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 47 MET CE :methyl 165:sc= -0.419 (180deg=-0.593) USER MOD Set 1.2: A 56 HIS : no HD1:sc= 1.01 K(o=0.59,f=-7.7!) USER MOD Single : A 1 GLY N :NH3+ -134:sc= 0.0269 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 173:sc= 1.23 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc=0.000598 USER MOD Single : A 13 ASN : amide:sc= 1.15 K(o=1.2,f=-0.49) USER MOD Single : A 14 GLN : amide:sc= 0.721 K(o=0.72,f=-0.56) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -169:sc= 1.22 (180deg=1.09) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0.965 K(o=0.97,f=0) USER MOD Single : A 44 ASN : amide:sc= 0.86 K(o=0.86,f=-0.18) USER MOD Single : A 45 THR OG1 : rot -149:sc= 0.00705 USER MOD Single : A 46 HIS : no HD1:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 49 LYS NZ :NH3+ -150:sc= 2.42 (180deg=1.6) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= 0.99 K(o=0.99,f=-0.62) 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 77 MET CE :methyl -142:sc= -0.0927 (180deg=-2!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -166:sc= 2.18 (180deg=1.91) USER MOD Single : A 90 ASN : amide:sc= 0.812 K(o=0.81,f=0) USER MOD Single : A 91 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.17) USER MOD Single : A 93 SER OG : rot -174:sc= 1.31 USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN : amide:sc= 0.116 K(o=0.12,f=-3.1!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= 0.134 K(o=0.13,f=-2.4) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0.00104 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.375 20.392 16.463 1.00 0.00 N ATOM 2 CA GLY A 1 -7.951 20.121 15.126 1.00 0.00 C ATOM 3 C GLY A 1 -7.301 18.911 14.468 1.00 0.00 C ATOM 4 O GLY A 1 -6.837 17.998 15.153 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.142 20.568 17.142 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.819 19.570 16.774 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.759 21.228 16.412 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.024 19.952 15.219 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.820 20.996 14.489 1.00 0.00 H new ATOM 10 N SER A 2 -7.269 18.891 13.133 1.00 0.00 N ATOM 11 CA SER A 2 -6.694 17.796 12.326 1.00 0.00 C ATOM 12 C SER A 2 -5.167 17.679 12.461 1.00 0.00 C ATOM 13 O SER A 2 -4.474 18.666 12.733 1.00 0.00 O ATOM 14 CB SER A 2 -7.056 17.982 10.846 1.00 0.00 C ATOM 15 OG SER A 2 -8.465 18.070 10.682 1.00 0.00 O ATOM 0 H SER A 2 -7.648 19.649 12.565 1.00 0.00 H new ATOM 0 HA SER A 2 -7.126 16.873 12.713 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.583 18.885 10.461 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.668 17.146 10.264 1.00 0.00 H new ATOM 0 HG SER A 2 -8.677 18.190 9.733 1.00 0.00 H new ATOM 21 N SER A 3 -4.630 16.476 12.237 1.00 0.00 N ATOM 22 CA SER A 3 -3.188 16.181 12.280 1.00 0.00 C ATOM 23 C SER A 3 -2.398 16.935 11.196 1.00 0.00 C ATOM 24 O SER A 3 -2.877 17.105 10.070 1.00 0.00 O ATOM 25 CB SER A 3 -2.945 14.672 12.129 1.00 0.00 C ATOM 26 OG SER A 3 -3.662 13.947 13.115 1.00 0.00 O ATOM 0 H SER A 3 -5.197 15.658 12.015 1.00 0.00 H new ATOM 0 HA SER A 3 -2.829 16.522 13.251 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.253 14.347 11.135 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.880 14.460 12.217 1.00 0.00 H new ATOM 0 HG SER A 3 -3.591 12.987 12.932 1.00 0.00 H new ATOM 32 N GLY A 4 -1.180 17.376 11.524 1.00 0.00 N ATOM 33 CA GLY A 4 -0.315 18.159 10.629 1.00 0.00 C ATOM 34 C GLY A 4 0.835 18.864 11.360 1.00 0.00 C ATOM 35 O GLY A 4 1.297 18.402 12.407 1.00 0.00 O ATOM 0 H GLY A 4 -0.758 17.197 12.435 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.099 17.499 9.866 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.919 18.905 10.112 1.00 0.00 H new ATOM 39 N SER A 5 1.288 19.995 10.807 1.00 0.00 N ATOM 40 CA SER A 5 2.312 20.893 11.384 1.00 0.00 C ATOM 41 C SER A 5 3.681 20.244 11.676 1.00 0.00 C ATOM 42 O SER A 5 4.424 20.706 12.547 1.00 0.00 O ATOM 43 CB SER A 5 1.753 21.660 12.596 1.00 0.00 C ATOM 44 OG SER A 5 0.556 22.348 12.251 1.00 0.00 O ATOM 0 H SER A 5 0.941 20.329 9.908 1.00 0.00 H new ATOM 0 HA SER A 5 2.539 21.607 10.593 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.556 20.965 13.412 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.496 22.372 12.956 1.00 0.00 H new ATOM 0 HG SER A 5 0.217 22.827 13.035 1.00 0.00 H new ATOM 50 N SER A 6 4.035 19.179 10.946 1.00 0.00 N ATOM 51 CA SER A 6 5.337 18.494 11.027 1.00 0.00 C ATOM 52 C SER A 6 5.732 17.869 9.679 1.00 0.00 C ATOM 53 O SER A 6 4.869 17.411 8.922 1.00 0.00 O ATOM 54 CB SER A 6 5.296 17.421 12.121 1.00 0.00 C ATOM 55 OG SER A 6 6.607 16.958 12.400 1.00 0.00 O ATOM 0 H SER A 6 3.408 18.756 10.262 1.00 0.00 H new ATOM 0 HA SER A 6 6.094 19.237 11.280 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.846 17.830 13.026 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.669 16.589 11.802 1.00 0.00 H new ATOM 0 HG SER A 6 6.570 16.274 13.101 1.00 0.00 H new ATOM 61 N GLY A 7 7.032 17.865 9.368 1.00 0.00 N ATOM 62 CA GLY A 7 7.611 17.293 8.143 1.00 0.00 C ATOM 63 C GLY A 7 8.099 15.839 8.294 1.00 0.00 C ATOM 64 O GLY A 7 7.789 15.178 9.292 1.00 0.00 O ATOM 0 H GLY A 7 7.737 18.274 9.982 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.865 17.334 7.349 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.449 17.914 7.826 1.00 0.00 H new ATOM 68 N PRO A 8 8.884 15.331 7.323 1.00 0.00 N ATOM 69 CA PRO A 8 9.531 14.017 7.399 1.00 0.00 C ATOM 70 C PRO A 8 10.479 13.878 8.602 1.00 0.00 C ATOM 71 O PRO A 8 11.094 14.854 9.044 1.00 0.00 O ATOM 72 CB PRO A 8 10.279 13.841 6.071 1.00 0.00 C ATOM 73 CG PRO A 8 9.545 14.778 5.114 1.00 0.00 C ATOM 74 CD PRO A 8 9.141 15.936 6.024 1.00 0.00 C ATOM 0 HA PRO A 8 8.784 13.238 7.551 1.00 0.00 H new ATOM 0 HB2 PRO A 8 11.331 14.109 6.166 1.00 0.00 H new ATOM 0 HB3 PRO A 8 10.243 12.808 5.725 1.00 0.00 H new ATOM 0 HG2 PRO A 8 10.188 15.109 4.298 1.00 0.00 H new ATOM 0 HG3 PRO A 8 8.678 14.297 4.661 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.933 16.682 6.087 1.00 0.00 H new ATOM 0 HD3 PRO A 8 8.255 16.444 5.644 1.00 0.00 H new ATOM 82 N ILE A 9 10.617 12.650 9.113 1.00 0.00 N ATOM 83 CA ILE A 9 11.407 12.306 10.310 1.00 0.00 C ATOM 84 C ILE A 9 12.344 11.105 10.087 1.00 0.00 C ATOM 85 O ILE A 9 12.158 10.306 9.167 1.00 0.00 O ATOM 86 CB ILE A 9 10.509 12.138 11.557 1.00 0.00 C ATOM 87 CG1 ILE A 9 9.203 11.347 11.355 1.00 0.00 C ATOM 88 CG2 ILE A 9 10.139 13.523 12.119 1.00 0.00 C ATOM 89 CD1 ILE A 9 9.370 9.897 10.892 1.00 0.00 C ATOM 0 H ILE A 9 10.168 11.836 8.693 1.00 0.00 H new ATOM 0 HA ILE A 9 12.064 13.154 10.504 1.00 0.00 H new ATOM 0 HB ILE A 9 11.116 11.546 12.242 1.00 0.00 H new ATOM 0 HG12 ILE A 9 8.650 11.348 12.295 1.00 0.00 H new ATOM 0 HG13 ILE A 9 8.590 11.874 10.624 1.00 0.00 H new ATOM 0 HG21 ILE A 9 9.506 13.402 12.998 1.00 0.00 H new ATOM 0 HG22 ILE A 9 11.047 14.057 12.397 1.00 0.00 H new ATOM 0 HG23 ILE A 9 9.601 14.092 11.360 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.389 9.435 10.782 1.00 0.00 H new ATOM 0 HD12 ILE A 9 9.889 9.879 9.934 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.951 9.344 11.630 1.00 0.00 H new ATOM 101 N SER A 10 13.366 10.977 10.939 1.00 0.00 N ATOM 102 CA SER A 10 14.354 9.884 10.912 1.00 0.00 C ATOM 103 C SER A 10 13.858 8.574 11.546 1.00 0.00 C ATOM 104 O SER A 10 14.427 7.510 11.295 1.00 0.00 O ATOM 105 CB SER A 10 15.644 10.348 11.601 1.00 0.00 C ATOM 106 OG SER A 10 15.373 10.804 12.921 1.00 0.00 O ATOM 0 H SER A 10 13.537 11.647 11.689 1.00 0.00 H new ATOM 0 HA SER A 10 14.536 9.655 9.862 1.00 0.00 H new ATOM 0 HB2 SER A 10 16.360 9.527 11.634 1.00 0.00 H new ATOM 0 HB3 SER A 10 16.104 11.149 11.022 1.00 0.00 H new ATOM 0 HG SER A 10 16.208 11.094 13.345 1.00 0.00 H new ATOM 112 N GLU A 11 12.775 8.619 12.331 1.00 0.00 N ATOM 113 CA GLU A 11 12.144 7.463 12.990 1.00 0.00 C ATOM 114 C GLU A 11 11.247 6.668 12.011 1.00 0.00 C ATOM 115 O GLU A 11 10.031 6.541 12.186 1.00 0.00 O ATOM 116 CB GLU A 11 11.419 7.950 14.262 1.00 0.00 C ATOM 117 CG GLU A 11 11.075 6.832 15.259 1.00 0.00 C ATOM 118 CD GLU A 11 12.331 6.287 15.970 1.00 0.00 C ATOM 119 OE1 GLU A 11 12.697 6.810 17.051 1.00 0.00 O ATOM 120 OE2 GLU A 11 12.960 5.330 15.458 1.00 0.00 O ATOM 0 H GLU A 11 12.293 9.495 12.534 1.00 0.00 H new ATOM 0 HA GLU A 11 12.903 6.746 13.302 1.00 0.00 H new ATOM 0 HB2 GLU A 11 12.045 8.688 14.763 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.499 8.457 13.971 1.00 0.00 H new ATOM 0 HG2 GLU A 11 10.374 7.212 16.002 1.00 0.00 H new ATOM 0 HG3 GLU A 11 10.574 6.019 14.734 1.00 0.00 H new ATOM 127 N ARG A 12 11.852 6.177 10.922 1.00 0.00 N ATOM 128 CA ARG A 12 11.188 5.445 9.832 1.00 0.00 C ATOM 129 C ARG A 12 10.734 4.057 10.305 1.00 0.00 C ATOM 130 O ARG A 12 11.564 3.236 10.701 1.00 0.00 O ATOM 131 CB ARG A 12 12.158 5.376 8.638 1.00 0.00 C ATOM 132 CG ARG A 12 11.502 4.866 7.347 1.00 0.00 C ATOM 133 CD ARG A 12 12.552 4.771 6.233 1.00 0.00 C ATOM 134 NE ARG A 12 11.936 4.423 4.940 1.00 0.00 N ATOM 135 CZ ARG A 12 12.525 3.897 3.885 1.00 0.00 C ATOM 136 NH1 ARG A 12 13.791 3.582 3.876 1.00 0.00 N ATOM 137 NH2 ARG A 12 11.843 3.679 2.802 1.00 0.00 N ATOM 0 H ARG A 12 12.855 6.282 10.769 1.00 0.00 H new ATOM 0 HA ARG A 12 10.283 5.965 9.517 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.572 6.368 8.459 1.00 0.00 H new ATOM 0 HB3 ARG A 12 12.993 4.724 8.895 1.00 0.00 H new ATOM 0 HG2 ARG A 12 11.051 3.889 7.519 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.699 5.539 7.046 1.00 0.00 H new ATOM 0 HD2 ARG A 12 13.076 5.722 6.143 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.297 4.020 6.496 1.00 0.00 H new ATOM 0 HE ARG A 12 10.937 4.611 4.851 1.00 0.00 H new ATOM 0 HH11 ARG A 12 14.362 3.741 4.706 1.00 0.00 H new ATOM 0 HH12 ARG A 12 14.210 3.177 3.039 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.851 3.915 2.768 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.299 3.272 1.985 1.00 0.00 H new ATOM 151 N ASN A 13 9.426 3.792 10.242 1.00 0.00 N ATOM 152 CA ASN A 13 8.788 2.577 10.771 1.00 0.00 C ATOM 153 C ASN A 13 8.084 1.770 9.667 1.00 0.00 C ATOM 154 O ASN A 13 7.416 2.339 8.802 1.00 0.00 O ATOM 155 CB ASN A 13 7.793 2.972 11.883 1.00 0.00 C ATOM 156 CG ASN A 13 8.444 3.532 13.142 1.00 0.00 C ATOM 157 OD1 ASN A 13 9.623 3.353 13.418 1.00 0.00 O ATOM 158 ND2 ASN A 13 7.679 4.197 13.975 1.00 0.00 N ATOM 0 H ASN A 13 8.761 4.433 9.810 1.00 0.00 H new ATOM 0 HA ASN A 13 9.563 1.931 11.185 1.00 0.00 H new ATOM 0 HB2 ASN A 13 7.100 3.714 11.486 1.00 0.00 H new ATOM 0 HB3 ASN A 13 7.203 2.096 12.153 1.00 0.00 H new ATOM 0 HD21 ASN A 13 8.068 4.561 14.845 1.00 0.00 H new ATOM 0 HD22 ASN A 13 6.695 4.351 13.752 1.00 0.00 H new ATOM 165 N GLN A 14 8.156 0.435 9.748 1.00 0.00 N ATOM 166 CA GLN A 14 7.479 -0.487 8.819 1.00 0.00 C ATOM 167 C GLN A 14 5.948 -0.308 8.833 1.00 0.00 C ATOM 168 O GLN A 14 5.290 -0.464 7.807 1.00 0.00 O ATOM 169 CB GLN A 14 7.876 -1.927 9.205 1.00 0.00 C ATOM 170 CG GLN A 14 7.393 -3.023 8.237 1.00 0.00 C ATOM 171 CD GLN A 14 8.100 -3.049 6.878 1.00 0.00 C ATOM 172 OE1 GLN A 14 8.980 -2.258 6.563 1.00 0.00 O ATOM 173 NE2 GLN A 14 7.751 -3.982 6.019 1.00 0.00 N ATOM 0 H GLN A 14 8.693 -0.045 10.470 1.00 0.00 H new ATOM 0 HA GLN A 14 7.796 -0.267 7.799 1.00 0.00 H new ATOM 0 HB2 GLN A 14 8.962 -1.980 9.276 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.481 -2.142 10.198 1.00 0.00 H new ATOM 0 HG2 GLN A 14 7.525 -3.993 8.716 1.00 0.00 H new ATOM 0 HG3 GLN A 14 6.324 -2.893 8.070 1.00 0.00 H new ATOM 0 HE21 GLN A 14 7.020 -4.651 6.262 1.00 0.00 H new ATOM 0 HE22 GLN A 14 8.211 -4.037 5.110 1.00 0.00 H new ATOM 182 N ASP A 15 5.381 0.081 9.979 1.00 0.00 N ATOM 183 CA ASP A 15 3.948 0.342 10.169 1.00 0.00 C ATOM 184 C ASP A 15 3.429 1.573 9.397 1.00 0.00 C ATOM 185 O ASP A 15 2.221 1.697 9.190 1.00 0.00 O ATOM 186 CB ASP A 15 3.676 0.512 11.669 1.00 0.00 C ATOM 187 CG ASP A 15 3.984 -0.771 12.456 1.00 0.00 C ATOM 188 OD1 ASP A 15 3.136 -1.693 12.452 1.00 0.00 O ATOM 189 OD2 ASP A 15 5.078 -0.862 13.061 1.00 0.00 O ATOM 0 H ASP A 15 5.924 0.228 10.830 1.00 0.00 H new ATOM 0 HA ASP A 15 3.408 -0.513 9.762 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.282 