USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 780 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 6 SER OG : rot -75:sc= 1.78 USER MOD Set 1.2: A 91 LYS NZ :NH3+ -158:sc= 0.993 (180deg=-0.098) USER MOD Set 1.3: A 93 SER OG : rot -92:sc= 1.48 USER MOD Set 2.1: A 38 GLN : amide:sc= 0.951 K(o=0.77,f=-0.34) USER MOD Set 2.2: A 77 MET CE :methyl -141:sc= -0.18 (180deg=-2.36!) USER MOD Set 3.1: A 10 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 14 GLN : amide:sc= 1.25 K(o=1.2,f=-3.3!) USER MOD Set 4.1: A 5 SER OG : rot -35:sc= 1.15 USER MOD Set 4.2: A 96 ASN : amide:sc= 0.582 K(o=1.7,f=0.59) USER MOD Single : A 1 GLY N :NH3+ 138:sc= 0.0248 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0.992 K(o=0.99,f=0) USER MOD Single : A 17 THR OG1 : rot 71:sc= 0.792 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0.769 K(o=0.77,f=-0.75) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 47 MET CE :methyl 171:sc= -0.0681 (180deg=-0.303) USER MOD Single : A 49 LYS NZ :NH3+ -154:sc= 2.47 (180deg=1.72) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0.797 K(o=0.8,f=0) USER MOD Single : A 56 HIS : no HD1:sc= 1.08 K(o=1.1,f=-6.8!) USER MOD Single : A 57 GLN : amide:sc= 0.894 K(o=0.89,f=-0.016) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 178:sc= 0 (180deg=-0.00369) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 179:sc= 1.13 (180deg=1.13) USER MOD Single : A 90 ASN : amide:sc= 0.509 K(o=0.51,f=-3.8!) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= 0.636 K(o=0.64,f=-0.86) USER MOD Single : A 100 SER OG : rot 180:sc= 0.00165 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0.00214 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.134 -17.570 5.071 1.00 0.00 N ATOM 2 CA GLY A 1 -5.781 -17.098 5.439 1.00 0.00 C ATOM 3 C GLY A 1 -5.672 -16.822 6.931 1.00 0.00 C ATOM 4 O GLY A 1 -6.647 -16.419 7.567 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.433 -17.111 4.187 1.00 0.00 H new ATOM 0 H2 GLY A 1 -7.117 -18.601 4.937 1.00 0.00 H new ATOM 0 H3 GLY A 1 -7.804 -17.330 5.830 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.043 -17.847 5.152 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.547 -16.190 4.882 1.00 0.00 H new ATOM 10 N SER A 2 -4.484 -17.036 7.505 1.00 0.00 N ATOM 11 CA SER A 2 -4.197 -16.834 8.939 1.00 0.00 C ATOM 12 C SER A 2 -4.190 -15.353 9.353 1.00 0.00 C ATOM 13 O SER A 2 -3.920 -14.465 8.538 1.00 0.00 O ATOM 14 CB SER A 2 -2.845 -17.465 9.301 1.00 0.00 C ATOM 15 OG SER A 2 -2.829 -18.844 8.959 1.00 0.00 O ATOM 0 H SER A 2 -3.673 -17.362 6.979 1.00 0.00 H new ATOM 0 HA SER A 2 -5.006 -17.320 9.485 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.043 -16.945 8.777 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.657 -17.347 10.368 1.00 0.00 H new ATOM 0 HG SER A 2 -1.959 -19.230 9.195 1.00 0.00 H new ATOM 21 N SER A 3 -4.446 -15.083 10.638 1.00 0.00 N ATOM 22 CA SER A 3 -4.359 -13.732 11.223 1.00 0.00 C ATOM 23 C SER A 3 -2.905 -13.248 11.352 1.00 0.00 C ATOM 24 O SER A 3 -1.985 -14.052 11.526 1.00 0.00 O ATOM 25 CB SER A 3 -5.036 -13.681 12.598 1.00 0.00 C ATOM 26 OG SER A 3 -6.431 -13.924 12.491 1.00 0.00 O ATOM 0 H SER A 3 -4.722 -15.799 11.310 1.00 0.00 H new ATOM 0 HA SER A 3 -4.882 -13.065 10.537 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.584 -14.423 13.257 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.868 -12.705 13.054 1.00 0.00 H new ATOM 0 HG SER A 3 -6.839 -13.888 13.381 1.00 0.00 H new ATOM 32 N GLY A 4 -2.700 -11.928 11.292 1.00 0.00 N ATOM 33 CA GLY A 4 -1.387 -11.288 11.418 1.00 0.00 C ATOM 34 C GLY A 4 -1.454 -9.852 11.951 1.00 0.00 C ATOM 35 O GLY A 4 -2.482 -9.176 11.845 1.00 0.00 O ATOM 0 H GLY A 4 -3.459 -11.261 11.151 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.763 -11.885 12.083 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.899 -11.283 10.443 1.00 0.00 H new ATOM 39 N SER A 5 -0.346 -9.393 12.534 1.00 0.00 N ATOM 40 CA SER A 5 -0.192 -8.113 13.244 1.00 0.00 C ATOM 41 C SER A 5 1.195 -7.498 13.013 1.00 0.00 C ATOM 42 O SER A 5 2.118 -8.186 12.570 1.00 0.00 O ATOM 43 CB SER A 5 -0.441 -8.324 14.746 1.00 0.00 C ATOM 44 OG SER A 5 0.486 -9.246 15.300 1.00 0.00 O ATOM 0 H SER A 5 0.520 -9.932 12.526 1.00 0.00 H new ATOM 0 HA SER A 5 -0.927 -7.413 12.847 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.363 -7.370 15.267 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.456 -8.689 14.900 1.00 0.00 H new ATOM 0 HG SER A 5 0.696 -9.937 14.637 1.00 0.00 H new ATOM 50 N SER A 6 1.353 -6.199 13.293 1.00 0.00 N ATOM 51 CA SER A 6 2.621 -5.475 13.101 1.00 0.00 C ATOM 52 C SER A 6 3.733 -5.976 14.032 1.00 0.00 C ATOM 53 O SER A 6 3.734 -5.695 15.234 1.00 0.00 O ATOM 54 CB SER A 6 2.430 -3.966 13.287 1.00 0.00 C ATOM 55 OG SER A 6 1.777 -3.421 12.154 1.00 0.00 O ATOM 0 H SER A 6 0.602 -5.615 13.661 1.00 0.00 H new ATOM 0 HA SER A 6 2.933 -5.674 12.076 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.843 -3.773 14.185 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.397 -3.483 13.428 1.00 0.00 H new ATOM 0 HG SER A 6 2.408 -3.369 11.406 1.00 0.00 H new ATOM 61 N GLY A 7 4.699 -6.700 13.462 1.00 0.00 N ATOM 62 CA GLY A 7 5.958 -7.084 14.106 1.00 0.00 C ATOM 63 C GLY A 7 7.029 -5.977 14.041 1.00 0.00 C ATOM 64 O GLY A 7 6.766 -4.888 13.516 1.00 0.00 O ATOM 0 H GLY A 7 4.624 -7.047 12.506 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.765 -7.334 15.149 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.344 -7.984 13.628 1.00 0.00 H new ATOM 68 N PRO A 8 8.248 -6.236 14.550 1.00 0.00 N ATOM 69 CA PRO A 8 9.377 -5.313 14.429 1.00 0.00 C ATOM 70 C PRO A 8 9.830 -5.146 12.967 1.00 0.00 C ATOM 71 O PRO A 8 9.706 -6.063 12.148 1.00 0.00 O ATOM 72 CB PRO A 8 10.482 -5.906 15.311 1.00 0.00 C ATOM 73 CG PRO A 8 10.194 -7.408 15.270 1.00 0.00 C ATOM 74 CD PRO A 8 8.667 -7.464 15.213 1.00 0.00 C ATOM 0 HA PRO A 8 9.108 -4.307 14.752 1.00 0.00 H new ATOM 0 HB2 PRO A 8 11.474 -5.676 14.923 1.00 0.00 H new ATOM 0 HB3 PRO A 8 10.439 -5.515 16.328 1.00 0.00 H new ATOM 0 HG2 PRO A 8 10.648 -7.882 14.400 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.584 -7.918 16.151 1.00 0.00 H new ATOM 0 HD2 PRO A 8 8.328 -8.341 14.661 1.00 0.00 H new ATOM 0 HD3 PRO A 8 8.241 -7.533 16.214 1.00 0.00 H new ATOM 82 N ILE A 9 10.383 -3.975 12.639 1.00 0.00 N ATOM 83 CA ILE A 9 10.896 -3.659 11.295 1.00 0.00 C ATOM 84 C ILE A 9 12.223 -4.377 10.992 1.00 0.00 C ATOM 85 O ILE A 9 13.004 -4.663 11.906 1.00 0.00 O ATOM 86 CB ILE A 9 10.976 -2.144 11.052 1.00 0.00 C ATOM 87 CG1 ILE A 9 12.109 -1.459 11.839 1.00 0.00 C ATOM 88 CG2 ILE A 9 9.606 -1.485 11.324 1.00 0.00 C ATOM 89 CD1 ILE A 9 12.292 -0.007 11.401 1.00 0.00 C ATOM 0 H ILE A 9 10.490 -3.209 13.304 1.00 0.00 H new ATOM 0 HA ILE A 9 10.171 -4.050 10.581 1.00 0.00 H new ATOM 0 HB ILE A 9 11.229 -2.002 10.001 1.00 0.00 H new ATOM 0 HG12 ILE A 9 11.886 -1.494 12.905 1.00 0.00 H new ATOM 0 HG13 ILE A 9 13.040 -2.006 11.690 1.00 0.00 H new ATOM 0 HG21 ILE A 9 9.677 -0.412 11.148 1.00 0.00 H new ATOM 0 HG22 ILE A 9 8.857 -1.913 10.657 1.00 0.00 H new ATOM 0 HG23 ILE A 9 9.315 -1.664 12.359 1.00 0.00 H new ATOM 0 HD11 ILE A 9 13.099 0.447 11.976 1.00 0.00 H new ATOM 0 HD12 ILE A 9 12.540 0.025 10.340 1.00 0.00 H new ATOM 0 HD13 ILE A 9 11.368 0.545 11.574 1.00 0.00 H new ATOM 101 N SER A 10 12.494 -4.644 9.712 1.00 0.00 N ATOM 102 CA SER A 10 13.744 -5.268 9.242 1.00 0.00 C ATOM 103 C SER A 10 14.623 -4.331 8.404 1.00 0.00 C ATOM 104 O SER A 10 15.847 -4.373 8.537 1.00 0.00 O ATOM 105 CB SER A 10 13.435 -6.557 8.471 1.00 0.00 C ATOM 106 OG SER A 10 12.596 -6.308 7.353 1.00 0.00 O ATOM 0 H SER A 10 11.843 -4.431 8.956 1.00 0.00 H new ATOM 0 HA SER A 10 14.325 -5.504 10.133 1.00 0.00 H new ATOM 0 HB2 SER A 10 14.366 -7.012 8.134 1.00 0.00 H new ATOM 0 HB3 SER A 10 12.953 -7.273 9.136 1.00 0.00 H new ATOM 0 HG SER A 10 12.420 -7.149 6.883 1.00 0.00 H new ATOM 112 N GLU A 11 14.028 -3.469 7.567 1.00 0.00 N ATOM 113 CA GLU A 11 14.770 -2.620 6.607 1.00 0.00 C ATOM 114 C GLU A 11 14.201 -1.200 6.396 1.00 0.00 C ATOM 115 O GLU A 11 14.934 -0.315 5.942 1.00 0.00 O ATOM 116 CB GLU A 11 14.837 -3.324 5.234 1.00 0.00 C ATOM 117 CG GLU A 11 15.682 -4.606 5.235 1.00 0.00 C ATOM 118 CD GLU A 11 15.881 -5.137 3.801 1.00 0.00 C ATOM 119 OE1 GLU A 11 16.899 -4.781 3.154 1.00 0.00 O ATOM 120 OE2 GLU A 11 15.033 -5.920 3.309 1.00 0.00 O ATOM 0 H GLU A 11 13.017 -3.336 7.532 1.00 0.00 H new ATOM 0 HA GLU A 11 15.754 -2.489 7.057 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.825 -3.568 4.911 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.247 -2.630 4.500 1.00 0.00 H new ATOM 0 HG2 GLU A 11 16.652 -4.406 5.691 1.00 0.00 H new ATOM 0 HG3 GLU A 11 15.194 -5.367 5.844 1.00 0.00 H new ATOM 127 N ARG A 12 12.916 -0.962 6.693 1.00 0.00 N ATOM 128 CA ARG A 12 12.193 0.293 6.391 1.00 0.00 C ATOM 129 C ARG A 12 11.095 0.556 7.432 1.00 0.00 C ATOM 130 O ARG A 12 10.787 -0.332 8.223 1.00 0.00 O ATOM 131 CB ARG A 12 11.630 0.170 4.954 1.00 0.00 C ATOM 132 CG ARG A 12 11.173 1.474 4.275 1.00 0.00 C ATOM 133 CD ARG A 12 12.308 2.494 4.111 1.00 0.00 C ATOM 134 NE ARG A 12 11.813 3.722 3.472 1.00 0.00 N ATOM 135 CZ ARG A 12 12.509 4.657 2.857 1.00 0.00 C ATOM 136 NH1 ARG A 12 13.810 4.639 2.780 1.00 0.00 N ATOM 137 NH2 ARG A 12 11.869 5.640 2.301 1.00 0.00 N ATOM 0 H ARG A 12 12.330 -1.652 7.163 1.00 0.00 H new ATOM 0 HA ARG A 12 12.863 1.152 6.443 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.394 -0.290 4.328 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.783 -0.516 4.978 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.757 1.240 3.295 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.372 1.922 4.863 1.00 0.00 H new ATOM 0 HD2 ARG A 12 12.734 2.731 5.086 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.108 2.062 3.510 1.00 0.00 H new ATOM 0 HE ARG A 12 10.804 3.869 3.509 1.00 0.00 H new ATOM 0 HH11 ARG A 12 14.336 3.877 3.208 1.00 0.00 H new ATOM 0 HH12 ARG A 12 14.302 5.387 2.292 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.851 5.676 2.346 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.384 6.376 1.819 1.00 0.00 H new ATOM 151 N ASN A 13 10.469 1.736 7.426 1.00 0.00 N ATOM 152 CA ASN A 13 9.305 2.057 8.264 1.00 0.00 C ATOM 153 C ASN A 13 8.035 1.291 7.832 1.00 0.00 C ATOM 154 O ASN A 13 7.065 1.852 7.322 1.00 0.00 O ATOM 155 CB ASN A 13 9.111 3.585 8.330 1.00 0.00 C ATOM 156 CG ASN A 13 9.969 4.210 9.413 1.00 0.00 C ATOM 157 OD1 ASN A 13 10.974 4.860 9.159 1.00 0.00 O ATOM 158 ND2 ASN A 13 9.600 4.013 10.659 1.00 0.00 N ATOM 0 H ASN A 13 10.760 2.510 6.829 1.00 0.00 H new ATOM 0 HA ASN A 13 9.501 1.709 9.278 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.363 4.026 7.366 1.00 0.00 H new ATOM 0 HB3 ASN A 13 8.062 3.811 8.520 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.153 4.403 11.422 1.00 0.00 H new ATOM 0 HD22 ASN A 13 8.761 3.470 10.863 1.00 0.00 H new ATOM 165 N GLN A 14 8.033 -0.022 8.068 1.00 0.00 N ATOM 166 CA GLN A 14 6.925 -0.950 7.806 1.00 0.00 C ATOM 167 C GLN A 14 5.708 -0.716 8.728 1.00 0.00 C ATOM 168 O GLN A 14 4.649 -1.314 8.541 1.00 0.00 O ATOM 169 CB GLN A 14 7.468 -2.380 7.932 1.00 0.00 C ATOM 170 CG GLN A 14 8.511 -2.742 6.860 1.00 0.00 C ATOM 171 CD GLN A 14 9.318 -3.968 7.273 1.00 0.00 C ATOM 172 OE1 GLN A 14 10.448 -3.867 7.738 1.00 0.00 O ATOM 173 NE2 GLN A 14 8.766 -5.156 7.157 1.00 0.00 N ATOM 0 H GLN A 14 8.844 -0.494 8.467 1.00 0.00 H new ATOM 0 HA GLN A 14 6.549 -0.776 6.798 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.916 -2.504 8.918 1.00 0.00 H new ATOM 0 HB3 GLN A 14 6.636 -3.082 7.869 1.00 0.00 H new ATOM 0 HG2 GLN A 14 8.010 -2.935 5.911 1.00 0.00 H new ATOM 0 HG3 GLN A 14 9.182 -1.898 6.701 1.00 0.00 H new ATOM 0 HE21 GLN A 14 7.826 -5.246 6.771 1.00 0.00 H new ATOM 0 HE22 GLN A 14 9.278 -5.987 7.453 1.00 0.00 H new ATOM 182 N ASP A 15 5.849 0.176 9.711 1.00 0.00 N ATOM 183 CA ASP A 15 4.791 0.724 10.562 1.00 0.00 C ATOM 184 C ASP A 15 3.986 1.847 9.870 1.00 0.00 C ATOM 185 O ASP A 15 2.816 2.047 10.196 1.00 0.00 O ATOM 186 CB ASP A 15 5.439 1.227 11.865 1.00 0.00 C ATOM 187 CG ASP A 15 6.445 2.376 11.655 1.00 0.00 C ATOM 188 OD1 ASP A 15 6.284 3.449 12.278 1.00 0.00 O ATOM 189 OD2 ASP A 15 7.417 2.201 10.880 1.00 0.00 O ATOM 0 H ASP A 15 6.764 0.559 