USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 881 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 114 THR OG1 : rot 71:sc= 0.289 USER MOD Set 1.2: A 135 ASN : amide:sc= 0.354 X(o=0.64,f=0.26) USER MOD Set 2.1: A 70 THR OG1 : rot 180:sc= 0.402 USER MOD Set 2.2: A 72 SER OG : rot -77:sc= 0.934 USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0148 USER MOD Single : A 7 ASN : amide:sc= 0.395 K(o=0.39,f=-2.9!) USER MOD Single : A 13 SER OG : rot 180:sc= 0.0855 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 HIS :FLIP no HE2:sc= -0.308 F(o=-0.86,f=-0.31) USER MOD Single : A 66 SER OG : rot -32:sc= 0.367 USER MOD Single : A 81 SER OG : rot -36:sc= 0.53 USER MOD Single : A 82 GLN : amide:sc= 0.467 X(o=0.47,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 166:sc= 1.2 (180deg=1.03) USER MOD Single : A 88 SER OG : rot 180:sc= 0.133 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -95:sc= 1.13 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 157:sc= 0.575 (180deg=0.263) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot -168:sc= 1.19 USER MOD Single : A 136 HIS : no HE2:sc= 0.382 K(o=0.38,f=-1.3) USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.0375 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -0.044 X(o=-0.044,f=-0.15) USER MOD ----------------------------------------------------------------- ATOM 13 N GLN A 2 -11.787 14.646 3.846 1.00 25.00 N ATOM 14 CA GLN A 2 -10.514 14.704 3.099 1.00 25.00 C ATOM 15 C GLN A 2 -9.434 15.453 3.897 1.00 25.00 C ATOM 16 O GLN A 2 -9.737 16.216 4.810 1.00 25.00 O ATOM 17 CB GLN A 2 -10.714 15.272 1.670 1.00 25.00 C ATOM 18 CG GLN A 2 -10.120 16.670 1.410 1.00 25.00 C ATOM 19 CD GLN A 2 -10.497 17.228 0.056 1.00 25.00 C ATOM 20 OE1 GLN A 2 -11.438 16.784 -0.574 1.00 25.00 O ATOM 21 NE2 GLN A 2 -9.759 18.208 -0.393 1.00 25.00 N ATOM 0 HA GLN A 2 -10.153 13.684 2.970 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -10.274 14.574 0.958 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -11.783 15.309 1.461 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -10.461 17.354 2.187 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -9.034 16.617 1.486 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -8.978 18.554 0.164 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -9.964 18.627 -1.300 1.00 25.00 H new ATOM 30 N GLY A 3 -8.176 15.161 3.605 1.00 25.00 N ATOM 31 CA GLY A 3 -7.078 15.774 4.328 1.00 25.00 C ATOM 32 C GLY A 3 -6.511 16.990 3.627 1.00 25.00 C ATOM 33 O GLY A 3 -6.737 17.198 2.437 1.00 25.00 O ATOM 0 H GLY A 3 -7.893 14.506 2.876 1.00 25.00 H new ATOM 0 HA2 GLY A 3 -7.421 16.062 5.322 1.00 25.00 H new ATOM 0 HA3 GLY A 3 -6.285 15.038 4.465 1.00 25.00 H new ATOM 37 N THR A 4 -5.722 17.758 4.357 1.00 25.00 N ATOM 38 CA THR A 4 -4.986 18.891 3.801 1.00 25.00 C ATOM 39 C THR A 4 -3.571 18.350 3.553 1.00 25.00 C ATOM 40 O THR A 4 -3.323 17.160 3.748 1.00 25.00 O ATOM 41 CB THR A 4 -5.016 20.109 4.784 1.00 25.00 C ATOM 42 OG1 THR A 4 -4.237 21.189 4.261 1.00 25.00 O ATOM 43 CG2 THR A 4 -4.486 19.742 6.170 1.00 25.00 C ATOM 0 H THR A 4 -5.570 17.617 5.356 1.00 25.00 H new ATOM 0 HA THR A 4 -5.421 19.273 2.877 1.00 25.00 H new ATOM 0 HB THR A 4 -6.059 20.410 4.883 1.00 25.00 H new ATOM 0 HG1 THR A 4 -4.265 21.945 4.884 1.00 25.00 H new ATOM 0 HG21 THR A 4 -4.526 20.617 6.818 1.00 25.00 H new ATOM 0 HG22 THR A 4 -5.099 18.947 6.595 1.00 25.00 H new ATOM 0 HG23 THR A 4 -3.455 19.399 6.086 1.00 25.00 H new ATOM 51 N ASP A 5 -2.632 19.184 3.137 1.00 25.00 N ATOM 52 CA ASP A 5 -1.270 18.704 2.866 1.00 25.00 C ATOM 53 C ASP A 5 -0.406 18.659 4.123 1.00 25.00 C ATOM 54 O ASP A 5 0.738 18.225 4.109 1.00 25.00 O ATOM 55 CB ASP A 5 -0.621 19.529 1.758 1.00 25.00 C ATOM 56 CG ASP A 5 -1.050 19.066 0.369 1.00 25.00 C ATOM 57 OD1 ASP A 5 -1.549 17.914 0.247 1.00 25.00 O ATOM 58 OD2 ASP A 5 -0.853 19.816 -0.600 1.00 25.00 O ATOM 0 H ASP A 5 -2.775 20.182 2.979 1.00 25.00 H new ATOM 0 HA ASP A 5 -1.349 17.674 2.519 1.00 25.00 H new ATOM 0 HB2 ASP A 5 -0.885 20.579 1.887 1.00 25.00 H new ATOM 0 HB3 ASP A 5 0.463 19.460 1.843 1.00 25.00 H new ATOM 63 N GLY A 6 -1.035 19.001 5.234 1.00 25.00 N ATOM 64 CA GLY A 6 -0.435 18.816 6.548 1.00 25.00 C ATOM 65 C GLY A 6 -0.699 17.394 7.016 1.00 25.00 C ATOM 66 O GLY A 6 -1.223 16.591 6.250 1.00 25.00 O ATOM 0 H GLY A 6 -1.968 19.412 5.254 1.00 25.00 H new ATOM 0 HA2 GLY A 6 0.638 19.004 6.502 1.00 25.00 H new ATOM 0 HA3 GLY A 6 -0.854 19.530 7.257 1.00 25.00 H new ATOM 70 N ASN A 7 -0.371 17.070 8.257 1.00 25.00 N ATOM 71 CA ASN A 7 -0.637 15.725 8.784 1.00 25.00 C ATOM 72 C ASN A 7 -2.090 15.675 9.273 1.00 25.00 C ATOM 73 O ASN A 7 -2.527 16.569 9.992 1.00 25.00 O ATOM 74 CB ASN A 7 0.306 15.394 9.951 1.00 25.00 C ATOM 75 CG ASN A 7 1.742 15.168 9.506 1.00 25.00 C ATOM 76 OD1 ASN A 7 2.102 15.363 8.353 1.00 25.00 O ATOM 77 ND2 ASN A 7 2.573 14.771 10.429 1.00 25.00 N ATOM 0 H ASN A 7 0.075 17.706 8.918 1.00 25.00 H new ATOM 0 HA ASN A 7 -0.470 14.992 7.994 1.00 25.00 H new ATOM 0 HB2 ASN A 7 0.279 16.208 10.675 1.00 25.00 H new ATOM 0 HB3 ASN A 7 -0.056 14.501 10.462 1.00 25.00 H new ATOM 0 HD21 ASN A 7 3.554 14.614 10.199 1.00 25.00 H new ATOM 0 HD22 ASN A 7 2.242 14.617 11.381 1.00 25.00 H new ATOM 84 N ASP A 8 -2.829 14.649 8.872 1.00 25.00 N ATOM 85 CA ASP A 8 -4.253 14.517 9.222 1.00 25.00 C ATOM 86 C ASP A 8 -4.566 13.163 9.841 1.00 25.00 C ATOM 87 O ASP A 8 -3.884 12.167 9.572 1.00 25.00 O ATOM 88 CB ASP A 8 -5.135 14.619 7.969 1.00 25.00 C ATOM 89 CG ASP A 8 -5.012 15.945 7.271 1.00 25.00 C ATOM 90 OD1 ASP A 8 -5.701 16.907 7.643 1.00 50.00 O ATOM 91 OD2 ASP A 8 -4.297 15.989 6.251 1.00 50.00 O ATOM 0 H ASP A 8 -2.470 13.886 8.299 1.00 25.00 H new ATOM 0 HA ASP A 8 -4.458 15.320 9.930 1.00 25.00 H new ATOM 0 HB2 ASP A 8 -4.865 13.823 7.275 1.00 25.00 H new ATOM 0 HB3 ASP A 8 -6.176 14.457 8.250 1.00 25.00 H new ATOM 96 N VAL A 9 -5.669 13.105 10.570 1.00 25.00 N ATOM 97 CA VAL A 9 -6.244 11.840 11.023 1.00 25.00 C ATOM 98 C VAL A 9 -7.670 11.853 10.500 1.00 25.00 C ATOM 99 O VAL A 9 -8.455 12.734 10.849 1.00 25.00 O ATOM 100 CB VAL A 9 -6.227 11.693 12.571 1.00 25.00 C ATOM 101 CG1 VAL A 9 -6.898 10.371 13.009 1.00 25.00 C ATOM 102 CG2 VAL A 9 -4.778 11.731 13.088 1.00 25.00 C ATOM 0 H VAL A 9 -6.193 13.929 10.866 1.00 25.00 H new ATOM 0 HA VAL A 9 -5.664 10.994 10.653 1.00 25.00 H new ATOM 0 HB VAL A 9 -6.788 12.525 12.996 1.00 25.00 H new ATOM 0 HG11 VAL A 9 -6.873 10.293 14.096 1.00 25.00 H new ATOM 0 HG12 VAL A 9 -7.933 10.358 12.668 1.00 25.00 H new ATOM 0 HG13 VAL A 9 -6.362 9.529 12.572 1.00 25.00 H new ATOM 0 HG21 VAL A 9 -4.776 11.627 14.173 1.00 25.00 H new ATOM 0 HG22 VAL A 9 -4.212 10.912 12.644 1.00 25.00 H new ATOM 0 HG23 VAL A 9 -4.318 12.680 12.813 1.00 25.00 H new ATOM 112 N LEU A 10 -7.980 10.923 9.611 1.00 25.00 N ATOM 113 CA LEU A 10 -9.291 10.854 8.969 1.00 25.00 C ATOM 114 C LEU A 10 -9.934 9.526 9.339 1.00 25.00 C ATOM 115 O LEU A 10 -9.262 8.504 9.343 1.00 25.00 O ATOM 116 CB LEU A 10 -9.135 10.955 7.445 1.00 25.00 C ATOM 117 CG LEU A 10 -8.440 12.227 6.926 1.00 25.00 C ATOM 118 CD1 LEU A 10 -8.162 12.093 5.437 1.00 25.00 C ATOM 119 CD2 LEU A 10 -9.288 13.484 7.182 1.00 25.00 C ATOM 0 H LEU A 10 -7.333 10.193 9.312 1.00 25.00 H new ATOM 0 HA LEU A 10 -9.917 11.680 9.306 1.00 25.00 H new ATOM 0 HB2 LEU A 10 -8.572 10.089 7.098 1.00 25.00 H new ATOM 0 HB3 LEU A 10 -10.125 10.894 6.992 1.00 25.00 H new ATOM 0 HG LEU A 10 -7.502 12.338 7.470 1.00 25.00 H new ATOM 0 HD11 LEU A 10 -7.670 12.996 5.076 1.00 25.00 H new ATOM 0 HD12 LEU A 10 -7.515 11.233 5.264 1.00 25.00 H new ATOM 0 HD13 LEU A 10 -9.102 11.953 4.903 1.00 25.00 H new ATOM 0 HD21 LEU A 10 -8.763 14.360 6.802 1.00 25.00 H new ATOM 0 HD22 LEU A 10 -10.247 13.386 6.673 1.00 25.00 H new ATOM 0 HD23 LEU A 10 -9.456 13.598 8.253 1.00 25.00 H new ATOM 131 N ILE A 11 -11.214 9.548 9.687 1.00 25.00 N ATOM 132 CA ILE A 11 -11.929 8.337 10.112 1.00 25.00 C ATOM 133 C ILE A 11 -13.267 8.288 9.377 1.00 25.00 C ATOM 134 O ILE A 11 -13.990 9.288 9.343 1.00 25.00 O ATOM 135 CB ILE A 11 -12.188 8.337 11.662 1.00 25.00 C ATOM 136 CG1 ILE A 11 -10.853 8.481 12.431 1.00 25.00 C ATOM 137 CG2 ILE A 11 -12.912 7.030 12.102 1.00 25.00 C ATOM 138 CD1 ILE A 11 -11.014 8.719 13.941 1.00 25.00 C ATOM 0 H ILE A 11 -11.786 10.392 9.685 1.00 25.00 H new ATOM 0 HA ILE A 11 -11.319 7.465 9.875 1.00 25.00 H new ATOM 0 HB ILE A 11 -12.829 9.187 11.898 1.00 25.00 H new ATOM 0 HG12 ILE A 11 -10.261 7.579 12.279 1.00 25.00 H new ATOM 0 HG13 ILE A 11 -10.288 9.309 12.003 1.00 25.00 H new ATOM 0 HG21 ILE A 11 -13.081 7.052 13.179 1.00 25.00 H new ATOM 0 HG22 ILE A 11 -13.869 6.953 11.586 1.00 25.00 H new ATOM 0 HG23 ILE A 11 -12.293 6.169 11.850 1.00 25.00 H new ATOM 0 HD11 ILE A 11 -10.030 8.808 14.402 1.00 25.00 H new ATOM 0 HD12 ILE A 11 -11.577 9.637 14.107 1.00 25.00 H new ATOM 0 HD13 ILE A 11 -11.549 7.880 14.387 1.00 25.00 H new ATOM 150 N GLY A 12 -13.571 7.156 8.757 1.00 25.00 N ATOM 151 CA GLY A 12 -14.806 7.014 8.005 1.00 25.00 C ATOM 152 C GLY A 12 -15.961 6.452 8.809 1.00 25.00 C ATOM 153 O GLY A 12 -15.796 5.984 9.932 1.00 25.00 O ATOM 0 H GLY A 12 -12.979 6.325 8.761 1.00 25.00 H new ATOM 0 HA2 GLY A 12 -15.093 7.989 7.611 1.00 25.00 H new ATOM 0 HA3 GLY A 12 -14.624 6.365 7.148 1.00 25.00 H new ATOM 157 N SER A 13 -17.137 6.496 8.211 1.00 25.00 N ATOM 158 CA SER A 13 -18.366 5.981 8.811 1.00 25.00 C ATOM 159 C SER A 13 -18.666 4.589 8.256 1.00 25.00 C ATOM 160 O SER A 13 -17.885 4.033 7.483 1.00 25.00 O ATOM 161 CB SER A 13 -19.520 6.946 8.494 1.00 25.00 C ATOM 162 OG SER A 13 -20.666 6.677 9.286 1.00 25.00 O ATOM 0 H SER A 13 -17.273 6.895 7.282 1.00 25.00 H new ATOM 0 HA SER A 13 -18.249 5.905 9.892 1.00 25.00 H new ATOM 0 HB2 SER A 13 -19.193 7.972 8.665 1.00 25.00 H new ATOM 0 HB3 SER A 13 -19.781 6.866 7.439 1.00 25.00 H new ATOM 0 HG SER A 13 -21.378 7.311 9.058 1.00 25.00 H new ATOM 168 N ASP A 14 -19.801 4.023 8.634 1.00 25.00 N ATOM 169 CA ASP A 14 -20.184 2.672 8.208 1.00 25.00 C ATOM 170 C ASP A 14 -20.531 2.585 6.728 1.00 25.00 C ATOM 171 O ASP A 14 -20.425 1.527 6.114 1.00 25.00 O ATOM 172 CB ASP A 14 -21.383 2.205 9.024 1.00 25.00 C ATOM 173 CG ASP A 14 -21.060 2.058 10.486 1.00 25.00 C ATOM 174 OD1 ASP A 14 -20.114 1.312 10.815 1.00 25.00 O ATOM 175 OD2 ASP A 14 -21.719 2.723 11.304 1.00 25.00 O ATOM 0 H ASP A 14 -20.484 4.477 9.241 1.00 25.00 H new ATOM 0 HA ASP A 14 -19.318 2.032 8.376 1.00 25.00 H new ATOM 0 HB2 ASP A 14 -22.200 2.917 8.905 1.00 25.00 H new ATOM 0 HB3 ASP A 14 -21.734 1.249 8.634 1.00 25.00 H new ATOM 180 N VAL A 15 -20.962 3.699 6.156 1.00 25.00 N ATOM 181 CA VAL A 15 -21.330 3.754 4.738 1.00 25.00 C ATOM 182 C VAL A 15 -20.070 3.691 3.863 1.00 25.00 C ATOM 183 O VAL A 15 -18.956 3.899 4.353 1.00 25.00 O ATOM 184 CB VAL A 15 -22.140 5.045 4.415 1.00 25.00 C ATOM 185 CG1 VAL A 15 -23.461 5.041 5.198 1.00 25.00 C ATOM 186 CG2 VAL A 15 -21.338 6.315 4.754 1.00 25.00 C ATOM 0 H VAL A 15 -21.068 4.585 6.650 1.00 25.00 H new ATOM 0 HA VAL A 15 -21.963 2.894 4.520 1.00 25.00 H new ATOM 0 HB VAL A 15 -22.346 5.052 3.345 1.00 25.00 H new ATOM 0 HG11 VAL A 15 -24.023 5.946 4.968 1.00 25.00 H new ATOM 0 HG12 VAL A 15 -24.049 4.167 4.916 1.00 25.00 H new ATOM 0 HG13 VAL A 15 -23.250 5.006 6.267 1.00 25.00 H new ATOM 0 HG21 VAL A 15 -21.934 7.196 4.516 1.00 25.00 H new ATOM 0 HG22 VAL A 15 -21.094 6.318 5.816 1.00 25.00 H new ATOM 0 HG23 VAL A 15 -20.418 6.331 4.170 1.00 25.00 H new ATOM 196 N GLY A 16 -20.239 3.402 2.580 1.00 25.00 N ATOM 197 CA GLY A 16 -19.103 3.380 1.671 1.00 25.00 C ATOM 198 C GLY A 16 -18.634 4.790 1.371 1.00 25.00 C ATOM 199 O GLY A 16 -19.462 5.685 1.202 1.00 25.00 O ATOM 0 H GLY A 16 -21.138 3.183 2.150 1.00 25.00 H new ATOM 0 HA2 GLY A 16 -18.288 2.806 2.112 1.00 25.00 H new ATOM 0 HA3 GLY A 16 -19.381 2.878 0.744 1.00 25.00 H new ATOM 203 N GLU A 17 -17.325 5.009 1.372 1.00 25.00 N ATOM 204 CA GLU A 17 -16.756 6.354 1.233 1.00 25.00 C ATOM 205 C GLU A 17 -15.500 6.374 0.366 1.00 25.00 C ATOM 206 O GLU A 17 -14.860 5.351 0.144 1.00 25.00 O ATOM 207 CB GLU A 17 -16.365 6.889 2.618 1.00 25.00 C ATOM 208 CG GLU A 17 -17.534 7.139 3.559 1.00 25.00 C ATOM 209 CD GLU A 17 -17.127 7.010 4.999 1.00 25.00 C ATOM 210 OE1 GLU A 17 -16.666 5.912 5.387 1.00 50.00 O ATOM 211 OE2 GLU A 17 -17.313 7.966 5.773 1.00 50.00 O ATOM 0 H GLU A 17 -16.629 4.270 1.468 1.00 25.00 H new ATOM 0 HA GLU A 17 -17.520 6.969 0.758 1.00 25.00 H new ATOM 0 HB2 GLU A 17 -15.684 6.179 3.087 1.00 25.00 H new ATOM 0 HB3 GLU A 17 -15.814 7.821 2.490 1.00 25.00 H new ATOM 0 HG2 GLU A 17 -17.936 8.137 3.383 1.00 25.00 H new ATOM 0 HG3 GLU A 17 -18.333 6.430 3.342 1.00 25.00 H new ATOM 218 N GLN A 18 -15.120 7.574 -0.055 1.00 25.00 N ATOM 219 CA GLN A 18 -13.870 7.807 -0.767 1.00 25.00 C ATOM 220 C GLN A 18 -13.097 8.820 0.077 1.00 25.00 C ATOM 221 O GLN A 18 -13.599 9.917 0.341 1.00 25.00 O ATOM 222 CB GLN A 18 -14.163 