USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1058 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 17 THR OG1 : rot 17:sc= 0.6 USER MOD Set 1.2: A 20 SER OG : rot -33:sc= 1.11 USER MOD Single : A 4 SER OG : rot 170:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.218 X(o=-0.22,f=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 MET CE :methyl 154:sc= -0.437 (180deg=-2.08!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.155 K(o=-0.15,f=-0.9) USER MOD Single : A 31 GLN : amide:sc= -0.553 K(o=-0.55,f=-3.6!) USER MOD Single : A 33 CYS SG : rot 180:sc= 0 USER MOD Single : A 34 ASN :FLIP amide:sc= -0.732 F(o=-2.3!,f=-0.73) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 38 SER OG : rot 128:sc= -0.473 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 130:sc= 1.25 USER MOD Single : A 53 SER OG : rot -28:sc= 0.86 USER MOD Single : A 54 LYS NZ :NH3+ -137:sc= -0.311 (180deg=-2.33!) USER MOD Single : A 59 ASN :FLIP amide:sc= -1.56 F(o=-2.3,f=-1.6) USER MOD Single : B 4 SER OG : rot -98:sc= -0.304 USER MOD Single : B 5 ASN :FLIP amide:sc= -0.788 F(o=-2.9!,f=-0.79) USER MOD Single : B 8 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0208) USER MOD Single : B 15 SER OG : rot -10:sc= 1 USER MOD Single : B 17 THR OG1 : rot 180:sc= -0.732 USER MOD Single : B 19 LYS NZ :NH3+ 161:sc= -0.038 (180deg=-0.476) USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 25 MET CE :methyl -104:sc= 0 (180deg=-0.0931) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 30 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.25) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : B 33 CYS SG : rot 180:sc= 0 USER MOD Single : B 34 ASN :FLIP amide:sc= -0.73 F(o=-2.7,f=-0.73) USER MOD Single : B 37 GLN : amide:sc= -0.116 K(o=-0.12,f=-2.3!) USER MOD Single : B 38 SER OG : rot 180:sc= 0 USER MOD Single : B 40 THR OG1 : rot 180:sc= 0 USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 SER OG : rot 180:sc= 0 USER MOD Single : B 54 LYS NZ :NH3+ 144:sc= -1.28! (180deg=-1.83!) USER MOD Single : B 59 ASN : amide:sc= -0.717 X(o=-0.72,f=-0.89) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 8.228 12.548 9.105 1.00 0.00 N ATOM 21 CA GLU A 2 8.415 11.191 8.511 1.00 0.00 C ATOM 22 C GLU A 2 7.311 10.910 7.492 1.00 0.00 C ATOM 23 O GLU A 2 6.553 11.784 7.119 1.00 0.00 O ATOM 24 CB GLU A 2 8.372 10.130 9.616 1.00 0.00 C ATOM 25 CG GLU A 2 9.599 10.292 10.520 1.00 0.00 C ATOM 26 CD GLU A 2 9.699 9.114 11.494 1.00 0.00 C ATOM 27 OE1 GLU A 2 8.803 8.285 11.490 1.00 0.00 O ATOM 28 OE2 GLU A 2 10.681 9.050 12.217 1.00 0.00 O ATOM 0 HA GLU A 2 9.383 11.155 8.011 1.00 0.00 H new ATOM 0 HB2 GLU A 2 7.458 10.234 10.201 1.00 0.00 H new ATOM 0 HB3 GLU A 2 8.358 9.132 9.178 1.00 0.00 H new ATOM 0 HG2 GLU A 2 10.502 10.348 9.912 1.00 0.00 H new ATOM 0 HG3 GLU A 2 9.529 11.227 11.075 1.00 0.00 H new ATOM 35 N LEU A 3 7.237 9.698 7.021 1.00 0.00 N ATOM 36 CA LEU A 3 6.210 9.347 5.999 1.00 0.00 C ATOM 37 C LEU A 3 4.802 9.565 6.565 1.00 0.00 C ATOM 38 O LEU A 3 3.968 10.218 5.965 1.00 0.00 O ATOM 39 CB LEU A 3 6.380 7.858 5.621 1.00 0.00 C ATOM 40 CG LEU A 3 5.905 7.621 4.178 1.00 0.00 C ATOM 41 CD1 LEU A 3 4.469 8.140 4.010 1.00 0.00 C ATOM 42 CD2 LEU A 3 6.844 8.357 3.193 1.00 0.00 C ATOM 0 H LEU A 3 7.847 8.930 7.301 1.00 0.00 H new ATOM 0 HA LEU A 3 6.339 9.981 5.122 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.426 7.567 5.720 1.00 0.00 H new ATOM 0 HB3 LEU A 3 5.809 7.233 6.307 1.00 0.00 H new ATOM 0 HG LEU A 3 5.926 6.552 3.965 1.00 0.00 H new ATOM 0 HD11 LEU A 3 4.138 7.969 2.986 1.00 0.00 H new ATOM 0 HD12 LEU A 3 3.808 7.612 4.698 1.00 0.00 H new ATOM 0 HD13 LEU A 3 4.440 9.208 4.227 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.505 8.187 2.171 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.830 9.426 3.407 1.00 0.00 H new ATOM 0 HD23 LEU A 3 7.860 7.977 3.306 1.00 0.00 H new ATOM 54 N SER A 4 4.535 9.010 7.709 1.00 0.00 N ATOM 55 CA SER A 4 3.188 9.157 8.327 1.00 0.00 C ATOM 56 C SER A 4 2.973 10.608 8.761 1.00 0.00 C ATOM 57 O SER A 4 1.868 11.116 8.745 1.00 0.00 O ATOM 58 CB SER A 4 3.088 8.231 9.542 1.00 0.00 C ATOM 59 OG SER A 4 4.110 8.562 10.479 1.00 0.00 O ATOM 0 H SER A 4 5.198 8.454 8.250 1.00 0.00 H new ATOM 0 HA SER A 4 2.421 8.888 7.600 1.00 0.00 H new ATOM 0 HB2 SER A 4 2.107 8.330 10.008 1.00 0.00 H new ATOM 0 HB3 SER A 4 3.189 7.192 9.230 1.00 0.00 H new ATOM 0 HG SER A 4 3.950 8.085 11.320 1.00 0.00 H new ATOM 65 N ASN A 5 4.026 11.269 9.161 1.00 0.00 N ATOM 66 CA ASN A 5 3.909 12.689 9.617 1.00 0.00 C ATOM 67 C ASN A 5 3.438 13.578 8.463 1.00 0.00 C ATOM 68 O ASN A 5 2.590 14.434 8.629 1.00 0.00 O ATOM 69 CB ASN A 5 5.281 13.173 10.087 1.00 0.00 C ATOM 70 CG ASN A 5 5.131 14.516 10.799 1.00 0.00 C ATOM 71 OD1 ASN A 5 5.059 14.571 12.010 1.00 0.00 O ATOM 72 ND2 ASN A 5 5.078 15.614 10.093 1.00 0.00 N ATOM 0 H ASN A 5 4.970 10.885 9.192 1.00 0.00 H new ATOM 0 HA ASN A 5 3.186 12.745 10.430 1.00 0.00 H new ATOM 0 HB2 ASN A 5 5.726 12.440 10.760 1.00 0.00 H new ATOM 0 HB3 ASN A 5 5.954 13.274 9.236 1.00 0.00 H new ATOM 0 HD21 ASN A 5 4.976 16.516 10.559 1.00 0.00 H new ATOM 0 HD22 ASN A 5 5.138 15.570 9.076 1.00 0.00 H new ATOM 79 N GLU A 6 3.982 13.374 7.297 1.00 0.00 N ATOM 80 CA GLU A 6 3.577 14.196 6.119 1.00 0.00 C ATOM 81 C GLU A 6 2.123 13.883 5.783 1.00 0.00 C ATOM 82 O GLU A 6 1.352 14.746 5.406 1.00 0.00 O ATOM 83 CB GLU A 6 4.448 13.809 4.920 1.00 0.00 C ATOM 84 CG GLU A 6 5.899 14.227 5.173 1.00 0.00 C ATOM 85 CD GLU A 6 6.819 13.526 4.171 1.00 0.00 C ATOM 86 OE1 GLU A 6 6.753 12.310 4.090 1.00 0.00 O ATOM 87 OE2 GLU A 6 7.573 14.213 3.500 1.00 0.00 O ATOM 0 H GLU A 6 4.694 12.669 7.106 1.00 0.00 H new ATOM 0 HA GLU A 6 3.696 15.256 6.344 1.00 0.00 H new ATOM 0 HB2 GLU A 6 4.394 12.733 4.753 1.00 0.00 H new ATOM 0 HB3 GLU A 6 4.074 14.291 4.017 1.00 0.00 H new ATOM 0 HG2 GLU A 6 5.998 15.308 5.078 1.00 0.00 H new ATOM 0 HG3 GLU A 6 6.190 13.969 6.191 1.00 0.00 H new ATOM 94 N LEU A 7 1.765 12.636 5.905 1.00 0.00 N ATOM 95 CA LEU A 7 0.377 12.205 5.586 1.00 0.00 C ATOM 96 C LEU A 7 -0.610 12.890 6.535 1.00 0.00 C ATOM 97 O LEU A 7 -1.679 13.316 6.140 1.00 0.00 O ATOM 98 CB LEU A 7 0.272 10.683 5.747 1.00 0.00 C ATOM 99 CG LEU A 7 -1.100 10.202 5.258 1.00 0.00 C ATOM 100 CD1 LEU A 7 -1.236 10.454 3.742 1.00 0.00 C ATOM 101 CD2 LEU A 7 -1.253 8.705 5.550 1.00 0.00 C ATOM 0 H LEU A 7 2.384 11.888 6.216 1.00 0.00 H new ATOM 0 HA LEU A 7 0.137 12.484 4.560 1.00 0.00 H new ATOM 0 HB2 LEU A 7 1.063 10.193 5.179 1.00 0.00 H new ATOM 0 HB3 LEU A 7 0.413 10.408 6.792 1.00 0.00 H new ATOM 0 HG LEU A 7 -1.881 10.754 5.781 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.213 10.110 3.402 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -1.137 11.521 3.540 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.455 9.910 3.211 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.228 8.364 5.202 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.469 8.151 5.033 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -1.170 8.533 6.623 1.00 0.00 H new ATOM 113 N LYS A 8 -0.259 12.987 7.787 1.00 0.00 N ATOM 114 CA LYS A 8 -1.162 13.639 8.779 1.00 0.00 C ATOM 115 C LYS A 8 -1.340 15.113 8.420 1.00 0.00 C ATOM 116 O LYS A 8 -2.404 15.682 8.576 1.00 0.00 O ATOM 117 CB LYS A 8 -0.548 13.535 10.174 1.00 0.00 C ATOM 118 CG LYS A 8 -0.627 12.087 10.660 1.00 0.00 C ATOM 119 CD LYS A 8 0.099 11.945 12.004 1.00 0.00 C ATOM 120 CE LYS A 8 -0.766 12.526 13.130 1.00 0.00 C ATOM 121 NZ LYS A 8 -0.196 12.133 14.446 1.00 0.00 N ATOM 0 H LYS A 8 0.621 12.640 8.169 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.131 13.139 8.765 1.00 0.00 H new ATOM 0 HB2 LYS A 8 0.490 13.866 10.151 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -1.077 14.191 10.865 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -1.669 11.787 10.767 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -0.178 11.422 9.922 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.312 10.895 12.203 1.00 0.00 H new ATOM 0 HD3 LYS A 8 1.057 12.463 11.966 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -0.806 13.612 13.049 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.790 12.162 13.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -0.782 12.527 15.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -0.180 11.096 14.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 0.773 12.501 14.528 1.00 0.00 H new ATOM 135 N VAL A 9 -0.291 15.734 7.954 1.00 0.00 N ATOM 136 CA VAL A 9 -0.363 17.180 7.591 1.00 0.00 C ATOM 137 C VAL A 9 -1.408 17.384 6.493 1.00 0.00 C ATOM 138 O VAL A 9 -2.209 18.299 6.546 1.00 0.00 O ATOM 139 CB VAL A 9 1.003 17.638 7.068 1.00 0.00 C ATOM 140 CG1 VAL A 9 0.893 19.066 6.525 1.00 0.00 C ATOM 141 CG2 VAL A 9 2.031 17.604 8.205 1.00 0.00 C ATOM 0 H VAL A 9 0.620 15.299 7.808 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.640 17.759 8.472 1.00 0.00 H new ATOM 0 HB VAL A 9 1.324 16.968 6.270 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.865 19.390 6.154 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.167 19.091 5.712 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.568 19.734 7.322 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.001 17.930 7.829 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.710 18.270 9.006 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.115 16.588 8.590 1.00 0.00 H new ATOM 151 N GLU A 10 -1.396 16.545 5.497 1.00 0.00 N ATOM 152 CA GLU A 10 -2.380 16.680 4.384 1.00 0.00 C ATOM 153 C GLU A 10 -3.780 16.386 4.914 1.00 0.00 C ATOM 154 O GLU A 10 -4.743 17.033 4.552 1.00 0.00 O ATOM 155 CB GLU A 10 -2.023 15.678 3.277 1.00 0.00 C ATOM 156 CG GLU A 10 -0.932 16.259 2.371 1.00 0.00 C ATOM 157 CD GLU A 10 0.390 16.347 3.138 1.00 0.00 C ATOM 158 OE1 GLU A 10 1.134 15.381 3.109 1.00 0.00 O ATOM 159 OE2 GLU A 10 0.636 17.381 3.738 1.00 0.00 O ATOM 0 H GLU A 10 -0.744 15.766 5.404 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.352 17.692 3.981 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.679 14.743 3.719 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.910 15.445 2.688 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.809 15.632 1.488 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -1.226 17.249 2.021 1.00 0.00 H new ATOM 166 N ARG A 11 -3.888 15.422 5.779 1.00 0.00 N ATOM 167 CA ARG A 11 -5.214 15.080 6.362 1.00 0.00 C ATOM 168 C ARG A 11 -5.744 16.328 7.060 1.00 0.00 C ATOM 169 O ARG A 11 -6.893 16.705 6.919 1.00 0.00 O ATOM 170 CB ARG A 11 -5.030 13.968 7.406 1.00 0.00 C ATOM 171 CG ARG A 11 -6.392 13.535 7.964 1.00 0.00 C ATOM 172 CD ARG A 11 -6.190 12.522 9.101 1.00 0.00 C ATOM 173 NE ARG A 11 -5.544 13.206 10.265 1.00 0.00 N ATOM 174 CZ ARG A 11 -5.128 12.511 11.294 1.00 0.00 C ATOM 175 NH1 ARG A 11 -5.274 11.215 11.326 1.00 0.00 N ATOM 176 NH2 ARG A 11 -4.561 13.125 12.299 1.00 0.00 N ATOM 0 H ARG A 11 -3.110 14.851 6.111 1.00 0.00 H new ATOM 0 HA ARG A 11 -5.903 14.743 5.587 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -4.526 13.114 6.953 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -4.393 14.322 8.216 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -6.938 14.404 8.332 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -6.995 13.091 7.172 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -7.149 12.098 9.400 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -5.568 11.695 8.760 1.00 0.00 H new ATOM 0 HE ARG A 11 -5.427 14.219 10.257 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -5.716 10.732 10.544 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -4.946 10.685 12.133 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -4.445 14.138 12.278 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -4.234 12.591 13.104 1.00 0.00 H new ATOM 190 N ILE A 12 -4.885 16.968 7.805 1.00 0.00 N ATOM 191 CA ILE A 12 -5.264 18.209 8.533 1.00 0.00 C ATOM 192 C ILE A 12 -5.511 19.338 7.526 1.00 0.00 C ATOM 193 O ILE A 12 -6.438 20.114 7.661 1.00 0.00 O ATOM 194 CB ILE A 12 -4.130 18.609 9.482 1.00 0.00 C ATOM 195 CG1 ILE A 12 -4.004 17.552 10.588 1.00 0.00 C ATOM 196 CG2 ILE A 12 -4.451 19.966 10.113 1.00 0.00 C ATOM 197 CD1 ILE A 12 -2.684 17.741 11.342 1.00 0.00 C ATOM 0 H ILE A 12 -3.917 16.676 7.941 1.00 0.00 H new ATOM 0 HA ILE A 12 -6.173 18.031 9.107 1.00 0.00 H new ATOM 0 HB ILE A 12 -3.194 18.677 8.928 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.843 17.635 11.279 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -4.045 16.553 10.155 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.645 20.253 10.789 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -4.552 20.717 9.329 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -5.385 19.896 10.671 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.601 16.988 12.125 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.850 17.636 10.648 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.660 18.734 11.790 1.00 0.00 H new ATOM 209 N ARG A 13 -4.674 19.441 6.528 1.00 0.00 N ATOM 210 CA ARG A 13 -4.833 20.525 5.515 1.00 0.00 C ATOM 211 C ARG A 13 -6.209 20.410 4.863 1.00 0.00 C ATOM 212 O ARG A 13 -6.898 21.391 4.665 1.00 0.00 O ATOM 213 CB ARG A 13 -3.760 20.376 4.432 1.00 0.00 C ATOM 214 CG ARG A 13 -3.861 21.542 3.446 1.00 0.00 C