4.419 -1.333 12.816 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -4.244 0.396 13.130 1.00 0.00 H new ATOM 799 N LEU A 47 -2.445 -2.679 8.350 1.00 0.00 N ATOM 800 CA LEU A 47 -2.954 -1.812 7.288 1.00 0.00 C ATOM 801 C LEU A 47 -4.076 -0.912 7.817 1.00 0.00 C ATOM 802 O LEU A 47 -4.981 -1.390 8.506 1.00 0.00 O ATOM 803 CB LEU A 47 -3.498 -2.702 6.154 1.00 0.00 C ATOM 804 CG LEU A 47 -4.205 -1.947 5.008 1.00 0.00 C ATOM 805 CD1 LEU A 47 -3.216 -1.166 4.144 1.00 0.00 C ATOM 806 CD2 LEU A 47 -4.972 -2.933 4.140 1.00 0.00 C ATOM 0 H LEU A 47 -2.948 -3.565 8.404 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.149 -1.175 6.922 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.671 -3.275 5.734 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.198 -3.420 6.581 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.892 -1.231 5.458 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.755 -0.650 3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.692 -0.436 4.761 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.494 -1.854 3.704 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.470 -2.396 3.332 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.280 -3.662 3.719 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.717 -3.448 4.746 1.00 0.00 H new ATOM 818 N ARG A 48 -4.097 0.340 7.354 1.00 0.00 N ATOM 819 CA ARG A 48 -5.281 1.202 7.302 1.00 0.00 C ATOM 820 C ARG A 48 -5.382 1.861 5.918 1.00 0.00 C ATOM 821 O ARG A 48 -4.420 2.446 5.432 1.00 0.00 O ATOM 822 CB ARG A 48 -5.208 2.231 8.444 1.00 0.00 C ATOM 823 CG ARG A 48 -6.506 3.047 8.559 1.00 0.00 C ATOM 824 CD ARG A 48 -6.440 4.147 9.629 1.00 0.00 C ATOM 825 NE ARG A 48 -6.090 3.627 10.963 1.00 0.00 N ATOM 826 CZ ARG A 48 -6.851 2.997 11.836 1.00 0.00 C ATOM 827 NH1 ARG A 48 -6.321 2.557 12.936 1.00 0.00 N ATOM 828 NH2 ARG A 48 -8.123 2.788 11.641 1.00 0.00 N ATOM 0 H ARG A 48 -3.261 0.798 6.992 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.189 0.616 7.444 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.017 1.716 9.386 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.369 2.905 8.273 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.728 3.502 7.594 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.331 2.373 8.791 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.704 4.894 9.331 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.404 4.653 9.683 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.123 3.775 11.251 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.327 2.700 13.116 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -6.898 2.068 13.620 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -8.568 3.117 10.784 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.673 2.295 12.345 1.00 0.00 H new ATOM 842 N ILE A 49 -6.554 1.801 5.296 1.00 0.00 N ATOM 843 CA ILE A 49 -6.924 2.630 4.141 1.00 0.00 C ATOM 844 C ILE A 49 -7.945 3.659 4.623 1.00 0.00 C ATOM 845 O ILE A 49 -8.896 3.331 5.335 1.00 0.00 O ATOM 846 CB ILE A 49 -7.429 1.809 2.935 1.00 0.00 C ATOM 847 CG1 ILE A 49 -6.476 0.642 2.601 1.00 0.00 C ATOM 848 CG2 ILE A 49 -7.588 2.723 1.703 1.00 0.00 C ATOM 849 CD1 ILE A 49 -6.949 -0.190 1.406 1.00 0.00 C ATOM 0 H ILE A 49 -7.295 1.161 5.583 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.037 3.134 3.758 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.397 1.386 3.204 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.483 1.039 2.390 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.382 -0.005 3.473 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.945 2.135 0.857 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.307 3.512 1.925 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.625 3.169 1.454 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.239 -0.995 1.219 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.929 -0.614 1.623 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -7.016 0.446 0.524 1.00 0.00 H new ATOM 861 N THR A 50 -7.708 4.905 4.243 1.00 0.00 N ATOM 862 CA THR A 50 -8.331 6.131 4.758 1.00 0.00 C ATOM 863 C THR A 50 -8.525 7.112 3.593 1.00 0.00 C ATOM 864 O THR A 50 -7.840 6.996 2.583 1.00 0.00 O ATOM 865 CB THR A 50 -7.475 6.724 5.895 1.00 0.00 C ATOM 866 OG1 THR A 50 -6.124 6.305 5.919 1.00 0.00 O ATOM 867 CG2 THR A 50 -8.054 6.282 7.237 1.00 0.00 C ATOM 0 H THR A 50 -7.026 5.109 3.513 1.00 0.00 H new ATOM 0 HA THR A 50 -9.310 5.914 5.185 1.00 0.00 H new ATOM 0 HB THR A 50 -7.498 7.800 5.719 1.00 0.00 H new ATOM 0 HG1 THR A 50 -5.781 6.254 5.002 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.454 6.697 8.047 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.080 6.639 7.326 1.00 0.00 H new ATOM 0 HG23 THR A 50 -8.042 5.194 7.298 1.00 0.00 H new ATOM 875 N SER A 51 -9.459 8.060 3.662 1.00 0.00 N ATOM 876 CA SER A 51 -9.696 9.061 2.606 1.00 0.00 C ATOM 877 C SER A 51 -10.532 10.220 3.136 1.00 0.00 C ATOM 878 O SER A 51 -11.290 10.039 4.083 1.00 0.00 O ATOM 879 CB SER A 51 -10.432 8.425 1.420 1.00 0.00 C ATOM 880 OG SER A 51 -10.665 9.381 0.398 1.00 0.00 O ATOM 0 H SER A 51 -10.084 8.161 4.461 1.00 0.00 H new ATOM 0 HA SER A 51 -8.725 9.434 2.280 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.844 7.598 1.023 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.381 8.008 1.757 1.00 0.00 H new ATOM 0 HG SER A 51 -11.434 9.102 -0.142 1.00 0.00 H new ATOM 886 N LYS A 52 -10.391 11.425 2.574 1.00 0.00 N ATOM 887 CA LYS A 52 -11.071 12.614 3.092 1.00 0.00 C ATOM 888 C LYS A 52 -11.893 13.430 2.086 1.00 0.00 C ATOM 889 O LYS A 52 -13.029 13.798 2.389 1.00 0.00 O ATOM 890 CB LYS A 52 -10.030 13.483 3.787 1.00 0.00 C ATOM 891 CG LYS A 52 -9.209 12.800 4.885 1.00 0.00 C ATOM 892 CD LYS A 52 -8.140 13.755 5.443 1.00 0.00 C ATOM 893 CE LYS A 52 -7.176 12.932 6.295 1.00 0.00 C ATOM 894 NZ LYS A 52 -6.289 13.757 7.145 1.00 0.00 N ATOM 0 H LYS A 52 -9.808 11.602 1.756 1.00 0.00 H new ATOM 0 HA LYS A 52 -11.834 12.252 3.782 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.343 13.866 3.032 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -10.537 14.344 4.223 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -9.869 12.476 5.690 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -8.731 11.906 4.485 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -7.606 14.247 4.630 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -8.604 14.540 6.041 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -7.750 12.257 6.930 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -6.564 12.311 5.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -5.673 13.137 7.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -5.704 14.371 6.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -6.865 14.344 7.782 1.00 0.00 H new ATOM 908 N GLY A 53 -11.343 13.721 0.907 1.00 0.00 N ATOM 909 CA GLY A 53 -11.983 14.583 -0.100 1.00 0.00 C ATOM 910 C GLY A 53 -11.286 14.485 -1.451 1.00 0.00 C ATOM 911 O GLY A 53 -10.361 15.248 -1.737 1.00 0.00 O ATOM 0 H GLY A 53 -10.433 13.364 0.617 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -13.030 14.299 -0.209 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.967 15.617 0.243 1.00 0.00 H new ATOM 915 N LYS A 54 -11.695 13.487 -2.248 1.00 0.00 N ATOM 916 CA LYS A 54 -11.066 13.074 -3.522 1.00 0.00 C ATOM 917 C LYS A 54 -9.575 12.738 -3.369 1.00 0.00 C ATOM 918 O LYS A 54 -8.813 12.793 -4.334 1.00 0.00 O ATOM 919 CB LYS A 54 -11.358 14.087 -4.649 1.00 0.00 C ATOM 920 CG LYS A 54 -12.860 14.326 -4.860 1.00 0.00 C ATOM 921 CD LYS A 54 -13.106 15.309 -6.010 1.00 0.00 C ATOM 922 CE LYS A 54 -14.610 15.579 -6.133 1.00 0.00 C ATOM 923 NZ LYS A 54 -14.904 16.562 -7.209 1.00 0.00 N ATOM 0 H LYS A 54 -12.509 12.917 -2.017 1.00 0.00 H new ATOM 0 HA LYS A 54 -11.532 12.136 -3.823 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.873 15.035 -4.414 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.918 13.726 -5.579 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -13.355 13.379 -5.075 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.302 14.716 -3.943 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.571 16.241 -5.827 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -12.721 14.898 -6.943 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -15.132 14.645 -6.340 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -14.992 15.953 -5.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -15.930 16.720 -7.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -14.426 17.461 -6.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -14.562 16.193 -8.119 1.00 0.00 H new ATOM 937 N THR A 55 -9.164 12.385 -2.148 1.00 0.00 N ATOM 938 CA THR A 55 -7.786 12.035 -1.798 1.00 0.00 C ATOM 939 C THR A 55 -7.825 10.889 -0.802 1.00 0.00 C ATOM 940 O THR A 55 -8.439 11.016 0.263 1.00 0.00 O ATOM 941 CB THR A 55 -7.032 13.228 -1.183 1.00 0.00 C ATOM 942 OG1 THR A 55 -7.161 14.398 -1.967 1.00 0.00 O ATOM 943 CG2 THR A 55 -5.542 12.924 -1.087 1.00 0.00 C ATOM 0 H THR A 55 -9.800 12.334 -1.353 1.00 0.00 H new ATOM 0 HA THR A 55 -7.256 11.747 -2.706 1.00 0.00 H new ATOM 0 HB THR A 55 -7.471 13.391 -0.198 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.091 14.706 -1.945 1.00 0.00 H new ATOM 0 HG21 THR A 55 -5.024 13.778 -0.650 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.389 12.047 -0.459 1.00 0.00 H new ATOM 0 HG23 THR A 55 -5.145 12.730 -2.084 1.00 0.00 H new ATOM 951 N ALA A 56 -7.205 9.766 -1.150 1.00 0.00 N ATOM 952 CA ALA A 56 -7.042 8.607 -0.282 1.00 0.00 C ATOM 953 C ALA A 56 -5.641 8.578 0.341 1.00 0.00 C ATOM 954 O ALA A 56 -4.707 9.213 -0.144 1.00 0.00 O ATOM 955 CB ALA A 56 -7.393 7.328 -1.052 1.00 0.00 C ATOM 0 H ALA A 56 -6.790 9.634 -2.072 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.736 8.677 0.556 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.269 6.464 -0.399 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.427 7.380 -1.392 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.732 7.229 -1.913 1.00 0.00 H new ATOM 961 N TYR A 57 -5.514 7.835 1.430 1.00 0.00 N ATOM 962 CA TYR A 57 -4.324 7.681 2.253 1.00 0.00 C ATOM 963 C TYR A 57 -4.192 6.207 2.663 1.00 0.00 C ATOM 964 O TYR A 57 -5.016 5.703 3.429 1.00 0.00 O ATOM 965 CB TYR A 57 -4.457 8.599 3.485 1.00 0.00 C ATOM 966 CG TYR A 57 -4.693 10.070 3.175 1.00 0.00 C ATOM 967 CD1 TYR A 57 -5.989 10.628 3.256 1.00 0.00 C ATOM 968 CD2 TYR