USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 709 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 48 TYR OH : rot 180:sc= 0.417 USER MOD Set 1.2: A 68 ASN : amide:sc= 0.474 K(o=0.89,f=-1.9!) USER MOD Set 2.1: A 9 GLN : amide:sc= 0.343 K(o=0.71,f=-0.42) USER MOD Set 2.2: A 11 GLN : amide:sc= 0.37 K(o=0.71,f=0) USER MOD Set 3.1: A 6 LYS NZ :NH3+ 176:sc= 1.06 (180deg=0.197) USER MOD Set 3.2: A 10 GLN : amide:sc= 0.734 K(o=1.8,f=-8.2!) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0444 (180deg=-0.421) USER MOD Single : A 1 MET N :NH3+ -159:sc= 1.93 (180deg=1.41) USER MOD Single : A 2 GLN : amide:sc= 0.864 K(o=0.86,f=-0.077) USER MOD Single : A 4 THR OG1 : rot 79:sc= 0.182 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.363 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 151:sc= 0.095 (180deg=0.00167) USER MOD Single : A 29 LYS NZ :NH3+ -174:sc= 1.25 (180deg=1.14) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -129:sc= 0.835 (180deg=0.0521) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -0.633 K(o=-0.63,f=-3!) USER MOD Single : A 45 LYS NZ :NH3+ -125:sc= 1.13 (180deg=-0.897) USER MOD Single : A 51 LYS NZ :NH3+ -116:sc= 0.212 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= -0.0578 K(o=-0.058,f=-4.8!) USER MOD Single : A 57 THR OG1 : rot 180:sc=-0.00821 USER MOD Single : A 60 LYS NZ :NH3+ -167:sc= 1.29 (180deg=1.16) USER MOD Single : A 62 TYR OH : rot 166:sc= 0.417 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl -120:sc= -0.233 (180deg=-0.262) USER MOD Single : B 286 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : B 289 TYR OH : rot -166:sc= 0.526 USER MOD Single : B 291 MET CE :methyl 169:sc= 0 (180deg=-0.0908) USER MOD Single : B 292 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 293 MET CE :methyl 169:sc= -0.345 (180deg=-0.419) USER MOD Single : B 294 SER OG : rot -27:sc= 0.829 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.004 1.330 5.930 1.00 0.00 N ATOM 2 CA MET A 1 3.366 0.972 4.535 1.00 0.00 C ATOM 3 C MET A 1 3.902 -0.447 4.510 1.00 0.00 C ATOM 4 O MET A 1 4.900 -0.758 5.153 1.00 0.00 O ATOM 5 CB MET A 1 4.389 1.947 3.929 1.00 0.00 C ATOM 6 CG MET A 1 4.675 1.707 2.440 1.00 0.00 C ATOM 7 SD MET A 1 5.876 2.863 1.713 1.00 0.00 S ATOM 8 CE MET A 1 7.402 1.878 1.776 1.00 0.00 C ATOM 0 H1 MET A 1 2.329 2.121 5.921 1.00 0.00 H new ATOM 0 H2 MET A 1 2.569 0.509 6.397 1.00 0.00 H new ATOM 0 H3 MET A 1 3.860 1.611 6.450 1.00 0.00 H new ATOM 0 HA MET A 1 2.468 1.042 3.922 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.025 2.966 4.059 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.323 1.869 4.485 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.045 0.690 2.312 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.739 1.778 1.886 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.263 2.532 1.637 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.475 1.382 2.744 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.384 1.128 0.985 1.00 0.00 H new ATOM 20 N GLN A 2 3.215 -1.324 3.791 1.00 0.00 N ATOM 21 CA GLN A 2 3.446 -2.771 3.807 1.00 0.00 C ATOM 22 C GLN A 2 4.431 -3.189 2.709 1.00 0.00 C ATOM 23 O GLN A 2 4.050 -3.680 1.646 1.00 0.00 O ATOM 24 CB GLN A 2 2.125 -3.558 3.799 1.00 0.00 C ATOM 25 CG GLN A 2 1.126 -3.017 4.834 1.00 0.00 C ATOM 26 CD GLN A 2 -0.068 -3.931 5.105 1.00 0.00 C ATOM 27 OE1 GLN A 2 -0.520 -4.704 4.269 1.00 0.00 O ATOM 28 NE2 GLN A 2 -0.633 -3.872 6.294 1.00 0.00 N ATOM 0 H GLN A 2 2.461 -1.047 3.163 1.00 0.00 H new ATOM 0 HA GLN A 2 3.928 -3.032 4.749 1.00 0.00 H new ATOM 0 HB2 GLN A 2 1.680 -3.509 2.805 1.00 0.00 H new ATOM 0 HB3 GLN A 2 2.328 -4.609 4.006 1.00 0.00 H new ATOM 0 HG2 GLN A 2 1.653 -2.843 5.772 1.00 0.00 H new ATOM 0 HG3 GLN A 2 0.756 -2.050 4.492 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -0.268 -3.233 7.001 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -1.435 -4.465 6.508 1.00 0.00 H new ATOM 37 N VAL A 3 5.718 -2.968 2.978 1.00 0.00 N ATOM 38 CA VAL A 3 6.842 -3.405 2.138 1.00 0.00 C ATOM 39 C VAL A 3 6.874 -4.934 2.083 1.00 0.00 C ATOM 40 O VAL A 3 6.804 -5.593 3.122 1.00 0.00 O ATOM 41 CB VAL A 3 8.178 -2.871 2.701 1.00 0.00 C ATOM 42 CG1 VAL A 3 9.370 -3.251 1.816 1.00 0.00 C ATOM 43 CG2 VAL A 3 8.174 -1.342 2.773 1.00 0.00 C ATOM 0 H VAL A 3 6.020 -2.464 3.812 1.00 0.00 H new ATOM 0 HA VAL A 3 6.707 -3.007 1.132 1.00 0.00 H new ATOM 0 HB VAL A 3 8.277 -3.319 3.690 1.00 0.00 H new ATOM 0 HG11 VAL A 3 10.287 -2.854 2.251 1.00 0.00 H new ATOM 0 HG12 VAL A 3 9.441 -4.337 1.747 1.00 0.00 H new ATOM 0 HG13 VAL A 3 9.231 -2.833 0.819 1.00 0.00 H new ATOM 0 HG21 VAL A 3 9.126 -0.994 3.173 1.00 0.00 H new ATOM 0 HG22 VAL A 3 8.028 -0.931 1.774 1.00 0.00 H new ATOM 0 HG23 VAL A 3 7.365 -1.011 3.424 1.00 0.00 H new ATOM 53 N THR A 4 6.986 -5.516 0.890 1.00 0.00 N ATOM 54 CA THR A 4 7.252 -6.957 0.743 1.00 0.00 C ATOM 55 C THR A 4 8.746 -7.214 0.951 1.00 0.00 C ATOM 56 O THR A 4 9.583 -6.514 0.385 1.00 0.00 O ATOM 57 CB THR A 4 6.837 -7.458 -0.645 1.00 0.00 C ATOM 58 OG1 THR A 4 5.440 -7.330 -0.818 1.00 0.00 O ATOM 59 CG2 THR A 4 7.183 -8.935 -0.839 1.00 0.00 C ATOM 0 H THR A 4 6.897 -5.015 0.006 1.00 0.00 H new ATOM 0 HA THR A 4 6.667 -7.496 1.489 1.00 0.00 H new ATOM 0 HB THR A 4 7.380 -6.852 -1.370 1.00 0.00 H new ATOM 0 HG1 THR A 4 5.221 -6.399 -1.031 1.00 0.00 H new ATOM 0 HG21 THR A 4 6.874 -9.253 -1.834 1.00 0.00 H new ATOM 0 HG22 THR A 4 8.259 -9.074 -0.732 1.00 0.00 H new ATOM 0 HG23 THR A 4 6.664 -9.532 -0.089 1.00 0.00 H new ATOM 67 N LEU A 5 9.100 -8.223 1.744 1.00 0.00 N ATOM 68 CA LEU A 5 10.478 -8.640 2.007 1.00 0.00 C ATOM 69 C LEU A 5 10.796 -9.944 1.271 1.00 0.00 C ATOM 70 O LEU A 5 9.933 -10.811 1.123 1.00 0.00 O ATOM 71 CB LEU A 5 10.655 -8.820 3.527 1.00 0.00 C ATOM 72 CG LEU A 5 10.839 -7.526 4.348 1.00 0.00 C ATOM 73 CD1 LEU A 5 12.323 -7.308 4.615 1.00 0.00 C ATOM 74 CD2 LEU A 5 10.220 -6.245 3.791 1.00 0.00 C ATOM 0 H LEU A 5 8.413 -8.793 2.238 1.00 0.00 H new ATOM 0 HA LEU A 5 11.168 -7.878 1.644 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.784 -9.350 3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 5 11.520 -9.461 3.698 1.00 0.00 H new ATOM 0 HG LEU A 5 10.270 -7.707 5.260 1.00 0.00 H new ATOM 0 HD11 LEU A 5 12.458 -6.395 5.195 1.00 0.00 H new ATOM 0 HD12 LEU A 5 12.720 -8.155 5.174 1.00 0.00 H new ATOM 0 HD13 LEU A 5 12.854 -7.218 3.667 1.00 0.00 H new ATOM 0 HD21 LEU A 5 10.427 -5.417 4.469 1.00 0.00 H new ATOM 0 HD22 LEU A 5 10.649 -6.029 2.813 1.00 0.00 H new ATOM 0 HD23 LEU A 5 9.142 -6.374 3.694 1.00 0.00 H new ATOM 86 N LYS A 6 12.061 -10.097 0.875 1.00 0.00 N ATOM 87 CA LYS A 6 12.639 -11.306 0.267 1.00 0.00 C ATOM 88 C LYS A 6 14.026 -11.605 0.843 1.00 0.00 C ATOM 89 O LYS A 6 14.813 -10.686 1.075 1.00 0.00 O ATOM 90 CB LYS A 6 12.648 -11.162 -1.264 1.00 0.00 C ATOM 91 CG LYS A 6 13.110 -12.458 -1.946 1.00 0.00 C ATOM 92 CD LYS A 6 12.554 -12.585 -3.369 1.00 0.00 C ATOM 93 CE LYS A 6 12.806 -14.007 -3.879 1.00 0.00 C ATOM 94 NZ LYS A 6 14.108 -14.114 -4.592 1.00 0.00 N ATOM 0 H LYS A 6 12.746 -9.348 0.972 1.00 0.00 H new ATOM 0 HA LYS A 6 12.018 -12.167 0.514 1.00 0.00 H new ATOM 0 HB2 LYS A 6 11.648 -10.902 -1.612 1.00 0.00 H new ATOM 0 HB3 LYS A 6 13.308 -10.343 -1.550 1.00 0.00 H new ATOM 0 HG2 LYS A 6 14.199 -12.483 -1.978 1.00 0.00 H new ATOM 0 HG3 LYS A 6 12.789 -13.315 -1.353 1.00 0.00 H new ATOM 0 HD2 LYS A 6 11.486 -12.366 -3.377 1.00 0.00 H new ATOM 0 HD3 LYS A 6 13.033 -11.859 -4.026 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.793 -14.702 -3.040 1.00 0.00 H new ATOM 0 HE3 LYS A 6 11.999 -14.301 -4.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 14.275 -15.104 -4.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 14.086 -13.520 -5.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 14.874 -13.793 -3.966 1.00 0.00 H new ATOM 108 N THR A 7 14.321 -12.881 1.078 1.00 0.00 N ATOM 109 CA THR A 7 15.570 -13.354 1.701 1.00 0.00 C ATOM 110 C THR A 7 16.543 -13.949 0.675 1.00 0.00 C ATOM 111 O THR A 7 16.167 -14.255 -0.461 1.00 0.00 O ATOM 112 CB THR A 7 15.287 -14.376 2.819 1.00 0.00 C ATOM 113 OG1 THR A 7 15.016 -15.653 2.280 1.00 0.00 O ATOM 114 CG2 THR A 7 14.100 -14.007 3.715 1.00 0.00 C ATOM 0 H THR A 7 13.685 -13.641 0.836 1.00 0.00 H new ATOM 0 HA THR A 7 16.046 -12.478 2.140 1.00 0.00 H new ATOM 0 HB THR A 7 16.194 -14.376 3.424 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.841 -16.285 3.008 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.966 -14.776 4.476 1.00 0.00 H new ATOM 0 HG22 THR A 7 14.292 -13.048 4.197 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.196 -13.934 3.110 1.00 0.00 H new ATOM 122 N LEU A 8 17.798 -14.182 1.078 1.00 0.00 N ATOM 123 CA LEU A 8 18.794 -14.901 0.265 1.00 0.00 C ATOM 124 C LEU A 8 18.452 -16.385 0.041 1.00 0.00 C ATOM 125 O LEU A 8 18.815 -16.960 -0.986 1.00 0.00 O ATOM 126 CB LEU A 8 20.180 -14.781 0.913 1.00 0.00 C ATOM 127 CG LEU A 8 20.754 -13.360 1.023 1.00 0.00 C ATOM 128 CD1 LEU A 8 22.215 -13.412 1.468 1.00 0.00 C ATOM 129 CD2 LEU A 8 20.751 -12.622 -0.307 1.00 0.00 C ATOM 0 H LEU A 8 18.156 -13.876 1.983 1.00 0.00 H new ATOM 0 HA LEU A 8 18.788 -14.429 -0.718 1.00 0.00 H new ATOM 0 HB2 LEU A 8 20.129 -15.209 1.914 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.880 -15.390 0.341 1.00 0.00 H new ATOM 0 HG LEU A 8 20.118 -12.841 1.740 1.00 0.00 H new ATOM 0 HD11 LEU A 8 22.609 -12.398 1.542 1.00 0.00 H new ATOM 0 HD12 LEU A 8 22.282 -13.899 2.441 1.00 0.00 H new ATOM 0 HD13 LEU A 8 22.797 -13.976 0.739 1.00 0.00 H new ATOM 0 HD21 LEU A 8 21.167 -11.624 -0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 8 21.355 -13.171 -1.029 1.00 0.00 H new ATOM 0 HD23 LEU A 8 19.729 -12.541 -0.676 1.00 0.00 H new ATOM 141 N GLN A 9 17.701 -16.992 0.964 1.00 0.00 N ATOM 142 CA GLN A 9 17.103 -18.327 0.823 1.00 0.00 C ATOM 143 C GLN A 9 15.867 -18.331 -0.108 1.00 0.00 C ATOM 144 O GLN A 9 15.214 -19.362 -0.279 1.00 0.00 O ATOM 145 CB GLN A 9 16.734 -18.854 2.219 1.00 0.00 C ATOM 146 CG GLN A 9 17.958 -19.054 3.130 1.00 0.00 C ATOM 147 CD