1.330 12.057 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.633 0.789 11.820 1.00 0.00 H new ATOM 194 N ALA A 16 4.316 2.472 8.946 1.00 0.00 N ATOM 195 CA ALA A 16 3.966 3.602 8.081 1.00 0.00 C ATOM 196 C ALA A 16 3.948 3.233 6.581 1.00 0.00 C ATOM 197 O ALA A 16 3.555 4.049 5.746 1.00 0.00 O ATOM 198 CB ALA A 16 4.902 4.776 8.385 1.00 0.00 C ATOM 0 H ALA A 16 5.309 2.432 9.176 1.00 0.00 H new ATOM 0 HA ALA A 16 2.941 3.900 8.304 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.647 5.620 7.744 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.793 5.067 9.430 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.933 4.477 8.197 1.00 0.00 H new ATOM 204 N THR A 17 4.331 2.001 6.232 1.00 0.00 N ATOM 205 CA THR A 17 4.188 1.431 4.885 1.00 0.00 C ATOM 206 C THR A 17 2.999 0.470 4.863 1.00 0.00 C ATOM 207 O THR A 17 2.806 -0.319 5.789 1.00 0.00 O ATOM 208 CB THR A 17 5.492 0.753 4.419 1.00 0.00 C ATOM 209 OG1 THR A 17 6.573 1.654 4.542 1.00 0.00 O ATOM 210 CG2 THR A 17 5.473 0.330 2.946 1.00 0.00 C ATOM 0 H THR A 17 4.760 1.355 6.894 1.00 0.00 H new ATOM 0 HA THR A 17 3.992 2.235 4.176 1.00 0.00 H new ATOM 0 HB THR A 17 5.594 -0.130 5.049 1.00 0.00 H new ATOM 0 HG1 THR A 17 7.399 1.217 4.246 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.423 -0.139 2.690 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.662 -0.379 2.782 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.321 1.207 2.317 1.00 0.00 H new ATOM 218 N VAL A 18 2.198 0.514 3.799 1.00 0.00 N ATOM 219 CA VAL A 18 1.138 -0.467 3.511 1.00 0.00 C ATOM 220 C VAL A 18 1.591 -1.410 2.401 1.00 0.00 C ATOM 221 O VAL A 18 2.313 -1.003 1.491 1.00 0.00 O ATOM 222 CB VAL A 18 -0.225 0.184 3.192 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.615 1.204 4.265 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.280 0.911 1.847 1.00 0.00 C ATOM 0 H VAL A 18 2.265 1.248 3.093 1.00 0.00 H new ATOM 0 HA VAL A 18 0.973 -1.045 4.420 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.917 -0.657 3.159 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.579 1.646 4.014 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.685 0.706 5.232 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.141 1.987 4.314 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.273 1.338 1.704 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.463 1.708 1.834 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.070 0.205 1.043 1.00 0.00 H new ATOM 234 N TYR A 19 1.155 -2.662 2.470 1.00 0.00 N ATOM 235 CA TYR A 19 1.284 -3.673 1.421 1.00 0.00 C ATOM 236 C TYR A 19 -0.001 -3.714 0.585 1.00 0.00 C ATOM 237 O TYR A 19 -1.097 -3.576 1.133 1.00 0.00 O ATOM 238 CB TYR A 19 1.565 -5.028 2.086 1.00 0.00 C ATOM 239 CG TYR A 19 1.349 -6.246 1.204 1.00 0.00 C ATOM 240 CD1 TYR A 19 0.081 -6.861 1.164 1.00 0.00 C ATOM 241 CD2 TYR A 19 2.405 -6.776 0.439 1.00 0.00 C ATOM 242 CE1 TYR A 19 -0.130 -8.002 0.369 1.00 0.00 C ATOM 243 CE2 TYR A 19 2.203 -7.933 -0.339 1.00 0.00 C ATOM 244 CZ TYR A 19 0.932 -8.544 -0.384 1.00 0.00 C ATOM 245 OH TYR A 19 0.724 -9.656 -1.143 1.00 0.00 O ATOM 0 H TYR A 19 0.678 -3.020 3.298 1.00 0.00 H new ATOM 0 HA TYR A 19 2.108 -3.431 0.750 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.597 -5.034 2.437 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.928 -5.120 2.966 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -0.732 -6.454 1.747 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.372 -6.295 0.448 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -1.106 -8.463 0.335 1.00 0.00 H new ATOM 0 HE2 TYR A 19 3.023 -8.353 -0.902 1.00 0.00 H new ATOM 0 HH TYR A 19 1.556 -9.900 -1.600 1.00 0.00 H new ATOM 255 N VAL A 20 0.134 -3.937 -0.723 1.00 0.00 N ATOM 256 CA VAL A 20 -0.967 -4.083 -1.686 1.00 0.00 C ATOM 257 C VAL A 20 -0.729 -5.337 -2.530 1.00 0.00 C ATOM 258 O VAL A 20 0.195 -5.368 -3.342 1.00 0.00 O ATOM 259 CB VAL A 20 -1.089 -2.845 -2.600 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.349 -2.959 -3.468 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.157 -1.523 -1.822 1.00 0.00 C ATOM 0 H VAL A 20 1.050 -4.025 -1.162 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.902 -4.176 -1.133 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.187 -2.827 -3.211 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.429 -2.082 -4.110 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.286 -3.856 -4.084 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.228 -3.020 -2.827 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.242 -0.692 -2.523 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.026 -1.533 -1.164 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.252 -1.404 -1.227 1.00 0.00 H new ATOM 271 N GLY A 21 -1.555 -6.369 -2.359 1.00 0.00 N ATOM 272 CA GLY A 21 -1.489 -7.621 -3.121 1.00 0.00 C ATOM 273 C GLY A 21 -2.642 -7.770 -4.116 1.00 0.00 C ATOM 274 O GLY A 21 -3.763 -7.346 -3.833 1.00 0.00 O ATOM 0 H GLY A 21 -2.308 -6.360 -1.671 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.542 -7.664 -3.660 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.501 -8.463 -2.429 1.00 0.00 H new ATOM 278 N GLY A 22 -2.380 -8.398 -5.266 1.00 0.00 N ATOM 279 CA GLY A 22 -3.385 -8.706 -6.298 1.00 0.00 C ATOM 280 C GLY A 22 -3.416 -7.709 -7.464 1.00 0.00 C ATOM 281 O GLY A 22 -4.477 -7.447 -8.032 1.00 0.00 O ATOM 0 H GLY A 22 -1.443 -8.715 -5.515 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.190 -9.703 -6.693 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.370 -8.734 -5.833 1.00 0.00 H new ATOM 285 N LEU A 23 -2.261 -7.125 -7.797 1.00 0.00 N ATOM 286 CA LEU A 23 -2.089 -6.099 -8.826 1.00 0.00 C ATOM 287 C LEU A 23 -2.203 -6.682 -10.245 1.00 0.00 C ATOM 288 O LEU A 23 -2.232 -7.900 -10.441 1.00 0.00 O ATOM 289 CB LEU A 23 -0.726 -5.408 -8.614 1.00 0.00 C ATOM 290 CG LEU A 23 -0.528 -4.742 -7.241 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.831 -4.050 -7.213 1.00 0.00 C ATOM 292 CD2 LEU A 23 -1.615 -3.713 -6.936 1.00 0.00 C ATOM 0 H LEU A 23 -1.384 -7.366 -7.336 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.891 -5.366 -8.731 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.063 -6.147 -8.757 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.598 -4.651 -9.388 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.585 -5.523 -6.483 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.978 -3.576 -6.243 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.618 -4.786 -7.380 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.870 -3.293 -7.996 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.432 -3.270 -5.957 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.600 -2.932 -7.696 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.589 -4.202 -6.937 1.00 0.00 H new ATOM 304 N ASP A 24 -2.239 -5.808 -11.252 1.00 0.00 N ATOM 305 CA ASP A 24 -2.325 -6.186 -12.667 1.00 0.00 C ATOM 306 C ASP A 24 -1.278 -5.457 -13.528 1.00 0.00 C ATOM 307 O ASP A 24 -0.698 -4.466 -13.091 1.00 0.00 O ATOM 308 CB ASP A 24 -3.756 -5.934 -13.166 1.00 0.00 C ATOM 309 CG ASP A 24 -4.106 -6.848 -14.344 1.00 0.00 C ATOM 310 OD1 ASP A 24 -4.000 -8.087 -14.179 1.00 0.00 O ATOM 311 OD2 ASP A 24 -4.471 -6.323 -15.419 1.00 0.00 O ATOM 0 H ASP A 24 -2.209 -4.799 -11.106 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.097 -7.248 -12.762 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.461 -6.101 -12.352 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.859 -4.892 -13.469 1.00 0.00 H new ATOM 316 N GLU A 25 -1.022 -5.920 -14.755 1.00 0.00 N ATOM 317 CA GLU A 25 0.105 -5.457 -15.593 1.00 0.00 C ATOM 318 C GLU A 25 0.111 -3.949 -15.935 1.00 0.00 C ATOM 319 O GLU A 25 1.152 -3.406 -16.311 1.00 0.00 O ATOM 320 CB GLU A 25 0.183 -6.313 -16.871 1.00 0.00 C ATOM 321 CG GLU A 25 -0.963 -6.066 -17.864 1.00 0.00 C ATOM 322 CD GLU A 25 -0.850 -7.007 -19.079 1.00 0.00 C ATOM 323 OE1 GLU A 25 -1.410 -8.130 -19.041 1.00 0.00 O ATOM 324 OE2 GLU A 25 -0.203 -6.628 -20.086 1.00 0.00 O ATOM 0 H GLU A 25 -1.593 -6.635 -15.206 1.00 0.00 H new ATOM 0 HA GLU A 25 0.998 -5.591 -14.982 1.00 0.00 H new ATOM 0 HB2 GLU A 25 1.131 -6.115 -17.371 1.00 0.00 H new ATOM 0 HB3 GLU A 25 0.185 -7.366 -16.590 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -1.920 -6.221 -17.367 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -0.942 -5.029 -18.199 1.00 0.00 H new ATOM 331 N LYS A 26 -1.032 -3.265 -15.781 1.00 0.00 N ATOM 332 CA LYS A 26 -1.187 -1.813 -15.981 1.00 0.00 C ATOM 333 C LYS A 26 -0.800 -0.975 -14.748 1.00 0.00 C ATOM 334 O LYS A 26 -0.581 0.230 -14.877 1.00 0.00 O ATOM 335 CB LYS A 26 -2.622 -1.495 -16.443 1.00 0.00 C ATOM 336 CG LYS A 26 -3.009 -2.161 -17.777 1.00 0.00 C ATOM 337 CD LYS A 26 -3.761 -3.495 -17.648 1.00 0.00 C ATOM 338 CE LYS A 26 -5.190 -3.317 -17.120 1.00 0.00 C ATOM 339 NZ LYS A 26 -5.902 -4.620 -17.067 1.00 0.00 N ATOM 0 H LYS A 26 -1.903 -3.719 -15.505 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.482 -1.525 -16.761 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.321 -1.816 -15.671 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.731 -0.415 -16.542 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -3.628 -1.467 -18.345 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.102 -2.328 -18.358 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.795 -3.984 -18.621 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -3.210 -4.156 -16.979 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.162 -2.873 -16.125 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -5.736 -2.626 -17.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.913 -4.456 -16.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.787 -5.116 -17.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.505 -5.202 -16.302 1.00 0.00 H new ATOM 353 N VAL A 27 -0.692 -1.590 -13.565 1.00 0.00 N ATOM 354 CA VAL A 27 -0.297 -0.927 -12.308 1.00 0.00 C ATOM 355 C VAL A 27 1.195 -0.568 -12.324 1.00 0.00 C ATOM 356 O VAL A 27 2.028 -1.366 -12.759 1.00 0.00 O ATOM 357 CB VAL A 27 -0.644 -1.797 -11.079 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.262 -1.106 -9.767 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.147 -2.115 -11.008 1.00 0.00 C ATOM 0 H VAL A 27 -0.880 -2.586 -13.448 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.867 -0.002 -12.228 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.071 -2.716 -11.202 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.522 -1.750 -8.927 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.811 -0.912 -9.757 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.802 -0.163 -9.682 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.348 -2.728 -10.130 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.713 -1.186 -10.939 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.447 -2.657 -11.905 1.00 0.00 H new ATOM 369 N SER A 28 1.537 0.619 -11.814 1.00 0.00 N ATOM 370 CA SER A 28 2.918 1.114 -11.680 1.00 0.00 C ATOM 371 C SER A 28 3.161 1.797 -10.327 1.00 0.00 C ATOM 372 O SER A 28 2.220 2.209 -9.648 1.00 0.00 O ATOM 373 CB SER A 28 3.225 2.076 -12.835 1.00 0.00 C ATOM 374 OG SER A 28 2.450 3.262 -12.722 1.00 0.00 O ATOM 0 H SER A 28 0.843 1.284 -11.472 1.00 0.00 H new ATOM 0 HA SER A 28 3.591 0.258 -11.724 1.00 0.00 H new ATOM 0 HB2 SER A 28 4.286 2.327 -12.833 1.00 0.00 H new ATOM 0 HB3 SER A 28 3.015 1.588 -13.787 1.00 0.00 H new ATOM 0 HG SER A 28 2.661 3.863 -13.467 1.00 0.00 H new ATOM 380 N GLU A 29 4.422 1.960 -9.920 1.00 0.00 N ATOM 381 CA GLU A 29 4.766 2.652 -8.666 1.00 0.00 C ATOM 382 C GLU A 29 4.266 4.114 -8.616 1.00 0.00 C ATOM 383 O GLU A 29 3.741 4.507 -7.570 1.00 0.00 O ATOM 384 CB GLU A 29 6.289 2.579 -8.432 1.00 0.00 C ATOM 385 CG GLU A 29 6.694 1.321 -7.652 1.00 0.00 C ATOM 386 CD GLU A 29 8.016 0.699 -8.148 1.00 0.00 C ATOM 387 OE1 GLU A 29 8.923 0.449 -7.321 1.00 0.00 O ATOM 388 OE2 GLU A 29 8.134 0.380 -9.357 1.00 0.00 O ATOM 0 H GLU A 29 5.230 1.621 -10.442 1.00 0.00 H new ATOM 0 HA GLU A 29 4.246 2.134 -7.860 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.804 2.591 -9.393 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.614 3.464 -7.885 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.791 1.572 -6.596 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.899 