8.351 -2.170 1.00 25.00 C ATOM 223 CG GLN A 18 -12.927 8.610 -3.011 1.00 25.00 C ATOM 224 CD GLN A 18 -13.280 9.215 -4.351 1.00 25.00 C ATOM 225 OE1 GLN A 18 -13.612 8.520 -5.294 1.00 25.00 O ATOM 226 NE2 GLN A 18 -13.229 10.520 -4.432 1.00 25.00 N ATOM 0 H GLN A 18 -15.674 8.418 0.089 1.00 25.00 H new ATOM 0 HA GLN A 18 -13.291 6.893 -0.901 1.00 25.00 H new ATOM 0 HB2 GLN A 18 -14.803 7.642 -2.695 1.00 25.00 H new ATOM 0 HB3 GLN A 18 -14.725 9.280 -2.076 1.00 25.00 H new ATOM 0 HG2 GLN A 18 -12.256 9.280 -2.474 1.00 25.00 H new ATOM 0 HG3 GLN A 18 -12.388 7.675 -3.164 1.00 25.00 H new ATOM 0 HE21 GLN A 18 -12.946 11.071 -3.621 1.00 25.00 H new ATOM 0 HE22 GLN A 18 -13.472 10.987 -5.306 1.00 25.00 H new ATOM 235 N ILE A 19 -11.927 8.430 0.568 1.00 25.00 N ATOM 236 CA ILE A 19 -11.166 9.250 1.515 1.00 25.00 C ATOM 237 C ILE A 19 -9.742 9.445 1.003 1.00 25.00 C ATOM 238 O ILE A 19 -9.030 8.483 0.750 1.00 25.00 O ATOM 239 CB ILE A 19 -11.113 8.565 2.929 1.00 25.00 C ATOM 240 CG1 ILE A 19 -12.541 8.220 3.419 1.00 25.00 C ATOM 241 CG2 ILE A 19 -10.412 9.494 3.956 1.00 25.00 C ATOM 242 CD1 ILE A 19 -12.594 7.402 4.719 1.00 25.00 C ATOM 0 H ILE A 19 -11.479 7.546 0.327 1.00 25.00 H new ATOM 0 HA ILE A 19 -11.664 10.215 1.606 1.00 25.00 H new ATOM 0 HB ILE A 19 -10.540 7.642 2.840 1.00 25.00 H new ATOM 0 HG12 ILE A 19 -13.094 9.148 3.567 1.00 25.00 H new ATOM 0 HG13 ILE A 19 -13.055 7.664 2.635 1.00 25.00 H new ATOM 0 HG21 ILE A 19 -10.384 9.004 4.929 1.00 25.00 H new ATOM 0 HG22 ILE A 19 -9.395 9.701 3.624 1.00 25.00 H new ATOM 0 HG23 ILE A 19 -10.965 10.430 4.036 1.00 25.00 H new ATOM 0 HD11 ILE A 19 -13.633 7.208 4.985 1.00 25.00 H new ATOM 0 HD12 ILE A 19 -12.074 6.455 4.575 1.00 25.00 H new ATOM 0 HD13 ILE A 19 -12.113 7.962 5.521 1.00 25.00 H new ATOM 254 N SER A 20 -9.322 10.691 0.859 1.00 25.00 N ATOM 255 CA SER A 20 -7.971 11.005 0.395 1.00 25.00 C ATOM 256 C SER A 20 -7.212 11.784 1.468 1.00 25.00 C ATOM 257 O SER A 20 -7.758 12.688 2.101 1.00 25.00 O ATOM 258 CB SER A 20 -8.047 11.805 -0.907 1.00 25.00 C ATOM 259 OG SER A 20 -8.823 12.979 -0.722 1.00 25.00 O ATOM 0 H SER A 20 -9.898 11.510 1.057 1.00 25.00 H new ATOM 0 HA SER A 20 -7.431 10.078 0.204 1.00 25.00 H new ATOM 0 HB2 SER A 20 -7.043 12.073 -1.236 1.00 25.00 H new ATOM 0 HB3 SER A 20 -8.486 11.191 -1.693 1.00 25.00 H new ATOM 0 HG SER A 20 -8.861 13.482 -1.562 1.00 25.00 H new ATOM 265 N GLY A 21 -5.961 11.407 1.694 1.00 25.00 N ATOM 266 CA GLY A 21 -5.163 12.020 2.750 1.00 25.00 C ATOM 267 C GLY A 21 -4.337 13.220 2.327 1.00 25.00 C ATOM 268 O GLY A 21 -3.986 14.052 3.167 1.00 25.00 O ATOM 0 H GLY A 21 -5.477 10.683 1.163 1.00 25.00 H new ATOM 0 HA2 GLY A 21 -5.830 12.325 3.556 1.00 25.00 H new ATOM 0 HA3 GLY A 21 -4.492 11.265 3.160 1.00 25.00 H new ATOM 272 N GLY A 22 -3.996 13.315 1.048 1.00 25.00 N ATOM 273 CA GLY A 22 -3.146 14.405 0.575 1.00 25.00 C ATOM 274 C GLY A 22 -1.698 14.204 0.998 1.00 25.00 C ATOM 275 O GLY A 22 -1.308 13.088 1.384 1.00 25.00 O ATOM 0 H GLY A 22 -4.290 12.659 0.325 1.00 25.00 H new ATOM 0 HA2 GLY A 22 -3.204 14.468 -0.512 1.00 25.00 H new ATOM 0 HA3 GLY A 22 -3.514 15.352 0.969 1.00 25.00 H new ATOM 279 N ALA A 23 -0.888 15.253 0.953 1.00 25.00 N ATOM 280 CA ALA A 23 0.508 15.156 1.387 1.00 25.00 C ATOM 281 C ALA A 23 0.563 15.044 2.913 1.00 25.00 C ATOM 282 O ALA A 23 -0.473 15.021 3.581 1.00 25.00 O ATOM 283 CB ALA A 23 1.313 16.374 0.900 1.00 25.00 C ATOM 0 H ALA A 23 -1.166 16.177 0.623 1.00 25.00 H new ATOM 0 HA ALA A 23 0.956 14.264 0.950 1.00 25.00 H new ATOM 0 HB1 ALA A 23 2.347 16.283 1.232 1.00 25.00 H new ATOM 0 HB2 ALA A 23 1.284 16.417 -0.189 1.00 25.00 H new ATOM 0 HB3 ALA A 23 0.878 17.285 1.311 1.00 25.00 H new ATOM 289 N GLY A 24 1.765 14.935 3.454 1.00 25.00 N ATOM 290 CA GLY A 24 1.940 14.793 4.890 1.00 25.00 C ATOM 291 C GLY A 24 1.759 13.359 5.346 1.00 25.00 C ATOM 292 O GLY A 24 1.251 12.515 4.596 1.00 25.00 O ATOM 0 H GLY A 24 2.634 14.942 2.920 1.00 25.00 H new ATOM 0 HA2 GLY A 24 2.935 15.139 5.170 1.00 25.00 H new ATOM 0 HA3 GLY A 24 1.223 15.431 5.407 1.00 25.00 H new ATOM 296 N ASP A 25 2.182 13.080 6.567 1.00 25.00 N ATOM 297 CA ASP A 25 2.071 11.737 7.148 1.00 25.00 C ATOM 298 C ASP A 25 0.696 11.638 7.793 1.00 25.00 C ATOM 299 O ASP A 25 0.399 12.354 8.752 1.00 25.00 O ATOM 300 CB ASP A 25 3.155 11.507 8.205 1.00 25.00 C ATOM 301 CG ASP A 25 4.546 11.312 7.605 1.00 25.00 C ATOM 302 OD1 ASP A 25 4.691 11.263 6.356 1.00 25.00 O ATOM 303 OD2 ASP A 25 5.502 11.151 8.401 1.00 25.00 O ATOM 0 H ASP A 25 2.611 13.768 7.187 1.00 25.00 H new ATOM 0 HA ASP A 25 2.200 10.982 6.373 1.00 25.00 H new ATOM 0 HB2 ASP A 25 3.176 12.358 8.886 1.00 25.00 H new ATOM 0 HB3 ASP A 25 2.895 10.630 8.798 1.00 25.00 H new ATOM 308 N ASP A 26 -0.167 10.807 7.229 1.00 25.00 N ATOM 309 CA ASP A 26 -1.569 10.759 7.651 1.00 25.00 C ATOM 310 C ASP A 26 -1.992 9.410 8.214 1.00 25.00 C ATOM 311 O ASP A 26 -1.344 8.380 7.984 1.00 25.00 O ATOM 312 CB ASP A 26 -2.470 11.056 6.448 1.00 25.00 C ATOM 313 CG ASP A 26 -2.126 12.355 5.773 1.00 25.00 C ATOM 314 OD1 ASP A 26 -2.103 13.400 6.441 1.00 50.00 O ATOM 315 OD2 ASP A 26 -1.939 12.370 4.534 1.00 50.00 O ATOM 0 H ASP A 26 0.072 10.157 6.480 1.00 25.00 H new ATOM 0 HA ASP A 26 -1.671 11.502 8.442 1.00 25.00 H new ATOM 0 HB2 ASP A 26 -2.386 10.243 5.727 1.00 25.00 H new ATOM 0 HB3 ASP A 26 -3.509 11.085 6.776 1.00 25.00 H new ATOM 320 N ARG A 27 -3.147 9.397 8.856 1.00 25.00 N ATOM 321 CA ARG A 27 -3.802 8.154 9.240 1.00 25.00 C ATOM 322 C ARG A 27 -5.172 8.229 8.610 1.00 25.00 C ATOM 323 O ARG A 27 -5.862 9.224 8.775 1.00 25.00 O ATOM 324 CB ARG A 27 -3.931 8.017 10.760 1.00 25.00 C ATOM 325 CG ARG A 27 -4.417 6.628 11.193 1.00 25.00 C ATOM 326 CD ARG A 27 -5.038 6.636 12.581 1.00 25.00 C ATOM 327 NE ARG A 27 -4.112 7.128 13.616 1.00 25.00 N ATOM 328 CZ ARG A 27 -4.362 7.135 14.923 1.00 25.00 C ATOM 329 NH1 ARG A 27 -5.482 6.668 15.420 1.00 25.00 N ATOM 330 NH2 ARG A 27 -3.468 7.614 15.743 1.00 25.00 N ATOM 0 H ARG A 27 -3.656 10.239 9.125 1.00 25.00 H new ATOM 0 HA ARG A 27 -3.226 7.290 8.909 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -2.964 8.219 11.222 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -4.625 8.771 11.131 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -5.149 6.262 10.473 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -3.578 5.932 11.177 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -5.931 7.261 12.571 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -5.359 5.626 12.837 1.00 25.00 H new ATOM 0 HE ARG A 27 -3.210 7.491 13.307 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -6.194 6.284 14.799 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -5.641 6.689 16.427 1.00 25.00 H new ATOM 0 HH21 ARG A 27 -2.587 7.979 15.381 1.00 25.00 H new ATOM 0 HH22 ARG A 27 -3.650 7.624 16.747 1.00 25.00 H new ATOM 344 N LEU A 28 -5.553 7.197 7.888 1.00 25.00 N ATOM 345 CA LEU A 28 -6.868 7.126 7.279 1.00 25.00 C ATOM 346 C LEU A 28 -7.489 5.869 7.840 1.00 25.00 C ATOM 347 O LEU A 28 -6.811 4.857 7.984 1.00 25.00 O ATOM 348 CB LEU A 28 -6.792 7.019 5.749 1.00 25.00 C ATOM 349 CG LEU A 28 -6.374 8.254 4.931 1.00 25.00 C ATOM 350 CD1 LEU A 28 -4.865 8.514 4.972 1.00 25.00 C ATOM 351 CD2 LEU A 28 -6.805 8.056 3.477 1.00 25.00 C ATOM 0 H LEU A 28 -4.963 6.385 7.706 1.00 25.00 H new ATOM 0 HA LEU A 28 -7.443 8.026 7.495 1.00 25.00 H new ATOM 0 HB2 LEU A 28 -6.095 6.216 5.510 1.00 25.00 H new ATOM 0 HB3 LEU A 28 -7.773 6.706 5.393 1.00 25.00 H new ATOM 0 HG LEU A 28 -6.864 9.119 5.377 1.00 25.00 H new ATOM 0 HD11 LEU A 28 -4.632 9.397 4.377 1.00 25.00 H new ATOM 0 HD12 LEU A 28 -4.552 8.678 6.003 1.00 25.00 H new ATOM 0 HD13 LEU A 28 -4.336 7.652 4.565 1.00 25.00 H new ATOM 0 HD21 LEU A 28 -6.513 8.926 2.889 1.00 25.00 H new ATOM 0 HD22 LEU A 28 -6.322 7.166 3.072 1.00 25.00 H new ATOM 0 HD23 LEU A 28 -7.887 7.934 3.432 1.00 25.00 H new ATOM 363 N ASP A 29 -8.767 5.936 8.133 1.00 25.00 N ATOM 364 CA ASP A 29 -9.530 4.780 8.560 1.00 25.00 C ATOM 365 C ASP A 29 -10.804 4.848 7.749 1.00 25.00 C ATOM 366 O ASP A 29 -11.375 5.916 7.591 1.00 25.00 O ATOM 367 CB ASP A 29 -9.815 4.835 10.063 1.00 25.00 C ATOM 368 CG ASP A 29 -10.589 3.619 10.559 1.00 25.00 C ATOM 369 OD1 ASP A 29 -10.805 2.657 9.778 1.00 25.00 O ATOM 370 OD2 ASP A 29 -10.988 3.633 11.739 1.00 25.00 O ATOM 0 H ASP A 29 -9.312 6.797 8.082 1.00 25.00 H new ATOM 0 HA ASP A 29 -8.995 3.844 8.399 1.00 25.00 H new ATOM 0 HB2 ASP A 29 -8.872 4.907 10.605 1.00 25.00 H new ATOM 0 HB3 ASP A 29 -10.382 5.738 10.289 1.00 25.00 H new ATOM 375 N GLY A 30 -11.201 3.724 7.181 1.00 25.00 N ATOM 376 CA GLY A 30 -12.388 3.653 6.356 1.00 25.00 C ATOM 377 C GLY A 30 -13.589 3.189 7.147 1.00 25.00 C ATOM 378 O GLY A 30 -14.732 3.399 6.735 1.00 25.00 O ATOM 0 H GLY A 30 -10.708 2.836 7.280 1.00 25.00 H new ATOM 0 HA2 GLY A 30 -12.592 4.634 5.926 1.00 25.00 H new ATOM 0 HA3 GLY A 30 -12.213 2.970 5.525 1.00 25.00 H new ATOM 382 N GLY A 31 -13.349 2.526 8.269 1.00 25.00 N ATOM 383 CA GLY A 31 -14.440 1.961 9.043 1.00 25.00 C ATOM 384 C GLY A 31 -15.122 0.833 8.283 1.00 25.00 C ATOM 385 O GLY A 31 -14.525 0.216 7.384 1.00 25.00 O ATOM 0 H GLY A 31 -12.420 2.368 8.659 1.00 25.00 H new ATOM 0 HA2 GLY A 31 -14.060 1.586 9.993 1.00 25.00 H new ATOM 0 HA3 GLY A 31 -15.167 2.739 9.275 1.00 25.00 H new ATOM 389 N ALA A 32 -16.377 0.555 8.614 1.00 25.00 N ATOM 390 CA ALA A 32 -17.135 -0.483 7.919 1.00 25.00 C ATOM 391 C ALA A 32 -17.526 0.002 6.512 1.00 25.00 C ATOM 392 O ALA A 32 -17.277 1.162 6.140 1.00 25.00 O ATOM 393 CB ALA A 32 -18.380 -0.859 8.736 1.00 25.00 C ATOM 0 H ALA A 32 -16.891 1.030 9.356 1.00 25.00 H new ATOM 0 HA ALA A 32 -16.513 -1.372 7.813 1.00 25.00 H new ATOM 0 HB1 ALA A 32 -18.940 -1.633 8.211 1.00 25.00 H new ATOM 0 HB2 ALA A 32 -18.075 -1.232 9.714 1.00 25.00 H new ATOM 0 HB3 ALA A 32 -19.011 0.021 8.864 1.00 25.00 H new ATOM 399 N GLY A 33 -18.104 -0.898 5.731 1.00 25.00 N ATOM 400 CA GLY A 33 -18.495 -0.579 4.367 1.00 25.00 C ATOM 401 C GLY A 33 -17.328 -0.677 3.414 1.00 25.00 C ATOM 402 O GLY A 33 -16.176 -0.779 3.845 1.00 25.00 O ATOM 0 H GLY A 33 -18.312 -1.854 6.018 1.00 25.00 H new ATOM 0 HA2 GLY A 33 -19.285 -1.259 4.046 1.00 25.00 H new ATOM 0 HA3 GLY A 33 -18.909 0.429 4.333 1.00 25.00 H new ATOM 406 N ASP A 34 -17.615 -0.665 2.127 1.00 0.00 N ATOM 407 CA ASP A 34 -16.576 -0.780 1.101 1.00 25.00 C ATOM 408 C ASP A 34 -16.030 0.622 0.853 1.00 25.00 C ATOM 409 O ASP A 34 -16.804 1.559 0.702 1.00 25.00 O ATOM 410 CB ASP A 34 -17.185 -1.358 -0.181 1.00 25.00 C ATOM 411 CG ASP A 34 -17.706 -2.784 0.006 1.00 25.00 C ATOM 412 OD1 ASP A 34 -17.378 -3.433 1.032 1.00 25.00 O ATOM 413 OD2 ASP A 34 -18.496 -3.240 -0.849 1.00 25.00 O ATOM 0 H ASP A 34 -18.562 -0.577 1.757 1.00 0.00 H new ATOM 0 HA ASP A 34 -15.774 -1.445 1.421 1.00 25.00 H new ATOM 0 HB2 ASP A 34 -18.002 -0.717 -0.512 1.00 25.00 H new ATOM 0 HB3 ASP A 34 -16.434 -1.350 -0.971 1.00 25.00 H new ATOM 418 N ASP A 35 -14.716 0.801 0.913 1.00 25.00 N ATOM 419 CA ASP A 35 -14.128 2.143 0.872 1.00 25.00 C ATOM 420 C ASP A 35 -12.962 2.281 -0.103 1.00 25.00 C ATOM 421 O ASP A 35 -12.234 1.324 -0.367 1.00 25.00 O ATOM 422 CB ASP A 35 -13.634 2.530 2.266 1.00 25.00 C ATOM 423 CG ASP A 35 -14.741 2.538 3.301 1.00 25.00 C ATOM 424 OD1 ASP A 35 -15.690 3.339 3.186 1.00 50.00 O ATOM 425 OD2 ASP A 35 -14.636 1.786 4.302 1.00 50.00 O ATOM 0 H ASP A 35 -14.038 0.043 0.990 1.00 25.00 H new ATOM 0 HA ASP A 35 -14.921 2.805 0.524 1.00 25.00 H new ATOM 0 HB2 ASP A 35 -12.857 1.832 2.578 1.00 25.00 H new ATOM 0 HB3 ASP A 35 -13.176 3.518 2.223 1.00 25.00 H new ATOM 430 N LEU A 36 -12.765 3.502 -0.585 1.00 25.00 N ATOM 431 CA LEU A 36 -11.645 3.844 -1.463 1.00 25.00 C ATOM 432 C LEU A 36 -10.724 4.760 -0.668 1.00 25.00 C ATOM 433 O LEU A 36 -11.172 5.803 -0.182 1.00 25.00 O ATOM 434 CB LEU A 36 -12.136 4.602 -2.712 1.00 25.00 C ATOM 435 CG LEU A 36 -12.792 3.832 -3.875 1.00 25.00 C ATOM 436 CD1 LEU A 36 -14.091 3.122 -3.491 1.00 25.00 C ATOM 437 CD2 LEU A 36 -13.074 4.828 -5.005 1.00 25.00 C ATOM 0 H LEU A 36 -13.379 4.290 -0.378 1.00 25.00 H new ATOM 0 HA LEU A 36 -11.139 2.936 -1.792 1.00 25.00 H new ATOM 0 HB2 LEU A 36 -12.852 5.351 -2.375 1.00 25.00 H new ATOM 0 HB3 LEU A 36 -11.281 5.140 -3.121 1.00 25.00 H new ATOM 0 HG LEU A 36 -12.098 3.049 -4.181 1.00 25.00 H new ATOM 0 HD11 LEU A 36 -14.493 2.603 -4.361 1.00 25.00 H new ATOM 0 HD12 LEU A 36 -13.891 2.401 -2.698 1.00 25.00 H new ATOM 0 HD13 LEU A 36 -14.816 3.856 -3.139 1.00 25.00 H new ATOM 0 HD21 LEU A 36 -13.539 4.307 -5.842 1.00 25.00 H new ATOM 0 HD22 LEU A 36 -13.746 5.607 -4.644 1.00 25.00 H new ATOM 0 HD23 LEU A 36 -12.138 5.280 -5.334 1.00 25.00 H new ATOM 449 N LEU A 37 -9.463 4.381 -0.504 1.00 25.00 N ATOM 450 CA LEU A 37 -8.518 5.173 0.291 1.00 25.00 C ATOM 451 C LEU A 37 -7.268 5.554 -0.510 1.00 25.00 C ATOM 452 O LEU A 37 -6.548 4.691 -1.005 1.00 25.00 O ATOM 453 CB LEU A 37 -8.099 4.385 1.543 1.00 25.00 C ATOM 454 CG LEU A 37 -8.859 4.657 2.857 1.00 25.00 C ATOM 455 CD1 LEU A 37 -10.324 4.222 2.811 1.00 25.00 C ATOM 456 CD2 LEU A 37 -8.160 3.924 4.011 1.00 25.00 C ATOM 0 H LEU A 37 -9.066 3.533 -0.908 1.00 25.00 H new ATOM 0 HA LEU A 37 -9.026 6.094 0.578 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -8.193 3.323 1.316 1.00 25.00 H new ATOM 0 HB3 LEU A 37 -7.042 4.580 1.722 1.00 25.00 H new ATOM 0 HG LEU A 37 -8.847 5.737 3.007 1.00 25.00 H new ATOM 0 HD11 LEU A 37 -10.799 4.442 3.767 1.00 25.00 H new ATOM 0 HD12 LEU A 37 -10.839 4.762 2.017 1.00 25.00 H new ATOM 0 HD13 LEU A 37 -10.380 3.151 2.616 1.00 25.00 H new ATOM 0 HD21 LEU A 37 -8.696 4.115 4.941 1.00 25.00 H new ATOM 0 HD22 LEU A 37 -8.152 2.853 3.810 1.00 25.00 H new ATOM 0 HD23 LEU A 37 -7.135 4.283 4.102 1.00 25.00 H new ATOM 468 N ASP A 38 -6.988 6.850 -0.579 1.00 25.00 N ATOM 469 CA ASP A 38 -5.805 7.374 -1.282 1.00 25.00 C ATOM 470 C ASP A 38 -4.829 7.992 -0.277 1.00 25.00 C ATOM 471 O ASP A 38 -5.170 8.939 0.442 1.00 25.00 O ATOM 472 CB ASP A 38 -6.208 8.448 -2.302 1.00 25.00 C ATOM 473 CG ASP A 38 -6.688 7.862 -3.619 1.00 25.00 C ATOM 474 OD1 ASP A 38 -7.800 7.302 -3.664 1.00 25.00 O ATOM 475 OD2 ASP A 38 -5.962 8.004 -4.627 1.00 25.00 O ATOM 0 H ASP A 38 -7.568 7.573 -0.153 1.00 25.00 H new ATOM 0 HA ASP A 38 -5.329 6.544 -1.803 1.00 25.00 H new ATOM 0 HB2 ASP A 38 -6.997 9.068 -1.877 1.00 25.00 H new ATOM 0 HB3 ASP A 38 -5.356 9.101 -2.490 1.00 25.00 H new ATOM 480 N GLY A 39 -3.613 7.460 -0.219 1.00 25.00 N ATOM 481 CA GLY A 39 -2.642 7.931 0.764 1.00 25.00 C ATOM 482 C GLY A 39 -2.012 9.287 0.474 1.00 25.00 C ATOM 483 O GLY A 39 -1.897 10.147 1.369 1.00 25.00 O ATOM 0 H GLY A 39 -3.279 6.714 -0.830 1.00 25.00 H new ATOM 0 HA2 GLY A 39 -3.132 7.979 1.737 1.00 25.00 H new ATOM 0 HA3 GLY A 39 -1.846 7.191 0.844 1.00 25.00 H new ATOM 487 N GLY A 40 -1.573 9.493 -0.758 1.00 25.00 N ATOM 488 CA GLY A 40 -0.897 10.728 -1.125 1.00 25.00 C ATOM 489 C GLY A 40 0.554 10.732 -0.682 1.00 25.00 C ATOM 490 O GLY A 40 1.059 9.743 -0.132 1.00 25.00 O ATOM 0 H GLY A 40 -1.672 8.822 -1.520 1.00 25.00 H new ATOM 0 HA2 GLY A 40 -0.947 10.862 -2.206 1.00 25.00 H new ATOM 0 HA3 GLY A 40 -1.416 11.574 -0.675 1.00 25.00 H new ATOM 494 N ALA A 41 1.246 11.846 -0.898 1.00 25.00 N ATOM 495 CA ALA A 41 2.651 11.958 -0.499 1.00 25.00 C ATOM 496 C ALA A 41 2.781 11.755 1.020 1.00 25.00 C ATOM 497 O ALA A 41 1.815 11.968 1.770 1.00 25.00 O ATOM 498 CB ALA A 41 3.212 13.326 -0.913 1.00 25.00 C ATOM 0 H ALA A 41 0.864 12.680 -1.343 1.00 25.00 H new ATOM 0 HA ALA A 41 3.229 11.184 -1.004 1.00 25.00 H new ATOM 0 HB1 ALA A 41 4.257 13.397 -0.611 1.00 25.00 H new ATOM 0 HB2 ALA A 41 3.139 13.437 -1.995 1.00 25.00 H new ATOM 0 HB3 ALA A 41 2.639 14.116 -0.427 1.00 25.00 H new ATOM 504 N GLY A 42 3.959 11.330 1.455 1.00 25.00 N ATOM 505 CA GLY A 42 4.192 11.040 2.865 1.00 25.00 C ATOM 506 C GLY A 42 3.869 9.589 3.178 1.00 25.00 C ATOM 507 O GLY A 42 3.250 8.893 2.357 1.00 25.00 O ATOM 0 H GLY A 42 4.768 11.178 0.853 1.00 25.00 H new ATOM 0 HA2 GLY A 42 5.232 11.248 3.117 1.00 25.00 H new ATOM 0 HA3 GLY A 42 3.577 11.695 3.482 1.00 25.00 H new ATOM 511 N ARG A 43 4.291 9.136 4.352 1.00 25.00 N ATOM 512 CA ARG A 43 4.051 7.752 4.794 1.00 25.00 C ATOM 513 C ARG A 43 2.745 7.755 5.551 1.00 25.00 C ATOM 514 O ARG A 43 2.526 8.578 6.434 1.00 25.00 O ATOM 515 CB ARG A 43 5.192 7.230 5.686 1.00 25.00 C ATOM 516 CG ARG A 43 5.717 8.253 6.659 1.00 25.00 C ATOM 517 CD ARG A 43 6.795 7.743 7.570 1.00 25.00 C ATOM 518 NE ARG A 43 7.148 8.834 8.488 1.00 25.00 N ATOM 519 CZ ARG A 43 8.135 8.829 9.370 1.00 25.00 C ATOM 520 NH1 ARG A 43 8.939 7.803 9.526 1.00 25.00 N ATOM 521 NH2 ARG A 43 8.311 9.888 10.103 1.00 25.00 N ATOM 0 H ARG A 43 4.805 9.705 5.025 1.00 25.00 H new ATOM 0 HA ARG A 43 4.008 7.086 3.932 1.00 25.00 H new ATOM 0 HB2 ARG A 43 4.839 6.361 6.241 1.00 25.00 H new ATOM 0 HB3 ARG A 43 6.011 6.891 5.052 1.00 25.00 H new ATOM 0 HG2 ARG A 43 6.103 9.105 6.099 1.00 25.00 H new ATOM 0 HG3 ARG A 43 4.889 8.619 7.265 1.00 25.00 H new ATOM 0 HD2 ARG A 43 6.448 6.872 8.125 1.00 25.00 H new ATOM 0 HD3 ARG A 43 7.666 7.428 6.995 1.00 25.00 H new ATOM 0 HE ARG A 43 6.577 9.678 8.441 1.00 25.00 H new ATOM 0 HH11 ARG A 43 8.815 6.967 8.955 1.00 25.00 H new ATOM 0 HH12 ARG A 43 9.687 7.842 10.218 1.00 25.00 H new ATOM 0 HH21 ARG A 43 7.696 10.694 9.990 1.00 25.00 H new ATOM 0 HH22 ARG A 43 9.064 9.913 10.791 1.00 25.00 H new ATOM 535 N ASP A 44 1.842 6.885 5.152 1.00 25.00 N ATOM 536 CA ASP A 44 0.485 6.899 5.666 1.00 25.00 C ATOM 537 C ASP A 44 0.114 5.568 6.282 1.00 25.00 C ATOM 538 O ASP A 44 0.730 4.540 5.996 1.00 25.00 O ATOM 539 CB ASP A 44 -0.466 7.221 4.517 1.00 25.00 C ATOM 540 CG ASP A 44 -0.131 8.536 3.856 1.00 25.00 C ATOM 541 OD1 ASP A 44 -0.180 9.575 4.538 1.00 50.00 O ATOM 542 OD2 ASP A 44 0.201 8.562 2.645 1.00 50.00 O ATOM 0 H ASP A 44 2.024 6.152 4.467 1.00 25.00 H new ATOM 0 HA ASP A 44 0.411 7.656 6.447 1.00 25.00 H new ATOM 0 HB2 ASP A 44 -0.423 6.422 3.777 1.00 25.00 H new ATOM 0 HB3 ASP A 44 -1.489 7.254 4.892 1.00 25.00 H new ATOM 547 N ARG A 45 -0.908 5.593 7.124 1.00 25.00 N ATOM 548 CA ARG A 45 -1.447 4.378 7.741 1.00 25.00 C ATOM 549 C ARG A 45 -2.862 4.246 7.223 1.00 25.00 C ATOM 550 O ARG A 45 -3.713 5.058 7.556 1.00 25.00 O ATOM 551 CB ARG A 45 -1.435 4.468 9.269 1.00 25.00 C ATOM 552 CG ARG A 45 -0.145 3.965 9.907 1.00 25.00 C ATOM 553 CD ARG A 45 1.032 4.914 9.685 1.00 25.00 C ATOM 554 NE ARG A 45 2.254 4.401 10.328 1.00 25.00 N ATOM 555 CZ ARG A 45 2.638 4.662 11.574 1.00 25.00 C ATOM 556 NH1 ARG A 45 1.949 5.442 12.373 1.00 25.00 N ATOM 557 NH2 ARG A 45 3.738 4.122 12.024 1.00 25.00 N ATOM 0 H ARG A 45 -1.389 6.449 7.401 1.00 25.00 H new ATOM 0 HA ARG A 45 -0.840 3.509 7.486 1.00 25.00 H new ATOM 0 HB2 ARG A 45 -1.594 5.505 9.563 1.00 25.00 H new ATOM 0 HB3 ARG A 45 -2.272 3.893 9.664 1.00 25.00 H new ATOM 0 HG2 ARG A 45 -0.302 3.832 10.977 1.00 25.00 H new ATOM 0 HG3 ARG A 45 0.101 2.986 9.496 1.00 25.00 H new ATOM 0 HD2 ARG A 45 1.205 5.040 8.616 1.00 25.00 H new ATOM 0 HD3 ARG A 45 0.791 5.898 10.087 1.00 25.00 H new ATOM 0 HE ARG A 45 2.856 3.795 9.771 1.00 25.00 H new ATOM 0 HH11 ARG A 45 1.085 5.873 12.045 1.00 25.00 H new ATOM 0 HH12 ARG A 45 2.278 5.617 13.323 1.00 25.00 H new ATOM 0 HH21 ARG A 45 4.289 3.510 11.422 1.00 25.00 H new ATOM 0 HH22 ARG A 45 4.046 4.312 12.977 1.00 25.00 H new ATOM 571 N LEU A 46 -3.073 3.279 6.349 1.00 25.00 N ATOM 572 CA LEU A 46 -4.346 3.106 5.654 1.00 25.00 C ATOM 573 C LEU A 46 -5.125 1.955 6.265 1.00 25.00 C ATOM 574 O LEU A 46 -4.872 0.798 5.972 1.00 25.00 O ATOM 575 CB LEU A 46 -4.087 2.821 4.173 1.00 25.00 C ATOM 576 CG LEU A 46 -3.364 3.961 3.447 1.00 25.00 C ATOM 577 CD1 LEU A 46 -2.503 3.402 2.322 1.00 25.00 C ATOM 578 CD2 LEU A 46 -4.343 4.971 2.882 1.00 25.00 C ATOM 0 H LEU A 46 -2.368 2.587 6.097 1.00 25.00 H new ATOM 0 HA LEU A 46 -4.930 4.021 5.753 1.00 25.00 H new ATOM 0 HB2 LEU A 46 -3.494 1.911 4.085 1.00 25.00 H new ATOM 0 HB3 LEU A 46 -5.038 2.630 3.676 1.00 25.00 H new ATOM 0 HG LEU A 46 -2.733 4.469 4.176 1.00 25.00 H new ATOM 0 HD11 LEU A 46 -1.994 4.220 1.813 1.00 25.00 H new ATOM 0 HD12 LEU A 46 -1.764 2.716 2.736 1.00 25.00 H new ATOM 0 HD13 LEU A 46 -3.134 2.869 1.611 1.00 25.00 H new ATOM 0 HD21 LEU A 46 -3.795 5.765 2.374 1.00 25.00 H new ATOM 0 HD22 LEU A 46 -5.006 4.477 2.172 1.00 25.00 H new ATOM 0 HD23 LEU A 46 -4.933 5.399 3.693 1.00 25.00 H new ATOM 590 N THR A 47 -6.053 2.279 7.139 1.00 25.00 N ATOM 591 CA THR A 47 -6.862 1.262 7.810 1.00 25.00 C ATOM 592 C THR A 47 -8.130 1.046 7.003 1.00 25.00 C ATOM 593 O THR A 47 -8.938 1.957 6.849 1.00 25.00 O ATOM 594 CB THR A 47 -7.208 1.696 9.246 1.00 25.00 C ATOM 595 OG1 THR A 47 -6.029 2.205 9.880 1.00 25.00 O ATOM 596 CG2 THR A 47 -7.742 0.543 10.059 1.00 25.00 C ATOM 0 H THR A 47 -6.273 3.238 7.408 1.00 25.00 H new ATOM 0 HA THR A 47 -6.298 0.332 7.874 1.00 25.00 H new ATOM 0 HB THR A 47 -7.980 2.464 9.192 1.00 25.00 H new ATOM 0 HG1 THR A 47 -6.244 2.485 10.794 1.00 25.00 H new ATOM 0 HG21 THR A 47 -7.976 0.886 11.067 1.00 25.00 H new ATOM 0 HG22 THR A 47 -8.646 0.154 9.589 1.00 25.00 H new ATOM 0 HG23 THR A 47 -6.991 -0.246 10.109 1.00 25.00 H new ATOM 604 N GLY A 48 -8.295 -0.138 6.436 1.00 25.00 N ATOM 605 CA GLY A 48 -9.466 -0.388 5.610 1.00 25.00 C ATOM 606 C GLY A 48 -10.672 -0.776 6.428 1.00 25.00 C ATOM 607 O GLY A 48 -11.806 -0.379 6.123 1.00 25.00 O ATOM 0 H GLY A 48 -7.651 -0.924 6.528 1.00 25.00 H new ATOM 0 HA2 GLY A 48 -9.696 0.506 5.030 1.00 25.00 H new ATOM 0 HA3 GLY A 48 -9.242 -1.182 4.898 1.00 25.00 H new ATOM 611 N GLY A 49 -10.443 -1.566 7.462 1.00 25.00 N ATOM 612 CA GLY A 49 -11.527 -2.055 8.294 1.00 25.00 C ATOM 613 C GLY A 49 -12.337 -3.113 7.564 1.00 25.00 C ATOM 614 O GLY A 49 -11.905 -3.650 6.533 1.00 25.00 O ATOM 0 H GLY A 49 -9.516 -1.882 7.745 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -11.123 -2.473 9.216 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -12.176 -1.226 8.577 1.00 25.00 H new ATOM 618 N LEU A 50 -13.522 -3.401 8.075 1.00 25.00 N ATOM 619 CA LEU A 50 -14.416 -4.373 7.442 1.00 25.00 C ATOM 620 C LEU A 50 -14.886 -3.865 6.084 1.00 25.00 C ATOM 621 O LEU A 50 -14.891 -2.659 5.821 1.00 25.00 O ATOM 622 CB LEU A 50 -15.638 -4.638 8.332 1.00 25.00 C ATOM 623 CG LEU A 50 -15.332 -5.338 9.663 1.00 25.00 C ATOM 624 CD1 LEU A 50 -16.578 -5.301 10.544 1.00 25.00 C ATOM 625 CD2 LEU A 50 -14.881 -6.789 9.458 1.00 25.00 C ATOM 0 H LEU A 50 -13.893 -2.979 8.926 1.00 25.00 H new ATOM 0 HA LEU A 50 -13.860 -5.301 7.306 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -16.128 -3.687 8.543 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -16.350 -5.246 7.774 1.00 25.00 H new ATOM 0 HG LEU A 50 -14.511 -4.808 10.145 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -16.368 -5.797 11.492 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -16.861 -4.265 10.731 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -17.396 -5.815 10.039 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -14.675 -7.246 10.426 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -15.670 -7.347 8.953 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -13.977 -6.807 8.849 1.00 25.00 H new ATOM 637 N GLY A 51 -15.280 -4.801 5.230 1.00 25.00 N ATOM 638 CA GLY A 51 -15.721 -4.477 3.879 1.00 25.00 C ATOM 639 C GLY A 51 -14.586 -4.659 2.888 1.00 25.00 C ATOM 640 O GLY A 51 -13.421 -4.784 3.299 1.00 25.00 O ATOM 0 H GLY A 51 -15.303 -5.797 5.451 1.00 25.00 H new ATOM 0 HA2 GLY A 51 -16.559 -5.116 3.601 1.00 25.00 H new ATOM 0 HA3 GLY A 51 -16.079 -3.448 3.845 1.00 25.00 H new ATOM 644 N ALA A 52 -14.917 -4.687 1.605 1.00 25.00 N ATOM 645 CA ALA A 52 -13.934 -4.834 0.543 1.00 25.00 C ATOM 646 C ALA A 52 -13.421 -3.432 0.229 1.00 25.00 C ATOM 647 O ALA A 52 -14.169 -2.574 -0.213 1.00 25.00 O ATOM 648 CB ALA A 52 -14.575 -5.478 -0.694 1.00 25.00 C ATOM 0 H ALA A 52 -15.878 -4.608 1.271 1.00 25.00 H new ATOM 0 HA ALA A 52 -13.114 -5.484 0.848 1.00 25.00 H new ATOM 0 HB1 ALA A 52 -13.827 -5.581 -1.480 1.00 25.00 H new ATOM 0 HB2 ALA A 52 -14.964 -6.462 -0.432 1.00 25.00 H new ATOM 0 HB3 ALA A 52 -15.391 -4.849 -1.050 1.00 25.00 H new ATOM 654 N ASP A 53 -12.163 -3.187 0.540 1.00 25.00 N ATOM 655 CA ASP A 53 -11.592 -1.853 0.403 1.00 25.00 C ATOM 656 C ASP A 53 -10.557 -1.848 -0.692 1.00 25.00 C ATOM 657 O ASP A 53 -9.906 -2.858 -0.930 1.00 25.00 O ATOM 658 CB ASP A 53 -10.926 -1.452 1.714 1.00 25.00 C ATOM 659 CG ASP A 53 -11.873 -1.528 2.880 1.00 25.00 C ATOM 660 OD1 ASP A 53 -12.885 -0.800 2.910 1.00 50.00 O ATOM 661 OD2 ASP A 53 -11.608 -2.326 3.810 1.00 50.00 O ATOM 0 H ASP A 53 -11.513 -3.891 0.890 1.00 25.00 H new ATOM 0 HA ASP A 53 -12.387 -1.149 0.156 1.00 25.00 H new ATOM 0 HB2 ASP A 53 -10.072 -2.103 1.899 1.00 25.00 H new ATOM 0 HB3 ASP A 53 -10.540 -0.436 1.627 1.00 25.00 H new ATOM 666 N THR A 54 -10.350 -0.710 -1.321 1.00 25.00 N ATOM 667 CA THR A 54 -9.288 -0.581 -2.300 1.00 25.00 C ATOM 668 C THR A 54 -8.412 0.597 -1.922 1.00 25.00 C ATOM 669 O THR A 54 -8.892 1.650 -1.481 1.00 25.00 O ATOM 670 CB THR A 54 -9.822 -0.488 -3.748 1.00 25.00 C ATOM 671 OG1 THR A 54 -8.723 -0.459 -4.662 1.00 25.00 O ATOM 672 CG2 THR A 54 -10.670 0.745 -3.976 1.00 25.00 C ATOM 0 H THR A 54 -10.900 0.136 -1.174 1.00 25.00 H new ATOM 0 HA THR A 54 -8.683 -1.487 -2.285 1.00 25.00 H new ATOM 0 HB THR A 54 -10.449 -1.364 -3.914 1.00 25.00 H new ATOM 0 HG1 THR A 54 -9.062 -0.402 -5.580 1.00 25.00 H new ATOM 0 HG21 THR A 54 -11.019 0.761 -5.008 1.00 25.00 H new ATOM 0 HG22 THR A 54 -11.527 0.726 -3.303 1.00 25.00 H new ATOM 0 HG23 THR A 54 -10.075 1.637 -3.781 1.00 25.00 H new ATOM 680 N PHE A 55 -7.113 0.381 -2.019 1.00 25.00 N ATOM 681 CA PHE A 55 -6.127 1.379 -1.636 1.00 25.00 C ATOM 682 C PHE A 55 -5.445 1.815 -2.909 1.00 25.00 C ATOM 683 O PHE A 55 -5.003 0.977 -3.694 1.00 25.00 O ATOM 684 CB PHE A 