GLN A 9 17.574 -19.591 4.509 1.00 0.00 C ATOM 148 OE1 GLN A 9 16.431 -19.533 4.944 1.00 0.00 O ATOM 149 NE2 GLN A 9 18.515 -20.126 5.256 1.00 0.00 N ATOM 0 H GLN A 9 17.484 -16.555 1.860 1.00 0.00 H new ATOM 0 HA GLN A 9 17.838 -18.982 0.355 1.00 0.00 H new ATOM 0 HB2 GLN A 9 16.045 -18.156 2.694 1.00 0.00 H new ATOM 0 HB3 GLN A 9 16.206 -19.802 2.115 1.00 0.00 H new ATOM 0 HG2 GLN A 9 18.653 -19.746 2.654 1.00 0.00 H new ATOM 0 HG3 GLN A 9 18.481 -18.105 3.245 1.00 0.00 H new ATOM 0 HE21 GLN A 9 19.472 -20.182 4.908 1.00 0.00 H new ATOM 0 HE22 GLN A 9 18.288 -20.485 6.183 1.00 0.00 H new ATOM 158 N GLN A 10 15.543 -17.181 -0.713 1.00 0.00 N ATOM 159 CA GLN A 10 14.384 -16.917 -1.570 1.00 0.00 C ATOM 160 C GLN A 10 13.027 -17.147 -0.880 1.00 0.00 C ATOM 161 O GLN A 10 12.039 -17.506 -1.526 1.00 0.00 O ATOM 162 CB GLN A 10 14.529 -17.606 -2.940 1.00 0.00 C ATOM 163 CG GLN A 10 15.864 -17.268 -3.626 1.00 0.00 C ATOM 164 CD GLN A 10 15.754 -17.365 -5.144 1.00 0.00 C ATOM 165 OE1 GLN A 10 15.133 -16.525 -5.785 1.00 0.00 O ATOM 166 NE2 GLN A 10 16.322 -18.371 -5.775 1.00 0.00 N ATOM 0 H GLN A 10 16.128 -16.352 -0.608 1.00 0.00 H new ATOM 0 HA GLN A 10 14.379 -15.845 -1.768 1.00 0.00 H new ATOM 0 HB2 GLN A 10 14.453 -18.686 -2.811 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.705 -17.303 -3.585 1.00 0.00 H new ATOM 0 HG2 GLN A 10 16.173 -16.261 -3.346 1.00 0.00 H new ATOM 0 HG3 GLN A 10 16.638 -17.949 -3.272 1.00 0.00 H new ATOM 0 HE21 GLN A 10 16.841 -19.075 -5.250 1.00 0.00 H new ATOM 0 HE22 GLN A 10 16.243 -18.447 -6.789 1.00 0.00 H new ATOM 175 N GLN A 11 12.962 -16.880 0.428 1.00 0.00 N ATOM 176 CA GLN A 11 11.708 -16.834 1.186 1.00 0.00 C ATOM 177 C GLN A 11 11.140 -15.411 1.131 1.00 0.00 C ATOM 178 O GLN A 11 11.896 -14.454 0.960 1.00 0.00 O ATOM 179 CB GLN A 11 11.933 -17.277 2.639 1.00 0.00 C ATOM 180 CG GLN A 11 12.563 -18.676 2.728 1.00 0.00 C ATOM 181 CD GLN A 11 12.435 -19.268 4.133 1.00 0.00 C ATOM 182 OE1 GLN A 11 11.345 -19.558 4.613 1.00 0.00 O ATOM 183 NE2 GLN A 11 13.509 -19.490 4.862 1.00 0.00 N ATOM 0 H GLN A 11 13.787 -16.688 0.996 1.00 0.00 H new ATOM 0 HA GLN A 11 10.992 -17.524 0.740 1.00 0.00 H new ATOM 0 HB2 GLN A 11 12.579 -16.557 3.141 1.00 0.00 H new ATOM 0 HB3 GLN A 11 10.981 -17.275 3.169 1.00 0.00 H new ATOM 0 HG2 GLN A 11 12.081 -19.338 2.009 1.00 0.00 H new ATOM 0 HG3 GLN A 11 13.616 -18.619 2.452 1.00 0.00 H new ATOM 0 HE21 GLN A 11 14.432 -19.260 4.493 1.00 0.00 H new ATOM 0 HE22 GLN A 11 13.418 -19.892 5.795 1.00 0.00 H new ATOM 192 N THR A 12 9.821 -15.253 1.259 1.00 0.00 N ATOM 193 CA THR A 12 9.148 -13.947 1.155 1.00 0.00 C ATOM 194 C THR A 12 8.093 -13.738 2.238 1.00 0.00 C ATOM 195 O THR A 12 7.336 -14.649 2.584 1.00 0.00 O ATOM 196 CB THR A 12 8.521 -13.714 -0.233 1.00 0.00 C ATOM 197 OG1 THR A 12 7.744 -14.820 -0.658 1.00 0.00 O ATOM 198 CG2 THR A 12 9.580 -13.459 -1.307 1.00 0.00 C ATOM 0 H THR A 12 9.183 -16.028 1.439 1.00 0.00 H new ATOM 0 HA THR A 12 9.937 -13.210 1.304 1.00 0.00 H new ATOM 0 HB THR A 12 7.888 -12.834 -0.117 1.00 0.00 H new ATOM 0 HG1 THR A 12 7.363 -14.632 -1.541 1.00 0.00 H new ATOM 0 HG21 THR A 12 9.092 -13.300 -2.269 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.160 -12.574 -1.044 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.244 -14.321 -1.375 1.00 0.00 H new ATOM 206 N PHE A 13 8.047 -12.512 2.759 1.00 0.00 N ATOM 207 CA PHE A 13 7.198 -12.044 3.862 1.00 0.00 C ATOM 208 C PHE A 13 6.746 -10.594 3.598 1.00 0.00 C ATOM 209 O PHE A 13 7.062 -10.026 2.551 1.00 0.00 O ATOM 210 CB PHE A 13 7.988 -12.162 5.182 1.00 0.00 C ATOM 211 CG PHE A 13 8.531 -13.551 5.474 1.00 0.00 C ATOM 212 CD1 PHE A 13 7.663 -14.565 5.921 1.00 0.00 C ATOM 213 CD2 PHE A 13 9.892 -13.846 5.256 1.00 0.00 C ATOM 214 CE1 PHE A 13 8.146 -15.870 6.129 1.00 0.00 C ATOM 215 CE2 PHE A 13 10.376 -15.150 5.467 1.00 0.00 C ATOM 216 CZ PHE A 13 9.501 -16.165 5.895 1.00 0.00 C ATOM 0 H PHE A 13 8.642 -11.766 2.399 1.00 0.00 H new ATOM 0 HA PHE A 13 6.301 -12.658 3.937 1.00 0.00 H new ATOM 0 HB2 PHE A 13 8.821 -11.459 5.155 1.00 0.00 H new ATOM 0 HB3 PHE A 13 7.341 -11.859 6.005 1.00 0.00 H new ATOM 0 HD1 PHE A 13 6.623 -14.340 6.105 1.00 0.00 H new ATOM 0 HD2 PHE A 13 10.565 -13.069 4.926 1.00 0.00 H new ATOM 0 HE1 PHE A 13 7.476 -16.646 6.469 1.00 0.00 H new ATOM 0 HE2 PHE A 13 11.420 -15.372 5.300 1.00 0.00 H new ATOM 0 HZ PHE A 13 9.869 -17.169 6.044 1.00 0.00 H new ATOM 226 N LYS A 14 6.038 -9.960 4.539 1.00 0.00 N ATOM 227 CA LYS A 14 5.741 -8.515 4.498 1.00 0.00 C ATOM 228 C LYS A 14 6.045 -7.833 5.835 1.00 0.00 C ATOM 229 O LYS A 14 5.997 -8.466 6.891 1.00 0.00 O ATOM 230 CB LYS A 14 4.301 -8.258 4.014 1.00 0.00 C ATOM 231 CG LYS A 14 3.210 -8.783 4.965 1.00 0.00 C ATOM 232 CD LYS A 14 1.811 -8.422 4.440 1.00 0.00 C ATOM 233 CE LYS A 14 0.692 -8.899 5.378 1.00 0.00 C ATOM 234 NZ LYS A 14 0.527 -10.378 5.362 1.00 0.00 N ATOM 0 H LYS A 14 5.651 -10.432 5.356 1.00 0.00 H new ATOM 0 HA LYS A 14 6.408 -8.058 3.767 1.00 0.00 H new ATOM 0 HB2 LYS A 14 4.162 -7.186 3.877 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.170 -8.724 3.037 1.00 0.00 H new ATOM 0 HG2 LYS A 14 3.298 -9.865 5.065 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.352 -8.358 5.959 1.00 0.00 H new ATOM 0 HD2 LYS A 14 1.741 -7.341 4.315 1.00 0.00 H new ATOM 0 HD3 LYS A 14 1.670 -8.867 3.455 1.00 0.00 H new ATOM 0 HE2 LYS A 14 0.910 -8.572 6.395 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.247 -8.429 5.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.239 -10.649 6.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 0.292 -10.691 4.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 1.413 -10.829 5.666 1.00 0.00 H new ATOM 248 N ILE A 15 6.334 -6.536 5.777 1.00 0.00 N ATOM 249 CA ILE A 15 6.635 -5.653 6.907 1.00 0.00 C ATOM 250 C ILE A 15 5.842 -4.359 6.748 1.00 0.00 C ATOM 251 O ILE A 15 6.104 -3.552 5.858 1.00 0.00 O ATOM 252 CB ILE A 15 8.157 -5.400 7.022 1.00 0.00 C ATOM 253 CG1 ILE A 15 8.902 -6.646 7.539 1.00 0.00 C ATOM 254 CG2 ILE A 15 8.495 -4.188 7.901 1.00 0.00 C ATOM 255 CD1 ILE A 15 8.666 -7.020 9.010 1.00 0.00 C ATOM 0 H ILE A 15 6.367 -6.040 4.886 1.00 0.00 H new ATOM 0 HA ILE A 15 6.334 -6.129 7.840 1.00 0.00 H new ATOM 0 HB ILE A 15 8.497 -5.179 6.010 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.616 -7.496 6.920 1.00 0.00 H new ATOM 0 HG13 ILE A 15 9.971 -6.490 7.393 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.577 -4.060 7.944 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.041 -3.293 7.477 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.108 -4.349 8.907 1.00 0.00 H new ATOM 0 HD11 ILE A 15 9.243 -7.912 9.256 1.00 0.00 H new ATOM 0 HD12 ILE A 15 8.982 -6.196 9.650 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.606 -7.218 9.170 1.00 0.00 H new ATOM 267 N ASP A 16 4.842 -4.184 7.608 1.00 0.00 N ATOM 268 CA ASP A 16 4.114 -2.918 7.748 1.00 0.00 C ATOM 269 C ASP A 16 4.947 -1.926 8.588 1.00 0.00 C ATOM 270 O ASP A 16 4.948 -1.976 9.822 1.00 0.00 O ATOM 271 CB ASP A 16 2.717 -3.137 8.342 1.00 0.00 C ATOM 272 CG ASP A 16 1.779 -1.932 8.120 1.00 0.00 C ATOM 273 OD1 ASP A 16 2.235 -0.845 7.684 1.00 0.00 O ATOM 274 OD2 ASP A 16 0.549 -2.116 8.281 1.00 0.00 O ATOM 0 H ASP A 16 4.509 -4.918 8.233 1.00 0.00 H new ATOM 0 HA ASP A 16 3.966 -2.488 6.758 1.00 0.00 H new ATOM 0 HB2 ASP A 16 2.272 -4.026 7.895 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.807 -3.329 9.411 1.00 0.00 H new ATOM 279 N ILE A 17 5.704 -1.065 7.911 1.00 0.00 N ATOM 280 CA ILE A 17 6.632 -0.074 8.482 1.00 0.00 C ATOM 281 C ILE A 17 6.158 1.361 8.198 1.00 0.00 C ATOM 282 O ILE A 17 5.523 1.632 7.179 1.00 0.00 O ATOM 283 CB ILE A 17 8.075 -0.354 7.983 1.00 0.00 C ATOM 284 CG1 ILE A 17 9.109 0.690 8.453 1.00 0.00 C ATOM 285 CG2 ILE A 17 8.164 -0.495 6.448 1.00 0.00 C ATOM 286 CD1 ILE A 17 9.266 0.755 9.977 1.00 0.00 C ATOM 0 H ILE A 17 5.690 -1.033 6.892 1.00 0.00 H new ATOM 0 HA ILE A 17 6.643 -0.171 9.568 1.00 0.00 H new ATOM 0 HB ILE A 17 8.327 -1.310 8.442 1.00 0.00 H new ATOM 0 HG12 ILE A 17 10.076 0.458 8.006 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.814 1.672 8.084 1.00 0.00 H new ATOM 0 HG21 ILE A 17 9.197 -0.690 6.160 1.00 0.00 H new ATOM 0 HG22 ILE A 17 7.534 -1.322 6.121 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.824 0.428 5.978 1.00 0.00 H new ATOM 0 HD11 ILE A 17 10.009 1.510 10.234 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.310 1.017 10.430 1.00 0.00 H new ATOM 0 HD13 ILE A 17 9.591 -0.216 10.351 1.00 0.00 H new ATOM 298 N ASP A 18 6.456 2.300 9.098 1.00 0.00 N ATOM 299 CA ASP A 18 6.148 3.726 8.920 1.00 0.00 C ATOM 300 C ASP A 18 7.115 4.403 7.915 1.00 0.00 C ATOM 301 O ASP A 18 8.301 4.538 8.228 1.00 0.00 O ATOM 302 CB ASP A 18 6.203 4.435 10.281 1.00 0.00 C ATOM 303 CG ASP A 18 5.024 4.034 11.182 1.00 0.00 C ATOM 304 OD1 ASP A 18 3.893 4.525 10.948 1.00 0.00 O ATOM 305 OD2 ASP A 18 5.222 3.236 12.129 1.00 0.00 O ATOM 0 H ASP A 18 6.923 2.093 9.981 1.00 0.00 H new ATOM 0 HA ASP A 18 5.144 3.809 8.505 1.00 0.00 H new ATOM 0 HB2 ASP A 18 7.141 4.191 10.780 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.194 5.514 10.129 1.00 0.00 H new ATOM 310 N PRO A 19 6.660 4.878 6.733 1.00 0.00 N ATOM 311 CA PRO A 19 7.517 5.567 5.753 1.00 0.00 C ATOM 312 C PRO A 19 7.978 6.957 6.235 1.00 0.00 C ATOM 313 O PRO A 19 8.895 7.543 5.661 1.00 0.00 O ATOM 314 CB PRO A 19 6.665 5.665 4.485 1.00 0.00 C ATOM 315 CG PRO A 19 5.244 5.777 5.030 1.00 0.00 C ATOM 316 CD PRO A 19 5.277 4.882 6.269 1.00 0.00 C ATOM 0 HA PRO A 19 8.444 5.017 5.588 1.00 0.00 H new ATOM 0 HB2 PRO A 19 6.936 6.533 3.884 1.00 0.00 H new ATOM 0 HB3 PRO A 19 6.785 4.787 3.850 1.00 0.00 H new ATOM 0 HG2 PRO A 19 4.989 6.806 5.283 1.00 0.00 H new ATOM 0 HG3 PRO A 19 4.506 5.435 4.305 1.00 0.00 H new ATOM 0 HD2 PRO A 19 4.609 5.262 7.041 1.00 0.00 H new ATOM 0 HD3 PRO A 19 4.944 3.872 6.028 1.00 0.00 H new ATOM 324 N GLU A 20 7.366 7.481 7.302 1.00 0.00 N ATOM 325 CA GLU A 20 7.789 8.678 8.039 1.00 0.00 C ATOM 326 C GLU A 20 9.137 8.484 8.768 1.00 0.00 C ATOM 