9.949 1.00 0.00 H new ATOM 0 HA ASP A 15 4.069 -0.064 10.774 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.655 1.562 12.544 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.948 0.395 12.352 1.00 0.00 H new ATOM 194 N ALA A 16 4.582 2.537 8.889 1.00 0.00 N ATOM 195 CA ALA A 16 3.952 3.572 8.060 1.00 0.00 C ATOM 196 C ALA A 16 3.886 3.199 6.559 1.00 0.00 C ATOM 197 O ALA A 16 3.337 3.948 5.751 1.00 0.00 O ATOM 198 CB ALA A 16 4.684 4.899 8.300 1.00 0.00 C ATOM 0 H ALA A 16 5.559 2.382 8.641 1.00 0.00 H new ATOM 0 HA ALA A 16 2.909 3.670 8.360 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.229 5.681 7.692 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.610 5.170 9.353 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.733 4.790 8.026 1.00 0.00 H new ATOM 204 N THR A 17 4.414 2.033 6.175 1.00 0.00 N ATOM 205 CA THR A 17 4.287 1.457 4.827 1.00 0.00 C ATOM 206 C THR A 17 3.167 0.419 4.812 1.00 0.00 C ATOM 207 O THR A 17 3.090 -0.433 5.698 1.00 0.00 O ATOM 208 CB THR A 17 5.618 0.863 4.327 1.00 0.00 C ATOM 209 OG1 THR A 17 6.660 1.800 4.472 1.00 0.00 O ATOM 210 CG2 THR A 17 5.607 0.478 2.845 1.00 0.00 C ATOM 0 H THR A 17 4.957 1.446 6.808 1.00 0.00 H new ATOM 0 HA THR A 17 4.029 2.259 4.135 1.00 0.00 H new ATOM 0 HB THR A 17 5.765 -0.032 4.932 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.871 1.911 5.423 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.578 0.068 2.568 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.834 -0.270 2.669 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.401 1.362 2.241 1.00 0.00 H new ATOM 218 N VAL A 18 2.304 0.473 3.799 1.00 0.00 N ATOM 219 CA VAL A 18 1.258 -0.529 3.538 1.00 0.00 C ATOM 220 C VAL A 18 1.699 -1.477 2.425 1.00 0.00 C ATOM 221 O VAL A 18 2.420 -1.076 1.513 1.00 0.00 O ATOM 222 CB VAL A 18 -0.120 0.105 3.240 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.509 1.114 4.325 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.205 0.830 1.895 1.00 0.00 C ATOM 0 H VAL A 18 2.308 1.231 3.117 1.00 0.00 H new ATOM 0 HA VAL A 18 1.125 -1.107 4.453 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.804 -0.744 3.214 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.482 1.544 4.090 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.559 0.610 5.290 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.237 1.907 4.369 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.205 1.244 1.768 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.528 1.637 1.869 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.002 0.126 1.089 1.00 0.00 H new ATOM 234 N TYR A 19 1.249 -2.725 2.495 1.00 0.00 N ATOM 235 CA TYR A 19 1.351 -3.748 1.453 1.00 0.00 C ATOM 236 C TYR A 19 0.056 -3.764 0.632 1.00 0.00 C ATOM 237 O TYR A 19 -1.033 -3.621 1.192 1.00 0.00 O ATOM 238 CB TYR A 19 1.601 -5.108 2.124 1.00 0.00 C ATOM 239 CG TYR A 19 1.349 -6.318 1.239 1.00 0.00 C ATOM 240 CD1 TYR A 19 0.074 -6.921 1.224 1.00 0.00 C ATOM 241 CD2 TYR A 19 2.376 -6.836 0.426 1.00 0.00 C ATOM 242 CE1 TYR A 19 -0.172 -8.039 0.404 1.00 0.00 C ATOM 243 CE2 TYR A 19 2.139 -7.967 -0.380 1.00 0.00 C ATOM 244 CZ TYR A 19 0.862 -8.568 -0.398 1.00 0.00 C ATOM 245 OH TYR A 19 0.623 -9.659 -1.177 1.00 0.00 O ATOM 0 H TYR A 19 0.775 -3.073 3.328 1.00 0.00 H new ATOM 0 HA TYR A 19 2.179 -3.532 0.778 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.634 -5.140 2.472 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.965 -5.183 3.006 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -0.716 -6.524 1.844 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.348 -6.365 0.420 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -1.152 -8.492 0.389 1.00 0.00 H new ATOM 0 HE2 TYR A 19 2.935 -8.375 -0.985 1.00 0.00 H new ATOM 0 HH TYR A 19 1.438 -9.896 -1.667 1.00 0.00 H new ATOM 255 N VAL A 20 0.171 -3.973 -0.681 1.00 0.00 N ATOM 256 CA VAL A 20 -0.942 -4.084 -1.634 1.00 0.00 C ATOM 257 C VAL A 20 -0.733 -5.324 -2.504 1.00 0.00 C ATOM 258 O VAL A 20 0.154 -5.341 -3.356 1.00 0.00 O ATOM 259 CB VAL A 20 -1.055 -2.824 -2.522 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.330 -2.902 -3.374 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.090 -1.519 -1.714 1.00 0.00 C ATOM 0 H VAL A 20 1.081 -4.074 -1.131 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.872 -4.174 -1.073 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.162 -2.806 -3.147 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.405 -2.012 -3.998 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.290 -3.788 -4.008 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.201 -2.962 -2.721 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.170 -0.672 -2.395 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.950 -1.529 -1.044 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.175 -1.429 -1.128 1.00 0.00 H new ATOM 271 N GLY A 21 -1.541 -6.365 -2.308 1.00 0.00 N ATOM 272 CA GLY A 21 -1.488 -7.612 -3.077 1.00 0.00 C ATOM 273 C GLY A 21 -2.643 -7.747 -4.070 1.00 0.00 C ATOM 274 O GLY A 21 -3.766 -7.341 -3.774 1.00 0.00 O ATOM 0 H GLY A 21 -2.269 -6.367 -1.593 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.543 -7.660 -3.618 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.505 -8.458 -2.390 1.00 0.00 H new ATOM 278 N GLY A 22 -2.380 -8.347 -5.234 1.00 0.00 N ATOM 279 CA GLY A 22 -3.389 -8.652 -6.261 1.00 0.00 C ATOM 280 C GLY A 22 -3.464 -7.614 -7.387 1.00 0.00 C ATOM 281 O GLY A 22 -4.541 -7.348 -7.918 1.00 0.00 O ATOM 0 H GLY A 22 -1.440 -8.642 -5.498 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.169 -9.628 -6.694 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.366 -8.728 -5.785 1.00 0.00 H new ATOM 285 N LEU A 23 -2.327 -7.003 -7.734 1.00 0.00 N ATOM 286 CA LEU A 23 -2.210 -5.923 -8.710 1.00 0.00 C ATOM 287 C LEU A 23 -2.376 -6.444 -10.141 1.00 0.00 C ATOM 288 O LEU A 23 -2.056 -7.597 -10.443 1.00 0.00 O ATOM 289 CB LEU A 23 -0.843 -5.233 -8.547 1.00 0.00 C ATOM 290 CG LEU A 23 -0.590 -4.577 -7.179 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.784 -3.916 -7.189 1.00 0.00 C ATOM 292 CD2 LEU A 23 -1.641 -3.523 -6.841 1.00 0.00 C ATOM 0 H LEU A 23 -1.429 -7.260 -7.324 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.007 -5.203 -8.528 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.060 -5.970 -8.727 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.747 -4.470 -9.319 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.644 -5.360 -6.422 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.970 -3.449 -6.222 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.548 -4.669 -7.381 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.817 -3.157 -7.971 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.420 -3.088 -5.866 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.628 -2.740 -7.599 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.627 -3.987 -6.816 1.00 0.00 H new ATOM 304 N ASP A 24 -2.846 -5.580 -11.035 1.00 0.00 N ATOM 305 CA ASP A 24 -2.965 -5.870 -12.464 1.00 0.00 C ATOM 306 C ASP A 24 -1.709 -5.435 -13.249 1.00 0.00 C ATOM 307 O ASP A 24 -0.964 -4.557 -12.812 1.00 0.00 O ATOM 308 CB ASP A 24 -4.249 -5.212 -12.993 1.00 0.00 C ATOM 309 CG ASP A 24 -4.478 -5.527 -14.477 1.00 0.00 C ATOM 310 OD1 ASP A 24 -4.969 -6.638 -14.784 1.00 0.00 O ATOM 311 OD2 ASP A 24 -4.106 -4.685 -15.324 1.00 0.00 O ATOM 0 H ASP A 24 -3.161 -4.643 -10.785 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.036 -6.948 -12.611 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.103 -5.560 -12.411 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.188 -4.132 -12.855 1.00 0.00 H new ATOM 316 N GLU A 25 -1.465 -6.011 -14.429 1.00 0.00 N ATOM 317 CA GLU A 25 -0.313 -5.668 -15.286 1.00 0.00 C ATOM 318 C GLU A 25 -0.251 -4.184 -15.712 1.00 0.00 C ATOM 319 O GLU A 25 0.831 -3.687 -16.038 1.00 0.00 O ATOM 320 CB GLU A 25 -0.275 -6.602 -16.509 1.00 0.00 C ATOM 321 CG GLU A 25 -1.440 -6.410 -17.492 1.00 0.00 C ATOM 322 CD GLU A 25 -1.332 -7.398 -18.670 1.00 0.00 C ATOM 323 OE1 GLU A 25 -1.842 -8.541 -18.563 1.00 0.00 O ATOM 324 OE2 GLU A 25 -0.738 -7.040 -19.717 1.00 0.00 O ATOM 0 H GLU A 25 -2.063 -6.736 -14.825 1.00 0.00 H new ATOM 0 HA GLU A 25 0.578 -5.819 -14.676 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.663 -6.445 -17.041 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.275 -7.635 -16.162 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.387 -6.558 -16.973 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.439 -5.387 -17.868 1.00 0.00 H new ATOM 331 N LYS A 26 -1.378 -3.454 -15.668 1.00 0.00 N ATOM 332 CA LYS A 26 -1.448 -2.002 -15.926 1.00 0.00 C ATOM 333 C LYS A 26 -0.936 -1.129 -14.766 1.00 0.00 C ATOM 334 O LYS A 26 -0.686 0.060 -14.967 1.00 0.00 O ATOM 335 CB LYS A 26 -2.887 -1.631 -16.296 1.00 0.00 C ATOM 336 CG LYS A 26 -3.240 -2.168 -17.692 1.00 0.00 C ATOM 337 CD LYS A 26 -4.720 -1.985 -18.028 1.00 0.00 C ATOM 338 CE LYS A 26 -5.150 -0.513 -18.007 1.00 0.00 C ATOM 339 NZ LYS A 26 -6.550 -0.347 -18.480 1.00 0.00 N ATOM 0 H LYS A 26 -2.286 -3.863 -15.448 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.772 -1.792 -16.755 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.576 -2.041 -15.557 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.006 -0.548 -16.276 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.634 -1.656 -18.440 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.986 -3.227 -17.746 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.920 -2.404 -19.014 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.323 -2.546 -17.315 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.058 -0.121 -16.994 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.480 0.072 -18.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.808 0.660 -18.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.631 -0.699 -19.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -7.191 -0.886 -17.863 1.00 0.00 H new ATOM 353 N VAL A 27 -0.783 -1.685 -13.560 1.00 0.00 N ATOM 354 CA VAL A 27 -0.352 -0.954 -12.351 1.00 0.00 C ATOM 355 C VAL A 27 1.146 -0.619 -12.392 1.00 0.00 C ATOM 356 O VAL A 27 1.966 -1.436 -12.818 1.00 0.00 O ATOM 357 CB VAL A 27 -0.714 -1.735 -11.069 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.276 -1.006 -9.794 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.231 -1.961 -10.970 1.00 0.00 C ATOM 0 H VAL A 27 -0.957 -2.675 -13.387 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.895 -0.009 -12.333 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.183 -2.684 -11.144 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.555 -1.598 -8.922 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.805 -0.867 -9.808 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.766 -0.034 -9.744 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.458 -2.513 -10.058 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.742 -0.998 -10.948 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.571 -2.532 -11.834 1.00 0.00 H new ATOM 369 N SER A 28 1.506 0.573 -11.906 1.00 0.00 N ATOM 370 CA SER A 28 2.889 1.044 -11.734 1.00 0.00 C ATOM 371 C SER A 28 3.088 1.753 -10.386 1.00 0.00 C ATOM 372 O SER A 28 2.123 2.176 -9.747 1.00 0.00 O ATOM 373 CB SER A 28 3.259 1.980 -12.893 1.00 0.00 C ATOM 374 OG SER A 28 2.497 3.178 -12.836 1.00 0.00 O ATOM 0 H SER A 28 0.818 1.265 -11.609 1.00 0.00 H new ATOM 0 HA SER A 28 3.548 0.175 -11.741 1.00 0.00 H new ATOM 0 HB2 SER A 28 4.322 2.217 -12.850 1.00 0.00 H new ATOM 0 HB3 SER A 28 3.083 1.476 -13.844 1.00 0.00 H new ATOM 0 HG SER A 28 2.749 3.762 -13.582 1.00 0.00 H new ATOM 380 N GLU A 29 4.336 1.926 -9.941 1.00 0.00 N ATOM 381 CA GLU A 29 4.633 2.644 -8.689 1.00 0.00 C ATOM 382 C GLU A 29 4.110 4.100 -8.685 1.00 0.00 C ATOM 383 O GLU A 29 3.447 4.476 -7.713 1.00 0.00 O ATOM 384 CB GLU A 29 6.147 2.587 -8.401 1.00 0.00 C ATOM 385 CG GLU A 29 6.561 1.295 -7.686 1.00 0.00 C ATOM 386 CD GLU A 29 7.863 0.694 -8.250 1.00 0.00 C ATOM 387 OE1 GLU A 29 7.924 0.393 -9.467 1.00 0.00 O ATOM 388 OE2 GLU A 29 8.815 0.450 -7.471 1.00 0.00 O ATOM 0 H GLU A 29 5.162 1.579 -10.428 1.00 0.00 H new ATOM 0 HA GLU A 29 4.096 2.138 -7.887 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.695 2.671 -9.339 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.430 