55 -5.139 0.774 -0.642 1.00 25.00 C ATOM 685 CG PHE A 55 -5.807 0.169 0.559 1.00 25.00 C ATOM 686 CD1 PHE A 55 -6.177 0.970 1.652 1.00 25.00 C ATOM 687 CD2 PHE A 55 -6.100 -1.209 0.591 1.00 25.00 C ATOM 688 CE1 PHE A 55 -6.836 0.404 2.773 1.00 25.00 C ATOM 689 CE2 PHE A 55 -6.763 -1.780 1.698 1.00 25.00 C ATOM 690 CZ PHE A 55 -7.129 -0.975 2.789 1.00 25.00 C ATOM 0 H PHE A 55 -6.710 -0.490 -2.365 1.00 25.00 H new ATOM 0 HA PHE A 55 -6.583 2.237 -1.143 1.00 25.00 H new ATOM 0 HB2 PHE A 55 -4.549 0.009 -1.146 1.00 25.00 H new ATOM 0 HB3 PHE A 55 -4.445 1.547 -0.313 1.00 25.00 H new ATOM 0 HD1 PHE A 55 -5.957 2.027 1.639 1.00 25.00 H new ATOM 0 HD2 PHE A 55 -5.814 -1.835 -0.241 1.00 25.00 H new ATOM 0 HE1 PHE A 55 -7.112 1.027 3.611 1.00 25.00 H new ATOM 0 HE2 PHE A 55 -6.989 -2.836 1.706 1.00 25.00 H new ATOM 0 HZ PHE A 55 -7.634 -1.411 3.638 1.00 25.00 H new ATOM 700 N ARG A 56 -5.434 3.115 -3.165 1.00 25.00 N ATOM 701 CA ARG A 56 -4.969 3.634 -4.445 1.00 25.00 C ATOM 702 C ARG A 56 -3.805 4.591 -4.284 1.00 25.00 C ATOM 703 O ARG A 56 -3.709 5.328 -3.304 1.00 25.00 O ATOM 704 CB ARG A 56 -6.131 4.357 -5.127 1.00 25.00 C ATOM 705 CG ARG A 56 -5.996 4.474 -6.633 1.00 25.00 C ATOM 706 CD ARG A 56 -6.954 5.517 -7.176 1.00 25.00 C ATOM 707 NE ARG A 56 -6.956 5.518 -8.649 1.00 25.00 N ATOM 708 CZ ARG A 56 -6.087 6.161 -9.421 1.00 25.00 C ATOM 709 NH1 ARG A 56 -5.104 6.874 -8.937 1.00 25.00 N ATOM 710 NH2 ARG A 56 -6.209 6.078 -10.718 1.00 25.00 N ATOM 0 H ARG A 56 -5.741 3.830 -2.505 1.00 25.00 H new ATOM 0 HA ARG A 56 -4.621 2.796 -5.048 1.00 25.00 H new ATOM 0 HB2 ARG A 56 -7.057 3.830 -4.897 1.00 25.00 H new ATOM 0 HB3 ARG A 56 -6.220 5.357 -4.703 1.00 25.00 H new ATOM 0 HG2 ARG A 56 -4.972 4.743 -6.892 1.00 25.00 H new ATOM 0 HG3 ARG A 56 -6.199 3.509 -7.098 1.00 25.00 H new ATOM 0 HD2 ARG A 56 -7.960 5.318 -6.808 1.00 25.00 H new ATOM 0 HD3 ARG A 56 -6.670 6.503 -6.809 1.00 25.00 H new ATOM 0 HE ARG A 56 -7.686 4.980 -9.115 1.00 25.00 H new ATOM 0 HH11 ARG A 56 -4.980 6.954 -7.928 1.00 25.00 H new ATOM 0 HH12 ARG A 56 -4.461 7.351 -9.569 1.00 25.00 H new ATOM 0 HH21 ARG A 56 -6.964 5.525 -11.125 1.00 25.00 H new ATOM 0 HH22 ARG A 56 -5.550 6.566 -11.325 1.00 25.00 H new ATOM 724 N PHE A 57 -2.942 4.607 -5.284 1.00 25.00 N ATOM 725 CA PHE A 57 -1.882 5.598 -5.349 1.00 25.00 C ATOM 726 C PHE A 57 -2.499 6.924 -5.795 1.00 25.00 C ATOM 727 O PHE A 57 -3.401 6.943 -6.634 1.00 25.00 O ATOM 728 CB PHE A 57 -0.809 5.157 -6.365 1.00 25.00 C ATOM 729 CG PHE A 57 -1.318 5.087 -7.795 1.00 25.00 C ATOM 730 CD1 PHE A 57 -1.289 6.227 -8.629 1.00 25.00 C ATOM 731 CD2 PHE A 57 -1.837 3.889 -8.317 1.00 25.00 C ATOM 732 CE1 PHE A 57 -1.788 6.170 -9.956 1.00 25.00 C ATOM 733 CE2 PHE A 57 -2.335 3.823 -9.639 1.00 25.00 C ATOM 734 CZ PHE A 57 -2.308 4.964 -10.460 1.00 25.00 C ATOM 0 H PHE A 57 -2.954 3.946 -6.061 1.00 25.00 H new ATOM 0 HA PHE A 57 -1.410 5.707 -4.372 1.00 25.00 H new ATOM 0 HB2 PHE A 57 0.029 5.852 -6.320 1.00 25.00 H new ATOM 0 HB3 PHE A 57 -0.427 4.178 -6.076 1.00 25.00 H new ATOM 0 HD1 PHE A 57 -0.882 7.153 -8.252 1.00 25.00 H new ATOM 0 HD2 PHE A 57 -1.856 3.004 -7.698 1.00 25.00 H new ATOM 0 HE1 PHE A 57 -1.769 7.052 -10.579 1.00 25.00 H new ATOM 0 HE2 PHE A 57 -2.737 2.895 -10.018 1.00 25.00 H new ATOM 0 HZ PHE A 57 -2.684 4.915 -11.471 1.00 25.00 H new ATOM 744 N ALA A 58 -1.959 8.027 -5.307 1.00 25.00 N ATOM 745 CA ALA A 58 -2.338 9.354 -5.778 1.00 25.00 C ATOM 746 C ALA A 58 -1.101 10.054 -6.353 1.00 25.00 C ATOM 747 O ALA A 58 -1.178 11.168 -6.859 1.00 25.00 O ATOM 748 CB ALA A 58 -2.938 10.165 -4.628 1.00 25.00 C ATOM 0 H ALA A 58 -1.248 8.032 -4.576 1.00 25.00 H new ATOM 0 HA ALA A 58 -3.092 9.268 -6.560 1.00 25.00 H new ATOM 0 HB1 ALA A 58 -3.218 11.155 -4.988 1.00 25.00 H new ATOM 0 HB2 ALA A 58 -3.822 9.654 -4.245 1.00 25.00 H new ATOM 0 HB3 ALA A 58 -2.202 10.264 -3.830 1.00 25.00 H new ATOM 754 N LEU A 59 0.051 9.399 -6.247 1.00 25.00 N ATOM 755 CA LEU A 59 1.318 9.961 -6.710 1.00 25.00 C ATOM 756 C LEU A 59 2.277 8.813 -7.029 1.00 25.00 C ATOM 757 O LEU A 59 2.135 7.731 -6.481 1.00 25.00 O ATOM 758 CB LEU A 59 1.909 10.844 -5.597 1.00 25.00 C ATOM 759 CG LEU A 59 3.101 11.746 -5.955 1.00 25.00 C ATOM 760 CD1 LEU A 59 2.741 12.777 -7.024 1.00 25.00 C ATOM 761 CD2 LEU A 59 3.590 12.453 -4.707 1.00 25.00 C ATOM 0 H LEU A 59 0.134 8.468 -5.840 1.00 25.00 H new ATOM 0 HA LEU A 59 1.163 10.565 -7.604 1.00 25.00 H new ATOM 0 HB2 LEU A 59 1.111 11.480 -5.215 1.00 25.00 H new ATOM 0 HB3 LEU A 59 2.216 10.192 -4.780 1.00 25.00 H new ATOM 0 HG LEU A 59 3.888 11.112 -6.363 1.00 25.00 H new ATOM 0 HD11 LEU A 59 3.614 13.392 -7.245 1.00 25.00 H new ATOM 0 HD12 LEU A 59 2.419 12.264 -7.930 1.00 25.00 H new ATOM 0 HD13 LEU A 59 1.933 13.411 -6.660 1.00 25.00 H new ATOM 0 HD21 LEU A 59 4.435 13.093 -4.959 1.00 25.00 H new ATOM 0 HD22 LEU A 59 2.785 13.061 -4.294 1.00 25.00 H new ATOM 0 HD23 LEU A 59 3.902 11.714 -3.969 1.00 25.00 H new ATOM 773 N ARG A 60 3.287 9.057 -7.852 1.00 25.00 N ATOM 774 CA ARG A 60 4.311 8.043 -8.119 1.00 25.00 C ATOM 775 C ARG A 60 5.127 7.756 -6.841 1.00 25.00 C ATOM 776 O ARG A 60 5.669 6.685 -6.677 1.00 25.00 O ATOM 777 CB ARG A 60 5.242 8.510 -9.260 1.00 25.00 C ATOM 778 CG ARG A 60 6.287 9.518 -8.798 1.00 25.00 C ATOM 779 CD ARG A 60 7.093 10.176 -9.889 1.00 25.00 C ATOM 780 NE ARG A 60 8.199 10.921 -9.252 1.00 25.00 N ATOM 781 CZ ARG A 60 9.451 10.491 -9.132 1.00 25.00 C ATOM 782 NH1 ARG A 60 9.866 9.363 -9.654 1.00 25.00 N ATOM 783 NH2 ARG A 60 10.310 11.210 -8.464 1.00 25.00 N ATOM 0 H ARG A 60 3.424 9.939 -8.345 1.00 25.00 H new ATOM 0 HA ARG A 60 3.818 7.122 -8.429 1.00 25.00 H new ATOM 0 HB2 ARG A 60 5.745 7.644 -9.689 1.00 25.00 H new ATOM 0 HB3 ARG A 60 4.641 8.955 -10.053 1.00 25.00 H new ATOM 0 HG2 ARG A 60 5.784 10.296 -8.224 1.00 25.00 H new ATOM 0 HG3 ARG A 60 6.974 9.014 -8.118 1.00 25.00 H new ATOM 0 HD2 ARG A 60 7.484 9.428 -10.578 1.00 25.00 H new ATOM 0 HD3 ARG A 60 6.466 10.850 -10.473 1.00 25.00 H new ATOM 0 HE ARG A 60 7.983 11.843 -8.872 1.00 25.00 H new ATOM 0 HH11 ARG A 60 9.218 8.775 -10.178 1.00 25.00 H new ATOM 0 HH12 ARG A 60 10.837 9.073 -9.536 1.00 25.00 H new ATOM 0 HH21 ARG A 60 10.018 12.091 -8.041 1.00 25.00 H new ATOM 0 HH22 ARG A 60 11.274 10.891 -8.365 1.00 25.00 H new ATOM 797 N GLU A 61 5.195 8.737 -5.943 1.00 25.00 N ATOM 798 CA GLU A 61 6.005 8.635 -4.726 1.00 25.00 C ATOM 799 C GLU A 61 5.154 8.321 -3.506 1.00 25.00 C ATOM 800 O GLU A 61 5.579 8.477 -2.368 1.00 25.00 O ATOM 801 CB GLU A 61 6.758 9.942 -4.487 1.00 25.00 C ATOM 802 CG GLU A 61 7.842 10.201 -5.521 1.00 25.00 C ATOM 803 CD GLU A 61 8.674 11.426 -5.225 1.00 25.00 C ATOM 804 OE1 GLU A 61 9.270 11.505 -4.131 1.00 25.00 O ATOM 805 OE2 GLU A 61 8.773 12.296 -6.127 1.00 25.00 O ATOM 0 H GLU A 61 4.694 9.621 -6.035 1.00 25.00 H new ATOM 0 HA GLU A 61 6.710 7.817 -4.872 1.00 25.00 H new ATOM 0 HB2 GLU A 61 6.049 10.770 -4.497 1.00 25.00 H new ATOM 0 HB3 GLU A 61 7.208 9.919 -3.495 1.00 25.00 H new ATOM 0 HG2 GLU A 61 8.497 9.331 -5.576 1.00 25.00 H new ATOM 0 HG3 GLU A 61 7.379 10.314 -6.501 1.00 25.00 H new ATOM 812 N ASP A 62 3.939 7.870 -3.757 1.00 25.00 N ATOM 813 CA ASP A 62 3.009 7.513 -2.680 1.00 25.00 C ATOM 814 C ASP A 62 3.587 6.421 -1.773 1.00 25.00 C ATOM 815 O ASP A 62 3.300 6.382 -0.580 1.00 25.00 O ATOM 816 CB ASP A 62 1.685 7.022 -3.277 1.00 25.00 C ATOM 817 CG ASP A 62 0.504 7.360 -2.415 1.00 25.00 C ATOM 818 OD1 ASP A 62 0.557 7.136 -1.191 1.00 25.00 O ATOM 819 OD2 ASP A 62 -0.455 7.951 -2.947 1.00 25.00 O ATOM 0 H ASP A 62 3.564 7.739 -4.697 1.00 25.00 H new ATOM 0 HA ASP A 62 2.842 8.406 -2.078 1.00 25.00 H new ATOM 0 HB2 ASP A 62 1.549 7.465 -4.264 1.00 25.00 H new ATOM 0 HB3 ASP A 62 1.732 5.942 -3.416 1.00 25.00 H new ATOM 824 N SER A 63 4.408 5.555 -2.354 1.00 25.00 N ATOM 825 CA SER A 63 5.033 4.427 -1.641 1.00 25.00 C ATOM 826 C SER A 63 6.553 4.409 -1.826 1.00 25.00 C ATOM 827 O SER A 63 7.130 3.408 -2.225 1.00 25.00 O ATOM 828 CB SER A 63 4.438 3.127 -2.185 1.00 25.00 C ATOM 829 OG SER A 63 3.031 3.126 -2.029 1.00 25.00 O ATOM 0 H SER A 63 4.666 5.608 -3.339 1.00 25.00 H new ATOM 0 HA SER A 63 4.834 4.534 -0.575 1.00 25.00 H new ATOM 0 HB2 SER A 63 4.694 3.015 -3.239 1.00 25.00 H new ATOM 0 HB3 SER A 63 4.869 2.274 -1.660 1.00 25.00 H new ATOM 0 HG SER A 63 2.663 2.289 -2.383 1.00 25.00 H new ATOM 835 N HIS A 64 7.182 5.551 -1.615 1.00 25.00 N ATOM 836 CA HIS A 64 8.597 5.756 -1.967 1.00 25.00 C ATOM 837 C HIS A 64 9.548 5.673 -0.766 1.00 25.00 C ATOM 838 O HIS A 64 9.245 6.162 0.312 1.00 25.00 O ATOM 839 CB HIS A 64 8.670 7.158 -2.606 1.00 25.00 C ATOM 840 CG HIS A 64 10.049 7.635 -2.957 1.00 25.00 C ATOM 841 ND1 HIS A 64 11.174 6.963 -3.318 1.00 25.00 N flip ATOM 842 CD2 HIS A 64 10.405 8.961 -3.000 1.00 25.00 C flip ATOM 843 CE1 HIS A 64 12.207 7.857 -3.539 1.00 25.00 C flip ATOM 844 NE2 HIS A 64 11.680 9.044 -3.341 1.00 25.00 N flip ATOM 0 H HIS A 64 6.738 6.368 -1.196 1.00 25.00 H new ATOM 0 HA HIS A 64 8.923 4.963 -2.640 1.00 25.00 H new ATOM 0 HB2 HIS A 64 8.063 7.158 -3.511 1.00 25.00 H new ATOM 0 HB3 HIS A 64 8.220 7.875 -1.920 1.00 25.00 H new ATOM 0 HD1 HIS A 64 11.246 5.950 -3.412 1.00 25.00 H new ATOM 0 HD2 HIS A 64 9.753 9.796 -2.790 1.00 25.00 H new ATOM 0 HE1 HIS A 64 13.226 7.628 -3.815 1.00 25.00 H new ATOM 852 N ARG A 65 10.730 5.104 -0.971 1.00 25.00 N ATOM 853 CA ARG A 65 11.804 5.140 0.023 1.00 25.00 C ATOM 854 C ARG A 65 13.091 5.625 -0.638 1.00 25.00 C ATOM 855 O ARG A 65 13.494 5.135 -1.691 1.00 25.00 O ATOM 856 CB ARG A 65 12.036 3.762 0.644 1.00 25.00 C ATOM 857 CG ARG A 65 10.846 3.228 1.411 1.00 25.00 C ATOM 858 CD ARG A 65 11.262 2.059 2.287 1.00 25.00 C ATOM 859 NE ARG A 65 10.110 1.483 2.994 1.00 25.00 N ATOM 860 CZ ARG A 65 10.127 0.375 3.724 1.00 25.00 C ATOM 861 NH1 ARG A 65 11.218 -0.325 3.907 1.00 25.00 N ATOM 862 NH2 ARG A 65 9.020 -0.033 4.273 1.00 25.00 N ATOM 0 H ARG A 65 10.974 4.605 -1.827 1.00 25.00 H new ATOM 0 HA ARG A 65 11.510 5.825 0.818 1.00 25.00 H new ATOM 0 HB2 ARG A 65 12.293 3.057 -0.146 1.00 25.00 H new ATOM 0 HB3 ARG A 65 12.894 3.816 1.314 1.00 25.00 H new ATOM 0 HG2 ARG A 65 10.418 4.019 2.028 1.00 25.00 H new ATOM 0 HG3 ARG A 65 10.069 2.911 0.715 1.00 25.00 H new ATOM 0 HD2 ARG A 65 11.735 1.292 1.673 1.00 25.00 H new ATOM 0 HD3 ARG A 65 12.006 2.391 3.011 1.00 25.00 H new ATOM 0 HE ARG A 65 9.221 1.977 2.917 1.00 25.00 H new ATOM 0 HH11 ARG A 65 12.095 -0.024 3.482 1.00 25.00 H new ATOM 0 HH12 ARG A 65 11.191 -1.172 4.475 1.00 25.00 H new ATOM 0 HH21 ARG A 65 8.159 0.497 4.139 1.00 25.00 H new ATOM 0 HH22 ARG A 65 9.014 -0.882 4.838 1.00 25.00 H new ATOM 876 N SER A 66 13.740 6.573 0.009 1.00 25.00 N ATOM 877 CA SER A 66 14.988 7.145 -0.480 1.00 25.00 C ATOM 878 C SER A 66 16.019 6.894 0.606 1.00 25.00 C ATOM 879 O SER A 66 15.646 6.585 1.740 1.00 25.00 O ATOM 880 CB SER A 66 14.802 8.646 -0.716 1.00 25.00 C ATOM 881 OG SER A 66 14.599 9.326 0.512 1.00 25.00 O ATOM 0 H SER A 66 13.419 6.972 0.891 1.00 25.00 H new ATOM 0 HA SER A 66 15.303 6.700 -1.424 1.00 25.00 H new ATOM 0 HB2 SER A 66 15.679 9.051 -1.221 1.00 25.00 H new ATOM 0 HB3 SER A 66 13.950 8.813 -1.375 1.00 25.00 H new ATOM 0 HG SER A 66 14.131 8.736 1.139 1.00 25.00 H new ATOM 887 N PRO A 67 17.322 7.066 0.314 1.00 25.00 N ATOM 888 CA PRO A 67 18.254 6.882 1.437 1.00 25.00 C ATOM 889 C PRO A 67 18.181 8.013 2.470 1.00 25.00 C ATOM 890 O PRO A 67 18.834 7.957 3.501 1.00 25.00 O ATOM 891 CB PRO A 67 19.618 6.861 0.740 1.00 25.00 C ATOM 892 CG PRO A 67 19.432 7.739 -0.443 1.00 25.00 C ATOM 893 CD PRO A 67 18.041 7.416 -0.930 1.00 25.00 C ATOM 0 HA PRO A 67 18.033 5.984 2.013 1.00 25.00 H new ATOM 0 HB2 PRO A 67 20.406 7.235 1.394 1.00 25.00 H new ATOM 0 HB3 PRO A 67 19.900 5.850 0.446 1.00 25.00 H new ATOM 0 HG2 PRO A 67 19.526 8.792 -0.176 1.00 25.00 H new ATOM 0 HG3 PRO A 67 20.179 7.537 -1.210 1.00 25.00 H new ATOM 0 HD2 PRO A 67 17.583 8.267 -1.434 1.00 25.00 H new ATOM 0 HD3 PRO A 67 18.044 6.589 -1.640 1.00 25.00 H new ATOM 901 N LEU A 68 17.382 9.038 2.187 1.00 25.00 N ATOM 902 CA LEU A 68 17.242 10.187 3.078 1.00 25.00 C ATOM 903 C LEU A 68 15.939 10.127 3.882 1.00 25.00 C ATOM 904 O LEU A 68 15.687 10.980 4.727 1.00 25.00 O ATOM 905 CB LEU A 68 17.260 11.480 2.253 1.00 25.00 C ATOM 906 CG LEU A 68 18.480 11.703 1.347 1.00 25.00 C ATOM 907 CD1 LEU A 68 18.258 12.964 0.516 1.00 25.00 C ATOM 908 CD2 LEU A 68 19.775 11.825 2.140 1.00 25.00 C ATOM 0 H LEU A 68 16.817 9.096 1.340 1.00 25.00 H new ATOM 0 HA LEU A 68 18.077 10.168 3.778 1.00 25.00 H new ATOM 0 HB2 LEU A 68 16.366 11.499 1.630 1.00 25.00 H new ATOM 0 HB3 LEU A 68 17.188 12.323 2.940 1.00 25.00 H new ATOM 0 HG LEU A 68 18.583 10.832 0.699 1.00 25.00 H new ATOM 0 HD11 LEU A 68 19.120 13.130 -0.130 1.00 25.00 H new ATOM 0 HD12 LEU A 68 17.364 12.844 -0.095 1.00 25.00 H new ATOM 0 HD13 LEU A 68 18.132 13.820 1.180 1.00 25.00 H new ATOM 0 HD21 LEU A 68 20.608 11.982 1.455 1.00 25.00 