327 O GLU A 20 9.811 9.463 9.095 1.00 0.00 O ATOM 328 CB GLU A 20 6.711 9.016 9.086 1.00 0.00 C ATOM 329 CG GLU A 20 5.320 9.346 8.519 1.00 0.00 C ATOM 330 CD GLU A 20 5.312 10.664 7.725 1.00 0.00 C ATOM 331 OE1 GLU A 20 5.196 11.752 8.340 1.00 0.00 O ATOM 332 OE2 GLU A 20 5.421 10.623 6.476 1.00 0.00 O ATOM 0 H GLU A 20 6.522 7.063 7.694 1.00 0.00 H new ATOM 0 HA GLU A 20 7.918 9.482 7.315 1.00 0.00 H new ATOM 0 HB2 GLU A 20 6.615 8.172 9.769 1.00 0.00 H new ATOM 0 HB3 GLU A 20 7.055 9.866 9.675 1.00 0.00 H new ATOM 0 HG2 GLU A 20 4.991 8.533 7.872 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.603 9.413 9.337 1.00 0.00 H new ATOM 339 N GLU A 21 9.539 7.234 9.026 1.00 0.00 N ATOM 340 CA GLU A 21 10.767 6.859 9.738 1.00 0.00 C ATOM 341 C GLU A 21 11.922 6.488 8.783 1.00 0.00 C ATOM 342 O GLU A 21 11.777 6.454 7.555 1.00 0.00 O ATOM 343 CB GLU A 21 10.472 5.693 10.701 1.00 0.00 C ATOM 344 CG GLU A 21 9.389 5.983 11.752 1.00 0.00 C ATOM 345 CD GLU A 21 9.752 7.164 12.677 1.00 0.00 C ATOM 346 OE1 GLU A 21 10.873 7.184 13.242 1.00 0.00 O ATOM 347 OE2 GLU A 21 8.910 8.076 12.864 1.00 0.00 O ATOM 0 H GLU A 21 8.995 6.422 8.732 1.00 0.00 H new ATOM 0 HA GLU A 21 11.096 7.732 10.301 1.00 0.00 H new ATOM 0 HB2 GLU A 21 10.167 4.825 10.116 1.00 0.00 H new ATOM 0 HB3 GLU A 21 11.394 5.423 11.215 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.448 6.200 11.247 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.228 5.090 12.357 1.00 0.00 H new ATOM 354 N THR A 22 13.102 6.224 9.351 1.00 0.00 N ATOM 355 CA THR A 22 14.312 5.858 8.602 1.00 0.00 C ATOM 356 C THR A 22 14.417 4.358 8.312 1.00 0.00 C ATOM 357 O THR A 22 13.645 3.541 8.817 1.00 0.00 O ATOM 358 CB THR A 22 15.582 6.359 9.305 1.00 0.00 C ATOM 359 OG1 THR A 22 15.708 5.742 10.567 1.00 0.00 O ATOM 360 CG2 THR A 22 15.573 7.874 9.510 1.00 0.00 C ATOM 0 H THR A 22 13.248 6.259 10.360 1.00 0.00 H new ATOM 0 HA THR A 22 14.223 6.359 7.638 1.00 0.00 H new ATOM 0 HB THR A 22 16.422 6.102 8.660 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.521 6.065 11.009 1.00 0.00 H new ATOM 0 HG21 THR A 22 16.492 8.179 10.011 1.00 0.00 H new ATOM 0 HG22 THR A 22 15.505 8.372 8.543 1.00 0.00 H new ATOM 0 HG23 THR A 22 14.716 8.153 10.123 1.00 0.00 H new ATOM 368 N VAL A 23 15.405 3.969 7.503 1.00 0.00 N ATOM 369 CA VAL A 23 15.727 2.562 7.204 1.00 0.00 C ATOM 370 C VAL A 23 16.062 1.765 8.478 1.00 0.00 C ATOM 371 O VAL A 23 15.725 0.585 8.568 1.00 0.00 O ATOM 372 CB VAL A 23 16.885 2.522 6.191 1.00 0.00 C ATOM 373 CG1 VAL A 23 17.490 1.128 5.972 1.00 0.00 C ATOM 374 CG2 VAL A 23 16.447 3.069 4.826 1.00 0.00 C ATOM 0 H VAL A 23 16.018 4.631 7.026 1.00 0.00 H new ATOM 0 HA VAL A 23 14.850 2.082 6.770 1.00 0.00 H new ATOM 0 HB VAL A 23 17.655 3.150 6.638 1.00 0.00 H new ATOM 0 HG11 VAL A 23 18.298 1.193 5.244 1.00 0.00 H new ATOM 0 HG12 VAL A 23 17.881 0.749 6.916 1.00 0.00 H new ATOM 0 HG13 VAL A 23 16.720 0.452 5.600 1.00 0.00 H new ATOM 0 HG21 VAL A 23 17.286 3.028 4.131 1.00 0.00 H new ATOM 0 HG22 VAL A 23 15.626 2.466 4.439 1.00 0.00 H new ATOM 0 HG23 VAL A 23 16.118 4.102 4.937 1.00 0.00 H new ATOM 384 N LYS A 24 16.640 2.396 9.509 1.00 0.00 N ATOM 385 CA LYS A 24 16.827 1.792 10.839 1.00 0.00 C ATOM 386 C LYS A 24 15.511 1.297 11.457 1.00 0.00 C ATOM 387 O LYS A 24 15.507 0.253 12.103 1.00 0.00 O ATOM 388 CB LYS A 24 17.544 2.802 11.751 1.00 0.00 C ATOM 389 CG LYS A 24 17.958 2.199 13.103 1.00 0.00 C ATOM 390 CD LYS A 24 18.829 3.163 13.924 1.00 0.00 C ATOM 391 CE LYS A 24 18.047 4.405 14.375 1.00 0.00 C ATOM 392 NZ LYS A 24 18.882 5.298 15.221 1.00 0.00 N ATOM 0 H LYS A 24 16.995 3.350 9.444 1.00 0.00 H new ATOM 0 HA LYS A 24 17.446 0.902 10.729 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.430 3.179 11.241 1.00 0.00 H new ATOM 0 HB3 LYS A 24 16.889 3.656 11.925 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.065 1.943 13.674 1.00 0.00 H new ATOM 0 HG3 LYS A 24 18.505 1.272 12.933 1.00 0.00 H new ATOM 0 HD2 LYS A 24 19.219 2.643 14.799 1.00 0.00 H new ATOM 0 HD3 LYS A 24 19.688 3.472 13.328 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.697 4.953 13.500 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.163 4.097 14.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 18.323 6.127 15.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 19.195 4.781 16.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 19.713 5.612 14.680 1.00 0.00 H new ATOM 406 N ALA A 25 14.391 1.986 11.228 1.00 0.00 N ATOM 407 CA ALA A 25 13.070 1.537 11.675 1.00 0.00 C ATOM 408 C ALA A 25 12.553 0.318 10.880 1.00 0.00 C ATOM 409 O ALA A 25 11.965 -0.586 11.469 1.00 0.00 O ATOM 410 CB ALA A 25 12.097 2.716 11.631 1.00 0.00 C ATOM 0 H ALA A 25 14.374 2.874 10.726 1.00 0.00 H new ATOM 0 HA ALA A 25 13.154 1.188 12.704 1.00 0.00 H new ATOM 0 HB1 ALA A 25 11.112 2.387 11.963 1.00 0.00 H new ATOM 0 HB2 ALA A 25 12.456 3.508 12.288 1.00 0.00 H new ATOM 0 HB3 ALA A 25 12.029 3.094 10.611 1.00 0.00 H new ATOM 416 N LEU A 26 12.805 0.230 9.567 1.00 0.00 N ATOM 417 CA LEU A 26 12.550 -0.983 8.778 1.00 0.00 C ATOM 418 C LEU A 26 13.293 -2.184 9.394 1.00 0.00 C ATOM 419 O LEU A 26 12.674 -3.186 9.754 1.00 0.00 O ATOM 420 CB LEU A 26 12.896 -0.691 7.300 1.00 0.00 C ATOM 421 CG LEU A 26 12.933 -1.894 6.344 1.00 0.00 C ATOM 422 CD1 LEU A 26 11.682 -2.747 6.489 1.00 0.00 C ATOM 423 CD2 LEU A 26 13.023 -1.404 4.898 1.00 0.00 C ATOM 0 H LEU A 26 13.192 1.000 9.021 1.00 0.00 H new ATOM 0 HA LEU A 26 11.497 -1.264 8.801 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.169 0.025 6.916 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.870 -0.203 7.270 1.00 0.00 H new ATOM 0 HG LEU A 26 13.806 -2.495 6.597 1.00 0.00 H new ATOM 0 HD11 LEU A 26 11.735 -3.591 5.801 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.610 -3.117 7.512 1.00 0.00 H new ATOM 0 HD13 LEU A 26 10.803 -2.146 6.258 1.00 0.00 H new ATOM 0 HD21 LEU A 26 13.049 -2.261 4.224 1.00 0.00 H new ATOM 0 HD22 LEU A 26 12.154 -0.788 4.668 1.00 0.00 H new ATOM 0 HD23 LEU A 26 13.930 -0.814 4.770 1.00 0.00 H new ATOM 435 N LYS A 27 14.603 -2.041 9.609 1.00 0.00 N ATOM 436 CA LYS A 27 15.439 -2.997 10.363 1.00 0.00 C ATOM 437 C LYS A 27 14.857 -3.349 11.744 1.00 0.00 C ATOM 438 O LYS A 27 14.802 -4.530 12.089 1.00 0.00 O ATOM 439 CB LYS A 27 16.896 -2.505 10.459 1.00 0.00 C ATOM 440 CG LYS A 27 17.569 -2.370 9.079 1.00 0.00 C ATOM 441 CD LYS A 27 19.019 -1.862 9.152 1.00 0.00 C ATOM 442 CE LYS A 27 19.959 -2.947 9.696 1.00 0.00 C ATOM 443 NZ LYS A 27 21.377 -2.509 9.755 1.00 0.00 N ATOM 0 H LYS A 27 15.130 -1.241 9.258 1.00 0.00 H new ATOM 0 HA LYS A 27 15.437 -3.928 9.797 1.00 0.00 H new ATOM 0 HB2 LYS A 27 16.917 -1.540 10.965 1.00 0.00 H new ATOM 0 HB3 LYS A 27 17.470 -3.199 11.073 1.00 0.00 H new ATOM 0 HG2 LYS A 27 17.556 -3.339 8.581 1.00 0.00 H new ATOM 0 HG3 LYS A 27 16.984 -1.687 8.463 1.00 0.00 H new ATOM 0 HD2 LYS A 27 19.350 -1.554 8.160 1.00 0.00 H new ATOM 0 HD3 LYS A 27 19.067 -0.981 9.792 1.00 0.00 H new ATOM 0 HE2 LYS A 27 19.632 -3.236 10.695 1.00 0.00 H new ATOM 0 HE3 LYS A 27 19.884 -3.834 9.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 21.863 -3.010 10.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 21.845 -2.726 8.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 21.417 -1.484 9.929 1.00 0.00 H new ATOM 457 N GLU A 28 14.379 -2.365 12.516 1.00 0.00 N ATOM 458 CA GLU A 28 13.692 -2.587 13.803 1.00 0.00 C ATOM 459 C GLU A 28 12.455 -3.485 13.658 1.00 0.00 C ATOM 460 O GLU A 28 12.323 -4.467 14.391 1.00 0.00 O ATOM 461 CB GLU A 28 13.406 -1.265 14.563 1.00 0.00 C ATOM 462 CG GLU A 28 11.942 -0.807 14.766 1.00 0.00 C ATOM 463 CD GLU A 28 11.881 0.370 15.758 1.00 0.00 C ATOM 464 OE1 GLU A 28 12.100 1.535 15.346 1.00 0.00 O ATOM 465 OE2 GLU A 28 11.609 0.140 16.963 1.00 0.00 O ATOM 0 H GLU A 28 14.457 -1.379 12.265 1.00 0.00 H new ATOM 0 HA GLU A 28 14.387 -3.140 14.435 1.00 0.00 H new ATOM 0 HB2 GLU A 28 13.862 -1.350 15.549 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.929 -0.466 14.038 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.512 -0.508 13.810 1.00 0.00 H new ATOM 0 HG3 GLU A 28 11.343 -1.637 15.140 1.00 0.00 H new ATOM 472 N LYS A 29 11.567 -3.199 12.697 1.00 0.00 N ATOM 473 CA LYS A 29 10.400 -4.037 12.402 1.00 0.00 C ATOM 474 C LYS A 29 10.762 -5.448 11.954 1.00 0.00 C ATOM 475 O LYS A 29 10.092 -6.384 12.375 1.00 0.00 O ATOM 476 CB LYS A 29 9.489 -3.369 11.359 1.00 0.00 C ATOM 477 CG LYS A 29 8.266 -2.661 11.961 1.00 0.00 C ATOM 478 CD LYS A 29 7.368 -3.530 12.863 1.00 0.00 C ATOM 479 CE LYS A 29 6.969 -4.876 12.233 1.00 0.00 C ATOM 480 NZ LYS A 29 6.155 -5.700 13.164 1.00 0.00 N ATOM 0 H LYS A 29 11.639 -2.375 12.100 1.00 0.00 H new ATOM 0 HA LYS A 29 9.861 -4.135 13.345 1.00 0.00 H new ATOM 0 HB2 LYS A 29 10.073 -2.644 10.792 1.00 0.00 H new ATOM 0 HB3 LYS A 29 9.147 -4.125 10.652 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.613 -1.806 12.541 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.659 -2.268 11.146 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.888 -3.719 13.802 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.464 -2.971 13.106 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.405 -4.696 11.318 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.867 -5.426 11.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.991 -6.638 12.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.662 -5.807 14.