3.444 -7.789 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.690 1.498 -6.623 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.759 0.562 -7.775 1.00 0.00 H new ATOM 395 N PRO A 30 4.281 4.907 -9.760 1.00 0.00 N ATOM 396 CA PRO A 30 3.655 6.227 -9.857 1.00 0.00 C ATOM 397 C PRO A 30 2.123 6.201 -9.782 1.00 0.00 C ATOM 398 O PRO A 30 1.534 7.148 -9.251 1.00 0.00 O ATOM 399 CB PRO A 30 4.121 6.814 -11.194 1.00 0.00 C ATOM 400 CG PRO A 30 5.460 6.124 -11.429 1.00 0.00 C ATOM 401 CD PRO A 30 5.200 4.725 -10.877 1.00 0.00 C ATOM 0 HA PRO A 30 3.957 6.832 -9.002 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.413 6.603 -11.995 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.230 7.897 -11.142 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.727 6.102 -12.485 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.274 6.624 -10.904 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.767 4.078 -11.639 1.00 0.00 H new ATOM 0 HD3 PRO A 30 6.127 4.255 -10.549 1.00 0.00 H new ATOM 409 N LEU A 31 1.464 5.127 -10.251 1.00 0.00 N ATOM 410 CA LEU A 31 0.016 4.978 -10.093 1.00 0.00 C ATOM 411 C LEU A 31 -0.324 4.807 -8.616 1.00 0.00 C ATOM 412 O LEU A 31 -1.128 5.574 -8.098 1.00 0.00 O ATOM 413 CB LEU A 31 -0.523 3.791 -10.906 1.00 0.00 C ATOM 414 CG LEU A 31 -2.054 3.630 -10.797 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.775 4.675 -11.640 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.431 2.243 -11.298 1.00 0.00 C ATOM 0 H LEU A 31 1.914 4.354 -10.741 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.462 5.880 -10.475 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.251 3.922 -11.953 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.042 2.875 -10.564 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.350 3.762 -9.756 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.852 4.539 -11.545 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.503 5.672 -11.294 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.486 4.562 -12.685 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.511 2.112 -11.228 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.119 2.134 -12.337 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.934 1.488 -10.689 1.00 0.00 H new ATOM 428 N LEU A 32 0.302 3.837 -7.938 1.00 0.00 N ATOM 429 CA LEU A 32 0.041 3.572 -6.520 1.00 0.00 C ATOM 430 C LEU A 32 0.232 4.828 -5.672 1.00 0.00 C ATOM 431 O LEU A 32 -0.608 5.122 -4.830 1.00 0.00 O ATOM 432 CB LEU A 32 0.948 2.456 -5.976 1.00 0.00 C ATOM 433 CG LEU A 32 0.785 1.084 -6.638 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.525 0.026 -5.823 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.676 0.652 -6.711 1.00 0.00 C ATOM 0 H LEU A 32 0.998 3.219 -8.354 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.998 3.249 -6.452 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.986 2.771 -6.086 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.759 2.348 -4.908 1.00 0.00 H new ATOM 0 HG LEU A 32 1.188 1.173 -7.647 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.406 -0.948 -6.298 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.584 0.279 -5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.114 -0.010 -4.814 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.743 -0.326 -7.188 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.089 0.594 -5.704 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.242 1.379 -7.294 1.00 0.00 H new ATOM 447 N TRP A 33 1.284 5.602 -5.938 1.00 0.00 N ATOM 448 CA TRP A 33 1.560 6.851 -5.231 1.00 0.00 C ATOM 449 C TRP A 33 0.385 7.825 -5.350 1.00 0.00 C ATOM 450 O TRP A 33 -0.253 8.155 -4.350 1.00 0.00 O ATOM 451 CB TRP A 33 2.859 7.451 -5.784 1.00 0.00 C ATOM 452 CG TRP A 33 3.522 8.529 -4.982 1.00 0.00 C ATOM 453 CD1 TRP A 33 2.935 9.553 -4.319 1.00 0.00 C ATOM 454 CD2 TRP A 33 4.953 8.697 -4.777 1.00 0.00 C ATOM 455 NE1 TRP A 33 3.905 10.320 -3.697 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.172 9.842 -3.958 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.086 7.987 -5.221 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.459 10.262 -3.592 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.384 8.398 -4.862 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.572 9.533 -4.051 1.00 0.00 C ATOM 0 H TRP A 33 1.973 5.378 -6.656 1.00 0.00 H new ATOM 0 HA TRP A 33 1.687 6.652 -4.167 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.575 6.640 -5.913 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.649 7.851 -6.776 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.872 9.742 -4.281 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.707 11.136 -3.118 1.00 0.00 H new ATOM 0 HE3 TRP A 33 5.957 7.115 -5.845 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.594 11.132 -2.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.240 7.839 -5.211 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.570 9.844 -3.781 1.00 0.00 H new ATOM 471 N GLU A 34 0.060 8.247 -6.572 1.00 0.00 N ATOM 472 CA GLU A 34 -1.006 9.226 -6.832 1.00 0.00 C ATOM 473 C GLU A 34 -2.413 8.726 -6.462 1.00 0.00 C ATOM 474 O GLU A 34 -3.267 9.522 -6.065 1.00 0.00 O ATOM 475 CB GLU A 34 -0.973 9.645 -8.309 1.00 0.00 C ATOM 476 CG GLU A 34 0.289 10.450 -8.633 1.00 0.00 C ATOM 477 CD GLU A 34 0.185 11.122 -10.016 1.00 0.00 C ATOM 478 OE1 GLU A 34 -0.298 12.279 -10.096 1.00 0.00 O ATOM 479 OE2 GLU A 34 0.587 10.510 -11.036 1.00 0.00 O ATOM 0 H GLU A 34 0.529 7.920 -7.417 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.806 10.080 -6.185 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.013 8.758 -8.941 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.856 10.241 -8.540 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.444 11.210 -7.868 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.158 9.793 -8.610 1.00 0.00 H new ATOM 486 N LEU A 35 -2.652 7.416 -6.540 1.00 0.00 N ATOM 487 CA LEU A 35 -3.918 6.784 -6.153 1.00 0.00 C ATOM 488 C LEU A 35 -4.109 6.765 -4.623 1.00 0.00 C ATOM 489 O LEU A 35 -5.226 6.942 -4.144 1.00 0.00 O ATOM 490 CB LEU A 35 -3.962 5.356 -6.734 1.00 0.00 C ATOM 491 CG LEU A 35 -5.371 4.760 -6.836 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.120 5.268 -8.068 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.305 3.235 -6.876 1.00 0.00 C ATOM 0 H LEU A 35 -1.958 6.750 -6.880 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.741 7.372 -6.560 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.512 5.366 -7.727 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.348 4.704 -6.112 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.918 5.082 -5.950 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.113 4.820 -8.100 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.213 6.353 -8.016 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.569 4.994 -8.968 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.314 2.829 -6.948 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.723 2.919 -7.742 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.830 2.867 -5.966 1.00 0.00 H new ATOM 505 N PHE A 36 -3.034 6.576 -3.850 1.00 0.00 N ATOM 506 CA PHE A 36 -3.063 6.460 -2.386 1.00 0.00 C ATOM 507 C PHE A 36 -2.946 7.814 -1.665 1.00 0.00 C ATOM 508 O PHE A 36 -3.248 7.892 -0.473 1.00 0.00 O ATOM 509 CB PHE A 36 -2.004 5.447 -1.928 1.00 0.00 C ATOM 510 CG PHE A 36 -2.439 3.983 -1.979 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.547 3.236 -0.789 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.720 3.353 -3.207 1.00 0.00 C ATOM 513 CE1 PHE A 36 -2.956 1.890 -0.825 1.00 0.00 C ATOM 514 CE2 PHE A 36 -3.107 2.000 -3.248 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.242 1.273 -2.054 1.00 0.00 C ATOM 0 H PHE A 36 -2.093 6.497 -4.235 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.046 6.086 -2.099 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.116 5.568 -2.549 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.713 5.687 -0.906 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.314 3.700 0.158 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.638 3.914 -4.126 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.050 1.330 0.094 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.300 1.522 -4.197 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.565 0.243 -2.081 1.00 0.00 H new ATOM 525 N LEU A 37 -2.622 8.902 -2.381 1.00 0.00 N ATOM 526 CA LEU A 37 -2.703 10.285 -1.875 1.00 0.00 C ATOM 527 C LEU A 37 -4.088 10.658 -1.298 1.00 0.00 C ATOM 528 O LEU A 37 -4.201 11.573 -0.481 1.00 0.00 O ATOM 529 CB LEU A 37 -2.348 11.266 -3.010 1.00 0.00 C ATOM 530 CG LEU A 37 -0.855 11.423 -3.336 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.676 12.462 -4.443 1.00 0.00 C ATOM 532 CD2 LEU A 37 -0.038 11.876 -2.128 1.00 0.00 C ATOM 0 H LEU A 37 -2.291 8.847 -3.344 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.991 10.355 -1.052 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.863 10.942 -3.915 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.746 12.247 -2.750 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.496 10.442 -3.649 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.384 12.571 -4.672 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.209 12.137 -5.337 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.076 13.420 -4.111 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.010 11.971 -2.413 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.408 12.840 -1.779 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.131 11.140 -1.329 1.00 0.00 H new ATOM 544 N GLN A 38 -5.135 9.932 -1.697 1.00 0.00 N ATOM 545 CA GLN A 38 -6.503 10.056 -1.169 1.00 0.00 C ATOM 546 C GLN A 38 -6.596 9.696 0.321 1.00 0.00 C ATOM 547 O GLN A 38 -7.412 10.268 1.047 1.00 0.00 O ATOM 548 CB GLN A 38 -7.456 9.139 -1.956 1.00 0.00 C ATOM 549 CG GLN A 38 -7.395 9.394 -3.463 1.00 0.00 C ATOM 550 CD GLN A 38 -8.398 8.538 -4.232 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.547 8.907 -4.445 1.00 0.00 O ATOM 552 NE2 GLN A 38 -8.007 7.361 -4.666 1.00 0.00 N ATOM 0 H GLN A 38 -5.055 9.217 -2.420 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.789 11.102 -1.283 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.203 8.098 -1.755 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.476 9.292 -1.605 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.592 10.448 -3.660 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.388 9.185 -3.825 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -7.053 7.045 -4.494 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.658 6.763 -5.175 1.00 0.00 H new ATOM 561 N ALA A 39 -5.759 8.759 0.783 1.00 0.00 N ATOM 562 CA ALA A 39 -5.695 8.366 2.188 1.00 0.00 C ATOM 563 C ALA A 39 -4.905 9.371 3.048 1.00 0.00 C ATOM 564 O ALA A 39 -5.337 9.736 4.142 1.00 0.00 O ATOM 565 CB ALA A 39 -5.069 6.976 2.279 1.00 0.00 C ATOM 0 H ALA A 39 -5.105 8.252 0.186 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.710 8.353 2.586 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.015 6.669 3.323 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.680 6.265 1.723 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.065 7.001 1.855 1.00 0.00 H new ATOM 571 N GLY A 40 -3.753 9.822 2.545 1.00 0.00 N ATOM 572 CA GLY A 40 -2.866 10.769 3.220 1.00 0.00 C ATOM 573 C GLY A 40 -1.584 11.057 2.424 1.00 0.00 C ATOM 574 O GLY A 40 -1.457 10.612 1.283 1.00 0.00 O ATOM 0 H GLY A 40 -3.403 9.530 1.632 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.401 11.704 3.389 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.598 10.374 4.200 1.00 0.00 H new ATOM 578 N PRO A 41 -0.617 11.790 3.003 1.00 0.00 N ATOM 579 CA PRO A 41 0.635 12.149 2.341 1.00 0.00 C ATOM 580 C PRO A 41 1.518 10.916 2.091 1.00 0.00 C ATOM 581 O PRO A 41 2.094 10.338 3.019 1.00 0.00 O ATOM 582 CB PRO A 41 1.299 13.182 3.261 1.00 0.00 C ATOM 583 CG PRO A 41 0.739 12.840 4.641 1.00 0.00 C ATOM 584 CD PRO A 41 -0.680 12.371 4.334 1.00 0.00 C ATOM 0 HA PRO A 41 0.467 12.567 1.348 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.386 13.101 3.237 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.049 14.201 2.967 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.323 12.061 5.131 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.743 13.706 