A 57 -3.607 10.883 2.796 1.00 0.00 C ATOM 969 CE1 TYR A 57 -6.196 11.983 2.943 1.00 0.00 C ATOM 970 CE2 TYR A 57 -3.812 12.247 2.505 1.00 0.00 C ATOM 971 CZ TYR A 57 -5.106 12.800 2.573 1.00 0.00 C ATOM 972 OH TYR A 57 -5.293 14.118 2.286 1.00 0.00 O ATOM 0 H TYR A 57 -6.295 7.285 1.787 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.426 7.965 1.704 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.281 8.237 4.100 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.550 8.511 4.083 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -6.823 10.012 3.559 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -2.615 10.461 2.728 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -7.191 12.400 2.986 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -2.974 12.870 2.229 1.00 0.00 H new ATOM 0 HH TYR A 57 -4.434 14.527 2.052 1.00 0.00 H new ATOM 982 N ILE A 58 -3.161 5.508 2.178 1.00 0.00 N ATOM 983 CA ILE A 58 -2.774 4.187 2.701 1.00 0.00 C ATOM 984 C ILE A 58 -1.795 4.430 3.846 1.00 0.00 C ATOM 985 O ILE A 58 -0.664 4.863 3.617 1.00 0.00 O ATOM 986 CB ILE A 58 -2.194 3.253 1.608 1.00 0.00 C ATOM 987 CG1 ILE A 58 -3.209 2.869 0.506 1.00 0.00 C ATOM 988 CG2 ILE A 58 -1.696 1.944 2.253 1.00 0.00 C ATOM 989 CD1 ILE A 58 -3.382 3.919 -0.594 1.00 0.00 C ATOM 0 H ILE A 58 -2.571 5.838 1.414 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.654 3.656 3.063 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.387 3.817 1.140 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.892 1.932 0.049 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.178 2.685 0.971 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.289 1.290 1.482 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.919 2.171 2.983 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.527 1.444 2.751 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.111 3.566 -1.323 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.732 4.853 -0.154 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.426 4.087 -1.090 1.00 0.00 H new ATOM 1001 N LYS A 59 -2.236 4.179 5.080 1.00 0.00 N ATOM 1002 CA LYS A 59 -1.434 4.321 6.299 1.00 0.00 C ATOM 1003 C LYS A 59 -1.074 2.961 6.897 1.00 0.00 C ATOM 1004 O LYS A 59 -1.909 2.068 7.018 1.00 0.00 O ATOM 1005 CB LYS A 59 -2.151 5.242 7.298 1.00 0.00 C ATOM 1006 CG LYS A 59 -2.310 6.657 6.717 1.00 0.00 C ATOM 1007 CD LYS A 59 -2.619 7.692 7.804 1.00 0.00 C ATOM 1008 CE LYS A 59 -2.587 9.107 7.217 1.00 0.00 C ATOM 1009 NZ LYS A 59 -2.684 10.131 8.287 1.00 0.00 N ATOM 0 H LYS A 59 -3.188 3.862 5.265 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.485 4.793 6.043 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.131 4.831 7.540 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.585 5.287 8.229 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -1.395 6.940 6.196 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.111 6.658 5.978 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.599 7.493 8.237 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -1.891 7.610 8.611 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -1.664 9.250 6.655 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -3.411 9.231 6.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.915 11.053 7.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -3.430 9.861 8.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -1.775 10.197 8.788 1.00 0.00 H new ATOM 1023 N LEU A 60 0.186 2.810 7.281 1.00 0.00 N ATOM 1024 CA LEU A 60 0.734 1.628 7.949 1.00 0.00 C ATOM 1025 C LEU A 60 0.963 1.922 9.434 1.00 0.00 C ATOM 1026 O LEU A 60 1.542 2.951 9.781 1.00 0.00 O ATOM 1027 CB LEU A 60 2.024 1.195 7.233 1.00 0.00 C ATOM 1028 CG LEU A 60 1.817 0.061 6.216 1.00 0.00 C ATOM 1029 CD1 LEU A 60 0.772 0.356 5.136 1.00 0.00 C ATOM 1030 CD2 LEU A 60 3.144 -0.204 5.515 1.00 0.00 C ATOM 0 H LEU A 60 0.887 3.536 7.131 1.00 0.00 H new ATOM 0 HA LEU A 60 0.026 0.801 7.894 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.451 2.057 6.720 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.752 0.874 7.978 1.00 0.00 H new ATOM 0 HG LEU A 60 1.452 -0.794 6.785 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.693 -0.498 4.464 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.195 0.539 5.605 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.073 1.237 4.569 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.018 -1.007 4.788 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.472 0.701 5.003 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.893 -0.496 6.252 1.00 0.00 H new ATOM 1042 N GLU A 61 0.519 1.024 10.310 1.00 0.00 N ATOM 1043 CA GLU A 61 0.480 1.244 11.762 1.00 0.00 C ATOM 1044 C GLU A 61 1.003 0.048 12.562 1.00 0.00 C ATOM 1045 O GLU A 61 0.897 -1.103 12.137 1.00 0.00 O ATOM 1046 CB GLU A 61 -0.948 1.549 12.220 1.00 0.00 C ATOM 1047 CG GLU A 61 -1.580 2.821 11.649 1.00 0.00 C ATOM 1048 CD GLU A 61 -2.976 3.077 12.249 1.00 0.00 C ATOM 1049 OE1 GLU A 61 -3.546 2.204 12.957 1.00 0.00 O ATOM 1050 OE2 GLU A 61 -3.554 4.152 11.984 1.00 0.00 O ATOM 0 H GLU A 61 0.170 0.107 10.031 1.00 0.00 H new ATOM 0 HA GLU A 61 1.136 2.093 11.955 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.582 0.702 11.956 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.951 1.622 13.308 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.933 3.674 11.854 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.659 2.734 10.565 1.00 0.00 H new ATOM 1057 N ASP A 62 1.551 0.299 13.750 1.00 0.00 N ATOM 1058 CA ASP A 62 2.121 -0.734 14.604 1.00 0.00 C ATOM 1059 C ASP A 62 1.036 -1.591 15.277 1.00 0.00 C ATOM 1060 O ASP A 62 -0.028 -1.103 15.680 1.00 0.00 O ATOM 1061 CB ASP A 62 3.033 -0.060 15.628 1.00 0.00 C ATOM 1062 CG ASP A 62 3.985 -1.067 16.272 1.00 0.00 C ATOM 1063 OD1 ASP A 62 5.132 -1.223 15.794 1.00 0.00 O ATOM 1064 OD2 ASP A 62 3.543 -1.719 17.241 1.00 0.00 O ATOM 0 H ASP A 62 1.611 1.236 14.148 1.00 0.00 H new ATOM 0 HA ASP A 62 2.704 -1.426 13.996 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.608 0.728 15.142 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.428 0.416 16.399 1.00 0.00 H new ATOM 1069 N LYS A 63 1.333 -2.883 15.421 1.00 0.00 N ATOM 1070 CA LYS A 63 0.463 -3.918 16.007 1.00 0.00 C ATOM 1071 C LYS A 63 0.514 -4.020 17.534 1.00 0.00 C ATOM 1072 O LYS A 63 -0.291 -4.745 18.120 1.00 0.00 O ATOM 1073 CB LYS A 63 0.738 -5.273 15.317 1.00 0.00 C ATOM 1074 CG LYS A 63 2.239 -5.597 15.214 1.00 0.00 C ATOM 1075 CD LYS A 63 2.504 -6.991 14.638 1.00 0.00 C ATOM 1076 CE LYS A 63 3.966 -7.069 14.183 1.00 0.00 C ATOM 1077 NZ LYS A 63 4.284 -8.374 13.548 1.00 0.00 N ATOM 0 H LYS A 63 2.231 -3.261 15.119 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.564 -3.609 15.811 1.00 0.00 H new ATOM 0 HB2 LYS A 63 0.237 -6.066 15.872 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.304 -5.261 14.317 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.726 -4.850 14.586 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.691 -5.525 16.203 1.00 0.00 H new ATOM 0 HD2 LYS A 63 2.302 -7.754 15.389 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.837 -7.185 13.798 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.169 -6.264 13.477 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.621 -6.914 15.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 4.983 -8.231 12.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.675 -9.021 14.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.417 -8.785 13.146 1.00 0.00 H new ATOM 1091 N VAL A 64 1.416 -3.281 18.175 1.00 0.00 N ATOM 1092 CA VAL A 64 1.591 -3.229 19.632 1.00 0.00 C ATOM 1093 C VAL A 64 1.448 -1.803 20.164 1.00 0.00 C ATOM 1094 O VAL A 64 0.755 -1.594 21.162 1.00 0.00 O ATOM 1095 CB VAL A 64 2.961 -3.828 20.012 1.00 0.00 C ATOM 1096 CG1 VAL A 64 3.265 -3.716 21.513 1.00 0.00 C ATOM 1097 CG2 VAL A 64 3.048 -5.313 19.632 1.00 0.00 C ATOM 0 H VAL A 64 2.072 -2.678 17.679 1.00 0.00 H new ATOM 0 HA VAL A 64 0.803 -3.823 20.096 1.00 0.00 H new ATOM 0 HB VAL A 64 3.692 -3.244 19.454 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.241 -4.154 21.720 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.269 -2.666 21.806 1.00 0.00 H new ATOM 0 HG13 VAL A 64 2.501 -4.248 22.080 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.026 -5.704 19.913 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.270 -5.869 20.156 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.910 -5.422 18.556 1.00 0.00 H new ATOM 1107 N SER A 65 2.055 -0.813 19.499 1.00 0.00 N ATOM 1108 CA SER A 65 2.076 0.578 19.977 1.00 0.00 C ATOM 1109 C SER A 65 0.947 1.435 19.396 1.00 0.00 C ATOM 1110 O SER A 65 0.590 2.462 19.975 1.00 0.00 O ATOM 1111 CB SER A 65 3.432 1.223 19.668 1.00 0.00 C ATOM 1112 OG SER A 65 4.475 0.550 20.358 1.00 0.00 O ATOM 0 H SER A 65 2.545 -0.951 18.615 1.00 0.00 H new ATOM 0 HA SER A 65 1.917 0.537 21.055 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.619 1.192 18.595 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.416 2.274 19.958 1.00 0.00 H new ATOM 0 HG SER A 65 5.333 0.974 20.148 1.00 0.00 H new ATOM 1118 N GLY A 66 0.388 1.035 18.247 1.00 0.00 N ATOM 1119 CA GLY A 66 -0.664 1.779 17.538 1.00 0.00 C ATOM 1120 C GLY A 66 -0.144 2.993 16.755 1.00 0.00 C ATOM 1121 O GLY A 66 -0.932 3.773 16.222 1.00 0.00 O ATOM 0 H GLY A 66 0.657 0.172 17.775 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.172 1.104 16.849 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.408 2.116 18.260 1.00 0.00 H new ATOM 1125 N GLU A 67 1.179 3.165 16.697 1.00 0.00 N ATOM 1126 CA GLU A 67 1.857 4.320 16.106 1.00 0.00 C ATOM 1127 C GLU A 67 1.982 4.214 14.578 1.00 0.00 C ATOM 1128 O GLU A 67 2.001 3.115 14.020 1.00 0.00 O ATOM 1129 CB GLU A 67 3.209 4.525 16.809 1.00 0.00 C ATOM 1130 CG GLU A 67 4.280 3.478 16.470 1.00 0.00 C ATOM 1131 CD GLU A 67 5.590 3.774 17.227 1.00 0.00 C ATOM 1132 OE1 GLU A 67 6.458 4.503 16.688 1.00 0.00 O ATOM 1133 OE2 GLU A 67 5.761 3.281 18.368 1.00 0.00 O ATOM 0 H GLU A 67 1.831 2.478 17.075 1.00 0.00 H new ATOM 0 HA GLU A 67 1.247 5.208 16.270 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.591 5.512 16.548 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.046 4.521 17.887 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.919 2.483 16.732 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.467 3.476 15.396 1.00 0.00 H new ATOM 1140 