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.242 -5.232 13.333 1.00 0.00 H new ATOM 494 N ILE A 30 11.796 -5.624 11.135 1.00 0.00 N ATOM 495 CA ILE A 30 12.273 -6.951 10.718 1.00 0.00 C ATOM 496 C ILE A 30 12.754 -7.753 11.937 1.00 0.00 C ATOM 497 O ILE A 30 12.332 -8.894 12.119 1.00 0.00 O ATOM 498 CB ILE A 30 13.358 -6.820 9.631 1.00 0.00 C ATOM 499 CG1 ILE A 30 12.767 -6.217 8.336 1.00 0.00 C ATOM 500 CG2 ILE A 30 13.989 -8.187 9.311 1.00 0.00 C ATOM 501 CD1 ILE A 30 13.835 -5.565 7.455 1.00 0.00 C ATOM 0 H ILE A 30 12.332 -4.852 10.738 1.00 0.00 H new ATOM 0 HA ILE A 30 11.447 -7.506 10.274 1.00 0.00 H new ATOM 0 HB ILE A 30 14.129 -6.155 10.019 1.00 0.00 H new ATOM 0 HG12 ILE A 30 12.263 -7.001 7.771 1.00 0.00 H new ATOM 0 HG13 ILE A 30 12.012 -5.475 8.596 1.00 0.00 H new ATOM 0 HG21 ILE A 30 14.751 -8.065 8.541 1.00 0.00 H new ATOM 0 HG22 ILE A 30 14.446 -8.597 10.212 1.00 0.00 H new ATOM 0 HG23 ILE A 30 13.218 -8.869 8.953 1.00 0.00 H new ATOM 0 HD11 ILE A 30 13.368 -5.157 6.559 1.00 0.00 H new ATOM 0 HD12 ILE A 30 14.322 -4.762 8.008 1.00 0.00 H new ATOM 0 HD13 ILE A 30 14.577 -6.311 7.170 1.00 0.00 H new ATOM 513 N GLU A 31 13.579 -7.159 12.807 1.00 0.00 N ATOM 514 CA GLU A 31 14.007 -7.793 14.064 1.00 0.00 C ATOM 515 C GLU A 31 12.808 -8.121 14.978 1.00 0.00 C ATOM 516 O GLU A 31 12.731 -9.218 15.531 1.00 0.00 O ATOM 517 CB GLU A 31 15.025 -6.894 14.789 1.00 0.00 C ATOM 518 CG GLU A 31 15.686 -7.606 15.979 1.00 0.00 C ATOM 519 CD GLU A 31 16.567 -6.648 16.803 1.00 0.00 C ATOM 520 OE1 GLU A 31 16.020 -5.885 17.635 1.00 0.00 O ATOM 521 OE2 GLU A 31 17.811 -6.675 16.642 1.00 0.00 O ATOM 0 H GLU A 31 13.969 -6.228 12.662 1.00 0.00 H new ATOM 0 HA GLU A 31 14.487 -8.740 13.817 1.00 0.00 H new ATOM 0 HB2 GLU A 31 15.794 -6.578 14.084 1.00 0.00 H new ATOM 0 HB3 GLU A 31 14.524 -5.992 15.140 1.00 0.00 H new ATOM 0 HG2 GLU A 31 14.915 -8.033 16.621 1.00 0.00 H new ATOM 0 HG3 GLU A 31 16.293 -8.435 15.615 1.00 0.00 H new ATOM 528 N SER A 32 11.848 -7.198 15.107 1.00 0.00 N ATOM 529 CA SER A 32 10.591 -7.372 15.852 1.00 0.00 C ATOM 530 C SER A 32 9.761 -8.559 15.333 1.00 0.00 C ATOM 531 O SER A 32 9.313 -9.402 16.113 1.00 0.00 O ATOM 532 CB SER A 32 9.777 -6.068 15.784 1.00 0.00 C ATOM 533 OG SER A 32 8.556 -6.162 16.500 1.00 0.00 O ATOM 0 H SER A 32 11.926 -6.275 14.681 1.00 0.00 H new ATOM 0 HA SER A 32 10.841 -7.599 16.888 1.00 0.00 H new ATOM 0 HB2 SER A 32 10.372 -5.249 16.188 1.00 0.00 H new ATOM 0 HB3 SER A 32 9.568 -5.826 14.742 1.00 0.00 H new ATOM 0 HG SER A 32 8.071 -5.313 16.433 1.00 0.00 H new ATOM 539 N GLU A 33 9.559 -8.644 14.015 1.00 0.00 N ATOM 540 CA GLU A 33 8.720 -9.650 13.355 1.00 0.00 C ATOM 541 C GLU A 33 9.368 -11.047 13.325 1.00 0.00 C ATOM 542 O GLU A 33 8.730 -12.037 13.692 1.00 0.00 O ATOM 543 CB GLU A 33 8.407 -9.171 11.924 1.00 0.00 C ATOM 544 CG GLU A 33 7.190 -9.866 11.299 1.00 0.00 C ATOM 545 CD GLU A 33 5.874 -9.492 12.015 1.00 0.00 C ATOM 546 OE1 GLU A 33 5.622 -8.282 12.243 1.00 0.00 O ATOM 547 OE2 GLU A 33 5.086 -10.406 12.359 1.00 0.00 O ATOM 0 H GLU A 33 9.988 -7.994 13.356 1.00 0.00 H new ATOM 0 HA GLU A 33 7.802 -9.754 13.934 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.233 -8.095 11.939 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.278 -9.344 11.293 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.119 -9.593 10.246 1.00 0.00 H new ATOM 0 HG3 GLU A 33 7.330 -10.946 11.340 1.00 0.00 H new ATOM 554 N LYS A 34 10.628 -11.139 12.871 1.00 0.00 N ATOM 555 CA LYS A 34 11.349 -12.406 12.637 1.00 0.00 C ATOM 556 C LYS A 34 12.122 -12.922 13.859 1.00 0.00 C ATOM 557 O LYS A 34 12.491 -14.097 13.905 1.00 0.00 O ATOM 558 CB LYS A 34 12.310 -12.237 11.443 1.00 0.00 C ATOM 559 CG LYS A 34 11.656 -11.728 10.142 1.00 0.00 C ATOM 560 CD LYS A 34 10.444 -12.546 9.670 1.00 0.00 C ATOM 561 CE LYS A 34 10.817 -14.004 9.366 1.00 0.00 C ATOM 562 NZ LYS A 34 9.641 -14.784 8.900 1.00 0.00 N ATOM 0 H LYS A 34 11.189 -10.316 12.650 1.00 0.00 H new ATOM 0 HA LYS A 34 10.589 -13.158 12.423 1.00 0.00 H new ATOM 0 HB2 LYS A 34 13.101 -11.544 11.729 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.785 -13.197 11.241 1.00 0.00 H new ATOM 0 HG2 LYS A 34 11.344 -10.694 10.289 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.406 -11.726 9.351 1.00 0.00 H new ATOM 0 HD2 LYS A 34 9.670 -12.522 10.437 1.00 0.00 H new ATOM 0 HD3 LYS A 34 10.022 -12.086 8.777 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.596 -14.030 8.604 1.00 0.00 H new ATOM 0 HE3 LYS A 34 11.231 -14.468 10.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.562 -15.659 9.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.778 -14.217 9.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 9.759 -15.023 7.895 1.00 0.00 H new ATOM 576 N GLY A 35 12.347 -12.058 14.845 1.00 0.00 N ATOM 577 CA GLY A 35 13.163 -12.293 16.040 1.00 0.00 C ATOM 578 C GLY A 35 14.657 -12.020 15.814 1.00 0.00 C ATOM 579 O GLY A 35 15.171 -12.125 14.694 1.00 0.00 O ATOM 0 H GLY A 35 11.943 -11.121 14.834 1.00 0.00 H new ATOM 0 HA2 GLY A 35 12.802 -11.658 16.849 1.00 0.00 H new ATOM 0 HA3 GLY A 35 13.034 -13.326 16.363 1.00 0.00 H new ATOM 583 N LYS A 36 15.377 -11.725 16.906 1.00 0.00 N ATOM 584 CA LYS A 36 16.827 -11.435 16.908 1.00 0.00 C ATOM 585 C LYS A 36 17.683 -12.626 16.455 1.00 0.00 C ATOM 586 O LYS A 36 18.782 -12.433 15.943 1.00 0.00 O ATOM 587 CB LYS A 36 17.293 -10.999 18.309 1.00 0.00 C ATOM 588 CG LYS A 36 16.586 -9.744 18.841 1.00 0.00 C ATOM 589 CD LYS A 36 17.054 -9.401 20.261 1.00 0.00 C ATOM 590 CE LYS A 36 16.353 -8.127 20.748 1.00 0.00 C ATOM 591 NZ LYS A 36 16.735 -7.791 22.144 1.00 0.00 N ATOM 0 H LYS A 36 14.962 -11.679 17.837 1.00 0.00 H new ATOM 0 HA LYS A 36 16.968 -10.628 16.189 1.00 0.00 H new ATOM 0 HB2 LYS A 36 17.128 -11.820 19.007 1.00 0.00 H new ATOM 0 HB3 LYS A 36 18.367 -10.814 18.282 1.00 0.00 H new ATOM 0 HG2 LYS A 36 16.785 -8.903 18.177 1.00 0.00 H new ATOM 0 HG3 LYS A 36 15.508 -9.903 18.840 1.00 0.00 H new ATOM 0 HD2 LYS A 36 16.834 -10.228 20.936 1.00 0.00 H new ATOM 0 HD3 LYS A 36 18.135 -9.259 20.273 1.00 0.00 H new ATOM 0 HE2 LYS A 36 16.609 -7.296 20.090 1.00 0.00 H new ATOM 0 HE3 LYS A 36 15.273 -8.260 20.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 16.242 -6.924 22.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 16.468 -8.574 22.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 17.763 -7.640 22.196 1.00 0.00 H new ATOM 605 N ASP A 37 17.187 -13.852 16.633 1.00 0.00 N ATOM 606 CA ASP A 37 17.847 -15.094 16.207 1.00 0.00 C ATOM 607 C ASP A 37 17.967 -15.197 14.676 1.00 0.00 C ATOM 608 O ASP A 37 19.008 -15.607 14.157 1.00 0.00 O ATOM 609 CB ASP A 37 17.066 -16.302 16.742 1.00 0.00 C ATOM 610 CG ASP A 37 17.102 -16.384 18.276 1.00 0.00 C ATOM 611 OD1 ASP A 37 18.091 -16.920 18.833 1.00 0.00 O ATOM 612 OD2 ASP A 37 16.139 -15.914 18.930 1.00 0.00 O ATOM 0 H ASP A 37 16.290 -14.016 17.090 1.00 0.00 H new ATOM 0 HA ASP A 37 18.857 -15.084 16.616 1.00 0.00 H new ATOM 0 HB2 ASP A 37 16.030 -16.240 16.407 1.00 0.00 H new ATOM 0 HB3 ASP A 37 17.483 -17.217 16.321 1.00 0.00 H new ATOM 617 N ALA A 38 16.907 -14.819 13.951 1.00 0.00 N ATOM 618 CA ALA A 38 16.861 -14.815 12.490 1.00 0.00 C ATOM 619 C ALA A 38 17.531 -13.561 11.894 1.00 0.00 C ATOM 620 O ALA A 38 18.421 -13.676 11.049 1.00 0.00 O ATOM 621 CB ALA A 38 15.396 -14.930 12.050 1.00 0.00 C ATOM 0 H ALA A 38 16.037 -14.500 14.378 1.00 0.00 H new ATOM 0 HA ALA A 38 17.427 -15.667 12.113 1.00 0.00 H new ATOM 0 HB1 ALA A 38 15.342 -14.929 10.961 1.00 0.00 H new ATOM 0 HB2 ALA A 38 14.973 -15.859 12.433 1.00 0.00 H new ATOM 0 HB3 ALA A 38 14.831 -14.085 12.442 1.00 0.00 H new ATOM 627 N PHE A 39 17.100 -12.369 12.326 1.00 0.00 N ATOM 628 CA PHE A 39 17.498 -11.075 11.759 1.00 0.00 C ATOM 629 C PHE A 39 17.696 -10.006 12.854 1.00 0.00 C ATOM 630 O PHE A 39 16.800 -9.192 13.085 1.00 0.00 O ATOM 631 CB PHE A 39 16.454 -10.635 10.716 1.00 0.00 C ATOM 632 CG PHE A 39 16.470 -11.438 9.426 1.00 0.00 C ATOM 633 CD1 PHE A 39 17.469 -11.208 8.461 1.00 0.00 C ATOM 634 CD2 PHE A 39 15.492 -12.424 9.189 1.00 0.00 C ATOM 635 CE1 PHE A 39 17.494 -11.960 7.272 1.00 0.00 C ATOM 636 CE2 PHE A 39 15.510 -13.170 7.996 1.00 0.00 C ATOM 637 CZ PHE A 39 16.512 -12.938 7.037 1.00 0.00 C ATOM 0 H PHE A 39 16.445 -12.276 13.103 1.00 0.00 H new ATOM 0 HA PHE A 39 18.464 -11.189 11.266 1.00 0.00 H new ATOM 0 HB2 PHE A 39 15.462 -10.708 11.161 1.00 0.00 H new ATOM 0 HB3 PHE A 39 16.619 -9.585 10.477 1.00 0.00 H new ATOM 0 HD1 PHE A 39 18.220 -10.451 8.634 1.00 0.00 H new ATOM 0 HD2 PHE A 39 14.725 -12.608 9.926 1.00 0.00 H new ATOM 0 HE1 PHE A 39 18.268 -11.786 6.539 1.00 0.00 H new ATOM 0 HE2 PHE A 39 14.754 -13.921 7.817 1.00 0.00 H new ATOM 0 HZ PHE A 39 16.527 -13.510 6.121 1.00 0.00 H new ATOM 647 N PRO A 40 18.863 -9.954 13.524 1.00 0.00 N ATOM 648 CA PRO A 40 19.196 -8.855 14.432 1.00 0.00 C ATOM 649 C PRO A 40 19.459 -7.567 13.627 1.00 0.00 C ATOM 650 O PRO A 40 19.908 -7.634 12.480 1.00 0.00 O ATOM 651 CB PRO A 40 20.439 -9.335 15.186 1.00 0.00 C ATOM 652 CG PRO A 40 21.138 -10.259 14.189 1.00 0.00 C ATOM 653 CD PRO A 40 20.002 -10.848 13.351 1.00 0.00 C ATOM 0 HA PRO A 40 18.391 -8.611 15.125 1.00 0.00 H new ATOM 0 HB2 PRO A 40 21.079 -8.501 15.474 1.00 0.00 H new ATOM 0 HB3 PRO A 40 20.172 -9.863 16.101 1.00 0.00 H new ATOM 0 HG2 PRO A 40 21.846 -9.710 13.568 1.00 0.00 H new ATOM 0 HG3 PRO A 40 21.701 -11.040 14.699 1.00 0.00 H new ATOM 0 HD2 PRO A 40 20.288 -10.916 12.301 1.00 0.00 H new ATOM 0 HD3 PRO A 40 19.758 -11.858 13.681 1.00 0.00 H new ATOM 661 N VAL A 41 19.222 -6.378 14.189 1.00 0.00 N ATOM 662 CA VAL A 41 19.507 -5.080 13.523 1.00 0.00 C ATOM 663 C VAL A 41 20.984 -4.967 13.136 1.00 0.00 C ATOM 664 O VAL A 41 21.315 -4.577 12.017 1.00 0.00 O ATOM 665 CB VAL A 41 19.097 -3.885 14.412 1.00 0.00 C ATOM 666 CG1 VAL A 41 19.548 -2.526 13.853 1.00 0.00 C ATOM 667 CG2 VAL A 41 17.576 -3.832 14.544 1.00 0.00 C ATOM 0 H VAL A 41 18.825 -6.276 15.123 1.00 0.00 H new ATOM 0 HA VAL A 41 18.908 -5.049 12.613 1.00 0.00 H new ATOM 0 HB VAL A 41 19.588 -4.048 15.371 1.00 0.00 H new ATOM 0 HG11 VAL A 41 19.227 -1.731 14.526 1.00 0.00 H new ATOM 0 HG12 VAL A 41 20.634 -2.511 13.765 1.00 0.00 H new ATOM 0 HG13 VAL A 41 19.103 -2.371 12.870 1.00 0.00 H new ATOM 0 HG21 VAL A 41 17.295 -2.987 15.172 1.00 0.00 H new ATOM 0 HG22 VAL A 41 17.129 -3.715 13.557 1.00 0.00 H new ATOM 0 HG23 VAL A 41 17.218 -4.756 14.997 1.00 0.00 H new ATOM 677 N ALA A 42 21.869 -5.333 14.062 1.00 0.00 N ATOM 678 CA ALA A 42 23.323 -5.252 13.896 1.00 0.00 C ATOM 679 C ALA A 42 23.920 -6.252 12.873 1.00 0.00 C ATOM 680 O ALA A 42 25.045 -6.049 12.411 1.00 0.00 O ATOM 681 CB ALA A 42 23.961 -5.437 15.279 1.00 0.00 C ATOM 0 H ALA A 42 21.590 -5.703 14.971 1.00 0.00 H new ATOM 0 HA ALA A 42 23.551 -4.273 13.473 1.00 0.00 H new ATOM 0 HB1 ALA A 42 25.046 -5.382 15.190 1.00 0.00 H new ATOM 0 HB2 ALA A 42 23.612 -4.651 15.949 1.00 0.00 H new ATOM 0 HB3 ALA A 42 23.679 -6.410 15.683 1.00 0.00 H new ATOM 687 N GLY A 43 23.189 -7.317 12.509 1.00 0.00 N ATOM 688 CA GLY A 43 23.636 -8.376 11.585 1.00 0.00 C ATOM 689 C GLY A 43 22.919 -8.401 10.235 1.00 0.00 C ATOM 690 O GLY A 43 23.471 -8.934 9.269 1.00 0.00 O ATOM 0 H GLY A 43 22.243 -7.471 12.858 1.00 0.00 H new ATOM 0 HA2 GLY A 43 24.705 -8.257 11.409 1.00 0.00 H new ATOM 0 HA3 GLY A 43 23.499 -9.342 12.070 1.00 0.00 H new ATOM 694 N GLN A 44 21.712 -7.835 10.138 1.00 0.00 N ATOM 695 CA GLN A 44 20.997 -7.728 8.866 1.00 0.00 C ATOM 696 C GLN A 44 21.499 -6.550 8.003 1.00 0.00 C ATOM 697 O GLN A 44 21.917 -5.511 8.527 1.00 0.00 O ATOM 698 CB GLN A 44 19.477 -7.686 9.105 1.00 0.00 C ATOM 699 CG GLN A 44 18.967 -6.317 9.567 1.00 0.00 C ATOM 700 CD GLN A 44 17.504 -6.360 9.976 1.00 0.00 C ATOM 701 OE1 GLN A 44 16.619 -6.019 9.213 1.00 0.00 O ATOM 702 NE2 GLN A 44 17.203 -6.754 11.191 1.00 0.00 N ATOM 0 H GLN A 44 21.208 -7.442 10.933 1.00 0.00 H new ATOM 0 HA GLN A 44 21.214 -8.624 8.284 1.00 0.00 H new ATOM 0 HB2 GLN A 44 18.965 -7.963 8.184 1.00 0.00 H new ATOM 0 HB3 GLN A 44 19.214 -8.434 9.853 1.00 0.00 H new ATOM 0 HG2 GLN A 44 19.568 -5.972 10.408 1.00 0.00 H new ATOM 0 HG3 GLN A 44 19.097 -5.592 8.763 1.00 0.00 H new ATOM 0 HE21 GLN A 44 17.943 -7.040 11.832 1.00 0.00 H new ATOM 0 HE22 GLN A 44 16.229 -6.774 11.494 1.00 0.00 H new ATOM 711 N LYS A 45 21.376 -6.677 6.678 1.00 0.00 N ATOM 712 CA LYS A 45 21.584 -5.616 5.674 1.00 0.00 C ATOM 713 C LYS A 45 20.368 -5.524 4.749 1.00 0.00 C ATOM 714 O LYS A 45 19.693 -6.527 4.511 1.00 0.00 O ATOM 715 CB LYS A 45 22.876 -5.844 4.865 1.00 0.00 C ATOM 716 CG LYS A 45 24.133 -6.008 5.735 1.00 0.00 C ATOM 717 CD LYS A 45 25.406 -5.912 4.881 1.00 0.00 C ATOM 718 CE LYS A 45 26.640 -6.280 5.713 1.00 0.00 C ATOM 719 NZ LYS A 45 27.898 -6.026 4.965 1.00 0.00 N ATOM 0 H LYS A 45 21.116 -7.565 6.250 1.00 0.00 H new ATOM 0 HA LYS A 45 21.698 -4.669 6.201 1.00 0.00 H new ATOM 0 HB2 LYS A 45 22.754 -6.734 4.247 1.00 0.00 H new ATOM 0 HB3 LYS A 45 23.022 -5.003 4.187 1.00 0.00 H new ATOM 0 HG2 LYS A 45 24.149 -5.239 6.507 1.00 0.00 H new ATOM 0 HG3 LYS A 45 24.104 -6.971 6.245 1.00 0.00 H new ATOM 0 HD2 LYS A 45 25.326 -6.579 4.023 1.00 0.00 H new ATOM 0 HD3 LYS A 45 25.513 -4.900 4.489 1.00 0.00 H new ATOM 0 HE2 LYS A 45 26.642 -5.702 6.637 1.00 0.00 H new ATOM 0 HE3 LYS A 45 26.589 -7.332 5.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 28.466 -6.897 4.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 27.671 -5.728 3.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 28.439 -5.275 5.440 1.00 0.00 H new ATOM 733 N LEU A 46 20.109 -4.323 4.232 1.00 0.00 N ATOM 734 CA LEU A 46 18.906 -3.929 3.496 1.00 0.00 C ATOM 735 C LEU A 46 19.276 -3.392 2.113 1.00 0.00 C ATOM 736 O LEU A 46 20.068 -2.458 2.013 1.00 0.00 O ATOM 737 CB LEU A 46 18.160 -2.853 4.320 1.00 0.00 C ATOM 738 CG LEU A 46 16.862 -3.320 4.989 1.00 0.00 C ATOM 739 CD1 LEU A 46 15.805 -3.635 3.932 1.00 0.00 C ATOM 740 CD2 LEU A 46 17.089 -4.537 5.883 1.00 0.00 C ATOM 0 H LEU A 46 20.772 -3.553 4.321 1.00 0.00 H new ATOM 0 HA LEU A 46 18.259 -4.794 3.350 1.00 0.00 H new ATOM 0 HB2 LEU A 46 18.833 -2.480 5.092 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.929 -2.013 3.665 1.00 0.00 H new ATOM 0 HG LEU A 46 16.508 -2.506 5.622 1.00 0.00 H new ATOM 0 HD11 LEU A 46 14.889 -3.965 4.421 1.00 0.00 H new ATOM 0 HD12 LEU A 46 15.600 -2.740 3.344 1.00 0.00 H new ATOM 0 HD13 LEU A 46 16.171 -4.424 3.276 1.00 0.00 H new ATOM 0 HD21 LEU A 46 16.144 -4.836 6.338 1.00 0.00 H new ATOM 0 HD22 LEU A 46 17.480 -5.360 5.285 1.00 0.00 H new ATOM 0 HD23 LEU A 46 17.805 -4.285 6.665 1.00 0.00 H new ATOM 752 N ILE A 47 18.717 -3.973 1.051 1.00 0.00 N ATOM 753 CA ILE A 47 19.086 -3.714 -0.347 1.00 0.00 C ATOM 754 C ILE A 47 17.827 -3.500 -1.203 1.00 0.00 C ATOM 755 O ILE A 47 16.921 -4.337 -1.208 1.00 0.00 O ATOM 756 CB ILE A 47 19.989 -4.866 -0.854 1.00 0.00 C ATOM 757 CG1 ILE A 47 21.328 -4.948 -0.073 1.00 0.00 C ATOM 758 CG2 ILE A 47 20.368 -4.711 -2.325 1.00 0.00 C ATOM 759 CD1 ILE A 47 21.361 -6.102 0.919 1.00 0.00 C ATOM 0 H ILE A 47 17.969 -4.661 1.140 1.00 0.00 H new ATOM 0 HA ILE A 47 19.661 -2.792 -0.427 1.00 0.00 H new ATOM 0 HB ILE A 47 19.390 -5.764 -0.703 1.00 0.00 H new ATOM 0 HG12 ILE A 47 22.150 -5.059 -0.780 1.00 0.00 H new ATOM 0 HG13 ILE A 47 21.491 -4.011 0.460 1.00 0.00 H new ATOM 0 HG21 ILE A 47 21.001 -5.545 -2.628 1.00 0.00 H new ATOM 0 HG22 ILE A 47 19.464 -4.701 -2.934 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.910 -3.775 -2.465 1.00 0.00 H new ATOM 0 HD11 ILE A 47 22.321 -6.110 1.436 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.558 -5.980 1.646 1.00 0.00 H new ATOM 0 HD13 ILE A 47 21.228 -7.044 0.386 1.00 0.00 H new ATOM 771 N TYR A 48 17.767 -2.375 -1.927 1.00 0.00 N ATOM 772 CA TYR A 48 16.704 -2.054 -2.888 1.00 0.00 C ATOM 773 C TYR A 48 17.280 -1.559 -4.217 1.00 0.00 C ATOM 774 O TYR A 48 18.276 -0.834 -4.227 1.00 0.00 O ATOM 775 CB TYR A 48 15.741 -1.011 -2.305 1.00 0.00 C ATOM 776 CG TYR A 48 14.430 -0.851 -3.061 1.00 0.00 C ATOM 777 CD1 TYR A 48 13.518 -1.922 -3.124 1.00 0.00 C ATOM 778 CD2 TYR A 48 14.100 0.376 -3.672 1.00 0.00 C ATOM 779 CE1 TYR A 48 12.271 -1.763 -3.758 1.00 0.00 C ATOM 780 CE2 TYR A 48 12.859 0.535 -4.322 1.00 0.00 C ATOM 781 CZ TYR A 48 11.934 -0.531 -4.356 1.00 0.00 C ATOM 782 OH TYR A 48 10.719 -0.377 -4.954 1.00 0.00 O ATOM 0 H TYR A 48 18.475 -1.644 -1.859 1.00 0.00 H new ATOM 0 HA TYR A 48 16.150 -2.973 -3.082 1.00 0.00 H new ATOM 0 HB2 TYR A 48 15.517 -1.282 -1.273 1.00 0.00 H new ATOM 0 HB3 TYR A 48 16.247 -0.046 -2.278 1.00 0.00 H new ATOM 0 HD1 TYR A 48 13.777 -2.873 -2.682 1.00 0.00 H new ATOM 0 HD2 TYR A 48 14.801 1.197 -3.642 1.00 0.00 H new ATOM 0 HE1 TYR A 48 11.572 -2.585 -3.786 1.00 0.00 H new ATOM 0 HE2 TYR A 48 12.615 1.475 -4.795 1.00 0.00 H new ATOM 0 HH TYR A 48 10.645 0.531 -5.316 1.00 0.00 H new ATOM 792 N ALA A 49 16.650 -1.915 -5.342 1.00 0.00 N ATOM 793 CA ALA A 49 17.066 -1.520 -6.693 1.00 0.00 C ATOM 794 C ALA A 49 18.584 -1.702 -6.971 1.00 0.00 C ATOM 795 O ALA A 49 19.211 -0.888 -7.654 1.00 0.00 O ATOM 796 CB ALA A 49 16.544 -0.095 -6.930 1.00 0.00 C ATOM 0 H ALA A 49 15.815 -2.501 -5.338 1.00 0.00 H new ATOM 0 HA ALA A 49 16.625 -2.196 -7.426 1.00 0.00 H new ATOM 0 HB1 ALA A 49 16.833 0.237 -7.927 1.00 0.00 H new ATOM 0 HB2 ALA A 49 15.457 -0.087 -6.846 1.00 0.00 H new ATOM 0 HB3 ALA A 49 16.971 0.577 -6.186 1.00 0.00 H new ATOM 802 N GLY A 50 19.185 -2.754 -6.403 1.00 0.00 N ATOM 803 CA GLY A 50 20.607 -3.107 -6.485 1.00 0.00 C ATOM 804 C GLY A 50 21.562 -2.276 -5.615 1.00 0.00 C ATOM 805 O GLY A 50 22.775 -2.362 -5.809 1.00 0.00 O ATOM 0 H GLY A 50 18.659 -3.422 -5.839 1.00 0.00 H new ATOM 0 HA2 GLY A 50 20.716 -4.156 -6.209 1.00 0.00 H new ATOM 0 HA3 GLY A 50 20.923 -3.016 -7.524 1.00 0.00 H new ATOM 809 N LYS A 51 21.052 -1.474 -4.669 1.00 0.00 N ATOM 810 CA LYS A 51 21.814 -0.558 -3.798 1.00 0.00 C ATOM 811 C LYS A 51 21.466 -0.761 -2.318 1.00 0.00 C ATOM 812 O LYS A 51 20.292 -0.846 -1.955 1.00 0.00 O ATOM 813 CB LYS A 51 21.533 0.891 -4.220 1.00 0.00 C ATOM 814 CG LYS A 51 22.240 1.255 -5.542 1.00 0.00 C ATOM 815 CD LYS A 51 21.618 2.500 -6.185 1.00 0.00 C ATOM 816 CE LYS A 51 20.268 2.135 -6.816 1.00 0.00 C ATOM 817 NZ LYS A 51 20.385 1.874 -8.271 1.00 0.00 N ATOM 0 H LYS A 51 20.050 -1.443 -4.479 1.00 0.00 H new ATOM 0 HA LYS A 51 22.876 -0.777 -3.912 1.00 0.00 H new ATOM 0 HB2 LYS A 51 20.458 1.034 -4.332 1.00 0.00 H new ATOM 0 HB3 LYS A 51 21.864 1.569 -3.433 1.00 0.00 H new ATOM 0 HG2 LYS A 51 23.299 1.432 -5.353 1.00 0.00 H new ATOM 0 HG3 LYS A 51 22.175 0.415 -6.234 1.00 0.00 H new ATOM 0 HD2 LYS A 51 21.481 3.279 -5.435 1.00 0.00 H new ATOM 0 HD3 LYS A 51 22.288 2.903 -6.944 1.00 0.00 H new ATOM 0 HE2 LYS A 51 19.864 1.252 -6.321 1.00 0.00 H new ATOM 0 HE3 LYS A 51 19.559 2.946 -6.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 19.837 2.585 -8.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 21.384 1.928 -8.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 20.015 0.926 -8.484 1.00 0.00 H new ATOM 831 N ILE A 52 22.479 -0.842 -1.453 1.00 0.00 N ATOM 832 CA ILE A 52 22.299 -0.957 0.002 1.00 0.00 C ATOM 833 C ILE A 52 21.730 0.346 0.584 1.00 0.00 C ATOM 834 O ILE A 52 22.253 1.437 0.343 1.00 0.00 O ATOM 835 CB ILE A 52 23.617 -1.362 0.693 1.00 0.00 C ATOM 836 CG1 ILE A 52 24.249 -2.536 -0.092 1.00 0.00 C ATOM 837 CG2 ILE A 52 23.362 -1.700 2.172 1.00 0.00 C ATOM 838 CD1 ILE A 52 25.091 -3.521 0.703 1.00 0.00 C ATOM 0 H ILE A 52 23.457 -0.830 -1.742 1.00 0.00 H new ATOM 0 HA ILE A 52 21.575 -1.749 0.196 1.00 0.00 H new ATOM 0 HB ILE A 52 24.325 -0.533 0.686 1.00 0.00 H new ATOM 0 HG12 ILE A 52 23.446 -3.091 -0.577 1.00 0.00 H new ATOM 0 HG13 ILE A 52 24.872 -2.119 -0.883 1.00 0.00 H new ATOM 0 HG21 ILE A 52 24.301 -1.984 2.647 1.00 0.00 H new ATOM 0 HG22 ILE A 52 22.948 -0.828 2.678 1.00 0.00 H new ATOM 0 HG23 ILE A 52 22.656 -2.528 2.240 1.00 0.00 H new ATOM 0 HD11 ILE A 52 25.474 -4.293 0.036 1.00 0.00 H new ATOM 0 HD12 ILE A 52 25.926 -2.995 1.167 1.00 0.00 H new ATOM 0 HD13 ILE A 52 24.478 -3.982 1.477 1.00 0.00 H new ATOM 850 N LEU A 53 20.645 0.225 1.347 1.00 0.00 N ATOM 851 CA LEU A 53 19.956 1.311 2.037 1.00 0.00 C ATOM 852 C LEU A 53 20.776 1.819 3.239 1.00 0.00 C ATOM 853 O LEU A 53 21.144 1.041 4.123 1.00 0.00 O ATOM 854 CB LEU A 53 18.576 0.816 2.506 1.00 0.00 C ATOM 855 CG LEU A 53 17.654 0.209 1.433 1.00 0.00 C ATOM 856 CD1 LEU A 53 16.257 -0.024 2.013 1.00 0.00 C ATOM 857 CD2 LEU A 53 17.491 1.142 0.243 1.00 0.00 C ATOM 0 H LEU A 53 20.201 -0.679 1.508 1.00 0.00 H new ATOM 0 HA LEU A 53 19.834 2.144 1.345 1.00 0.00 H new ATOM 0 HB2 LEU A 53 18.730 0.068 3.284 1.00 0.00 H new ATOM 0 HB3 LEU A 53 18.054 1.654 2.968 1.00 0.00 H new