H new ATOM 0 HD22 LEU A 68 19.704 12.670 2.824 1.00 25.00 H new ATOM 0 HD23 LEU A 68 19.941 10.910 2.709 1.00 25.00 H new ATOM 920 N GLY A 69 15.099 9.138 3.608 1.00 25.00 N ATOM 921 CA GLY A 69 13.828 9.029 4.314 1.00 25.00 C ATOM 922 C GLY A 69 12.842 8.077 3.674 1.00 25.00 C ATOM 923 O GLY A 69 12.926 7.778 2.480 1.00 25.00 O ATOM 0 H GLY A 69 15.269 8.410 2.914 1.00 25.00 H new ATOM 0 HA2 GLY A 69 14.020 8.702 5.336 1.00 25.00 H new ATOM 0 HA3 GLY A 69 13.373 10.018 4.375 1.00 25.00 H new ATOM 927 N THR A 70 11.891 7.601 4.466 1.00 25.00 N ATOM 928 CA THR A 70 10.881 6.662 3.996 1.00 25.00 C ATOM 929 C THR A 70 9.494 7.294 3.986 1.00 25.00 C ATOM 930 O THR A 70 9.091 7.974 4.930 1.00 25.00 O ATOM 931 CB THR A 70 10.882 5.380 4.866 1.00 25.00 C ATOM 932 OG1 THR A 70 9.851 4.498 4.419 1.00 25.00 O ATOM 933 CG2 THR A 70 10.645 5.663 6.355 1.00 25.00 C ATOM 0 H THR A 70 11.798 7.854 5.450 1.00 25.00 H new ATOM 0 HA THR A 70 11.133 6.391 2.971 1.00 25.00 H new ATOM 0 HB THR A 70 11.871 4.935 4.758 1.00 25.00 H new ATOM 0 HG1 THR A 70 9.853 3.687 4.969 1.00 25.00 H new ATOM 0 HG21 THR A 70 10.657 4.725 6.910 1.00 25.00 H new ATOM 0 HG22 THR A 70 11.432 6.317 6.731 1.00 25.00 H new ATOM 0 HG23 THR A 70 9.677 6.148 6.484 1.00 25.00 H new ATOM 941 N PHE A 71 8.786 7.082 2.890 1.00 25.00 N ATOM 942 CA PHE A 71 7.453 7.633 2.678 1.00 25.00 C ATOM 943 C PHE A 71 6.512 6.498 2.276 1.00 25.00 C ATOM 944 O PHE A 71 5.431 6.723 1.749 1.00 25.00 O ATOM 945 CB PHE A 71 7.516 8.703 1.588 1.00 25.00 C ATOM 946 CG PHE A 71 8.718 9.607 1.719 1.00 25.00 C ATOM 947 CD1 PHE A 71 8.765 10.596 2.718 1.00 25.00 C ATOM 948 CD2 PHE A 71 9.826 9.456 0.854 1.00 25.00 C ATOM 949 CE1 PHE A 71 9.908 11.418 2.866 1.00 25.00 C ATOM 950 CE2 PHE A 71 10.974 10.278 0.995 1.00 25.00 C ATOM 951 CZ PHE A 71 11.017 11.256 2.004 1.00 25.00 C ATOM 0 H PHE A 71 9.122 6.516 2.111 1.00 25.00 H new ATOM 0 HA PHE A 71 7.079 8.096 3.591 1.00 25.00 H new ATOM 0 HB2 PHE A 71 7.537 8.219 0.612 1.00 25.00 H new ATOM 0 HB3 PHE A 71 6.609 9.306 1.625 1.00 25.00 H new ATOM 0 HD1 PHE A 71 7.921 10.730 3.378 1.00 25.00 H new ATOM 0 HD2 PHE A 71 9.798 8.706 0.077 1.00 25.00 H new ATOM 0 HE1 PHE A 71 9.933 12.171 3.640 1.00 25.00 H new ATOM 0 HE2 PHE A 71 11.814 10.152 0.328 1.00 25.00 H new ATOM 0 HZ PHE A 71 11.891 11.879 2.120 1.00 25.00 H new ATOM 961 N SER A 72 6.961 5.270 2.506 1.00 25.00 N ATOM 962 CA SER A 72 6.175 4.082 2.177 1.00 25.00 C ATOM 963 C SER A 72 4.998 3.938 3.134 1.00 25.00 C ATOM 964 O SER A 72 5.117 4.256 4.317 1.00 25.00 O ATOM 965 CB SER A 72 7.040 2.841 2.310 1.00 25.00 C ATOM 966 OG SER A 72 7.578 2.751 3.621 1.00 25.00 O ATOM 0 H SER A 72 7.870 5.068 2.921 1.00 25.00 H new ATOM 0 HA SER A 72 5.811 4.190 1.155 1.00 25.00 H new ATOM 0 HB2 SER A 72 6.448 1.952 2.091 1.00 25.00 H new ATOM 0 HB3 SER A 72 7.848 2.873 1.580 1.00 25.00 H new ATOM 0 HG SER A 72 8.326 3.378 3.711 1.00 25.00 H new ATOM 972 N ASP A 73 3.887 3.422 2.639 1.00 25.00 N ATOM 973 CA ASP A 73 2.675 3.295 3.443 1.00 25.00 C ATOM 974 C ASP A 73 2.536 1.946 4.117 1.00 25.00 C ATOM 975 O ASP A 73 3.085 0.937 3.660 1.00 25.00 O ATOM 976 CB ASP A 73 1.443 3.534 2.570 1.00 25.00 C ATOM 977 CG ASP A 73 1.319 4.976 2.146 1.00 25.00 C ATOM 978 OD1 ASP A 73 2.126 5.803 2.615 1.00 50.00 O ATOM 979 OD2 ASP A 73 0.444 5.324 1.339 1.00 50.00 O ATOM 0 H ASP A 73 3.795 3.082 1.682 1.00 25.00 H new ATOM 0 HA ASP A 73 2.753 4.047 4.229 1.00 25.00 H new ATOM 0 HB2 ASP A 73 1.498 2.900 1.685 1.00 25.00 H new ATOM 0 HB3 ASP A 73 0.548 3.240 3.118 1.00 25.00 H new ATOM 984 N LEU A 74 1.768 1.945 5.196 1.00 25.00 N ATOM 985 CA LEU A 74 1.432 0.733 5.935 1.00 25.00 C ATOM 986 C LEU A 74 -0.075 0.596 5.828 1.00 25.00 C ATOM 987 O LEU A 74 -0.800 1.555 6.085 1.00 25.00 O ATOM 988 CB LEU A 74 1.807 0.848 7.421 1.00 25.00 C ATOM 989 CG LEU A 74 3.268 0.597 7.831 1.00 25.00 C ATOM 990 CD1 LEU A 74 4.232 1.686 7.336 1.00 25.00 C ATOM 991 CD2 LEU A 74 3.337 0.515 9.359 1.00 25.00 C ATOM 0 H LEU A 74 1.356 2.792 5.588 1.00 25.00 H new ATOM 0 HA LEU A 74 1.975 -0.120 5.527 1.00 25.00 H new ATOM 0 HB2 LEU A 74 1.537 1.850 7.754 1.00 25.00 H new ATOM 0 HB3 LEU A 74 1.182 0.148 7.976 1.00 25.00 H new ATOM 0 HG LEU A 74 3.584 -0.336 7.365 1.00 25.00 H new ATOM 0 HD11 LEU A 74 5.246 1.449 7.659 1.00 25.00 H new ATOM 0 HD12 LEU A 74 4.200 1.733 6.248 1.00 25.00 H new ATOM 0 HD13 LEU A 74 3.936 2.650 7.750 1.00 25.00 H new ATOM 0 HD21 LEU A 74 4.367 0.337 9.668 1.00 25.00 H new ATOM 0 HD22 LEU A 74 2.986 1.453 9.790 1.00 25.00 H new ATOM 0 HD23 LEU A 74 2.707 -0.303 9.708 1.00 25.00 H new ATOM 1003 N ILE A 75 -0.556 -0.581 5.477 1.00 25.00 N ATOM 1004 CA ILE A 75 -1.993 -0.825 5.400 1.00 25.00 C ATOM 1005 C ILE A 75 -2.343 -1.664 6.613 1.00 25.00 C ATOM 1006 O ILE A 75 -1.551 -2.504 7.045 1.00 25.00 O ATOM 1007 CB ILE A 75 -2.400 -1.536 4.092 1.00 25.00 C ATOM 1008 CG1 ILE A 75 -1.808 -0.768 2.875 1.00 25.00 C ATOM 1009 CG2 ILE A 75 -3.937 -1.626 3.962 1.00 25.00 C ATOM 1010 CD1 ILE A 75 -2.159 -1.337 1.489 1.00 25.00 C ATOM 0 H ILE A 75 0.023 -1.387 5.240 1.00 25.00 H new ATOM 0 HA ILE A 75 -2.539 0.119 5.394 1.00 25.00 H new ATOM 0 HB ILE A 75 -2.003 -2.551 4.113 1.00 25.00 H new ATOM 0 HG12 ILE A 75 -2.151 0.266 2.920 1.00 25.00 H new ATOM 0 HG13 ILE A 75 -0.723 -0.748 2.975 1.00 25.00 H new ATOM 0 HG21 ILE A 75 -4.194 -2.131 3.031 1.00 25.00 H new ATOM 0 HG22 ILE A 75 -4.341 -2.188 4.804 1.00 25.00 H new ATOM 0 HG23 ILE A 75 -4.361 -0.622 3.959 1.00 25.00 H new ATOM 0 HD11 ILE A 75 -1.695 -0.725 0.716 1.00 25.00 H new ATOM 0 HD12 ILE A 75 -1.791 -2.360 1.412 1.00 25.00 H new ATOM 0 HD13 ILE A 75 -3.241 -1.330 1.356 1.00 25.00 H new ATOM 1022 N LEU A 76 -3.498 -1.384 7.176 1.00 25.00 N ATOM 1023 CA LEU A 76 -3.974 -1.998 8.412 1.00 25.00 C ATOM 1024 C LEU A 76 -5.357 -2.584 8.146 1.00 25.00 C ATOM 1025 O LEU A 76 -6.095 -2.086 7.287 1.00 25.00 O ATOM 1026 CB LEU A 76 -4.086 -0.937 9.529 1.00 25.00 C ATOM 1027 CG LEU A 76 -2.874 -0.561 10.401 1.00 25.00 C ATOM 1028 CD1 LEU A 76 -2.436 -1.766 11.242 1.00 25.00 C ATOM 1029 CD2 LEU A 76 -1.686 -0.013 9.598 1.00 25.00 C ATOM 0 H LEU A 76 -4.153 -0.708 6.783 1.00 25.00 H new ATOM 0 HA LEU A 76 -3.275 -2.772 8.731 1.00 25.00 H new ATOM 0 HB2 LEU A 76 -4.437 -0.018 9.060 1.00 25.00 H new ATOM 0 HB3 LEU A 76 -4.873 -1.270 10.206 1.00 25.00 H new ATOM 0 HG LEU A 76 -3.202 0.249 11.052 1.00 25.00 H new ATOM 0 HD11 LEU A 76 -1.578 -1.489 11.855 1.00 25.00 H new ATOM 0 HD12 LEU A 76 -3.258 -2.077 11.887 1.00 25.00 H new ATOM 0 HD13 LEU A 76 -2.160 -2.589 10.583 1.00 25.00 H new ATOM 0 HD21 LEU A 76 -0.869 0.231 10.277 1.00 25.00 H new ATOM 0 HD22 LEU A 76 -1.352 -0.765 8.884 1.00 25.00 H new ATOM 0 HD23 LEU A 76 -1.992 0.885 9.062 1.00 25.00 H new ATOM 1041 N ASP A 77 -5.685 -3.635 8.893 1.00 25.00 N ATOM 1042 CA ASP A 77 -6.971 -4.341 8.785 1.00 25.00 C ATOM 1043 C ASP A 77 -7.200 -4.785 7.339 1.00 25.00 C ATOM 1044 O ASP A 77 -8.278 -4.605 6.755 1.00 25.00 O ATOM 1045 CB ASP A 77 -8.137 -3.474 9.284 1.00 25.00 C ATOM 1046 CG ASP A 77 -8.032 -3.150 10.764 1.00 25.00 C ATOM 1047 OD1 ASP A 77 -7.103 -3.633 11.447 1.00 25.00 O ATOM 1048 OD2 ASP A 77 -8.902 -2.391 11.248 1.00 25.00 O ATOM 0 H ASP A 77 -5.063 -4.029 9.599 1.00 25.00 H new ATOM 0 HA ASP A 77 -6.931 -5.223 9.425 1.00 25.00 H new ATOM 0 HB2 ASP A 77 -8.165 -2.546 8.714 1.00 25.00 H new ATOM 0 HB3 ASP A 77 -9.077 -3.992 9.095 1.00 25.00 H new ATOM 1053 N PHE A 78 -6.142 -5.331 6.755 1.00 25.00 N ATOM 1054 CA PHE A 78 -6.166 -5.774 5.373 1.00 25.00 C ATOM 1055 C PHE A 78 -6.746 -7.177 5.247 1.00 25.00 C ATOM 1056 O PHE A 78 -6.299 -8.125 5.903 1.00 25.00 O ATOM 1057 CB PHE A 78 -4.755 -5.744 4.788 1.00 25.00 C ATOM 1058 CG PHE A 78 -4.727 -5.986 3.312 1.00 25.00 C ATOM 1059 CD1 PHE A 78 -5.054 -4.951 2.421 1.00 25.00 C ATOM 1060 CD2 PHE A 78 -4.403 -7.253 2.799 1.00 25.00 C ATOM 1061 CE1 PHE A 78 -5.061 -5.174 1.027 1.00 25.00 C ATOM 1062 CE2 PHE A 78 -4.403 -7.487 1.407 1.00 25.00 C ATOM 1063 CZ PHE A 78 -4.740 -6.445 0.518 1.00 25.00 C ATOM 0 H PHE A 78 -5.249 -5.478 7.225 1.00 25.00 H new ATOM 0 HA PHE A 78 -6.807 -5.091 4.816 1.00 25.00 H new ATOM 0 HB2 PHE A 78 -4.301 -4.776 5.000 1.00 25.00 H new ATOM 0 HB3 PHE A 78 -4.146 -6.498 5.286 1.00 25.00 H new ATOM 0 HD1 PHE A 78 -5.303 -3.973 2.807 1.00 25.00 H new ATOM 0 HD2 PHE A 78 -4.151 -8.056 3.476 1.00 25.00 H new ATOM 0 HE1 PHE A 78 -5.313 -4.369 0.352 1.00 25.00 H new ATOM 0 HE2 PHE A 78 -4.145 -8.463 1.023 1.00 25.00 H new ATOM 0 HZ PHE A 78 -4.751 -6.622 -0.547 1.00 25.00 H new ATOM 1073 N ASP A 79 -7.728 -7.306 4.371 1.00 25.00 N ATOM 1074 CA ASP A 79 -8.376 -8.584 4.086 1.00 25.00 C ATOM 1075 C ASP A 79 -7.833 -9.114 2.761 1.00 25.00 C ATOM 1076 O ASP A 79 -8.283 -8.688 1.702 1.00 25.00 O ATOM 1077 CB ASP A 79 -9.890 -8.389 3.946 1.00 25.00 C ATOM 1078 CG ASP A 79 -10.544 -7.940 5.228 1.00 25.00 C ATOM 1079 OD1 ASP A 79 -10.413 -8.632 6.246 1.00 25.00 O ATOM 1080 OD2 ASP A 79 -11.216 -6.874 5.207 1.00 25.00 O ATOM 0 H ASP A 79 -8.103 -6.525 3.832 1.00 25.00 H new ATOM 0 HA ASP A 79 -8.175 -9.281 4.899 1.00 25.00 H new ATOM 0 HB2 ASP A 79 -10.086 -7.653 3.167 1.00 25.00 H new ATOM 0 HB3 ASP A 79 -10.343 -9.325 3.621 1.00 25.00 H new ATOM 1085 N PRO A 80 -6.894 -10.074 2.784 1.00 25.00 N ATOM 1086 CA PRO A 80 -6.344 -10.554 1.506 1.00 25.00 C ATOM 1087 C PRO A 80 -7.317 -11.354 0.639 1.00 25.00 C ATOM 1088 O PRO A 80 -7.014 -11.703 -0.498 1.00 25.00 O ATOM 1089 CB PRO A 80 -5.171 -11.427 1.953 1.00 25.00 C ATOM 1090 CG PRO A 80 -5.588 -11.928 3.276 1.00 25.00 C ATOM 1091 CD PRO A 80 -6.250 -10.752 3.924 1.00 25.00 C ATOM 0 HA PRO A 80 -6.079 -9.717 0.859 1.00 25.00 H new ATOM 0 HB2 PRO A 80 -4.992 -12.244 1.254 1.00 25.00 H new ATOM 0 HB3 PRO A 80 -4.247 -10.853 2.016 1.00 25.00 H new ATOM 0 HG2 PRO A 80 -6.274 -12.770 3.185 1.00 25.00 H new ATOM 0 HG3 PRO A 80 -4.734 -12.274 3.858 1.00 25.00 H new ATOM 0 HD2 PRO A 80 -6.977 -11.060 4.675 1.00 25.00 H new ATOM 0 HD3 PRO A 80 -5.529 -10.106 4.424 1.00 25.00 H new ATOM 1099 N SER A 81 -8.508 -11.609 1.164 1.00 25.00 N ATOM 1100 CA SER A 81 -9.546 -12.305 0.412 1.00 25.00 C ATOM 1101 C SER A 81 -10.565 -11.326 -0.197 1.00 25.00 C ATOM 1102 O SER A 81 -11.508 -11.762 -0.860 1.00 25.00 O ATOM 1103 CB SER A 81 -10.269 -13.282 1.341 1.00 25.00 C ATOM 1104 OG SER A 81 -11.184 -14.091 0.624 1.00 25.00 O ATOM 0 H SER A 81 -8.781 -11.344 2.110 1.00 25.00 H new ATOM 0 HA SER A 81 -9.068 -12.841 -0.408 1.00 25.00 H new ATOM 0 HB2 SER A 81 -9.539 -13.915 1.846 1.00 25.00 H new ATOM 0 HB3 SER A 81 -10.800 -12.727 2.115 1.00 25.00 H new ATOM 0 HG SER A 81 -11.597 -13.563 -0.091 1.00 25.00 H new ATOM 1110 N GLN A 82 -10.429 -10.032 0.089 1.00 25.00 N ATOM 1111 CA GLN A 82 -11.427 -9.027 -0.334 1.00 25.00 C ATOM 1112 C GLN A 82 -10.836 -7.691 -0.802 1.00 25.00 C ATOM 1113 O GLN A 82 -11.368 -7.065 -1.707 1.00 25.00 O ATOM 1114 CB GLN A 82 -12.373 -8.708 0.838 1.00 25.00 C ATOM 1115 CG GLN A 82 -13.299 -9.851 1.264 1.00 25.00 C ATOM 1116 CD GLN A 82 -14.438 -10.068 0.281 1.00 25.00 C ATOM 1117 OE1 GLN A 82 -15.406 -9.332 0.287 1.00 25.00 O ATOM 1118 NE2 GLN A 82 -14.331 -11.073 -0.549 1.00 25.00 N ATOM 0 H GLN A 82 -9.642 -9.647 0.611 1.00 25.00 H new ATOM 0 HA GLN A 82 -11.937 -9.482 -1.183 1.00 25.00 H new ATOM 0 HB2 GLN A 82 -11.772 -8.410 1.697 1.00 25.00 H new ATOM 0 HB3 GLN A 82 -12.986 -7.849 0.565 1.00 25.00 H new ATOM 0 HG2 GLN A 82 -12.720 -10.770 1.354 1.00 25.00 H new ATOM 0 HG3 GLN A 82 -13.710 -9.635 2.250 1.00 25.00 H new ATOM 0 HE21 GLN A 82 -13.504 -11.669 -0.524 1.00 25.00 H new ATOM 0 HE22 GLN A 82 -15.075 -11.261 -1.221 1.00 25.00 H new ATOM 1127 N ASP A 83 -9.791 -7.230 -0.134 1.00 25.00 N ATOM 1128 CA ASP A 83 -9.244 -5.899 -0.381 1.00 25.00 C ATOM 1129 C ASP A 83 -8.318 -5.883 -1.604 1.00 25.00 C ATOM 1130 O ASP A 83 -7.788 -6.923 -2.012 1.00 25.00 O ATOM 1131 CB ASP A 83 -8.473 -5.407 0.856 1.00 25.00 C ATOM 1132 CG ASP A 83 -9.380 -5.132 2.057 1.00 25.00 C ATOM 1133 OD1 ASP A 83 -10.617 -5.108 1.929 1.00 50.00 O ATOM 1134 OD2 ASP A 83 -8.854 -4.943 3.176 1.00 50.00 O ATOM 0 H ASP A 83 -9.300 -7.758 0.587 1.00 25.00 H new ATOM 0 HA ASP A 83 -10.082 -5.232 -0.583 1.00 25.00 H new ATOM 0 HB2 ASP A 83 -7.729 -6.153 1.134 1.00 25.00 H new ATOM 0 HB3 ASP A 83 -7.931 -4.496 0.601 1.00 25.00 H new ATOM 1139 N LYS A 84 -8.112 -4.703 -2.182 1.00 25.00 N ATOM 1140 CA LYS A 84 -7.282 -4.554 -3.382 1.00 25.00 C ATOM 1141 C LYS A 84 -6.293 -3.402 -3.249 1.00 25.00 C ATOM 1142 O LYS A 84 -6.548 -2.454 -2.516 1.00 25.00 O ATOM 1143 CB LYS A 84 -8.199 -4.311 -4.588 1.00 25.00 C ATOM 1144 CG LYS A 84 -7.682 -4.874 -5.908 1.00 25.00 C ATOM 1145 CD LYS A 84 -7.821 -6.390 -5.958 1.00 25.00 C ATOM 1146 CE LYS A 84 -7.311 -6.925 -7.278 1.00 25.00 C ATOM 1147 NZ LYS A 84 -7.497 -8.395 -7.365 1.00 25.00 N ATOM 0 H LYS A 84 -8.510 -3.829 -1.839 1.00 25.00 H new ATOM 0 HA LYS A 84 -6.703 -5.468 -3.516 1.00 25.00 H new ATOM 0 HB2 