ATOM 215 CD ARG A 13 -2.853 21.356 2.316 1.00 0.00 C ATOM 216 NE ARG A 13 -1.463 21.484 2.860 1.00 0.00 N ATOM 217 CZ ARG A 13 -0.551 22.191 2.235 1.00 0.00 C ATOM 218 NH1 ARG A 13 -0.828 22.822 1.127 1.00 0.00 N ATOM 219 NH2 ARG A 13 0.654 22.265 2.734 1.00 0.00 N ATOM 0 H ARG A 13 -3.883 18.817 6.370 1.00 0.00 H new ATOM 0 HA ARG A 13 -4.732 21.493 6.005 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -2.770 20.356 4.887 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.888 19.430 3.906 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.870 21.599 3.039 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -3.672 22.483 3.962 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -2.985 20.378 1.854 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -3.021 22.101 1.538 1.00 0.00 H new ATOM 0 HE ARG A 13 -1.221 21.013 3.732 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -1.767 22.771 0.732 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -0.106 23.366 0.656 1.00 0.00 H new ATOM 0 HH21 ARG A 13 0.878 21.776 3.601 1.00 0.00 H new ATOM 0 HH22 ARG A 13 1.371 22.812 2.257 1.00 0.00 H new ATOM 233 N LEU A 14 -6.607 19.216 4.523 1.00 0.00 N ATOM 234 CA LEU A 14 -7.938 19.020 3.878 1.00 0.00 C ATOM 235 C LEU A 14 -8.981 18.735 4.959 1.00 0.00 C ATOM 236 O LEU A 14 -10.160 18.610 4.682 1.00 0.00 O ATOM 237 CB LEU A 14 -7.857 17.836 2.902 1.00 0.00 C ATOM 238 CG LEU A 14 -6.853 18.146 1.779 1.00 0.00 C ATOM 239 CD1 LEU A 14 -6.711 16.919 0.873 1.00 0.00 C ATOM 240 CD2 LEU A 14 -7.344 19.343 0.942 1.00 0.00 C ATOM 0 H LEU A 14 -6.066 18.363 4.664 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.224 19.918 3.330 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -7.552 16.935 3.435 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.841 17.637 2.477 1.00 0.00 H new ATOM 0 HG LEU A 14 -5.889 18.394 2.223 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -6.000 17.136 0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.352 16.073 1.459 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -7.680 16.674 0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.625 19.553 0.150 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.311 19.105 0.500 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.444 20.219 1.583 1.00 0.00 H new ATOM 252 N SER A 15 -8.547 18.639 6.192 1.00 0.00 N ATOM 253 CA SER A 15 -9.482 18.365 7.329 1.00 0.00 C ATOM 254 C SER A 15 -10.530 17.340 6.912 1.00 0.00 C ATOM 255 O SER A 15 -11.693 17.647 6.741 1.00 0.00 O ATOM 256 CB SER A 15 -10.160 19.665 7.764 1.00 0.00 C ATOM 257 OG SER A 15 -10.967 19.411 8.905 1.00 0.00 O ATOM 0 H SER A 15 -7.569 18.740 6.463 1.00 0.00 H new ATOM 0 HA SER A 15 -8.915 17.961 8.167 1.00 0.00 H new ATOM 0 HB2 SER A 15 -9.410 20.421 7.995 1.00 0.00 H new ATOM 0 HB3 SER A 15 -10.771 20.060 6.952 1.00 0.00 H new ATOM 0 HG SER A 15 -11.403 20.242 9.189 1.00 0.00 H new ATOM 263 N LEU A 16 -10.109 16.116 6.746 1.00 0.00 N ATOM 264 CA LEU A 16 -11.051 15.032 6.327 1.00 0.00 C ATOM 265 C LEU A 16 -11.403 14.151 7.518 1.00 0.00 C ATOM 266 O LEU A 16 -10.556 13.754 8.294 1.00 0.00 O ATOM 267 CB LEU A 16 -10.386 14.183 5.246 1.00 0.00 C ATOM 268 CG LEU A 16 -9.999 15.080 4.066 1.00 0.00 C ATOM 269 CD1 LEU A 16 -9.244 14.254 3.021 1.00 0.00 C ATOM 270 CD2 LEU A 16 -11.267 15.682 3.432 1.00 0.00 C ATOM 0 H LEU A 16 -9.144 15.815 6.883 1.00 0.00 H new ATOM 0 HA LEU A 16 -11.965 15.481 5.939 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.501 13.689 5.648 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -11.066 13.398 4.914 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.358 15.887 4.422 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.969 14.893 2.182 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.343 13.836 3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.882 13.444 2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.987 16.319 2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.913 14.879 3.078 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.800 16.275 4.176 1.00 0.00 H new ATOM 282 N THR A 17 -12.663 13.851 7.654 1.00 0.00 N ATOM 283 CA THR A 17 -13.126 13.002 8.782 1.00 0.00 C ATOM 284 C THR A 17 -12.748 11.545 8.525 1.00 0.00 C ATOM 285 O THR A 17 -12.856 11.035 7.426 1.00 0.00 O ATOM 286 CB THR A 17 -14.647 13.138 8.923 1.00 0.00 C ATOM 287 OG1 THR A 17 -15.266 12.998 7.649 1.00 0.00 O ATOM 288 CG2 THR A 17 -14.974 14.518 9.500 1.00 0.00 C ATOM 0 H THR A 17 -13.401 14.163 7.022 1.00 0.00 H new ATOM 0 HA THR A 17 -12.648 13.327 9.706 1.00 0.00 H new ATOM 0 HB THR A 17 -15.021 12.360 9.588 1.00 0.00 H new ATOM 0 HG1 THR A 17 -14.634 12.589 7.022 1.00 0.00 H new ATOM 0 HG21 THR A 17 -16.054 14.623 9.603 1.00 0.00 H new ATOM 0 HG22 THR A 17 -14.504 14.624 10.478 1.00 0.00 H new ATOM 0 HG23 THR A 17 -14.597 15.291 8.830 1.00 0.00 H new ATOM 296 N ALA A 18 -12.299 10.882 9.551 1.00 0.00 N ATOM 297 CA ALA A 18 -11.888 9.455 9.432 1.00 0.00 C ATOM 298 C ALA A 18 -13.104 8.601 9.084 1.00 0.00 C ATOM 299 O ALA A 18 -13.017 7.654 8.324 1.00 0.00 O ATOM 300 CB ALA A 18 -11.315 8.989 10.772 1.00 0.00 C ATOM 0 H ALA A 18 -12.197 11.276 10.486 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.137 9.354 8.649 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.011 7.945 10.695 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -10.450 9.600 11.030 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.075 9.089 11.547 1.00 0.00 H new ATOM 306 N LYS A 19 -14.232 8.933 9.638 1.00 0.00 N ATOM 307 CA LYS A 19 -15.470 8.158 9.359 1.00 0.00 C ATOM 308 C LYS A 19 -15.819 8.260 7.874 1.00 0.00 C ATOM 309 O LYS A 19 -16.185 7.287 7.242 1.00 0.00 O ATOM 310 CB LYS A 19 -16.619 8.733 10.194 1.00 0.00 C ATOM 311 CG LYS A 19 -17.887 7.913 9.961 1.00 0.00 C ATOM 312 CD LYS A 19 -19.010 8.429 10.864 1.00 0.00 C ATOM 313 CE LYS A 19 -20.270 7.590 10.637 1.00 0.00 C ATOM 314 NZ LYS A 19 -21.367 8.095 11.512 1.00 0.00 N ATOM 0 H LYS A 19 -14.352 9.717 10.280 1.00 0.00 H new ATOM 0 HA LYS A 19 -15.312 7.111 9.618 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -16.355 8.719 11.251 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -16.793 9.774 9.922 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -18.188 7.981 8.916 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -17.694 6.861 10.170 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -18.706 8.373 11.909 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -19.214 9.478 10.647 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -20.571 7.642 9.591 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -20.067 6.542 10.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -22.224 7.526 11.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -21.077 8.023 12.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -21.566 9.089 11.280 1.00 0.00 H new ATOM 328 N SER A 20 -15.719 9.438 7.318 1.00 0.00 N ATOM 329 CA SER A 20 -16.059 9.622 5.875 1.00 0.00 C ATOM 330 C SER A 20 -15.154 8.746 5.004 1.00 0.00 C ATOM 331 O SER A 20 -15.618 8.015 4.150 1.00 0.00 O ATOM 332 CB SER A 20 -15.851 11.092 5.491 1.00 0.00 C ATOM 333 OG SER A 20 -14.492 11.451 5.719 1.00 0.00 O ATOM 0 H SER A 20 -15.416 10.283 7.801 1.00 0.00 H new ATOM 0 HA SER A 20 -17.098 9.335 5.715 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.109 11.246 4.443 1.00 0.00 H new ATOM 0 HB3 SER A 20 -16.511 11.730 6.079 1.00 0.00 H new ATOM 0 HG SER A 20 -14.150 10.960 6.495 1.00 0.00 H new ATOM 339 N VAL A 21 -13.867 8.812 5.213 1.00 0.00 N ATOM 340 CA VAL A 21 -12.927 7.982 4.399 1.00 0.00 C ATOM 341 C VAL A 21 -13.089 6.506 4.770 1.00 0.00 C ATOM 342 O VAL A 21 -13.093 5.636 3.922 1.00 0.00 O ATOM 343 CB VAL A 21 -11.482 8.422 4.665 1.00 0.00 C ATOM 344 CG1 VAL A 21 -10.517 7.491 3.923 1.00 0.00 C ATOM 345 CG2 VAL A 21 -11.285 9.857 4.166 1.00 0.00 C ATOM 0 H VAL A 21 -13.423 9.406 5.914 1.00 0.00 H new ATOM 0 HA VAL A 21 -13.155 8.117 3.342 1.00 0.00 H new ATOM 0 HB VAL A 21 -11.282 8.376 5.735 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.491 7.805 4.113 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -10.655 6.469 4.275 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.718 7.537 2.853 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -10.258 10.170 4.355 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.487 9.901 3.096 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -11.970 10.522 4.692 1.00 0.00 H new ATOM 355 N ALA A 22 -13.202 6.225 6.040 1.00 0.00 N ATOM 356 CA ALA A 22 -13.343 4.810 6.497 1.00 0.00 C ATOM 357 C ALA A 22 -14.586 4.173 5.874 1.00 0.00 C ATOM 358 O ALA A 22 -14.543 3.069 5.367 1.00 0.00 O ATOM 359 CB ALA A 22 -13.483 4.783 8.023 1.00 0.00 C ATOM 0 H ALA A 22 -13.203 6.919 6.787 1.00 0.00 H new ATOM 0 HA ALA A 22 -12.460 4.250 6.189 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.586 3.752 8.361 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.597 5.227 8.478 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -14.365 5.351 8.318 1.00 0.00 H new ATOM 365 N GLU A 23 -15.694 4.859 5.922 1.00 0.00 N ATOM 366 CA GLU A 23 -16.955 4.298 5.351 1.00 0.00 C ATOM 367 C GLU A 23 -16.836 4.203 3.825 1.00 0.00 C ATOM 368 O GLU A 23 -17.292 3.257 3.214 1.00 0.00 O ATOM 369 CB GLU A 23 -18.127 5.220 5.708 1.00 0.00 C ATOM 370 CG GLU A 23 -19.451 4.520 5.393 1.00 0.00 C ATOM 371 CD GLU A 23 -20.615 5.482 5.638 1.00 0.00 C ATOM 372 OE1 GLU A 23 -20.384 6.526 6.227 1.00 0.00 O ATOM 373 OE2 GLU A 23 -21.721 5.159 5.235 1.00 0.00 O ATOM 0 H GLU A 23 -15.783 5.788 6.333 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.126 3.304 5.764 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.086 5.483 6.765 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -18.054 6.151 5.145 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.457 4.183 4.356 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.562 3.633 6.017 1.00 0.00 H new ATOM 380 N GLU A 24 -16.229 5.183 3.210 1.00 0.00 N ATOM 381 CA GLU A 24 -16.077 5.171 1.723 1.00 0.00 C ATOM 382 C GLU A 24 -15.134 4.038 1.310 1.00 0.00 C ATOM 383 O GLU A 24 -15.370 3.334 0.346 1.00 0.00 O ATOM 384 CB GLU A 24 -15.501 6.519 1.271 1.00 0.00 C ATOM 385 CG GLU A 24 -15.222 6.502 -0.245 1.00 0.00 C ATOM 386 CD GLU A 24 -13.816 5.952 -0.530 1.00 0.00 C ATOM 387 OE1 GLU A 24 -13.100 5.668 0.416 1.00 0.00 O ATOM 388 OE2 GLU A 24 -13.480 5.825 -1.696 1.00 0.00 O ATOM 0 H GLU A 24 -15.829 5.997 3.676 1.00 0.00 H new ATOM 0 HA GLU A 24 -17.048 5.011 1.254 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -16.201 7.319 1.510 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.580 6.729 1.815 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -15.968 5.889 -0.751 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.312 7.511 -0.648 1.00 0.00 H new ATOM 395 N MET A 25 -14.070 3.862 2.044 1.00 0.00 N ATOM 396 CA MET A 25 -13.090 2.781 1.729 1.00 0.00 C ATOM 397 C MET A 25 -13.748 1.419 1.936 1.00 0.00 C ATOM 398 O MET A 25 -13.503 0.483 1.202 1.00 0.00 O ATOM 399 CB MET A 25 -11.879 2.908 2.654 1.00 0.00 C ATOM 400 CG MET A 25 -11.004 4.074 2.189 1.00 0.00 C ATOM 401 SD MET A 25 -9.585 4.237 3.300 1.00 0.00 S ATOM 402 CE MET A 25 -8.803 2.650 2.908 1.00 0.00 C ATOM 0 H MET A 25 -13.834 4.428 2.859 1.00 0.00 H new ATOM 0 HA MET A 25 -12.768 2.874 0.692 1.00 0.00 H new ATOM 0 HB2 MET A 25 -12.207 3.072 3.680 1.00 0.00 H new ATOM 0 HB3 MET A 25 -11.304 1.982 2.647 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.663 3.903 1.168 1.00 0.00 H new ATOM 0 HG3 MET A 25 -11.583 4.998 2.182 1.00 0.00 H new ATOM 0 HE1 MET A 25 -7.732 2.716 3.097 1.00 0.00 H new ATOM 0 HE2 MET A 25 -9.234 1.868 3.533 1.00 0.00 H new ATOM 0 HE3 MET A 25 -8.972 2.410 1.858 1.00 0.00 H new ATOM 412 N GLY A 26 -14.568 1.302 2.946 1.00 0.00 N ATOM 413 CA GLY A 26 -15.251 0.000 3.235 1.00 0.00 C ATOM 414 C GLY A 26 -14.693 -0.585 4.532 1.00 0.00 C ATOM 415 O GLY A 26 -14.920 -1.732 4.851 1.00 0.00 O ATOM 0 H GLY A 26 -14.798 2.058 3.591 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -16.327 0.152 3.324 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.095 -0.697 2.411 1.00 0.00 H new ATOM 419 N ILE A 27 -13.959 0.204 5.278 1.00 0.00 N ATOM 420 CA ILE A 27 -13.367 -0.284 6.566 1.00 0.00 C ATOM 421 C ILE A 27 -13.755 0.650 7.706 1.00 0.00 C ATOM 422 O ILE A 27 -14.219 1.751 7.496 1.00 0.00 O ATOM 423 CB ILE A 27 -11.841 -0.327 6.443 1.00 0.00 C ATOM 424 CG1 ILE A 27 -11.306 1.059 6.054 1.00 0.00 C ATOM 425 CG2 ILE A 27 -11.449 -1.350 5.376 1.00 0.00 C ATOM 426 CD1 ILE A 27 -9.776 1.054 6.105 1.00 0.00 C ATOM 0 H ILE A 27 -13.742 1.174 5.049 1.00 0.00 H new ATOM 0 HA ILE A 27 -13.748 -1.283 6.776 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.410 -0.615 7.402 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -11.645 1.322 5.052 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -11.700 1.815 6.733 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -10.363 -1.383 5.285 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -11.820 -2.334 5.662 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.884 -1.062 4.419 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -9.400 2.039 5.828 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -9.446 0.810 7.115 