ATOM 0 HG LEU A 53 18.114 -0.726 1.112 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.612 -0.454 1.247 1.00 0.00 H new ATOM 0 HD12 LEU A 53 16.323 -0.710 2.858 1.00 0.00 H new ATOM 0 HD13 LEU A 53 15.839 0.925 2.348 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.834 0.680 -0.494 1.00 0.00 H new ATOM 0 HD22 LEU A 53 17.057 2.085 0.576 1.00 0.00 H new ATOM 0 HD23 LEU A 53 18.465 1.331 -0.208 1.00 0.00 H new ATOM 869 N ASN A 54 21.052 3.123 3.289 1.00 0.00 N ATOM 870 CA ASN A 54 21.679 3.785 4.438 1.00 0.00 C ATOM 871 C ASN A 54 20.712 3.804 5.639 1.00 0.00 C ATOM 872 O ASN A 54 19.636 4.395 5.545 1.00 0.00 O ATOM 873 CB ASN A 54 22.074 5.210 4.022 1.00 0.00 C ATOM 874 CG ASN A 54 22.917 5.929 5.067 1.00 0.00 C ATOM 875 OD1 ASN A 54 22.619 5.942 6.254 1.00 0.00 O ATOM 876 ND2 ASN A 54 24.013 6.539 4.672 1.00 0.00 N ATOM 0 H ASN A 54 20.843 3.761 2.521 1.00 0.00 H new ATOM 0 HA ASN A 54 22.571 3.239 4.746 1.00 0.00 H new ATOM 0 HB2 ASN A 54 22.628 5.167 3.084 1.00 0.00 H new ATOM 0 HB3 ASN A 54 21.171 5.790 3.832 1.00 0.00 H new ATOM 0 HD21 ASN A 54 24.605 7.016 5.352 1.00 0.00 H new ATOM 0 HD22 ASN A 54 24.272 6.535 3.685 1.00 0.00 H new ATOM 883 N ASP A 55 21.079 3.178 6.762 1.00 0.00 N ATOM 884 CA ASP A 55 20.235 3.068 7.963 1.00 0.00 C ATOM 885 C ASP A 55 19.737 4.417 8.527 1.00 0.00 C ATOM 886 O ASP A 55 18.610 4.497 9.020 1.00 0.00 O ATOM 887 CB ASP A 55 20.944 2.231 9.040 1.00 0.00 C ATOM 888 CG ASP A 55 22.189 2.913 9.632 1.00 0.00 C ATOM 889 OD1 ASP A 55 23.271 2.844 9.002 1.00 0.00 O ATOM 890 OD2 ASP A 55 22.097 3.488 10.743 1.00 0.00 O ATOM 0 H ASP A 55 21.987 2.724 6.867 1.00 0.00 H new ATOM 0 HA ASP A 55 19.328 2.554 7.645 1.00 0.00 H new ATOM 0 HB2 ASP A 55 20.240 2.018 9.844 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.235 1.273 8.610 1.00 0.00 H new ATOM 895 N ASP A 56 20.530 5.488 8.421 1.00 0.00 N ATOM 896 CA ASP A 56 20.177 6.832 8.904 1.00 0.00 C ATOM 897 C ASP A 56 19.314 7.639 7.908 1.00 0.00 C ATOM 898 O ASP A 56 18.670 8.618 8.292 1.00 0.00 O ATOM 899 CB ASP A 56 21.477 7.585 9.227 1.00 0.00 C ATOM 900 CG ASP A 56 21.227 8.913 9.963 1.00 0.00 C ATOM 901 OD1 ASP A 56 20.728 8.885 11.115 1.00 0.00 O ATOM 902 OD2 ASP A 56 21.573 9.989 9.415 1.00 0.00 O ATOM 0 H ASP A 56 21.453 5.447 7.989 1.00 0.00 H new ATOM 0 HA ASP A 56 19.560 6.717 9.795 1.00 0.00 H new ATOM 0 HB2 ASP A 56 22.117 6.950 9.839 1.00 0.00 H new ATOM 0 HB3 ASP A 56 22.017 7.784 8.301 1.00 0.00 H new ATOM 907 N THR A 57 19.272 7.234 6.635 1.00 0.00 N ATOM 908 CA THR A 57 18.474 7.872 5.574 1.00 0.00 C ATOM 909 C THR A 57 17.017 7.376 5.605 1.00 0.00 C ATOM 910 O THR A 57 16.723 6.267 6.064 1.00 0.00 O ATOM 911 CB THR A 57 19.156 7.639 4.209 1.00 0.00 C ATOM 912 OG1 THR A 57 20.458 8.196 4.239 1.00 0.00 O ATOM 913 CG2 THR A 57 18.459 8.305 3.030 1.00 0.00 C ATOM 0 H THR A 57 19.806 6.431 6.301 1.00 0.00 H new ATOM 0 HA THR A 57 18.430 8.948 5.745 1.00 0.00 H new ATOM 0 HB THR A 57 19.134 6.559 4.064 1.00 0.00 H new ATOM 0 HG1 THR A 57 20.897 8.049 3.375 1.00 0.00 H new ATOM 0 HG21 THR A 57 19.007 8.088 2.113 1.00 0.00 H new ATOM 0 HG22 THR A 57 17.442 7.921 2.944 1.00 0.00 H new ATOM 0 HG23 THR A 57 18.428 9.383 3.187 1.00 0.00 H new ATOM 921 N ALA A 58 16.072 8.211 5.159 1.00 0.00 N ATOM 922 CA ALA A 58 14.643 7.892 5.184 1.00 0.00 C ATOM 923 C ALA A 58 14.203 6.899 4.090 1.00 0.00 C ATOM 924 O ALA A 58 14.841 6.777 3.045 1.00 0.00 O ATOM 925 CB ALA A 58 13.840 9.195 5.140 1.00 0.00 C ATOM 0 H ALA A 58 16.279 9.131 4.769 1.00 0.00 H new ATOM 0 HA ALA A 58 14.438 7.367 6.117 1.00 0.00 H new ATOM 0 HB1 ALA A 58 12.774 8.966 5.158 1.00 0.00 H new ATOM 0 HB2 ALA A 58 14.094 9.809 6.004 1.00 0.00 H new ATOM 0 HB3 ALA A 58 14.079 9.739 4.226 1.00 0.00 H new ATOM 931 N LEU A 59 13.071 6.217 4.303 1.00 0.00 N ATOM 932 CA LEU A 59 12.511 5.238 3.354 1.00 0.00 C ATOM 933 C LEU A 59 12.057 5.878 2.027 1.00 0.00 C ATOM 934 O LEU A 59 12.237 5.293 0.955 1.00 0.00 O ATOM 935 CB LEU A 59 11.360 4.478 4.047 1.00 0.00 C ATOM 936 CG LEU A 59 11.834 3.546 5.181 1.00 0.00 C ATOM 937 CD1 LEU A 59 10.639 2.937 5.908 1.00 0.00 C ATOM 938 CD2 LEU A 59 12.662 2.371 4.664 1.00 0.00 C ATOM 0 H LEU A 59 12.510 6.328 5.147 1.00 0.00 H new ATOM 0 HA LEU A 59 13.299 4.538 3.077 1.00 0.00 H new ATOM 0 HB2 LEU A 59 10.651 5.200 4.453 1.00 0.00 H new ATOM 0 HB3 LEU A 59 10.824 3.889 3.303 1.00 0.00 H new ATOM 0 HG LEU A 59 12.439 4.169 5.840 1.00 0.00 H new ATOM 0 HD11 LEU A 59 10.993 2.282 6.705 1.00 0.00 H new ATOM 0 HD12 LEU A 59 10.029 3.733 6.336 1.00 0.00 H new ATOM 0 HD13 LEU A 59 10.040 2.360 5.203 1.00 0.00 H new ATOM 0 HD21 LEU A 59 12.970 1.746 5.502 1.00 0.00 H new ATOM 0 HD22 LEU A 59 12.062 1.780 3.972 1.00 0.00 H new ATOM 0 HD23 LEU A 59 13.545 2.747 4.148 1.00 0.00 H new ATOM 950 N LYS A 60 11.527 7.107 2.086 1.00 0.00 N ATOM 951 CA LYS A 60 11.084 7.902 0.923 1.00 0.00 C ATOM 952 C LYS A 60 12.206 8.221 -0.076 1.00 0.00 C ATOM 953 O LYS A 60 11.940 8.331 -1.271 1.00 0.00 O ATOM 954 CB LYS A 60 10.424 9.208 1.400 1.00 0.00 C ATOM 955 CG LYS A 60 9.192 8.957 2.283 1.00 0.00 C ATOM 956 CD LYS A 60 8.533 10.278 2.695 1.00 0.00 C ATOM 957 CE LYS A 60 7.428 10.003 3.719 1.00 0.00 C ATOM 958 NZ LYS A 60 6.766 11.255 4.159 1.00 0.00 N ATOM 0 H LYS A 60 11.389 7.595 2.971 1.00 0.00 H new ATOM 0 HA LYS A 60 10.364 7.282 0.388 1.00 0.00 H new ATOM 0 HB2 LYS A 60 11.152 9.797 1.957 1.00 0.00 H new ATOM 0 HB3 LYS A 60 10.131 9.801 0.533 1.00 0.00 H new ATOM 0 HG2 LYS A 60 8.473 8.341 1.743 1.00 0.00 H new ATOM 0 HG3 LYS A 60 9.485 8.400 3.173 1.00 0.00 H new ATOM 0 HD2 LYS A 60 9.278 10.951 3.120 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.116 10.777 1.820 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.687 9.333 3.284 1.00 0.00 H new ATOM 0 HE3 LYS A 60 7.852 9.492 4.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.185 11.064 5.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 7.488 11.966 4.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.160 11.614 3.394 1.00 0.00 H new ATOM 972 N GLU A 61 13.458 8.300 0.379 1.00 0.00 N ATOM 973 CA GLU A 61 14.643 8.581 -0.456 1.00 0.00 C ATOM 974 C GLU A 61 14.948 7.489 -1.494 1.00 0.00 C ATOM 975 O GLU A 61 15.649 7.743 -2.476 1.00 0.00 O ATOM 976 CB GLU A 61 15.871 8.757 0.451 1.00 0.00 C ATOM 977 CG GLU A 61 15.781 10.008 1.339 1.00 0.00 C ATOM 978 CD GLU A 61 15.752 11.313 0.519 1.00 0.00 C ATOM 979 OE1 GLU A 61 16.823 11.760 0.040 1.00 0.00 O ATOM 980 OE2 GLU A 61 14.659 11.906 0.351 1.00 0.00 O ATOM 0 H GLU A 61 13.689 8.168 1.364 1.00 0.00 H new ATOM 0 HA GLU A 61 14.417 9.491 -1.012 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.980 7.876 1.083 1.00 0.00 H new ATOM 0 HB3 GLU A 61 16.767 8.819 -0.166 1.00 0.00 H new ATOM 0 HG2 GLU A 61 14.883 9.949 1.954 1.00 0.00 H new ATOM 0 HG3 GLU A 61 16.633 10.029 2.019 1.00 0.00 H new ATOM 987 N TYR A 62 14.390 6.291 -1.302 1.00 0.00 N ATOM 988 CA TYR A 62 14.561 5.122 -2.167 1.00 0.00 C ATOM 989 C TYR A 62 13.263 4.740 -2.898 1.00 0.00 C ATOM 990 O TYR A 62 13.249 3.786 -3.677 1.00 0.00 O ATOM 991 CB TYR A 62 15.118 3.977 -1.312 1.00 0.00 C ATOM 992 CG TYR A 62 16.466 4.294 -0.690 1.00 0.00 C ATOM 993 CD1 TYR A 62 17.640 4.130 -1.451 1.00 0.00 C ATOM 994 CD2 TYR A 62 16.551 4.729 0.650 1.00 0.00 C ATOM 995 CE1 TYR A 62 18.899 4.376 -0.872 1.00 0.00 C ATOM 996 CE2 TYR A 62 17.810 4.971 1.234 1.00 0.00 C ATOM 997 CZ TYR A 62 18.987 4.791 0.475 1.00 0.00 C ATOM 998 OH TYR A 62 20.202 5.005 1.050 1.00 0.00 O ATOM 0 H TYR A 62 13.781 6.102 -0.506 1.00 0.00 H new ATOM 0 HA TYR A 62 15.268 5.355 -2.963 1.00 0.00 H new ATOM 0 HB2 TYR A 62 14.406 3.744 -0.520 1.00 0.00 H new ATOM 0 HB3 TYR A 62 15.211 3.084 -1.930 1.00 0.00 H new ATOM 0 HD1 TYR A 62 17.574 3.815 -2.482 1.00 0.00 H new ATOM 0 HD2 TYR A 62 15.651 4.876 1.228 1.00 0.00 H new ATOM 0 HE1 TYR A 62 19.797 4.247 -1.458 1.00 0.00 H new ATOM 0 HE2 TYR A 62 17.875 5.294 2.262 1.00 0.00 H new ATOM 0 HH TYR A 62 20.085 5.498 1.889 1.00 0.00 H new ATOM 1008 N LYS A 63 12.180 5.504 -2.672 1.00 0.00 N ATOM 1009 CA LYS A 63 10.834 5.361 -3.254 1.00 0.00 C ATOM 1010 C LYS A 63 10.314 3.909 -3.247 1.00 0.00 C ATOM 1011 O LYS A 63 9.736 3.435 -4.228 1.00 0.00 O ATOM 1012 CB LYS A 63 10.795 6.027 -4.648 1.00 0.00 C ATOM 1013 CG LYS A 63 11.184 7.519 -4.616 1.00 0.00 C ATOM 1014 CD LYS A 63 11.174 8.169 -6.010 1.00 0.00 C ATOM 1015 CE LYS A 63 9.784 8.285 -6.656 1.00 0.00 C ATOM 1016 NZ LYS A 63 8.911 9.263 -5.951 1.00 0.00 N ATOM 0 H LYS A 63 12.226 6.296 -2.031 1.00 0.00 H new ATOM 0 HA LYS A 63 10.130 5.889 -2.612 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.472 5.495 -5.317 1.00 0.00 H new ATOM 0 HB3 LYS A 63 9.792 5.928 -5.064 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.494 8.056 -3.965 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.178 7.621 -4.180 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.608 9.166 -5.934 1.00 0.00 H new ATOM 0 HD3 LYS A 63 11.819 7.590 -6.670 1.00 0.00 H new ATOM 0 HE2 LYS A 63 9.894 8.586 -7.698 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.303 7.307 -6.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.985 9.306 -6.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.782 8.964 -4.