5.303 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -1.018 11.638 5.067 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -1.384 13.203 4.366 1.00 0.00 H new ATOM 592 N VAL A 42 1.637 10.531 0.817 1.00 0.00 N ATOM 593 CA VAL A 42 2.534 9.467 0.342 1.00 0.00 C ATOM 594 C VAL A 42 3.934 10.037 0.102 1.00 0.00 C ATOM 595 O VAL A 42 4.096 11.089 -0.523 1.00 0.00 O ATOM 596 CB VAL A 42 1.996 8.779 -0.928 1.00 0.00 C ATOM 597 CG1 VAL A 42 2.956 7.684 -1.413 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.627 8.129 -0.692 1.00 0.00 C ATOM 0 H VAL A 42 1.098 10.961 0.065 1.00 0.00 H new ATOM 0 HA VAL A 42 2.586 8.702 1.117 1.00 0.00 H new ATOM 0 HB VAL A 42 1.903 9.563 -1.679 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.551 7.216 -2.310 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.926 8.125 -1.641 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.074 6.932 -0.633 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.285 7.656 -1.613 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.712 7.377 0.093 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -0.090 8.891 -0.388 1.00 0.00 H new ATOM 608 N VAL A 43 4.940 9.323 0.600 1.00 0.00 N ATOM 609 CA VAL A 43 6.356 9.723 0.638 1.00 0.00 C ATOM 610 C VAL A 43 7.199 8.929 -0.370 1.00 0.00 C ATOM 611 O VAL A 43 8.168 9.458 -0.917 1.00 0.00 O ATOM 612 CB VAL A 43 6.918 9.516 2.064 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.247 10.244 2.280 1.00 0.00 C ATOM 614 CG2 VAL A 43 5.969 10.017 3.158 1.00 0.00 C ATOM 0 H VAL A 43 4.789 8.402 1.011 1.00 0.00 H new ATOM 0 HA VAL A 43 6.413 10.777 0.364 1.00 0.00 H new ATOM 0 HB VAL A 43 7.050 8.437 2.141 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.598 10.066 3.296 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.986 9.871 1.570 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.105 11.314 2.127 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.418 9.845 4.136 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.790 11.084 3.024 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.023 9.479 3.093 1.00 0.00 H new ATOM 624 N ASN A 44 6.853 7.655 -0.585 1.00 0.00 N ATOM 625 CA ASN A 44 7.589 6.687 -1.406 1.00 0.00 C ATOM 626 C ASN A 44 6.689 5.486 -1.808 1.00 0.00 C ATOM 627 O ASN A 44 5.642 5.252 -1.201 1.00 0.00 O ATOM 628 CB ASN A 44 8.829 6.283 -0.578 1.00 0.00 C ATOM 629 CG ASN A 44 9.619 5.107 -1.117 1.00 0.00 C ATOM 630 OD1 ASN A 44 10.010 5.070 -2.274 1.00 0.00 O ATOM 631 ND2 ASN A 44 9.871 4.117 -0.292 1.00 0.00 N ATOM 0 H ASN A 44 6.012 7.252 -0.172 1.00 0.00 H new ATOM 0 HA ASN A 44 7.905 7.113 -2.358 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.494 7.144 -0.509 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.506 6.047 0.436 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.398 3.306 -0.615 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.539 4.159 0.672 1.00 0.00 H new ATOM 638 N THR A 45 7.108 4.700 -2.804 1.00 0.00 N ATOM 639 CA THR A 45 6.447 3.467 -3.287 1.00 0.00 C ATOM 640 C THR A 45 7.465 2.383 -3.663 1.00 0.00 C ATOM 641 O THR A 45 8.596 2.694 -4.041 1.00 0.00 O ATOM 642 CB THR A 45 5.569 3.719 -4.529 1.00 0.00 C ATOM 643 OG1 THR A 45 6.194 4.600 -5.439 1.00 0.00 O ATOM 644 CG2 THR A 45 4.206 4.300 -4.176 1.00 0.00 C ATOM 0 H THR A 45 7.959 4.910 -3.326 1.00 0.00 H new ATOM 0 HA THR A 45 5.826 3.134 -2.455 1.00 0.00 H new ATOM 0 HB THR A 45 5.433 2.739 -4.987 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.611 4.737 -6.215 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.630 4.457 -5.088 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.673 3.607 -3.525 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.338 5.252 -3.662 1.00 0.00 H new ATOM 652 N HIS A 46 7.060 1.107 -3.606 1.00 0.00 N ATOM 653 CA HIS A 46 7.881 -0.035 -4.034 1.00 0.00 C ATOM 654 C HIS A 46 7.025 -1.106 -4.722 1.00 0.00 C ATOM 655 O HIS A 46 5.968 -1.458 -4.210 1.00 0.00 O ATOM 656 CB HIS A 46 8.596 -0.631 -2.807 1.00 0.00 C ATOM 657 CG HIS A 46 9.619 -1.694 -3.135 1.00 0.00 C ATOM 658 ND1 HIS A 46 10.314 -1.824 -4.342 1.00 0.00 N ATOM 659 CD2 HIS A 46 10.017 -2.688 -2.290 1.00 0.00 C ATOM 660 CE1 HIS A 46 11.119 -2.891 -4.192 1.00 0.00 C ATOM 661 NE2 HIS A 46 10.963 -3.425 -2.969 1.00 0.00 N ATOM 0 H HIS A 46 6.141 0.835 -3.257 1.00 0.00 H new ATOM 0 HA HIS A 46 8.618 0.314 -4.757 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.089 0.174 -2.262 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.849 -1.058 -2.138 1.00 0.00 H new ATOM 0 HD2 HIS A 46 9.661 -2.863 -1.286 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.795 -3.265 -4.947 1.00 0.00 H new ATOM 0 HE2 HIS A 46 11.460 -4.238 -2.605 1.00 0.00 H new ATOM 669 N MET A 47 7.468 -1.664 -5.848 1.00 0.00 N ATOM 670 CA MET A 47 6.864 -2.844 -6.485 1.00 0.00 C ATOM 671 C MET A 47 7.974 -3.803 -6.941 1.00 0.00 C ATOM 672 O MET A 47 8.614 -3.529 -7.961 1.00 0.00 O ATOM 673 CB MET A 47 5.961 -2.440 -7.665 1.00 0.00 C ATOM 674 CG MET A 47 4.617 -1.869 -7.195 1.00 0.00 C ATOM 675 SD MET A 47 3.572 -1.125 -8.473 1.00 0.00 S ATOM 676 CE MET A 47 3.338 -2.554 -9.547 1.00 0.00 C ATOM 0 H MET A 47 8.275 -1.304 -6.358 1.00 0.00 H new ATOM 0 HA MET A 47 6.232 -3.353 -5.757 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.475 -1.699 -8.277 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.783 -3.309 -8.299 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.054 -2.670 -6.716 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.813 -1.116 -6.432 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.588 -2.322 -10.303 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.281 -2.801 -10.035 1.00 0.00 H new ATOM 0 HE3 MET A 47 3.003 -3.405 -8.953 1.00 0.00 H new ATOM 686 N PRO A 48 8.230 -4.911 -6.218 1.00 0.00 N ATOM 687 CA PRO A 48 9.276 -5.874 -6.567 1.00 0.00 C ATOM 688 C PRO A 48 9.144 -6.438 -7.989 1.00 0.00 C ATOM 689 O PRO A 48 8.070 -6.891 -8.402 1.00 0.00 O ATOM 690 CB PRO A 48 9.202 -6.967 -5.497 1.00 0.00 C ATOM 691 CG PRO A 48 8.703 -6.194 -4.280 1.00 0.00 C ATOM 692 CD PRO A 48 7.702 -5.218 -4.894 1.00 0.00 C ATOM 0 HA PRO A 48 10.251 -5.388 -6.580 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.518 -7.767 -5.779 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.174 -7.427 -5.317 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.233 -6.850 -3.548 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.514 -5.675 -3.769 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.709 -5.662 -4.959 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.609 -4.316 -4.288 1.00 0.00 H new ATOM 700 N LYS A 49 10.253 -6.404 -8.739 1.00 0.00 N ATOM 701 CA LYS A 49 10.339 -6.847 -10.140 1.00 0.00 C ATOM 702 C LYS A 49 10.854 -8.284 -10.256 1.00 0.00 C ATOM 703 O LYS A 49 11.672 -8.741 -9.457 1.00 0.00 O ATOM 704 CB LYS A 49 11.199 -5.884 -10.981 1.00 0.00 C ATOM 705 CG LYS A 49 10.798 -4.399 -10.918 1.00 0.00 C ATOM 706 CD LYS A 49 9.328 -4.130 -11.290 1.00 0.00 C ATOM 707 CE LYS A 49 8.999 -2.630 -11.392 1.00 0.00 C ATOM 708 NZ LYS A 49 9.305 -1.897 -10.137 1.00 0.00 N ATOM 0 H LYS A 49 11.142 -6.058 -8.379 1.00 0.00 H new ATOM 0 HA LYS A 49 9.325 -6.832 -10.540 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.236 -5.975 -10.656 1.00 0.00 H new ATOM 0 HB3 LYS A 49 11.161 -6.207 -12.021 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.981 -4.026 -9.910 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.442 -3.831 -11.589 1.00 0.00 H new ATOM 0 HD2 LYS A 49 9.106 -4.611 -12.243 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.680 -4.589 -10.543 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.566 -2.191 -12.213 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.943 -2.508 -11.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.700 -1.054 -10.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.126 -2.516 -9.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.304 -1.607 -10.139 1.00 0.00 H new ATOM 722 N ASP A 50 10.378 -8.986 -11.276 1.00 0.00 N ATOM 723 CA ASP A 50 10.707 -10.379 -11.570 1.00 0.00 C ATOM 724 C ASP A 50 12.099 -10.545 -12.214 1.00 0.00 C ATOM 725 O ASP A 50 12.498 -9.750 -13.066 1.00 0.00 O ATOM 726 CB ASP A 50 9.602 -10.940 -12.470 1.00 0.00 C ATOM 727 CG ASP A 50 9.792 -12.442 -12.663 1.00 0.00 C ATOM 728 OD1 ASP A 50 9.315 -13.210 -11.795 1.00 0.00 O ATOM 729 OD2 ASP A 50 10.500 -12.818 -13.624 1.00 0.00 O ATOM 0 H ASP A 50 9.725 -8.586 -11.950 1.00 0.00 H new ATOM 0 HA ASP A 50 10.759 -10.937 -10.635 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.626 -10.744 -12.026 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.619 -10.437 -13.437 1.00 0.00 H new ATOM 734 N ARG A 51 12.834 -11.605 -11.850 1.00 0.00 N ATOM 735 CA ARG A 51 14.211 -11.861 -12.323 1.00 0.00 C ATOM 736 C ARG A 51 14.329 -12.512 -13.715 1.00 0.00 C ATOM 737 O ARG A 51 15.442 -12.831 -14.136 1.00 0.00 O ATOM 738 CB ARG A 51 15.011 -12.607 -11.234 1.00 0.00 C ATOM 739 CG ARG A 51 14.572 -14.065 -11.014 1.00 0.00 C ATOM 740 CD ARG A 51 15.401 -14.721 -9.903 1.00 0.00 C ATOM 741 NE ARG A 51 15.024 -16.139 -9.716 1.00 0.00 N ATOM 742 CZ ARG A 51 14.109 -16.629 -8.896 1.00 0.00 C ATOM 743 NH1 ARG A 51 13.395 -15.872 -8.112 1.00 0.00 N ATOM 744 NH2 ARG A 51 13.891 -17.912 -8.851 1.00 0.00 N ATOM 0 H ARG A 51 12.489 -12.321 -11.211 1.00 0.00 H new ATOM 0 HA ARG A 51 14.661 -10.882 -12.487 1.00 0.00 H new ATOM 0 HB2 ARG A 51 16.067 -12.594 -11.503 1.00 0.00 H new ATOM 0 HB3 ARG A 51 14.915 -12.065 -10.293 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.515 -14.096 -10.751 1.00 0.00 H new ATOM 0 HG3 ARG A 51 14.687 -14.628 -11.940 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.461 -14.654 -10.149 1.00 0.00 H new ATOM 0 HD3 ARG A 51 15.256 -14.178 -8.969 1.00 0.00 H new ATOM 0 HE ARG A 51 15.528 -16.818 -10.286 1.00 0.00 H new ATOM 0 HH11 ARG A 51 13.532 -14.861 -8.116 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.699 -16.290 -7.494 1.00 0.00 H new ATOM 0 HH21 ARG A 51 14.426 -18.542 -9.449 1.00 0.00 H new ATOM 0 HH22 ARG A 51 13.185 -18.287 -8.218 1.00 0.00 H new ATOM 758 N VAL A 52 13.215 -12.723 -14.426 1.00 0.00 N ATOM 759 CA VAL A 52 13.150 -13.434 -15.721 1.00 0.00 C ATOM 760 C VAL A 52 12.328 -12.647 -16.746 1.00 0.00 C ATOM 761 O VAL A 52 12.722 -12.568 -17.911 1.00 0.00 O ATOM 762 CB VAL A 52 12.559 -14.856 -15.554 1.00 0.00 C ATOM 763 CG1 VAL A 52 12.689 -15.672 -16.848 1.00 0.00 C ATOM 764 CG2 VAL A 52 13.245 -15.658 -14.440 1.00 0.00 C ATOM 0 H VAL A 52 12.302 -12.396 -14.111 1.00 0.00 H new ATOM 0 HA VAL A 52 14.172 -13.524 -16.088 1.00 0.00 H new ATOM 0 HB VAL A 52 11.511 -14.700 -15.296 1.00 0.00 H new ATOM 0 HG11 VAL A 52 12.265 -16.665 -16.696 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.153 -15.167 -17.652 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.742 -15.764 -17.116 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.789 -16.646 -14.369 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.306 -15.763 -14.668 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.128 -15.136 -13.491 1.00 0.00 H new ATOM 774 N THR A 53 11.218 -12.026 -16.327 1.00 0.00 N ATOM 775 CA THR A 53 10.316 -11.251 -17.200 1.00 0.00 C ATOM 776 C THR A 53 10.430 -9.746 -16.970 1.00 0.00 C ATOM 777 O THR A 53 9.989 -8.948 -17.802 1.00 0.00 O ATOM 778 CB THR A 53 8.846 -11.670 -17.028 1.00 0.00 C ATOM 779 OG1 THR A 53 8.373 -11.278 -15.755 1.00 0.00 O ATOM 780 CG2 THR A 53 8.632 -13.177 -17.178 1.00 0.00 C ATOM 0 H THR A 53 10.913 -12.046 -15.354 1.00 0.00 H new ATOM 0 HA THR A 53 10.637 -11.475 -18.217 1.00 0.00 H new ATOM 0 HB THR A 53 8.293 -11.169 -17.822 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.436 -11.548 -15.657 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.575 -13.409 -17.046 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.952 -13.493 -18.171 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.216 -13.704 -16.424 1.00 0.00 H new ATOM 788 N GLY A 54 11.010 -9.345 -15.833 1.00 0.00 N ATOM 789 CA GLY A 54 11.237 -7.954 -15.456 1.00 0.00 C ATOM 790 C GLY A 54 9.977 -7.154 -15.082 1.00 0.00 C ATOM 791 O GLY A 54 10.076 -5.964 -14.779 1.00 0.00 O ATOM 0 H GLY A 54 11.343 -10.005 -15.130 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.924 -7.933 -14.610 