0.580 -7.732 1.00 0.00 H new ATOM 395 N PRO A 30 4.328 4.914 -9.703 1.00 0.00 N ATOM 396 CA PRO A 30 3.674 6.222 -9.757 1.00 0.00 C ATOM 397 C PRO A 30 2.146 6.162 -9.610 1.00 0.00 C ATOM 398 O PRO A 30 1.565 7.077 -9.024 1.00 0.00 O ATOM 399 CB PRO A 30 4.075 6.833 -11.104 1.00 0.00 C ATOM 400 CG PRO A 30 5.416 6.172 -11.399 1.00 0.00 C ATOM 401 CD PRO A 30 5.201 4.761 -10.859 1.00 0.00 C ATOM 0 HA PRO A 30 3.998 6.828 -8.911 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.340 6.617 -11.879 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.165 7.918 -11.044 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.644 6.170 -12.465 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.240 6.680 -10.897 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.745 4.118 -11.612 1.00 0.00 H new ATOM 0 HD3 PRO A 30 6.148 4.300 -10.577 1.00 0.00 H new ATOM 409 N LEU A 31 1.484 5.089 -10.073 1.00 0.00 N ATOM 410 CA LEU A 31 0.046 4.907 -9.858 1.00 0.00 C ATOM 411 C LEU A 31 -0.233 4.667 -8.377 1.00 0.00 C ATOM 412 O LEU A 31 -1.054 5.365 -7.789 1.00 0.00 O ATOM 413 CB LEU A 31 -0.500 3.745 -10.708 1.00 0.00 C ATOM 414 CG LEU A 31 -2.025 3.555 -10.578 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.778 4.665 -11.300 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.413 2.217 -11.198 1.00 0.00 C ATOM 0 H LEU A 31 1.926 4.335 -10.599 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.466 5.816 -10.172 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.251 3.922 -11.754 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.000 2.823 -10.413 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.288 3.583 -9.521 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.851 4.506 -11.192 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.508 5.629 -10.868 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.514 4.655 -12.358 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.490 2.074 -11.111 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.130 2.208 -12.251 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.897 1.411 -10.677 1.00 0.00 H new ATOM 428 N LEU A 32 0.482 3.724 -7.757 1.00 0.00 N ATOM 429 CA LEU A 32 0.320 3.420 -6.332 1.00 0.00 C ATOM 430 C LEU A 32 0.637 4.614 -5.430 1.00 0.00 C ATOM 431 O LEU A 32 0.118 4.697 -4.325 1.00 0.00 O ATOM 432 CB LEU A 32 1.204 2.235 -5.921 1.00 0.00 C ATOM 433 CG LEU A 32 0.933 0.914 -6.642 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.613 -0.212 -5.871 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.553 0.584 -6.715 1.00 0.00 C ATOM 0 H LEU A 32 1.185 3.153 -8.225 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.731 3.166 -6.197 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.246 2.510 -6.087 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.084 2.072 -4.850 1.00 0.00 H new ATOM 0 HG LEU A 32 1.317 1.014 -7.657 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.428 -1.161 -6.374 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.686 -0.027 -5.828 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.211 -0.254 -4.859 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.690 -0.363 -7.236 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.958 0.505 -5.706 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.075 1.374 -7.255 1.00 0.00 H new ATOM 447 N TRP A 33 1.451 5.555 -5.898 1.00 0.00 N ATOM 448 CA TRP A 33 1.679 6.824 -5.216 1.00 0.00 C ATOM 449 C TRP A 33 0.461 7.743 -5.339 1.00 0.00 C ATOM 450 O TRP A 33 -0.216 8.026 -4.350 1.00 0.00 O ATOM 451 CB TRP A 33 2.959 7.458 -5.770 1.00 0.00 C ATOM 452 CG TRP A 33 3.596 8.541 -4.959 1.00 0.00 C ATOM 453 CD1 TRP A 33 2.993 9.584 -4.342 1.00 0.00 C ATOM 454 CD2 TRP A 33 5.019 8.695 -4.701 1.00 0.00 C ATOM 455 NE1 TRP A 33 3.950 10.360 -3.709 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.222 9.866 -3.916 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.157 7.955 -5.076 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.501 10.289 -3.527 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.447 8.370 -4.699 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.620 9.537 -3.929 1.00 0.00 C ATOM 0 H TRP A 33 1.975 5.457 -6.768 1.00 0.00 H new ATOM 0 HA TRP A 33 1.816 6.655 -4.148 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.694 6.666 -5.911 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.735 7.863 -6.757 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.931 9.781 -4.343 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.741 11.193 -3.158 1.00 0.00 H new ATOM 0 HE3 TRP A 33 6.037 7.056 -5.662 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.625 11.179 -2.928 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.308 7.792 -5.001 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.613 9.855 -3.647 1.00 0.00 H new ATOM 471 N GLU A 34 0.153 8.190 -6.557 1.00 0.00 N ATOM 472 CA GLU A 34 -0.887 9.200 -6.815 1.00 0.00 C ATOM 473 C GLU A 34 -2.311 8.743 -6.459 1.00 0.00 C ATOM 474 O GLU A 34 -3.131 9.559 -6.035 1.00 0.00 O ATOM 475 CB GLU A 34 -0.836 9.642 -8.285 1.00 0.00 C ATOM 476 CG GLU A 34 0.455 10.407 -8.592 1.00 0.00 C ATOM 477 CD GLU A 34 0.387 11.091 -9.971 1.00 0.00 C ATOM 478 OE1 GLU A 34 0.766 10.465 -10.991 1.00 0.00 O ATOM 479 OE2 GLU A 34 -0.045 12.268 -10.047 1.00 0.00 O ATOM 0 H GLU A 34 0.619 7.862 -7.403 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.662 10.036 -6.153 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.906 8.768 -8.932 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.697 10.273 -8.507 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.628 11.157 -7.820 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.302 9.721 -8.565 1.00 0.00 H new ATOM 486 N LEU A 35 -2.600 7.445 -6.568 1.00 0.00 N ATOM 487 CA LEU A 35 -3.888 6.859 -6.176 1.00 0.00 C ATOM 488 C LEU A 35 -4.088 6.878 -4.647 1.00 0.00 C ATOM 489 O LEU A 35 -5.211 7.038 -4.175 1.00 0.00 O ATOM 490 CB LEU A 35 -3.966 5.418 -6.719 1.00 0.00 C ATOM 491 CG LEU A 35 -5.391 4.856 -6.815 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.117 5.353 -8.065 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.356 3.329 -6.828 1.00 0.00 C ATOM 0 H LEU A 35 -1.939 6.760 -6.935 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.690 7.461 -6.604 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.509 5.390 -7.708 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.374 4.767 -6.076 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.937 5.209 -5.940 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.122 4.931 -8.094 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.180 6.441 -8.041 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.567 5.042 -8.953 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.373 2.942 -6.896 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.779 2.986 -7.686 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.891 2.968 -5.910 1.00 0.00 H new ATOM 505 N PHE A 36 -3.012 6.734 -3.868 1.00 0.00 N ATOM 506 CA PHE A 36 -3.034 6.635 -2.403 1.00 0.00 C ATOM 507 C PHE A 36 -2.904 7.995 -1.697 1.00 0.00 C ATOM 508 O PHE A 36 -3.198 8.087 -0.504 1.00 0.00 O ATOM 509 CB PHE A 36 -1.962 5.635 -1.957 1.00 0.00 C ATOM 510 CG PHE A 36 -2.379 4.169 -2.036 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.547 3.529 -3.279 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.592 3.432 -0.854 1.00 0.00 C ATOM 513 CE1 PHE A 36 -2.929 2.177 -3.343 1.00 0.00 C ATOM 514 CE2 PHE A 36 -2.993 2.085 -0.914 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.169 1.459 -2.160 1.00 0.00 C ATOM 0 H PHE A 36 -2.068 6.681 -4.252 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.014 6.268 -2.099 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.073 5.779 -2.572 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.679 5.862 -0.929 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.381 4.082 -4.192 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.446 3.905 0.106 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.038 1.691 -4.301 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.166 1.532 -0.003 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.488 0.428 -2.208 1.00 0.00 H new ATOM 525 N LEU A 37 -2.575 9.071 -2.426 1.00 0.00 N ATOM 526 CA LEU A 37 -2.636 10.458 -1.932 1.00 0.00 C ATOM 527 C LEU A 37 -4.024 10.867 -1.392 1.00 0.00 C ATOM 528 O LEU A 37 -4.141 11.818 -0.617 1.00 0.00 O ATOM 529 CB LEU A 37 -2.205 11.416 -3.059 1.00 0.00 C ATOM 530 CG LEU A 37 -0.702 11.434 -3.380 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.427 12.426 -4.509 1.00 0.00 C ATOM 532 CD2 LEU A 37 0.136 11.854 -2.173 1.00 0.00 C ATOM 0 H LEU A 37 -2.253 9.003 -3.392 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.953 10.523 -1.085 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.748 11.149 -3.965 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.512 12.426 -2.789 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.425 10.420 -3.669 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.640 12.436 -4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.982 12.128 -5.398 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.742 13.423 -4.202 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.192 11.853 -2.445 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.157 12.856 -1.858 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.029 11.153 -1.354 1.00 0.00 H new ATOM 544 N GLN A 38 -5.071 10.123 -1.763 1.00 0.00 N ATOM 545 CA GLN A 38 -6.437 10.254 -1.232 1.00 0.00 C ATOM 546 C GLN A 38 -6.524 9.920 0.267 1.00 0.00 C ATOM 547 O GLN A 38 -7.333 10.510 0.985 1.00 0.00 O ATOM 548 CB GLN A 38 -7.392 9.320 -1.996 1.00 0.00 C ATOM 549 CG GLN A 38 -7.340 9.541 -3.509 1.00 0.00 C ATOM 550 CD GLN A 38 -8.361 8.679 -4.248 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.506 9.058 -4.461 1.00 0.00 O ATOM 552 NE2 GLN A 38 -7.991 7.484 -4.656 1.00 0.00 N ATOM 0 H GLN A 38 -4.991 9.387 -2.465 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.724 11.297 -1.366 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.137 8.284 -1.774 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.411 9.480 -1.643 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.526 10.592 -3.729 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.339 9.312 -3.875 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -7.040 7.158 -4.484 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.655 6.883 -5.144 1.00 0.00 H new ATOM 561 N ALA A 39 -5.693 8.984 0.741 1.00 0.00 N ATOM 562 CA ALA A 39 -5.636 8.604 2.152 1.00 0.00 C ATOM 563 C ALA A 39 -4.838 9.608 3.003 1.00 0.00 C ATOM 564 O ALA A 39 -5.272 9.993 4.090 1.00 0.00 O ATOM 565 CB ALA A 39 -5.017 7.212 2.255 1.00 0.00 C ATOM 0 H ALA A 39 -5.040 8.468 0.152 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.652 8.603 2.547 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.967 6.913 3.302 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.630 6.500 1.703 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.012 7.229 1.834 1.00 0.00 H new ATOM 571 N GLY A 40 -3.678 10.037 2.498 1.00 0.00 N ATOM 572 CA GLY A 40 -2.771 10.968 3.170 1.00 0.00 C ATOM 573 C GLY A 40 -1.483 11.227 2.373 1.00 0.00 C ATOM 574 O GLY A 40 -1.363 10.774 1.234 1.00 0.00 O ATOM 0 H GLY A 40 -3.336 9.737 1.585 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.286 11.914 3.336 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.512 10.570 4.151 1.00 0.00 H new ATOM 578 N PRO A 41 -0.504 11.945 2.949 1.00 0.00 N ATOM 579 CA PRO A 41 0.758 12.276 2.288 1.00 0.00 C ATOM 580 C PRO A 41 1.628 11.027 2.061 1.00 0.00 C ATOM 581 O PRO A 41 2.192 10.459 3.000 1.00 0.00 O ATOM 582 CB PRO A 41 1.429 13.315 3.194 1.00 0.00 C ATOM 583 CG PRO A 41 0.857 13.004 4.577 1.00 0.00 C ATOM 584 CD PRO A 41 -0.565 12.546 4.270 1.00 0.00 C ATOM 0 HA PRO A 41 0.601 12.679 1.287 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.515 13.220 3.178 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.193 14.332 2.881 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.430 12.228 5.084 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.867 13.881 5.224 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.914 11.828 5.012 