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -9.391 0.310 5.408 1.00 0.00 H new ATOM 438 N SER A 28 -13.565 0.201 8.913 1.00 0.00 N ATOM 439 CA SER A 28 -13.907 1.031 10.101 1.00 0.00 C ATOM 440 C SER A 28 -12.722 1.919 10.476 1.00 0.00 C ATOM 441 O SER A 28 -11.631 1.784 9.958 1.00 0.00 O ATOM 442 CB SER A 28 -14.252 0.111 11.277 1.00 0.00 C ATOM 443 OG SER A 28 -15.567 -0.396 11.100 1.00 0.00 O ATOM 0 H SER A 28 -13.182 -0.719 9.131 1.00 0.00 H new ATOM 0 HA SER A 28 -14.763 1.663 9.865 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.537 -0.710 11.335 1.00 0.00 H new ATOM 0 HB3 SER A 28 -14.184 0.660 12.216 1.00 0.00 H new ATOM 0 HG SER A 28 -15.793 -0.987 11.848 1.00 0.00 H new ATOM 449 N ARG A 29 -12.946 2.822 11.383 1.00 0.00 N ATOM 450 CA ARG A 29 -11.866 3.739 11.834 1.00 0.00 C ATOM 451 C ARG A 29 -10.739 2.932 12.472 1.00 0.00 C ATOM 452 O ARG A 29 -9.575 3.261 12.343 1.00 0.00 O ATOM 453 CB ARG A 29 -12.425 4.726 12.865 1.00 0.00 C ATOM 454 CG ARG A 29 -13.264 5.795 12.163 1.00 0.00 C ATOM 455 CD ARG A 29 -13.715 6.838 13.187 1.00 0.00 C ATOM 456 NE ARG A 29 -14.337 7.997 12.474 1.00 0.00 N ATOM 457 CZ ARG A 29 -14.211 9.218 12.940 1.00 0.00 C ATOM 458 NH1 ARG A 29 -13.535 9.452 14.033 1.00 0.00 N ATOM 459 NH2 ARG A 29 -14.755 10.215 12.293 1.00 0.00 N ATOM 0 H ARG A 29 -13.847 2.967 11.839 1.00 0.00 H new ATOM 0 HA ARG A 29 -11.481 4.287 10.974 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -13.035 4.195 13.596 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -11.607 5.195 13.413 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -12.681 6.271 11.375 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -14.131 5.338 11.686 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -14.431 6.397 13.881 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -12.864 7.175 13.779 1.00 0.00 H new ATOM 0 HE ARG A 29 -14.865 7.837 11.616 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -13.096 8.681 14.536 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -13.446 10.406 14.383 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -15.273 10.042 11.432 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -14.661 11.166 12.649 1.00 0.00 H new ATOM 473 N GLN A 30 -11.078 1.885 13.167 1.00 0.00 N ATOM 474 CA GLN A 30 -10.037 1.049 13.835 1.00 0.00 C ATOM 475 C GLN A 30 -8.898 0.772 12.852 1.00 0.00 C ATOM 476 O GLN A 30 -7.737 0.986 13.150 1.00 0.00 O ATOM 477 CB GLN A 30 -10.664 -0.284 14.260 1.00 0.00 C ATOM 478 CG GLN A 30 -9.654 -1.107 15.066 1.00 0.00 C ATOM 479 CD GLN A 30 -9.344 -0.394 16.383 1.00 0.00 C ATOM 480 OE1 GLN A 30 -10.220 0.174 17.003 1.00 0.00 O ATOM 481 NE2 GLN A 30 -8.120 -0.397 16.836 1.00 0.00 N ATOM 0 H GLN A 30 -12.038 1.568 13.304 1.00 0.00 H new ATOM 0 HA GLN A 30 -9.649 1.575 14.707 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -11.556 -0.101 14.859 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -10.981 -0.843 13.380 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -10.056 -2.101 15.265 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -8.738 -1.243 14.490 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -7.384 -0.874 16.315 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -7.899 0.078 17.711 1.00 0.00 H new ATOM 490 N GLN A 31 -9.232 0.304 11.684 1.00 0.00 N ATOM 491 CA GLN A 31 -8.195 0.008 10.654 1.00 0.00 C ATOM 492 C GLN A 31 -7.616 1.313 10.112 1.00 0.00 C ATOM 493 O GLN A 31 -6.443 1.410 9.807 1.00 0.00 O ATOM 494 CB GLN A 31 -8.833 -0.773 9.501 1.00 0.00 C ATOM 495 CG GLN A 31 -9.177 -2.189 9.970 1.00 0.00 C ATOM 496 CD GLN A 31 -9.826 -2.975 8.828 1.00 0.00 C ATOM 497 OE1 GLN A 31 -9.991 -2.466 7.736 1.00 0.00 O ATOM 498 NE2 GLN A 31 -10.196 -4.209 9.036 1.00 0.00 N ATOM 0 H GLN A 31 -10.191 0.111 11.394 1.00 0.00 H new ATOM 0 HA GLN A 31 -7.399 -0.582 11.107 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -9.733 -0.264 9.158 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.148 -0.816 8.654 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -8.274 -2.699 10.307 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -9.854 -2.144 10.823 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.057 -4.635 9.952 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.624 -4.747 8.282 1.00 0.00 H new ATOM 507 N LEU A 32 -8.443 2.307 9.968 1.00 0.00 N ATOM 508 CA LEU A 32 -7.970 3.607 9.421 1.00 0.00 C ATOM 509 C LEU A 32 -6.914 4.206 10.349 1.00 0.00 C ATOM 510 O LEU A 32 -5.902 4.721 9.914 1.00 0.00 O ATOM 511 CB LEU A 32 -9.161 4.572 9.321 1.00 0.00 C ATOM 512 CG LEU A 32 -8.860 5.672 8.286 1.00 0.00 C ATOM 513 CD1 LEU A 32 -9.170 5.161 6.872 1.00 0.00 C ATOM 514 CD2 LEU A 32 -9.714 6.908 8.578 1.00 0.00 C ATOM 0 H LEU A 32 -9.434 2.275 10.207 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.534 3.448 8.435 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.059 4.026 9.033 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.359 5.021 10.294 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.805 5.937 8.350 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.954 5.945 6.146 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.553 4.288 6.657 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.223 4.886 6.807 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.497 7.683 7.843 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.770 6.642 8.524 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.485 7.281 9.576 1.00 0.00 H new ATOM 526 N CYS A 33 -7.161 4.146 11.624 1.00 0.00 N ATOM 527 CA CYS A 33 -6.198 4.706 12.612 1.00 0.00 C ATOM 528 C CYS A 33 -4.928 3.853 12.637 1.00 0.00 C ATOM 529 O CYS A 33 -3.830 4.351 12.815 1.00 0.00 O ATOM 530 CB CYS A 33 -6.842 4.690 14.003 1.00 0.00 C ATOM 531 SG CYS A 33 -5.987 5.873 15.066 1.00 0.00 S ATOM 0 H CYS A 33 -7.998 3.728 12.030 1.00 0.00 H new ATOM 0 HA CYS A 33 -5.942 5.727 12.330 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -7.899 4.946 13.931 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -6.785 3.690 14.432 1.00 0.00 H new ATOM 0 HG CYS A 33 -6.530 5.866 16.247 1.00 0.00 H new ATOM 537 N ASN A 34 -5.081 2.569 12.478 1.00 0.00 N ATOM 538 CA ASN A 34 -3.904 1.651 12.507 1.00 0.00 C ATOM 539 C ASN A 34 -2.974 1.965 11.333 1.00 0.00 C ATOM 540 O ASN A 34 -1.765 1.918 11.454 1.00 0.00 O ATOM 541 CB ASN A 34 -4.380 0.200 12.388 1.00 0.00 C ATOM 542 CG ASN A 34 -5.195 -0.194 13.627 1.00 0.00 C ATOM 543 OD1 ASN A 34 -5.283 0.635 14.632 1.00 0.00 O flip ATOM 544 ND2 ASN A 34 -5.765 -1.265 13.676 1.00 0.00 N flip ATOM 0 H ASN A 34 -5.979 2.110 12.328 1.00 0.00 H new ATOM 0 HA ASN A 34 -3.370 1.789 13.447 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -4.988 0.082 11.491 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -3.522 -0.464 12.282 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -5.698 -1.915 12.892 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -6.311 -1.515 14.501 1.00 0.00 H new ATOM 551 N ILE A 35 -3.536 2.272 10.195 1.00 0.00 N ATOM 552 CA ILE A 35 -2.700 2.581 8.994 1.00 0.00 C ATOM 553 C ILE A 35 -1.847 3.822 9.263 1.00 0.00 C ATOM 554 O ILE A 35 -0.678 3.868 8.931 1.00 0.00 O ATOM 555 CB ILE A 35 -3.615 2.840 7.790 1.00 0.00 C ATOM 556 CG1 ILE A 35 -4.298 1.532 7.382 1.00 0.00 C ATOM 557 CG2 ILE A 35 -2.787 3.374 6.616 1.00 0.00 C ATOM 558 CD1 ILE A 35 -5.416 1.821 6.377 1.00 0.00 C ATOM 0 H ILE A 35 -4.543 2.323 10.043 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.046 1.735 8.782 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.370 3.578 8.061 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.568 0.852 6.942 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.707 1.035 8.262 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.441 3.557 5.763 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.302 4.305 6.907 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.029 2.640 6.342 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.898 0.886 6.090 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.152 2.484 6.832 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.995 2.298 5.492 1.00 0.00 H new ATOM 570 N GLU A 36 -2.428 4.825 9.857 1.00 0.00 N ATOM 571 CA GLU A 36 -1.664 6.070 10.149 1.00 0.00 C ATOM 572 C GLU A 36 -0.504 5.731 11.089 1.00 0.00 C ATOM 573 O GLU A 36 0.568 6.299 11.003 1.00 0.00 O ATOM 574 CB GLU A 36 -2.584 7.079 10.845 1.00 0.00 C ATOM 575 CG GLU A 36 -1.905 8.453 10.901 1.00 0.00 C ATOM 576 CD GLU A 36 -2.535 9.306 12.006 1.00 0.00 C ATOM 577 OE1 GLU A 36 -3.746 9.452 12.001 1.00 0.00 O ATOM 578 OE2 GLU A 36 -1.792 9.799 12.839 1.00 0.00 O ATOM 0 H GLU A 36 -3.404 4.837 10.154 1.00 0.00 H new ATOM 0 HA GLU A 36 -1.285 6.495 9.220 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.530 7.153 10.308 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.816 6.737 11.854 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -0.838 8.333 11.087 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.006 8.957 9.940 1.00 0.00 H new ATOM 585 N GLN A 37 -0.719 4.806 11.988 1.00 0.00 N ATOM 586 CA GLN A 37 0.359 4.415 12.949 1.00 0.00 C ATOM 587 C GLN A 37 1.312 3.430 12.265 1.00 0.00 C ATOM 588 O GLN A 37 2.052 2.713 12.908 1.00 0.00 O ATOM 589 CB GLN A 37 -0.272 3.762 14.187 1.00 0.00 C ATOM 590 CG GLN A 37 -1.058 4.819 14.972 1.00 0.00 C ATOM 591 CD GLN A 37 -1.738 4.169 16.180 1.00 0.00 C ATOM 592 OE1 GLN A 37 -1.553 2.997 16.441 1.00 0.00 O ATOM 593 NE2 GLN A 37 -2.522 4.888 16.935 1.00 0.00 N ATOM 0 H GLN A 37 -1.598 4.301 12.100 1.00 0.00 H new ATOM 0 HA GLN A 37 0.917 5.299 13.258 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -0.933 2.949 13.887 1.00 0.00 H new ATOM 0 HB3 GLN A 37 0.503 3.326 14.817 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -0.388 5.612 15.304 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -1.806 5.282 14.328 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -2.678 5.872 16.717 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -2.979 4.466 17.743 1.00 0.00 H new ATOM 602 N SER A 38 1.298 3.404 10.962 1.00 0.00 N ATOM 603 CA SER A 38 2.196 2.483 10.207 1.00 0.00 C ATOM 604 C SER A 38 3.602 3.098 10.139 1.00 0.00 C ATOM 605 O SER A 38 4.539 2.486 9.666 1.00 0.00 O ATOM 606 CB SER A 38 1.635 2.291 8.794 1.00 0.00 C ATOM 607 OG SER A 38 0.354 1.670 8.881 1.00 0.00 O ATOM 0 H SER A 38 0.697 3.988 10.381 1.00 0.00 H new ATOM 0 HA SER A 38 2.253 1.516 10.706 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.553 3.253 8.288 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.312 1.676 8.201 1.00 0.00 H new ATOM 0 HG SER A 38 -0.300 2.197 8.376 1.00 0.00 H new ATOM 613 N GLU A 39 3.738 4.309 10.622 1.00 0.00 N ATOM 614 CA GLU A 39 5.063 5.014 10.619 1.00 0.00 C ATOM 615 C GLU A 39 5.658 5.026 9.209 1.00 0.00 C ATOM 616 O GLU A 39 5.617 6.024 8.516 1.00 0.00 O ATOM 617 CB GLU A 39 6.045 4.314 11.572 1.00 0.00 C ATOM 618 CG GLU A 39 5.351 3.965 12.891 1.00 0.00 C ATOM 619 CD GLU A 39 4.924 5.239 13.621 1.00 0.00 C ATOM 620 OE1 GLU A 39 5.520 6.274 13.372 1.00 0.00 O ATOM 621 OE2 GLU A 39 4.016 5.154 14.432 1.00 0.00 O ATOM 0 H GLU A 39 2.974 4.850 11.026 1.00 0.00 H new ATOM 0 HA GLU A 39 4.901 6.039 10.953 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.431 3.407 11.106 1.00 0.00 H new ATOM 0 HB3 GLU A 39 6.900 4.962 11.764 1.00 0.00 H new ATOM 0 HG2 GLU A 39 4.479 3.340 12.697 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.025 3.385 13.522 1.00 0.00 H new ATOM 628 N THR A 40 6.226 3.926 8.790 1.00 0.00 N ATOM 629 CA THR A 40 6.852 3.850 7.434 1.00 0.00 C ATOM 630 C THR A 40 5.868 3.247 6.440 1.00 0.00 C ATOM 631 O THR A 40 4.856 2.678 6.806 1.00 0.00 O ATOM 632 CB THR A 40 8.109 2.974 7.499 1.00 0.00 C ATOM 633 OG1 THR A 40 7.746 1.638 7.824 1.00 0.00 O ATOM 634 CG2 THR A 40 9.062 3.516 8.563 1.00 0.00 C ATOM 0 H THR A 40 6.284 3.066 9.335 1.00 0.00 H new ATOM 0 HA THR A 40 7.121 4.855 7.109 1.00 0.00 H new ATOM 0 HB THR A 40 8.605 2.989 6.529 1.00 0.00 H new ATOM 0 HG1 THR A 40 8.551 1.081 7.863 1.00 0.00 H new ATOM 0 HG21 THR A 40 9.954 2.890 8.606 1.00 0.00 H new ATOM 0 HG22 THR A 40 9.347 4.537 8.310 1.00 0.00 H new ATOM 0 HG23 THR A 40 8.566 3.508 9.534 1.00 0.00 H new ATOM 642 N ALA A 41 6.161 3.382 5.175 1.00 0.00 N ATOM 643 CA ALA A 41 5.250 2.841 4.128 1.00 0.00 C ATOM 644 C ALA A 41 5.667 1.410 3.770 1.00 0.00 C ATOM 645 O ALA A 41 6.778 0.996 4.046 1.00 0.00 O ATOM 646 CB ALA A 41 5.329 3.722 2.875 1.00 0.00 C ATOM 0 H ALA A 41 6.997 3.847 4.821 1.00 0.00 H new ATOM 0 HA ALA A 41 4.228 2.837 4.508 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.662 3.326 2.109 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.029 4.739 3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.352 3.728 2.498 1.00 0.00 H new ATOM 652 N PRO A 42 4.784 0.651 3.161 1.00 0.00 N ATOM 653 CA PRO A 42 5.075 -0.758 2.770 1.00 0.00 C ATOM 654 C PRO A 42 6.032 -0.857 1.572 1.00 0.00 C ATOM 655 O PRO A 42 6.054 -0.006 0.703 1.00 0.00 O ATOM 656 CB PRO A 42 3.687 -1.347 2.415 1.00 0.00 C ATOM 657 CG PRO A 42 2.679 -0.296 2.784 1.00 0.00 C ATOM 658 CD PRO A 42 3.417 1.032 2.770 1.00 0.00 C ATOM 0 HA PRO A 42 5.579 -1.296 3.573 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.627 -1.589 1.354 1.00 0.00 H new ATOM 0 HB3 PRO A 42 3.504 -2.271 2.963 1.00 0.00 H