LYS A 84 -9.175 -4.750 -4.379 1.00 25.00 H new ATOM 0 HB3 LYS A 84 -8.350 -3.237 -4.701 1.00 25.00 H new ATOM 0 HG2 LYS A 84 -8.234 -4.429 -6.736 1.00 25.00 H new ATOM 0 HG3 LYS A 84 -6.635 -4.599 -6.038 1.00 25.00 H new ATOM 0 HD2 LYS A 84 -7.263 -6.840 -5.137 1.00 25.00 H new ATOM 0 HD3 LYS A 84 -8.866 -6.670 -5.825 1.00 25.00 H new ATOM 0 HE2 LYS A 84 -7.838 -6.439 -8.099 1.00 25.00 H new ATOM 0 HE3 LYS A 84 -6.254 -6.682 -7.389 1.00 25.00 H new ATOM 0 HZ1 LYS A 84 -7.365 -8.704 -8.349 1.00 25.00 H new ATOM 0 HZ2 LYS A 84 -6.800 -8.870 -6.757 1.00 25.00 H new ATOM 0 HZ3 LYS A 84 -8.457 -8.643 -7.050 1.00 25.00 H new ATOM 1161 N ILE A 85 -5.171 -3.486 -3.952 1.00 25.00 N ATOM 1162 CA ILE A 85 -4.151 -2.435 -3.911 1.00 25.00 C ATOM 1163 C ILE A 85 -3.726 -2.025 -5.328 1.00 25.00 C ATOM 1164 O ILE A 85 -3.209 -2.846 -6.099 1.00 25.00 O ATOM 1165 CB ILE A 85 -2.867 -2.895 -3.138 1.00 25.00 C ATOM 1166 CG1 ILE A 85 -3.229 -3.597 -1.806 1.00 25.00 C ATOM 1167 CG2 ILE A 85 -1.950 -1.665 -2.847 1.00 25.00 C ATOM 1168 CD1 ILE A 85 -2.023 -4.237 -1.084 1.00 25.00 C ATOM 0 H ILE A 85 -4.940 -4.271 -4.560 1.00 25.00 H new ATOM 0 HA ILE A 85 -4.605 -1.591 -3.391 1.00 25.00 H new ATOM 0 HB ILE A 85 -2.337 -3.610 -3.768 1.00 25.00 H new ATOM 0 HG12 ILE A 85 -3.695 -2.871 -1.140 1.00 25.00 H new ATOM 0 HG13 ILE A 85 -3.972 -4.369 -2.005 1.00 25.00 H new ATOM 0 HG21 ILE A 85 -1.060 -1.993 -2.310 1.00 25.00 H new ATOM 0 HG22 ILE A 85 -1.655 -1.200 -3.788 1.00 25.00 H new ATOM 0 HG23 ILE A 85 -2.494 -0.941 -2.240 1.00 25.00 H new ATOM 0 HD11 ILE A 85 -2.360 -4.708 -0.160 1.00 25.00 H new ATOM 0 HD12 ILE A 85 -1.569 -4.989 -1.730 1.00 25.00 H new ATOM 0 HD13 ILE A 85 -1.288 -3.467 -0.851 1.00 25.00 H new ATOM 1180 N ASP A 86 -3.908 -0.757 -5.662 1.00 25.00 N ATOM 1181 CA ASP A 86 -3.472 -0.219 -6.950 1.00 25.00 C ATOM 1182 C ASP A 86 -2.113 0.457 -6.781 1.00 25.00 C ATOM 1183 O ASP A 86 -1.977 1.421 -6.027 1.00 25.00 O ATOM 1184 CB ASP A 86 -4.476 0.809 -7.468 1.00 25.00 C ATOM 1185 CG ASP A 86 -5.369 0.252 -8.557 1.00 25.00 C ATOM 1186 OD1 ASP A 86 -6.379 -0.405 -8.232 1.00 25.00 O ATOM 1187 OD2 ASP A 86 -5.049 0.464 -9.746 1.00 25.00 O ATOM 0 H ASP A 86 -4.359 -0.072 -5.055 1.00 25.00 H new ATOM 0 HA ASP A 86 -3.400 -1.039 -7.665 1.00 25.00 H new ATOM 0 HB2 ASP A 86 -5.093 1.158 -6.640 1.00 25.00 H new ATOM 0 HB3 ASP A 86 -3.938 1.676 -7.852 1.00 25.00 H new ATOM 1192 N VAL A 87 -1.112 -0.043 -7.496 1.00 25.00 N ATOM 1193 CA VAL A 87 0.255 0.512 -7.452 1.00 25.00 C ATOM 1194 C VAL A 87 0.754 0.744 -8.879 1.00 25.00 C ATOM 1195 O VAL A 87 1.949 0.729 -9.166 1.00 25.00 O ATOM 1196 CB VAL A 87 1.236 -0.437 -6.693 1.00 25.00 C ATOM 1197 CG1 VAL A 87 0.862 -0.535 -5.216 1.00 25.00 C ATOM 1198 CG2 VAL A 87 1.238 -1.845 -7.313 1.00 25.00 C ATOM 0 H VAL A 87 -1.214 -0.841 -8.123 1.00 25.00 H new ATOM 0 HA VAL A 87 0.223 1.457 -6.910 1.00 25.00 H new ATOM 0 HB VAL A 87 2.235 -0.011 -6.783 1.00 25.00 H new ATOM 0 HG11 VAL A 87 1.559 -1.201 -4.708 1.00 25.00 H new ATOM 0 HG12 VAL A 87 0.910 0.455 -4.762 1.00 25.00 H new ATOM 0 HG13 VAL A 87 -0.150 -0.929 -5.122 1.00 25.00 H new ATOM 0 HG21 VAL A 87 1.930 -2.483 -6.764 1.00 25.00 H new ATOM 0 HG22 VAL A 87 0.235 -2.267 -7.260 1.00 25.00 H new ATOM 0 HG23 VAL A 87 1.551 -1.783 -8.355 1.00 25.00 H new ATOM 1208 N SER A 88 -0.192 0.930 -9.785 1.00 25.00 N ATOM 1209 CA SER A 88 0.085 1.046 -11.215 1.00 25.00 C ATOM 1210 C SER A 88 0.982 2.227 -11.617 1.00 25.00 C ATOM 1211 O SER A 88 1.485 2.266 -12.729 1.00 25.00 O ATOM 1212 CB SER A 88 -1.259 1.148 -11.923 1.00 25.00 C ATOM 1213 OG SER A 88 -2.248 0.562 -11.082 1.00 25.00 O ATOM 0 H SER A 88 -1.182 1.006 -9.551 1.00 25.00 H new ATOM 0 HA SER A 88 0.655 0.164 -11.509 1.00 25.00 H new ATOM 0 HB2 SER A 88 -1.503 2.190 -12.128 1.00 25.00 H new ATOM 0 HB3 SER A 88 -1.223 0.634 -12.884 1.00 25.00 H new ATOM 0 HG SER A 88 -3.124 0.618 -11.518 1.00 25.00 H new ATOM 1219 N ALA A 89 1.193 3.173 -10.709 1.00 25.00 N ATOM 1220 CA ALA A 89 2.063 4.322 -10.980 1.00 25.00 C ATOM 1221 C ALA A 89 3.546 3.955 -10.997 1.00 25.00 C ATOM 1222 O ALA A 89 4.360 4.731 -11.486 1.00 25.00 O ATOM 1223 CB ALA A 89 1.829 5.408 -9.947 1.00 25.00 C ATOM 0 H ALA A 89 0.776 3.171 -9.778 1.00 25.00 H new ATOM 0 HA ALA A 89 1.803 4.681 -11.976 1.00 25.00 H new ATOM 0 HB1 ALA A 89 2.480 6.257 -10.157 1.00 25.00 H new ATOM 0 HB2 ALA A 89 0.788 5.730 -9.987 1.00 25.00 H new ATOM 0 HB3 ALA A 89 2.050 5.019 -8.953 1.00 25.00 H new ATOM 1229 N LEU A 90 3.894 2.811 -10.422 1.00 25.00 N ATOM 1230 CA LEU A 90 5.291 2.377 -10.387 1.00 25.00 C ATOM 1231 C LEU A 90 5.558 1.622 -11.675 1.00 25.00 C ATOM 1232 O LEU A 90 6.469 1.924 -12.436 1.00 25.00 O ATOM 1233 CB LEU A 90 5.558 1.444 -9.190 1.00 25.00 C ATOM 1234 CG LEU A 90 5.006 1.892 -7.829 1.00 25.00 C ATOM 1235 CD1 LEU A 90 5.281 0.808 -6.786 1.00 25.00 C ATOM 1236 CD2 LEU A 90 5.608 3.221 -7.373 1.00 25.00 C ATOM 0 H LEU A 90 3.238 2.170 -9.976 1.00 25.00 H new ATOM 0 HA LEU A 90 5.942 3.245 -10.283 1.00 25.00 H new ATOM 0 HB2 LEU A 90 5.138 0.465 -9.422 1.00 25.00 H new ATOM 0 HB3 LEU A 90 6.636 1.314 -9.094 1.00 25.00 H new ATOM 0 HG LEU A 90 3.932 2.043 -7.937 1.00 25.00 H new ATOM 0 HD11 LEU A 90 4.889 1.125 -5.820 1.00 25.00 H new ATOM 0 HD12 LEU A 90 4.794 -0.119 -7.088 1.00 25.00 H new ATOM 0 HD13 LEU A 90 6.356 0.644 -6.706 1.00 25.00 H new ATOM 0 HD21 LEU A 90 5.188 3.498 -6.406 1.00 25.00 H new ATOM 0 HD22 LEU A 90 6.689 3.119 -7.283 1.00 25.00 H new ATOM 0 HD23 LEU A 90 5.376 3.995 -8.104 1.00 25.00 H new ATOM 1248 N GLY A 91 4.699 0.640 -11.908 1.00 25.00 N ATOM 1249 CA GLY A 91 4.844 -0.237 -13.056 1.00 25.00 C ATOM 1250 C GLY A 91 5.864 -1.311 -12.738 1.00 25.00 C ATOM 1251 O GLY A 91 6.635 -1.172 -11.797 1.00 25.00 O ATOM 0 H GLY A 91 3.895 0.432 -11.316 1.00 25.00 H new ATOM 0 HA2 GLY A 91 3.885 -0.692 -13.304 1.00 25.00 H new ATOM 0 HA3 GLY A 91 5.161 0.335 -13.928 1.00 25.00 H new ATOM 1327 N ASN A 97 11.634 -10.223 -9.118 1.00 25.00 N ATOM 1328 CA ASN A 97 12.892 -10.529 -8.423 1.00 25.00 C ATOM 1329 C ASN A 97 13.024 -9.667 -7.162 1.00 25.00 C ATOM 1330 O ASN A 97 13.930 -9.868 -6.364 1.00 25.00 O ATOM 1331 CB ASN A 97 14.099 -10.238 -9.324 1.00 25.00 C ATOM 1332 CG ASN A 97 14.057 -10.992 -10.627 1.00 25.00 C ATOM 1333 OD1 ASN A 97 13.576 -12.103 -10.709 1.00 25.00 O ATOM 1334 ND2 ASN A 97 14.570 -10.380 -11.659 1.00 25.00 N ATOM 0 HA ASN A 97 12.874 -11.587 -8.161 1.00 25.00 H new ATOM 0 HB2 ASN A 97 14.141 -9.169 -9.531 1.00 25.00 H new ATOM 0 HB3 ASN A 97 15.014 -10.496 -8.791 1.00 25.00 H new ATOM 0 HD21 ASN A 97 14.575 -10.836 -12.572 1.00 25.00 H new ATOM 0 HD22 ASN A 97 14.966 -9.446 -11.553 1.00 25.00 H new ATOM 1341 N GLY A 98 12.162 -8.670 -7.023 1.00 25.00 N ATOM 1342 CA GLY A 98 12.231 -7.744 -5.895 1.00 25.00 C ATOM 1343 C GLY A 98 13.208 -6.603 -6.083 1.00 25.00 C ATOM 1344 O GLY A 98 13.403 -5.782 -5.180 1.00 25.00 O ATOM 0 H GLY A 98 11.404 -8.479 -7.678 1.00 25.00 H new ATOM 0 HA2 GLY A 98 11.238 -7.331 -5.718 1.00 25.00 H new ATOM 0 HA3 GLY A 98 12.509 -8.301 -5.000 1.00 25.00 H new ATOM 1348 N TYR A 99 13.842 -6.564 -7.247 1.00 25.00 N ATOM 1349 CA TYR A 99 14.825 -5.534 -7.562 1.00 25.00 C ATOM 1350 C TYR A 99 14.656 -5.086 -9.001 1.00 25.00 C ATOM 1351 O TYR A 99 14.235 -5.875 -9.841 1.00 25.00 O ATOM 1352 CB TYR A 99 16.251 -6.069 -7.368 1.00 25.00 C ATOM 1353 CG TYR A 99 16.525 -6.597 -5.974 1.00 25.00 C ATOM 1354 CD1 TYR A 99 16.873 -5.722 -4.926 1.00 25.00 C ATOM 1355 CD2 TYR A 99 16.427 -7.976 -5.692 1.00 25.00 C ATOM 1356 CE1 TYR A 99 17.115 -6.219 -3.614 1.00 25.00 C ATOM 1357 CE2 TYR A 99 16.661 -8.472 -4.387 1.00 25.00 C ATOM 1358 CZ TYR A 99 17.001 -7.587 -3.360 1.00 25.00 C ATOM 1359 OH TYR A 99 17.224 -8.063 -2.093 1.00 25.00 O ATOM 0 H TYR A 99 13.692 -7.240 -7.996 1.00 25.00 H new ATOM 0 HA TYR A 99 14.666 -4.691 -6.889 1.00 25.00 H new ATOM 0 HB2 TYR A 99 16.431 -6.866 -8.089 1.00 25.00 H new ATOM 0 HB3 TYR A 99 16.961 -5.272 -7.590 1.00 25.00 H new ATOM 0 HD1 TYR A 99 16.957 -4.663 -5.120 1.00 25.00 H new ATOM 0 HD2 TYR A 99 16.170 -8.664 -6.484 1.00 25.00 H new ATOM 0 HE1 TYR A 99 17.386 -5.541 -2.819 1.00 25.00 H new ATOM 0 HE2 TYR A 99 16.577 -9.530 -4.186 1.00 25.00 H new ATOM 0 HH TYR A 99 17.104 -9.036 -2.083 1.00 25.00 H new ATOM 1369 N ALA A 100 15.042 -3.846 -9.278 1.00 25.00 N ATOM 1370 CA ALA A 100 15.031 -3.270 -10.625 1.00 25.00 C ATOM 1371 C ALA A 100 13.647 -3.269 -11.288 1.00 25.00 C ATOM 1372 O ALA A 100 13.509 -3.649 -12.450 1.00 25.00 O ATOM 1373 CB ALA A 100 16.083 -3.979 -11.522 1.00 25.00 C ATOM 0 H ALA A 100 15.377 -3.199 -8.564 1.00 25.00 H new ATOM 0 HA ALA A 100 15.300 -2.220 -10.514 1.00 25.00 H new ATOM 0 HB1 ALA A 100 16.064 -3.541 -12.520 1.00 25.00 H new ATOM 0 HB2 ALA A 100 17.075 -3.852 -11.089 1.00 25.00 H new ATOM 0 HB3 ALA A 100 15.849 -5.041 -11.587 1.00 25.00 H new ATOM 1379 N GLY A 101 12.641 -2.802 -10.561 1.00 25.00 N ATOM 1380 CA GLY A 101 11.313 -2.650 -11.138 1.00 25.00 C ATOM 1381 C GLY A 101 10.602 -3.976 -11.266 1.00 25.00 C ATOM 1382 O GLY A 101 9.814 -4.196 -12.186 1.00 25.00 O ATOM 0 H GLY A 101 12.717 -2.525 -9.582 1.00 25.00 H new ATOM 0 HA2 GLY A 101 10.721 -1.979 -10.516 1.00 25.00 H new ATOM 0 HA3 GLY A 101 11.395 -2.185 -12.120 1.00 25.00 H new ATOM 1386 N THR A 102 10.890 -4.887 -10.350 1.00 25.00 N ATOM 1387 CA THR A 102 10.246 -6.197 -10.345 1.00 25.00 C ATOM 1388 C THR A 102 9.854 -6.456 -8.900 1.00 25.00 C ATOM 1389 O THR A 102 10.499 -5.947 -7.999 1.00 25.00 O ATOM 1390 CB THR A 102 11.183 -7.312 -10.847 1.00 25.00 C ATOM 1391 OG1 THR A 102 12.191 -7.554 -9.873 1.00 25.00 O ATOM 1392 CG2 THR A 102 11.888 -6.934 -12.134 1.00 25.00 C ATOM 0 H THR A 102 11.565 -4.746 -9.599 1.00 25.00 H new ATOM 0 HA THR A 102 9.389 -6.200 -11.018 1.00 25.00 H new ATOM 0 HB THR A 102 10.564 -8.191 -11.024 1.00 25.00 H new ATOM 0 HG1 THR A 102 12.994 -7.040 -10.099 1.00 25.00 H new ATOM 0 HG21 THR A 102 12.537 -7.752 -12.447 1.00 25.00 H new ATOM 0 HG22 THR A 102 11.148 -6.740 -12.911 1.00 25.00 H new ATOM 0 HG23 THR A 102 12.487 -6.038 -11.971 1.00 25.00 H new ATOM 1400 N LEU A 103 8.778 -7.196 -8.675 1.00 25.00 N ATOM 1401 CA LEU A 103 8.202 -7.306 -7.328 1.00 25.00 C ATOM 1402 C LEU A 103 8.648 -8.507 -6.501 1.00 25.00 C ATOM 1403 O LEU A 103 8.869 -9.583 -7.025 1.00 25.00 O ATOM 1404 CB LEU A 103 6.678 -7.366 -7.453 1.00 25.00 C ATOM 1405 CG LEU A 103 5.913 -6.165 -6.883 1.00 25.00 C ATOM 1406 CD1 LEU A 103 4.464 -6.274 -7.316 1.00 25.00 C ATOM 1407 CD2 LEU A 103 5.988 -6.087 -5.351 1.00 25.00 C ATOM 0 H LEU A 103 8.285 -7.726 -9.394 1.00 25.00 H new ATOM 0 HA LEU A 103 8.566 -6.428 -6.795 1.00 25.00 H new ATOM 0 HB2 LEU A 103 6.423 -7.468 -8.508 1.00 25.00 H new ATOM 0 HB3 LEU A 103 6.327 -8.268 -6.952 1.00 25.00 H new ATOM 0 HG LEU A 103 6.374 -5.256 -7.268 1.00 25.00 H new ATOM 0 HD11 LEU A 103 3.901 -5.428 -6.921 1.00 25.00 H new ATOM 0 HD12 LEU A 103 4.408 -6.270 -8.405 1.00 25.00 H new ATOM 0 HD13 LEU A 103 4.039 -7.202 -6.935 1.00 25.00 H new ATOM 0 HD21 LEU A 103 5.429 -5.218 -5.003 1.00 25.00 H new ATOM 0 HD22 LEU A 103 5.559 -6.991 -4.919 1.00 25.00 H new ATOM 0 HD23 LEU A 103 7.029 -5.996 -5.042 1.00 25.00 H new ATOM 1419 N ALA A 104 8.668 -8.339 -5.191 1.00 25.00 N ATOM 1420 CA ALA A 104 8.829 -9.454 -4.264 1.00 25.00 C ATOM 1421 C ALA A 104 7.995 -9.143 -3.033 1.00 25.00 C ATOM 1422 O ALA A 104 7.670 -7.977 -2.770 1.00 25.00 O ATOM 1423 CB ALA A 104 10.294 -9.658 -3.875 1.00 25.00 C ATOM 0 H ALA A 104 8.574 -7.430 -4.737 1.00 25.00 H new ATOM 0 HA ALA A 104 8.499 -10.378 -4.739 1.00 25.00 H new ATOM 0 HB1 ALA A 104 10.373 -10.497 -3.184 1.00 25.00 H new ATOM 0 HB2 ALA A 104 10.882 -9.867 -4.769 1.00 25.00 H new ATOM 0 HB3 ALA A 104 10.672 -8.755 -3.395 1.00 25.00 H new ATOM 1429 N VAL A 105 7.689 -10.184 -2.274 1.00 25.00 N ATOM 1430 CA VAL A 105 6.930 -10.063 -1.044 1.00 25.00 C ATOM 1431 C VAL A 105 7.757 -10.722 0.062 1.00 25.00 C ATOM 1432 O VAL A 105 8.575 -11.600 -0.206 1.00 25.00 O ATOM 1433 CB VAL A 105 5.524 -10.736 -1.211 1.00 25.00 C ATOM 1434 CG1 VAL A 105 5.637 -12.263 -1.392 1.00 25.00 C ATOM 1435 CG2 VAL A 105 4.589 -10.411 -0.036 1.00 25.00 C ATOM 0 H VAL A 105 7.963 -11.141 -2.497 1.00 25.00 H new ATOM 0 HA VAL A 105 6.745 -9.020 -0.788 1.00 25.00 H new ATOM 0 HB VAL A 105 5.089 -10.316 -2.118 1.00 25.00 H new ATOM 0 HG11 VAL A 105 4.641 -12.691 -1.504 1.00 25.00 H new ATOM 0 HG12 VAL A 105 6.228 -12.481 -2.282 1.00 25.00 H new ATOM 0 HG13 VAL A 105 6.122 -12.698 -0.518 1.00 25.00 H new ATOM 0 HG21 VAL A 105 3.626 -10.897 -0.192 1.00 25.00 H new ATOM 0 HG22 VAL A 105 5.032 -10.773 0.892 1.00 25.00 H new ATOM 0 HG23 VAL A 105 4.445 -9.332 0.027 1.00 25.00 H new ATOM 1445 N SER A 106 7.584 -10.268 1.289 1.00 25.00 N ATOM 1446 CA SER A 106 8.294 -10.826 2.437 1.00 25.00 C ATOM 1447 C SER A 106 7.361 -10.778 3.634 1.00 25.00 C ATOM 1448 O SER A 106 6.386 -10.030 3.618 1.00 25.00 O ATOM 1449 CB SER A 106 