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -1.260 13.386 4.287 1.00 0.00 H new ATOM 592 N VAL A 42 1.750 10.619 0.794 1.00 0.00 N ATOM 593 CA VAL A 42 2.632 9.533 0.339 1.00 0.00 C ATOM 594 C VAL A 42 4.044 10.075 0.096 1.00 0.00 C ATOM 595 O VAL A 42 4.227 11.133 -0.511 1.00 0.00 O ATOM 596 CB VAL A 42 2.084 8.833 -0.922 1.00 0.00 C ATOM 597 CG1 VAL A 42 3.019 7.712 -1.395 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.703 8.211 -0.680 1.00 0.00 C ATOM 0 H VAL A 42 1.223 11.046 0.032 1.00 0.00 H new ATOM 0 HA VAL A 42 2.671 8.780 1.126 1.00 0.00 H new ATOM 0 HB VAL A 42 2.011 9.611 -1.682 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.601 7.241 -2.285 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.998 8.130 -1.631 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.123 6.968 -0.606 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.356 7.729 -1.594 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.772 7.471 0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -0.002 8.991 -0.391 1.00 0.00 H new ATOM 608 N VAL A 43 5.039 9.331 0.575 1.00 0.00 N ATOM 609 CA VAL A 43 6.464 9.705 0.625 1.00 0.00 C ATOM 610 C VAL A 43 7.308 8.878 -0.353 1.00 0.00 C ATOM 611 O VAL A 43 8.308 9.372 -0.877 1.00 0.00 O ATOM 612 CB VAL A 43 7.003 9.509 2.061 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.360 10.183 2.283 1.00 0.00 C ATOM 614 CG2 VAL A 43 6.063 10.077 3.127 1.00 0.00 C ATOM 0 H VAL A 43 4.872 8.402 0.960 1.00 0.00 H new ATOM 0 HA VAL A 43 6.541 10.752 0.332 1.00 0.00 H new ATOM 0 HB VAL A 43 7.091 8.427 2.162 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.688 10.012 3.308 1.00 0.00 H new ATOM 0 HG12 VAL A 43 9.092 9.763 1.593 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.267 11.255 2.106 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.492 9.911 4.115 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.931 11.147 2.963 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.096 9.578 3.063 1.00 0.00 H new ATOM 624 N ASN A 44 6.931 7.612 -0.568 1.00 0.00 N ATOM 625 CA ASN A 44 7.660 6.624 -1.368 1.00 0.00 C ATOM 626 C ASN A 44 6.734 5.453 -1.795 1.00 0.00 C ATOM 627 O ASN A 44 5.707 5.202 -1.159 1.00 0.00 O ATOM 628 CB ASN A 44 8.867 6.175 -0.512 1.00 0.00 C ATOM 629 CG ASN A 44 9.631 4.987 -1.061 1.00 0.00 C ATOM 630 OD1 ASN A 44 10.072 4.978 -2.201 1.00 0.00 O ATOM 631 ND2 ASN A 44 9.808 3.956 -0.268 1.00 0.00 N ATOM 0 H ASN A 44 6.071 7.233 -0.171 1.00 0.00 H new ATOM 0 HA ASN A 44 8.017 7.046 -2.307 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.554 7.015 -0.410 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.513 5.930 0.489 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.317 3.138 -0.601 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.436 3.973 0.682 1.00 0.00 H new ATOM 638 N THR A 45 7.108 4.707 -2.838 1.00 0.00 N ATOM 639 CA THR A 45 6.462 3.452 -3.285 1.00 0.00 C ATOM 640 C THR A 45 7.492 2.380 -3.655 1.00 0.00 C ATOM 641 O THR A 45 8.631 2.696 -4.009 1.00 0.00 O ATOM 642 CB THR A 45 5.530 3.652 -4.495 1.00 0.00 C ATOM 643 OG1 THR A 45 6.078 4.510 -5.469 1.00 0.00 O ATOM 644 CG2 THR A 45 4.174 4.213 -4.102 1.00 0.00 C ATOM 0 H THR A 45 7.902 4.965 -3.424 1.00 0.00 H new ATOM 0 HA THR A 45 5.869 3.125 -2.431 1.00 0.00 H new ATOM 0 HB THR A 45 5.410 2.652 -4.911 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.356 4.991 -5.925 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.558 4.334 -4.993 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.683 3.527 -3.412 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.307 5.181 -3.619 1.00 0.00 H new ATOM 652 N HIS A 46 7.101 1.101 -3.588 1.00 0.00 N ATOM 653 CA HIS A 46 7.938 -0.030 -4.005 1.00 0.00 C ATOM 654 C HIS A 46 7.099 -1.116 -4.687 1.00 0.00 C ATOM 655 O HIS A 46 6.054 -1.493 -4.166 1.00 0.00 O ATOM 656 CB HIS A 46 8.673 -0.608 -2.783 1.00 0.00 C ATOM 657 CG HIS A 46 9.882 -1.418 -3.176 1.00 0.00 C ATOM 658 ND1 HIS A 46 9.857 -2.737 -3.637 1.00 0.00 N ATOM 659 CD2 HIS A 46 11.169 -0.969 -3.193 1.00 0.00 C ATOM 660 CE1 HIS A 46 11.134 -3.055 -3.914 1.00 0.00 C ATOM 661 NE2 HIS A 46 11.941 -2.011 -3.656 1.00 0.00 N ATOM 0 H HIS A 46 6.185 0.820 -3.239 1.00 0.00 H new ATOM 0 HA HIS A 46 8.670 0.329 -4.729 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.981 0.207 -2.128 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.988 -1.235 -2.212 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.515 0.011 -2.901 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.464 -4.012 -4.290 1.00 0.00 H new ATOM 0 HE2 HIS A 46 12.953 -1.994 -3.782 1.00 0.00 H new ATOM 669 N MET A 47 7.538 -1.649 -5.826 1.00 0.00 N ATOM 670 CA MET A 47 6.947 -2.834 -6.465 1.00 0.00 C ATOM 671 C MET A 47 8.064 -3.789 -6.910 1.00 0.00 C ATOM 672 O MET A 47 8.732 -3.498 -7.906 1.00 0.00 O ATOM 673 CB MET A 47 6.052 -2.433 -7.651 1.00 0.00 C ATOM 674 CG MET A 47 4.719 -1.835 -7.184 1.00 0.00 C ATOM 675 SD MET A 47 3.693 -1.077 -8.471 1.00 0.00 S ATOM 676 CE MET A 47 3.392 -2.515 -9.512 1.00 0.00 C ATOM 0 H MET A 47 8.329 -1.266 -6.344 1.00 0.00 H new ATOM 0 HA MET A 47 6.314 -3.348 -5.742 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.577 -1.708 -8.273 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.860 -3.307 -8.273 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.139 -2.622 -6.702 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.928 -1.082 -6.424 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.571 -2.303 -10.197 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.291 -2.745 -10.083 1.00 0.00 H new ATOM 0 HE3 MET A 47 3.131 -3.369 -8.887 1.00 0.00 H new ATOM 686 N PRO A 48 8.287 -4.920 -6.213 1.00 0.00 N ATOM 687 CA PRO A 48 9.295 -5.910 -6.595 1.00 0.00 C ATOM 688 C PRO A 48 9.081 -6.454 -8.016 1.00 0.00 C ATOM 689 O PRO A 48 7.947 -6.731 -8.415 1.00 0.00 O ATOM 690 CB PRO A 48 9.213 -7.010 -5.530 1.00 0.00 C ATOM 691 CG PRO A 48 8.717 -6.247 -4.302 1.00 0.00 C ATOM 692 CD PRO A 48 7.729 -5.253 -4.909 1.00 0.00 C ATOM 0 HA PRO A 48 10.289 -5.464 -6.630 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.525 -7.804 -5.819 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.182 -7.477 -5.353 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.237 -6.908 -3.580 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.531 -5.743 -3.781 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.736 -5.691 -5.004 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.627 -4.366 -4.284 1.00 0.00 H new ATOM 700 N LYS A 49 10.169 -6.603 -8.783 1.00 0.00 N ATOM 701 CA LYS A 49 10.154 -7.002 -10.206 1.00 0.00 C ATOM 702 C LYS A 49 10.550 -8.467 -10.414 1.00 0.00 C ATOM 703 O LYS A 49 11.288 -9.050 -9.620 1.00 0.00 O ATOM 704 CB LYS A 49 11.042 -6.063 -11.050 1.00 0.00 C ATOM 705 CG LYS A 49 10.740 -4.556 -10.930 1.00 0.00 C ATOM 706 CD LYS A 49 9.282 -4.181 -11.252 1.00 0.00 C ATOM 707 CE LYS A 49 9.051 -2.661 -11.355 1.00 0.00 C ATOM 708 NZ LYS A 49 9.442 -1.937 -10.118 1.00 0.00 N ATOM 0 H LYS A 49 11.112 -6.446 -8.426 1.00 0.00 H new ATOM 0 HA LYS A 49 9.124 -6.907 -10.548 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.082 -6.228 -10.768 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.947 -6.350 -12.097 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.973 -4.229 -9.917 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.402 -4.009 -11.602 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.993 -4.650 -12.193 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.630 -4.589 -10.479 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.620 -2.267 -12.197 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.998 -2.471 -11.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.848 -1.090 -10.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.311 -2.560 -9.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.441 -1.654 -10.182 1.00 0.00 H new ATOM 722 N ASP A 50 10.049 -9.065 -11.487 1.00 0.00 N ATOM 723 CA ASP A 50 10.346 -10.428 -11.935 1.00 0.00 C ATOM 724 C ASP A 50 11.713 -10.511 -12.650 1.00 0.00 C ATOM 725 O ASP A 50 12.090 -9.601 -13.391 1.00 0.00 O ATOM 726 CB ASP A 50 9.201 -10.878 -12.854 1.00 0.00 C ATOM 727 CG ASP A 50 9.353 -12.348 -13.257 1.00 0.00 C ATOM 728 OD1 ASP A 50 8.748 -13.227 -12.598 1.00 0.00 O ATOM 729 OD2 ASP A 50 10.136 -12.616 -14.196 1.00 0.00 O ATOM 0 H ASP A 50 9.389 -8.591 -12.104 1.00 0.00 H new ATOM 0 HA ASP A 50 10.418 -11.093 -11.074 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.247 -10.735 -12.346 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.183 -10.254 -13.748 1.00 0.00 H new ATOM 734 N ARG A 51 12.455 -11.613 -12.466 1.00 0.00 N ATOM 735 CA ARG A 51 13.816 -11.803 -13.013 1.00 0.00 C ATOM 736 C ARG A 51 13.893 -12.321 -14.463 1.00 0.00 C ATOM 737 O ARG A 51 14.994 -12.565 -14.957 1.00 0.00 O ATOM 738 CB ARG A 51 14.662 -12.635 -12.026 1.00 0.00 C ATOM 739 CG ARG A 51 14.234 -14.109 -11.917 1.00 0.00 C ATOM 740 CD ARG A 51 15.063 -14.839 -10.855 1.00 0.00 C ATOM 741 NE ARG A 51 14.664 -16.256 -10.742 1.00 0.00 N ATOM 742 CZ ARG A 51 15.168 -17.154 -9.912 1.00 0.00 C ATOM 743 NH1 ARG A 51 16.120 -16.864 -9.071 1.00 0.00 N ATOM 744 NH2 ARG A 51 14.720 -18.377 -9.913 1.00 0.00 N ATOM 0 H ARG A 51 12.125 -12.413 -11.925 1.00 0.00 H new ATOM 0 HA ARG A 51 14.246 -10.806 -13.105 1.00 0.00 H new ATOM 0 HB2 ARG A 51 15.706 -12.593 -12.335 1.00 0.00 H new ATOM 0 HB3 ARG A 51 14.603 -12.177 -11.039 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.176 -14.167 -11.662 1.00 0.00 H new ATOM 0 HG3 ARG A 51 14.357 -14.600 -12.882 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.121 -14.776 -11.110 1.00 0.00 H new ATOM 0 HD3 ARG A 51 14.938 -14.346 -9.891 1.00 0.00 H new ATOM 0 HE ARG A 51 13.924 -16.575 -11.368 1.00 0.00 H new ATOM 0 HH11 ARG A 51 16.501 -15.918 -9.038 1.00 0.00 H new ATOM 0 HH12 ARG A 51 16.484 -17.583 -8.446 1.00 0.00 H new ATOM 0 HH21 ARG A 51 13.976 -18.647 -10.556 1.00 0.00 H new ATOM 0 HH22 ARG A 51 15.113 -19.065 -9.270 1.00 0.00 H new ATOM 758 N VAL A 52 12.756 -12.496 -15.147 1.00 0.00 N ATOM 759 CA VAL A 52 12.648 -13.086 -16.498 1.00 0.00 C ATOM 760 C VAL A 52 11.751 -12.235 -17.404 1.00 0.00 C ATOM 761 O VAL A 52 12.088 -12.021 -18.570 1.00 0.00 O ATOM 762 CB VAL A 52 12.101 -14.534 -16.438 1.00 0.00 C ATOM 763 CG1 VAL A 52 12.192 -15.226 -17.805 1.00 0.00 C ATOM 764 CG2 VAL A 52 12.858 -15.415 -15.433 1.00 0.00 C ATOM 0 H VAL A 52 11.850 -12.223 -14.766 1.00 0.00 H new ATOM 0 HA VAL A 52 13.653 -13.109 -16.918 1.00 0.00 H new ATOM 0 HB VAL A 52 11.063 -14.431 -16.123 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.800 -16.240 -17.726 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.608 -14.667 -18.536 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.233 -15.264 -18.125 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.431 -16.418 -15.434 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.909 -15.468 -15.715 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.772 -14.985 -14.435 1.00 0.00 H new ATOM 774 N THR A 53 10.639 -11.707 -16.879 1.00 0.00 N ATOM 775 CA THR A 53 9.677 -10.867 -17.615 1.00 0.00 C ATOM 776 C THR A 53 9.837 -9.383 -17.297 1.00 0.00 C ATOM 777 O THR A 53 9.418 -8.532 -18.083 1.00 0.00 O ATOM 778 CB THR A 53 8.222 -11.288 -17.350 1.00 0.00 C ATOM 779 OG1 THR A 53 7.926 -11.187 -15.976 1.00 0.00 O ATOM 780 CG2 THR A 53 7.944 -12.725 -17.792 1.00 0.00 C ATOM 0 H THR A 53 10.373 -11.854 -15.905 1.00 0.00 H new ATOM 0 HA THR A 53 9.903 -11.021 -18.670 1.00 0.00 H new ATOM 0 HB THR A 53 7.594 -10.614 -17.932 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.997 -11.456 -15.821 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.904 -12.975 -17.584 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.133 -12.820 -18.861 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.597 -13.406 -17.246 1.00 0.00 H new ATOM 788 N GLY A 54 10.460 -9.060 -16.158 1.00 0.00 N ATOM 789 CA GLY A 54 10.833 -7.701 -15.769 1.00 0.00 C ATOM 790 C GLY A 54 9.677 -6.787 -15.322 1.00 0.00 C ATOM 791 O GLY A 54 9.918 -5.646 -14.922 1.00 0.00 O ATOM 0 H GLY A 54 10.725 -9.759 -15.464 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.557 -7.762 -14.956 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.339 -7.229 -16.611 1.00 0.00 H new ATOM 795 N GLN A 55 8.434 -7.281 -15.352 1.00 0.00 N ATOM 796 CA GLN A 55 7.254 -6.628 -14.770 1.00 0.00 C ATOM 797 C GLN A 55 7.143 -6.938 -13.265 1.00 0.00 C ATOM 798 O GLN A 55 7.939 -7.707 -12.728 1.00 0.00 O ATOM 799 CB GLN A 55 5.993 -7.003 -15.577 1.00 0.00 C ATOM 800 CG GLN A 55 5.703 -8.509 -15.656 1.00 0.00 C ATOM 801 CD GLN A 55 4.363 -8.788 -16.334 1.00 0.00 C ATOM 802 OE1 GLN A 55 3.345 -9.028 -15.697 1.00 0.00 O ATOM 803 NE2 GLN A 55 4.298 -8.752 -17.650 1.00 0.00 N ATOM 0 H GLN A 55 8.214 -8.173 -15.795 1.00 0.00 H new ATOM 0 HA GLN A 55 7.358 -5.545 -14.840 1.00 0.00 H new ATOM 0 HB2 GLN A 55 5.132 -6.504 -15.132 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.098 -6.614 -16.590 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.501 -9.005 -16.208 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.699 -8.933 -14.652 1.00 0.00 H new ATOM 0 HE21 GLN A 55 5.136 -8.554 -18.197 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.410 -8.923 -18.122 1.00 0.00 H new ATOM 812 N HIS A 56 6.189 -6.334 -12.553 1.00 0.00 N ATOM 813 CA HIS A 56 6.026 -6.561 -11.107 1.00 0.00 C ATOM 814 C HIS A 56 5.551 -7.985 -10.759 1.00 0.00 C ATOM 815 O HIS A 56 4.942 -8.679 -11.577 1.00 0.00 O ATOM 816 CB HIS A 56 5.130 -5.479 -10.495 1.00 0.00 C ATOM 817 CG HIS A 56 3.697 -5.531 -10.959 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.733 -6.424 -10.486 1.00 0.00 N ATOM 819 CD2 HIS A 56 3.125 -4.707 -11.884 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.604 -6.125 -11.149 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.808 -5.090 -11.978 1.00 0.00 N ATOM 0 H HIS A 56 5.514 -5.682 -12.951 1.00 0.00 H new ATOM 0 HA HIS A 56 7.015 -6.480 -10.656 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.153 -5.575 -9.409 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.544 -4.500 -10.737 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.610 -3.913 -12.432 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.664 -6.644 -11.031 1.00 0.00 H new ATOM 0 HE2 HIS A 56 1.104 -4.659 -12.577 1.00 0.00 H new ATOM 829 N GLN A 57 5.821 -8.422 -9.524 1.00 0.00 N ATOM 830 CA GLN A 57 5.503 -9.768 -9.017 1.00 0.00 C ATOM 831 C GLN A 57 4.031 -9.946 -8.557 1.00 0.00 C ATOM 832 O GLN A 57 3.712 -10.897 -7.841 1.00 0.00 O ATOM 833 CB GLN A 57 6.506 -10.156 -7.911 1.00 0.00 C ATOM 834 CG GLN A 57 7.964 -10.269 -8.396 1.00 0.00 C ATOM 835 CD GLN A 57 8.916 -10.784 -7.310 1.00 0.00 C ATOM 836 OE1 GLN A 57 8.537 -11.442 -6.349 1.00 0.00 O ATOM 837 NE2 GLN A 57 10.204 -10.533 -7.420 1.00 0.00 N ATOM 0 H GLN A 57 6.280 -7.835 -8.827 1.00 0.00 H new ATOM 0 HA GLN A 57 5.606 -10.455 -9.857 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.456 -9.415 -7.114 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.203 -11.110 -7.479 1.00 0.00 H new ATOM 0 HG2 GLN A 57 8.005 -10.939 -9.255 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.305 -9.291 -8.737 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.552 -9.988 -8.209 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.854 -10.884 -6.716 1.00 0.00 H new ATOM 846 N GLY A 58 3.119 -9.041 -8.937 1.00 0.00 N ATOM 847 CA GLY A 58 1.698 -9.065 -8.552 1.00 0.00 C ATOM 848 C GLY A 58 1.371 -8.360 -7.227 1.00 0.00 C ATOM 849 O GLY A 58 0.210 -8.357 -6.808 1.00 0.00 O ATOM 0 H GLY A 58 3.354 -8.250 -9.537 1.00 0.00 H new ATOM 0 HA2 GLY A 58 1.114 -8.601 -9.347 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.373 -10.103 -8.483 1.00 0.00 H new ATOM 853 N TYR A 59 2.361 -7.749 -6.572 1.00 0.00 N ATOM 854 CA TYR A 59 2.195 -6.977 -5.335 1.00 0.00 C ATOM 855 C TYR A 59 3.118 -5.747 -5.273 1.00 0.00 C ATOM 856 O TYR A 59 4.110 -5.647 -6.002 1.00 0.00 O ATOM 857 CB TYR A 59 2.389 -7.889 -4.114 1.00 0.00 C ATOM 858 CG TYR A 59 3.804 -8.397 -3.900 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.657 -7.746 -2.987 1.00 0.00 C ATOM 860 CD2 TYR A 59 4.256 -9.536 -4.594 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.948 -8.252 -2.745 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.558 -10.024 -4.378 1.00 0.00 C ATOM 863 CZ TYR A 59 6.406 -9.390 -3.446 1.00 0.00 C ATOM 864 OH TYR A 59 7.655 -9.883 -3.219 1.00 0.00 O ATOM 0 H TYR A 59 3.328 -7.778 -6.895 1.00 0.00 H new ATOM 0 HA TYR A 59 1.177 -6.588 -5.325 1.00 0.00 H new ATOM 0 HB2 TYR A 59 2.077 -7.345 -3.222 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.724 -8.747 -4.213 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.320 -6.858 -2.473 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.602 -10.036 -5.293 1.00 0.00 H new ATOM 0 HE1 TYR A 59 6.589 -7.770 -2.022 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.909 -10.886 -4.927 1.00 0.00 H new ATOM 0 HH TYR A 59 7.805 -10.669 -3.785 1.00 0.00 H new ATOM 874 N GLY A 60 2.771 -4.803 -4.399 1.00 0.00 N ATOM 875 CA GLY A 60 3.459 -3.531 -4.192 1.00 0.00 C ATOM 876 C GLY A 60 3.310 -2.992 -2.768 1.00 0.00 C ATOM 877 O GLY A 60 2.685 -3.614 -1.907 1.00 0.00 O ATOM 0 H GLY A 60 1.963 -4.911 -3.786 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.518 -3.657 -4.417 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.069 -2.795 -4.895 1.00 0.00 H new ATOM 881 N PHE A 61 3.880 -1.812 -2.533 1.00 0.00 N ATOM 882 CA PHE A 61 3.906 -1.110 -1.252 1.00 0.00 C ATOM 883 C PHE A 61 3.785 0.409 -1.436 1.00 0.00 C ATOM 884 O PHE A 61 4.286 0.966 -2.420 1.00 0.00 O ATOM 885 CB PHE A 61 5.217 -1.403 -0.508 1.00 0.00 C ATOM 886 CG PHE A 61 5.507 -2.856 -0.187 1.00 0.00 C ATOM 887 CD1 PHE A 61 5.093 -3.406 1.041 1.00 0.00 C ATOM 888 CD2 PHE A 61 6.245 -3.645 -1.091 1.00 0.00 C ATOM 889 CE1 PHE A 61 5.426 -4.732 1.370 1.00 0.00 C ATOM 890 CE2 PHE A 61 6.570 -4.973 -0.768 1.00 0.00 C ATOM 891 CZ PHE A 61 6.162 -5.518 0.463 1.00 0.00 C ATOM 0 H PHE A 61 4.361 -1.294 -3.268 1.00 0.00 H new ATOM 0 HA PHE A 61 3.053 -1.468 -0.675 1.00 0.00 H new ATOM 0 HB2 PHE A 61 6.042 -1.015 -1.106 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.210 -0.843 0.427 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.518 -2.808 1.732 1.00 0.00 H new ATOM 0 HD2 PHE A 61 6.562 -3.228 -2.035 1.00 0.00 H new ATOM 0 HE1 PHE A 61 5.117 -5.147 2.318 1.00 0.00 H new ATOM 0 HE2 PHE A 61 7.133 -5.576 -1.465 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.413 -6.538 0.712 1.00 0.00 H new ATOM 901 N VAL A 62 3.186 1.086 -0.451 1.00 0.00 N ATOM 902 CA VAL A 62 3.047 2.554 -0.398 1.00 0.00 C ATOM 903 C VAL A 62 3.425 3.064 0.991 1.00 0.00 C ATOM 904 O VAL A 62 2.912 2.574 1.993 1.00 0.00 O ATOM 905 CB VAL A 62 1.619 3.013 -0.763 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.576 4.531 -0.945 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.097 2.351 -2.042 1.00 0.00 C ATOM 0 H VAL A 62 2.771 0.620 0.356 1.00 0.00 H new ATOM 0 HA VAL A 62 3.725 2.977 -1.139 1.00 0.00 H new ATOM 0 HB VAL A 62 0.978 2.710 0.064 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.562 4.838 -1.202 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.878 5.017 -0.018 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.257 4.821 -1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.089 2.709 -2.252 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.753 2.603 -2.876 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.077 1.269 -1.910 1.00 0.00 H new ATOM 917 N GLU A 63 4.323 4.043 1.065 1.00 0.00 N ATOM 918 CA GLU A 63 4.861 4.589 2.314 1.00 0.00 C ATOM 919 C GLU A 63 4.287 5.977 2.607 1.00 0.00 C ATOM 920 O GLU A 63 4.398 6.889 1.786 1.00 0.00 O ATOM 921 CB GLU A 63 6.388 4.618 2.217 1.00 0.00 C ATOM 922 CG GLU A 63 7.072 4.999 3.536 1.00 0.00 C ATOM 923 CD GLU A 63 8.600 4.801 3.495 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.274 5.129 4.498 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.167 4.329 2.478 1.00 0.00 O ATOM 0 H GLU A 63 4.709 4.493 0.235 1.00 0.00 H new ATOM 0 HA GLU A 63 4.567 3.952 3.148 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.744 3.637 1.901 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.683 5.328 1.444 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.851 6.041 3.767 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.654 4.398 4.344 1.00 0.00 H new ATOM 932 N PHE A 64 3.703 6.149 3.790 1.00 0.00 N ATOM 933 CA PHE A 64 3.103 7.397 4.257 1.00 0.00 C ATOM 934 C PHE A 64 4.003 8.149 5.240 1.00 0.00 C ATOM 935 O PHE A 64 4.896 7.574 5.865 1.00 0.00 O ATOM 936 CB PHE A 64 1.736 7.101 4.881 1.00 0.00 C ATOM 937 CG PHE A 64 0.686 6.748 3.851 1.00 0.00 C ATOM 938 CD1 PHE A 64 -0.066 7.776 3.258 1.00 0.00 C ATOM 939 CD2 PHE A 64 0.492 5.412 3.454 1.00 0.00 C ATOM 940 CE1 PHE A 64 -1.033 7.469 2.289 1.00 0.00 C ATOM 941 CE2 PHE A 64 -0.476 5.105 2.480 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.243 6.136 1.904 1.00 0.00 C ATOM 0 H PHE A 64 3.632 5.396 4.475 1.00 0.00 H new ATOM 0 HA PHE A 64 2.978 8.053 3.395 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.835 6.278 5.589 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.404 7.971 5.448 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.100 8.803 3.548 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.084 4.624 3.896 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.616 8.259 1.839 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.630 4.081 2.175 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.994 5.900 1.165 1.00 0.00 H new ATOM 952 N LEU A 65 3.738 9.450 5.399 1.00 0.00 N ATOM 953 CA LEU A 65 4.466 10.313 6.333 1.00 0.00 C ATOM 954 C LEU A 65 4.317 9.848 7.793 1.00 0.00 C ATOM 955 O LEU A 65 5.275 9.929 8.567 1.00 0.00 O ATOM 956 CB LEU A 65 3.951 11.751 6.155 1.00 0.00 C ATOM 957 CG LEU A 65 4.869 12.814 6.780 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.120 13.037 5.928 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.128 14.148 6.877 1.00 0.00 C ATOM 0 H LEU A 65 3.007 9.936 4.879 1.00 0.00 H new ATOM 0 HA LEU A 65 5.532 10.262 6.109 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.840 11.959 5.091 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.960 11.831 6.601 1.00 0.00 H new ATOM 0 HG LEU A 65 5.159 12.455 7.768 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.749 13.794 6.396 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.676 12.103 5.847 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.828 13.373 4.933 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.784 14.897 7.321 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.830 14.472 5.880 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.242 14.027 7.500 1.00 0.00 H new ATOM 971 N SER A 66 3.138 9.326 8.143 1.00 0.00 N ATOM 972 CA SER A 66 2.799 8.854 9.491 1.00 0.00 C ATOM 973 C SER A 66 1.953 7.588 9.453 1.00 0.00 C ATOM 974 O SER A 66 1.224 7.310 8.500 1.00 0.00 O ATOM 975 CB SER A 66 2.073 9.947 10.292 1.00 0.00 C ATOM 976 OG SER A 66 2.752 11.195 10.250 1.00 0.00 O ATOM 0 H SER A 66 2.371 9.217 7.479 1.00 0.00 H new ATOM 0 HA SER A 66 3.739 8.616 9.989 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.065 10.072 9.898 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.972 9.627 11.329 1.00 0.00 H new ATOM 0 HG SER A 66 2.252 11.857 10.772 1.00 0.00 H new ATOM 982 N GLU A 67 2.038 6.815 10.530 1.00 0.00 N ATOM 983 CA GLU A 67 1.367 5.522 10.674 1.00 0.00 C ATOM 984 C GLU A 67 -0.165 5.631 10.624 1.00 0.00 C ATOM 985 O GLU A 67 -0.826 4.757 10.070 1.00 0.00 O ATOM 986 CB GLU A 67 1.804 4.926 12.012 1.00 0.00 C ATOM 987 CG GLU A 67 3.274 4.484 12.017 1.00 0.00 C ATOM 988 CD GLU A 67 3.745 4.000 13.402 1.00 0.00 C ATOM 989 OE1 GLU A 67 2.999 3.274 14.102 1.00 0.00 O ATOM 990 OE2 GLU A 67 4.891 4.339 13.785 1.00 0.00 O ATOM 0 H GLU A 67 2.588 7.074 11.349 1.00 0.00 H new ATOM 0 HA GLU A 67 1.652 4.886 9.835 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.649 5.663 12.800 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.172 4.070 12.247 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.411 3.683 11.291 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.900 5.316 11.695 1.00 0.00 H new ATOM 997 N GLU A 68 -0.739 6.722 11.138 1.00 0.00 N ATOM 998 CA GLU A 68 -2.188 6.980 11.095 1.00 0.00 C ATOM 999 C GLU A 68 -2.719 7.251 9.674 1.00 0.00 C ATOM 1000 O GLU A 68 -3.882 6.964 9.383 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.539 