N LEU A 68 2.085 5.354 13.893 1.00 0.00 N ATOM 1141 CA LEU A 68 2.233 5.423 12.436 1.00 0.00 C ATOM 1142 C LEU A 68 3.662 5.037 12.003 1.00 0.00 C ATOM 1143 O LEU A 68 4.637 5.650 12.446 1.00 0.00 O ATOM 1144 CB LEU A 68 1.855 6.847 11.973 1.00 0.00 C ATOM 1145 CG LEU A 68 1.797 7.033 10.444 1.00 0.00 C ATOM 1146 CD1 LEU A 68 0.580 6.342 9.831 1.00 0.00 C ATOM 1147 CD2 LEU A 68 1.695 8.520 10.104 1.00 0.00 C ATOM 0 H LEU A 68 2.068 6.270 14.341 1.00 0.00 H new ATOM 0 HA LEU A 68 1.565 4.705 11.961 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.883 7.105 12.394 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.578 7.552 12.384 1.00 0.00 H new ATOM 0 HG LEU A 68 2.707 6.592 10.038 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.578 6.498 8.752 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.623 5.274 10.043 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.330 6.761 10.260 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.654 8.644 9.022 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.791 8.934 10.551 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.567 9.044 10.497 1.00 0.00 H new ATOM 1159 N PHE A 69 3.783 4.060 11.101 1.00 0.00 N ATOM 1160 CA PHE A 69 5.038 3.708 10.427 1.00 0.00 C ATOM 1161 C PHE A 69 5.268 4.588 9.188 1.00 0.00 C ATOM 1162 O PHE A 69 6.309 5.238 9.075 1.00 0.00 O ATOM 1163 CB PHE A 69 5.032 2.213 10.066 1.00 0.00 C ATOM 1164 CG PHE A 69 6.175 1.790 9.157 1.00 0.00 C ATOM 1165 CD1 PHE A 69 5.937 1.501 7.797 1.00 0.00 C ATOM 1166 CD2 PHE A 69 7.490 1.729 9.657 1.00 0.00 C ATOM 1167 CE1 PHE A 69 7.008 1.181 6.944 1.00 0.00 C ATOM 1168 CE2 PHE A 69 8.558 1.384 8.808 1.00 0.00 C ATOM 1169 CZ PHE A 69 8.317 1.114 7.450 1.00 0.00 C ATOM 0 H PHE A 69 2.996 3.479 10.812 1.00 0.00 H new ATOM 0 HA PHE A 69 5.869 3.895 11.108 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.077 1.628 10.985 1.00 0.00 H new ATOM 0 HB3 PHE A 69 4.087 1.971 9.580 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.929 1.526 7.410 1.00 0.00 H new ATOM 0 HD2 PHE A 69 7.680 1.948 10.697 1.00 0.00 H new ATOM 0 HE1 PHE A 69 6.824 0.986 5.898 1.00 0.00 H new ATOM 0 HE2 PHE A 69 9.563 1.327 9.200 1.00 0.00 H new ATOM 0 HZ PHE A 69 9.137 0.855 6.796 1.00 0.00 H new ATOM 1179 N ALA A 70 4.289 4.629 8.277 1.00 0.00 N ATOM 1180 CA ALA A 70 4.347 5.391 7.028 1.00 0.00 C ATOM 1181 C ALA A 70 2.944 5.700 6.472 1.00 0.00 C ATOM 1182 O ALA A 70 1.960 5.056 6.842 1.00 0.00 O ATOM 1183 CB ALA A 70 5.171 4.592 6.008 1.00 0.00 C ATOM 0 H ALA A 70 3.413 4.120 8.393 1.00 0.00 H new ATOM 0 HA ALA A 70 4.821 6.353 7.225 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.225 5.145 5.070 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.178 4.436 6.396 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.696 3.627 5.833 1.00 0.00 H new ATOM 1189 N GLN A 71 2.861 6.668 5.555 1.00 0.00 N ATOM 1190 CA GLN A 71 1.619 7.098 4.899 1.00 0.00 C ATOM 1191 C GLN A 71 1.835 7.407 3.407 1.00 0.00 C ATOM 1192 O GLN A 71 2.779 8.111 3.053 1.00 0.00 O ATOM 1193 CB GLN A 71 1.034 8.316 5.639 1.00 0.00 C ATOM 1194 CG GLN A 71 2.057 9.432 5.920 1.00 0.00 C ATOM 1195 CD GLN A 71 1.417 10.810 6.044 1.00 0.00 C ATOM 1196 OE1 GLN A 71 0.412 11.012 6.716 1.00 0.00 O ATOM 1197 NE2 GLN A 71 1.976 11.801 5.384 1.00 0.00 N ATOM 0 H GLN A 71 3.678 7.190 5.238 1.00 0.00 H new ATOM 0 HA GLN A 71 0.905 6.276 4.949 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.216 8.728 5.048 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.607 7.982 6.585 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.593 9.202 6.841 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.795 9.451 5.118 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.812 11.634 4.825 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.573 12.737 5.432 1.00 0.00 H new ATOM 1206 N ALA A 72 0.956 6.917 2.532 1.00 0.00 N ATOM 1207 CA ALA A 72 0.981 7.148 1.084 1.00 0.00 C ATOM 1208 C ALA A 72 -0.316 7.840 0.607 1.00 0.00 C ATOM 1209 O ALA A 72 -1.358 7.177 0.528 1.00 0.00 O ATOM 1210 CB ALA A 72 1.225 5.807 0.379 1.00 0.00 C ATOM 0 H ALA A 72 0.177 6.326 2.822 1.00 0.00 H new ATOM 0 HA ALA A 72 1.794 7.828 0.828 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.246 5.962 -0.700 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.179 5.393 0.705 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.423 5.113 0.630 1.00 0.00 H new ATOM 1216 N PRO A 73 -0.290 9.155 0.301 1.00 0.00 N ATOM 1217 CA PRO A 73 -1.420 9.878 -0.279 1.00 0.00 C ATOM 1218 C PRO A 73 -1.614 9.551 -1.770 1.00 0.00 C ATOM 1219 O PRO A 73 -0.645 9.372 -2.512 1.00 0.00 O ATOM 1220 CB PRO A 73 -1.115 11.361 -0.052 1.00 0.00 C ATOM 1221 CG PRO A 73 0.410 11.411 -0.083 1.00 0.00 C ATOM 1222 CD PRO A 73 0.813 10.076 0.546 1.00 0.00 C ATOM 0 HA PRO A 73 -2.359 9.588 0.191 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.554 11.986 -0.829 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.510 11.712 0.901 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.790 11.508 -1.100 1.00 0.00 H new ATOM 0 HG3 PRO A 73 0.797 12.257 0.484 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.737 9.702 0.104 1.00 0.00 H new ATOM 0 HD3 PRO A 73 0.994 10.189 1.615 1.00 0.00 H new ATOM 1230 N VAL A 74 -2.872 9.504 -2.214 1.00 0.00 N ATOM 1231 CA VAL A 74 -3.310 9.069 -3.553 1.00 0.00 C ATOM 1232 C VAL A 74 -4.436 9.986 -4.048 1.00 0.00 C ATOM 1233 O VAL A 74 -5.450 10.132 -3.368 1.00 0.00 O ATOM 1234 CB VAL A 74 -3.829 7.609 -3.521 1.00 0.00 C ATOM 1235 CG1 VAL A 74 -3.999 7.049 -4.939 1.00 0.00 C ATOM 1236 CG2 VAL A 74 -2.937 6.638 -2.741 1.00 0.00 C ATOM 0 H VAL A 74 -3.656 9.781 -1.624 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.454 9.124 -4.225 1.00 0.00 H new ATOM 0 HB VAL A 74 -4.786 7.676 -3.004 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.364 6.023 -4.884 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.715 7.660 -5.488 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.038 7.065 -5.454 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.374 5.640 -2.769 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.945 6.613 -3.192 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -2.857 6.969 -1.706 1.00 0.00 H new ATOM 1246 N GLU A 75 -4.299 10.592 -5.231 1.00 0.00 N ATOM 1247 CA GLU A 75 -5.320 11.519 -5.771 1.00 0.00 C ATOM 1248 C GLU A 75 -6.379 10.818 -6.646 1.00 0.00 C ATOM 1249 O GLU A 75 -7.493 11.318 -6.804 1.00 0.00 O ATOM 1250 CB GLU A 75 -4.634 12.646 -6.562 1.00 0.00 C ATOM 1251 CG GLU A 75 -3.770 13.547 -5.669 1.00 0.00 C ATOM 1252 CD GLU A 75 -3.170 14.711 -6.481 1.00 0.00 C ATOM 1253 OE1 GLU A 75 -2.053 14.560 -7.034 1.00 0.00 O ATOM 1254 OE2 GLU A 75 -3.806 15.790 -6.568 1.00 0.00 O ATOM 0 H GLU A 75 -3.492 10.462 -5.841 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.855 11.934 -4.916 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.012 12.210 -7.344 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.393 13.251 -7.058 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.373 13.941 -4.851 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.969 12.960 -5.220 1.00 0.00 H new ATOM 1261 N GLN A 76 -6.037 9.656 -7.209 1.00 0.00 N ATOM 1262 CA GLN A 76 -6.927 8.756 -7.952 1.00 0.00 C ATOM 1263 C GLN A 76 -6.317 7.349 -8.033 1.00 0.00 C ATOM 1264 O GLN A 76 -5.091 7.214 -8.100 1.00 0.00 O ATOM 1265 CB GLN A 76 -7.245 9.307 -9.362 1.00 0.00 C ATOM 1266 CG GLN A 76 -6.128 9.255 -10.421 1.00 0.00 C ATOM 1267 CD GLN A 76 -4.890 10.087 -10.085 1.00 0.00 C ATOM 1268 OE1 GLN A 76 -4.779 11.258 -10.423 1.00 0.00 O ATOM 1269 NE2 GLN A 76 -3.909 9.514 -9.419 1.00 0.00 N ATOM 0 H GLN A 76 -5.083 9.298 -7.157 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.871 8.693 -7.410 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -8.102 8.757 -9.751 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -7.556 10.346 -9.253 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.825 8.217 -10.559 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.532 9.598 -11.373 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.989 8.539 -9.132 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.069 10.046 -9.191 1.00 0.00 H new ATOM 1278 N TYR A 77 -7.156 6.313 -8.077 1.00 0.00 N ATOM 1279 CA TYR A 77 -6.747 4.918 -8.244 1.00 0.00 C ATOM 1280 C TYR A 77 -7.328 4.318 -9.546 1.00 0.00 C ATOM 1281 O TYR A 77 -8.541 4.422 -9.756 1.00 0.00 O ATOM 1282 CB TYR A 77 -7.180 4.112 -7.016 1.00 0.00 C ATOM 1283 CG TYR A 77 -6.684 2.683 -7.031 1.00 0.00 C ATOM 1284 CD1 TYR A 77 -7.579 1.627 -7.287 1.00 0.00 C ATOM 1285 CD2 TYR A 77 -5.321 2.416 -6.812 1.00 0.00 C ATOM 1286 CE1 TYR A 77 -7.115 0.299 -7.305 1.00 0.00 C ATOM 1287 CE2 TYR A 77 -4.850 1.090 -6.867 1.00 0.00 C ATOM 1288 CZ TYR A 77 -5.747 0.025 -7.096 1.00 0.00 C ATOM 1289 OH TYR A 77 -5.294 -1.256 -7.120 1.00 0.00 O ATOM 0 H TYR A 77 -8.167 6.424 -7.995 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.661 4.873 -8.330 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.812 4.607 -6.117 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.268 4.111 -6.957 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -8.623 1.836 -7.470 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.637 3.225 -6.602 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -7.807 -0.512 -7.479 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -3.798 0.887 -6.733 1.00 0.00 H new ATOM 0 HH TYR A 77 -6.056 -1.872 -7.120 1.00 0.00 H new ATOM 1299 N PRO A 78 -6.512 3.674 -10.409 1.00 0.00 N ATOM 1300 CA PRO A 78 -5.052 3.572 -10.331 1.00 0.00 C ATOM 1301 C PRO A 78 -4.348 4.928 -10.538 1.00 0.00 C ATOM 1302 O PRO A 78 -4.837 5.801 -11.257 1.00 0.00 O ATOM 1303 CB PRO A 78 -4.658 2.556 -11.410 1.00 0.00 C ATOM 1304 CG PRO A 78 -5.752 2.727 -12.463 1.00 0.00 C ATOM 1305 CD PRO A 78 -6.991 3.014 -11.617 1.00 0.00 C ATOM 0 HA PRO A 78 -4.737 3.253 -9.338 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -3.669 2.765 -11.818 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.632 1.540 -11.017 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -5.531 3.546 -13.148 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -5.875 1.829 -13.069 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -7.692 3.650 -12.157 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -7.519 2.092 -11.374 1.00 0.00 H new ATOM 1313 N GLY A 79 -3.188 5.093 -9.900 1.00 0.00 N ATOM 1314 CA GLY A 79 -2.331 6.283 -9.969 1.00 0.00 C ATOM 1315 C GLY A 79 -0.851 5.948 -9.745 1.00 0.00 C ATOM 1316 O GLY A 79 -0.452 4.786 -9.834 1.00 0.00 O ATOM 0 H GLY A 79 -2.801 4.370 -9.294 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.450 6.758 -10.943 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.655 7.005 -9.220 1.00 0.00 H new ATOM 1320 N ILE A 80 -0.025 6.953 -9.427 1.00 0.00 N ATOM 1321 CA ILE A 80 1.418 6.751 -9.180 1.00 0.00 C ATOM 1322 C ILE A 80 1.707 6.133 -7.801 1.00 0.00 C ATOM 1323 O ILE A 80 2.622 5.327 -7.660 1.00 0.00 O ATOM 1324 CB ILE A 80 2.216 8.059 -9.409 1.00 0.00 C ATOM 1325 CG1 ILE A 80 3.730 7.791 -9.228 1.00 0.00 C ATOM 1326 CG2 ILE A 80 1.740 9.206 -8.496 1.00 0.00 C ATOM 1327 CD1 ILE A 80 4.658 8.911 -9.706 1.00 0.00 C ATOM 0 H ILE A 80 -0.329 7.922 -9.333 1.00 0.00 H new ATOM 0 HA ILE A 80 1.763 6.021 -9.913 1.00 0.00 H new ATOM 0 HB ILE A 80 2.032 8.385 -10.433 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.925 7.607 -8.172 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.986 6.877 -9.763 1.00 0.00 H new ATOM 0 HG21 ILE A 80 2.331 10.100 -8.696 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.688 9.415 -8.693 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.863 8.916 -7.453 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.695 8.623 -9.534 1.00 0.00 H new ATOM 0 HD12 ILE A 80 4.501 9.084 -10.771 1.00 0.00 H new ATOM 0 HD13 ILE A 80 4.439 9.825 -9.154 1.00 0.00 H new ATOM 1339 N ALA A 81 0.922 6.481 -6.779 1.00 0.00 N ATOM 1340 CA ALA A 81 1.218 6.168 -5.378 1.00 0.00 C ATOM 1341 C ALA A 81 0.790 4.761 -4.938 1.00 0.00 C ATOM 1342 O ALA A 81 0.898 4.446 -3.755 1.00 0.00 O ATOM 1343 CB ALA A 81 0.637 7.291 -4.514 1.00 0.00 C ATOM 0 H ALA A 81 0.050 6.996 -6.903 1.00 0.00 H new ATOM 0 HA ALA A 81 2.299 6.130 -5.246 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.842 7.085 -3.463 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.095 8.240 -4.794 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.440 7.349 -4.669 1.00 0.00 H new ATOM 1349 N VAL A 82 0.340 3.920 -5.875 1.00 0.00 N ATOM 1350 CA VAL A 82 -0.093 2.533 -5.651 1.00 0.00 C ATOM 1351 C VAL A 82 0.154 1.700 -6.921 1.00 0.00 C ATOM 1352 O VAL A 82 -0.249 2.092 -8.015 1.00 0.00 O ATOM 1353 CB VAL A 82 -1.587 2.453 -5.274 1.00 0.00 C ATOM 1354 CG1 VAL A 82 -1.949 1.030 -4.813 1.00 0.00 C ATOM 1355 CG2 VAL A 82 -2.053 3.413 -4.171 1.00 0.00 C ATOM 0 H VAL A 82 0.264 4.198 -6.854 1.00 0.00 H new ATOM 0 HA VAL A 82 0.489 2.136 -4.819 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.096 2.746 -6.192 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -3.006 0.990 -4.551 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.748 0.324 -5.619 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.349 0.766 -3.942 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.118 3.269 -3.989 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.498 3.211 -3.255 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.874 4.442 -4.484 1.00 0.00 H new ATOM 1365 N GLU A 83 0.790 0.539 -6.779 1.00 0.00 N ATOM 1366 CA GLU A 83 1.148 -0.404 -7.852 1.00 0.00 C ATOM 1367 C GLU A 83 0.965 -1.873 -7.425 1.00 0.00 C ATOM 1368 O GLU A 83 0.983 -2.201 -6.240 1.00 0.00 O ATOM 1369 CB GLU A 83 2.611 -0.185 -8.287 1.00 0.00 C ATOM 1370 CG GLU A 83 2.746 0.832 -9.421 1.00 0.00 C ATOM 1371 CD GLU A 83 4.213 0.938 -9.875 1.00 0.00 C ATOM 1372 OE1 GLU A 83 4.994 1.699 -9.259 1.00 0.00 O ATOM 1373 OE2 GLU A 83 4.611 0.281 -10.865 1.00 0.00 O ATOM 0 H GLU A 83 1.089 0.206 -5.862 1.00 0.00 H new ATOM 0 HA GLU A 83 0.473 -0.207 -8.685 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.193 0.154 -7.430 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.037 -1.136 -8.606 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.119 0.534 -10.262 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.390 1.807 -9.088 1.00 0.00 H new ATOM 1380 N THR A 84 0.837 -2.768 -8.404 1.00 0.00 N ATOM 1381 CA THR A 84 0.741 -4.234 -8.254 1.00 0.00 C ATOM 1382 C THR A 84 2.034 -4.927 -8.701 1.00 0.00 C ATOM 1383 O THR A 84 2.837 -4.368 -9.455 1.00 0.00 O ATOM 1384 CB THR A 84 -0.430 -4.774 -9.097 1.00 0.00 C ATOM 1385 OG1 THR A 84 -0.297 -4.385 -10.450 1.00 0.00 O ATOM 1386 CG2 THR A 84 -1.775 -4.239 -8.610 1.00 0.00 C ATOM 0 H THR A 84 0.794 -2.481 -9.382 1.00 0.00 H new ATOM 0 HA THR A 84 0.575 -4.448 -7.198 1.00 0.00 H new ATOM 0 HB THR A 84 -0.400 -5.859 -8.996 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.050 -4.740 -10.968 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.574 -4.644 -9.231 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.933 -4.540 -7.574 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.780 -3.151 -8.677 1.00 0.00 H new ATOM 1394 N VAL A 85 2.231 -6.172 -8.262 1.00 0.00 N ATOM 1395 CA VAL A 85 3.211 -7.107 -8.840 1.00 0.00 C ATOM 1396 C VAL A 85 2.601 -7.882 -10.025 1.00 0.00 C ATOM 1397 O VAL A 85 1.390 -7.839 -10.256 1.00 0.00 O ATOM 1398 CB VAL A 85 3.738 -8.079 -7.774 1.00 0.00 C ATOM 1399 CG1 VAL A 85 4.354 -7.319 -6.597 1.00 0.00 C ATOM 1400 CG2 VAL A 85 2.640 -9.008 -7.264 1.00 0.00 C ATOM 0 H VAL A 85 1.708 -6.570 -7.482 1.00 0.00 H new ATOM 0 HA VAL A 85 4.051 -6.521 -9.212 1.00 0.00 H new ATOM 0 HB VAL A 85 4.508 -8.686 -8.251 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.720 -8.030 -5.856 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.183 -6.707 -6.953 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.599 -6.678 -6.143 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.053 -9.680 -6.512 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.839 -8.416 -6.822 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.243 -9.592 -8.094 1.00 0.00 H new ATOM 1410 N THR A 86 3.420 -8.649 -10.745 1.00 0.00 N ATOM 1411 CA THR A 86 3.013 -9.469 -11.901 1.00 0.00 C ATOM 1412 C THR A 86 2.704 -10.923 -11.542 1.00 0.00 C ATOM 1413 O THR A 86 1.878 -11.564 -12.194 1.00 0.00 O ATOM 1414 CB THR A 86 4.114 -9.461 -12.973 1.00 0.00 C ATOM 1415 OG1 THR A 86 5.299 -10.040 -12.468 1.00 0.00 O ATOM 1416 CG2 THR A 86 4.457 -8.041 -13.406 1.00 0.00 C ATOM 0 H THR A 86 4.416 -8.723 -10.539 1.00 0.00 H new ATOM 0 HA THR A 86 2.094 -9.016 -12.274 1.00 0.00 H new ATOM 0 HB THR A 86 3.732 -10.029 -13.821 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.990 -10.029 -13.163 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.239 -8.071 -14.165 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.569 -7.562 -13.819 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.809 -7.473 -12.545 1.00 0.00 H new ATOM 1424 N ASP A 87 3.366 -11.455 -10.510 1.00 0.00 N ATOM 1425 CA ASP A 87 3.382 -12.889 -10.200 1.00 0.00 C ATOM 1426 C ASP A 87 2.250 -13.317 -9.254 1.00 0.00 C ATOM 1427 O ASP A 87 1.530 -14.277 -9.541 1.00 0.00 O ATOM 1428 CB ASP A 87 4.748 -13.247 -9.606 1.00 0.00 C ATOM 1429 CG ASP A 87 4.835 -14.737 -9.241 1.00 0.00 C ATOM 1430 OD1 ASP A 87 4.509 -15.089 -8.081 1.00 0.00 O ATOM 1431 OD2 ASP A 87 5.211 -15.555 -10.114 1.00 0.00 O ATOM 0 H ASP A 87 3.914 -10.894 -9.857 1.00 0.00 H new ATOM 0 HA ASP A 87 3.213 -13.434 -11.129 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.532 -13.001 -10.322 1.00 0.00 H new ATOM 0 HB3 ASP A 87 4.928 -12.643 -8.717 1.00 0.00 H new ATOM 1436 N SER A 88 2.098 -12.601 -8.133 1.00 0.00 N ATOM 1437 CA SER A 88 1.219 -13.014 -7.017 1.00 0.00 C ATOM 1438 C SER A 88 0.385 -11.857 -6.462 1.00 0.00 C ATOM 1439 O SER A 88 0.927 -10.917 -5.893 1.00 0.00 O ATOM 1440 CB SER A 88 2.053 -13.637 -5.886 1.00 0.00 C ATOM 1441 OG SER A 88 2.475 -14.951 -6.211 1.00 0.00 O ATOM 0 H SER A 88 2.579 -11.717 -7.968 1.00 0.00 H new ATOM 0 HA SER A 88 0.526 -13.752 -7.420 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.925 -13.013 -5.690 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.464 -13.660 -4.969 1.00 0.00 H new ATOM 0 HG SER A 88 3.192 -14.909 -6.877 1.00 0.00 H new ATOM 1447 N SER A 89 -0.947 -11.927 -6.560 1.00 0.00 N ATOM 1448 CA SER A 89 -1.843 -10.780 -6.294 1.00 0.00 C ATOM 1449 C SER A 89 -1.858 -10.267 -4.842 1.00 0.00 C ATOM 1450 O SER A 89 -2.443 -9.216 -4.585 1.00 0.00 O ATOM 1451 CB SER A 89 -3.286 -11.095 -6.714 1.00 0.00 C ATOM 1452 OG SER A 89 -3.347 -11.958 -7.842 1.00 0.00 O ATOM 0 H SER A 89 -1.442 -12.779 -6.826 1.00 0.00 H new ATOM 0 HA SER A 89 -1.418 -9.980 -6.899 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.812 -11.556 -5.878 1.00 0.00 H new ATOM 0 HB3 SER A 89 -3.806 -10.165 -6.943 1.00 0.00 H new ATOM 0 HG SER A 89 -3.764 -11.486 -8.593 1.00 0.00 H new ATOM 1458 N ARG A 90 -1.223 -10.970 -3.888 1.00 0.00 N ATOM 1459 CA ARG A 90 -1.138 -10.583 -2.467 1.00 0.00 C ATOM 1460 C ARG A 90 -0.009 -9.594 -2.130 1.00 0.00 C ATOM 1461 O ARG A 90 0.392 -9.501 -0.970 1.00 0.00 O ATOM 1462 CB ARG A 90 -1.292 -11.806 -1.542 1.00 0.00 C ATOM 1463 CG ARG A 90 -0.047 -12.677 -1.362 1.00 0.00 C ATOM 1464 CD ARG A 90 -0.378 -13.878 -0.467 1.00 0.00 C ATOM 1465 NE ARG A 90 0.752 -14.823 -0.378 1.00 0.00 N ATOM 1466 CZ ARG A 90 1.729 -14.834 0.513 1.00 0.00 C ATOM 1467 NH1 ARG A 90 2.658 -15.744 0.444 1.00 0.00 N ATOM 1468 NH2 ARG A 90 1.822 -13.967 1.480 1.00 0.00 N ATOM 0 H ARG A 90 -0.742 -11.847 -4.088 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.006 -9.961 -2.250 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.610 -11.455 -0.560 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.095 -12.432 -1.932 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.310 -13.022 -2.332 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.757 -12.091 -0.917 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.637 -13.527 0.532 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.254 -14.394 -0.861 1.00 0.00 H new ATOM 0 HE ARG A 90 0.783 -15.555 -1.088 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.631 -16.446 -0.296 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.413 -15.755 1.130 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.120 -13.234 1.577 1.00 0.00 H new ATOM 0 HH22 ARG A 90 2.597 -14.021 2.141 1.00 0.00 H new ATOM 1482 N TYR A 91 0.494 -8.850 -3.118 1.00 0.00 N ATOM 1483 CA TYR A 91 1.619 -7.930 -2.981 1.00 0.00 C ATOM 1484 C TYR A 91 1.389 -6.635 -3.780 1.00 0.00 C ATOM 1485 O TYR A 91 0.946 -6.676 -4.932 1.00 0.00 O ATOM 1486 CB TYR A 91 2.895 -8.638 -3.451 1.00 0.00 C ATOM 1487 