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.735 -7.448 -16.283 1.00 0.00 H new ATOM 795 N GLN A 55 8.799 -7.787 -15.091 1.00 0.00 N ATOM 796 CA GLN A 55 7.516 -7.182 -14.706 1.00 0.00 C ATOM 797 C GLN A 55 7.339 -7.196 -13.177 1.00 0.00 C ATOM 798 O GLN A 55 8.089 -7.876 -12.475 1.00 0.00 O ATOM 799 CB GLN A 55 6.357 -7.918 -15.409 1.00 0.00 C ATOM 800 CG GLN A 55 6.538 -8.128 -16.924 1.00 0.00 C ATOM 801 CD GLN A 55 6.907 -6.853 -17.680 1.00 0.00 C ATOM 802 OE1 GLN A 55 6.143 -5.899 -17.761 1.00 0.00 O ATOM 803 NE2 GLN A 55 8.091 -6.775 -18.255 1.00 0.00 N ATOM 0 H GLN A 55 8.708 -8.763 -15.374 1.00 0.00 H new ATOM 0 HA GLN A 55 7.508 -6.140 -15.026 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.226 -8.891 -14.936 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.437 -7.357 -15.243 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.315 -8.875 -17.088 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.614 -8.532 -17.339 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.739 -7.561 -18.197 1.00 0.00 H new ATOM 0 HE22 GLN A 55 8.359 -5.929 -18.758 1.00 0.00 H new ATOM 812 N HIS A 56 6.349 -6.482 -12.629 1.00 0.00 N ATOM 813 CA HIS A 56 6.019 -6.615 -11.200 1.00 0.00 C ATOM 814 C HIS A 56 5.427 -8.002 -10.885 1.00 0.00 C ATOM 815 O HIS A 56 4.764 -8.614 -11.727 1.00 0.00 O ATOM 816 CB HIS A 56 5.131 -5.457 -10.714 1.00 0.00 C ATOM 817 CG HIS A 56 3.677 -5.535 -11.116 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.725 -6.367 -10.519 1.00 0.00 N ATOM 819 CD2 HIS A 56 3.053 -4.744 -12.039 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.556 -6.074 -11.112 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.722 -5.095 -12.014 1.00 0.00 N ATOM 0 H HIS A 56 5.770 -5.816 -13.140 1.00 0.00 H new ATOM 0 HA HIS A 56 6.947 -6.543 -10.634 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.187 -5.412 -9.626 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.544 -4.522 -11.093 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.513 -3.993 -12.664 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.616 -6.558 -10.894 1.00 0.00 H new ATOM 0 HE2 HIS A 56 0.986 -4.680 -12.585 1.00 0.00 H new ATOM 829 N GLN A 57 5.666 -8.510 -9.673 1.00 0.00 N ATOM 830 CA GLN A 57 5.264 -9.866 -9.256 1.00 0.00 C ATOM 831 C GLN A 57 3.839 -9.951 -8.658 1.00 0.00 C ATOM 832 O GLN A 57 3.537 -10.854 -7.874 1.00 0.00 O ATOM 833 CB GLN A 57 6.362 -10.491 -8.372 1.00 0.00 C ATOM 834 CG GLN A 57 7.639 -10.790 -9.180 1.00 0.00 C ATOM 835 CD GLN A 57 8.662 -11.605 -8.386 1.00 0.00 C ATOM 836 OE1 GLN A 57 8.891 -11.395 -7.201 1.00 0.00 O ATOM 837 NE2 GLN A 57 9.320 -12.571 -8.995 1.00 0.00 N ATOM 0 H GLN A 57 6.150 -7.989 -8.941 1.00 0.00 H new ATOM 0 HA GLN A 57 5.179 -10.476 -10.155 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.600 -9.813 -7.552 1.00 0.00 H new ATOM 0 HB3 GLN A 57 5.989 -11.413 -7.925 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.372 -11.334 -10.086 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.094 -9.851 -9.494 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.146 -12.764 -9.981 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.004 -13.126 -8.480 1.00 0.00 H new ATOM 846 N GLY A 58 2.943 -9.026 -9.021 1.00 0.00 N ATOM 847 CA GLY A 58 1.532 -9.012 -8.605 1.00 0.00 C ATOM 848 C GLY A 58 1.251 -8.316 -7.267 1.00 0.00 C ATOM 849 O GLY A 58 0.106 -8.320 -6.811 1.00 0.00 O ATOM 0 H GLY A 58 3.184 -8.244 -9.629 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.946 -8.521 -9.382 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.178 -10.041 -8.542 1.00 0.00 H new ATOM 853 N TYR A 59 2.259 -7.707 -6.637 1.00 0.00 N ATOM 854 CA TYR A 59 2.127 -6.961 -5.383 1.00 0.00 C ATOM 855 C TYR A 59 3.055 -5.736 -5.322 1.00 0.00 C ATOM 856 O TYR A 59 4.047 -5.639 -6.052 1.00 0.00 O ATOM 857 CB TYR A 59 2.349 -7.893 -4.180 1.00 0.00 C ATOM 858 CG TYR A 59 3.769 -8.402 -4.008 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.640 -7.774 -3.097 1.00 0.00 C ATOM 860 CD2 TYR A 59 4.210 -9.518 -4.746 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.945 -8.271 -2.916 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.524 -9.997 -4.591 1.00 0.00 C ATOM 863 CZ TYR A 59 6.397 -9.374 -3.672 1.00 0.00 C ATOM 864 OH TYR A 59 7.667 -9.835 -3.503 1.00 0.00 O ATOM 0 H TYR A 59 3.214 -7.720 -6.994 1.00 0.00 H new ATOM 0 HA TYR A 59 1.109 -6.574 -5.342 1.00 0.00 H new ATOM 0 HB2 TYR A 59 2.058 -7.364 -3.273 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.682 -8.750 -4.277 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.307 -6.912 -2.538 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.537 -10.008 -5.434 1.00 0.00 H new ATOM 0 HE1 TYR A 59 6.603 -7.807 -2.196 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.865 -10.840 -5.174 1.00 0.00 H new ATOM 0 HH TYR A 59 7.819 -10.599 -4.097 1.00 0.00 H new ATOM 874 N GLY A 60 2.711 -4.793 -4.446 1.00 0.00 N ATOM 875 CA GLY A 60 3.407 -3.529 -4.231 1.00 0.00 C ATOM 876 C GLY A 60 3.270 -3.006 -2.800 1.00 0.00 C ATOM 877 O GLY A 60 2.679 -3.652 -1.933 1.00 0.00 O ATOM 0 H GLY A 60 1.899 -4.897 -3.838 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.464 -3.658 -4.465 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.016 -2.783 -4.923 1.00 0.00 H new ATOM 881 N PHE A 61 3.814 -1.815 -2.569 1.00 0.00 N ATOM 882 CA PHE A 61 3.841 -1.122 -1.287 1.00 0.00 C ATOM 883 C PHE A 61 3.738 0.398 -1.464 1.00 0.00 C ATOM 884 O PHE A 61 4.234 0.953 -2.452 1.00 0.00 O ATOM 885 CB PHE A 61 5.144 -1.426 -0.532 1.00 0.00 C ATOM 886 CG PHE A 61 5.467 -2.885 -0.274 1.00 0.00 C ATOM 887 CD1 PHE A 61 5.077 -3.488 0.936 1.00 0.00 C ATOM 888 CD2 PHE A 61 6.210 -3.623 -1.216 1.00 0.00 C ATOM 889 CE1 PHE A 61 5.436 -4.821 1.208 1.00 0.00 C ATOM 890 CE2 PHE A 61 6.559 -4.958 -0.949 1.00 0.00 C ATOM 891 CZ PHE A 61 6.175 -5.557 0.264 1.00 0.00 C ATOM 0 H PHE A 61 4.271 -1.281 -3.309 1.00 0.00 H new ATOM 0 HA PHE A 61 2.982 -1.480 -0.720 1.00 0.00 H new ATOM 0 HB2 PHE A 61 5.970 -0.991 -1.094 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.106 -0.913 0.429 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.501 -2.927 1.657 1.00 0.00 H new ATOM 0 HD2 PHE A 61 6.512 -3.162 -2.145 1.00 0.00 H new ATOM 0 HE1 PHE A 61 5.144 -5.279 2.141 1.00 0.00 H new ATOM 0 HE2 PHE A 61 7.122 -5.524 -1.676 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.447 -6.581 0.471 1.00 0.00 H new ATOM 901 N VAL A 62 3.164 1.077 -0.467 1.00 0.00 N ATOM 902 CA VAL A 62 3.040 2.545 -0.413 1.00 0.00 C ATOM 903 C VAL A 62 3.439 3.048 0.975 1.00 0.00 C ATOM 904 O VAL A 62 2.912 2.579 1.980 1.00 0.00 O ATOM 905 CB VAL A 62 1.612 3.009 -0.771 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.571 4.531 -0.908 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.099 2.390 -2.078 1.00 0.00 C ATOM 0 H VAL A 62 2.761 0.614 0.348 1.00 0.00 H new ATOM 0 HA VAL A 62 3.714 2.971 -1.156 1.00 0.00 H new ATOM 0 HB VAL A 62 0.966 2.675 0.041 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.559 4.846 -1.161 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.869 4.989 0.035 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.256 4.844 -1.696 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.091 2.751 -2.280 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.758 2.674 -2.898 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.084 1.304 -1.985 1.00 0.00 H new ATOM 917 N GLU A 63 4.373 3.994 1.046 1.00 0.00 N ATOM 918 CA GLU A 63 4.908 4.545 2.296 1.00 0.00 C ATOM 919 C GLU A 63 4.291 5.912 2.604 1.00 0.00 C ATOM 920 O GLU A 63 4.431 6.854 1.823 1.00 0.00 O ATOM 921 CB GLU A 63 6.436 4.610 2.202 1.00 0.00 C ATOM 922 CG GLU A 63 7.114 5.036 3.512 1.00 0.00 C ATOM 923 CD GLU A 63 8.629 4.756 3.492 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.257 4.756 2.406 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.243 4.562 4.564 1.00 0.00 O ATOM 0 H GLU A 63 4.792 4.412 0.215 1.00 0.00 H new ATOM 0 HA GLU A 63 4.640 3.892 3.127 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.816 3.632 1.907 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.714 5.310 1.414 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.943 6.099 3.680 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.657 4.504 4.347 1.00 0.00 H new ATOM 932 N PHE A 64 3.628 6.027 3.753 1.00 0.00 N ATOM 933 CA PHE A 64 3.016 7.261 4.242 1.00 0.00 C ATOM 934 C PHE A 64 3.915 8.004 5.233 1.00 0.00 C ATOM 935 O PHE A 64 4.838 7.434 5.820 1.00 0.00 O ATOM 936 CB PHE A 64 1.655 6.944 4.870 1.00 0.00 C ATOM 937 CG PHE A 64 0.609 6.581 3.843 1.00 0.00 C ATOM 938 CD1 PHE A 64 0.417 5.241 3.455 1.00 0.00 C ATOM 939 CD2 PHE A 64 -0.145 7.604 3.241 1.00 0.00 C ATOM 940 CE1 PHE A 64 -0.547 4.924 2.484 1.00 0.00 C ATOM 941 CE2 PHE A 64 -1.108 7.286 2.272 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.315 5.949 1.902 1.00 0.00 C ATOM 0 H PHE A 64 3.498 5.240 4.389 1.00 0.00 H new ATOM 0 HA PHE A 64 2.877 7.927 3.391 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.768 6.120 5.575 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.313 7.807 5.441 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.010 4.458 3.904 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.017 8.633 3.524 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.698 3.897 2.185 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.690 8.070 1.811 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.068 5.705 1.167 1.00 0.00 H new ATOM 952 N LEU A 65 3.616 9.289 5.442 1.00 0.00 N ATOM 953 CA LEU A 65 4.330 10.130 6.405 1.00 0.00 C ATOM 954 C LEU A 65 4.163 9.632 7.855 1.00 0.00 C ATOM 955 O LEU A 65 5.109 9.711 8.643 1.00 0.00 O ATOM 956 CB LEU A 65 3.828 11.575 6.247 1.00 0.00 C ATOM 957 CG LEU A 65 4.755 12.622 6.883 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.007 12.855 6.033 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.019 13.958 7.006 1.00 0.00 C ATOM 0 H LEU A 65 2.870 9.776 4.946 1.00 0.00 H new ATOM 0 HA LEU A 65 5.399 10.081 6.197 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.716 11.798 5.186 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.838 11.658 6.696 1.00 0.00 H new ATOM 0 HG LEU A 65 5.049 12.243 7.862 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.639 13.602 6.514 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.559 11.920 5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.715 13.209 5.044 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.680 14.697 7.458 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.716 14.299 6.016 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.136 13.831 7.632 1.00 0.00 H new ATOM 971 N SER A 66 2.984 9.088 8.185 1.00 0.00 N ATOM 972 CA SER A 66 2.635 8.615 9.534 1.00 0.00 C ATOM 973 C SER A 66 1.757 7.369 9.511 1.00 0.00 C ATOM 974 O SER A 66 1.025 7.090 8.559 1.00 0.00 O ATOM 975 CB SER A 66 1.920 9.710 10.345 1.00 0.00 C ATOM 976 OG SER A 66 2.570 10.972 10.266 1.00 0.00 O ATOM 0 H SER A 66 2.230 8.961 7.509 1.00 0.00 H new ATOM 0 HA SER A 66 3.582 8.361 10.011 1.00 0.00 H new ATOM 0 HB2 SER A 66 0.896 9.811 9.985 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.862 9.402 11.389 1.00 0.00 H new ATOM 0 HG SER A 66 2.074 11.629 10.797 1.00 0.00 H new ATOM 982 N GLU A 67 1.811 6.623 10.607 1.00 0.00 N ATOM 983 CA GLU A 67 1.124 5.346 10.792 1.00 0.00 C ATOM 984 C GLU A 67 -0.408 5.459 10.729 1.00 0.00 C ATOM 985 O GLU A 67 -1.077 4.547 10.250 1.00 0.00 O ATOM 986 CB GLU A 67 1.530 4.765 12.151 1.00 0.00 C ATOM 987 CG GLU A 67 3.042 4.582 12.346 1.00 0.00 C ATOM 988 CD GLU A 67 3.661 5.762 13.126 1.00 0.00 C ATOM 989 OE1 GLU A 67 3.885 5.636 14.355 1.00 0.00 O ATOM 990 OE2 GLU A 67 3.873 6.842 12.524 1.00 0.00 O ATOM 0 H GLU A 67 2.355 6.899 11.424 1.00 0.00 H new ATOM 0 HA GLU A 67 1.423 4.696 9.969 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.153 5.419 12.937 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.042 3.799 12.278 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.230 3.652 12.882 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.527 4.493 11.374 1.00 0.00 H new ATOM 997 N GLU A 68 -0.977 6.588 11.163 1.00 0.00 N ATOM 998 CA GLU A 68 -2.424 6.845 11.092 1.00 0.00 C ATOM 999 C GLU A 68 -2.924 7.108 9.659 1.00 0.00 C ATOM 1000 O GLU A 68 -4.070 6.793 9.335 