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.355 10.203 -5.973 1.00 0.00 H new ATOM 1030 N ILE A 64 10.539 3.201 -2.134 1.00 0.00 N ATOM 1031 CA ILE A 64 10.141 1.799 -1.927 1.00 0.00 C ATOM 1032 C ILE A 64 8.623 1.651 -2.087 1.00 0.00 C ATOM 1033 O ILE A 64 7.848 2.404 -1.494 1.00 0.00 O ATOM 1034 CB ILE A 64 10.622 1.258 -0.561 1.00 0.00 C ATOM 1035 CG1 ILE A 64 12.131 1.514 -0.349 1.00 0.00 C ATOM 1036 CG2 ILE A 64 10.320 -0.251 -0.455 1.00 0.00 C ATOM 1037 CD1 ILE A 64 12.619 1.051 1.025 1.00 0.00 C ATOM 0 H ILE A 64 11.018 3.598 -1.326 1.00 0.00 H new ATOM 0 HA ILE A 64 10.629 1.194 -2.691 1.00 0.00 H new ATOM 0 HB ILE A 64 10.081 1.791 0.220 1.00 0.00 H new ATOM 0 HG12 ILE A 64 12.696 0.997 -1.124 1.00 0.00 H new ATOM 0 HG13 ILE A 64 12.335 2.579 -0.463 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.662 -0.624 0.510 1.00 0.00 H new ATOM 0 HG22 ILE A 64 9.246 -0.415 -0.547 1.00 0.00 H new ATOM 0 HG23 ILE A 64 10.838 -0.783 -1.253 1.00 0.00 H new ATOM 0 HD11 ILE A 64 13.686 1.255 1.120 1.00 0.00 H new ATOM 0 HD12 ILE A 64 12.076 1.587 1.804 1.00 0.00 H new ATOM 0 HD13 ILE A 64 12.443 -0.019 1.132 1.00 0.00 H new ATOM 1049 N ASP A 65 8.202 0.681 -2.898 1.00 0.00 N ATOM 1050 CA ASP A 65 6.790 0.371 -3.151 1.00 0.00 C ATOM 1051 C ASP A 65 6.313 -0.831 -2.311 1.00 0.00 C ATOM 1052 O ASP A 65 7.109 -1.666 -1.876 1.00 0.00 O ATOM 1053 CB ASP A 65 6.593 0.130 -4.655 1.00 0.00 C ATOM 1054 CG ASP A 65 5.108 0.146 -5.042 1.00 0.00 C ATOM 1055 OD1 ASP A 65 4.556 1.246 -5.284 1.00 0.00 O ATOM 1056 OD2 ASP A 65 4.488 -0.940 -5.071 1.00 0.00 O ATOM 0 H ASP A 65 8.844 0.075 -3.409 1.00 0.00 H new ATOM 0 HA ASP A 65 6.177 1.219 -2.845 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.124 0.896 -5.219 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.031 -0.830 -4.930 1.00 0.00 H new ATOM 1061 N GLU A 66 5.004 -0.933 -2.080 1.00 0.00 N ATOM 1062 CA GLU A 66 4.391 -2.027 -1.313 1.00 0.00 C ATOM 1063 C GLU A 66 4.294 -3.340 -2.117 1.00 0.00 C ATOM 1064 O GLU A 66 4.496 -4.426 -1.565 1.00 0.00 O ATOM 1065 CB GLU A 66 2.987 -1.608 -0.843 1.00 0.00 C ATOM 1066 CG GLU A 66 3.037 -0.422 0.131 1.00 0.00 C ATOM 1067 CD GLU A 66 1.651 -0.074 0.704 1.00 0.00 C ATOM 1068 OE1 GLU A 66 0.713 0.223 -0.077 1.00 0.00 O ATOM 1069 OE2 GLU A 66 1.505 -0.064 1.950 1.00 0.00 O ATOM 0 H GLU A 66 4.327 -0.251 -2.423 1.00 0.00 H new ATOM 0 HA GLU A 66 5.039 -2.219 -0.458 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.380 -1.342 -1.708 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.499 -2.454 -0.359 1.00 0.00 H new ATOM 0 HG2 GLU A 66 3.717 -0.656 0.950 1.00 0.00 H new ATOM 0 HG3 GLU A 66 3.444 0.449 -0.382 1.00 0.00 H new ATOM 1076 N LYS A 67 3.984 -3.251 -3.420 1.00 0.00 N ATOM 1077 CA LYS A 67 3.819 -4.397 -4.334 1.00 0.00 C ATOM 1078 C LYS A 67 5.160 -4.965 -4.805 1.00 0.00 C ATOM 1079 O LYS A 67 5.274 -6.178 -4.999 1.00 0.00 O ATOM 1080 CB LYS A 67 2.965 -3.991 -5.548 1.00 0.00 C ATOM 1081 CG LYS A 67 1.590 -3.446 -5.129 1.00 0.00 C ATOM 1082 CD LYS A 67 0.698 -3.151 -6.341 1.00 0.00 C ATOM 1083 CE LYS A 67 -0.633 -2.566 -5.853 1.00 0.00 C ATOM 1084 NZ LYS A 67 -1.546 -2.254 -6.983 1.00 0.00 N ATOM 0 H LYS A 67 3.836 -2.354 -3.882 1.00 0.00 H new ATOM 0 HA LYS A 67 3.311 -5.182 -3.774 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.494 -3.234 -6.126 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.830 -4.853 -6.201 1.00 0.00 H new ATOM 0 HG2 LYS A 67 1.095 -4.169 -4.481 1.00 0.00 H new ATOM 0 HG3 LYS A 67 1.723 -2.535 -4.546 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.194 -2.449 -7.011 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.522 -4.064 -6.909 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.116 -3.274 -5.180 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -0.443 -1.659 -5.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.435 -1.861 -6.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -1.095 -1.559 -7.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.748 -3.124 -7.516 1.00 0.00 H new ATOM 1098 N ASN A 68 6.169 -4.107 -4.987 1.00 0.00 N ATOM 1099 CA ASN A 68 7.551 -4.542 -5.218 1.00 0.00 C ATOM 1100 C ASN A 68 8.172 -5.059 -3.900 1.00 0.00 C ATOM 1101 O ASN A 68 7.607 -4.868 -2.821 1.00 0.00 O ATOM 1102 CB ASN A 68 8.368 -3.384 -5.828 1.00 0.00 C ATOM 1103 CG ASN A 68 9.712 -3.826 -6.399 1.00 0.00 C ATOM 1104 OD1 ASN A 68 9.925 -4.977 -6.752 1.00 0.00 O ATOM 1105 ND2 ASN A 68 10.674 -2.939 -6.477 1.00 0.00 N ATOM 0 H ASN A 68 6.052 -3.094 -4.978 1.00 0.00 H new ATOM 0 HA ASN A 68 7.563 -5.367 -5.930 1.00 0.00 H new ATOM 0 HB2 ASN A 68 7.783 -2.913 -6.618 1.00 0.00 H new ATOM 0 HB3 ASN A 68 8.538 -2.627 -5.063 1.00 0.00 H new ATOM 0 HD21 ASN A 68 11.591 -3.211 -6.830 1.00 0.00 H new ATOM 0 HD22 ASN A 68 10.505 -1.976 -6.185 1.00 0.00 H new ATOM 1112 N PHE A 69 9.348 -5.685 -3.972 1.00 0.00 N ATOM 1113 CA PHE A 69 10.025 -6.284 -2.818 1.00 0.00 C ATOM 1114 C PHE A 69 11.399 -5.663 -2.524 1.00 0.00 C ATOM 1115 O PHE A 69 12.154 -5.300 -3.430 1.00 0.00 O ATOM 1116 CB PHE A 69 10.119 -7.809 -2.991 1.00 0.00 C ATOM 1117 CG PHE A 69 11.010 -8.291 -4.124 1.00 0.00 C ATOM 1118 CD1 PHE A 69 12.382 -8.522 -3.898 1.00 0.00 C ATOM 1119 CD2 PHE A 69 10.467 -8.522 -5.403 1.00 0.00 C ATOM 1120 CE1 PHE A 69 13.205 -8.974 -4.946 1.00 0.00 C ATOM 1121 CE2 PHE A 69 11.289 -8.979 -6.448 1.00 0.00 C ATOM 1122 CZ PHE A 69 12.658 -9.205 -6.220 1.00 0.00 C ATOM 0 H PHE A 69 9.865 -5.792 -4.845 1.00 0.00 H new ATOM 0 HA PHE A 69 9.415 -6.063 -1.942 1.00 0.00 H new ATOM 0 HB2 PHE A 69 10.483 -8.240 -2.059 1.00 0.00 H new ATOM 0 HB3 PHE A 69 9.114 -8.200 -3.152 1.00 0.00 H new ATOM 0 HD1 PHE A 69 12.803 -8.352 -2.918 1.00 0.00 H new ATOM 0 HD2 PHE A 69 9.416 -8.348 -5.581 1.00 0.00 H new ATOM 0 HE1 PHE A 69 14.257 -9.143 -4.771 1.00 0.00 H new ATOM 0 HE2 PHE A 69 10.869 -9.157 -7.427 1.00 0.00 H new ATOM 0 HZ PHE A 69 13.289 -9.556 -7.023 1.00 0.00 H new ATOM 1132 N VAL A 70 11.723 -5.556 -1.235 1.00 0.00 N ATOM 1133 CA VAL A 70 13.055 -5.220 -0.711 1.00 0.00 C ATOM 1134 C VAL A 70 13.794 -6.538 -0.459 1.00 0.00 C ATOM 1135 O VAL A 70 13.163 -7.568 -0.198 1.00 0.00 O ATOM 1136 CB VAL A 70 12.942 -4.344 0.566 1.00 0.00 C ATOM 1137 CG1 VAL A 70 13.219 -5.071 1.886 1.00 0.00 C ATOM 1138 CG2 VAL A 70 13.886 -3.138 0.499 1.00 0.00 C ATOM 0 H VAL A 70 11.039 -5.707 -0.494 1.00 0.00 H new ATOM 0 HA VAL A 70 13.619 -4.623 -1.428 1.00 0.00 H new ATOM 0 HB VAL A 70 11.895 -4.041 0.572 1.00 0.00 H new ATOM 0 HG11 VAL A 70 13.114 -4.372 2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 70 12.508 -5.888 2.008 1.00 0.00 H new ATOM 0 HG13 VAL A 70 14.233 -5.472 1.875 1.00 0.00 H new ATOM 0 HG21 VAL A 70 13.783 -2.545 1.408 1.00 0.00 H new ATOM 0 HG22 VAL A 70 14.915 -3.486 0.407 1.00 0.00 H new ATOM 0 HG23 VAL A 70 13.632 -2.525 -0.366 1.00 0.00 H new ATOM 1148 N VAL A 71 15.125 -6.519 -0.481 1.00 0.00 N ATOM 1149 CA VAL A 71 15.940 -7.684 -0.104 1.00 0.00 C ATOM 1150 C VAL A 71 16.587 -7.444 1.251 1.00 0.00 C ATOM 1151 O VAL A 71 17.189 -6.397 1.497 1.00 0.00 O ATOM 1152 CB VAL A 71 16.977 -8.040 -1.181 1.00 0.00 C ATOM 1153 CG1 VAL A 71 17.854 -9.225 -0.754 1.00 0.00 C ATOM 1154 CG2 VAL A 71 16.284 -8.460 -2.481 1.00 0.00 C ATOM 0 H VAL A 71 15.671 -5.703 -0.758 1.00 0.00 H new ATOM 0 HA VAL A 71 15.282 -8.549 -0.025 1.00 0.00 H new ATOM 0 HB VAL A 71 17.586 -7.147 -1.324 1.00 0.00 H new ATOM 0 HG11 VAL A 71 18.575 -9.447 -1.541 1.00 0.00 H new ATOM 0 HG12 VAL A 71 18.385 -8.972 0.164 1.00 0.00 H new ATOM 0 HG13 VAL A 71 17.226 -10.099 -0.581 1.00 0.00 H new ATOM 0 HG21 VAL A 71 17.036 -8.708 -3.230 1.00 0.00 H new ATOM 0 HG22 VAL A 71 15.657 -9.332 -2.294 1.00 0.00 H new ATOM 0 HG23 VAL A 71 15.665 -7.640 -2.845 1.00 0.00 H new ATOM 1164 N VAL A 72 16.472 -8.443 2.122 1.00 0.00 N ATOM 1165 CA VAL A 72 17.149 -8.519 3.417 1.00 0.00 C ATOM 1166 C VAL A 72 18.088 -9.727 3.442 1.00 0.00 C ATOM 1167 O VAL A 72 17.745 -10.823 2.991 1.00 0.00 O ATOM 1168 CB VAL A 72 16.136 -8.501 4.580 1.00 0.00 C ATOM 1169 CG1 VAL A 72 15.095 -9.631 4.511 1.00 0.00 C ATOM 1170 CG2 VAL A 72 16.855 -8.526 5.936 1.00 0.00 C ATOM 0 H VAL A 72 15.882 -9.255 1.939 1.00 0.00 H new ATOM 0 HA VAL A 72 17.767 -7.632 3.557 1.00 0.00 H new ATOM 0 HB VAL A 72 15.586 -7.566 4.476 1.00 0.00 H new ATOM 0 HG11 VAL A 72 14.417 -9.554 5.361 1.00 0.00 H new ATOM 0 HG12 VAL A 72 14.527 -9.546 3.585 1.00 0.00 H new ATOM 0 HG13 VAL A 72 15.602 -10.595 4.538 1.00 0.00 H new ATOM 0 HG21 VAL A 72 16.118 -8.513 6.739 1.00 0.00 H new ATOM 0 HG22 VAL A 72 17.458 -9.431 6.012 1.00 0.00 H new ATOM 0 HG23 VAL A 72 17.501 -7.652 6.022 1.00 0.00 H new ATOM 1180 N MET A 73 19.290 -9.523 3.974 1.00 0.00 N ATOM 1181 CA MET A 73 20.286 -10.568 4.223 1.00 0.00 C ATOM 1182 C MET A 73 20.855 -10.459 5.628 1.00 0.00 C ATOM 1183 O MET A 73 20.744 -9.409 6.251 1.00 0.00 O ATOM 1184 CB MET A 73 21.386 -10.524 3.152 1.00 0.00 C ATOM 1185 CG MET A 73 22.217 -9.238 3.119 1.00 0.00 C ATOM 1186 SD MET A 73 23.524 -9.226 1.860 1.00 0.00 S ATOM 1187 CE MET A 73 24.690 -10.419 2.577 1.00 0.00 C ATOM 0 H MET A 73 19.611 -8.596 4.254 1.00 0.00 H new ATOM 0 HA MET A 73 19.796 -11.539 4.155 1.00 0.00 H new ATOM 0 HB2 MET A 73 22.058 -11.367 3.310 1.00 0.00 H new ATOM 0 HB3 MET A 73 20.924 -10.664 2.175 1.00 0.00 H new ATOM 0 HG2 MET A 73 21.551 -8.393 2.943 1.00 0.00 H new ATOM 0 HG3 MET A 73 22.671 -9.087 4.099 1.00 0.00 H new ATOM 0 HE1 MET A 73 25.649 -9.931 2.752 1.00 0.00 H new ATOM 0 HE2 MET A 73 24.294 -10.792 3.522 1.00 0.00 H new ATOM 0 HE3 MET A 73 24.828 -11.252 1.888 1.00 0.00 H new ATOM 1197 N VAL A 74 21.477 -11.532 6.113 1.00 0.00 N ATOM 1198 CA VAL A 74 22.154 -11.605 7.412 1.00 0.00 C ATOM 1199 C VAL A 74 23.520 -12.272 7.237 1.00 0.00 C ATOM 1200 O VAL A 74 23.635 -13.309 6.579 1.00 0.00 O ATOM 1201 CB VAL A 74 21.259 -12.292 8.468 1.00 0.00 C ATOM 1202 CG1 VAL A 74 20.846 -13.727 8.112 1.00 0.00 C ATOM 1203 CG2 VAL A 74 21.907 -12.289 9.856 1.00 0.00 C ATOM 0 H VAL A 74 21.527 -12.409 5.594 1.00 0.00 H new ATOM 0 HA VAL A 74 22.333 -10.600 7.795 1.00 0.00 H new ATOM 0 HB VAL A 74 20.352 -11.688 8.479 1.00 0.00 H new ATOM 0 HG11 VAL A 74 20.220 -14.133 8.907 1.00 0.00 H new ATOM 0 HG12 VAL A 74 20.287 -13.723 7.176 1.00 0.00 H new ATOM 0 HG13 VAL A 74 21.737 -14.345 8.000 1.00 0.00 H new ATOM 0 HG21 VAL A 74 21.245 -12.781 10.568 1.00 0.00 H new ATOM 0 HG22 VAL A 74 22.857 -12.822 9.815 1.00 0.00 H new ATOM 0 HG23 VAL A 74 22.081 -11.261 10.174 1.00 0.00 H new ATOM 1872 N GLU B 283 31.240 -12.522 1.513 1.00 0.00 N ATOM 1873 CA GLU B 283 30.270 -11.481 1.894 1.00 0.00 C ATOM 1874 C GLU B 283 29.936 -10.546 0.712 1.00 0.00 C ATOM 1875 O GLU B 283 28.770 -10.231 0.481 1.00 0.00 O ATOM 1876 CB GLU B 283 30.800 -10.704 3.112 1.00 0.00 C ATOM 1877 CG GLU B 283 29.727 -9.811 3.751 1.00 0.00 C ATOM 1878 CD GLU B 283 30.227 -9.079 5.015 1.00 0.00 C ATOM 1879 OE1 GLU B 283 30.860 -9.712 5.894 