CG TYR A 91 3.304 -9.841 -2.622 1.00 0.00 C ATOM 1488 CD1 TYR A 91 2.923 -11.141 -3.014 1.00 0.00 C ATOM 1489 CD2 TYR A 91 4.064 -9.656 -1.455 1.00 0.00 C ATOM 1490 CE1 TYR A 91 3.322 -12.256 -2.254 1.00 0.00 C ATOM 1491 CE2 TYR A 91 4.440 -10.764 -0.676 1.00 0.00 C ATOM 1492 CZ TYR A 91 4.091 -12.069 -1.083 1.00 0.00 C ATOM 1493 OH TYR A 91 4.504 -13.137 -0.348 1.00 0.00 O ATOM 0 H TYR A 91 0.115 -8.874 -4.065 1.00 0.00 H new ATOM 0 HA TYR A 91 1.719 -7.645 -1.934 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.756 -8.958 -4.484 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.714 -7.918 -3.448 1.00 0.00 H new ATOM 0 HD1 TYR A 91 2.323 -11.281 -3.901 1.00 0.00 H new ATOM 0 HD2 TYR A 91 4.360 -8.661 -1.156 1.00 0.00 H new ATOM 0 HE1 TYR A 91 3.041 -13.252 -2.565 1.00 0.00 H new ATOM 0 HE2 TYR A 91 4.998 -10.616 0.237 1.00 0.00 H new ATOM 0 HH TYR A 91 5.022 -12.823 0.422 1.00 0.00 H new ATOM 1503 N PHE A 92 1.726 -5.491 -3.181 1.00 0.00 N ATOM 1504 CA PHE A 92 1.580 -4.153 -3.769 1.00 0.00 C ATOM 1505 C PHE A 92 2.796 -3.281 -3.457 1.00 0.00 C ATOM 1506 O PHE A 92 3.550 -3.567 -2.534 1.00 0.00 O ATOM 1507 CB PHE A 92 0.318 -3.463 -3.229 1.00 0.00 C ATOM 1508 CG PHE A 92 -0.968 -4.217 -3.483 1.00 0.00 C ATOM 1509 CD1 PHE A 92 -1.636 -4.099 -4.715 1.00 0.00 C ATOM 1510 CD2 PHE A 92 -1.489 -5.049 -2.480 1.00 0.00 C ATOM 1511 CE1 PHE A 92 -2.814 -4.831 -4.945 1.00 0.00 C ATOM 1512 CE2 PHE A 92 -2.677 -5.759 -2.702 1.00 0.00 C ATOM 1513 CZ PHE A 92 -3.333 -5.664 -3.941 1.00 0.00 C ATOM 0 H PHE A 92 2.122 -5.467 -2.241 1.00 0.00 H new ATOM 0 HA PHE A 92 1.497 -4.276 -4.849 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.432 -3.316 -2.155 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.239 -2.474 -3.680 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.245 -3.448 -5.483 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -0.974 -5.142 -1.535 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.321 -4.752 -5.896 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.089 -6.380 -1.920 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.235 -6.231 -4.121 1.00 0.00 H new ATOM 1523 N VAL A 93 2.963 -2.187 -4.190 1.00 0.00 N ATOM 1524 CA VAL A 93 3.904 -1.104 -3.869 1.00 0.00 C ATOM 1525 C VAL A 93 3.120 0.182 -3.650 1.00 0.00 C ATOM 1526 O VAL A 93 2.150 0.422 -4.363 1.00 0.00 O ATOM 1527 CB VAL A 93 4.975 -0.963 -4.967 1.00 0.00 C ATOM 1528 CG1 VAL A 93 5.841 0.295 -4.842 1.00 0.00 C ATOM 1529 CG2 VAL A 93 5.889 -2.186 -4.932 1.00 0.00 C ATOM 0 H VAL A 93 2.437 -2.018 -5.048 1.00 0.00 H new ATOM 0 HA VAL A 93 4.441 -1.337 -2.950 1.00 0.00 H new ATOM 0 HB VAL A 93 4.435 -0.881 -5.910 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.569 0.318 -5.653 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.207 1.180 -4.898 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.364 0.283 -3.886 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.650 -2.094 -5.707 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.370 -2.253 -3.956 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.300 -3.086 -5.108 1.00 0.00 H new ATOM 1539 N ILE A 94 3.525 1.020 -2.695 1.00 0.00 N ATOM 1540 CA ILE A 94 2.930 2.347 -2.490 1.00 0.00 C ATOM 1541 C ILE A 94 3.996 3.431 -2.308 1.00 0.00 C ATOM 1542 O ILE A 94 5.078 3.171 -1.775 1.00 0.00 O ATOM 1543 CB ILE A 94 1.869 2.385 -1.366 1.00 0.00 C ATOM 1544 CG1 ILE A 94 2.387 2.101 0.064 1.00 0.00 C ATOM 1545 CG2 ILE A 94 0.643 1.515 -1.690 1.00 0.00 C ATOM 1546 CD1 ILE A 94 2.662 0.632 0.425 1.00 0.00 C ATOM 0 H ILE A 94 4.275 0.800 -2.040 1.00 0.00 H new ATOM 0 HA ILE A 94 2.389 2.570 -3.410 1.00 0.00 H new ATOM 0 HB ILE A 94 1.566 3.432 -1.348 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.309 2.664 0.209 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.658 2.494 0.773 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.073 1.575 -0.870 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.175 1.873 -2.607 1.00 0.00 H new ATOM 0 HG23 ILE A 94 0.956 0.479 -1.823 1.00 0.00 H new ATOM 0 HD11 ILE A 94 3.020 0.571 1.453 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.743 0.055 0.326 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.419 0.228 -0.247 1.00 0.00 H new ATOM 1558 N ARG A 95 3.685 4.658 -2.748 1.00 0.00 N ATOM 1559 CA ARG A 95 4.584 5.823 -2.622 1.00 0.00 C ATOM 1560 C ARG A 95 4.329 6.573 -1.315 1.00 0.00 C ATOM 1561 O ARG A 95 3.539 7.520 -1.273 1.00 0.00 O ATOM 1562 CB ARG A 95 4.491 6.733 -3.859 1.00 0.00 C ATOM 1563 CG ARG A 95 5.659 7.730 -3.911 1.00 0.00 C ATOM 1564 CD ARG A 95 5.490 8.715 -5.073 1.00 0.00 C ATOM 1565 NE ARG A 95 6.645 9.628 -5.169 1.00 0.00 N ATOM 1566 CZ ARG A 95 6.775 10.668 -5.968 1.00 0.00 C ATOM 1567 NH1 ARG A 95 7.858 11.383 -5.908 1.00 0.00 N ATOM 1568 NH2 ARG A 95 5.855 11.019 -6.820 1.00 0.00 N ATOM 0 H ARG A 95 2.799 4.876 -3.204 1.00 0.00 H new ATOM 0 HA ARG A 95 5.612 5.462 -2.580 1.00 0.00 H new ATOM 0 HB2 ARG A 95 4.491 6.123 -4.762 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.547 7.277 -3.842 1.00 0.00 H new ATOM 0 HG2 ARG A 95 5.716 8.278 -2.971 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.599 7.189 -4.022 1.00 0.00 H new ATOM 0 HD2 ARG A 95 5.379 8.164 -6.007 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.576 9.293 -4.934 1.00 0.00 H new ATOM 0 HE ARG A 95 7.430 9.433 -4.548 1.00 0.00 H new ATOM 0 HH11 ARG A 95 8.596 11.137 -5.248 1.00 0.00 H new ATOM 0 HH12 ARG A 95 7.971 12.190 -6.521 1.00 0.00 H new ATOM 0 HH21 ARG A 95 4.991 10.481 -6.888 1.00 0.00 H new ATOM 0 HH22 ARG A 95 5.998 11.832 -7.419 1.00 0.00 H new ATOM 1582 N ILE A 96 4.995 6.156 -0.243 1.00 0.00 N ATOM 1583 CA ILE A 96 4.902 6.832 1.059 1.00 0.00 C ATOM 1584 C ILE A 96 5.611 8.195 1.025 1.00 0.00 C ATOM 1585 O ILE A 96 6.656 8.344 0.390 1.00 0.00 O ATOM 1586 CB ILE A 96 5.303 5.932 2.251 1.00 0.00 C ATOM 1587 CG1 ILE A 96 6.796 5.535 2.312 1.00 0.00 C ATOM 1588 CG2 ILE A 96 4.432 4.667 2.286 1.00 0.00 C ATOM 1589 CD1 ILE A 96 7.634 6.463 3.198 1.00 0.00 C ATOM 0 H ILE A 96 5.613 5.345 -0.245 1.00 0.00 H new ATOM 0 HA ILE A 96 3.848 7.040 1.243 1.00 0.00 H new ATOM 0 HB ILE A 96 5.130 6.551 3.131 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.879 4.515 2.686 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.207 5.539 1.303 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.728 4.045 3.131 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.385 4.949 2.392 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.565 4.108 1.360 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.671 6.128 3.197 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.581 7.481 2.812 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.247 6.441 4.217 1.00 0.00 H new ATOM 1601 N GLN A 97 5.008 9.205 1.656 1.00 0.00 N ATOM 1602 CA GLN A 97 5.376 10.627 1.572 1.00 0.00 C ATOM 1603 C GLN A 97 5.203 11.322 2.929 1.00 0.00 C ATOM 1604 O GLN A 97 4.239 11.079 3.656 1.00 0.00 O ATOM 1605 CB GLN A 97 4.498 11.336 0.524 1.00 0.00 C ATOM 1606 CG GLN A 97 4.886 11.016 -0.928 1.00 0.00 C ATOM 1607 CD GLN A 97 3.729 11.220 -1.895 1.00 0.00 C ATOM 1608 OE1 GLN A 97 3.460 12.312 -2.377 1.00 0.00 O ATOM 1609 NE2 GLN A 97 2.995 10.174 -2.198 1.00 0.00 N ATOM 0 H GLN A 97 4.209 9.049 2.271 1.00 0.00 H new ATOM 0 HA GLN A 97 6.424 10.687 1.279 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.458 11.052 0.683 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.562 12.413 0.679 1.00 0.00 H new ATOM 0 HG2 GLN A 97 5.721 11.649 -1.226 1.00 0.00 H new ATOM 0 HG3 GLN A 97 5.231 9.984 -0.990 1.00 0.00 H new ATOM 0 HE21 GLN A 97 3.217 9.262 -1.798 1.00 0.00 H new ATOM 0 HE22 GLN A 97 2.203 10.273 -2.833 1.00 0.00 H new ATOM 1618 N ASP A 98 6.099 12.261 3.232 1.00 0.00 N ATOM 1619 CA ASP A 98 6.057 13.061 4.475 1.00 0.00 C ATOM 1620 C ASP A 98 5.267 14.384 4.325 1.00 0.00 C ATOM 1621 O ASP A 98 5.224 15.201 5.246 1.00 0.00 O ATOM 1622 CB ASP A 98 7.471 13.262 5.041 1.00 0.00 C ATOM 1623 CG ASP A 98 8.115 11.939 5.484 1.00 0.00 C ATOM 1624 OD1 ASP A 98 7.631 11.325 6.464 1.00 0.00 O ATOM 1625 OD2 ASP A 98 9.136 11.534 4.878 1.00 0.00 O ATOM 0 H ASP A 98 6.883 12.496 2.624 1.00 0.00 H new ATOM 0 HA ASP A 98 5.491 12.488 5.209 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.099 13.734 4.285 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.427 13.944 5.890 1.00 0.00 H new ATOM 1630 N GLY A 99 4.632 14.602 3.166 1.00 0.00 N ATOM 1631 CA GLY A 99 3.756 15.753 2.887 1.00 0.00 C ATOM 1632 C GLY A 99 4.494 17.045 2.503 1.00 0.00 C ATOM 1633 O GLY A 99 3.896 18.122 2.497 1.00 0.00 O ATOM 0 H GLY A 99 4.714 13.966 2.373 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.075 15.486 2.079 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.144 15.948 3.768 1.00 0.00 H new ATOM 1637 N THR A 100 5.792 16.941 2.197 1.00 0.00 N ATOM 1638 CA THR A 100 6.711 18.071 1.940 1.00 0.00 C ATOM 1639 C THR A 100 7.576 17.882 0.675 1.00 0.00 C ATOM 1640 O THR A 100 8.573 18.581 0.482 1.00 0.00 O ATOM 1641 CB THR A 100 7.536 18.343 3.217 1.00 0.00 C ATOM 1642 OG1 THR A 100 8.234 19.569 3.147 1.00 0.00 O ATOM 1643 CG2 THR A 100 8.534 17.228 3.549 1.00 0.00 C ATOM 0 H THR A 100 6.255 16.036 2.117 1.00 0.00 H new ATOM 0 HA THR A 100 6.120 18.958 1.713 1.00 0.00 H new ATOM 0 HB THR A 100 6.796 18.386 4.016 1.00 0.00 H new ATOM 0 HG1 THR A 100 8.544 19.717 2.229 1.00 0.00 H new ATOM 0 HG21 THR A 100 9.079 17.486 4.457 1.00 0.00 H new ATOM 0 HG22 THR A 100 7.996 16.292 3.701 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.238 17.112 2.725 1.00 0.00 H new ATOM 1651 N GLY A 101 7.228 16.917 -0.190 1.00 0.00 N ATOM 1652 CA GLY A 101 7.983 16.571 -1.408 1.00 0.00 C ATOM 1653 C GLY A 101 9.023 15.456 -1.214 1.00 0.00 C ATOM 1654 O GLY A 101 9.619 14.989 -2.189 1.00 0.00 O ATOM 0 H GLY A 101 6.396 16.342 -0.061 1.00 0.00 H new ATOM 0 HA2 GLY A 101 7.280 16.265 -2.182 1.00 0.00 H new ATOM 0 HA3 GLY A 101 8.490 17.464 -1.773 1.00 0.00 H new ATOM 1658 N ARG A 102 9.199 14.976 0.025 1.00 0.00 N ATOM 1659 CA ARG A 102 9.854 13.710 0.360 1.00 0.00 C ATOM 1660 C ARG A 102 8.973 12.556 -0.076 1.00 0.00 C ATOM 1661 O ARG A 102 7.761 12.574 0.151 1.00 0.00 O ATOM 1662 CB ARG A 102 10.050 13.590 1.875 1.00 0.00 C ATOM 1663 CG ARG A 102 11.129 14.527 2.416 1.00 0.00 C ATOM 1664 CD ARG A 102 11.131 14.527 3.950 1.00 0.00 C ATOM 1665 NE ARG A 102 11.346 13.180 4.510 