new ATOM 0 HG2 PRO A 42 1.851 -0.287 2.076 1.00 0.00 H new ATOM 0 HG3 PRO A 42 2.255 -0.494 3.768 1.00 0.00 H new ATOM 0 HD2 PRO A 42 3.393 1.497 1.785 1.00 0.00 H new ATOM 0 HD3 PRO A 42 2.980 1.745 3.470 1.00 0.00 H new ATOM 666 N VAL A 43 6.802 -1.911 1.517 1.00 0.00 N ATOM 667 CA VAL A 43 7.749 -2.106 0.380 1.00 0.00 C ATOM 668 C VAL A 43 6.954 -2.342 -0.909 1.00 0.00 C ATOM 669 O VAL A 43 7.459 -2.165 -2.001 1.00 0.00 O ATOM 670 CB VAL A 43 8.658 -3.316 0.649 1.00 0.00 C ATOM 671 CG1 VAL A 43 9.593 -3.006 1.818 1.00 0.00 C ATOM 672 CG2 VAL A 43 7.817 -4.552 0.990 1.00 0.00 C ATOM 0 H VAL A 43 6.816 -2.652 2.218 1.00 0.00 H new ATOM 0 HA VAL A 43 8.367 -1.214 0.275 1.00 0.00 H new ATOM 0 HB VAL A 43 9.242 -3.519 -0.249 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.237 -3.865 2.007 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.207 -2.140 1.573 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.003 -2.792 2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.476 -5.400 1.178 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.221 -4.352 1.880 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.156 -4.784 0.155 1.00 0.00 H new ATOM 682 N VAL A 44 5.719 -2.745 -0.786 1.00 0.00 N ATOM 683 CA VAL A 44 4.880 -2.998 -1.994 1.00 0.00 C ATOM 684 C VAL A 44 4.671 -1.681 -2.741 1.00 0.00 C ATOM 685 O VAL A 44 4.732 -1.627 -3.951 1.00 0.00 O ATOM 686 CB VAL A 44 3.518 -3.558 -1.573 1.00 0.00 C ATOM 687 CG1 VAL A 44 2.814 -4.158 -2.793 1.00 0.00 C ATOM 688 CG2 VAL A 44 3.711 -4.642 -0.508 1.00 0.00 C ATOM 0 H VAL A 44 5.251 -2.911 0.105 1.00 0.00 H new ATOM 0 HA VAL A 44 5.382 -3.719 -2.639 1.00 0.00 H new ATOM 0 HB VAL A 44 2.909 -2.754 -1.160 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.845 -4.557 -2.494 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.671 -3.385 -3.548 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.424 -4.961 -3.207 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.740 -5.038 -0.211 1.00 0.00 H new ATOM 0 HG22 VAL A 44 4.322 -5.448 -0.915 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.209 -4.213 0.362 1.00 0.00 H new ATOM 698 N VAL A 45 4.415 -0.624 -2.015 1.00 0.00 N ATOM 699 CA VAL A 45 4.188 0.704 -2.654 1.00 0.00 C ATOM 700 C VAL A 45 5.437 1.100 -3.443 1.00 0.00 C ATOM 701 O VAL A 45 5.362 1.544 -4.573 1.00 0.00 O ATOM 702 CB VAL A 45 3.918 1.749 -1.565 1.00 0.00 C ATOM 703 CG1 VAL A 45 3.871 3.151 -2.184 1.00 0.00 C ATOM 704 CG2 VAL A 45 2.575 1.444 -0.896 1.00 0.00 C ATOM 0 H VAL A 45 4.353 -0.625 -0.997 1.00 0.00 H new ATOM 0 HA VAL A 45 3.332 0.650 -3.327 1.00 0.00 H new ATOM 0 HB VAL A 45 4.718 1.712 -0.825 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.679 3.887 -1.403 1.00 0.00 H new ATOM 0 HG12 VAL A 45 4.826 3.370 -2.662 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.075 3.194 -2.927 1.00 0.00 H new ATOM 0 HG21 VAL A 45 2.378 2.184 -0.121 1.00 0.00 H new ATOM 0 HG22 VAL A 45 1.781 1.480 -1.642 1.00 0.00 H new ATOM 0 HG23 VAL A 45 2.609 0.451 -0.449 1.00 0.00 H new ATOM 714 N LYS A 46 6.586 0.926 -2.853 1.00 0.00 N ATOM 715 CA LYS A 46 7.858 1.267 -3.551 1.00 0.00 C ATOM 716 C LYS A 46 8.051 0.320 -4.737 1.00 0.00 C ATOM 717 O LYS A 46 8.551 0.702 -5.776 1.00 0.00 O ATOM 718 CB LYS A 46 9.035 1.115 -2.584 1.00 0.00 C ATOM 719 CG LYS A 46 8.971 2.220 -1.526 1.00 0.00 C ATOM 720 CD LYS A 46 10.211 2.149 -0.624 1.00 0.00 C ATOM 721 CE LYS A 46 10.094 0.969 0.347 1.00 0.00 C ATOM 722 NZ LYS A 46 11.107 1.110 1.428 1.00 0.00 N ATOM 0 H LYS A 46 6.700 0.559 -1.908 1.00 0.00 H new ATOM 0 HA LYS A 46 7.813 2.297 -3.904 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.003 0.136 -2.106 1.00 0.00 H new ATOM 0 HB3 LYS A 46 9.977 1.172 -3.129 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.917 3.196 -2.009 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.067 2.110 -0.927 1.00 0.00 H new ATOM 0 HD2 LYS A 46 11.107 2.039 -1.234 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.317 3.079 -0.066 1.00 0.00 H new ATOM 0 HE2 LYS A 46 9.092 0.936 0.776 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.244 0.030 -0.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.026 0.309 2.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 12.060 1.121 1.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 10.944 1.999 1.943 1.00 0.00 H new ATOM 736 N TYR A 47 7.669 -0.920 -4.575 1.00 0.00 N ATOM 737 CA TYR A 47 7.840 -1.906 -5.683 1.00 0.00 C ATOM 738 C TYR A 47 7.049 -1.444 -6.912 1.00 0.00 C ATOM 739 O TYR A 47 7.583 -1.316 -8.001 1.00 0.00 O ATOM 740 CB TYR A 47 7.308 -3.276 -5.239 1.00 0.00 C ATOM 741 CG TYR A 47 7.519 -4.265 -6.357 1.00 0.00 C ATOM 742 CD1 TYR A 47 8.737 -4.947 -6.461 1.00 0.00 C ATOM 743 CD2 TYR A 47 6.510 -4.489 -7.301 1.00 0.00 C ATOM 744 CE1 TYR A 47 8.945 -5.854 -7.507 1.00 0.00 C ATOM 745 CE2 TYR A 47 6.719 -5.395 -8.348 1.00 0.00 C ATOM 746 CZ TYR A 47 7.938 -6.077 -8.451 1.00 0.00 C ATOM 747 OH TYR A 47 8.145 -6.966 -9.485 1.00 0.00 O ATOM 0 H TYR A 47 7.247 -1.292 -3.724 1.00 0.00 H new ATOM 0 HA TYR A 47 8.899 -1.981 -5.932 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.825 -3.608 -4.339 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.249 -3.207 -4.991 1.00 0.00 H new ATOM 0 HD1 TYR A 47 9.517 -4.773 -5.734 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.570 -3.963 -7.222 1.00 0.00 H new ATOM 0 HE1 TYR A 47 9.884 -6.382 -7.585 1.00 0.00 H new ATOM 0 HE2 TYR A 47 5.940 -5.568 -9.076 1.00 0.00 H new ATOM 0 HH TYR A 47 7.390 -7.589 -9.537 1.00 0.00 H new ATOM 757 N ILE A 48 5.778 -1.176 -6.740 1.00 0.00 N ATOM 758 CA ILE A 48 4.946 -0.714 -7.891 1.00 0.00 C ATOM 759 C ILE A 48 5.421 0.673 -8.328 1.00 0.00 C ATOM 760 O ILE A 48 5.312 1.042 -9.480 1.00 0.00 O ATOM 761 CB ILE A 48 3.469 -0.653 -7.478 1.00 0.00 C ATOM 762 CG1 ILE A 48 3.300 0.276 -6.269 1.00 0.00 C ATOM 763 CG2 ILE A 48 2.975 -2.057 -7.118 1.00 0.00 C ATOM 764 CD1 ILE A 48 1.825 0.318 -5.847 1.00 0.00 C ATOM 0 H ILE A 48 5.282 -1.258 -5.852 1.00 0.00 H new ATOM 0 HA ILE A 48 5.050 -1.414 -8.720 1.00 0.00 H new ATOM 0 HB ILE A 48 2.884 -0.265 -8.312 1.00 0.00 H new ATOM 0 HG12 ILE A 48 3.915 -0.075 -5.440 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.645 1.279 -6.519 1.00 0.00 H new ATOM 0 HG21 ILE A 48 1.926 -2.010 -6.825 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.081 -2.713 -7.982 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.565 -2.449 -6.290 1.00 0.00 H new ATOM 0 HD11 ILE A 48 1.711 0.979 -4.988 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.220 0.690 -6.674 1.00 0.00 H new ATOM 0 HD13 ILE A 48 1.495 -0.685 -5.579 1.00 0.00 H new ATOM 776 N ALA A 49 5.960 1.436 -7.414 1.00 0.00 N ATOM 777 CA ALA A 49 6.463 2.796 -7.767 1.00 0.00 C ATOM 778 C ALA A 49 7.660 2.649 -8.707 1.00 0.00 C ATOM 779 O ALA A 49 7.844 3.422 -9.628 1.00 0.00 O ATOM 780 CB ALA A 49 6.900 3.532 -6.498 1.00 0.00 C ATOM 0 H ALA A 49 6.074 1.175 -6.435 1.00 0.00 H new ATOM 0 HA ALA A 49 5.672 3.366 -8.255 1.00 0.00 H new ATOM 0 HB1 ALA A 49 7.266 4.524 -6.761 1.00 0.00 H new ATOM 0 HB2 ALA A 49 6.051 3.626 -5.821 1.00 0.00 H new ATOM 0 HB3 ALA A 49 7.695 2.970 -6.007 1.00 0.00 H new ATOM 786 N PHE A 50 8.472 1.650 -8.476 1.00 0.00 N ATOM 787 CA PHE A 50 9.658 1.419 -9.349 1.00 0.00 C ATOM 788 C PHE A 50 9.171 1.144 -10.768 1.00 0.00 C ATOM 789 O PHE A 50 9.678 1.684 -11.733 1.00 0.00 O ATOM 790 CB PHE A 50 10.446 0.212 -8.838 1.00 0.00 C ATOM 791 CG PHE A 50 11.644 -0.023 -9.728 1.00 0.00 C ATOM 792 CD1 PHE A 50 12.696 0.899 -9.737 1.00 0.00 C ATOM 793 CD2 PHE A 50 11.704 -1.162 -10.546 1.00 0.00 C ATOM 794 CE1 PHE A 50 13.809 0.685 -10.561 1.00 0.00 C ATOM 795 CE2 PHE A 50 12.816 -1.374 -11.368 1.00 0.00 C ATOM 796 CZ PHE A 50 13.869 -0.453 -11.376 1.00 0.00 C ATOM 0 H PHE A 50 8.362 0.981 -7.714 1.00 0.00 H new ATOM 0 HA PHE A 50 10.304 2.297 -9.338 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.771 0.384 -7.812 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.809 -0.673 -8.827 1.00 0.00 H new ATOM 0 HD1 PHE A 50 12.650 1.776 -9.109 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.892 -1.874 -10.541 1.00 0.00 H new ATOM 0 HE1 PHE A 50 14.621 1.397 -10.568 1.00 0.00 H new ATOM 0 HE2 PHE A 50 12.862 -2.250 -11.998 1.00 0.00 H new ATOM 0 HZ PHE A 50 14.727 -0.619 -12.010 1.00 0.00 H new ATOM 806 N LEU A 51 8.174 0.310 -10.890 1.00 0.00 N ATOM 807 CA LEU A 51 7.616 -0.007 -12.237 1.00 0.00 C ATOM 808 C LEU A 51 7.023 1.276 -12.825 1.00 0.00 C ATOM 809 O LEU A 51 7.133 1.547 -14.007 1.00 0.00 O ATOM 810 CB LEU A 51 6.523 -1.075 -12.105 1.00 0.00 C ATOM 811 CG LEU A 51 7.143 -2.415 -11.671 1.00 0.00 C ATOM 812 CD1 LEU A 51 6.026 -3.412 -11.340 1.00 0.00 C ATOM 813 CD2 LEU A 51 8.022 -2.990 -12.802 1.00 0.00 C ATOM 0 H LEU A 51 7.720 -0.168 -10.112 1.00 0.00 H new ATOM 0 HA LEU A 51 8.400 -0.390 -12.890 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.779 -0.756 -11.375 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.005 -1.196 -13.056 1.00 0.00 H new ATOM 0 HG LEU A 51 7.763 -2.247 -10.790 1.00 0.00 H new ATOM 0 HD11 LEU A 51 6.465 -4.361 -11.033 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.413 -3.016 -10.530 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.405 -3.568 -12.222 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.454 -3.938 -12.481 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.412 -3.152 -13.691 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.822 -2.287 -13.034 1.00 0.00 H new ATOM 825 N ARG A 52 6.400 2.066 -11.997 1.00 0.00 N ATOM 826 CA ARG A 52 5.798 3.346 -12.473 1.00 0.00 C ATOM 827 C ARG A 52 6.903 4.254 -13.021 1.00 0.00 C ATOM 828 O ARG A 52 6.733 4.919 -14.025 1.00 0.00 O ATOM 829 CB ARG A 52 5.102 4.051 -11.305 1.00 0.00 C ATOM 830 CG ARG A 52 4.419 5.326 -11.802 1.00 0.00 C ATOM 831 CD ARG A 52 3.699 6.020 -10.639 1.00 0.00 C ATOM 832 NE ARG A 52 3.079 7.289 -11.128 1.00 0.00 N ATOM 833 CZ ARG A 52 2.325 8.007 -10.336 1.00 0.00 C ATOM 834 NH1 ARG A 52 2.099 7.632 -9.107 1.00 0.00 N ATOM 835 NH2 ARG A 52 1.794 9.114 -10.784 1.00 0.00 N ATOM 0 H ARG A 52 6.280 1.880 -11.001 1.00 0.00 H new ATOM 0 HA ARG A 52 5.071 3.134 -13.257 1.00 0.00 H new ATOM 0 HB2 ARG A 52 4.366 3.386 -10.853 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.829 4.295 -10.530 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.158 5.999 -12.237 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.706 5.083 -12.590 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.933 5.363 -10.227 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.404 6.232 -9.835 1.00 0.00 H new ATOM 0 HE ARG A 52 3.245 7.597 -12.086 1.00 0.00 H new ATOM 0 HH11 ARG A 52 2.512 6.769 -8.753 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.509 8.202 -8.500 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.969 9.412 -11.744 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.205 9.680 -10.174 1.00 0.00 H new ATOM 849 N SER A 53 8.029 4.292 -12.358 1.00 0.00 N ATOM 850 CA SER A 53 9.152 5.162 -12.822 1.00 0.00 C ATOM 851 C SER A 53 9.607 4.697 -14.202 1.00 0.00 C ATOM 852 O SER A 53 10.211 5.436 -14.957 1.00 0.00 O ATOM 853 CB SER A 53 10.325 5.059 -11.841 1.00 0.00 C ATOM 854 OG SER A 53 10.870 3.745 -11.894 1.00 0.00 O ATOM 0 H SER A 53 8.221 3.756 -11.512 1.00 0.00 H new ATOM 0 HA SER A 53 8.813 6.197 -12.872 1.00 0.00 H new ATOM 0 HB2 SER A 53 11.090 5.793 -12.094 1.00 0.00 H new ATOM 0 HB3 SER A 53 9.988 5.285 -10.829 1.00 0.00 H new ATOM 0 HG SER A 53 10.169 3.110 -12.152 1.00 0.00 H new ATOM 860 N LYS A 54 9.313 3.472 -14.533 1.00 0.00 N ATOM 861 CA LYS A 54 9.715 2.928 -15.862 1.00 0.00 C ATOM 862 C LYS A 54 8.667 3.326 -16.896 1.00 0.00 C ATOM 863 O LYS A 54 8.713 2.915 -18.039 1.00 0.00 O ATOM 864 CB LYS A 54 9.813 1.399 -15.766 1.00 0.00 C ATOM 865 CG LYS A 54 10.848 1.004 -14.696 1.00 0.00 C ATOM 866 CD LYS A 54 12.266 1.128 -15.270 1.00 0.00 C ATOM 867 CE LYS A 54 13.287 0.644 -14.241 1.00 0.00 C ATOM 868 NZ LYS A 54 13.161 -0.831 -14.062 1.00 0.00 N ATOM 0 H LYS A 54 8.807 2.818 -13.936 1.00 0.00 H new ATOM 0 HA LYS A 54 10.683 3.329 -16.161 1.00 0.00 H new ATOM 0 HB2 LYS A 54 8.839 0.979 -15.514 1.00 0.00 H new ATOM 0 HB3 LYS A 54 10.100 0.983 -16.732 1.00 0.00 H new ATOM 0 HG2 LYS A 54 10.743 1.646 -13.821 1.00 0.00 H new ATOM 0 HG3 LYS A 54 10.669 -0.019 -14.364 1.00 0.00 H new ATOM 0 HD2 LYS A 54 12.351 0.540 -16.184 1.00 0.00 H new ATOM 0 HD3 LYS A 54 12.470 2.165 -15.538 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.296 0.895 -14.569 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.126 1.150 -13.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.216 -1.064 -13.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.247 -1.150 -14.