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.805 7.985 12.053 1.00 0.00 C ATOM 1002 CG GLU A 68 -2.154 9.339 11.726 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.565 10.406 12.759 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -3.629 11.051 12.586 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -1.827 10.612 13.754 1.00 0.00 O ATOM 0 H GLU A 68 -0.446 7.355 11.576 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.932 5.935 11.410 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.888 8.105 12.043 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.526 7.697 13.067 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.069 9.234 11.717 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.451 9.659 10.727 1.00 0.00 H new ATOM 1012 N ASP A 69 -2.060 7.617 8.776 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.351 7.769 7.346 1.00 0.00 C ATOM 1014 C ASP A 69 -2.270 6.416 6.618 1.00 0.00 C ATOM 1015 O ASP A 69 -3.084 6.134 5.737 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.389 8.800 6.738 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.634 10.210 7.298 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -2.727 10.776 7.061 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -0.722 10.763 7.956 1.00 0.00 O ATOM 0 H ASP A 69 -1.128 7.939 9.036 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.372 8.131 7.223 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.361 8.502 6.942 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.508 8.814 5.655 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.356 5.539 7.049 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.254 4.166 6.567 1.00 0.00 C ATOM 1026 C ALA A 70 -2.462 3.321 7.015 1.00 0.00 C ATOM 1027 O ALA A 70 -3.100 2.672 6.189 1.00 0.00 O ATOM 1028 CB ALA A 70 0.084 3.587 7.059 1.00 0.00 C ATOM 0 H ALA A 70 -0.657 5.772 7.754 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.272 4.147 5.477 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.185 2.559 6.711 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.906 4.186 6.666 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.110 3.606 8.149 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.848 3.386 8.293 1.00 0.00 N ATOM 1035 CA ASP A 71 -4.037 2.710 8.835 1.00 0.00 C ATOM 1036 C ASP A 71 -5.333 3.115 8.107 1.00 0.00 C ATOM 1037 O ASP A 71 -6.200 2.275 7.857 1.00 0.00 O ATOM 1038 CB ASP A 71 -4.136 3.018 10.336 1.00 0.00 C ATOM 1039 CG ASP A 71 -5.317 2.287 10.994 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -6.340 2.943 11.308 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -5.214 1.058 11.222 1.00 0.00 O ATOM 0 H ASP A 71 -2.335 3.919 8.995 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.924 1.638 8.676 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.208 2.726 10.828 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.249 4.093 10.480 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.439 4.380 7.690 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.576 4.865 6.907 1.00 0.00 C ATOM 1048 C TYR A 72 -6.542 4.375 5.452 1.00 0.00 C ATOM 1049 O TYR A 72 -7.586 4.037 4.896 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.634 6.393 6.978 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.922 6.954 6.405 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -7.909 7.591 5.153 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -9.136 6.804 7.103 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -9.103 8.081 4.590 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -10.337 7.289 6.545 1.00 0.00 C ATOM 1056 CZ TYR A 72 -10.322 7.927 5.284 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.475 8.401 4.735 1.00 0.00 O ATOM 0 H TYR A 72 -4.739 5.095 7.886 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.484 4.450 7.344 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.534 6.709 8.016 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.786 6.811 6.435 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.977 7.706 4.619 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -9.147 6.317 8.067 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -9.086 8.574 3.629 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -11.267 7.173 7.081 1.00 0.00 H new ATOM 0 HH TYR A 72 -12.225 8.215 5.338 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.360 4.244 4.841 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.217 3.675 3.501 1.00 0.00 C ATOM 1069 C ALA A 73 -5.619 2.190 3.481 1.00 0.00 C ATOM 1070 O ALA A 73 -6.313 1.748 2.566 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.780 3.906 3.031 1.00 0.00 C ATOM 0 H ALA A 73 -4.477 4.530 5.263 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.894 4.171 2.806 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.652 3.488 2.032 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.573 4.976 3.006 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.089 3.419 3.719 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.287 1.447 4.542 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.731 0.059 4.758 1.00 0.00 C ATOM 1079 C ILE A 74 -7.262 -0.013 4.906 1.00 0.00 C ATOM 1080 O ILE A 74 -7.881 -0.959 4.420 1.00 0.00 O ATOM 1081 CB ILE A 74 -4.994 -0.551 5.976 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.468 -0.556 5.739 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.476 -1.989 6.245 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.631 -0.742 7.005 1.00 0.00 C ATOM 0 H ILE A 74 -4.690 1.797 5.292 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.473 -0.537 3.883 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.221 0.066 6.846 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.225 -1.354 5.037 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.183 0.383 5.265 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -4.944 -2.396 7.105 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.546 -1.981 6.451 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.279 -2.608 5.370 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.572 -0.733 6.746 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.841 0.069 7.702 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -2.882 -1.695 7.471 1.00 0.00 H new ATOM 1096 N LYS A 75 -7.893 1.005 5.506 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.355 1.096 5.643 1.00 0.00 C ATOM 1098 C LYS A 75 -10.062 1.314 4.298 1.00 0.00 C ATOM 1099 O LYS A 75 -11.065 0.647 4.037 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.705 2.174 6.686 1.00 0.00 C ATOM 1101 CG LYS A 75 -11.212 2.246 6.972 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.568 3.233 8.096 1.00 0.00 C ATOM 1103 CE LYS A 75 -11.028 2.782 9.462 1.00 0.00 C ATOM 1104 NZ LYS A 75 -11.467 3.692 10.552 1.00 0.00 N ATOM 0 H LYS A 75 -7.398 1.798 5.915 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.731 0.138 6.002 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.172 1.965 7.613 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.359 3.145 6.331 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.735 2.538 6.061 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.572 1.253 7.241 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.164 4.216 7.855 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.651 3.339 8.153 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -11.371 1.769 9.673 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -9.939 2.750 9.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -11.084 3.357 11.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -11.119 4.653 10.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.506 3.703 10.598 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.555 2.208 3.438 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.237 2.584 2.186 1.00 0.00 C ATOM 1120 C ILE A 76 -9.853 1.744 0.958 1.00 0.00 C ATOM 1121 O ILE A 76 -10.722 1.487 0.129 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.128 4.098 1.898 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.691 4.597 1.649 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.808 4.895 3.028 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.644 6.036 1.132 1.00 0.00 C ATOM 0 H ILE A 76 -8.668 2.689 3.586 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.285 2.345 2.369 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.650 4.271 0.957 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.122 4.530 2.577 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.203 3.941 0.928 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.728 5.962 2.820 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.860 4.615 3.089 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.318 4.673 3.976 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.607 6.333 0.975 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.187 6.102 0.189 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.105 6.700 1.863 1.00 0.00 H new ATOM 1137 N MET A 77 -8.598 1.294 0.824 1.00 0.00 N ATOM 1138 CA MET A 77 -8.094 0.622 -0.396 1.00 0.00 C ATOM 1139 C MET A 77 -8.184 -0.909 -0.372 1.00 0.00 C ATOM 1140 O MET A 77 -7.807 -1.576 -1.333 1.00 0.00 O ATOM 1141 CB MET A 77 -6.687 1.118 -0.744 1.00 0.00 C ATOM 1142 CG MET A 77 -6.703 2.539 -1.307 1.00 0.00 C ATOM 1143 SD MET A 77 -7.021 2.604 -3.088 1.00 0.00 S ATOM 1144 CE MET A 77 -6.586 4.333 -3.381 1.00 0.00 C ATOM 0 H MET A 77 -7.896 1.383 1.558 1.00 0.00 H new ATOM 0 HA MET A 77 -8.774 0.911 -1.197 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.061 1.089 0.148 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.235 0.445 -1.472 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.466 3.119 -0.788 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.745 3.015 -1.099 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.282 4.767 -4.099 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.641 4.886 -2.443 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.572 4.391 -3.778 1.00 0.00 H new ATOM 1154 N ASP A 78 -8.718 -1.477 0.703 1.00 0.00 N ATOM 1155 CA ASP A 78 -8.889 -2.925 0.847 1.00 0.00 C ATOM 1156 C ASP A 78 -10.199 -3.416 0.204 1.00 0.00 C ATOM 1157 O ASP A 78 -11.247 -2.779 0.334 1.00 0.00 O ATOM 1158 CB ASP A 78 -8.757 -3.338 2.321 1.00 0.00 C ATOM 1159 CG ASP A 78 -8.728 -4.861 2.477 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -7.970 -5.516 1.730 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -9.468 -5.424 3.314 1.00 0.00 O ATOM 0 H ASP A 78 -9.048 -0.945 1.508 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.088 -3.420 0.299 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.845 -2.911 2.739 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.591 -2.929 2.891 1.00 0.00 H new ATOM 1166 N MET A 79 -10.132 -4.545 -0.509 1.00 0.00 N ATOM 1167 CA MET A 79 -11.201 -5.101 -1.358 1.00 0.00 C ATOM 1168 C MET A 79 -11.685 -4.180 -2.501 1.00 0.00 C ATOM 1169 O MET A 79 -12.718 -4.442 -3.124 1.00 0.00 O ATOM 1170 CB MET A 79 -12.345 -5.699 -0.517 1.00 0.00 C ATOM 1171 CG MET A 79 -11.819 -6.605 0.606 1.00 0.00 C ATOM 1172 SD MET A 79 -12.986 -7.844 1.222 1.00 0.00 S ATOM 1173 CE MET A 79 -12.836 -9.052 -0.122 1.00 0.00 C ATOM 0 H MET A 79 -9.294 -5.126 -0.513 1.00 0.00 H new ATOM 0 HA MET A 79 -10.735 -5.926 -1.897 1.00 0.00 H new ATOM 0 HB2 MET A 79 -12.937 -4.893 -0.085 1.00 0.00 H new ATOM 0 HB3 MET A 79 -13.010 -6.272 -1.164 1.00 0.00 H new ATOM 0 HG2 MET A 79 -10.927 -7.119 0.246 1.00 0.00 H new ATOM 0 HG3 MET A 79 -11.510 -5.976 1.441 1.00 0.00 H new ATOM 0 HE1 MET A 79 -13.462 -9.918 0.095 1.00 0.00 H new ATOM 0 HE2 MET A 79 -13.159 -8.597 -1.058 1.00 0.00 H new ATOM 0 HE3 MET A 79 -11.797 -9.369 -0.212 1.00 0.00 H new ATOM 1183 N ILE A 80 -10.928 -3.122 -2.814 1.00 0.00 N ATOM 1184 CA ILE A 80 -11.099 -2.278 -4.006 1.00 0.00 C ATOM 1185 C ILE A 80 -10.645 -3.041 -5.262 1.00 0.00 C ATOM 1186 O ILE A 80 -9.808 -3.938 -5.182 1.00 0.00 O ATOM 1187 CB ILE A 80 -10.379 -0.920 -3.780 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -11.359 0.056 -3.085 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -9.735 -0.308 -5.032 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -10.895 1.519 -3.017 1.00 0.00 C ATOM 0 H ILE A 80 -10.152 -2.818 -2.225 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.150 -2.043 -4.174 1.00 0.00 H new ATOM 0 HB ILE A 80 -9.524 -1.116 -3.133 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.314 0.020 -3.609 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.539 -0.298 -2.070 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.258 0.637 -4.771 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -8.987 -0.994 -5.429 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.502 -0.132 -5.786 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.653 2.118 -2.512 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.958 1.578 -2.464 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.745 1.900 -4.027 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.190 -2.695 -6.434 1.00 0.00 N ATOM 1203 CA LYS A 81 -10.944 -3.379 -7.715 1.00 0.00 C ATOM 1204 C LYS A 81 -10.199 -2.494 -8.723 1.00 0.00 C ATOM 1205 O LYS A 81 -10.763 -2.072 -9.735 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.278 -3.920 -8.253 1.00 0.00 C ATOM 1207 CG LYS A 81 -12.889 -4.994 -7.335 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.120 -5.680 -7.945 1.00 0.00 C ATOM 1209 CE LYS A 81 -13.736 -6.670 -9.052 1.00 0.00 C ATOM 1210 NZ LYS A 81 -14.938 -7.245 -9.712 1.00 0.00 N ATOM 0 H LYS A 81 -11.834 -1.909 -6.523 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.273 -4.221 -7.547 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.983 -3.096 -8.363 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.122 -4.341 -9.246 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.133 -5.747 -7.114 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.169 -4.536 -6.386 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.667 -6.206 -7.162 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.792 -4.924 -8.352 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.119 -6.165 -9.795 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.133 -7.473 -8.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.642 -7.910 -10.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.514 -7.748 -9.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.500 -6.480 -10.136 1.00 0.00 H new ATOM 1224 N LEU A 82 -8.919 -2.223 -8.457 1.00 0.00 N ATOM 1225 CA LEU A 82 -8.029 -1.470 -9.359 1.00 0.00 C ATOM 1226 C LEU A 82 -7.953 -2.166 -10.732 1.00 0.00 C ATOM 1227 O LEU A 82 -7.680 -3.366 -10.795 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.652 -1.330 -8.679 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.627 -0.455 -9.427 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.169 0.942 -9.741 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.379 -0.300 -8.555 1.00 0.00 C ATOM 0 H LEU A 82 -8.460 -2.523 -7.597 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.418 -0.469 -9.545 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.799 -0.914 -7.682 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.228 -2.326 -8.550 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.401 -0.950 -10.371 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.408 1.518 -10.268 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.057 0.855 -10.367 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.428 1.449 -8.812 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.646 0.318 -9.075 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.651 0.175 -7.612 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.950 -1.282 -8.356 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.254 -1.447 -11.825 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.450 -2.033 -13.169 1.00 0.00 C ATOM 1245 C TYR A 83 -9.335 -3.315 -13.239 1.00 0.00 C ATOM 1246 O TYR A 83 -9.139 -4.159 -14.118 1.00 0.00 O ATOM 1247 CB TYR A 83 -7.092 -2.207 -13.876 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.264 -0.942 -14.010 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -6.762 0.158 -14.738 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -4.977 -0.881 -13.443 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -5.975 1.315 -14.901 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -4.183 0.267 -13.617 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.679 1.370 -14.344 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.901 2.474 -14.516 1.00 0.00 O ATOM 0 H TYR A 83 -8.370 -0.434 -11.805 1.00 0.00 H new ATOM 0 HA TYR A 83 -9.052 -1.306 -13.715 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.508 -2.947 -13.329 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.269 -2.613 -14.872 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.750 0.113 -15.172 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -4.599 -1.717 -12.873 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.363 2.159 -15.452 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -3.191 0.304 -13.193 1.00 0.00 H new ATOM 0 HH TYR A 83 -4.471 3.267 -14.597 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.319 -3.491 -12.343 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.263 -4.624 -12.371 1.00 0.00 C ATOM 1266 C GLY A 84 -10.730 -5.959 -11.814 1.00 0.00 C ATOM 1267 O GLY A 84 -11.205 -7.025 -12.214 1.00 0.00 O ATOM 0 H GLY A 84 -10.485 -2.846 -11.571 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.152 -4.345 -11.805 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.579 -4.783 -13.402 1.00 0.00 H new ATOM 1271 N LYS A 85 -9.761 -5.912 -10.892 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.094 -7.031 -10.217 1.00 0.00 C ATOM 1273 C LYS A 85 -8.967 -6.672 -8.724 1.00 0.00 C ATOM 1274 O LYS A 85 -8.393 -5.624 -8.414 1.00 0.00 O ATOM 1275 CB LYS A 85 -7.718 -7.255 -10.872 1.00 0.00 C ATOM 1276 CG LYS A 85 -6.979 -8.465 -10.281 1.00 0.00 C ATOM 1277 CD LYS A 85 -5.597 -8.632 -10.929 1.00 0.00 C ATOM 1278 CE LYS A 85 -4.865 -9.825 -10.302 1.00 0.00 C ATOM 1279 NZ LYS A 85 -3.511 -10.009 -10.889 1.00 0.00 N ATOM 0 H LYS A 85 -9.393 -5.016 -10.573 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.662 -7.957 -10.308 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.848 -7.400 -11.944 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.107 -6.361 -10.743 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -6.867 -8.338 -9.204 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.569 -9.368 -10.436 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.706 -8.785 -12.003 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.011 -7.723 -10.794 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -4.778 -9.674 -9.226 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.452 -10.731 -10.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -3.040 -10.814 -10.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -3.597 -10.195 -11.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -2.948 -9.147 -10.740 1.00 0.00 H new ATOM 1293 N PRO A 86 -9.539 -7.458 -7.794 1.00 0.00 N ATOM 1294 CA PRO A 86 -9.611 -7.093 -6.381 1.00 0.00 C ATOM 1295 C PRO A 86 -8.234 -7.122 -5.699 1.00 0.00 C ATOM 1296 O PRO A 86 -7.551 -8.149 -5.692 1.00 0.00 O ATOM 1297 CB PRO A 86 -10.626 -8.053 -5.749 1.00 0.00 C ATOM 1298 CG PRO A 86 -10.633 -9.257 -6.689 1.00 0.00 C ATOM 1299 CD PRO A 86 -10.339 -8.640 -8.054 1.00 0.00 C ATOM 0 HA PRO A 86 -9.938 -6.061 -6.253 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -10.331 -8.337 -4.739 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -11.614 -7.598 -5.676 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -9.877 -9.991 -6.408 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -11.595 -9.770 -6.678 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.802 -9.342 -8.692 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.262 -8.380 -8.572 1.00 0.00 H new ATOM 1307 N ILE A 87 -7.854 -5.994 -5.096 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.635 -5.825 -4.295 1.00 0.00 C ATOM 1309 C ILE A 87 -6.919 -6.005 -2.799 1.00 0.00 C ATOM 1310 O ILE A 87 -7.977 -5.608 -2.300 1.00 0.00 O ATOM 1311 CB ILE A 87 -5.912 -4.485 -4.587 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.794 -3.231 -4.393 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.335 -4.513 -6.011 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -5.992 -1.937 -4.203 1.00 0.00 C ATOM 0 H ILE A 87 -8.407 -5.139 -5.153 1.00 0.00 H new ATOM 0 HA ILE A 87 -5.948 -6.615 -4.598 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.115 -4.399 -3.849 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.447 -3.120 -5.258 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.437 -3.380 -3.526 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.827 -3.571 -6.216 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.625 -5.335 -6.100 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.144 -4.653 -6.729 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.678 -1.100 -4.073 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.359 -2.028 -3.321 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.369 -1.763 -5.080 1.00 0.00 H new ATOM 1326 N ARG A 88 -5.957 -6.579 -2.069 1.00 0.00 N ATOM 1327 CA ARG A 88 -5.960 -6.667 -0.599 1.00 0.00 C ATOM 1328 C ARG A 88 -4.864 -5.790 -0.003 1.00 0.00 C ATOM 1329 O ARG A 88 -3.751 -5.761 -0.527 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.834 -8.124 -0.117 1.00 0.00 C ATOM 1331 CG ARG A 88 -6.960 -9.070 -0.576 1.00 0.00 C ATOM 1332 CD ARG A 88 -8.390 -8.563 -0.327 1.00 0.00 C ATOM 1333 NE ARG A 88 -8.624 -8.134 1.067 1.00 0.00 N ATOM 1334 CZ ARG A 88 -9.146 -8.820 2.062 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -9.410 -10.095 1.974 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -9.423 -8.217 3.179 1.00 0.00 N ATOM 0 H ARG A 88 -5.133 -7.007 -2.491 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.922 -6.294 -0.246 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.882 -8.523 -0.466 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.801 -8.127 0.972 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -6.840 -9.259 -1.643 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -6.838 -10.026 -0.067 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -8.593 -7.727 -0.996 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -9.097 -9.353 -0.580 1.00 0.00 H new ATOM 0 HE ARG A 88 -8.344 -7.179 1.288 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -9.212 -10.598 1.109 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -9.815 -10.588 2.770 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -9.236 -7.219 3.280 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -9.828 -8.741 3.955 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.178 -5.080 1.082 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.299 -4.070 1.699 1.00 0.00 C ATOM 1352 C VAL A 89 -4.174 -4.293 3.210 1.00 0.00 C ATOM 1353 O VAL A 89 -5.164 -4.590 3.879 1.00 0.00 O ATOM 1354 CB VAL A 89 -4.771 -2.638 1.366 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -3.786 -1.566 1.843 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -4.915 -2.438 -0.148 1.00 0.00 C ATOM 0 H VAL A 89 -6.067 -5.189 1.570 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.303 -4.187 1.272 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.726 -2.529 1.880 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.168 -0.579 1.583 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.668 -1.636 2.924 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.820 -1.720 1.362 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.249 -1.420 -0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -3.952 -2.607 -0.631 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.647 -3.144 -0.540 1.00 0.00 H new ATOM 1366 N ASN A 90 -2.954 -4.165 3.743 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.606 -4.292 5.171 1.00 0.00 C ATOM 1368 C ASN A 90 -1.235 -3.627 5.445 1.00 0.00 C ATOM 1369 O ASN A 90 -0.619 -3.081 4.531 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.620 -5.795 5.533 1.00 0.00 C ATOM 1371 CG ASN A 90 -2.728 -6.098 7.022 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -2.752 -5.222 7.874 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -2.794 -7.357 7.386 1.00 0.00 N ATOM 0 H ASN A 90 -2.139 -3.960 3.165 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.330 -3.776 5.801 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.456 -6.269 5.020 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -1.709 -6.254 5.149 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -2.865 -7.599 8.374 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -2.775 -8.094 6.681 1.00 0.00 H new ATOM 1380 N LYS A 91 -0.731 -3.656 6.682 1.00 0.00 N ATOM 1381 CA LYS A 91 0.605 -3.152 7.060 1.00 0.00 C ATOM 1382 C LYS A 91 1.723 -3.952 6.371 1.00 0.00 C ATOM 1383 O LYS A 91 1.626 -5.172 6.249 1.00 0.00 O ATOM 1384 CB LYS A 91 0.780 -3.231 8.594 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.316 -2.530 9.418 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.221 -0.997 9.416 1.00 0.00 C ATOM 1387 CE LYS A 91 0.922 -0.427 10.271 1.00 0.00 C ATOM 1388 NZ LYS A 91 0.775 -0.746 11.717 1.00 0.00 N ATOM 0 H LYS A 91 -1.249 -4.039 7.473 1.00 0.00 H new ATOM 0 HA LYS A 91 0.678 -2.115 6.732 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.815 -4.281 8.886 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.744 -2.795 8.856 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.291 -2.823 9.029 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.264 -2.885 10.447 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.094 -0.655 8.389 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.165 -0.587 9.775 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.871 -0.823 9.911 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.960 0.655 10.