1.00 0.00 N ATOM 1666 CZ ARG A 102 12.467 12.600 4.885 1.00 0.00 C ATOM 1667 NH1 ARG A 102 12.417 11.389 5.353 1.00 0.00 N ATOM 1668 NH2 ARG A 102 13.628 13.187 4.804 1.00 0.00 N ATOM 0 H ARG A 102 8.876 15.480 0.851 1.00 0.00 H new ATOM 0 HA ARG A 102 10.819 13.683 -0.146 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.106 13.805 2.376 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.314 12.561 2.121 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.106 14.216 2.047 1.00 0.00 H new ATOM 0 HG3 ARG A 102 10.957 15.538 2.048 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.912 15.196 4.310 1.00 0.00 H new ATOM 0 HD3 ARG A 102 10.182 14.921 4.312 1.00 0.00 H new ATOM 0 HE ARG A 102 10.504 12.616 4.623 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.521 10.906 5.424 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.273 10.921 5.649 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.695 14.137 4.437 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.470 12.697 5.107 1.00 0.00 H new ATOM 1682 N SER A 103 9.605 11.531 -0.623 1.00 0.00 N ATOM 1683 CA SER A 103 8.941 10.263 -0.941 1.00 0.00 C ATOM 1684 C SER A 103 9.864 9.039 -0.981 1.00 0.00 C ATOM 1685 O SER A 103 11.072 9.157 -1.202 1.00 0.00 O ATOM 1686 CB SER A 103 8.170 10.381 -2.264 1.00 0.00 C ATOM 1687 OG SER A 103 9.025 10.408 -3.397 1.00 0.00 O ATOM 0 H SER A 103 10.596 11.548 -0.863 1.00 0.00 H new ATOM 0 HA SER A 103 8.257 10.085 -0.111 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.481 9.541 -2.354 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.566 11.288 -2.248 1.00 0.00 H new ATOM 0 HG SER A 103 9.430 11.296 -3.480 1.00 0.00 H new ATOM 1693 N ALA A 104 9.267 7.857 -0.813 1.00 0.00 N ATOM 1694 CA ALA A 104 9.862 6.554 -1.099 1.00 0.00 C ATOM 1695 C ALA A 104 8.799 5.584 -1.641 1.00 0.00 C ATOM 1696 O ALA A 104 7.648 5.604 -1.204 1.00 0.00 O ATOM 1697 CB ALA A 104 10.521 6.005 0.175 1.00 0.00 C ATOM 0 H ALA A 104 8.314 7.781 -0.458 1.00 0.00 H new ATOM 0 HA ALA A 104 10.627 6.664 -1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 104 10.966 5.032 -0.036 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.297 6.694 0.509 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.769 5.898 0.957 1.00 0.00 H new ATOM 1703 N PHE A 105 9.182 4.703 -2.564 1.00 0.00 N ATOM 1704 CA PHE A 105 8.356 3.565 -2.975 1.00 0.00 C ATOM 1705 C PHE A 105 8.703 2.351 -2.102 1.00 0.00 C ATOM 1706 O PHE A 105 9.853 1.903 -2.091 1.00 0.00 O ATOM 1707 CB PHE A 105 8.542 3.280 -4.472 1.00 0.00 C ATOM 1708 CG PHE A 105 7.872 4.279 -5.402 1.00 0.00 C ATOM 1709 CD1 PHE A 105 6.556 4.046 -5.847 1.00 0.00 C ATOM 1710 CD2 PHE A 105 8.562 5.419 -5.861 1.00 0.00 C ATOM 1711 CE1 PHE A 105 5.946 4.918 -6.763 1.00 0.00 C ATOM 1712 CE2 PHE A 105 7.949 6.301 -6.769 1.00 0.00 C ATOM 1713 CZ PHE A 105 6.647 6.044 -7.230 1.00 0.00 C ATOM 0 H PHE A 105 10.077 4.757 -3.050 1.00 0.00 H new ATOM 0 HA PHE A 105 7.301 3.796 -2.829 1.00 0.00 H new ATOM 0 HB2 PHE A 105 9.609 3.259 -4.693 1.00 0.00 H new ATOM 0 HB3 PHE A 105 8.152 2.286 -4.689 1.00 0.00 H new ATOM 0 HD1 PHE A 105 6.011 3.189 -5.480 1.00 0.00 H new ATOM 0 HD2 PHE A 105 9.566 5.616 -5.514 1.00 0.00 H new ATOM 0 HE1 PHE A 105 4.941 4.724 -7.108 1.00 0.00 H new ATOM 0 HE2 PHE A 105 8.480 7.177 -7.112 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.185 6.711 -7.943 1.00 0.00 H new ATOM 1723 N ILE A 106 7.719 1.824 -1.369 1.00 0.00 N ATOM 1724 CA ILE A 106 7.865 0.635 -0.507 1.00 0.00 C ATOM 1725 C ILE A 106 6.945 -0.495 -0.974 1.00 0.00 C ATOM 1726 O ILE A 106 5.828 -0.235 -1.420 1.00 0.00 O ATOM 1727 CB ILE A 106 7.672 0.958 0.996 1.00 0.00 C ATOM 1728 CG1 ILE A 106 6.205 1.246 1.389 1.00 0.00 C ATOM 1729 CG2 ILE A 106 8.592 2.122 1.399 1.00 0.00 C ATOM 1730 CD1 ILE A 106 5.983 1.411 2.898 1.00 0.00 C ATOM 0 H ILE A 106 6.777 2.215 -1.354 1.00 0.00 H new ATOM 0 HA ILE A 106 8.894 0.291 -0.608 1.00 0.00 H new ATOM 0 HB ILE A 106 7.948 0.061 1.550 1.00 0.00 H new ATOM 0 HG12 ILE A 106 5.876 2.153 0.883 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.576 0.433 1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.453 2.346 2.457 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.631 1.844 1.220 1.00 0.00 H new ATOM 0 HG23 ILE A 106 8.345 3.003 0.806 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.929 1.610 3.091 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.279 0.496 3.411 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.583 2.244 3.265 1.00 0.00 H new ATOM 1742 N GLY A 107 7.398 -1.741 -0.855 1.00 0.00 N ATOM 1743 CA GLY A 107 6.597 -2.931 -1.140 1.00 0.00 C ATOM 1744 C GLY A 107 5.894 -3.426 0.117 1.00 0.00 C ATOM 1745 O GLY A 107 6.475 -3.373 1.201 1.00 0.00 O ATOM 0 H GLY A 107 8.348 -1.957 -0.553 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.859 -2.702 -1.908 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.237 -3.719 -1.538 1.00 0.00 H new ATOM 1749 N ILE A 108 4.664 -3.916 -0.026 1.00 0.00 N ATOM 1750 CA ILE A 108 3.877 -4.555 1.029 1.00 0.00 C ATOM 1751 C ILE A 108 3.335 -5.916 0.586 1.00 0.00 C ATOM 1752 O ILE A 108 2.881 -6.080 -0.547 1.00 0.00 O ATOM 1753 CB ILE A 108 2.754 -3.651 1.584 1.00 0.00 C ATOM 1754 CG1 ILE A 108 1.735 -3.164 0.530 1.00 0.00 C ATOM 1755 CG2 ILE A 108 3.376 -2.479 2.354 1.00 0.00 C ATOM 1756 CD1 ILE A 108 0.493 -2.504 1.152 1.00 0.00 C ATOM 0 H ILE A 108 4.168 -3.877 -0.916 1.00 0.00 H new ATOM 0 HA ILE A 108 4.567 -4.723 1.856 1.00 0.00 H new ATOM 0 HB ILE A 108 2.162 -4.269 2.259 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.222 -2.452 -0.136 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.422 -4.010 -0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.585 -1.840 2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.975 -2.863 3.180 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.011 -1.900 1.684 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.184 -2.184 0.360 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.016 -3.221 1.796 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.797 -1.639 1.741 1.00 0.00 H new ATOM 1768 N GLY A 109 3.374 -6.889 1.495 1.00 0.00 N ATOM 1769 CA GLY A 109 2.842 -8.242 1.328 1.00 0.00 C ATOM 1770 C GLY A 109 1.744 -8.567 2.337 1.00 0.00 C ATOM 1771 O GLY A 109 1.839 -8.195 3.510 1.00 0.00 O ATOM 0 H GLY A 109 3.798 -6.749 2.412 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.447 -8.351 0.318 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.653 -8.963 1.433 1.00 0.00 H new ATOM 1775 N PHE A 110 0.701 -9.257 1.871 1.00 0.00 N ATOM 1776 CA PHE A 110 -0.497 -9.610 2.637 1.00 0.00 C ATOM 1777 C PHE A 110 -0.483 -11.072 3.093 1.00 0.00 C ATOM 1778 O PHE A 110 0.122 -11.940 2.460 1.00 0.00 O ATOM 1779 CB PHE A 110 -1.751 -9.320 1.797 1.00 0.00 C ATOM 1780 CG PHE A 110 -2.149 -7.861 1.755 1.00 0.00 C ATOM 1781 CD1 PHE A 110 -3.337 -7.443 2.385 1.00 0.00 C ATOM 1782 CD2 PHE A 110 -1.332 -6.916 1.103 1.00 0.00 C ATOM 1783 CE1 PHE A 110 -3.698 -6.086 2.378 1.00 0.00 C ATOM 1784 CE2 PHE A 110 -1.679 -5.557 1.123 1.00 0.00 C ATOM 1785 CZ PHE A 110 -2.859 -5.142 1.760 1.00 0.00 C ATOM 0 H PHE A 110 0.666 -9.599 0.911 1.00 0.00 H new ATOM 0 HA PHE A 110 -0.510 -8.997 3.538 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -1.580 -9.667 0.778 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.583 -9.900 2.196 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -3.971 -8.167 2.874 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -0.439 -7.238 0.588 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -4.618 -5.768 2.846 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -1.038 -4.829 0.648 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.123 -4.095 1.775 1.00 0.00 H new ATOM 1795 N THR A 111 -1.222 -11.353 4.168 1.00 0.00 N ATOM 1796 CA THR A 111 -1.379 -12.701 4.739 1.00 0.00 C ATOM 1797 C THR A 111 -2.236 -13.624 3.861 1.00 0.00 C ATOM 1798 O THR A 111 -2.088 -14.847 3.916 1.00 0.00 O ATOM 1799 CB THR A 111 -1.945 -12.582 6.168 1.00 0.00 C ATOM 1800 OG1 THR A 111 -1.851 -13.804 6.869 1.00 0.00 O ATOM 1801 CG2 THR A 111 -3.405 -12.121 6.234 1.00 0.00 C ATOM 0 H THR A 111 -1.740 -10.639 4.679 1.00 0.00 H new ATOM 0 HA THR A 111 -0.396 -13.171 4.778 1.00 0.00 H new ATOM 0 HB THR A 111 -1.325 -11.815 6.631 1.00 0.00 H new ATOM 0 HG1 THR A 111 -2.217 -13.693 7.771 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.722 -12.065 7.275 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.497 -11.138 5.773 1.00 0.00 H new ATOM 0 HG23 THR A 111 -4.036 -12.832 5.701 1.00 0.00 H new ATOM 1809 N ASP A 112 -3.105 -13.056 3.013 1.00 0.00 N ATOM 1810 CA ASP A 112 -4.011 -13.806 2.138 1.00 0.00 C ATOM 1811 C ASP A 112 -4.405 -13.005 0.885 1.00 0.00 C ATOM 1812 O ASP A 112 -4.552 -11.778 0.927 1.00 0.00 O ATOM 1813 CB ASP A 112 -5.262 -14.225 2.930 1.00 0.00 C ATOM 1814 CG ASP A 112 -6.096 -15.264 2.164 1.00 0.00 C ATOM 1815 OD1 ASP A 112 -5.840 -16.481 2.320 1.00 0.00 O ATOM 1816 OD2 ASP A 112 -6.982 -14.862 1.376 1.00 0.00 O ATOM 0 H ASP A 112 -3.198 -12.045 2.916 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.484 -14.694 1.791 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.962 -14.637 3.893 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.874 -13.347 3.136 1.00 0.00 H new ATOM 1821 N ARG A 113 -4.613 -13.705 -0.237 1.00 0.00 N ATOM 1822 CA ARG A 113 -5.001 -13.113 -1.527 1.00 0.00 C ATOM 1823 C ARG A 113 -6.381 -12.447 -1.497 1.00 0.00 C ATOM 1824 O ARG A 113 -6.555 -11.401 -2.116 1.00 0.00 O ATOM 1825 CB ARG A 113 -4.907 -14.205 -2.606 1.00 0.00 C ATOM 1826 CG ARG A 113 -5.004 -13.627 -4.023 1.00 0.00 C ATOM 1827 CD ARG A 113 -4.840 -14.736 -5.072 1.00 0.00 C ATOM 1828 NE ARG A 113 -4.812 -14.189 -6.444 1.00 0.00 N ATOM 1829 CZ ARG A 113 -5.463 -14.620 -7.510 1.00 0.00 C ATOM 1830 NH1 ARG A 113 -5.286 -14.007 -8.642 1.00 0.00 N ATOM 1831 NH2 ARG A 113 -6.276 -15.638 -7.486 1.00 0.00 N ATOM 0 H ARG A 113 -4.515 -14.720 -0.276 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.312 -12.301 -1.760 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -3.964 -14.741 -2.497 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.706 -14.932 -2.456 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -5.967 -13.134 -4.155 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -4.235 -12.868 -4.165 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -3.918 -15.285 -4.880 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -5.660 -15.448 -4.981 1.00 0.00 H new ATOM 0 HE ARG A 113 -4.214 -13.375 -6.587 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -4.654 -13.208 -8.696 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -5.779 -14.324 -9.476 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -6.435 -16.144 -6.614 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -6.754 -15.929 -8.339 1.00 0.00 H new ATOM 1845 N GLY A 114 -7.340 -12.988 -0.746 1.00 0.00 N ATOM 1846 CA GLY A 114 -8.669 -12.390 -0.581 1.00 0.00 C ATOM 1847 C GLY A 114 -8.640 -11.053 0.170 1.00 0.00 C ATOM 1848 O GLY A 114 -9.431 -10.159 -0.126 1.00 0.00 O ATOM 0 H GLY A 114 -7.218 -13.860 -0.231 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.117 -12.238 -1.563 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.310 -13.088 -0.043 1.00 0.00 H new ATOM 1852 N ASP A 115 -7.681 -10.873 1.083 1.00 0.00 N ATOM 1853 CA ASP A 115 -7.499 -9.621 1.832 1.00 0.00 C ATOM 1854 C ASP A 115 -6.704 -8.576 1.034 1.00 0.00 C ATOM 1855 O ASP A 115 -6.998 -7.383 1.118 1.00 0.00 O ATOM 1856 CB ASP A 115 -6.859 -9.914 3.196 1.00 0.00 C ATOM 1857 CG ASP A 115 -7.855 -10.593 4.153 1.00 0.00 C ATOM 1858 OD1 ASP A 115 -8.948 -10.018 4.383 1.00 0.00 O ATOM 1859 OD2 ASP A 115 -7.542 -11.677 4.696 1.00 0.00 O ATOM 0 H ASP A 115 -7.003 -11.595 1.327 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.482 -9.182 2.002 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -5.988 -10.556 3.060 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -6.503 -8.984 3.639 1.00 0.00 H new ATOM 1864 N ALA A 116 -5.772 -9.012 0.182 1.00 0.00 N ATOM 1865 CA ALA A 116 -5.163 -8.161 -0.835 1.00 0.00 C ATOM 1866 C ALA A 116 -6.162 -7.681 -1.906 1.00 0.00 C ATOM 1867 O ALA A 116 -6.133 -6.519 -2.317 1.00 0.00 O ATOM 1868 CB ALA A 116 -4.047 -8.975 -1.465 1.00 0.00 C ATOM 0 H ALA A 116 -5.420 -9.969 0.181 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.790 -7.249 -0.369 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.556 -8.383 -2.237 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.320 -9.249 -0.700 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -4.463 -9.878 -1.911 1.00 0.00 H new ATOM 1874 N PHE A 117 -7.096 -8.540 -2.327 1.00 0.00 N ATOM 1875 CA PHE A 117 -8.228 -8.110 -3.156 1.00 0.00 C ATOM 1876 C PHE A 117 -9.097 -7.077 -2.421 1.00 0.00 C ATOM 1877 O PHE A 117 -9.511 -6.096 -3.036 1.00 0.00 O ATOM 1878 CB PHE A 117 -9.046 -9.322 -3.629 1.00 0.00 C ATOM 1879 CG PHE A 117 -8.689 -9.788 -5.031 1.00 0.00 C ATOM 1880 CD1 PHE A 117 -9.569 -9.534 -6.103 1.00 0.00 C ATOM 1881 CD2 PHE A 117 -7.476 -10.459 -5.279 1.00 0.00 C ATOM 1882 CE1 PHE A 117 -9.243 -9.956 -7.405 1.00 0.00 C ATOM 1883 CE2 PHE A 117 -7.153 -10.888 -6.579 1.00 0.00 C ATOM 1884 CZ PHE A 117 -8.036 -10.636 -7.643 1.00 0.00 C ATOM 0 H PHE A 117 -7.091 -9.536 -2.108 1.00 0.00 H new ATOM 0 HA PHE A 117 -7.834 -7.615 -4.044 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.895 -10.146 -2.932 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.106 -9.069 -3.598 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.498 -9.013 -5.924 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -6.790 -10.645 -4.466 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -9.921 -9.757 -8.222 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -6.226 -11.411 -6.760 1.00 0.00 H new ATOM 0 HZ PHE A 117 -7.788 -10.964 -8.642 1.00 0.00 H new ATOM 1894 N ASP A 118 -9.311 -7.223 -1.108 1.00 0.00 N ATOM 1895 CA ASP A 118 -10.086 -6.265 -0.306 1.00 0.00 C ATOM 1896 C ASP A 118 -9.388 -4.893 -0.170 1.00 0.00 C ATOM 1897 O ASP A 118 -10.054 -3.859 -0.257 1.00 0.00 O ATOM 1898 CB ASP A 118 -10.419 -6.892 1.062 1.00 0.00 C ATOM 1899 CG ASP A 118 -11.692 -6.325 1.719 1.00 0.00 C ATOM 1900 OD1 ASP A 118 -12.627 -5.883 1.010 1.00 0.00 O ATOM 1901 OD2 ASP A 118 -11.787 -6.405 2.966 1.00 0.00 O ATOM 0 H ASP A 118 -8.951 -8.011 -0.569 1.00 0.00 H new ATOM 0 HA ASP A 118 -11.018 -6.057 -0.832 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -10.535 -7.969 0.938 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -9.576 -6.738 1.735 1.00 0.00 H new ATOM 1906 N PHE A 119 -8.051 -4.859 -0.063 1.00 0.00 N ATOM 1907 CA PHE A 119 -7.228 -3.640 -0.187 1.00 0.00 C ATOM 1908 C PHE A 119 -7.497 -2.903 -1.511 1.00 0.00 C ATOM 1909 O PHE A 119 -7.809 -1.711 -1.515 1.00 0.00 O ATOM 1910 CB PHE A 119 -5.739 -4.010 -0.025 1.00 0.00 C ATOM 1911 CG PHE A 119 -4.745 -2.952 -0.486 1.00 0.00 C ATOM 1912 CD1 PHE A 119 -4.212 -2.033 0.432 1.00 0.00 C ATOM 1913 CD2 PHE A 119 -4.348 -2.881 -1.836 1.00 0.00 C ATOM 1914 CE1 PHE A 119 -3.336 -1.024 0.006 1.00 0.00 C ATOM 1915 CE2 PHE A 119 -3.467 -1.872 -2.266 1.00 0.00 C ATOM 1916 CZ PHE A 119 -2.963 -0.937 -1.346 1.00 0.00 C ATOM 0 H PHE A 119 -7.497 -5.696 0.116 1.00 0.00 H new ATOM 0 HA PHE A 119 -7.503 -2.946 0.607 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.549 -4.228 1.026 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.549 -4.928 -0.580 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.479 -2.104 1.476 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -4.722 -3.605 -2.545 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.947 -0.312 0.719 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -3.178 -1.816 -3.305 1.00 0.00 H new ATOM 0 HZ PHE A 119 -2.293 -0.157 -1.676 1.00 0.00 H new ATOM 1926 N ASN A 120 -7.431 -3.621 -2.636 1.00 0.00 N ATOM 1927 CA ASN A 120 -7.619 -3.053 -3.972 1.00 0.00 C ATOM 1928 C ASN A 120 -9.070 -2.597 -4.220 1.00 0.00 C ATOM 1929 O ASN A 120 -9.299 -1.509 -4.757 1.00 0.00 O ATOM 1930 CB ASN A 120 -7.139 -4.109 -4.991 1.00 0.00 C ATOM 1931 CG ASN A 120 -7.812 -4.000 -6.349 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -7.582 -3.083 -7.122 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -8.707 -4.910 -6.660 1.00 0.00 N ATOM 0 H ASN A 120 -7.243 -4.624 -2.644 1.00 0.00 H new ATOM 0 HA ASN A 120 -7.030 -2.142 -4.080 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -6.061 -4.011 -5.121 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -7.322 -5.103 -4.584 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -9.209 -4.850 -7.546 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -8.900 -5.677 -6.015 1.00 0.00 H new ATOM 1940 N VAL A 121 -10.058 -3.394 -3.803 1.00 0.00 N ATOM 1941 CA VAL A 121 -11.479 -3.057 -3.970 1.00 0.00 C ATOM 1942 C VAL A 121 -11.851 -1.830 -3.133 1.00 0.00 C ATOM 1943 O VAL A 121 -12.564 -0.955 -3.623 1.00 0.00 O ATOM 1944 CB VAL A 121 -12.381 -4.273 -3.670 1.00 0.00 C ATOM 1945 CG1 VAL A 121 -13.873 -3.914 -3.597 1.00 0.00 C ATOM 1946 CG2 VAL A 121 -12.234 -5.325 -4.779 1.00 0.00 C ATOM 0 H VAL A 121 -9.898 -4.289 -3.341 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.649 -2.793 -5.014 1.00 0.00 H new ATOM 0 HB VAL A 121 -12.056 -4.649 -2.700 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.453 -4.812 -3.383 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -14.033 -3.182 -2.805 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -14.193 -3.493 -4.550 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.874 -6.179 -4.558 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -12.527 -4.890 -5.735 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.196 -5.654 -4.833 1.00 0.00 H new ATOM 1956 N SER A 122 -11.296 -1.694 -1.925 1.00 0.00 N ATOM 1957 CA SER A 122 -11.512 -0.526 -1.054 1.00 0.00 C ATOM 1958 C SER A 122 -10.936 0.786 -1.608 1.00 0.00 C ATOM 1959 O SER A 122 -11.313 1.856 -1.131 1.00 0.00 O ATOM 1960 CB SER A 122 -10.934 -0.783 0.338 1.00 0.00 C ATOM 1961 OG SER A 122 -11.562 -1.902 0.936 1.00 0.00 O ATOM 0 H SER A 122 -10.678 -2.396 -1.517 1.00 0.00 H new ATOM 0 HA SER A 122 -12.593 -0.397 -1.004 1.00 0.00 H new ATOM 0 HB2 SER A 122 -9.860 -0.956 0.266 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.074 0.098 0.965 1.00 0.00 H new ATOM 0 HG SER A 122 -11.139 -2.725 0.614 1.00 0.00 H new ATOM 1967 N LEU A 123 -10.066 0.729 -2.627 1.00 0.00 N ATOM 1968 CA LEU A 123 -9.637 1.895 -3.405 1.00 0.00 C ATOM 1969 C LEU A 123 -10.531 2.104 -4.640 1.00 0.00 C ATOM 1970 O LEU A 123 -11.108 3.180 -4.804 1.00 0.00 O ATOM 1971 CB LEU A 123 -8.147 1.758 -3.780 1.00 0.00 C ATOM 1972 CG LEU A 123 -7.163 1.816 -2.593 1.00 0.00 C ATOM 1973 CD1 LEU A 123 -5.756 1.460 -3.073 1.00 0.00 C ATOM 1974 CD2 LEU A 123 -7.111 3.209 -1.957 1.00 0.00 C ATOM 0 H LEU A 123 -9.636 -0.142 -2.936 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.747 2.788 -2.790 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.006 0.812 -4.302 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.891 2.551 -4.482 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.516 1.104 -1.848 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -5.063 1.502 -2.232 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.758 0.454 -3.492 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.442 2.170 -3.838 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.406 3.203 -1.126 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.789 3.937 -2.701 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -8.101 3.479 -1.591 1.00 0.00 H new ATOM 1986 N GLN A 124 -10.705 1.091 -5.499 1.00 0.00 N ATOM 1987 CA GLN A 124 -11.420 1.278 -6.774 1.00 0.00 C ATOM 1988 C GLN A 124 -12.930 1.529 -6.605 1.00 0.00 C ATOM 1989 O GLN A 124 -13.509 2.322 -7.347 1.00 0.00 O ATOM 1990 CB GLN A 124 -11.101 0.135 -7.757 1.00 0.00 C ATOM 1991 CG GLN A 124 -11.879 -1.166 -7.554 1.00 0.00 C ATOM 1992 CD GLN A 124 -11.520 -2.206 -8.615 1.00 0.00 C ATOM 1993 OE1 GLN A 124 -12.310 -2.537 -9.489 1.00 0.00 O ATOM 1994 NE2 GLN A 124 -10.320 -2.753 -8.608 1.00 0.00 N ATOM 0 H GLN A 124 -10.366 0.142 -5.340 1.00 0.00 H new ATOM 0 HA GLN A 124 -11.043 2.201 -7.215 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.288 0.492 -8.770 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.036 -0.088 -7.689 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.666 -1.567 -6.563 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -12.949 -0.961 -7.592 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -9.645 -2.492 -7.889 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -10.067 -3.437 -9.321 1.00 0.00 H new ATOM 2003 N ASP A 125 -13.559 0.935 -5.585 1.00 0.00 N ATOM 2004 CA ASP A 125 -14.965 1.168 -5.228 