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.932 -1.309 -14.570 1.00 0.00 H new ATOM 882 N GLY A 55 7.733 4.143 -16.496 1.00 0.00 N ATOM 883 CA GLY A 55 6.676 4.610 -17.436 1.00 0.00 C ATOM 884 C GLY A 55 5.558 3.572 -17.534 1.00 0.00 C ATOM 885 O GLY A 55 4.718 3.633 -18.411 1.00 0.00 O ATOM 0 H GLY A 55 7.656 4.511 -15.548 1.00 0.00 H new ATOM 0 HA2 GLY A 55 6.269 5.561 -17.093 1.00 0.00 H new ATOM 0 HA3 GLY A 55 7.107 4.784 -18.422 1.00 0.00 H new ATOM 889 N VAL A 56 5.539 2.619 -16.641 1.00 0.00 N ATOM 890 CA VAL A 56 4.473 1.571 -16.683 1.00 0.00 C ATOM 891 C VAL A 56 3.116 2.195 -16.351 1.00 0.00 C ATOM 892 O VAL A 56 2.976 2.963 -15.419 1.00 0.00 O ATOM 893 CB VAL A 56 4.804 0.458 -15.680 1.00 0.00 C ATOM 894 CG1 VAL A 56 3.630 -0.523 -15.593 1.00 0.00 C ATOM 895 CG2 VAL A 56 6.060 -0.291 -16.149 1.00 0.00 C ATOM 0 H VAL A 56 6.215 2.519 -15.883 1.00 0.00 H new ATOM 0 HA VAL A 56 4.427 1.144 -17.685 1.00 0.00 H new ATOM 0 HB VAL A 56 4.982 0.896 -14.698 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.868 -1.312 -14.880 1.00 0.00 H new ATOM 0 HG12 VAL A 56 2.737 0.007 -15.263 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.450 -0.962 -16.574 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.298 -1.083 -15.439 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.878 -0.727 -17.131 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.897 0.405 -16.211 1.00 0.00 H new ATOM 905 N ASP A 57 2.120 1.868 -17.128 1.00 0.00 N ATOM 906 CA ASP A 57 0.755 2.430 -16.907 1.00 0.00 C ATOM 907 C ASP A 57 0.156 1.841 -15.633 1.00 0.00 C ATOM 908 O ASP A 57 -0.657 0.938 -15.660 1.00 0.00 O ATOM 909 CB ASP A 57 -0.121 2.083 -18.121 1.00 0.00 C ATOM 910 CG ASP A 57 -1.421 2.886 -18.081 1.00 0.00 C ATOM 911 OD1 ASP A 57 -1.522 3.776 -17.253 1.00 0.00 O ATOM 912 OD2 ASP A 57 -2.296 2.602 -18.885 1.00 0.00 O ATOM 0 H ASP A 57 2.194 1.227 -17.918 1.00 0.00 H new ATOM 0 HA ASP A 57 0.808 3.513 -16.794 1.00 0.00 H new ATOM 0 HB2 ASP A 57 0.420 2.299 -19.042 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -0.344 1.016 -18.125 1.00 0.00 H new ATOM 917 N LEU A 58 0.562 2.370 -14.510 1.00 0.00 N ATOM 918 CA LEU A 58 0.046 1.890 -13.199 1.00 0.00 C ATOM 919 C LEU A 58 -1.168 2.733 -12.793 1.00 0.00 C ATOM 920 O LEU A 58 -2.082 2.253 -12.151 1.00 0.00 O ATOM 921 CB LEU A 58 1.148 2.051 -12.143 1.00 0.00 C ATOM 922 CG LEU A 58 0.718 1.380 -10.831 1.00 0.00 C ATOM 923 CD1 LEU A 58 0.811 -0.149 -10.962 1.00 0.00 C ATOM 924 CD2 LEU A 58 1.627 1.851 -9.691 1.00 0.00 C ATOM 0 H LEU A 58 1.242 3.128 -14.447 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.246 0.843 -13.276 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.076 1.605 -12.502 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.348 3.109 -11.972 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.314 1.656 -10.615 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.504 -0.614 -10.025 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.157 -0.486 -11.766 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.839 -0.433 -11.188 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.320 1.374 -8.760 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.659 1.582 -9.914 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.549 2.933 -9.587 1.00 0.00 H new ATOM 936 N ASN A 59 -1.168 3.991 -13.148 1.00 0.00 N ATOM 937 CA ASN A 59 -2.306 4.883 -12.775 1.00 0.00 C ATOM 938 C ASN A 59 -3.598 4.379 -13.419 1.00 0.00 C ATOM 939 O ASN A 59 -4.626 4.274 -12.777 1.00 0.00 O ATOM 940 CB ASN A 59 -2.025 6.311 -13.264 1.00 0.00 C ATOM 941 CG ASN A 59 -1.877 6.330 -14.791 1.00 0.00 C ATOM 942 OD1 ASN A 59 -0.750 5.968 -15.336 1.00 0.00 O flip ATOM 943 ND2 ASN A 59 -2.802 6.689 -15.496 1.00 0.00 N flip ATOM 0 H ASN A 59 -0.425 4.441 -13.683 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.416 4.880 -11.691 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -2.837 6.973 -12.962 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.115 6.690 -12.799 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.685 6.973 -15.073 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.694 6.706 -16.510 1.00 0.00 H new ATOM 950 N ALA A 60 -3.546 4.068 -14.682 1.00 0.00 N ATOM 951 CA ALA A 60 -4.760 3.566 -15.390 1.00 0.00 C ATOM 952 C ALA A 60 -5.111 2.172 -14.880 1.00 0.00 C ATOM 953 O ALA A 60 -6.266 1.797 -14.798 1.00 0.00 O ATOM 954 CB ALA A 60 -4.483 3.498 -16.894 1.00 0.00 C ATOM 0 H ALA A 60 -2.709 4.140 -15.261 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.593 4.244 -15.201 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.370 3.131 -17.411 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.233 4.493 -17.263 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.649 2.822 -17.080 1.00 0.00 H new ATOM 960 N LEU A 61 -4.115 1.397 -14.556 1.00 0.00 N ATOM 961 CA LEU A 61 -4.367 0.018 -14.070 1.00 0.00 C ATOM 962 C LEU A 61 -5.233 0.069 -12.819 1.00 0.00 C ATOM 963 O LEU A 61 -6.173 -0.682 -12.672 1.00 0.00 O ATOM 964 CB LEU A 61 -3.028 -0.647 -13.735 1.00 0.00 C ATOM 965 CG LEU A 61 -3.262 -2.087 -13.207 1.00 0.00 C ATOM 966 CD1 LEU A 61 -2.208 -3.033 -13.786 1.00 0.00 C ATOM 967 CD2 LEU A 61 -3.165 -2.112 -11.672 1.00 0.00 C ATOM 0 H LEU A 61 -3.132 1.664 -14.608 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.881 -0.555 -14.842 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.396 -0.676 -14.622 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.499 -0.059 -12.985 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.256 -2.410 -13.515 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.379 -4.042 -13.411 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.278 -3.034 -14.874 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.215 -2.698 -13.487 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.331 -3.128 -11.313 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -2.175 -1.776 -11.364 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.920 -1.450 -11.249 1.00 0.00 H new ATOM 979 N PHE A 62 -4.921 0.951 -11.919 1.00 0.00 N ATOM 980 CA PHE A 62 -5.726 1.067 -10.669 1.00 0.00 C ATOM 981 C PHE A 62 -7.079 1.717 -10.979 1.00 0.00 C ATOM 982 O PHE A 62 -8.124 1.229 -10.588 1.00 0.00 O ATOM 983 CB PHE A 62 -4.957 1.946 -9.666 1.00 0.00 C ATOM 984 CG PHE A 62 -4.028 1.089 -8.835 1.00 0.00 C ATOM 985 CD1 PHE A 62 -2.969 0.409 -9.448 1.00 0.00 C ATOM 986 CD2 PHE A 62 -4.232 0.968 -7.455 1.00 0.00 C ATOM 987 CE1 PHE A 62 -2.118 -0.394 -8.679 1.00 0.00 C ATOM 988 CE2 PHE A 62 -3.381 0.169 -6.689 1.00 0.00 C ATOM 989 CZ PHE A 62 -2.324 -0.514 -7.300 1.00 0.00 C ATOM 0 H PHE A 62 -4.139 1.602 -11.992 1.00 0.00 H new ATOM 0 HA PHE A 62 -5.895 0.076 -10.249 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -4.385 2.706 -10.199 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -5.658 2.471 -9.018 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -2.809 0.504 -10.512 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -5.049 1.493 -6.982 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -1.302 -0.921 -9.150 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -3.539 0.078 -5.624 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.667 -1.134 -6.708 1.00 0.00 H new ATOM 999 N ASP A 63 -7.053 2.825 -11.659 1.00 0.00 N ATOM 1000 CA ASP A 63 -8.312 3.560 -11.988 1.00 0.00 C ATOM 1001 C ASP A 63 -9.426 2.584 -12.397 1.00 0.00 C ATOM 1002 O ASP A 63 -10.581 2.778 -12.061 1.00 0.00 O ATOM 1003 CB ASP A 63 -8.022 4.546 -13.125 1.00 0.00 C ATOM 1004 CG ASP A 63 -9.147 5.578 -13.233 1.00 0.00 C ATOM 1005 OD1 ASP A 63 -10.287 5.217 -12.987 1.00 0.00 O ATOM 1006 OD2 ASP A 63 -8.850 6.714 -13.565 1.00 0.00 O ATOM 0 H ASP A 63 -6.201 3.263 -12.009 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.655 4.101 -11.106 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.073 5.050 -12.945 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -7.923 4.006 -14.067 1.00 0.00 H new ATOM 1011 N ARG A 64 -9.105 1.537 -13.108 1.00 0.00 N ATOM 1012 CA ARG A 64 -10.167 0.564 -13.513 1.00 0.00 C ATOM 1013 C ARG A 64 -10.446 -0.415 -12.369 1.00 0.00 C ATOM 1014 O ARG A 64 -11.514 -0.989 -12.268 1.00 0.00 O ATOM 1015 CB ARG A 64 -9.707 -0.211 -14.741 1.00 0.00 C ATOM 1016 CG ARG A 64 -8.335 -0.866 -14.481 1.00 0.00 C ATOM 1017 CD ARG A 64 -8.070 -2.010 -15.489 1.00 0.00 C ATOM 1018 NE ARG A 64 -6.977 -1.607 -16.416 1.00 0.00 N ATOM 1019 CZ ARG A 64 -7.202 -0.746 -17.375 1.00 0.00 C ATOM 1020 NH1 ARG A 64 -8.382 -0.209 -17.533 1.00 0.00 N ATOM 1021 NH2 ARG A 64 -6.235 -0.431 -18.190 1.00 0.00 N ATOM 0 H ARG A 64 -8.162 1.312 -13.425 1.00 0.00 H new ATOM 0 HA ARG A 64 -11.080 1.112 -13.746 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -10.441 -0.977 -14.991 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -9.641 0.459 -15.598 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.548 -0.116 -14.561 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.301 -1.257 -13.464 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.794 -2.921 -14.958 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.977 -2.231 -16.052 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.045 -2.005 -16.302 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -9.145 -0.459 -16.904 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -8.541 0.461 -18.286 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.314 -0.855 -18.077 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -6.399 0.239 -18.941 1.00 0.00 H new ATOM 1035 N ILE A 65 -9.481 -0.611 -11.515 1.00 0.00 N ATOM 1036 CA ILE A 65 -9.660 -1.548 -10.369 1.00 0.00 C ATOM 1037 C ILE A 65 -10.682 -0.973 -9.393 1.00 0.00 C ATOM 1038 O ILE A 65 -11.527 -1.678 -8.874 1.00 0.00 O ATOM 1039 CB ILE A 65 -8.316 -1.753 -9.649 1.00 0.00 C ATOM 1040 CG1 ILE A 65 -7.349 -2.547 -10.557 1.00 0.00 C ATOM 1041 CG2 ILE A 65 -8.540 -2.518 -8.335 1.00 0.00 C ATOM 1042 CD1 ILE A 65 -7.600 -4.054 -10.415 1.00 0.00 C ATOM 0 H ILE A 65 -8.568 -0.159 -11.562 1.00 0.00 H new ATOM 0 HA ILE A 65 -10.016 -2.508 -10.742 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.879 -0.779 -9.427 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -7.485 -2.245 -11.596 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.318 -2.317 -10.290 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.585 -2.660 -7.829 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -9.210 -1.948 -7.691 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -8.985 -3.490 -8.551 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.912 -4.600 -11.060 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.441 -4.353 -9.379 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -8.626 -4.281 -10.705 1.00 0.00 H new ATOM 1282 N GLU B 2 -6.666 -10.160 -12.213 1.00 0.00 N ATOM 1283 CA GLU B 2 -6.295 -9.838 -10.802 1.00 0.00 C ATOM 1284 C GLU B 2 -5.081 -8.909 -10.776 1.00 0.00 C ATOM 1285 O GLU B 2 -4.344 -8.796 -11.737 1.00 0.00 O ATOM 1286 CB GLU B 2 -5.964 -11.131 -10.047 1.00 0.00 C ATOM 1287 CG GLU B 2 -7.168 -12.075 -10.103 1.00 0.00 C ATOM 1288 CD GLU B 2 -6.990 -13.201 -9.081 1.00 0.00 C ATOM 1289 OE1 GLU B 2 -5.899 -13.743 -9.006 1.00 0.00 O ATOM 1290 OE2 GLU B 2 -7.949 -13.500 -8.388 1.00 0.00 O ATOM 0 HA GLU B 2 -7.137 -9.339 -10.321 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -5.091 -11.610 -10.490 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -5.712 -10.906 -9.011 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -8.085 -11.523 -9.894 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -7.268 -12.493 -11.105 1.00 0.00 H new ATOM 1297 N LEU B 3 -4.880 -8.237 -9.677 1.00 0.00 N ATOM 1298 CA LEU B 3 -3.723 -7.299 -9.558 1.00 0.00 C ATOM 1299 C LEU B 3 -2.412 -8.069 -9.671 1.00 0.00 C ATOM 1300 O LEU B 3 -1.502 -7.670 -10.375 1.00 0.00 O ATOM 1301 CB LEU B 3 -3.774 -6.614 -8.186 1.00 0.00 C ATOM 1302 CG LEU B 3 -4.936 -5.615 -8.142 1.00 0.00 C ATOM 1303 CD1 LEU B 3 -5.200 -5.202 -6.690 1.00 0.00 C ATOM 1304 CD2 LEU B 3 -4.591 -4.363 -8.975 1.00 0.00 C ATOM 0 H LEU B 3 -5.471 -8.296 -8.848 1.00 0.00 H new ATOM 0 HA LEU B 3 -3.779 -6.559 -10.356 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -3.896 -7.361 -7.402 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -2.833 -6.099 -7.992 1.00 0.00 H new ATOM 0 HG LEU B 3 -5.826 -6.087 -8.559 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -6.026 -4.492 -6.658 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -5.456 -6.083 -6.102 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -4.306 -4.737 -6.276 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -5.423 -3.660 -8.937 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -3.697 -3.890 -8.568 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -4.408 -4.653 -10.010 1.00 0.00 H new ATOM 1316 N SER B 4 -2.316 -9.170 -8.986 1.00 0.00 N ATOM 1317 CA SER B 4 -1.075 -9.993 -9.037 1.00 0.00 C ATOM 1318 C SER B 4 -0.897 -10.553 -10.444 1.00 0.00 C ATOM 1319 O SER B 4 0.203 -10.651 -10.954 1.00 0.00 O ATOM 1320 CB SER B 4 -1.193 -11.142 -8.036 1.00 0.00 C ATOM 1321 OG SER B 4 -1.515 -10.615 -6.754 1.00 0.00 O ATOM 0 H SER B 4 -3.052 -9.541 -8.385 1.00 0.00 H new ATOM 0 HA SER B 4 -0.212 -9.377 -8.783 1.00 0.00 H new ATOM 0 HB2 SER B 4 -1.963 -11.843 -8.358 1.00 0.00 H new ATOM 0 HB3 SER B 4 -0.256 -11.697 -7.989 1.00 0.00 H new ATOM 0 HG SER B 4 -0.698 -10.534 -6.219 1.00 0.00 H new ATOM 1327 N ASN B 5 -1.979 -10.927 -11.069 1.00 0.00 N ATOM 1328 CA ASN B 5 -1.898 -11.489 -12.446 1.00 0.00 C ATOM 1329 C ASN B 5 -1.387 -10.407 -13.401 1.00 0.00 C ATOM 1330 O ASN B 5 -0.514 -10.641 -14.217 1.00 0.00 O ATOM 1331 CB ASN B 5 -3.299 -11.929 -12.885 1.00 0.00 C ATOM 1332 CG ASN B 5 -3.224 -12.604 -14.255 1.00 0.00 C ATOM 1333 OD1 ASN B 5 -2.787 -11.926 -15.280 1.00 0.00 O flip ATOM 1334 ND2 ASN B 5 -3.570 -13.760 -14.396 1.00 0.00 N flip ATOM 0 H ASN B 5 -2.921 -10.867 -10.683 1.00 0.00 H new ATOM 0 HA ASN B 5 -1.219 -12.342 -12.461 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -3.720 -12.618 -12.153 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -3.964 -11.066 -12.930 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -3.912 -14.291 -13.595 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -3.519 -14.199 -15.315 1.00 0.00 H new ATOM 1341 N GLU B 6 -1.925 -9.222 -13.294 1.00 0.00 N ATOM 1342 CA GLU B 6 -1.485 -8.105 -14.181 1.00 0.00 C ATOM 1343 C GLU B 6 -0.076 -7.667 -13.786 1.00 0.00 C ATOM 1344 O GLU B 6 0.746 -7.341 -14.621 1.00 0.00 O ATOM 1345 CB GLU B 6 -2.450 -6.919 -14.026 1.00 0.00 C ATOM 1346 CG GLU B 6 -2.348 -5.991 -15.243 1.00 0.00 C ATOM 1347 CD GLU B 6 -0.983 -5.292 -15.262 1.00 0.00 C ATOM 1348 OE1 GLU B 6 -0.425 -5.083 -14.197 1.00 0.00 O ATOM 1349 OE2 GLU B 6 -0.522 -4.972 -16.346 1.00 0.00 O ATOM 0 H GLU B 6 -2.656 -8.978 -12.626 1.00 0.00 H new ATOM 0 HA GLU B 6 -1.485 -8.442 -15.218 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -3.472 -7.283 -13.922 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -2.215 -6.366 -13.117 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -2.484 -6.565 -16.160 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -3.145 -5.248 -15.211 1.00 0.00 H new ATOM 1356 N LEU B 7 0.194 -7.645 -12.512 1.00 0.00 N ATOM 1357 CA LEU B 7 1.536 -7.222 -12.031 1.00 0.00 C ATOM 1358 C LEU B 7 2.592 -8.206 -12.534 1.00 0.00 C ATOM 1359 O LEU B 7 3.673 -7.825 -12.948 1.00 0.00 O ATOM 1360 CB LEU B 7 1.543 -7.211 -10.498 1.00 0.00 C ATOM 1361 CG LEU B 7 2.888 -6.679 -9.986 1.00 0.00 C ATOM 1362 CD1 LEU B 7 3.056 -5.200 -10.385 1.00 0.00 C ATOM 1363 CD2 LEU B 7 2.940 -6.809 -8.461 1.00 0.00 C ATOM 0 H LEU B 7 -0.464 -7.904 -11.777 1.00 0.00 H new ATOM 0 HA LEU B 7 1.760 -6.224 -12.407 1.00 0.00 H new ATOM 0 HB2 LEU B 7 0.730 -6.587 -10.126 1.00 0.00 H new ATOM 0 HB3 LEU B 7 1.372 -8.218 -10.118 1.00 0.00 H new ATOM 0 HG LEU B 7 3.696 -7.261 -10.430 1.00 0.00 H new ATOM 0 HD11 LEU B 7 4.013 -4.830 -10.018 1.00 0.00 H new ATOM 0 HD12 LEU B 7 3.025 -5.110 -11.471 1.00 0.00 H new ATOM 0 HD13 LEU B 7 2.249 -4.612 -9.949 1.00 0.00 H new ATOM 0 HD21 LEU B 7 3.895 -6.431 -8.096 1.00 0.00 H new ATOM 0 HD22 LEU B 7 2.128 -6.231 -8.019 1.00 0.00 H new ATOM 0 HD23 LEU B 7 2.833 -7.857 -8.181 1.00 0.00 H new ATOM 1375 N LYS B 8 2.285 -9.472 -12.488 1.00 0.00 N ATOM 1376 CA LYS B 8 3.257 -10.501 -12.949 1.00 0.00 C ATOM 1377 C LYS B 8 3.532 -10.293 -14.439 1.00 0.00 C ATOM 1378 O LYS B 8 4.651 -10.413 -14.901 1.00 0.00 O ATOM 1379 CB LYS B 8 2.660 -11.893 -12.730 1.00 0.00 C ATOM 1380 CG LYS B 8 3.699 -12.958 -13.076 1.00 0.00 C ATOM 1381 CD LYS B 8 3.124 -14.348 -12.793 1.00 0.00 C ATOM 1382 CE LYS B 8 4.171 -15.416 -13.123 1.00 0.00 C ATOM 1383 NZ LYS B 8 5.177 -15.480 -12.024 1.00 0.00 N ATOM 0 H LYS B 8 1.396 -9.840 -12.148 1.00 0.00 H new ATOM 0 HA LYS B 8 4.187 -10.412 -12.387 1.00 0.00 H new ATOM 0 HB2 LYS B 8 2.342 -12.004 -11.693 1.00 0.00 H new ATOM 0 HB3 LYS B 8 1.773 -12.021 -13.351 1.00 0.00 H new ATOM 0 HG2 LYS B 8 3.982 -12.877 -14.126 1.00 0.00 H new ATOM 0 HG3 LYS B 8 4.604 -12.802 -12.489 1.00 0.00 H new ATOM 0 HD2 LYS B 8 2.830 -14.424 -11.746 1.00 0.00 H new ATOM 0 HD3 LYS B 8 2.226 -14.509 -13.389 1.00 0.00 H new ATOM 0 HE2 LYS B 8 3.690 -16.386 -13.248 1.00 0.00 H new ATOM 0 HE3 LYS B 8 4.662 -15.180 -14.067 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 5.819 -16.282 -12.187 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 5.725 -14.596 -12.003 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 4.690 -15.607 -11.114 1.00 0.00 H new ATOM 1397 N VAL B 9 2.508 -9.976 -15.186 1.00 0.00 N ATOM 1398 CA VAL B 9 2.678 -9.748 -16.652 1.00 0.00 C ATOM 1399 C VAL B 9 3.620 -8.566 -16.879 1.00 0.00 C ATOM 1400 O VAL B 9 4.523 -8.626 -17.688 1.00 0.00 O ATOM 1401 CB VAL B 9 1.314 -9.425 -17.273 1.00 0.00 C ATOM 1402 CG1 VAL B 9 1.500 -8.974 -18.727 1.00 0.00 C ATOM 1403 CG2 VAL B 9 0.424 -10.671 -17.237 1.00 0.00 C ATOM 0 H VAL B 9 1.554 -9.864 -14.842 1.00 0.00 H new ATOM 0 HA VAL B 9 3.095 -10.643 -17.113 1.00 0.00 H new ATOM 0 HB VAL B 9 0.843 -8.624 -16.703 1.00 0.00 H new ATOM 0 HG11 VAL B 9 0.528 -8.746 -19.164 1.00 0.00 H new ATOM 0 HG12 VAL B 9 2.128 -8.084 -18.754 1.00 0.00 H new ATOM 0 HG13 VAL B 9 1.976 -9.772 -19.297 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -0.545 -10.439 -17.679 1.00 0.00 H new ATOM 0 HG22 VAL B 9 0.898 -11.473 -17.803 1.00 0.00 H new ATOM 0 HG23 VAL B 9 0.285 -10.989 -16.204 1.00 0.00 H new ATOM 1413 N GLU B 10 3.407 -7.493 -16.165 1.00 0.00 N ATOM 1414 CA GLU B 10 4.271 -6.289 -16.329 1.00 0.00 C ATOM 1415 C GLU B 10 5.734 -6.699 -16.176 1.00 0.00 C ATOM 1416 O GLU B 10 6.592 -6.274 -16.925 1.00 0.00 O ATOM 1417 CB GLU B 10 3.910 -5.264 -15.246 1.00 0.00 C ATOM 1418 CG GLU B 10 2.560 -4.602 -15.573 1.00 0.00 C ATOM 1419 CD GLU B 10 2.756 -3.464 -16.580 1.00 0.00 C ATOM 1420 OE1 GLU B 10 3.774 -3.458 -17.254 1.00 0.00 O ATOM 1421 OE2 GLU B 10 1.881 -2.617 -16.660 1.00 0.00 O ATOM 0 H GLU B 10 2.666 -7.399 -15.470 1.00 0.00 H new ATOM 0 HA GLU B 10 4.117 -5.850 -17.315 1.00 0.00 H new ATOM 0 HB2 GLU B 10 3.857 -5.754 -14.274 1.00 0.00 H new ATOM 0 HB3 GLU B 10 4.689 -4.505 -15.179 1.00 0.00 H new ATOM 0 HG2 GLU B 10 1.873 -5.343 -15.981 1.00 0.00 H new ATOM 0 HG3 GLU B 10 2.106 -4.215 -14.660 1.00 0.00 H new ATOM 1428 N ARG B 11 6.015 -7.537 -15.218 1.00 0.00 N ATOM 1429 CA ARG B 11 7.418 -8.001 -15.005 1.00 0.00 C ATOM 1430 C ARG B 11 7.913 -8.726 -16.260 1.00 0.00 C ATOM 1431 O ARG B 11 9.033 -8.540 -16.696 1.00 0.00 O ATOM 1432 CB ARG B 11 7.453 -8.964 -13.815 1.00 0.00 C ATOM 1433 CG ARG B 11 8.863 -9.528 -13.640 1.00 0.00 C ATOM 1434 CD ARG B 11 8.935 -10.331 -12.338 1.00 0.00 C ATOM 1435 NE ARG B 11 10.182 -11.152 -12.331 1.00 0.00 N ATOM 1436 CZ ARG B 11 10.297 -12.172 -11.520 1.00 0.00 C ATOM 1437 NH1 ARG B 11 9.333 -12.481 -10.697 1.00 0.00 N ATOM 1438 NH2 ARG B 11 11.389 -12.889 -11.536 1.00 0.00 N ATOM 0 H ARG B 11 5.330 -7.924 -14.568 1.00 0.00 H new ATOM 0 HA ARG B 11 8.061 -7.144 -14.805 1.00 0.00 H new ATOM 0 HB2 ARG B 11 7.145 -8.445 -12.907 1.00 0.00 H new ATOM 0 HB3 ARG B 11 6.744 -9.777 -13.973 1.00 0.00 H new ATOM 0 HG2 ARG B 11 9.119 -10.165 -14.487 1.00 0.00 H new ATOM 0 HG3 ARG B 11 9.591 -8.717 -13.620 1.00 0.00 H new ATOM 0 HD2 ARG B 11 8.925 -9.657 -11.481 1.00 0.00 H new ATOM 0 HD3 ARG B 11 8.061 -10.976 -12.247 1.00 0.00 H new ATOM 0 HE ARG B 11 10.948 -10.916 -12.962 1.00 0.00 H new ATOM 0 HH11 ARG B 11 8.478 -11.925 -10.681 1.00 0.00 H new ATOM 0 HH12 ARG B 11 9.434 -13.279 -10.069 1.00 0.00 H new ATOM 0 HH21 ARG B 11 12.145 -12.652 -12.178 1.00 0.00 H new ATOM 0 HH22 ARG B 11 11.485 -13.686 -10.906 1.00 0.00 H new ATOM 1452 N ILE B 12 7.083 -9.554 -16.833 1.00 0.00 N ATOM 1453 CA ILE B 12 7.482 -10.305 -18.060 1.00 0.00 C ATOM 1454 C ILE B 12 7.694 -9.327 -19.220 1.00 0.00 C ATOM 1455 O ILE B 12 8.627 -9.455 -19.990 1.00 0.00 O ATOM 1456 CB ILE B 12 6.382 -11.307 -18.427 1.00 0.00 C ATOM 1457 CG1 ILE B 12 6.310 -12.401 -17.357 1.00 0.00 C ATOM 1458 CG2 ILE B 12 6.700 -11.945 -19.784 1.00 0.00 C ATOM 1459 CD1 ILE B 12 5.065 -13.264 -17.582 1.00 0.00 C ATOM 0 H ILE B 12 6.137 -9.745 -16.502 1.00 0.00 H new ATOM 0 HA ILE B 12 8.412 -10.841 -17.868 1.00 0.00 H new ATOM 0 HB ILE B 12 5.425 -10.788 -18.484 1.00 0.00 H new ATOM 0 HG12 ILE B 12 7.206 -13.021 -17.397 1.00 0.00 H new ATOM 0 HG13 ILE B 12 6.277 -11.951 -16.365 1.00 0.00 H new ATOM 0 HG21 ILE B 12 5.917 -12.657 -20.044 1.00 0.00 H new ATOM 0 HG22 ILE B 12 6.752 -11.169 -20.548 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.657 -12.463 -19.727 1.00 0.00 H new ATOM 0 HD11 ILE B 12 5.018 -14.041 -16.819 1.00 0.00 H new ATOM 0 HD12 ILE B 12 4.174 -12.640 -17.520 1.00 0.00 H new ATOM 0 HD13 ILE B 12 5.116 -13.727 -18.568 1.00 0.00 H new ATOM 1471 N ARG B 13 6.820 -8.365 -19.361 1.00 0.00 N ATOM 1472 CA ARG B 13 6.952 -7.388 -20.483 1.00 0.00 C ATOM 1473 C ARG B 13 8.284 -6.653 -20.359 1.00 0.00 C ATOM 1474 O ARG B 13 8.995 -6.465 -21.328 1.00 0.00 O ATOM 1475 CB ARG B 13 5.821 -6.356 -20.412 1.00 0.00 C ATOM 1476 CG ARG B 13 4.462 -7.045 -20.610 1.00 0.00 C ATOM 1477 CD ARG B 13 3.398 -6.009 -20.999 1.00 0.00 C ATOM 1478 NE ARG B 13 3.467 -5.762 -22.473 1.00 0.00 N ATOM 1479 CZ ARG B 13 2.695 -6.422 -23.303 1.00 0.00 C ATOM 1480 NH1 ARG B 13 1.848 -7.314 -22.864 1.00 0.00 N ATOM 1481 NH2 ARG B 13 2.778 -6.187 -24.586 1.00 0.00 N ATOM 0 H ARG B 13 6.020 -8.213 -18.747 1.00 0.00 H new ATOM 0 HA ARG B 13 6.902 -7.927 -21.429 1.00 0.00 H new ATOM 0 HB2 ARG B 13 5.842 -5.848 -19.448 1.00 0.00 H new ATOM 0 HB3 ARG B 13 5.966 -5.594 -21.178 1.00 0.00 H new ATOM 0 HG2 ARG B 13 4.541 -7.806 -21.386 1.00 0.00 H new ATOM 0 HG3 ARG B 13 4.167 -7.555 -19.693 1.00 0.00 H new ATOM 0 HD2 ARG B 13 2.406 -6.368 -20.724 1.00 0.00 H new ATOM 0 HD3 ARG B 13 3.562 -5.079 -20.454 1.00 0.00 H new ATOM 0 HE ARG B 13 4.123 -5.071 -22.837 1.00 0.00 H new ATOM 0 HH11 ARG B 13 1.781 -7.505 -21.864 1.00 0.00 H new ATOM 0 HH12 ARG B 13 1.254 -7.820 -23.521 1.00 0.00 H new ATOM 0 HH21 ARG B 13 3.440 -5.494 -24.936 1.00 0.00 H new ATOM 0 HH22 ARG B 13 2.181 -6.696 -25.237 1.00 0.00 H new ATOM 1495 N LEU B 14 8.630 -6.247 -19.168 1.00 0.00 N ATOM 1496 CA LEU B 14 9.923 -5.527 -18.958 1.00 0.00 C ATOM 1497 C LEU B 14 11.000 -6.552 -18.600 1.00 0.00 C ATOM 1498 O LEU B 14 12.164 -6.225 -18.459 1.00 0.00 O ATOM 1499 CB LEU B 14 9.763 -4.515 -17.813 1.00 0.00 C ATOM 1500 CG LEU B 14 8.741 -3.433 -18.201 1.00 0.00 C ATOM 1501 CD1 LEU B 14 8.484 -2.522 -16.994 1.00 0.00 C ATOM 1502 CD2 LEU B 14 9.281 -2.590 -19.375 1.00 0.00 C ATOM 0 H LEU B 14 8.071 -6.383 -18.326 1.00 0.00 H new ATOM 0 HA LEU B 14 10.209 -4.994 -19.865 1.00 0.00 H new ATOM 0 HB2 LEU B 14 9.436 -5.027 -16.908 1.00 0.00 H new ATOM 0 HB3 LEU B 14 10.725 -4.054 -17.588 1.00 0.00 H new ATOM 0 HG LEU B 14 7.811 -3.913 -18.507 1.00 0.00 H new ATOM 0 HD11 LEU B 14 7.760 -1.754 -17.266 1.00 0.00 H new ATOM 0 HD12 LEU B 14 8.091 -3.115 -16.168 1.00 0.00 H new ATOM 0 HD13 LEU B 14 9.418 -2.049 -16.690 1.00 0.00 H new ATOM 0 HD21 LEU B 14 8.550 -1.827 -19.642 1.00 0.00 H new ATOM 0 HD22 LEU B 14 10.214 -2.111 -19.080 1.00 0.00 H new ATOM 0 HD23 LEU B 14 9.461 -3.236 -20.234 1.00 0.00 H new ATOM 1514 N SER B 15 10.608 -7.795 -18.463 1.00 0.00 N ATOM 1515 CA SER B 15 11.577 -8.882 -18.119 1.00 0.00 C ATOM 1516 C SER B 15 12.581 -8.385 -17.078 1.00 0.00 C ATOM 1517 O SER B 15 13.781 -8.495 -17.240 1.00 0.00 O ATOM 1518 CB SER B 15 12.303 -9.338 -19.388 1.00 0.00 C ATOM 1519 OG SER B 15 11.336 -9.644 -20.388 1.00 0.00 O ATOM 0 H SER B 15 9.643 -8.107 -18.577 1.00 0.00 H new ATOM 0 HA SER B 15 11.035 -9.728 -17.695 1.00 0.00 H new ATOM 0 HB2 SER B 15 12.975 -8.555 -19.740 1.00 0.00 H new ATOM 0 HB3 SER B 15 12.917 -10.213 -19.177 1.00 0.00 H new ATOM 0 HG SER B 15 10.441 -9.647 -19.988 1.00 0.00 H new ATOM 1525 N LEU B 16 12.077 -7.832 -16.010 1.00 0.00 N ATOM 1526 CA LEU B 16 12.963 -7.305 -14.930 1.00 0.00 C ATOM 1527 C LEU B 16 13.470 -8.448 -14.061 1.00 0.00 C ATOM 1528 O LEU B 16 12.775 -9.409 -13.800 1.00 0.00 O ATOM 1529 CB LEU B 16 12.171 -6.323 -14.064 1.00 0.00 C ATOM 1530 CG LEU B 16 11.857 -5.060 -14.877 1.00 0.00 C ATOM 1531 CD1 LEU B 16 10.797 -4.225 -14.148 1.00 0.00 C ATOM 1532 CD2 LEU B 16 13.135 -4.218 -15.064 1.00 0.00 C ATOM 0 H LEU B 16 11.078 -7.721 -15.836 1.00 0.00 H new ATOM 0 HA LEU B 16 13.816 -6.799 -15.383 1.00 0.00 H new ATOM 0 HB2 LEU B 16 11.246 -6.787 -13.722 1.00 0.00 H new ATOM 0 HB3 LEU B 16 12.744 -6.062 -13.174 1.00 0.00 H new ATOM 0 HG LEU B 16 11.478 -5.356 -15.855 1.00 0.00 H new ATOM 0 HD11 LEU B 16 10.577 -3.329 -14.729 1.00 0.00 H new ATOM 0 HD12 LEU B 16 9.887 -4.814 -14.031 1.00 0.00 H new ATOM 0 HD13 LEU B 16 11.172 -3.938 -13.166 1.00 0.00 H new ATOM 0 HD21 LEU B 16 12.901 -3.324 -15.642 1.00 0.00 H new ATOM 0 HD22 LEU B 16 13.525 -3.927 -14.089 1.00 0.00 H new ATOM 0 HD23 LEU B 16 13.884 -4.807 -15.594 1.00 0.00 H new ATOM 1544 N THR B 17 14.687 -8.334 -13.608 1.00 0.00 N ATOM 1545 CA THR B 17 15.286 -9.394 -12.749 1.00 0.00 C ATOM 1546 C THR B 17 15.057 -9.055 -11.278 1.00 0.00 C ATOM 1547 O THR B 17 15.170 -7.920 -10.857 1.00 0.00 O ATOM 1548 CB THR B 17 16.791 -9.483 -13.021 1.00 0.00 C ATOM 1549 OG1 THR B 17 17.373 -8.188 -12.929 1.00 0.00 O ATOM 1550 CG2 THR B 17 17.022 -10.052 -14.422 1.00 0.00 C ATOM 0 H THR B 17 15.300 -7.541 -13.799 1.00 0.00 H new ATOM 0 HA THR B 17 14.816 -10.350 -12.978 1.00 0.00 H new ATOM 0 HB THR B 17 17.254 -10.137 -12.282 1.00 0.00 H new ATOM 0 HG1 THR B 17 18.336 -8.249 -13.102 1.00 0.00 H new ATOM 0 HG21 THR B 17 18.093 -10.116 -14.617 1.00 0.00 H new ATOM 0 HG22 THR B 17 16.581 -11.047 -14.488 1.00 0.00 H new ATOM 0 HG23 THR B 17 16.557 -9.399 -15.161 1.00 0.00 H new ATOM 1558 N ALA B 18 14.738 -10.046 -10.498 1.00 0.00 N ATOM 1559 CA ALA B 18 14.498 -9.829 -9.045 1.00 0.00 C ATOM 1560 C ALA B 18 15.791 -9.333 -8.398 1.00 0.00 C ATOM 1561 O ALA B 18 15.775 -8.535 -7.480 1.00 0.00 O ATOM 1562 CB ALA B 18 14.075 -11.155 -8.401 1.00 0.00 C ATOM 0 H ALA B 18 14.632 -11.012 -10.809 1.00 0.00 H new ATOM 0 HA ALA B 18 13.710 -9.090 -8.902 1.00 0.00 H new