8.124 12.064 1.00 0.00 C ATOM 1002 CG GLU A 68 -1.899 9.475 11.706 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.191 10.527 12.793 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -3.140 11.332 12.629 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -1.465 10.562 13.817 1.00 0.00 O ATOM 0 H GLU A 68 -0.209 7.460 11.601 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.692 6.069 11.418 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.622 8.244 12.089 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.226 7.842 13.069 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.822 9.353 11.592 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.283 9.821 10.747 1.00 0.00 H new ATOM 1012 N ASP A 69 -1.867 7.738 8.765 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.199 7.914 7.346 1.00 0.00 C ATOM 1014 C ASP A 69 -2.151 6.575 6.589 1.00 0.00 C ATOM 1015 O ASP A 69 -2.986 6.329 5.717 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.254 8.954 6.729 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.516 10.365 7.278 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -0.606 10.940 7.920 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -2.620 10.912 7.044 1.00 0.00 O ATOM 0 H ASP A 69 -0.916 8.025 8.997 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.222 8.280 7.261 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.221 8.672 6.932 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.376 8.958 5.646 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.246 5.665 6.980 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.205 4.300 6.462 1.00 0.00 C ATOM 1026 C ALA A 70 -2.409 3.476 6.956 1.00 0.00 C ATOM 1027 O ALA A 70 -3.071 2.803 6.167 1.00 0.00 O ATOM 1028 CB ALA A 70 0.135 3.673 6.877 1.00 0.00 C ATOM 0 H ALA A 70 -0.520 5.862 7.669 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.277 4.310 5.374 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.190 2.651 6.501 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.955 4.258 6.460 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.212 3.665 7.964 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.753 3.588 8.243 1.00 0.00 N ATOM 1035 CA ASP A 71 -3.896 2.898 8.860 1.00 0.00 C ATOM 1036 C ASP A 71 -5.242 3.276 8.206 1.00 0.00 C ATOM 1037 O ASP A 71 -6.143 2.443 8.088 1.00 0.00 O ATOM 1038 CB ASP A 71 -3.897 3.187 10.369 1.00 0.00 C ATOM 1039 CG ASP A 71 -4.427 1.992 11.173 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -5.620 1.990 11.560 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -3.623 1.064 11.436 1.00 0.00 O ATOM 0 H ASP A 71 -2.236 4.172 8.900 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.782 1.827 8.695 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.885 3.425 10.695 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.512 4.064 10.572 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.353 4.511 7.704 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.515 4.994 6.952 1.00 0.00 C ATOM 1048 C TYR A 72 -6.513 4.543 5.484 1.00 0.00 C ATOM 1049 O TYR A 72 -7.569 4.232 4.937 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.573 6.521 7.040 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.853 7.096 6.460 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -7.826 7.776 5.228 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -9.077 6.912 7.133 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -9.018 8.271 4.662 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -10.272 7.401 6.570 1.00 0.00 C ATOM 1056 CZ TYR A 72 -10.247 8.080 5.333 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.407 8.554 4.799 1.00 0.00 O ATOM 0 H TYR A 72 -4.623 5.216 7.811 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.403 4.554 7.405 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.484 6.824 8.083 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.718 6.943 6.512 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.887 7.919 4.714 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -9.099 6.396 8.081 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -8.992 8.795 3.718 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -11.210 7.256 7.086 1.00 0.00 H new ATOM 0 HH TYR A 72 -12.155 8.333 5.393 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.345 4.435 4.842 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.239 3.942 3.468 1.00 0.00 C ATOM 1069 C ALA A 73 -5.703 2.482 3.366 1.00 0.00 C ATOM 1070 O ALA A 73 -6.419 2.120 2.436 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.795 4.133 3.001 1.00 0.00 C ATOM 0 H ALA A 73 -4.449 4.687 5.260 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.899 4.509 2.811 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.693 3.772 1.978 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.537 5.191 3.040 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.125 3.572 3.652 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.393 1.673 4.382 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.879 0.295 4.536 1.00 0.00 C ATOM 1079 C ILE A 74 -7.411 0.259 4.651 1.00 0.00 C ATOM 1080 O ILE A 74 -8.057 -0.580 4.024 1.00 0.00 O ATOM 1081 CB ILE A 74 -5.202 -0.337 5.773 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.677 -0.412 5.552 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.770 -1.733 6.082 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.888 -0.555 6.847 1.00 0.00 C ATOM 0 H ILE A 74 -4.780 1.965 5.143 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.617 -0.285 3.651 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.412 0.297 6.634 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.452 -1.258 4.902 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.347 0.487 5.031 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.269 -2.144 6.958 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.839 -1.655 6.279 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.605 -2.390 5.228 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.823 -0.602 6.621 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -3.085 0.303 7.490 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -3.191 -1.469 7.359 1.00 0.00 H new ATOM 1096 N LYS A 75 -8.004 1.199 5.401 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.459 1.304 5.589 1.00 0.00 C ATOM 1098 C LYS A 75 -10.204 1.559 4.270 1.00 0.00 C ATOM 1099 O LYS A 75 -11.270 0.975 4.062 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.747 2.380 6.654 1.00 0.00 C ATOM 1101 CG LYS A 75 -11.244 2.526 6.962 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.532 3.513 8.107 1.00 0.00 C ATOM 1103 CE LYS A 75 -10.958 3.109 9.475 1.00 0.00 C ATOM 1104 NZ LYS A 75 -11.600 1.885 10.025 1.00 0.00 N ATOM 0 H LYS A 75 -7.480 1.917 5.901 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.842 0.348 5.945 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.215 2.128 7.571 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.356 3.338 6.311 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.763 2.860 6.063 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.652 1.549 7.221 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.129 4.489 7.835 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.612 3.629 8.203 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -9.885 2.941 9.380 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -11.090 3.932 10.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -11.177 1.656 10.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.620 2.051 10.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.452 1.091 9.370 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.648 2.382 3.373 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.297 2.749 2.103 1.00 0.00 C ATOM 1120 C ILE A 76 -9.901 1.885 0.891 1.00 0.00 C ATOM 1121 O ILE A 76 -10.750 1.662 0.030 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.153 4.260 1.812 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.696 4.731 1.639 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.855 5.076 2.913 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.595 6.146 1.067 1.00 0.00 C ATOM 0 H ILE A 76 -8.734 2.814 3.505 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.353 2.525 2.254 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.635 4.433 0.850 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.191 4.697 2.604 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.171 4.039 0.980 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.749 6.140 2.701 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.913 4.815 2.941 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.401 4.851 3.878 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.546 6.424 0.967 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.074 6.178 0.088 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.094 6.846 1.737 1.00 0.00 H new ATOM 1137 N MET A 77 -8.664 1.375 0.803 1.00 0.00 N ATOM 1138 CA MET A 77 -8.137 0.682 -0.396 1.00 0.00 C ATOM 1139 C MET A 77 -8.222 -0.850 -0.360 1.00 0.00 C ATOM 1140 O MET A 77 -7.847 -1.518 -1.322 1.00 0.00 O ATOM 1141 CB MET A 77 -6.715 1.158 -0.718 1.00 0.00 C ATOM 1142 CG MET A 77 -6.677 2.600 -1.227 1.00 0.00 C ATOM 1143 SD MET A 77 -6.977 2.750 -3.007 1.00 0.00 S ATOM 1144 CE MET A 77 -6.468 4.469 -3.229 1.00 0.00 C ATOM 0 H MET A 77 -7.990 1.429 1.566 1.00 0.00 H new ATOM 0 HA MET A 77 -8.808 0.968 -1.206 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.097 1.076 0.176 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.277 0.500 -1.469 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.424 3.185 -0.691 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.704 3.033 -0.993 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.129 4.954 -3.948 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.524 4.991 -2.274 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.443 4.500 -3.600 1.00 0.00 H new ATOM 1154 N ASP A 78 -8.735 -1.424 0.721 1.00 0.00 N ATOM 1155 CA ASP A 78 -8.895 -2.876 0.859 1.00 0.00 C ATOM 1156 C ASP A 78 -10.194 -3.376 0.204 1.00 0.00 C ATOM 1157 O ASP A 78 -11.242 -2.735 0.300 1.00 0.00 O ATOM 1158 CB ASP A 78 -8.778 -3.305 2.330 1.00 0.00 C ATOM 1159 CG ASP A 78 -8.725 -4.831 2.471 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -9.397 -5.402 3.359 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -8.018 -5.480 1.669 1.00 0.00 O ATOM 0 H ASP A 78 -9.055 -0.897 1.534 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.078 -3.353 0.317 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.880 -2.867 2.767 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.628 -2.917 2.891 1.00 0.00 H new ATOM 1166 N MET A 79 -10.119 -4.523 -0.481 1.00 0.00 N ATOM 1167 CA MET A 79 -11.179 -5.103 -1.326 1.00 0.00 C ATOM 1168 C MET A 79 -11.666 -4.204 -2.486 1.00 0.00 C ATOM 1169 O MET A 79 -12.684 -4.494 -3.119 1.00 0.00 O ATOM 1170 CB MET A 79 -12.319 -5.696 -0.478 1.00 0.00 C ATOM 1171 CG MET A 79 -11.787 -6.579 0.660 1.00 0.00 C ATOM 1172 SD MET A 79 -12.951 -7.807 1.308 1.00 0.00 S ATOM 1173 CE MET A 79 -12.802 -9.046 -0.008 1.00 0.00 C ATOM 0 H MET A 79 -9.280 -5.102 -0.463 1.00 0.00 H new ATOM 0 HA MET A 79 -10.706 -5.932 -1.852 1.00 0.00 H new ATOM 0 HB2 MET A 79 -12.919 -4.888 -0.060 1.00 0.00 H new ATOM 0 HB3 MET A 79 -12.978 -6.285 -1.116 1.00 0.00 H new ATOM 0 HG2 MET A 79 -10.897 -7.100 0.306 1.00 0.00 H new ATOM 0 HG3 MET A 79 -11.474 -5.933 1.480 1.00 0.00 H new ATOM 0 HE1 MET A 79 -13.453 -9.892 0.213 1.00 0.00 H new ATOM 0 HE2 MET A 79 -13.094 -8.603 -0.960 1.00 0.00 H new ATOM 0 HE3 MET A 79 -11.769 -9.389 -0.070 1.00 0.00 H new ATOM 1183 N ILE A 80 -10.928 -3.132 -2.797 1.00 0.00 N ATOM 1184 CA ILE A 80 -11.096 -2.301 -3.998 1.00 0.00 C ATOM 1185 C ILE A 80 -10.656 -3.085 -5.246 1.00 0.00 C ATOM 1186 O ILE A 80 -9.846 -4.007 -5.158 1.00 0.00 O ATOM 1187 CB ILE A 80 -10.357 -0.950 -3.791 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -11.333 0.069 -3.156 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -9.646 -0.391 -5.031 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -10.839 1.522 -3.131 1.00 0.00 C ATOM 0 H ILE A 80 -10.169 -2.806 -2.198 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.145 -2.055 -4.164 1.00 0.00 H new ATOM 0 HB ILE A 80 -9.530 -1.147 -3.109 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.276 0.032 -3.701 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.544 -0.243 -2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.163 0.553 -4.779 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -8.895 -1.104 -5.372 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.375 -0.225 -5.824 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.595 2.155 -2.667 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.914 1.582 -2.558 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.657 1.862 -4.151 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.184 -2.726 -6.420 1.00 0.00 N ATOM 1203 CA LYS A 81 -10.943 -3.415 -7.698 1.00 0.00 C ATOM 1204 C LYS A 81 -10.157 -2.551 -8.694 1.00 0.00 C ATOM 1205 O LYS A 81 -10.702 -2.097 -9.701 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.285 -3.918 -8.250 1.00 0.00 C ATOM 1207 CG LYS A 81 -12.935 -4.977 -7.340 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.153 -5.652 -7.986 1.00 0.00 C ATOM 1209 CE LYS A 81 -13.740 -6.661 -9.067 1.00 0.00 C ATOM 1210 NZ LYS A 81 -14.922 -7.212 -9.783 1.00 0.00 N ATOM 0 H LYS A 81 -11.809 -1.926 -6.514 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.299 -4.277 -7.526 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.966 -3.075 -8.365 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.131 -4.341 -9.243 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.195 -5.737 -7.089 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.239 -4.508 -6.405 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.736 -6.160 -7.218 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.799 -4.892 -8.426 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.074 -6.177 -9.782 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.179 -7.476 -8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.605 -7.890 -10.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.545 -7.695 -9.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.443 -6.437 -10.240 1.00 0.00 H new ATOM 1224 N LEU A 82 -8.865 -2.342 -8.428 1.00 0.00 N ATOM 1225 CA LEU A 82 -7.944 -1.635 -9.334 1.00 0.00 C ATOM 1226 C LEU A 82 -7.895 -2.354 -10.700 1.00 0.00 C ATOM 1227 O LEU A 82 -7.715 -3.571 -10.739 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.561 -1.538 -8.654 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.537 -0.622 -9.348 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.065 0.799 -9.551 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.274 -0.541 -8.488 1.00 0.00 C ATOM 0 H LEU A 82 -8.420 -2.661 -7.568 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.291 -0.621 -9.531 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.703 -1.185 -7.633 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.138 -2.540 -8.588 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.331 -1.053 -10.328 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.303 1.403 -10.044 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.962 0.769 -10.170 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.307 1.239 -8.583 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.544 0.106 -8.974 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.526 -0.133 -7.509 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.851 -1.538 -8.368 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.113 -1.636 -11.812 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.329 -2.241 -13.146 1.00 0.00 C ATOM 1245 C TYR A 83 -9.344 -3.425 -13.210 1.00 0.00 C ATOM 1246 O TYR A 83 -9.221 -4.297 -14.075 1.00 0.00 O ATOM 1247 CB TYR A 83 -6.977 -2.580 -13.804 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.080 -1.385 -14.057 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -4.941 -1.171 -13.259 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -6.375 -0.502 -15.115 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -4.110 -0.062 -13.503 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -5.542 0.605 -15.364 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.412 0.837 -14.549 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.607 1.910 -14.776 1.00 0.00 O ATOM 0 H TYR A 83 -8.146 -0.617 -11.817 1.00 0.00 H new ATOM 0 HA TYR A 83 -8.832 -1.471 -13.731 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.446 -3.288 -13.168 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.166 -3.083 -14.752 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.705 -1.858 -12.460 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.242 -0.675 -15.736 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -3.238 0.102 -12.888 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -5.767 1.277 -16.179 1.00 0.00 H new ATOM 0 HH TYR A 83 -3.956 2.426 -15.532 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.355 -3.488 -12.327 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.387 -4.543 -12.339 1.00 0.00 C ATOM 1266 C GLY A 84 -10.932 -5.905 -11.784 1.00 0.00 C ATOM 1267 O GLY A 84 -11.388 -6.951 -12.251 1.00 0.00 O ATOM 0 H GLY A 84 -10.481 -2.805 -11.580 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.243 -4.199 -11.759 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.731 -4.682 -13.364 1.00 0.00 H new ATOM 1271 N LYS A 85 -10.025 -5.898 -10.798 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.326 -7.039 -10.199 1.00 0.00 C ATOM 1273 C LYS A 85 -9.120 -6.734 -8.702 1.00 0.00 C ATOM 1274 O LYS A 85 -8.512 -5.709 -8.387 1.00 0.00 O ATOM 1275 CB LYS A 85 -7.983 -7.200 -10.933 1.00 0.00 C ATOM 1276 CG LYS A 85 -7.229 -8.487 -10.567 1.00 0.00 C ATOM 1277 CD LYS A 85 -5.867 -8.470 -11.272 1.00 0.00 C ATOM 1278 CE LYS A 85 -5.154 -9.822 -11.206 1.00 0.00 C ATOM 1279 NZ LYS A 85 -3.843 -9.747 -11.897 1.00 0.00 N ATOM 0 H LYS A 85 -9.739 -5.020 -10.364 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.890 -7.967 -10.290 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -8.163 -7.188 -12.008 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.350 -6.342 -10.706 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.096 -8.554 -9.487 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.803 -9.362 -10.872 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -6.006 -8.187 -12.315 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.235 -7.708 -10.816 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -5.008 -10.114 -10.166 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.773 -10.590 -11.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -3.478 -10.708 -12.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -3.960 -9.267 -12.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -3.171 -9.214 -11.309 1.00 0.00 H new ATOM 1293 N PRO A 86 -9.668 -7.534 -7.773 1.00 0.00 N ATOM 1294 CA PRO A 86 -9.703 -7.185 -6.354 1.00 0.00 C ATOM 1295 C PRO A 86 -8.311 -7.223 -5.704 1.00 0.00 C ATOM 1296 O PRO A 86 -7.636 -8.256 -5.710 1.00 0.00 O ATOM 1297 CB PRO A 86 -10.710 -8.146 -5.714 1.00 0.00 C ATOM 1298 CG PRO A 86 -10.716 -9.351 -6.653 1.00 0.00 C ATOM 1299 CD PRO A 86 -10.459 -8.725 -8.022 1.00 0.00 C ATOM 0 HA PRO A 86 -10.019 -6.153 -6.203 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -10.408 -8.427 -4.705 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -11.699 -7.695 -5.637 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -9.943 -10.072 -6.388 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -11.669 -9.880 -6.624 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.927 -9.418 -8.674 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.396 -8.475 -8.519 1.00 0.00 H new ATOM 1307 N ILE A 87 -7.908 -6.095 -5.112 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.678 -5.941 -4.323 1.00 0.00 C ATOM 1309 C ILE A 87 -6.952 -6.105 -2.822 1.00 0.00 C ATOM 1310 O ILE A 87 -8.012 -5.714 -2.324 1.00 0.00 O ATOM 1311 CB ILE A 87 -5.939 -4.613 -4.623 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.809 -3.349 -4.438 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.355 -4.657 -6.045 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -5.997 -2.060 -4.261 1.00 0.00 C ATOM 0 H ILE A 87 -8.448 -5.231 -5.170 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.008 -6.744 -4.631 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.141 -4.531 -3.885 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.463 -3.240 -5.303 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.451 -3.485 -3.568 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.836 -3.722 -6.254 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.653 -5.487 -6.125 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.162 -4.793 -6.766 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.676 -1.216 -4.137 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.362 -2.148 -3.379 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.375 -1.898 -5.141 1.00 0.00 H new ATOM 1326 N ARG A 88 -5.980 -6.658 -2.090 1.00 0.00 N ATOM 1327 CA ARG A 88 -5.976 -6.720 -0.617 1.00 0.00 C ATOM 1328 C ARG A 88 -4.892 -5.816 -0.040 1.00 0.00 C ATOM 1329 O ARG A 88 -3.780 -5.779 -0.570 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.834 -8.165 -0.109 1.00 0.00 C ATOM 1331 CG ARG A 88 -6.961 -9.127 -0.532 1.00 0.00 C ATOM 1332 CD ARG A 88 -8.392 -8.625 -0.271 1.00 0.00 C ATOM 1333 NE ARG A 88 -8.602 -8.150 1.111 1.00 0.00 N ATOM 1334 CZ ARG A 88 -9.059 -8.822 2.150 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -9.281 -10.106 2.112 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -9.309 -8.194 3.259 1.00 0.00 N ATOM 0 H ARG A 88 -5.154 -7.085 -2.510 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.941 -6.353 -0.267 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.885 -8.566 -0.464 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.785 -8.146 0.980 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -6.856 -9.336 -1.597 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -6.825 -10.072 -0.007 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -8.617 -7.815 -0.964 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -9.096 -9.430 -0.482 1.00 0.00 H new ATOM 0 HE ARG A 88 -8.362 -7.174 1.285 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -9.101 -10.630 1.255 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -9.635 -10.587 2.939 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -9.152 -7.188 3.322 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -9.663 -8.707 4.067 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.216 -5.090 1.032 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.351 -4.060 1.632 1.00 0.00 C ATOM 1352 C VAL A 89 -4.244 -4.244 3.150 1.00 0.00 C ATOM 1353 O VAL A 89 -5.246 -4.495 3.821 1.00 0.00 O ATOM 1354 CB VAL A 89 -4.831 -2.641 1.255 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -3.870 -1.546 1.726 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -4.949 -2.475 -0.264 1.00 0.00 C ATOM 0 H VAL A 89 -6.104 -5.200 1.521 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.348 -4.180 1.222 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.797 -2.534 1.748 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.258 -0.570 1.433 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.774 -1.588 2.811 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.892 -1.699 1.269 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.289 -1.465 -0.494 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -3.976 -2.644 -0.725 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.666 -3.197 -0.654 1.00 0.00 H new ATOM 1366 N ASN A 90 -3.029 -4.117 3.693 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.711 -4.220 5.128 1.00 0.00 C ATOM 1368 C ASN A 90 -1.412 -3.468 5.474 1.00 0.00 C ATOM 1369 O ASN A 90 -0.683 -3.040 4.578 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.641 -5.711 5.537 1.00 0.00 C ATOM 1371 CG ASN A 90 -1.691 -6.559 4.703 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -2.101 -7.277 3.804 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -0.403 -6.532 4.965 1.00 0.00 N ATOM 0 H ASN A 90 -2.203 -3.932 3.124 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.505 -3.741 5.701 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.338 -5.772 6.582 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -3.641 -6.139 5.470 1.00 0.00 H new ATOM 0 HD21 ASN A 90 0.240 -7.106 4.420 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -0.047 -5.937 5.713 1.00 0.00 H new ATOM 1380 N LYS A 91 -1.086 -3.329 6.768 1.00 0.00 N ATOM 1381 CA LYS A 91 0.213 -2.794 7.229 1.00 0.00 C ATOM 1382 C LYS A 91 1.339 -3.684 6.692 1.00 0.00 C ATOM 1383 O LYS A 91 1.200 -4.908 6.714 1.00 0.00 O ATOM 1384 CB LYS A 91 0.280 -2.743 8.775 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.876 -2.027 9.500 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.840 -0.491 9.410 1.00 0.00 C ATOM 1387 CE LYS A 91 -0.143 0.183 10.599 1.00 0.00 C ATOM 1388 NZ LYS A 91 -0.988 0.147 11.823 1.00 0.00 N ATOM 0 H LYS A 91 -1.715 -3.584 7.530 1.00 0.00 H new ATOM 0 HA LYS A 91 0.325 -1.777 6.853 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.331 -3.767 9.146 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.212 -2.254 9.058 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.820 -2.379 9.085 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.862 -2.316 10.551 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.330 -0.202 8.491 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.861 -0.116 9.340 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.805 -0.317 10.796 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.089 1.218 10.