1.00 0.00 C ATOM 2005 C ASP A 125 -15.139 2.369 -4.273 1.00 0.00 C ATOM 2006 O ASP A 125 -16.246 2.657 -3.811 1.00 0.00 O ATOM 2007 CB ASP A 125 -15.588 -0.129 -4.685 1.00 0.00 C ATOM 2008 CG ASP A 125 -17.123 -0.058 -4.560 1.00 0.00 C ATOM 2009 OD1 ASP A 125 -17.674 -0.566 -3.554 1.00 0.00 O ATOM 2010 OD2 ASP A 125 -17.788 0.479 -5.479 1.00 0.00 O ATOM 0 H ASP A 125 -13.096 0.265 -4.971 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.509 1.446 -6.131 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.321 -0.956 -5.343 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -15.160 -0.349 -3.707 1.00 0.00 H new ATOM 2015 N HIS A 126 -14.058 3.116 -4.012 1.00 0.00 N ATOM 2016 CA HIS A 126 -14.108 4.444 -3.395 1.00 0.00 C ATOM 2017 C HIS A 126 -13.913 5.577 -4.414 1.00 0.00 C ATOM 2018 O HIS A 126 -14.553 6.618 -4.293 1.00 0.00 O ATOM 2019 CB HIS A 126 -13.096 4.520 -2.249 1.00 0.00 C ATOM 2020 CG HIS A 126 -13.159 5.845 -1.539 1.00 0.00 C ATOM 2021 ND1 HIS A 126 -14.222 6.293 -0.748 1.00 0.00 N ATOM 2022 CD2 HIS A 126 -12.211 6.822 -1.610 1.00 0.00 C ATOM 2023 CE1 HIS A 126 -13.879 7.527 -0.343 1.00 0.00 C ATOM 2024 NE2 HIS A 126 -12.684 7.867 -0.852 1.00 0.00 N ATOM 0 H HIS A 126 -13.110 2.808 -4.228 1.00 0.00 H new ATOM 0 HA HIS A 126 -15.108 4.589 -2.987 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -13.290 3.717 -1.538 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -12.091 4.364 -2.640 1.00 0.00 H new ATOM 0 HD1 HIS A 126 -15.080 5.788 -0.525 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -11.278 6.783 -2.152 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -14.478 8.155 0.300 1.00 0.00 H new ATOM 2032 N PHE A 127 -13.096 5.376 -5.455 1.00 0.00 N ATOM 2033 CA PHE A 127 -12.835 6.375 -6.506 1.00 0.00 C ATOM 2034 C PHE A 127 -13.794 6.329 -7.713 1.00 0.00 C ATOM 2035 O PHE A 127 -13.711 7.209 -8.572 1.00 0.00 O ATOM 2036 CB PHE A 127 -11.366 6.272 -6.946 1.00 0.00 C ATOM 2037 CG PHE A 127 -10.369 6.911 -5.994 1.00 0.00 C ATOM 2038 CD1 PHE A 127 -9.438 6.123 -5.292 1.00 0.00 C ATOM 2039 CD2 PHE A 127 -10.330 8.312 -5.861 1.00 0.00 C ATOM 2040 CE1 PHE A 127 -8.440 6.728 -4.511 1.00 0.00 C ATOM 2041 CE2 PHE A 127 -9.341 8.920 -5.065 1.00 0.00 C ATOM 2042 CZ PHE A 127 -8.386 8.130 -4.405 1.00 0.00 C ATOM 0 H PHE A 127 -12.589 4.502 -5.596 1.00 0.00 H new ATOM 0 HA PHE A 127 -13.032 7.349 -6.059 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -11.110 5.219 -7.065 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -11.261 6.738 -7.926 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -9.491 5.046 -5.354 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -11.061 8.922 -6.371 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -7.715 6.118 -3.993 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -9.317 9.995 -4.962 1.00 0.00 H new ATOM 0 HZ PHE A 127 -7.611 8.598 -3.817 1.00 0.00 H new ATOM 2052 N LYS A 128 -14.734 5.372 -7.801 1.00 0.00 N ATOM 2053 CA LYS A 128 -15.617 5.214 -8.984 1.00 0.00 C ATOM 2054 C LYS A 128 -16.420 6.463 -9.385 1.00 0.00 C ATOM 2055 O LYS A 128 -16.656 6.682 -10.572 1.00 0.00 O ATOM 2056 CB LYS A 128 -16.516 3.967 -8.883 1.00 0.00 C ATOM 2057 CG LYS A 128 -17.758 4.074 -7.981 1.00 0.00 C ATOM 2058 CD LYS A 128 -17.405 4.096 -6.493 1.00 0.00 C ATOM 2059 CE LYS A 128 -18.643 4.073 -5.595 1.00 0.00 C ATOM 2060 NZ LYS A 128 -19.359 2.771 -5.649 1.00 0.00 N ATOM 0 H LYS A 128 -14.907 4.688 -7.064 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.918 5.065 -9.807 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.848 3.706 -9.888 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -15.906 3.138 -8.524 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -18.309 4.980 -8.233 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -18.421 3.232 -8.181 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.775 3.237 -6.260 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.819 4.989 -6.275 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.346 4.279 -4.567 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.322 4.871 -5.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -20.073 2.736 -4.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -19.826 2.670 -6.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.679 1.995 -5.518 1.00 0.00 H new ATOM 2074 N TRP A 129 -16.798 7.302 -8.417 1.00 0.00 N ATOM 2075 CA TRP A 129 -17.515 8.570 -8.637 1.00 0.00 C ATOM 2076 C TRP A 129 -16.586 9.734 -9.037 1.00 0.00 C ATOM 2077 O TRP A 129 -17.040 10.709 -9.637 1.00 0.00 O ATOM 2078 CB TRP A 129 -18.314 8.927 -7.376 1.00 0.00 C ATOM 2079 CG TRP A 129 -17.474 9.272 -6.184 1.00 0.00 C ATOM 2080 CD1 TRP A 129 -16.844 8.380 -5.391 1.00 0.00 C ATOM 2081 CD2 TRP A 129 -17.123 10.591 -5.651 1.00 0.00 C ATOM 2082 NE1 TRP A 129 -16.073 9.044 -4.463 1.00 0.00 N ATOM 2083 CE2 TRP A 129 -16.234 10.409 -4.547 1.00 0.00 C ATOM 2084 CE3 TRP A 129 -17.464 11.920 -5.985 1.00 0.00 C ATOM 2085 CZ2 TRP A 129 -15.711 11.484 -3.814 1.00 0.00 C ATOM 2086 CZ3 TRP A 129 -16.964 13.008 -5.241 1.00 0.00 C ATOM 2087 CH2 TRP A 129 -16.090 12.793 -4.159 1.00 0.00 C ATOM 0 H TRP A 129 -16.611 7.117 -7.431 1.00 0.00 H new ATOM 0 HA TRP A 129 -18.189 8.420 -9.480 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -18.966 9.771 -7.601 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -18.958 8.086 -7.119 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -16.931 7.307 -5.472 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -15.457 8.581 -3.795 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -18.118 12.106 -6.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -15.027 11.309 -2.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -17.254 14.015 -5.503 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -15.711 13.632 -3.595 1.00 0.00 H new ATOM 2098 N VAL A 130 -15.284 9.621 -8.748 1.00 0.00 N ATOM 2099 CA VAL A 130 -14.234 10.564 -9.176 1.00 0.00 C ATOM 2100 C VAL A 130 -13.790 10.265 -10.617 1.00 0.00 C ATOM 2101 O VAL A 130 -13.496 11.183 -11.384 1.00 0.00 O ATOM 2102 CB VAL A 130 -13.031 10.537 -8.204 1.00 0.00 C ATOM 2103 CG1 VAL A 130 -12.029 11.661 -8.501 1.00 0.00 C ATOM 2104 CG2 VAL A 130 -13.474 10.703 -6.743 1.00 0.00 C ATOM 0 H VAL A 130 -14.917 8.848 -8.193 1.00 0.00 H new ATOM 0 HA VAL A 130 -14.653 11.570 -9.154 1.00 0.00 H new ATOM 0 HB VAL A 130 -12.562 9.564 -8.351 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.200 11.605 -7.795 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -11.649 11.551 -9.517 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.525 12.626 -8.402 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -12.600 10.679 -6.093 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -13.988 11.657 -6.625 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -14.150 9.891 -6.473 1.00 0.00 H new ATOM 2114 N LYS A 131 -13.811 8.985 -11.019 1.00 0.00 N ATOM 2115 CA LYS A 131 -13.440 8.477 -12.351 1.00 0.00 C ATOM 2116 C LYS A 131 -14.677 8.333 -13.255 1.00 0.00 C ATOM 2117 O LYS A 131 -14.917 7.293 -13.868 1.00 0.00 O ATOM 2118 CB LYS A 131 -12.580 7.206 -12.166 1.00 0.00 C ATOM 2119 CG LYS A 131 -11.944 6.596 -13.433 1.00 0.00 C ATOM 2120 CD LYS A 131 -11.281 7.622 -14.366 1.00 0.00 C ATOM 2121 CE LYS A 131 -10.578 6.906 -15.524 1.00 0.00 C ATOM 2122 NZ LYS A 131 -10.097 7.873 -16.542 1.00 0.00 N ATOM 0 H LYS A 131 -14.103 8.236 -10.391 1.00 0.00 H new ATOM 0 HA LYS A 131 -12.818 9.188 -12.895 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -11.779 7.439 -11.464 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -13.201 6.442 -11.698 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -11.198 5.861 -13.132 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -12.713 6.060 -13.989 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -12.032 8.309 -14.756 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -10.561 8.220 -13.808 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -9.736 6.329 -15.141 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -11.265 6.198 -15.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -9.581 7.364 -17.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -10.909 8.370 -16.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -9.463 8.564 -16.092 1.00 0.00 H new ATOM 2136 N GLN A 132 -15.487 9.392 -13.309 1.00 0.00 N ATOM 2137 CA GLN A 132 -16.669 9.499 -14.161 1.00 0.00 C ATOM 2138 C GLN A 132 -16.324 10.274 -15.442 1.00 0.00 C ATOM 2139 O GLN A 132 -16.173 11.499 -15.433 1.00 0.00 O ATOM 2140 CB GLN A 132 -17.834 10.148 -13.395 1.00 0.00 C ATOM 2141 CG GLN A 132 -18.433 9.224 -12.323 1.00 0.00 C ATOM 2142 CD GLN A 132 -19.120 7.992 -12.914 1.00 0.00 C ATOM 2143 OE1 GLN A 132 -20.090 8.078 -13.657 1.00 0.00 O ATOM 2144 NE2 GLN A 132 -18.646 6.800 -12.620 1.00 0.00 N ATOM 0 H GLN A 132 -15.332 10.225 -12.742 1.00 0.00 H new ATOM 0 HA GLN A 132 -16.992 8.499 -14.451 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -17.485 11.066 -12.922 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -18.614 10.430 -14.102 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -17.642 8.902 -11.645 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -19.154 9.785 -11.729 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -17.839 6.710 -12.003 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -19.086 5.966 -13.009 1.00 0.00 H new ATOM 2153 N GLU A 133 -16.186 9.535 -16.544 1.00 0.00 N ATOM 2154 CA GLU A 133 -15.942 10.053 -17.907 1.00 0.00 C ATOM 2155 C GLU A 133 -17.095 10.925 -18.450 1.00 0.00 C ATOM 2156 O GLU A 133 -18.278 10.524 -18.331 1.00 0.00 O ATOM 2157 CB GLU A 133 -15.662 8.886 -18.873 1.00 0.00 C ATOM 2158 CG GLU A 133 -14.386 8.084 -18.566 1.00 0.00 C ATOM 2159 CD GLU A 133 -13.089 8.913 -18.718 1.00 0.00 C ATOM 2160 OE1 GLU A 133 -12.796 9.410 -19.835 1.00 0.00 O ATOM 2161 OE2 GLU A 133 -12.322 9.036 -17.731 1.00 0.00 O ATOM 2162 OXT GLU A 133 -16.805 12.008 -19.009 1.00 0.00 O ATOM 0 H GLU A 133 -16.242 8.517 -16.519 1.00 0.00 H new ATOM 0 HA GLU A 133 -15.069 10.702 -17.839 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -16.514 8.206 -18.855 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -15.590 9.281 -19.886 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -14.444 7.698 -17.548 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.338 7.222 -19.232 1.00 0.00 H new TER 2169 GLU A 133