ATOM 0 HB1 ALA B 18 13.898 -11.002 -7.336 1.00 0.00 H new ATOM 0 HB2 ALA B 18 13.160 -11.513 -8.873 1.00 0.00 H new ATOM 0 HB3 ALA B 18 14.866 -11.893 -8.535 1.00 0.00 H new ATOM 1568 N LYS B 19 16.906 -9.806 -8.878 1.00 0.00 N ATOM 1569 CA LYS B 19 18.218 -9.381 -8.317 1.00 0.00 C ATOM 1570 C LYS B 19 18.406 -7.882 -8.535 1.00 0.00 C ATOM 1571 O LYS B 19 18.831 -7.162 -7.652 1.00 0.00 O ATOM 1572 CB LYS B 19 19.338 -10.137 -9.039 1.00 0.00 C ATOM 1573 CG LYS B 19 20.689 -9.786 -8.413 1.00 0.00 C ATOM 1574 CD LYS B 19 21.802 -10.587 -9.097 1.00 0.00 C ATOM 1575 CE LYS B 19 23.153 -10.237 -8.465 1.00 0.00 C ATOM 1576 NZ LYS B 19 23.160 -10.653 -7.034 1.00 0.00 N ATOM 0 H LYS B 19 16.965 -10.477 -9.644 1.00 0.00 H new ATOM 0 HA LYS B 19 18.247 -9.600 -7.250 1.00 0.00 H new ATOM 0 HB2 LYS B 19 19.165 -11.211 -8.973 1.00 0.00 H new ATOM 0 HB3 LYS B 19 19.340 -9.878 -10.098 1.00 0.00 H new ATOM 0 HG2 LYS B 19 20.881 -8.718 -8.516 1.00 0.00 H new ATOM 0 HG3 LYS B 19 20.674 -10.006 -7.346 1.00 0.00 H new ATOM 0 HD2 LYS B 19 21.609 -11.655 -8.997 1.00 0.00 H new ATOM 0 HD3 LYS B 19 21.820 -10.365 -10.164 1.00 0.00 H new ATOM 0 HE2 LYS B 19 23.958 -10.737 -9.003 1.00 0.00 H new ATOM 0 HE3 LYS B 19 23.335 -9.165 -8.543 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 24.141 -10.719 -6.696 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 22.645 -9.951 -6.466 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 22.699 -11.580 -6.940 1.00 0.00 H new ATOM 1590 N SER B 20 18.100 -7.414 -9.714 1.00 0.00 N ATOM 1591 CA SER B 20 18.266 -5.962 -10.019 1.00 0.00 C ATOM 1592 C SER B 20 17.381 -5.123 -9.092 1.00 0.00 C ATOM 1593 O SER B 20 17.828 -4.166 -8.481 1.00 0.00 O ATOM 1594 CB SER B 20 17.848 -5.712 -11.473 1.00 0.00 C ATOM 1595 OG SER B 20 17.668 -4.320 -11.683 1.00 0.00 O ATOM 0 H SER B 20 17.740 -7.977 -10.484 1.00 0.00 H new ATOM 0 HA SER B 20 19.308 -5.678 -9.869 1.00 0.00 H new ATOM 0 HB2 SER B 20 18.608 -6.097 -12.152 1.00 0.00 H new ATOM 0 HB3 SER B 20 16.924 -6.246 -11.693 1.00 0.00 H new ATOM 0 HG SER B 20 17.402 -4.161 -12.613 1.00 0.00 H new ATOM 1601 N VAL B 21 16.131 -5.479 -8.979 1.00 0.00 N ATOM 1602 CA VAL B 21 15.199 -4.711 -8.101 1.00 0.00 C ATOM 1603 C VAL B 21 15.651 -4.815 -6.644 1.00 0.00 C ATOM 1604 O VAL B 21 15.679 -3.839 -5.920 1.00 0.00 O ATOM 1605 CB VAL B 21 13.790 -5.292 -8.226 1.00 0.00 C ATOM 1606 CG1 VAL B 21 12.851 -4.571 -7.253 1.00 0.00 C ATOM 1607 CG2 VAL B 21 13.286 -5.104 -9.659 1.00 0.00 C ATOM 0 H VAL B 21 15.711 -6.274 -9.460 1.00 0.00 H new ATOM 0 HA VAL B 21 15.201 -3.665 -8.409 1.00 0.00 H new ATOM 0 HB VAL B 21 13.813 -6.355 -7.986 1.00 0.00 H new ATOM 0 HG11 VAL B 21 11.847 -4.985 -7.342 1.00 0.00 H new ATOM 0 HG12 VAL B 21 13.210 -4.707 -6.233 1.00 0.00 H new ATOM 0 HG13 VAL B 21 12.827 -3.508 -7.491 1.00 0.00 H new ATOM 0 HG21 VAL B 21 12.282 -5.518 -9.749 1.00 0.00 H new ATOM 0 HG22 VAL B 21 13.263 -4.041 -9.900 1.00 0.00 H new ATOM 0 HG23 VAL B 21 13.954 -5.619 -10.350 1.00 0.00 H new ATOM 1617 N ALA B 22 15.997 -5.997 -6.212 1.00 0.00 N ATOM 1618 CA ALA B 22 16.446 -6.183 -4.802 1.00 0.00 C ATOM 1619 C ALA B 22 17.724 -5.382 -4.579 1.00 0.00 C ATOM 1620 O ALA B 22 18.034 -4.970 -3.476 1.00 0.00 O ATOM 1621 CB ALA B 22 16.719 -7.667 -4.539 1.00 0.00 C ATOM 0 H ALA B 22 15.988 -6.846 -6.777 1.00 0.00 H new ATOM 0 HA ALA B 22 15.669 -5.837 -4.121 1.00 0.00 H new ATOM 0 HB1 ALA B 22 17.047 -7.799 -3.508 1.00 0.00 H new ATOM 0 HB2 ALA B 22 15.807 -8.240 -4.706 1.00 0.00 H new ATOM 0 HB3 ALA B 22 17.498 -8.019 -5.215 1.00 0.00 H new ATOM 1627 N GLU B 23 18.470 -5.168 -5.624 1.00 0.00 N ATOM 1628 CA GLU B 23 19.742 -4.404 -5.500 1.00 0.00 C ATOM 1629 C GLU B 23 19.426 -2.965 -5.082 1.00 0.00 C ATOM 1630 O GLU B 23 20.063 -2.399 -4.213 1.00 0.00 O ATOM 1631 CB GLU B 23 20.460 -4.409 -6.875 1.00 0.00 C ATOM 1632 CG GLU B 23 21.934 -4.800 -6.717 1.00 0.00 C ATOM 1633 CD GLU B 23 22.580 -3.950 -5.616 1.00 0.00 C ATOM 1634 OE1 GLU B 23 22.699 -2.750 -5.810 1.00 0.00 O ATOM 1635 OE2 GLU B 23 22.936 -4.514 -4.596 1.00 0.00 O ATOM 0 H GLU B 23 18.252 -5.492 -6.566 1.00 0.00 H new ATOM 0 HA GLU B 23 20.387 -4.860 -4.749 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.963 -5.109 -7.547 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.388 -3.422 -7.332 1.00 0.00 H new ATOM 0 HG2 GLU B 23 22.015 -5.858 -6.467 1.00 0.00 H new ATOM 0 HG3 GLU B 23 22.462 -4.654 -7.659 1.00 0.00 H new ATOM 1642 N GLU B 24 18.450 -2.376 -5.710 1.00 0.00 N ATOM 1643 CA GLU B 24 18.065 -0.972 -5.381 1.00 0.00 C ATOM 1644 C GLU B 24 17.316 -0.948 -4.045 1.00 0.00 C ATOM 1645 O GLU B 24 17.574 -0.131 -3.183 1.00 0.00 O ATOM 1646 CB GLU B 24 17.126 -0.423 -6.468 1.00 0.00 C ATOM 1647 CG GLU B 24 17.587 -0.850 -7.867 1.00 0.00 C ATOM 1648 CD GLU B 24 18.904 -0.162 -8.220 1.00 0.00 C ATOM 1649 OE1 GLU B 24 19.371 0.632 -7.421 1.00 0.00 O ATOM 1650 OE2 GLU B 24 19.409 -0.420 -9.301 1.00 0.00 O ATOM 0 H GLU B 24 17.894 -2.810 -6.447 1.00 0.00 H new ATOM 0 HA GLU B 24 18.967 -0.363 -5.322 1.00 0.00 H new ATOM 0 HB2 GLU B 24 16.112 -0.782 -6.291 1.00 0.00 H new ATOM 0 HB3 GLU B 24 17.094 0.665 -6.409 1.00 0.00 H new ATOM 0 HG2 GLU B 24 17.713 -1.932 -7.902 1.00 0.00 H new ATOM 0 HG3 GLU B 24 16.825 -0.593 -8.603 1.00 0.00 H new ATOM 1657 N MET B 25 16.372 -1.842 -3.896 1.00 0.00 N ATOM 1658 CA MET B 25 15.560 -1.900 -2.644 1.00 0.00 C ATOM 1659 C MET B 25 16.470 -2.272 -1.479 1.00 0.00 C ATOM 1660 O MET B 25 16.342 -1.757 -0.384 1.00 0.00 O ATOM 1661 CB MET B 25 14.460 -2.961 -2.795 1.00 0.00 C ATOM 1662 CG MET B 25 13.351 -2.441 -3.715 1.00 0.00 C ATOM 1663 SD MET B 25 12.341 -1.225 -2.829 1.00 0.00 S ATOM 1664 CE MET B 25 11.227 -2.396 -2.007 1.00 0.00 C ATOM 0 H MET B 25 16.127 -2.542 -4.597 1.00 0.00 H new ATOM 0 HA MET B 25 15.100 -0.929 -2.457 1.00 0.00 H new ATOM 0 HB2 MET B 25 14.883 -3.879 -3.204 1.00 0.00 H new ATOM 0 HB3 MET B 25 14.046 -3.209 -1.818 1.00 0.00 H new ATOM 0 HG2 MET B 25 13.787 -1.987 -4.605 1.00 0.00 H new ATOM 0 HG3 MET B 25 12.728 -3.269 -4.053 1.00 0.00 H new ATOM 0 HE1 MET B 25 10.260 -2.394 -2.511 1.00 0.00 H new ATOM 0 HE2 MET B 25 11.656 -3.397 -2.049 1.00 0.00 H new ATOM 0 HE3 MET B 25 11.094 -2.102 -0.966 1.00 0.00 H new ATOM 1674 N GLY B 26 17.389 -3.169 -1.710 1.00 0.00 N ATOM 1675 CA GLY B 26 18.324 -3.591 -0.630 1.00 0.00 C ATOM 1676 C GLY B 26 17.640 -4.608 0.282 1.00 0.00 C ATOM 1677 O GLY B 26 17.911 -4.671 1.463 1.00 0.00 O ATOM 0 H GLY B 26 17.533 -3.631 -2.608 1.00 0.00 H new ATOM 0 HA2 GLY B 26 19.223 -4.027 -1.065 1.00 0.00 H new ATOM 0 HA3 GLY B 26 18.639 -2.723 -0.050 1.00 0.00 H new ATOM 1681 N ILE B 27 16.758 -5.409 -0.265 1.00 0.00 N ATOM 1682 CA ILE B 27 16.042 -6.442 0.554 1.00 0.00 C ATOM 1683 C ILE B 27 16.355 -7.835 0.017 1.00 0.00 C ATOM 1684 O ILE B 27 16.840 -8.001 -1.086 1.00 0.00 O ATOM 1685 CB ILE B 27 14.530 -6.202 0.490 1.00 0.00 C ATOM 1686 CG1 ILE B 27 14.048 -6.251 -0.969 1.00 0.00 C ATOM 1687 CG2 ILE B 27 14.201 -4.836 1.095 1.00 0.00 C ATOM 1688 CD1 ILE B 27 12.522 -6.140 -1.007 1.00 0.00 C ATOM 0 H ILE B 27 16.500 -5.393 -1.252 1.00 0.00 H new ATOM 0 HA ILE B 27 16.377 -6.367 1.589 1.00 0.00 H new ATOM 0 HB ILE B 27 14.022 -6.982 1.057 1.00 0.00 H new ATOM 0 HG12 ILE B 27 14.497 -5.437 -1.539 1.00 0.00 H new ATOM 0 HG13 ILE B 27 14.367 -7.182 -1.437 1.00 0.00 H new ATOM 0 HG21 ILE B 27 13.125 -4.667 1.049 1.00 0.00 H new ATOM 0 HG22 ILE B 27 14.528 -4.810 2.135 1.00 0.00 H new ATOM 0 HG23 ILE B 27 14.715 -4.056 0.534 1.00 0.00 H new ATOM 0 HD11 ILE B 27 12.180 -6.175 -2.041 1.00 0.00 H new ATOM 0 HD12 ILE B 27 12.083 -6.969 -0.452 1.00 0.00 H new ATOM 0 HD13 ILE B 27 12.214 -5.197 -0.555 1.00 0.00 H new ATOM 1700 N SER B 28 16.083 -8.833 0.804 1.00 0.00 N ATOM 1701 CA SER B 28 16.358 -10.232 0.383 1.00 0.00 C ATOM 1702 C SER B 28 15.449 -10.617 -0.785 1.00 0.00 C ATOM 1703 O SER B 28 14.338 -10.144 -0.917 1.00 0.00 O ATOM 1704 CB SER B 28 16.109 -11.172 1.567 1.00 0.00 C ATOM 1705 OG SER B 28 17.017 -10.854 2.615 1.00 0.00 O ATOM 0 H SER B 28 15.676 -8.738 1.734 1.00 0.00 H new ATOM 0 HA SER B 28 17.396 -10.316 0.061 1.00 0.00 H new ATOM 0 HB2 SER B 28 15.082 -11.072 1.917 1.00 0.00 H new ATOM 0 HB3 SER B 28 16.241 -12.209 1.258 1.00 0.00 H new ATOM 0 HG SER B 28 16.861 -11.452 3.376 1.00 0.00 H new ATOM 1711 N ARG B 29 15.935 -11.481 -1.630 1.00 0.00 N ATOM 1712 CA ARG B 29 15.148 -11.935 -2.812 1.00 0.00 C ATOM 1713 C ARG B 29 13.878 -12.644 -2.340 1.00 0.00 C ATOM 1714 O ARG B 29 12.846 -12.587 -2.982 1.00 0.00 O ATOM 1715 CB ARG B 29 15.997 -12.901 -3.649 1.00 0.00 C ATOM 1716 CG ARG B 29 17.125 -12.125 -4.335 1.00 0.00 C ATOM 1717 CD ARG B 29 17.999 -13.075 -5.168 1.00 0.00 C ATOM 1718 NE ARG B 29 17.167 -13.702 -6.241 1.00 0.00 N ATOM 1719 CZ ARG B 29 17.732 -14.204 -7.310 1.00 0.00 C ATOM 1720 NH1 ARG B 29 19.025 -14.146 -7.472 1.00 0.00 N ATOM 1721 NH2 ARG B 29 16.988 -14.757 -8.232 1.00 0.00 N ATOM 0 H ARG B 29 16.862 -11.900 -1.551 1.00 0.00 H new ATOM 0 HA ARG B 29 14.874 -11.073 -3.420 1.00 0.00 H new ATOM 0 HB2 ARG B 29 16.413 -13.682 -3.012 1.00 0.00 H new ATOM 0 HB3 ARG B 29 15.375 -13.396 -4.395 1.00 0.00 H new ATOM 0 HG2 ARG B 29 16.704 -11.351 -4.977 1.00 0.00 H new ATOM 0 HG3 ARG B 29 17.736 -11.621 -3.586 1.00 0.00 H new ATOM 0 HD2 ARG B 29 18.831 -12.527 -5.611 1.00 0.00 H new ATOM 0 HD3 ARG B 29 18.429 -13.846 -4.529 1.00 0.00 H new ATOM 0 HE ARG B 29 16.153 -13.739 -6.139 1.00 0.00 H new ATOM 0 HH11 ARG B 29 19.609 -13.706 -6.761 1.00 0.00 H new ATOM 0 HH12 ARG B 29 19.452 -14.541 -8.310 1.00 0.00 H new ATOM 0 HH21 ARG B 29 15.975 -14.795 -8.115 1.00 0.00 H new ATOM 0 HH22 ARG B 29 17.420 -15.150 -9.068 1.00 0.00 H new ATOM 1735 N GLN B 30 13.954 -13.319 -1.228 1.00 0.00 N ATOM 1736 CA GLN B 30 12.766 -14.047 -0.699 1.00 0.00 C ATOM 1737 C GLN B 30 11.623 -13.055 -0.455 1.00 0.00 C ATOM 1738 O GLN B 30 10.483 -13.308 -0.796 1.00 0.00 O ATOM 1739 CB GLN B 30 13.144 -14.721 0.626 1.00 0.00 C ATOM 1740 CG GLN B 30 14.226 -15.780 0.384 1.00 0.00 C ATOM 1741 CD GLN B 30 13.665 -16.904 -0.490 1.00 0.00 C ATOM 1742 OE1 GLN B 30 12.634 -17.472 -0.185 1.00 0.00 O ATOM 1743 NE2 GLN B 30 14.304 -17.253 -1.572 1.00 0.00 N ATOM 0 H GLN B 30 14.796 -13.399 -0.657 1.00 0.00 H new ATOM 0 HA GLN B 30 12.444 -14.798 -1.420 1.00 0.00 H new ATOM 0 HB2 GLN B 30 13.505 -13.975 1.333 1.00 0.00 H new ATOM 0 HB3 GLN B 30 12.264 -15.184 1.073 1.00 0.00 H new ATOM 0 HG2 GLN B 30 15.090 -15.326 -0.102 1.00 0.00 H new ATOM 0 HG3 GLN B 30 14.571 -16.185 1.335 1.00 0.00 H new ATOM 0 HE21 GLN B 30 15.169 -16.778 -1.829 1.00 0.00 H new ATOM 0 HE22 GLN B 30 13.939 -18.001 -2.161 1.00 0.00 H new ATOM 1752 N GLN B 31 11.926 -11.927 0.130 1.00 0.00 N ATOM 1753 CA GLN B 31 10.867 -10.907 0.402 1.00 0.00 C ATOM 1754 C GLN B 31 10.326 -10.360 -0.921 1.00 0.00 C ATOM 1755 O GLN B 31 9.135 -10.180 -1.091 1.00 0.00 O ATOM 1756 CB GLN B 31 11.466 -9.755 1.219 1.00 0.00 C ATOM 1757 CG GLN B 31 11.804 -10.247 2.630 1.00 0.00 C ATOM 1758 CD GLN B 31 12.454 -9.118 3.436 1.00 0.00 C ATOM 1759 OE1 GLN B 31 13.524 -8.650 3.099 1.00 0.00 O ATOM 1760 NE2 GLN B 31 11.848 -8.660 4.499 1.00 0.00 N ATOM 0 H GLN B 31 12.864 -11.666 0.433 1.00 0.00 H new ATOM 0 HA GLN B 31 10.055 -11.371 0.962 1.00 0.00 H new ATOM 0 HB2 GLN B 31 12.364 -9.377 0.730 1.00 0.00 H new ATOM 0 HB3 GLN B 31 10.759 -8.927 1.271 1.00 0.00 H new ATOM 0 HG2 GLN B 31 10.899 -10.589 3.132 1.00 0.00 H new ATOM 0 HG3 GLN B 31 12.479 -11.101 2.574 1.00 0.00 H new ATOM 0 HE21 GLN B 31 10.950 -9.052 4.783 1.00 0.00 H new ATOM 0 HE22 GLN B 31 12.273 -7.911 5.045 1.00 0.00 H new ATOM 1769 N LEU B 32 11.196 -10.084 -1.850 1.00 0.00 N ATOM 1770 CA LEU B 32 10.750 -9.537 -3.163 1.00 0.00 C ATOM 1771 C LEU B 32 9.889 -10.571 -3.892 1.00 0.00 C ATOM 1772 O LEU B 32 8.889 -10.248 -4.506 1.00 0.00 O ATOM 1773 CB LEU B 32 11.976 -9.213 -4.024 1.00 0.00 C ATOM 1774 CG LEU B 32 11.550 -8.375 -5.244 1.00 0.00 C ATOM 1775 CD1 LEU B 32 11.454 -6.894 -4.852 1.00 0.00 C ATOM 1776 CD2 LEU B 32 12.575 -8.535 -6.371 1.00 0.00 C ATOM 0 H LEU B 32 12.203 -10.214 -1.757 1.00 0.00 H new ATOM 0 HA LEU B 32 10.166 -8.633 -2.992 1.00 0.00 H new ATOM 0 HB2 LEU B 32 12.712 -8.666 -3.434 1.00 0.00 H new ATOM 0 HB3 LEU B 32 12.454 -10.135 -4.354 1.00 0.00 H new ATOM 0 HG LEU B 32 10.576 -8.724 -5.588 1.00 0.00 H new ATOM 0 HD11 LEU B 32 11.152 -6.307 -5.719 1.00 0.00 H new ATOM 0 HD12 LEU B 32 10.716 -6.775 -4.059 1.00 0.00 H new ATOM 0 HD13 LEU B 32 12.425 -6.547 -4.499 1.00 0.00 H new ATOM 0 HD21 LEU B 32 12.267 -7.939 -7.230 1.00 0.00 H new ATOM 0 HD22 LEU B 32 13.551 -8.196 -6.026 1.00 0.00 H new ATOM 0 HD23 LEU B 32 12.637 -9.584 -6.660 1.00 0.00 H new ATOM 1788 N CYS B 33 10.287 -11.811 -3.833 1.00 0.00 N ATOM 1789 CA CYS B 33 9.522 -12.896 -4.519 1.00 0.00 C ATOM 1790 C CYS B 33 8.093 -12.952 -3.966 1.00 0.00 C ATOM 1791 O CYS B 33 7.146 -13.216 -4.681 1.00 0.00 O ATOM 1792 CB CYS B 33 10.230 -14.238 -4.269 1.00 0.00 C ATOM 1793 SG CYS B 33 10.053 -15.303 -5.719 1.00 0.00 S ATOM 0 H CYS B 33 11.119 -12.125 -3.334 1.00 0.00 H new ATOM 0 HA CYS B 33 9.478 -12.696 -5.590 1.00 0.00 H new ATOM 0 HB2 CYS B 33 11.286 -14.069 -4.057 1.00 0.00 H new ATOM 0 HB3 CYS B 33 9.804 -14.727 -3.393 1.00 0.00 H new ATOM 0 HG CYS B 33 10.655 -16.435 -5.502 1.00 0.00 H new