9.552 -10.012 2.726 1.00 25.00 C ATOM 1450 OG SER A 106 10.401 -9.985 1.590 1.00 25.00 O ATOM 0 H SER A 106 6.950 -9.504 1.523 1.00 25.00 H new ATOM 0 HA SER A 106 8.594 -11.853 2.229 1.00 25.00 H new ATOM 0 HB2 SER A 106 9.277 -8.995 3.006 1.00 25.00 H new ATOM 0 HB3 SER A 106 10.084 -10.443 3.574 1.00 25.00 H new ATOM 0 HG SER A 106 11.202 -9.458 1.793 1.00 25.00 H new ATOM 1456 N LEU A 107 7.654 -11.556 4.665 1.00 25.00 N ATOM 1457 CA LEU A 107 6.850 -11.586 5.885 1.00 25.00 C ATOM 1458 C LEU A 107 7.783 -11.372 7.061 1.00 25.00 C ATOM 1459 O LEU A 107 8.989 -11.570 6.932 1.00 25.00 O ATOM 1460 CB LEU A 107 6.156 -12.953 6.042 1.00 25.00 C ATOM 1461 CG LEU A 107 4.993 -13.274 5.088 1.00 25.00 C ATOM 1462 CD1 LEU A 107 4.652 -14.755 5.168 1.00 25.00 C ATOM 1463 CD2 LEU A 107 3.757 -12.446 5.433 1.00 25.00 C ATOM 0 H LEU A 107 8.456 -12.186 4.683 1.00 25.00 H new ATOM 0 HA LEU A 107 6.085 -10.810 5.839 1.00 25.00 H new ATOM 0 HB2 LEU A 107 6.912 -13.729 5.924 1.00 25.00 H new ATOM 0 HB3 LEU A 107 5.783 -13.025 7.063 1.00 25.00 H new ATOM 0 HG LEU A 107 5.306 -13.023 4.074 1.00 25.00 H new ATOM 0 HD11 LEU A 107 3.828 -14.976 4.490 1.00 25.00 H new ATOM 0 HD12 LEU A 107 5.523 -15.345 4.884 1.00 25.00 H new ATOM 0 HD13 LEU A 107 4.360 -15.007 6.188 1.00 25.00 H new ATOM 0 HD21 LEU A 107 2.950 -12.692 4.743 1.00 25.00 H new ATOM 0 HD22 LEU A 107 3.443 -12.668 6.453 1.00 25.00 H new ATOM 0 HD23 LEU A 107 3.995 -11.385 5.349 1.00 25.00 H new ATOM 1534 N ARG A 113 3.441 -9.359 9.930 1.00 25.00 N ATOM 1535 CA ARG A 113 3.620 -8.210 9.040 1.00 25.00 C ATOM 1536 C ARG A 113 4.023 -8.730 7.689 1.00 25.00 C ATOM 1537 O ARG A 113 4.612 -9.804 7.587 1.00 25.00 O ATOM 1538 CB ARG A 113 4.699 -7.264 9.566 1.00 25.00 C ATOM 1539 CG ARG A 113 4.279 -6.518 10.798 1.00 25.00 C ATOM 1540 CD ARG A 113 5.276 -5.443 11.145 1.00 25.00 C ATOM 1541 NE ARG A 113 4.633 -4.419 11.974 1.00 25.00 N ATOM 1542 CZ ARG A 113 4.612 -4.381 13.299 1.00 25.00 C ATOM 1543 NH1 ARG A 113 5.236 -5.260 14.047 1.00 25.00 N ATOM 1544 NH2 ARG A 113 3.931 -3.433 13.872 1.00 25.00 N ATOM 0 HA ARG A 113 2.687 -7.650 8.982 1.00 25.00 H new ATOM 0 HB2 ARG A 113 5.600 -7.837 9.785 1.00 25.00 H new ATOM 0 HB3 ARG A 113 4.958 -6.548 8.786 1.00 25.00 H new ATOM 0 HG2 ARG A 113 3.297 -6.071 10.640 1.00 25.00 H new ATOM 0 HG3 ARG A 113 4.182 -7.212 11.633 1.00 25.00 H new ATOM 0 HD2 ARG A 113 6.122 -5.877 11.678 1.00 25.00 H new ATOM 0 HD3 ARG A 113 5.670 -4.992 10.234 1.00 25.00 H new ATOM 0 HE ARG A 113 4.156 -3.663 11.484 1.00 25.00 H new ATOM 0 HH11 ARG A 113 5.767 -6.015 13.612 1.00 25.00 H new ATOM 0 HH12 ARG A 113 5.190 -5.189 15.063 1.00 25.00 H new ATOM 0 HH21 ARG A 113 3.434 -2.747 13.304 1.00 25.00 H new ATOM 0 HH22 ARG A 113 3.894 -3.375 14.890 1.00 25.00 H new ATOM 1558 N THR A 114 3.722 -7.959 6.664 1.00 25.00 N ATOM 1559 CA THR A 114 4.047 -8.317 5.285 1.00 25.00 C ATOM 1560 C THR A 114 4.698 -7.097 4.654 1.00 25.00 C ATOM 1561 O THR A 114 4.413 -5.972 5.056 1.00 25.00 O ATOM 1562 CB THR A 114 2.763 -8.706 4.515 1.00 25.00 C ATOM 1563 OG1 THR A 114 2.005 -9.623 5.307 1.00 25.00 O ATOM 1564 CG2 THR A 114 3.060 -9.371 3.180 1.00 25.00 C ATOM 0 H THR A 114 3.244 -7.063 6.757 1.00 25.00 H new ATOM 0 HA THR A 114 4.719 -9.174 5.252 1.00 25.00 H new ATOM 0 HB THR A 114 2.212 -7.785 4.321 1.00 25.00 H new ATOM 0 HG1 THR A 114 1.618 -9.151 6.074 1.00 25.00 H new ATOM 0 HG21 THR A 114 2.123 -9.623 2.683 1.00 25.00 H new ATOM 0 HG22 THR A 114 3.632 -8.688 2.552 1.00 25.00 H new ATOM 0 HG23 THR A 114 3.638 -10.280 3.347 1.00 25.00 H new ATOM 1572 N TYR A 115 5.586 -7.312 3.701 1.00 25.00 N ATOM 1573 CA TYR A 115 6.305 -6.226 3.046 1.00 25.00 C ATOM 1574 C TYR A 115 6.326 -6.495 1.551 1.00 25.00 C ATOM 1575 O TYR A 115 6.332 -7.655 1.142 1.00 25.00 O ATOM 1576 CB TYR A 115 7.736 -6.163 3.587 1.00 25.00 C ATOM 1577 CG TYR A 115 7.806 -6.216 5.105 1.00 25.00 C ATOM 1578 CD1 TYR A 115 7.572 -5.066 5.884 1.00 25.00 C ATOM 1579 CD2 TYR A 115 8.100 -7.430 5.773 1.00 25.00 C ATOM 1580 CE1 TYR A 115 7.632 -5.118 7.304 1.00 25.00 C ATOM 1581 CE2 TYR A 115 8.163 -7.485 7.190 1.00 25.00 C ATOM 1582 CZ TYR A 115 7.929 -6.328 7.940 1.00 25.00 C ATOM 1583 OH TYR A 115 8.001 -6.374 9.307 1.00 25.00 O ATOM 0 H TYR A 115 5.831 -8.240 3.357 1.00 25.00 H new ATOM 0 HA TYR A 115 5.813 -5.273 3.242 1.00 25.00 H new ATOM 0 HB2 TYR A 115 8.310 -6.992 3.174 1.00 25.00 H new ATOM 0 HB3 TYR A 115 8.209 -5.244 3.240 1.00 25.00 H new ATOM 0 HD1 TYR A 115 7.343 -4.130 5.395 1.00 25.00 H new ATOM 0 HD2 TYR A 115 8.279 -8.326 5.197 1.00 25.00 H new ATOM 0 HE1 TYR A 115 7.449 -4.228 7.888 1.00 25.00 H new ATOM 0 HE2 TYR A 115 8.391 -8.416 7.687 1.00 25.00 H new ATOM 0 HH TYR A 115 8.215 -7.287 9.593 1.00 25.00 H new ATOM 1593 N LEU A 116 6.336 -5.441 0.749 1.00 25.00 N ATOM 1594 CA LEU A 116 6.381 -5.549 -0.711 1.00 25.00 C ATOM 1595 C LEU A 116 7.489 -4.630 -1.204 1.00 25.00 C ATOM 1596 O LEU A 116 7.633 -3.522 -0.687 1.00 25.00 O ATOM 1597 CB LEU A 116 5.051 -5.091 -1.315 1.00 25.00 C ATOM 1598 CG LEU A 116 3.837 -6.005 -1.087 1.00 25.00 C ATOM 1599 CD1 LEU A 116 2.547 -5.229 -1.360 1.00 25.00 C ATOM 1600 CD2 LEU A 116 3.909 -7.230 -1.999 1.00 25.00 C ATOM 0 H LEU A 116 6.313 -4.480 1.089 1.00 25.00 H new ATOM 0 HA LEU A 116 6.562 -6.583 -1.005 1.00 25.00 H new ATOM 0 HB2 LEU A 116 4.816 -4.106 -0.912 1.00 25.00 H new ATOM 0 HB3 LEU A 116 5.189 -4.971 -2.390 1.00 25.00 H new ATOM 0 HG LEU A 116 3.844 -6.343 -0.051 1.00 25.00 H new ATOM 0 HD11 LEU A 116 1.689 -5.881 -1.197 1.00 25.00 H new ATOM 0 HD12 LEU A 116 2.487 -4.375 -0.686 1.00 25.00 H new ATOM 0 HD13 LEU A 116 2.545 -4.878 -2.392 1.00 25.00 H new ATOM 0 HD21 LEU A 116 3.041 -7.866 -1.824 1.00 25.00 H new ATOM 0 HD22 LEU A 116 3.919 -6.908 -3.040 1.00 25.00 H new ATOM 0 HD23 LEU A 116 4.819 -7.791 -1.784 1.00 25.00 H new ATOM 1612 N LYS A 117 8.268 -5.079 -2.182 1.00 25.00 N ATOM 1613 CA LYS A 117 9.399 -4.286 -2.691 1.00 25.00 C ATOM 1614 C LYS A 117 9.568 -4.364 -4.202 1.00 25.00 C ATOM 1615 O LYS A 117 9.528 -5.449 -4.768 1.00 25.00 O ATOM 1616 CB LYS A 117 10.683 -4.774 -2.015 1.00 25.00 C ATOM 1617 CG LYS A 117 11.910 -3.956 -2.368 1.00 25.00 C ATOM 1618 CD LYS A 117 12.927 -4.021 -1.253 1.00 25.00 C ATOM 1619 CE LYS A 117 14.089 -3.083 -1.523 1.00 25.00 C ATOM 1620 NZ LYS A 117 14.707 -2.634 -0.234 1.00 25.00 N ATOM 0 H LYS A 117 8.145 -5.982 -2.641 1.00 25.00 H new ATOM 0 HA LYS A 117 9.191 -3.242 -2.455 1.00 25.00 H new ATOM 0 HB2 LYS A 117 10.543 -4.754 -0.934 1.00 25.00 H new ATOM 0 HB3 LYS A 117 10.858 -5.813 -2.295 1.00 25.00 H new ATOM 0 HG2 LYS A 117 12.350 -4.330 -3.292 1.00 25.00 H new ATOM 0 HG3 LYS A 117 11.624 -2.920 -2.548 1.00 25.00 H new ATOM 0 HD2 LYS A 117 12.453 -3.756 -0.308 1.00 25.00 H new ATOM 0 HD3 LYS A 117 13.295 -5.042 -1.150 1.00 25.00 H new ATOM 0 HE2 LYS A 117 14.836 -3.586 -2.136 1.00 25.00 H new ATOM 0 HE3 LYS A 117 13.743 -2.218 -2.089 1.00 25.00 H new ATOM 0 HZ1 LYS A 117 15.688 -2.335 -0.405 1.00 25.00 H new ATOM 0 HZ2 LYS A 117 14.164 -1.836 0.152 1.00 25.00 H new ATOM 0 HZ3 LYS A 117 14.699 -3.420 0.447 1.00 25.00 H new ATOM 1634 N SER A 118 9.777 -3.208 -4.830 1.00 25.00 N ATOM 1635 CA SER A 118 10.037 -3.124 -6.278 1.00 25.00 C ATOM 1636 C SER A 118 11.484 -2.677 -6.566 1.00 25.00 C ATOM 1637 O SER A 118 12.127 -3.164 -7.501 1.00 25.00 O ATOM 1638 CB SER A 118 9.059 -2.141 -6.922 1.00 25.00 C ATOM 1639 OG SER A 118 9.202 -2.127 -8.328 1.00 25.00 O ATOM 0 H SER A 118 9.772 -2.304 -4.358 1.00 25.00 H new ATOM 0 HA SER A 118 9.898 -4.118 -6.703 1.00 25.00 H new ATOM 0 HB2 SER A 118 8.037 -2.416 -6.660 1.00 25.00 H new ATOM 0 HB3 SER A 118 9.231 -1.140 -6.526 1.00 25.00 H new ATOM 0 HG SER A 118 8.564 -1.492 -8.715 1.00 25.00 H new ATOM 1645 N TYR A 119 11.986 -1.769 -5.728 1.00 25.00 N ATOM 1646 CA TYR A 119 13.361 -1.229 -5.835 1.00 25.00 C ATOM 1647 C TYR A 119 13.718 -0.793 -7.273 1.00 25.00 C ATOM 1648 O TYR A 119 14.586 -1.372 -7.922 1.00 25.00 O ATOM 1649 CB TYR A 119 14.364 -2.259 -5.300 1.00 25.00 C ATOM 1650 CG TYR A 119 15.731 -1.688 -4.986 1.00 25.00 C ATOM 1651 CD1 TYR A 119 15.947 -0.929 -3.818 1.00 25.00 C ATOM 1652 CD2 TYR A 119 16.824 -1.914 -5.848 1.00 25.00 C ATOM 1653 CE1 TYR A 119 17.228 -0.395 -3.520 1.00 25.00 C ATOM 1654 CE2 TYR A 119 18.106 -1.386 -5.551 1.00 25.00 C ATOM 1655 CZ TYR A 119 18.293 -0.629 -4.392 1.00 25.00 C ATOM 1656 OH TYR A 119 19.531 -0.116 -4.098 1.00 25.00 O ATOM 0 H TYR A 119 11.455 -1.379 -4.949 1.00 25.00 H new ATOM 0 HA TYR A 119 13.413 -0.327 -5.225 1.00 25.00 H new ATOM 0 HB2 TYR A 119 13.956 -2.712 -4.397 1.00 25.00 H new ATOM 0 HB3 TYR A 119 14.476 -3.057 -6.034 1.00 25.00 H new ATOM 0 HD1 TYR A 119 15.126 -0.751 -3.140 1.00 25.00 H new ATOM 0 HD2 TYR A 119 16.683 -2.497 -6.746 1.00 25.00 H new ATOM 0 HE1 TYR A 119 17.378 0.189 -2.624 1.00 25.00 H new ATOM 0 HE2 TYR A 119 18.935 -1.568 -6.219 1.00 25.00 H new ATOM 0 HH TYR A 119 20.165 -0.368 -4.802 1.00 25.00 H new ATOM 1758 N SER A 127 13.927 3.369 -4.258 1.00 25.00 N ATOM 1759 CA SER A 127 13.173 2.207 -3.849 1.00 25.00 C ATOM 1760 C SER A 127 11.720 2.589 -3.703 1.00 25.00 C ATOM 1761 O SER A 127 11.390 3.689 -3.280 1.00 25.00 O ATOM 1762 CB SER A 127 13.691 1.646 -2.537 1.00 25.00 C ATOM 1763 OG SER A 127 13.148 0.357 -2.304 1.00 25.00 O ATOM 0 HA SER A 127 13.284 1.435 -4.610 1.00 25.00 H new ATOM 0 HB2 SER A 127 14.779 1.590 -2.562 1.00 25.00 H new ATOM 0 HB3 SER A 127 13.425 2.314 -1.718 1.00 25.00 H new ATOM 0 HG SER A 127 13.332 0.087 -1.380 1.00 25.00 H new ATOM 1769 N PHE A 128 10.853 1.656 -4.025 1.00 25.00 N ATOM 1770 CA PHE A 128 9.428 1.836 -3.840 1.00 25.00 C ATOM 1771 C PHE A 128 8.959 0.575 -3.151 1.00 25.00 C ATOM 1772 O PHE A 128 9.306 -0.543 -3.567 1.00 25.00 O ATOM 1773 CB PHE A 128 8.733 2.102 -5.170 1.00 25.00 C ATOM 1774 CG PHE A 128 9.119 3.423 -5.777 1.00 25.00 C ATOM 1775 CD1 PHE A 128 10.243 3.521 -6.612 1.00 25.00 C ATOM 1776 CD2 PHE A 128 8.380 4.587 -5.496 1.00 25.00 C ATOM 1777 CE1 PHE A 128 10.625 4.756 -7.175 1.00 25.00 C ATOM 1778 CE2 PHE A 128 8.758 5.837 -6.053 1.00 25.00 C ATOM 1779 CZ PHE A 128 9.882 5.919 -6.889 1.00 25.00 C ATOM 0 H PHE A 128 11.113 0.753 -4.422 1.00 25.00 H new ATOM 0 HA PHE A 128 9.186 2.709 -3.234 1.00 25.00 H new ATOM 0 HB2 PHE A 128 8.977 1.302 -5.868 1.00 25.00 H new ATOM 0 HB3 PHE A 128 7.653 2.077 -5.022 1.00 25.00 H new ATOM 0 HD1 PHE A 128 10.824 2.637 -6.827 1.00 25.00 H new ATOM 0 HD2 PHE A 128 7.516 4.529 -4.850 1.00 25.00 H new ATOM 0 HE1 PHE A 128 11.486 4.811 -7.825 1.00 25.00 H new ATOM 0 HE2 PHE A 128 8.181 6.723 -5.834 1.00 25.00 H new ATOM 0 HZ PHE A 128 10.176 6.869 -7.311 1.00 25.00 H new ATOM 1789 N GLU A 129 8.341 0.773 -1.997 1.00 25.00 N ATOM 1790 CA GLU A 129 8.040 -0.317 -1.068 1.00 25.00 C ATOM 1791 C GLU A 129 6.731 -0.047 -0.342 1.00 25.00 C ATOM 1792 O GLU A 129 6.357 1.107 -0.161 1.00 25.00 O ATOM 1793 CB GLU A 129 9.166 -0.451 -0.021 1.00 25.00 C ATOM 1794 CG GLU A 129 10.514 -0.858 -0.616 1.00 25.00 C ATOM 1795 CD GLU A 129 11.624 -1.035 0.416 1.00 25.00 C ATOM 1796 OE1 GLU A 129 11.440 -1.787 1.386 1.00 25.00 O ATOM 1797 OE2 GLU A 129 12.724 -0.464 0.212 1.00 25.00 O ATOM 0 H GLU A 129 8.033 1.690 -1.674 1.00 25.00 H new ATOM 0 HA GLU A 129 7.958 -1.239 -1.643 1.00 25.00 H new ATOM 0 HB2 GLU A 129 9.281 0.500 0.499 1.00 25.00 H new ATOM 0 HB3 GLU A 129 8.870 -1.189 0.725 1.00 25.00 H new ATOM 0 HG2 GLU A 129 10.390 -1.792 -1.164 1.00 25.00 H new ATOM 0 HG3 GLU A 129 10.822 -0.103 -1.339 1.00 25.00 H new ATOM 1804 N LEU A 130 6.060 -1.102 0.090 1.00 25.00 N ATOM 1805 CA LEU A 130 4.806 -0.994 0.848 1.00 25.00 C ATOM 1806 C LEU A 130 4.871 -2.004 1.987 1.00 25.00 C ATOM 1807 O LEU A 130 5.702 -2.912 1.955 1.00 25.00 O ATOM 1808 CB LEU A 130 3.585 -1.322 -0.024 1.00 25.00 C ATOM 1809 CG LEU A 130 3.224 -0.332 -1.147 1.00 25.00 C ATOM 1810 CD1 LEU A 130 3.890 -0.701 -2.484 1.00 25.00 C ATOM 1811 CD2 LEU A 130 1.706 -0.305 -1.322 1.00 25.00 C ATOM 0 H LEU A 130 6.363 -2.063 -0.071 1.00 25.00 H new ATOM 0 HA LEU A 130 4.697 0.028 1.210 1.00 25.00 H new ATOM 0 HB2 LEU A 130 3.749 -2.299 -0.478 1.00 25.00 H new ATOM 0 HB3 LEU A 130 2.719 -1.416 0.632 1.00 25.00 H new ATOM 0 HG LEU A 130 3.595 0.651 -0.858 1.00 25.00 H new ATOM 0 HD11 LEU A 130 3.606 0.026 -3.245 1.00 25.00 H new ATOM 0 HD12 LEU A 130 4.973 -0.696 -2.364 1.00 25.00 H new ATOM 0 HD13 LEU A 130 3.563 -1.694 -2.791 1.00 25.00 H new ATOM 0 HD21 LEU A 130 1.444 0.394 -2.116 1.00 25.00 H new ATOM 0 HD22 LEU A 130 1.352 -1.302 -1.585 1.00 25.00 H new ATOM 0 HD23 LEU A 130 1.238 0.012 -0.390 1.00 25.00 H new ATOM 1823 N ALA A 131 3.992 -1.875 2.967 1.00 25.00 N ATOM 1824 CA ALA A 131 3.923 -2.829 4.068 1.00 25.00 C ATOM 1825 C ALA A 131 2.471 -3.048 4.489 1.00 25.00 C ATOM 1826 O ALA A 131 1.629 -2.171 4.320 1.00 25.00 O ATOM 1827 CB ALA A 131 4.756 -2.321 5.254 1.00 25.00 C ATOM 0 H ALA A 131 3.312 -1.117 3.025 1.00 25.00 H new ATOM 0 HA ALA A 131 4.332 -3.783 3.736 1.00 25.00 H new ATOM 0 HB1 ALA A 131 4.699 -3.039 6.072 1.00 25.00 H new ATOM 0 HB2 ALA A 131 5.795 -2.204 4.945 1.00 25.00 H new ATOM 0 HB3 ALA A 131 4.366 -1.359 5.587 1.00 25.00 H new ATOM 1833 N LEU A 132 2.207 -4.208 5.069 1.00 25.00 N ATOM 1834 CA LEU A 132 0.896 -4.531 5.624 1.00 25.00 C ATOM 1835 C LEU A 132 1.161 -4.930 7.070 1.00 25.00 C ATOM 1836 O LEU A 132 2.041 -5.754 7.323 1.00 25.00 O ATOM 1837 CB LEU A 132 0.240 -5.721 4.901 1.00 25.00 C ATOM 1838 CG LEU A 132 0.158 -5.734 3.365 1.00 25.00 C ATOM 1839 CD1 LEU A 132 -0.448 -7.062 2.905 1.00 25.00 C ATOM 1840 CD2 LEU A 132 -0.680 -4.597 2.820 1.00 25.00 C ATOM 0 H LEU A 132 2.894 -4.955 5.170 1.00 25.00 H new ATOM 0 HA LEU A 132 0.221 -3.681 5.520 1.00 25.00 H new ATOM 0 HB2 LEU A 132 0.775 -6.621 5.205 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -0.778 -5.811 5.281 1.00 25.00 H new ATOM 0 HG LEU A 132 1.171 -5.612 2.983 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -0.509 -7.077 1.817 1.00 25.00 H new ATOM 0 HD12 LEU A 132 0.180 -7.886 3.245 1.00 25.00 H new ATOM 0 HD13 LEU A 132 -1.448 -7.171 3.325 1.00 25.00 H new ATOM 0 HD21 LEU A 132 -0.705 -4.653 1.732 1.00 25.00 H new ATOM 0 HD22 LEU A 132 -1.695 -4.673 3.211 1.00 25.00 H new ATOM 0 HD23 LEU A 132 -0.244 -3.645 3.125 1.00 25.00 H new ATOM 1852 N ASP A 133 0.404 -4.384 8.004 1.00 25.00 N ATOM 1853 CA ASP A 133 0.546 -4.746 9.414 1.00 25.00 C ATOM 1854 C ASP A 133 -0.752 -5.432 9.815 1.00 25.00 C ATOM 1855 O ASP A 133 -1.830 -4.965 9.459 1.00 25.00 O ATOM 1856 CB ASP A 133 0.740 -3.496 10.295 1.00 25.00 C ATOM 1857 CG ASP A 133 2.199 -3.089 10.457 1.00 25.00 C ATOM 1858 OD1 ASP A 133 3.041 -3.416 9.603 1.00 25.00 O ATOM 1859 OD2 ASP A 133 2.519 -2.472 11.504 1.00 25.00 O ATOM 0 H ASP A 133 -0.317 -3.687 7.818 1.00 25.00 H new ATOM 0 HA ASP A 133 1.416 -5.388 9.550 1.00 25.00 H new ATOM 0 HB2 ASP A 133 0.185 -2.665 9.860 1.00 25.00 H new ATOM 0 HB3 ASP A 133 0.312 -3.685 11.279 1.00 25.00 H new ATOM 1864 N GLY A 134 -0.660 -6.546 10.530 1.00 25.00 N ATOM 1865 CA GLY A 134 -1.860 -7.254 10.957 1.00 25.00 C ATOM 1866 C GLY A 134 -2.490 -8.035 9.827 1.00 25.00 C ATOM 1867 O GLY A 134 -3.666 -8.373 9.869 1.00 25.00 O ATOM 0 H GLY A 134 0.218 -6.974 10.823 1.00 25.00 H new ATOM 0 HA2 GLY A 134 -1.609 -7.934 11.771 1.00 25.00 H new ATOM 0 HA3 GLY A 134 -2.582 -6.539 11.350 1.00 25.00 H new ATOM 1871 N ASN A 135 -1.711 -8.304 8.793 1.00 25.00 N ATOM 1872 CA ASN A 135 -2.204 -9.041 7.631 1.00 25.00 C ATOM 1873 C ASN A 135 -2.582 -10.464 8.019 1.00 25.00 C ATOM 1874 O ASN A 135 -1.866 -11.126 8.772 1.00 25.00 O ATOM 1875 CB ASN A 135 -1.132 -9.095 6.539 1.00 25.00 C ATOM 1876 CG ASN A 135 -1.629 -9.761 5.272 1.00 25.00 C ATOM 1877 OD1 ASN A 135 -2.782 -9.630 4.898 1.00 25.00 O ATOM 1878 ND2 ASN A 135 -0.764 -10.482 4.615 1.00 25.00 N ATOM 0 H ASN A 135 -0.732 -8.024 8.730 1.00 25.00 H new ATOM 0 HA ASN A 135 -3.085 -8.521 7.255 1.00 25.00 H new ATOM 0 HB2 ASN A 135 -0.802 -8.082 6.308 1.00 25.00 H new ATOM 0 HB3 ASN A 135 -0.263 -9.636 6.914 1.00 25.00 H new ATOM 0 HD21 ASN A 135 -1.044 -10.959 3.758 1.00 25.00 H new ATOM 0 HD22 ASN A 135 0.193 -10.569 4.958 1.00 25.00 H new ATOM 1885 N HIS A 136 -3.671 -10.956 7.446 1.00 25.00 N ATOM 1886 CA HIS A 136 -4.097 -12.338 7.630 1.00 25.00 C ATOM 1887 C HIS A 136 -3.222 -13.259 6.791 1.00 25.00 C ATOM 1888 O HIS A 136 -3.631 -13.734 5.746 1.00 25.00 O ATOM 1889 CB HIS A 136 -5.568 -12.494 7.240 1.00 25.00 C ATOM 1890 CG HIS A 136 -6.506 -11.685 8.077 1.00 25.00 C ATOM 1891 ND1 HIS A 136 -6.914 -10.400 7.792 1.00 25.00 N ATOM 1892 CD2 HIS A 136 -7.151 -12.009 9.234 1.00 25.00 C ATOM 1893 CE1 HIS A 136 -7.761 -10.016 8.744 1.00 25.00 C ATOM 1894 NE2 HIS A 136 -7.937 -10.958 9.651 1.00 25.00 N ATOM 0 H HIS A 136 -4.284 -10.410 6.841 1.00 25.00 H new ATOM 0 HA HIS A 136 -3.990 -12.610 8.680 1.00 25.00 H new ATOM 0 HB2 HIS A 136 -5.689 -12.207 6.195 1.00 25.00 H new ATOM 0 HB3 HIS A 136 -5.844 -13.546 7.316 1.00 25.00 H new ATOM 0 HD1 HIS A 136 -6.619 -9.841 6.992 1.00 25.00 H new ATOM 0 HD2 HIS A 136 -7.059 -12.954 9.749 1.00 25.00 H new ATOM 0 HE1 HIS A 136 -8.245 -9.051 8.771 1.00 25.00 H new ATOM 1902 N ALA A 137 -2.021 -13.527 7.277 1.00 25.00 N ATOM 1903 CA ALA A 137 -1.094 -14.430 6.603 1.00 25.00 C ATOM 1904 C ALA A 137 -1.707 -15.827 6.494 1.00 25.00 C ATOM 1905 O ALA A 137 -1.441 -16.565 5.555 1.00 25.00 O ATOM 1906 CB ALA A 137 0.233 -14.481 7.361 1.00 25.00 C ATOM 0 H ALA A 137 -1.660 -13.129 8.144 1.00 25.00 H new ATOM 0 HA ALA A 137 -0.903 -14.058 5.597 1.00 25.00 H new ATOM 0 HB1 ALA A 137 0.918 -15.158 6.850 1.00 25.00 H new ATOM 0 HB2 ALA A 137 0.669 -13.483 7.398 1.00 25.00 H new ATOM 0 HB3 ALA A 137 0.059 -14.839 8.376 1.00 25.00 H new ATOM 1912 N ALA A 138 -2.564 -16.156 7.452 1.00 25.00 N ATOM 1913 CA ALA A 138 -3.268 -17.432 7.461 1.00 25.00 C ATOM 1914 C ALA A 138 -4.178 -17.595 6.235 1.00 25.00 C ATOM 1915 O ALA A 138 -4.457 -18.717 5.823 1.00 25.00 O ATOM 1916 CB ALA A 138 -4.092 -17.559 8.747 1.00 25.00 C ATOM 0 H ALA A 138 -2.790 -15.550 8.241 1.00 25.00 H new ATOM 0 HA ALA A 138 -2.521 -18.225 7.421 1.00 25.00 H new ATOM 0 HB1 ALA A 138 -4.617 -18.514 8.750 1.00 25.00 H new ATOM 0 HB2 ALA A 138 -3.429 -17.507 9.611 1.00 25.00 H new ATOM 0 HB3 ALA A 138 -4.817 -16.747 8.796 1.00 25.00 H new ATOM 1922 N THR A 139 -4.648 -16.488 5.674 1.00 25.00 N ATOM 1923 CA THR A 139 -5.529 -16.536 4.497 1.00 25.00 C ATOM 1924 C THR A 139 -4.983 -15.699 3.339 1.00 25.00 C ATOM 1925 O THR A 139 -5.748 -15.170 2.525 1.00 25.00 O ATOM 1926 CB THR A 139 -6.949 -16.027 4.843 1.00 25.00 C ATOM 1927 OG1 THR A 139 -6.874 -14.690 5.338 1.00 25.00 O ATOM 1928 CG2 THR A 139 -7.593 -16.886 5.917 1.00 25.00 C ATOM 0 H THR A 139 -4.440 -15.547 6.007 1.00 25.00 H new ATOM 0 HA THR A 139 -5.573 -17.581 4.190 1.00 25.00 H new ATOM 0 HB THR A 139 -7.547 -16.073 3.933 1.00 25.00 H new ATOM 0 HG1 THR A 139 -7.775 -14.370 5.554 1.00 25.00 H new ATOM 0 HG21 THR A 139 -8.590 -16.504 6.139 1.00 25.00 H new ATOM 0 HG22 THR A 139 -7.669 -17.914 5.564 1.00 25.00 H new ATOM 0 HG23 THR A 139 -6.984 -16.857 6.820 1.00 25.00 H new ATOM 1936 N LEU A 140 -3.663 -15.553 3.266 1.00 25.00 N ATOM 1937 CA LEU A 140 -3.058 -14.732 2.221 1.00 25.00 C ATOM 1938 C LEU A 140 -3.335 -15.303 0.832 1.00 25.00 C ATOM 1939 O LEU A 140 -3.544 -16.504 0.659 1.00 25.00 O ATOM 1940 CB LEU A 140 -1.549 -14.541 2.457 1.00 25.00 C ATOM 1941 CG LEU A 140 -0.586 -15.733 2.263 1.00 25.00 C ATOM 1942 CD1 LEU A 140 -0.148 -15.927 0.802 1.00 25.00 C ATOM 1943 CD2 LEU A 140 0.670 -15.501 3.113 1.00 25.00 C ATOM 0 H LEU A 140 -2.999 -15.986 3.908 1.00 25.00 H new ATOM 0 HA LEU A 140 -3.524 -13.748 2.270 1.00 25.00 H new ATOM 0 HB2 LEU A 140 -1.215 -13.742 1.796 1.00 25.00 H new ATOM 0 HB3 LEU A 140 -1.422 -14.183 3.479 1.00 25.00 H new ATOM 0 HG LEU A 140 -1.126 -16.629 2.567 1.00 25.00 H new ATOM 0 HD11 LEU A 140 0.527 -16.780 0.735 1.00 25.00 H new ATOM 0 HD12 LEU A 140 -1.025 -16.108 0.180 1.00 25.00 H new ATOM 0 HD13 LEU A 140 0.365 -15.030 0.454 1.00 25.00 H new ATOM 0 HD21 LEU A 140 1.357 -16.337 2.983 1.00 25.00 H new ATOM 0 HD22 LEU A 140 1.158 -14.579 2.797 1.00 25.00 H new ATOM 0 HD23 LEU A 140 0.389 -15.422 4.163 1.00 25.00 H new ATOM 1955 N SER A 141 -3.314 -14.425 -0.157 1.00 25.00 N ATOM 1956 CA SER A 141 -3.555 -14.803 -1.539 1.00 25.00 C ATOM 1957 C SER A 141 -2.700 -13.919 -2.431 1.00 25.00 C ATOM 1958 O SER A 141 -2.361 -12.795 -2.061 1.00 25.00 O ATOM 1959 CB SER A 141 -5.038 -14.622 -1.879 1.00 25.00 C ATOM 1960 OG SER A 141 -5.303 -14.985 -3.226 1.00 25.00 O ATOM 0 H SER A 141 -3.129 -13.431 -0.024 1.00 25.00 H new ATOM 0 HA SER A 141 -3.294 -15.850 -1.694 1.00 25.00 H new ATOM 0 HB2 SER A 141 -5.645 -15.231 -1.209 1.00 25.00 H new ATOM 0 HB3 SER A 141 -5.327 -13.584 -1.715 1.00 25.00 H new ATOM 0 HG SER A 141 -6.256 -14.862 -3.416 1.00 25.00 H new ATOM 1966 N ALA A 142 -2.356 -14.420 -3.606 1.00 25.00 N ATOM 1967 CA ALA A 142 -1.507 -13.699 -4.555 1.00 25.00 C ATOM 1968 C ALA A 142 -2.296 -12.688 -5.410 1.00 25.00 C ATOM 1969 O ALA A 142 -1.802 -12.188 -6.424 1.00 25.00 O ATOM 1970 CB ALA A 142 -0.813 -14.709 -5.457 1.00 25.00 C ATOM 0 H ALA A 142 -2.655 -15.338 -3.934 1.00 25.00 H new ATOM 0 HA ALA A 142 -0.778 -13.125 -3.983 1.00 25.00 H new ATOM 0 HB1 ALA A 142 -0.177 -14.184 -6.169 1.00 25.00 H new ATOM 0 HB2 ALA A 142 -0.203 -15.379 -4.851 1.00 25.00 H new ATOM 0 HB3 ALA A 142 -1.561 -15.289 -5.998 1.00 25.00 H new ATOM 1976 N GLY A 143 -3.537 -12.428 -5.022 1.00 25.00 N ATOM 1977 CA GLY A 143 -4.409 -11.550 -5.792 1.00 25.00 C ATOM 1978 C GLY A 143 -4.606 -10.154 -5.227 1.00 25.00 C ATOM 1979 O GLY A 143 -5.491 -9.447 -5.684 1.00 25.00 O ATOM 0 H GLY A 143 -3.963 -12.812 -4.179 1.00 25.00 H new ATOM 0 HA2 GLY A 143 -4.004 -11.460 -6.800 1.00 25.00 H new ATOM 0 HA3 GLY A 143 -5.385 -12.026 -5.882 1.00 25.00 H new ATOM 1983 N ASN A 144 -3.831 -9.769 -4.218 1.00 25.00 N ATOM 1984 CA ASN A 144 -4.032 -8.475 -3.541 1.00 25.00 C ATOM 1985 C ASN A 144 -3.863 -7.265 -4.461 1.00 25.00 C ATOM 1986 O ASN A 144 -4.594 -6.287 -4.383 1.00 25.00 O ATOM 1987 CB ASN A 144 -3.019 -8.327 -2.403 1.00 25.00 C ATOM 1988 CG ASN A 144 -3.079 -9.459 -1.422 1.00 25.00 C ATOM 1989 OD1 ASN A 144 -4.131 -9.878 -1.005 1.00 25.00 O ATOM 1990 ND2 ASN A 144 -1.940 -9.983 -1.085 1.00 25.00 N ATOM 0 H ASN A 144 -3.060 -10.325 -3.847 1.00 25.00 H new ATOM 0 HA ASN A 144 -5.061 -8.486 -3.182 1.00 25.00 H new ATOM 0 HB2 ASN A 144 -2.014 -8.268 -2.822 1.00 25.00 H new ATOM 0 HB3 ASN A 144 -3.202 -7.388 -1.880 1.00 25.00 H new ATOM 0 HD21 ASN A 144 -1.913 -10.778 -0.446 1.00 25.00 H new ATOM 0 HD22 ASN A 144 -1.072 -9.600 -1.459 1.00 25.00 H new ATOM 1997 N ILE A 145 -2.840 -7.307 -5.297 1.00 25.00 N ATOM 1998 CA ILE A 145 -2.502 -6.174 -6.154 1.00 25.00 C ATOM 1999 C ILE A 145 -3.439 -6.218 -7.362 1.00 25.00 C ATOM 2000 O ILE A 145 -3.853 -7.290 -7.775 1.00 25.00 O ATOM 2001 CB ILE A 145 -0.991 -6.233 -6.549 1.00 25.00 C ATOM 2002 CG1 ILE A 145 -0.141 -6.096 -5.261 1.00 25.00 C ATOM 2003 CG2 ILE A 145 -0.624 -5.114 -7.559 1.00 25.00 C ATOM 2004 CD1 ILE A 145 1.355 -6.326 -5.443 1.00 25.00 C ATOM 0 H ILE A 145 -2.225 -8.114 -5.404 1.00 25.00 H new ATOM 0 HA ILE A 145 -2.640 -5.223 -5.640 1.00 25.00 H new ATOM 0 HB ILE A 145 -0.787 -7.186 -7.036 1.00 25.00 H new ATOM 0 HG12 ILE A 145 -0.292 -5.098 -4.850 1.00 25.00 H new ATOM 0 HG13 ILE A 145 -0.514 -6.805 -4.522 1.00 25.00 H new ATOM 0 HG21 ILE A 145 0.434 -5.185 -7.812 1.00 25.00 H new ATOM 0 HG22 ILE A 145 -1.222 -5.230 -8.463 1.00 25.00 H new ATOM 0 HG23 ILE A 145 -0.826 -4.140 -7.113 1.00 25.00 H new ATOM 0 HD11 ILE A 145 1.861 -6.207 -4.485 1.00 25.00 H new ATOM 0 HD12 ILE A 145 1.525 -7.334 -5.821 1.00 25.00 H new ATOM 0 HD13 ILE A 145 1.751 -5.601 -6.154 1.00 25.00 H new ATOM 2016 N VAL A 146 -3.772 -5.054 -7.904 1.00 25.00 N ATOM 2017 CA VAL A 146 -4.692 -4.925 -9.040 1.00 25.00 C ATOM 2018 C VAL A 146 -4.343 -5.822 -10.247 1.00 25.00 C ATOM 2019 O VAL A 146 -5.237 -6.342 -10.910 1.00 25.00 O ATOM 2020 CB VAL A 146 -4.810 -3.414 -9.467 1.00 25.00 C ATOM 2021 CG1 VAL A 146 -3.487 -2.876 -10.074 1.00 25.00 C ATOM 2022 CG2 VAL A 146 -5.975 -3.205 -10.434 1.00 25.00 C ATOM 0 H VAL A 146 -3.411 -4.161 -7.569 1.00 25.00 H new ATOM 0 HA VAL A 146 -5.660 -5.287 -8.693 1.00 25.00 H new ATOM 0 HB VAL A 146 -5.009 -2.841 -8.561 1.00 25.00 H new ATOM 0 HG11 VAL A 146 -3.614 -1.830 -10.354 1.00 25.00 H new ATOM 0 HG12 VAL A 146 -2.688 -2.960 -9.337 1.00 25.00 H new ATOM 0 HG13 VAL A 146 -3.228 -3.460 -10.957 1.00 25.00 H new ATOM 0 HG21 VAL A 146 -6.033 -2.153 -10.712 1.00 25.00 H new ATOM 0 HG22 VAL A 146 -5.818 -3.809 -11.328 1.00 25.00 H new ATOM 0 HG23 VAL A 146 -6.906 -3.505 -9.952 1.00 25.00 H new ATOM 2032 N PHE A 147 -3.058 -6.049 -10.491 1.00 25.00 N ATOM 2033 CA PHE A 147 -2.623 -6.906 -11.598 1.00 25.00 C ATOM 2034 C PHE A 147 -2.904 -8.386 -11.319 1.00 25.00 C ATOM 2035 O PHE A 147 -3.147 -9.162 -12.241 1.00 25.00 O ATOM 2036 CB PHE A 147 -1.126 -6.699 -11.853 1.00 25.00 C ATOM 2037 CG PHE A 147 -0.765 -5.271 -12.183 1.00 25.00 C ATOM 2038 CD1 PHE A 147 -1.217 -4.678 -13.376 1.00 25.00 C ATOM 2039 CD2 PHE A 147 0.030 -4.511 -11.299 1.00 25.00 C ATOM 2040 CE1 PHE A 147 -0.893 -3.334 -13.690 1.00 25.00 C ATOM 2041 CE2 PHE A 147 0.362 -3.161 -11.605 1.00 25.00 C ATOM 2042 CZ PHE A 147 -0.100 -2.575 -12.799 1.00 25.00 C ATOM 0 H PHE A 147 -2.296 -5.654 -9.940 1.00 25.00 H new ATOM 0 HA PHE A 147 -3.193 -6.623 -12.483 1.00 25.00 H new ATOM 0 HB2 PHE A 147 -0.568 -7.012 -10.970 1.00 25.00 H new ATOM 0 HB3 PHE A 147 -0.812 -7.344 -12.674 1.00 25.00 H new ATOM 0 HD1 PHE A 147 -1.819 -5.255 -14.062 1.00 25.00 H new ATOM 0 HD2 PHE A 147 0.389 -4.957 -10.383 1.00 25.00 H new ATOM 0 HE1 PHE A 147 -1.251 -2.891 -14.608 1.00 25.00 H new ATOM 0 HE2 PHE A 147 0.969 -2.586 -10.921 1.00 25.00 H new ATOM 0 HZ PHE A 147 0.150 -1.551 -13.033 1.00 25.00 H new