1.00 0.00 O ATOM 1880 OE2 GLU B 283 29.953 -7.861 5.152 1.00 0.00 O ATOM 0 HA GLU B 283 29.332 -11.962 2.172 1.00 0.00 H new ATOM 0 HB2 GLU B 283 31.171 -11.409 3.856 1.00 0.00 H new ATOM 0 HB3 GLU B 283 31.646 -10.088 2.806 1.00 0.00 H new ATOM 0 HG2 GLU B 283 29.392 -9.075 3.020 1.00 0.00 H new ATOM 0 HG3 GLU B 283 28.861 -10.421 4.009 1.00 0.00 H new ATOM 1887 N GLU B 284 30.937 -10.164 -0.088 1.00 0.00 N ATOM 1888 CA GLU B 284 30.773 -9.346 -1.300 1.00 0.00 C ATOM 1889 C GLU B 284 29.932 -10.044 -2.386 1.00 0.00 C ATOM 1890 O GLU B 284 29.073 -9.415 -3.006 1.00 0.00 O ATOM 1891 CB GLU B 284 32.149 -8.969 -1.875 1.00 0.00 C ATOM 1892 CG GLU B 284 32.971 -8.090 -0.922 1.00 0.00 C ATOM 1893 CD GLU B 284 34.304 -7.670 -1.572 1.00 0.00 C ATOM 1894 OE1 GLU B 284 34.344 -6.629 -2.273 1.00 0.00 O ATOM 1895 OE2 GLU B 284 35.329 -8.371 -1.380 1.00 0.00 O ATOM 0 H GLU B 284 31.908 -10.420 0.091 1.00 0.00 H new ATOM 0 HA GLU B 284 30.232 -8.448 -1.000 1.00 0.00 H new ATOM 0 HB2 GLU B 284 32.707 -9.879 -2.095 1.00 0.00 H new ATOM 0 HB3 GLU B 284 32.011 -8.443 -2.820 1.00 0.00 H new ATOM 0 HG2 GLU B 284 32.397 -7.203 -0.654 1.00 0.00 H new ATOM 0 HG3 GLU B 284 33.168 -8.634 0.002 1.00 0.00 H new ATOM 1902 N GLU B 285 30.142 -11.342 -2.620 1.00 0.00 N ATOM 1903 CA GLU B 285 29.351 -12.132 -3.577 1.00 0.00 C ATOM 1904 C GLU B 285 27.903 -12.360 -3.102 1.00 0.00 C ATOM 1905 O GLU B 285 26.969 -12.251 -3.900 1.00 0.00 O ATOM 1906 CB GLU B 285 30.041 -13.476 -3.838 1.00 0.00 C ATOM 1907 CG GLU B 285 31.316 -13.338 -4.676 1.00 0.00 C ATOM 1908 CD GLU B 285 31.974 -14.713 -4.894 1.00 0.00 C ATOM 1909 OE1 GLU B 285 32.402 -15.348 -3.901 1.00 0.00 O ATOM 1910 OE2 GLU B 285 32.062 -15.169 -6.062 1.00 0.00 O ATOM 0 H GLU B 285 30.869 -11.881 -2.150 1.00 0.00 H new ATOM 0 HA GLU B 285 29.295 -11.559 -4.503 1.00 0.00 H new ATOM 0 HB2 GLU B 285 30.288 -13.943 -2.885 1.00 0.00 H new ATOM 0 HB3 GLU B 285 29.346 -14.142 -4.349 1.00 0.00 H new ATOM 0 HG2 GLU B 285 31.077 -12.886 -5.639 1.00 0.00 H new ATOM 0 HG3 GLU B 285 32.016 -12.669 -4.175 1.00 0.00 H new ATOM 1917 N GLN B 286 27.694 -12.626 -1.806 1.00 0.00 N ATOM 1918 CA GLN B 286 26.362 -12.713 -1.188 1.00 0.00 C ATOM 1919 C GLN B 286 25.594 -11.385 -1.326 1.00 0.00 C ATOM 1920 O GLN B 286 24.422 -11.376 -1.706 1.00 0.00 O ATOM 1921 CB GLN B 286 26.487 -13.095 0.297 1.00 0.00 C ATOM 1922 CG GLN B 286 27.007 -14.522 0.517 1.00 0.00 C ATOM 1923 CD GLN B 286 27.242 -14.839 1.995 1.00 0.00 C ATOM 1924 OE1 GLN B 286 26.466 -14.488 2.874 1.00 0.00 O ATOM 1925 NE2 GLN B 286 28.314 -15.520 2.339 1.00 0.00 N ATOM 0 H GLN B 286 28.455 -12.789 -1.147 1.00 0.00 H new ATOM 0 HA GLN B 286 25.801 -13.487 -1.712 1.00 0.00 H new ATOM 0 HB2 GLN B 286 27.158 -12.392 0.790 1.00 0.00 H new ATOM 0 HB3 GLN B 286 25.512 -12.994 0.774 1.00 0.00 H new ATOM 0 HG2 GLN B 286 26.291 -15.233 0.106 1.00 0.00 H new ATOM 0 HG3 GLN B 286 27.939 -14.654 -0.032 1.00 0.00 H new ATOM 0 HE21 GLN B 286 28.976 -15.824 1.625 1.00 0.00 H new ATOM 0 HE22 GLN B 286 28.483 -15.744 3.320 1.00 0.00 H new ATOM 1934 N ILE B 287 26.271 -10.258 -1.075 1.00 0.00 N ATOM 1935 CA ILE B 287 25.767 -8.900 -1.344 1.00 0.00 C ATOM 1936 C ILE B 287 25.382 -8.728 -2.820 1.00 0.00 C ATOM 1937 O ILE B 287 24.259 -8.323 -3.102 1.00 0.00 O ATOM 1938 CB ILE B 287 26.775 -7.824 -0.869 1.00 0.00 C ATOM 1939 CG1 ILE B 287 26.745 -7.722 0.672 1.00 0.00 C ATOM 1940 CG2 ILE B 287 26.477 -6.445 -1.485 1.00 0.00 C ATOM 1941 CD1 ILE B 287 27.948 -6.974 1.260 1.00 0.00 C ATOM 0 H ILE B 287 27.207 -10.262 -0.670 1.00 0.00 H new ATOM 0 HA ILE B 287 24.855 -8.759 -0.764 1.00 0.00 H new ATOM 0 HB ILE B 287 27.766 -8.131 -1.203 1.00 0.00 H new ATOM 0 HG12 ILE B 287 25.829 -7.216 0.977 1.00 0.00 H new ATOM 0 HG13 ILE B 287 26.710 -8.726 1.094 1.00 0.00 H new ATOM 0 HG21 ILE B 287 27.207 -5.720 -1.125 1.00 0.00 H new ATOM 0 HG22 ILE B 287 26.536 -6.511 -2.571 1.00 0.00 H new ATOM 0 HG23 ILE B 287 25.476 -6.126 -1.195 1.00 0.00 H new ATOM 0 HD11 ILE B 287 27.860 -6.941 2.346 1.00 0.00 H new ATOM 0 HD12 ILE B 287 28.867 -7.491 0.986 1.00 0.00 H new ATOM 0 HD13 ILE B 287 27.972 -5.958 0.867 1.00 0.00 H new ATOM 1953 N ALA B 288 26.263 -9.032 -3.777 1.00 0.00 N ATOM 1954 CA ALA B 288 25.962 -8.859 -5.203 1.00 0.00 C ATOM 1955 C ALA B 288 24.753 -9.699 -5.678 1.00 0.00 C ATOM 1956 O ALA B 288 23.965 -9.240 -6.509 1.00 0.00 O ATOM 1957 CB ALA B 288 27.226 -9.163 -6.011 1.00 0.00 C ATOM 0 H ALA B 288 27.195 -9.401 -3.590 1.00 0.00 H new ATOM 0 HA ALA B 288 25.662 -7.824 -5.368 1.00 0.00 H new ATOM 0 HB1 ALA B 288 27.017 -9.038 -7.074 1.00 0.00 H new ATOM 0 HB2 ALA B 288 28.021 -8.478 -5.715 1.00 0.00 H new ATOM 0 HB3 ALA B 288 27.541 -10.189 -5.821 1.00 0.00 H new ATOM 1963 N TYR B 289 24.559 -10.898 -5.120 1.00 0.00 N ATOM 1964 CA TYR B 289 23.348 -11.708 -5.304 1.00 0.00 C ATOM 1965 C TYR B 289 22.097 -10.992 -4.750 1.00 0.00 C ATOM 1966 O TYR B 289 21.087 -10.889 -5.452 1.00 0.00 O ATOM 1967 CB TYR B 289 23.588 -13.089 -4.673 1.00 0.00 C ATOM 1968 CG TYR B 289 22.372 -13.983 -4.491 1.00 0.00 C ATOM 1969 CD1 TYR B 289 21.465 -14.207 -5.548 1.00 0.00 C ATOM 1970 CD2 TYR B 289 22.170 -14.620 -3.252 1.00 0.00 C ATOM 1971 CE1 TYR B 289 20.352 -15.052 -5.357 1.00 0.00 C ATOM 1972 CE2 TYR B 289 21.061 -15.463 -3.059 1.00 0.00 C ATOM 1973 CZ TYR B 289 20.146 -15.680 -4.109 1.00 0.00 C ATOM 1974 OH TYR B 289 19.076 -16.499 -3.920 1.00 0.00 O ATOM 0 H TYR B 289 25.251 -11.342 -4.517 1.00 0.00 H new ATOM 0 HA TYR B 289 23.145 -11.847 -6.366 1.00 0.00 H new ATOM 0 HB2 TYR B 289 24.312 -13.622 -5.289 1.00 0.00 H new ATOM 0 HB3 TYR B 289 24.049 -12.940 -3.696 1.00 0.00 H new ATOM 0 HD1 TYR B 289 21.623 -13.731 -6.504 1.00 0.00 H new ATOM 0 HD2 TYR B 289 22.870 -14.460 -2.445 1.00 0.00 H new ATOM 0 HE1 TYR B 289 19.656 -15.219 -6.166 1.00 0.00 H new ATOM 0 HE2 TYR B 289 20.910 -15.945 -2.104 1.00 0.00 H new ATOM 0 HH TYR B 289 18.959 -16.668 -2.962 1.00 0.00 H new ATOM 1984 N ALA B 290 22.172 -10.417 -3.541 1.00 0.00 N ATOM 1985 CA ALA B 290 21.125 -9.564 -2.970 1.00 0.00 C ATOM 1986 C ALA B 290 20.771 -8.361 -3.872 1.00 0.00 C ATOM 1987 O ALA B 290 19.592 -8.090 -4.119 1.00 0.00 O ATOM 1988 CB ALA B 290 21.564 -9.096 -1.574 1.00 0.00 C ATOM 0 H ALA B 290 22.976 -10.535 -2.924 1.00 0.00 H new ATOM 0 HA ALA B 290 20.214 -10.157 -2.893 1.00 0.00 H new ATOM 0 HB1 ALA B 290 20.790 -8.461 -1.143 1.00 0.00 H new ATOM 0 HB2 ALA B 290 21.721 -9.963 -0.932 1.00 0.00 H new ATOM 0 HB3 ALA B 290 22.493 -8.532 -1.655 1.00 0.00 H new ATOM 1994 N MET B 291 21.787 -7.658 -4.392 1.00 0.00 N ATOM 1995 CA MET B 291 21.660 -6.557 -5.341 1.00 0.00 C ATOM 1996 C MET B 291 20.889 -6.994 -6.588 1.00 0.00 C ATOM 1997 O MET B 291 19.834 -6.426 -6.858 1.00 0.00 O ATOM 1998 CB MET B 291 23.037 -5.975 -5.707 1.00 0.00 C ATOM 1999 CG MET B 291 23.747 -5.319 -4.518 1.00 0.00 C ATOM 2000 SD MET B 291 25.348 -4.579 -4.937 1.00 0.00 S ATOM 2001 CE MET B 291 25.548 -3.480 -3.509 1.00 0.00 C ATOM 0 H MET B 291 22.758 -7.854 -4.149 1.00 0.00 H new ATOM 0 HA MET B 291 21.088 -5.764 -4.859 1.00 0.00 H new ATOM 0 HB2 MET B 291 23.667 -6.770 -6.105 1.00 0.00 H new ATOM 0 HB3 MET B 291 22.914 -5.238 -6.501 1.00 0.00 H new ATOM 0 HG2 MET B 291 23.099 -4.548 -4.101 1.00 0.00 H new ATOM 0 HG3 MET B 291 23.896 -6.066 -3.739 1.00 0.00 H new ATOM 0 HE1 MET B 291 26.564 -3.086 -3.492 1.00 0.00 H new ATOM 0 HE2 MET B 291 24.840 -2.654 -3.583 1.00 0.00 H new ATOM 0 HE3 MET B 291 25.360 -4.038 -2.592 1.00 0.00 H new ATOM 2011 N GLN B 292 21.361 -8.015 -7.313 1.00 0.00 N ATOM 2012 CA GLN B 292 20.712 -8.520 -8.531 1.00 0.00 C ATOM 2013 C GLN B 292 19.224 -8.843 -8.326 1.00 0.00 C ATOM 2014 O GLN B 292 18.413 -8.483 -9.177 1.00 0.00 O ATOM 2015 CB GLN B 292 21.487 -9.737 -9.070 1.00 0.00 C ATOM 2016 CG GLN B 292 20.837 -10.422 -10.292 1.00 0.00 C ATOM 2017 CD GLN B 292 20.573 -9.515 -11.500 1.00 0.00 C ATOM 2018 OE1 GLN B 292 19.505 -9.539 -12.099 1.00 0.00 O ATOM 2019 NE2 GLN B 292 21.526 -8.711 -11.929 1.00 0.00 N ATOM 0 H GLN B 292 22.213 -8.520 -7.069 1.00 0.00 H new ATOM 0 HA GLN B 292 20.741 -7.723 -9.274 1.00 0.00 H new ATOM 0 HB2 GLN B 292 22.494 -9.419 -9.341 1.00 0.00 H new ATOM 0 HB3 GLN B 292 21.588 -10.470 -8.270 1.00 0.00 H new ATOM 0 HG2 GLN B 292 21.480 -11.242 -10.610 1.00 0.00 H new ATOM 0 HG3 GLN B 292 19.891 -10.862 -9.978 1.00 0.00 H new ATOM 0 HE21 GLN B 292 22.422 -8.677 -11.443 1.00 0.00 H new ATOM 0 HE22 GLN B 292 21.367 -8.123 -12.747 1.00 0.00 H new ATOM 2028 N MET B 293 18.841 -9.477 -7.212 1.00 0.00 N ATOM 2029 CA MET B 293 17.430 -9.767 -6.926 1.00 0.00 C ATOM 2030 C MET B 293 16.572 -8.491 -6.851 1.00 0.00 C ATOM 2031 O MET B 293 15.603 -8.364 -7.602 1.00 0.00 O ATOM 2032 CB MET B 293 17.289 -10.606 -5.648 1.00 0.00 C ATOM 2033 CG MET B 293 17.727 -12.058 -5.868 1.00 0.00 C ATOM 2034 SD MET B 293 17.287 -13.184 -4.515 1.00 0.00 S ATOM 2035 CE MET B 293 18.359 -12.549 -3.200 1.00 0.00 C ATOM 0 H MET B 293 19.488 -9.800 -6.493 1.00 0.00 H new ATOM 0 HA MET B 293 17.050 -10.352 -7.763 1.00 0.00 H new ATOM 0 HB2 MET B 293 17.889 -10.162 -4.854 1.00 0.00 H new ATOM 0 HB3 MET B 293 16.252 -10.586 -5.313 1.00 0.00 H new ATOM 0 HG2 MET B 293 17.278 -12.425 -6.791 1.00 0.00 H new ATOM 0 HG3 MET B 293 18.808 -12.082 -6.008 1.00 0.00 H new ATOM 0 HE1 MET B 293 18.074 -13.000 -2.249 1.00 0.00 H new ATOM 0 HE2 MET B 293 19.396 -12.799 -3.424 1.00 0.00 H new ATOM 0 HE3 MET B 293 18.252 -11.466 -3.135 1.00 0.00 H new ATOM 2045 N SER B 294 16.918 -7.532 -5.981 1.00 0.00 N ATOM 2046 CA SER B 294 16.159 -6.271 -5.854 1.00 0.00 C ATOM 2047 C SER B 294 16.198 -5.406 -7.123 1.00 0.00 C ATOM 2048 O SER B 294 15.199 -4.783 -7.483 1.00 0.00 O ATOM 2049 CB SER B 294 16.642 -5.444 -4.659 1.00 0.00 C ATOM 2050 OG SER B 294 17.932 -4.915 -4.892 1.00 0.00 O ATOM 0 H SER B 294 17.718 -7.602 -5.353 1.00 0.00 H new ATOM 0 HA SER B 294 15.124 -6.573 -5.695 1.00 0.00 H new ATOM 0 HB2 SER B 294 15.941 -4.631 -4.469 1.00 0.00 H new ATOM 0 HB3 SER B 294 16.657 -6.067 -3.765 1.00 0.00 H new ATOM 0 HG SER B 294 18.412 -5.490 -5.524 1.00 0.00 H new