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.548 0.726 12.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.932 0.524 11.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -1.076 -0.834 12.156 1.00 0.00 H new ATOM 1402 N ALA A 92 2.469 -3.121 6.267 1.00 0.00 N ATOM 1403 CA ALA A 92 3.619 -3.899 5.782 1.00 0.00 C ATOM 1404 C ALA A 92 4.357 -4.672 6.905 1.00 0.00 C ATOM 1405 O ALA A 92 5.291 -5.430 6.639 1.00 0.00 O ATOM 1406 CB ALA A 92 4.547 -2.960 5.003 1.00 0.00 C ATOM 0 H ALA A 92 2.618 -2.112 6.247 1.00 0.00 H new ATOM 0 HA ALA A 92 3.254 -4.682 5.117 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.407 -3.520 4.635 1.00 0.00 H new ATOM 0 HB2 ALA A 92 4.006 -2.531 4.160 1.00 0.00 H new ATOM 0 HB3 ALA A 92 4.889 -2.160 5.659 1.00 0.00 H new ATOM 1412 N SER A 93 3.939 -4.487 8.161 1.00 0.00 N ATOM 1413 CA SER A 93 4.335 -5.254 9.350 1.00 0.00 C ATOM 1414 C SER A 93 3.438 -6.476 9.626 1.00 0.00 C ATOM 1415 O SER A 93 3.839 -7.378 10.363 1.00 0.00 O ATOM 1416 CB SER A 93 4.296 -4.305 10.556 1.00 0.00 C ATOM 1417 OG SER A 93 3.026 -3.676 10.631 1.00 0.00 O ATOM 0 H SER A 93 3.272 -3.750 8.391 1.00 0.00 H new ATOM 0 HA SER A 93 5.335 -5.650 9.173 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.492 -4.860 11.474 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.080 -3.553 10.464 1.00 0.00 H new ATOM 0 HG SER A 93 3.034 -3.008 11.348 1.00 0.00 H new ATOM 1423 N ALA A 94 2.239 -6.547 9.028 1.00 0.00 N ATOM 1424 CA ALA A 94 1.210 -7.548 9.349 1.00 0.00 C ATOM 1425 C ALA A 94 1.535 -8.980 8.870 1.00 0.00 C ATOM 1426 O ALA A 94 0.859 -9.933 9.265 1.00 0.00 O ATOM 1427 CB ALA A 94 -0.131 -7.068 8.780 1.00 0.00 C ATOM 0 H ALA A 94 1.952 -5.899 8.295 1.00 0.00 H new ATOM 0 HA ALA A 94 1.167 -7.628 10.435 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.906 -7.799 9.009 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -0.393 -6.109 9.227 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.048 -6.954 7.699 1.00 0.00 H new ATOM 1433 N HIS A 95 2.572 -9.150 8.041 1.00 0.00 N ATOM 1434 CA HIS A 95 3.071 -10.462 7.598 1.00 0.00 C ATOM 1435 C HIS A 95 3.809 -11.239 8.708 1.00 0.00 C ATOM 1436 O HIS A 95 4.012 -12.448 8.579 1.00 0.00 O ATOM 1437 CB HIS A 95 3.996 -10.264 6.388 1.00 0.00 C ATOM 1438 CG HIS A 95 3.402 -9.469 5.246 1.00 0.00 C ATOM 1439 ND1 HIS A 95 3.986 -8.334 4.675 1.00 0.00 N ATOM 1440 CD2 HIS A 95 2.257 -9.764 4.562 1.00 0.00 C ATOM 1441 CE1 HIS A 95 3.189 -7.982 3.653 1.00 0.00 C ATOM 1442 NE2 HIS A 95 2.142 -8.821 3.561 1.00 0.00 N ATOM 0 H HIS A 95 3.098 -8.368 7.651 1.00 0.00 H new ATOM 0 HA HIS A 95 2.205 -11.065 7.326 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.905 -9.764 6.724 1.00 0.00 H new ATOM 0 HB3 HIS A 95 4.291 -11.244 6.013 1.00 0.00 H new ATOM 0 HD2 HIS A 95 1.575 -10.576 4.765 1.00 0.00 H new ATOM 0 HE1 HIS A 95 3.364 -7.142 2.997 1.00 0.00 H new ATOM 0 HE2 HIS A 95 1.393 -8.769 2.871 1.00 0.00 H new ATOM 1450 N ASN A 96 4.216 -10.565 9.792 1.00 0.00 N ATOM 1451 CA ASN A 96 4.925 -11.159 10.930 1.00 0.00 C ATOM 1452 C ASN A 96 3.962 -11.852 11.926 1.00 0.00 C ATOM 1453 O ASN A 96 2.808 -11.438 12.075 1.00 0.00 O ATOM 1454 CB ASN A 96 5.775 -10.051 11.588 1.00 0.00 C ATOM 1455 CG ASN A 96 6.841 -10.555 12.551 1.00 0.00 C ATOM 1456 OD1 ASN A 96 7.123 -11.739 12.669 1.00 0.00 O ATOM 1457 ND2 ASN A 96 7.486 -9.662 13.266 1.00 0.00 N ATOM 0 H ASN A 96 4.056 -9.564 9.903 1.00 0.00 H new ATOM 0 HA ASN A 96 5.581 -11.958 10.583 1.00 0.00 H new ATOM 0 HB2 ASN A 96 6.259 -9.469 10.804 1.00 0.00 H new ATOM 0 HB3 ASN A 96 5.111 -9.373 12.124 1.00 0.00 H new ATOM 0 HD21 ASN A 96 8.216 -9.958 13.914 1.00 0.00 H new ATOM 0 HD22 ASN A 96 7.257 -8.672 13.173 1.00 0.00 H new ATOM 1464 N LYS A 97 4.474 -12.864 12.646 1.00 0.00 N ATOM 1465 CA LYS A 97 3.786 -13.717 13.644 1.00 0.00 C ATOM 1466 C LYS A 97 2.596 -14.539 13.104 1.00 0.00 C ATOM 1467 O LYS A 97 2.114 -14.340 11.987 1.00 0.00 O ATOM 1468 CB LYS A 97 3.414 -12.897 14.903 1.00 0.00 C ATOM 1469 CG LYS A 97 4.558 -12.082 15.534 1.00 0.00 C ATOM 1470 CD LYS A 97 5.755 -12.941 15.969 1.00 0.00 C ATOM 1471 CE LYS A 97 6.790 -12.069 16.690 1.00 0.00 C ATOM 1472 NZ LYS A 97 7.967 -12.865 17.127 1.00 0.00 N ATOM 0 H LYS A 97 5.453 -13.132 12.542 1.00 0.00 H new ATOM 0 HA LYS A 97 4.514 -14.479 13.923 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.607 -12.213 14.642 1.00 0.00 H new ATOM 0 HB3 LYS A 97 3.022 -13.581 15.656 1.00 0.00 H new ATOM 0 HG2 LYS A 97 4.899 -11.334 14.818 1.00 0.00 H new ATOM 0 HG3 LYS A 97 4.174 -11.542 16.400 1.00 0.00 H new ATOM 0 HD2 LYS A 97 5.419 -13.741 16.628 1.00 0.00 H new ATOM 0 HD3 LYS A 97 6.209 -13.415 15.099 1.00 0.00 H new ATOM 0 HE2 LYS A 97 7.117 -11.268 16.027 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.328 -11.596 17.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 8.646 -12.243 17.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 7.657 -13.613 17.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 8.422 -13.296 16.297 1.00 0.00 H new ATOM 1486 N ASN A 98 2.145 -15.504 13.910 1.00 0.00 N ATOM 1487 CA ASN A 98 0.996 -16.382 13.651 1.00 0.00 C ATOM 1488 C ASN A 98 0.313 -16.791 14.978 1.00 0.00 C ATOM 1489 O ASN A 98 0.922 -16.700 16.049 1.00 0.00 O ATOM 1490 CB ASN A 98 1.491 -17.610 12.852 1.00 0.00 C ATOM 1491 CG ASN A 98 0.378 -18.450 12.237 1.00 0.00 C ATOM 1492 OD1 ASN A 98 -0.777 -18.055 12.148 1.00 0.00 O ATOM 1493 ND2 ASN A 98 0.695 -19.636 11.771 1.00 0.00 N ATOM 0 H ASN A 98 2.591 -15.706 14.805 1.00 0.00 H new ATOM 0 HA ASN A 98 0.244 -15.857 13.062 1.00 0.00 H new ATOM 0 HB2 ASN A 98 2.153 -17.268 12.057 1.00 0.00 H new ATOM 0 HB3 ASN A 98 2.085 -18.242 13.512 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -0.019 -20.222 11.338 1.00 0.00 H new ATOM 0 HD22 ASN A 98 1.656 -19.972 11.842 1.00 0.00 H new ATOM 1500 N LEU A 99 -0.938 -17.258 14.918 1.00 0.00 N ATOM 1501 CA LEU A 99 -1.686 -17.778 16.070 1.00 0.00 C ATOM 1502 C LEU A 99 -1.259 -19.221 16.407 1.00 0.00 C ATOM 1503 O LEU A 99 -1.253 -20.090 15.530 1.00 0.00 O ATOM 1504 CB LEU A 99 -3.195 -17.670 15.767 1.00 0.00 C ATOM 1505 CG LEU A 99 -4.124 -18.179 16.889 1.00 0.00 C ATOM 1506 CD1 LEU A 99 -3.994 -17.363 18.177 1.00 0.00 C ATOM 1507 CD2 LEU A 99 -5.579 -18.104 16.428 1.00 0.00 C ATOM 0 H LEU A 99 -1.471 -17.286 14.049 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.463 -17.183 16.956 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.435 -16.627 15.562 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.408 -18.231 14.857 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.826 -19.206 17.100 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.670 -17.765 18.932 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -2.968 -17.419 18.541 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.251 -16.323 17.976 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -6.232 -18.464 17.223 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.833 -17.071 16.191 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -5.712 -18.723 15.541 1.00 0.00 H new ATOM 1519 N SER A 100 -0.959 -19.479 17.685 1.00 0.00 N ATOM 1520 CA SER A 100 -0.515 -20.793 18.200 1.00 0.00 C ATOM 1521 C SER A 100 -1.381 -21.352 19.347 1.00 0.00 C ATOM 1522 O SER A 100 -1.104 -22.442 19.853 1.00 0.00 O ATOM 1523 CB SER A 100 0.956 -20.717 18.640 1.00 0.00 C ATOM 1524 OG SER A 100 1.793 -20.311 17.565 1.00 0.00 O ATOM 0 H SER A 100 -1.018 -18.767 18.413 1.00 0.00 H new ATOM 0 HA SER A 100 -0.631 -21.492 17.371 1.00 0.00 H new ATOM 0 HB2 SER A 100 1.055 -20.014 19.467 1.00 0.00 H new ATOM 0 HB3 SER A 100 1.279 -21.691 19.008 1.00 0.00 H new ATOM 0 HG SER A 100 2.723 -20.269 17.872 1.00 0.00 H new ATOM 1530 N GLY A 101 -2.427 -20.631 19.773 1.00 0.00 N ATOM 1531 CA GLY A 101 -3.339 -21.058 20.845 1.00 0.00 C ATOM 1532 C GLY A 101 -4.311 -22.177 20.420 1.00 0.00 C ATOM 1533 O GLY A 101 -4.643 -22.282 19.232 1.00 0.00 O ATOM 0 H GLY A 101 -2.667 -19.722 19.378 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -2.751 -21.403 21.695 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -3.915 -20.197 21.185 1.00 0.00 H new ATOM 1537 N PRO A 102 -4.789 -23.016 21.362 1.00 0.00 N ATOM 1538 CA PRO A 102 -5.722 -24.109 21.078 1.00 0.00 C ATOM 1539 C PRO A 102 -7.144 -23.608 20.766 1.00 0.00 C ATOM 1540 O PRO A 102 -7.587 -22.572 21.273 1.00 0.00 O ATOM 1541 CB PRO A 102 -5.690 -24.996 22.327 1.00 0.00 C ATOM 1542 CG PRO A 102 -5.397 -24.002 23.449 1.00 0.00 C ATOM 1543 CD PRO A 102 -4.456 -22.999 22.782 1.00 0.00 C ATOM 0 HA PRO A 102 -5.427 -24.656 20.183 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -6.639 -25.510 22.481 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -4.919 -25.764 22.257 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -6.306 -23.523 23.812 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -4.929 -24.487 24.306 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -4.588 -22.002 23.202 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -3.414 -23.276 22.941 1.00 0.00 H new ATOM 1551 N SER A 103 -7.883 -24.370 19.955 1.00 0.00 N ATOM 1552 CA SER A 103 -9.271 -24.073 19.554 1.00 0.00 C ATOM 1553 C SER A 103 -10.338 -24.612 20.523 1.00 0.00 C ATOM 1554 O SER A 103 -11.480 -24.145 20.504 1.00 0.00 O ATOM 1555 CB SER A 103 -9.519 -24.622 18.144 1.00 0.00 C ATOM 1556 OG SER A 103 -9.261 -26.019 18.097 1.00 0.00 O ATOM 0 H SER A 103 -7.528 -25.234 19.546 1.00 0.00 H new ATOM 0 HA SER A 103 -9.373 -22.988 19.575 1.00 0.00 H new ATOM 0 HB2 SER A 103 -10.550 -24.427 17.849 1.00 0.00 H new ATOM 0 HB3 SER A 103 -8.879 -24.105 17.429 1.00 0.00 H new ATOM 0 HG SER A 103 -9.426 -26.352 17.190 1.00 0.00 H new ATOM 1562 N SER A 104 -9.983 -25.579 21.378 1.00 0.00 N ATOM 1563 CA SER A 104 -10.862 -26.214 22.372 1.00 0.00 C ATOM 1564 C SER A 104 -10.065 -26.750 23.575 1.00 0.00 C ATOM 1565 O SER A 104 -8.841 -26.916 23.497 1.00 0.00 O ATOM 1566 CB SER A 104 -11.652 -27.349 21.704 1.00 0.00 C ATOM 1567 OG SER A 104 -12.712 -27.785 22.541 1.00 0.00 O ATOM 0 H SER A 104 -9.036 -25.957 21.398 1.00 0.00 H new ATOM 0 HA SER A 104 -11.553 -25.460 22.750 1.00 0.00 H new ATOM 0 HB2 SER A 104 -12.053 -27.007 20.750 1.00 0.00 H new ATOM 0 HB3 SER A 104 -10.986 -28.184 21.488 1.00 0.00 H new ATOM 0 HG SER A 104 -13.204 -28.507 22.097 1.00 0.00 H new ATOM 1573 N GLY A 105 -10.748 -27.023 24.693 1.00 0.00 N ATOM 1574 CA GLY A 105 -10.169 -27.523 25.952 1.00 0.00 C ATOM 1575 C GLY A 105 -11.231 -27.898 26.986 1.00 0.00 C ATOM 1576 O GLY A 105 -11.387 -29.106 27.267 1.00 0.00 O ATOM 1577 OXT GLY A 105 -11.905 -26.980 27.504 1.00 0.00 O ATOM 0 H GLY A 105 -11.759 -26.898 24.751 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.551 -28.395 25.741 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -9.513 -26.761 26.372 1.00 0.00 H new TER 1581 GLY A 105