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.321 -0.063 12.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.229 -0.692 11.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.130 -1.706 11.898 1.00 0.00 H new ATOM 1402 N ALA A 92 2.833 -3.300 6.017 1.00 0.00 N ATOM 1403 CA ALA A 92 4.045 -3.969 5.517 1.00 0.00 C ATOM 1404 C ALA A 92 4.853 -4.697 6.623 1.00 0.00 C ATOM 1405 O ALA A 92 5.904 -5.283 6.354 1.00 0.00 O ATOM 1406 CB ALA A 92 4.892 -2.935 4.765 1.00 0.00 C ATOM 0 H ALA A 92 2.921 -2.285 6.068 1.00 0.00 H new ATOM 0 HA ALA A 92 3.743 -4.766 4.837 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.796 -3.412 4.386 1.00 0.00 H new ATOM 0 HB2 ALA A 92 4.318 -2.531 3.931 1.00 0.00 H new ATOM 0 HB3 ALA A 92 5.165 -2.126 5.443 1.00 0.00 H new ATOM 1412 N SER A 93 4.371 -4.645 7.869 1.00 0.00 N ATOM 1413 CA SER A 93 4.906 -5.311 9.068 1.00 0.00 C ATOM 1414 C SER A 93 4.016 -6.453 9.587 1.00 0.00 C ATOM 1415 O SER A 93 4.336 -7.033 10.622 1.00 0.00 O ATOM 1416 CB SER A 93 5.102 -4.269 10.181 1.00 0.00 C ATOM 1417 OG SER A 93 3.931 -3.476 10.330 1.00 0.00 O ATOM 0 H SER A 93 3.537 -4.098 8.085 1.00 0.00 H new ATOM 0 HA SER A 93 5.855 -5.763 8.780 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.331 -4.771 11.121 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.953 -3.631 9.944 1.00 0.00 H new ATOM 0 HG SER A 93 4.007 -2.673 9.774 1.00 0.00 H new ATOM 1423 N ALA A 94 2.913 -6.789 8.900 1.00 0.00 N ATOM 1424 CA ALA A 94 1.829 -7.681 9.354 1.00 0.00 C ATOM 1425 C ALA A 94 2.187 -9.179 9.568 1.00 0.00 C ATOM 1426 O ALA A 94 1.307 -10.044 9.569 1.00 0.00 O ATOM 1427 CB ALA A 94 0.647 -7.509 8.389 1.00 0.00 C ATOM 0 H ALA A 94 2.742 -6.427 7.962 1.00 0.00 H new ATOM 0 HA ALA A 94 1.581 -7.368 10.368 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.173 -8.157 8.699 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.314 -6.471 8.403 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.960 -7.776 7.380 1.00 0.00 H new ATOM 1433 N HIS A 95 3.469 -9.512 9.723 1.00 0.00 N ATOM 1434 CA HIS A 95 4.010 -10.877 9.732 1.00 0.00 C ATOM 1435 C HIS A 95 4.007 -11.556 11.113 1.00 0.00 C ATOM 1436 O HIS A 95 4.255 -12.761 11.194 1.00 0.00 O ATOM 1437 CB HIS A 95 5.430 -10.834 9.142 1.00 0.00 C ATOM 1438 CG HIS A 95 5.520 -10.091 7.829 1.00 0.00 C ATOM 1439 ND1 HIS A 95 6.222 -8.900 7.620 1.00 0.00 N ATOM 1440 CD2 HIS A 95 4.889 -10.440 6.671 1.00 0.00 C ATOM 1441 CE1 HIS A 95 6.007 -8.567 6.335 1.00 0.00 C ATOM 1442 NE2 HIS A 95 5.209 -9.472 5.742 1.00 0.00 N ATOM 0 H HIS A 95 4.194 -8.807 9.852 1.00 0.00 H new ATOM 0 HA HIS A 95 3.349 -11.495 9.125 1.00 0.00 H new ATOM 0 HB2 HIS A 95 6.099 -10.363 9.862 1.00 0.00 H new ATOM 0 HB3 HIS A 95 5.785 -11.854 8.997 1.00 0.00 H new ATOM 0 HD2 HIS A 95 4.262 -11.305 6.513 1.00 0.00 H new ATOM 0 HE1 HIS A 95 6.418 -7.695 5.848 1.00 0.00 H new ATOM 0 HE2 HIS A 95 4.894 -9.447 4.772 1.00 0.00 H new ATOM 1450 N ASN A 96 3.731 -10.823 12.199 1.00 0.00 N ATOM 1451 CA ASN A 96 3.668 -11.382 13.554 1.00 0.00 C ATOM 1452 C ASN A 96 2.320 -12.085 13.801 1.00 0.00 C ATOM 1453 O ASN A 96 1.261 -11.479 13.623 1.00 0.00 O ATOM 1454 CB ASN A 96 3.956 -10.265 14.573 1.00 0.00 C ATOM 1455 CG ASN A 96 3.860 -10.757 16.006 1.00 0.00 C ATOM 1456 OD1 ASN A 96 4.715 -11.483 16.493 1.00 0.00 O ATOM 1457 ND2 ASN A 96 2.810 -10.409 16.714 1.00 0.00 N ATOM 0 H ASN A 96 3.544 -9.821 12.162 1.00 0.00 H new ATOM 0 HA ASN A 96 4.431 -12.151 13.674 1.00 0.00 H new ATOM 0 HB2 ASN A 96 4.953 -9.862 14.395 1.00 0.00 H new ATOM 0 HB3 ASN A 96 3.250 -9.448 14.423 1.00 0.00 H new ATOM 0 HD21 ASN A 96 2.707 -10.744 17.672 1.00 0.00 H new ATOM 0 HD22 ASN A 96 2.098 -9.803 16.306 1.00 0.00 H new ATOM 1464 N LYS A 97 2.346 -13.351 14.236 1.00 0.00 N ATOM 1465 CA LYS A 97 1.135 -14.132 14.556 1.00 0.00 C ATOM 1466 C LYS A 97 0.475 -13.681 15.868 1.00 0.00 C ATOM 1467 O LYS A 97 1.153 -13.220 16.789 1.00 0.00 O ATOM 1468 CB LYS A 97 1.441 -15.642 14.528 1.00 0.00 C ATOM 1469 CG LYS A 97 2.427 -16.108 15.615 1.00 0.00 C ATOM 1470 CD LYS A 97 2.706 -17.612 15.496 1.00 0.00 C ATOM 1471 CE LYS A 97 3.690 -18.055 16.587 1.00 0.00 C ATOM 1472 NZ LYS A 97 3.987 -19.508 16.500 1.00 0.00 N ATOM 0 H LYS A 97 3.213 -13.870 14.378 1.00 0.00 H new ATOM 0 HA LYS A 97 0.396 -13.935 13.780 1.00 0.00 H new ATOM 0 HB2 LYS A 97 0.507 -16.192 14.641 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.847 -15.901 13.550 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.361 -15.553 15.526 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.018 -15.887 16.601 1.00 0.00 H new ATOM 0 HD2 LYS A 97 1.775 -18.171 15.587 1.00 0.00 H new ATOM 0 HD3 LYS A 97 3.117 -17.837 14.512 1.00 0.00 H new ATOM 0 HE2 LYS A 97 4.616 -17.488 16.494 1.00 0.00 H new ATOM 0 HE3 LYS A 97 3.273 -17.827 17.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.655 -19.771 17.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 3.106 -20.050 16.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 4.408 -19.721 15.573 1.00 0.00 H new ATOM 1486 N ASN A 98 -0.846 -13.839 15.960 1.00 0.00 N ATOM 1487 CA ASN A 98 -1.658 -13.450 17.119 1.00 0.00 C ATOM 1488 C ASN A 98 -2.778 -14.464 17.421 1.00 0.00 C ATOM 1489 O ASN A 98 -3.215 -15.212 16.542 1.00 0.00 O ATOM 1490 CB ASN A 98 -2.217 -12.028 16.894 1.00 0.00 C ATOM 1491 CG ASN A 98 -3.229 -11.937 15.761 1.00 0.00 C ATOM 1492 OD1 ASN A 98 -2.885 -11.728 14.607 1.00 0.00 O ATOM 1493 ND2 ASN A 98 -4.505 -12.099 16.037 1.00 0.00 N ATOM 0 H ASN A 98 -1.399 -14.253 15.209 1.00 0.00 H new ATOM 0 HA ASN A 98 -1.019 -13.447 18.002 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -2.685 -11.682 17.815 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -1.389 -11.351 16.684 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -5.198 -12.050 15.291 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -4.801 -12.274 16.997 1.00 0.00 H new ATOM 1500 N LEU A 99 -3.268 -14.451 18.665 1.00 0.00 N ATOM 1501 CA LEU A 99 -4.468 -15.181 19.094 1.00 0.00 C ATOM 1502 C LEU A 99 -5.751 -14.412 18.722 1.00 0.00 C ATOM 1503 O LEU A 99 -5.713 -13.206 18.457 1.00 0.00 O ATOM 1504 CB LEU A 99 -4.399 -15.451 20.612 1.00 0.00 C ATOM 1505 CG LEU A 99 -3.192 -16.287 21.082 1.00 0.00 C ATOM 1506 CD1 LEU A 99 -3.246 -16.451 22.602 1.00 0.00 C ATOM 1507 CD2 LEU A 99 -3.160 -17.682 20.455 1.00 0.00 C ATOM 0 H LEU A 99 -2.832 -13.921 19.420 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.502 -16.136 18.570 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.381 -14.494 21.133 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.313 -15.962 20.915 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.296 -15.751 20.769 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.393 -17.042 22.935 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.214 -15.470 23.075 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.170 -16.958 22.881 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.289 -18.226 20.822 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.066 -18.223 20.726 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.101 -17.592 19.370 1.00 0.00 H new ATOM 1519 N SER A 100 -6.894 -15.101 18.734 1.00 0.00 N ATOM 1520 CA SER A 100 -8.224 -14.510 18.498 1.00 0.00 C ATOM 1521 C SER A 100 -8.763 -13.699 19.690 1.00 0.00 C ATOM 1522 O SER A 100 -9.609 -12.821 19.508 1.00 0.00 O ATOM 1523 CB SER A 100 -9.215 -15.620 18.125 1.00 0.00 C ATOM 1524 OG SER A 100 -9.245 -16.625 19.129 1.00 0.00 O ATOM 0 H SER A 100 -6.928 -16.105 18.911 1.00 0.00 H new ATOM 0 HA SER A 100 -8.112 -13.801 17.678 1.00 0.00 H new ATOM 0 HB2 SER A 100 -10.211 -15.197 17.997 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.931 -16.062 17.170 1.00 0.00 H new ATOM 0 HG SER A 100 -9.884 -17.323 18.874 1.00 0.00 H new ATOM 1530 N GLY A 101 -8.263 -13.958 20.904 1.00 0.00 N ATOM 1531 CA GLY A 101 -8.619 -13.247 22.137 1.00 0.00 C ATOM 1532 C GLY A 101 -8.040 -13.895 23.409 1.00 0.00 C ATOM 1533 O GLY A 101 -7.411 -14.958 23.327 1.00 0.00 O ATOM 0 H GLY A 101 -7.575 -14.695 21.060 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.265 -12.218 22.069 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.705 -13.205 22.222 1.00 0.00 H new ATOM 1537 N PRO A 102 -8.235 -13.271 24.587 1.00 0.00 N ATOM 1538 CA PRO A 102 -7.800 -13.802 25.882 1.00 0.00 C ATOM 1539 C PRO A 102 -8.660 -14.989 26.360 1.00 0.00 C ATOM 1540 O PRO A 102 -9.753 -15.243 25.844 1.00 0.00 O ATOM 1541 CB PRO A 102 -7.888 -12.608 26.841 1.00 0.00 C ATOM 1542 CG PRO A 102 -9.056 -11.801 26.277 1.00 0.00 C ATOM 1543 CD PRO A 102 -8.901 -11.986 24.768 1.00 0.00 C ATOM 0 HA PRO A 102 -6.792 -14.212 25.825 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -8.075 -12.927 27.866 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -6.965 -12.029 26.851 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.015 -12.176 26.634 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -8.997 -10.751 26.564 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -9.872 -11.976 24.272 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -8.313 -11.177 24.334 1.00 0.00 H new ATOM 1551 N SER A 103 -8.176 -15.704 27.380 1.00 0.00 N ATOM 1552 CA SER A 103 -8.881 -16.815 28.045 1.00 0.00 C ATOM 1553 C SER A 103 -8.584 -16.883 29.554 1.00 0.00 C ATOM 1554 O SER A 103 -7.694 -16.195 30.063 1.00 0.00 O ATOM 1555 CB SER A 103 -8.537 -18.150 27.365 1.00 0.00 C ATOM 1556 OG SER A 103 -7.188 -18.524 27.597 1.00 0.00 O ATOM 0 H SER A 103 -7.256 -15.524 27.781 1.00 0.00 H new ATOM 0 HA SER A 103 -9.949 -16.625 27.941 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.200 -18.930 27.738 1.00 0.00 H new ATOM 0 HB3 SER A 103 -8.713 -18.068 26.292 1.00 0.00 H new ATOM 0 HG SER A 103 -7.004 -19.378 27.152 1.00 0.00 H new ATOM 1562 N SER A 104 -9.328 -17.726 30.279 1.00 0.00 N ATOM 1563 CA SER A 104 -9.175 -17.971 31.725 1.00 0.00 C ATOM 1564 C SER A 104 -8.067 -18.979 32.093 1.00 0.00 C ATOM 1565 O SER A 104 -7.842 -19.237 33.281 1.00 0.00 O ATOM 1566 CB SER A 104 -10.526 -18.412 32.305 1.00 0.00 C ATOM 1567 OG SER A 104 -11.012 -19.564 31.628 1.00 0.00 O ATOM 0 H SER A 104 -10.080 -18.277 29.865 1.00 0.00 H new ATOM 0 HA SER A 104 -8.852 -17.029 32.168 1.00 0.00 H new ATOM 0 HB2 SER A 104 -10.418 -18.627 33.368 1.00 0.00 H new ATOM 0 HB3 SER A 104 -11.248 -17.600 32.216 1.00 0.00 H new ATOM 0 HG SER A 104 -11.873 -19.831 32.013 1.00 0.00 H new ATOM 1573 N GLY A 105 -7.368 -19.552 31.099 1.00 0.00 N ATOM 1574 CA GLY A 105 -6.285 -20.540 31.267 1.00 0.00 C ATOM 1575 C GLY A 105 -5.035 -19.987 31.960 1.00 0.00 C ATOM 1576 O GLY A 105 -4.503 -18.950 31.503 1.00 0.00 O ATOM 1577 OXT GLY A 105 -4.573 -20.616 32.938 1.00 0.00 O ATOM 0 H GLY A 105 -7.547 -19.333 30.119 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.664 -21.384 31.844 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -6.004 -20.925 30.287 1.00 0.00 H new TER 1581 GLY A 105