ATOM 1799 N ASN B 34 7.947 -12.713 -2.694 1.00 0.00 N ATOM 1800 CA ASN B 34 6.596 -12.750 -2.057 1.00 0.00 C ATOM 1801 C ASN B 34 5.703 -11.661 -2.652 1.00 0.00 C ATOM 1802 O ASN B 34 4.525 -11.859 -2.867 1.00 0.00 O ATOM 1803 CB ASN B 34 6.729 -12.444 -0.565 1.00 0.00 C ATOM 1804 CG ASN B 34 7.701 -13.412 0.109 1.00 0.00 C ATOM 1805 OD1 ASN B 34 8.122 -14.461 -0.537 1.00 0.00 O flip ATOM 1806 ND2 ASN B 34 8.087 -13.205 1.245 1.00 0.00 N flip ATOM 0 H ASN B 34 8.713 -12.491 -2.059 1.00 0.00 H new ATOM 0 HA ASN B 34 6.167 -13.738 -2.226 1.00 0.00 H new ATOM 0 HB2 ASN B 34 7.078 -11.420 -0.430 1.00 0.00 H new ATOM 0 HB3 ASN B 34 5.752 -12.513 -0.088 1.00 0.00 H new ATOM 0 HD21 ASN B 34 7.759 -12.384 1.753 1.00 0.00 H new ATOM 0 HD22 ASN B 34 8.739 -13.853 1.688 1.00 0.00 H new ATOM 1813 N ILE B 35 6.259 -10.501 -2.881 1.00 0.00 N ATOM 1814 CA ILE B 35 5.453 -9.363 -3.420 1.00 0.00 C ATOM 1815 C ILE B 35 4.899 -9.733 -4.796 1.00 0.00 C ATOM 1816 O ILE B 35 3.744 -9.486 -5.100 1.00 0.00 O ATOM 1817 CB ILE B 35 6.348 -8.117 -3.540 1.00 0.00 C ATOM 1818 CG1 ILE B 35 6.745 -7.630 -2.140 1.00 0.00 C ATOM 1819 CG2 ILE B 35 5.584 -7.003 -4.261 1.00 0.00 C ATOM 1820 CD1 ILE B 35 7.831 -6.551 -2.248 1.00 0.00 C ATOM 0 H ILE B 35 7.243 -10.290 -2.717 1.00 0.00 H new ATOM 0 HA ILE B 35 4.624 -9.151 -2.745 1.00 0.00 H new ATOM 0 HB ILE B 35 7.244 -8.373 -4.106 1.00 0.00 H new ATOM 0 HG12 ILE B 35 5.872 -7.229 -1.624 1.00 0.00 H new ATOM 0 HG13 ILE B 35 7.110 -8.467 -1.545 1.00 0.00 H new ATOM 0 HG21 ILE B 35 6.220 -6.121 -4.345 1.00 0.00 H new ATOM 0 HG22 ILE B 35 5.300 -7.342 -5.257 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.687 -6.751 -3.695 1.00 0.00 H new ATOM 0 HD11 ILE B 35 8.107 -6.211 -1.250 1.00 0.00 H new ATOM 0 HD12 ILE B 35 8.708 -6.966 -2.745 1.00 0.00 H new ATOM 0 HD13 ILE B 35 7.451 -5.709 -2.826 1.00 0.00 H new ATOM 1832 N GLU B 36 5.710 -10.323 -5.623 1.00 0.00 N ATOM 1833 CA GLU B 36 5.252 -10.722 -6.985 1.00 0.00 C ATOM 1834 C GLU B 36 4.203 -11.833 -6.863 1.00 0.00 C ATOM 1835 O GLU B 36 3.302 -11.944 -7.670 1.00 0.00 O ATOM 1836 CB GLU B 36 6.458 -11.239 -7.784 1.00 0.00 C ATOM 1837 CG GLU B 36 6.153 -11.183 -9.283 1.00 0.00 C ATOM 1838 CD GLU B 36 6.135 -9.727 -9.760 1.00 0.00 C ATOM 1839 OE1 GLU B 36 6.507 -8.862 -8.985 1.00 0.00 O ATOM 1840 OE2 GLU B 36 5.747 -9.503 -10.895 1.00 0.00 O ATOM 0 H GLU B 36 6.682 -10.550 -5.414 1.00 0.00 H new ATOM 0 HA GLU B 36 4.812 -9.865 -7.495 1.00 0.00 H new ATOM 0 HB2 GLU B 36 7.339 -10.637 -7.561 1.00 0.00 H new ATOM 0 HB3 GLU B 36 6.689 -12.263 -7.489 1.00 0.00 H new ATOM 0 HG2 GLU B 36 6.904 -11.746 -9.837 1.00 0.00 H new ATOM 0 HG3 GLU B 36 5.190 -11.652 -9.484 1.00 0.00 H new ATOM 1847 N GLN B 37 4.322 -12.660 -5.857 1.00 0.00 N ATOM 1848 CA GLN B 37 3.341 -13.773 -5.666 1.00 0.00 C ATOM 1849 C GLN B 37 2.264 -13.337 -4.666 1.00 0.00 C ATOM 1850 O GLN B 37 1.286 -14.027 -4.448 1.00 0.00 O ATOM 1851 CB GLN B 37 4.080 -15.007 -5.126 1.00 0.00 C ATOM 1852 CG GLN B 37 3.066 -16.071 -4.697 1.00 0.00 C ATOM 1853 CD GLN B 37 3.760 -17.421 -4.544 1.00 0.00 C ATOM 1854 OE1 GLN B 37 4.865 -17.608 -5.011 1.00 0.00 O ATOM 1855 NE2 GLN B 37 3.150 -18.382 -3.906 1.00 0.00 N ATOM 0 H GLN B 37 5.060 -12.613 -5.155 1.00 0.00 H new ATOM 0 HA GLN B 37 2.869 -14.018 -6.618 1.00 0.00 H new ATOM 0 HB2 GLN B 37 4.742 -15.410 -5.892 1.00 0.00 H new ATOM 0 HB3 GLN B 37 4.706 -14.726 -4.279 1.00 0.00 H new ATOM 0 HG2 GLN B 37 2.601 -15.783 -3.754 1.00 0.00 H new ATOM 0 HG3 GLN B 37 2.269 -16.144 -5.436 1.00 0.00 H new ATOM 0 HE21 GLN B 37 2.222 -18.225 -3.514 1.00 0.00 H new ATOM 0 HE22 GLN B 37 3.602 -19.290 -3.800 1.00 0.00 H new ATOM 1864 N SER B 38 2.438 -12.198 -4.061 1.00 0.00 N ATOM 1865 CA SER B 38 1.440 -11.712 -3.066 1.00 0.00 C ATOM 1866 C SER B 38 0.082 -11.508 -3.733 1.00 0.00 C ATOM 1867 O SER B 38 -0.018 -11.214 -4.907 1.00 0.00 O ATOM 1868 CB SER B 38 1.921 -10.389 -2.469 1.00 0.00 C ATOM 1869 OG SER B 38 0.920 -9.874 -1.605 1.00 0.00 O ATOM 0 H SER B 38 3.233 -11.577 -4.213 1.00 0.00 H new ATOM 0 HA SER B 38 1.335 -12.456 -2.276 1.00 0.00 H new ATOM 0 HB2 SER B 38 2.850 -10.541 -1.919 1.00 0.00 H new ATOM 0 HB3 SER B 38 2.135 -9.674 -3.264 1.00 0.00 H new ATOM 0 HG SER B 38 1.225 -9.027 -1.219 1.00 0.00 H new ATOM 1875 N GLU B 39 -0.964 -11.677 -2.976 1.00 0.00 N ATOM 1876 CA GLU B 39 -2.341 -11.514 -3.527 1.00 0.00 C ATOM 1877 C GLU B 39 -2.604 -10.042 -3.854 1.00 0.00 C ATOM 1878 O GLU B 39 -1.946 -9.453 -4.691 1.00 0.00 O ATOM 1879 CB GLU B 39 -3.364 -11.989 -2.484 1.00 0.00 C ATOM 1880 CG GLU B 39 -3.306 -13.518 -2.341 1.00 0.00 C ATOM 1881 CD GLU B 39 -4.192 -14.176 -3.405 1.00 0.00 C ATOM 1882 OE1 GLU B 39 -3.876 -14.049 -4.576 1.00 0.00 O ATOM 1883 OE2 GLU B 39 -5.178 -14.790 -3.028 1.00 0.00 O ATOM 0 H GLU B 39 -0.925 -11.924 -1.987 1.00 0.00 H new ATOM 0 HA GLU B 39 -2.434 -12.106 -4.437 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -3.159 -11.519 -1.522 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -4.367 -11.682 -2.782 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -2.278 -13.863 -2.448 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -3.639 -13.812 -1.346 1.00 0.00 H new ATOM 1890 N THR B 40 -3.579 -9.456 -3.211 1.00 0.00 N ATOM 1891 CA THR B 40 -3.928 -8.032 -3.482 1.00 0.00 C ATOM 1892 C THR B 40 -3.097 -7.092 -2.615 1.00 0.00 C ATOM 1893 O THR B 40 -2.416 -7.500 -1.692 1.00 0.00 O ATOM 1894 CB THR B 40 -5.415 -7.805 -3.186 1.00 0.00 C ATOM 1895 OG1 THR B 40 -5.671 -8.035 -1.804 1.00 0.00 O ATOM 1896 CG2 THR B 40 -6.263 -8.760 -4.028 1.00 0.00 C ATOM 0 H THR B 40 -4.155 -9.909 -2.501 1.00 0.00 H new ATOM 0 HA THR B 40 -3.716 -7.820 -4.530 1.00 0.00 H new ATOM 0 HB THR B 40 -5.675 -6.776 -3.436 1.00 0.00 H new ATOM 0 HG1 THR B 40 -6.622 -7.887 -1.618 1.00 0.00 H new ATOM 0 HG21 THR B 40 -7.319 -8.594 -3.814 1.00 0.00 H new ATOM 0 HG22 THR B 40 -6.075 -8.577 -5.086 1.00 0.00 H new ATOM 0 HG23 THR B 40 -6.001 -9.790 -3.785 1.00 0.00 H new ATOM 1904 N ALA B 41 -3.161 -5.828 -2.920 1.00 0.00 N ATOM 1905 CA ALA B 41 -2.392 -4.816 -2.148 1.00 0.00 C ATOM 1906 C ALA B 41 -3.118 -4.531 -0.827 1.00 0.00 C ATOM 1907 O ALA B 41 -4.314 -4.725 -0.711 1.00 0.00 O ATOM 1908 CB ALA B 41 -2.295 -3.521 -2.980 1.00 0.00 C ATOM 0 H ALA B 41 -3.722 -5.448 -3.683 1.00 0.00 H new ATOM 0 HA ALA B 41 -1.390 -5.189 -1.935 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -1.733 -2.772 -2.423 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -1.787 -3.730 -3.921 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -3.297 -3.144 -3.185 1.00 0.00 H new ATOM 1914 N PRO B 42 -2.397 -4.070 0.164 1.00 0.00 N ATOM 1915 CA PRO B 42 -2.977 -3.752 1.502 1.00 0.00 C ATOM 1916 C PRO B 42 -3.910 -2.537 1.468 1.00 0.00 C ATOM 1917 O PRO B 42 -3.857 -1.714 0.575 1.00 0.00 O ATOM 1918 CB PRO B 42 -1.743 -3.486 2.381 1.00 0.00 C ATOM 1919 CG PRO B 42 -0.671 -3.061 1.427 1.00 0.00 C ATOM 1920 CD PRO B 42 -0.947 -3.802 0.121 1.00 0.00 C ATOM 0 HA PRO B 42 -3.603 -4.562 1.876 1.00 0.00 H new ATOM 0 HB2 PRO B 42 -1.944 -2.710 3.119 1.00 0.00 H new ATOM 0 HB3 PRO B 42 -1.450 -4.380 2.931 1.00 0.00 H new ATOM 0 HG2 PRO B 42 -0.691 -1.982 1.274 1.00 0.00 H new ATOM 0 HG3 PRO B 42 0.317 -3.310 1.815 1.00 0.00 H new ATOM 0 HD2 PRO B 42 -0.678 -3.198 -0.745 1.00 0.00 H new ATOM 0 HD3 PRO B 42 -0.372 -4.726 0.057 1.00 0.00 H new ATOM 1928 N VAL B 43 -4.763 -2.430 2.451 1.00 0.00 N ATOM 1929 CA VAL B 43 -5.715 -1.285 2.520 1.00 0.00 C ATOM 1930 C VAL B 43 -4.922 0.024 2.539 1.00 0.00 C ATOM 1931 O VAL B 43 -5.453 1.091 2.295 1.00 0.00 O ATOM 1932 CB VAL B 43 -6.560 -1.397 3.796 1.00 0.00 C ATOM 1933 CG1 VAL B 43 -7.597 -2.509 3.627 1.00 0.00 C ATOM 1934 CG2 VAL B 43 -5.659 -1.726 4.996 1.00 0.00 C ATOM 0 H VAL B 43 -4.841 -3.097 3.219 1.00 0.00 H new ATOM 0 HA VAL B 43 -6.374 -1.300 1.652 1.00 0.00 H new ATOM 0 HB VAL B 43 -7.063 -0.446 3.972 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -8.197 -2.588 4.534 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -8.245 -2.277 2.782 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -7.089 -3.456 3.445 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -6.267 -1.804 5.897 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -5.149 -2.673 4.819 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -4.920 -0.935 5.124 1.00 0.00 H new ATOM 1944 N VAL B 44 -3.655 -0.060 2.833 1.00 0.00 N ATOM 1945 CA VAL B 44 -2.793 1.159 2.880 1.00 0.00 C ATOM 1946 C VAL B 44 -2.780 1.833 1.505 1.00 0.00 C ATOM 1947 O VAL B 44 -2.877 3.040 1.388 1.00 0.00 O ATOM 1948 CB VAL B 44 -1.365 0.751 3.250 1.00 0.00 C ATOM 1949 CG1 VAL B 44 -0.456 1.980 3.210 1.00 0.00 C ATOM 1950 CG2 VAL B 44 -1.350 0.151 4.660 1.00 0.00 C ATOM 0 H VAL B 44 -3.171 -0.932 3.046 1.00 0.00 H new ATOM 0 HA VAL B 44 -3.187 1.853 3.623 1.00 0.00 H new ATOM 0 HB VAL B 44 -1.006 0.009 2.537 1.00 0.00 H new ATOM 0 HG11 VAL B 44 0.561 1.689 3.474 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -0.463 2.405 2.206 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -0.817 2.723 3.921 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -0.332 -0.139 4.921 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -1.711 0.891 5.374 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -1.996 -0.727 4.689 1.00 0.00 H new ATOM 1960 N VAL B 45 -2.646 1.053 0.468 1.00 0.00 N ATOM 1961 CA VAL B 45 -2.615 1.617 -0.914 1.00 0.00 C ATOM 1962 C VAL B 45 -3.946 2.311 -1.216 1.00 0.00 C ATOM 1963 O VAL B 45 -3.989 3.372 -1.807 1.00 0.00 O ATOM 1964 CB VAL B 45 -2.383 0.483 -1.918 1.00 0.00 C ATOM 1965 CG1 VAL B 45 -2.297 1.057 -3.334 1.00 0.00 C ATOM 1966 CG2 VAL B 45 -1.072 -0.238 -1.580 1.00 0.00 C ATOM 0 H VAL B 45 -2.556 0.038 0.518 1.00 0.00 H new ATOM 0 HA VAL B 45 -1.807 2.344 -0.994 1.00 0.00 H new ATOM 0 HB VAL B 45 -3.213 -0.222 -1.864 1.00 0.00 H new ATOM 0 HG11 VAL B 45 -2.132 0.248 -4.045 1.00 0.00 H new ATOM 0 HG12 VAL B 45 -3.228 1.569 -3.576 1.00 0.00 H new ATOM 0 HG13 VAL B 45 -1.469 1.764 -3.390 1.00 0.00 H new ATOM 0 HG21 VAL B 45 -0.906 -1.045 -2.294 1.00 0.00 H new ATOM 0 HG22 VAL B 45 -0.244 0.469 -1.633 1.00 0.00 H new ATOM 0 HG23 VAL B 45 -1.133 -0.651 -0.573 1.00 0.00 H new ATOM 1976 N LYS B 46 -5.033 1.706 -0.820 1.00 0.00 N ATOM 1977 CA LYS B 46 -6.378 2.305 -1.083 1.00 0.00 C ATOM 1978 C LYS B 46 -6.441 3.698 -0.455 1.00 0.00 C ATOM 1979 O LYS B 46 -6.971 4.628 -1.031 1.00 0.00 O ATOM 1980 CB LYS B 46 -7.453 1.424 -0.431 1.00 0.00 C ATOM 1981 CG LYS B 46 -7.358 -0.012 -0.961 1.00 0.00 C ATOM 1982 CD LYS B 46 -7.689 -0.037 -2.456 1.00 0.00 C ATOM 1983 CE LYS B 46 -8.012 -1.464 -2.892 1.00 0.00 C ATOM 1984 NZ LYS B 46 -8.372 -1.462 -4.339 1.00 0.00 N ATOM 0 H LYS B 46 -5.049 0.816 -0.322 1.00 0.00 H new ATOM 0 HA LYS B 46 -6.546 2.372 -2.158 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.329 1.428 0.652 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.442 1.831 -0.640 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -6.355 -0.405 -0.795 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -8.047 -0.657 -0.416 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -8.537 0.616 -2.661 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -6.846 0.346 -3.031 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -7.154 -2.113 -2.719 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -8.837 -1.861 -2.300 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -8.593 -2.432 -4.643 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -9.202 -0.854 -4.489 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -7.572 -1.099 -4.895 1.00 0.00 H new ATOM 1998 N TYR B 47 -5.904 3.838 0.722 1.00 0.00 N ATOM 1999 CA TYR B 47 -5.915 5.159 1.417 1.00 0.00 C ATOM 2000 C TYR B 47 -5.139 6.183 0.572 1.00 0.00 C ATOM 2001 O TYR B 47 -5.561 7.315 0.385 1.00 0.00 O ATOM 2002 CB TYR B 47 -5.242 5.002 2.783 1.00 0.00 C ATOM 2003 CG TYR B 47 -5.429 6.261 3.588 1.00 0.00 C ATOM 2004 CD1 TYR B 47 -4.526 7.320 3.456 1.00 0.00 C ATOM 2005 CD2 TYR B 47 -6.510 6.368 4.470 1.00 0.00 C ATOM 2006 CE1 TYR B 47 -4.708 8.488 4.207 1.00 0.00 C ATOM 2007 CE2 TYR B 47 -6.690 7.537 5.220 1.00 0.00 C ATOM 2008 CZ TYR B 47 -5.788 8.596 5.086 1.00 0.00 C ATOM 2009 OH TYR B 47 -5.965 9.749 5.823 1.00 0.00 O ATOM 0 H TYR B 47 -5.451 3.086 1.241 1.00 0.00 H new ATOM 0 HA TYR B 47 -6.940 5.505 1.549 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -5.670 4.152 3.315 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -4.180 4.795 2.654 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -3.690 7.238 2.777 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -7.206 5.549 4.572 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -4.012 9.307 4.106 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -7.524 7.620 5.901 1.00 0.00 H new ATOM 0 HH TYR B 47 -6.764 9.660 6.383 1.00 0.00 H new ATOM 2019 N ILE B 48 -4.008 5.778 0.060 1.00 0.00 N ATOM 2020 CA ILE B 48 -3.183 6.691 -0.782 1.00 0.00 C ATOM 2021 C ILE B 48 -3.957 7.065 -2.049 1.00 0.00 C ATOM 2022 O ILE B 48 -3.960 8.203 -2.479 1.00 0.00 O ATOM 2023 CB ILE B 48 -1.878 5.978 -1.169 1.00 0.00 C ATOM 2024 CG1 ILE B 48 -0.996 5.817 0.074 1.00 0.00 C ATOM 2025 CG2 ILE B 48 -1.131 6.792 -2.234 1.00 0.00 C ATOM 2026 CD1 ILE B 48 0.165 4.867 -0.234 1.00 0.00 C ATOM 0 H ILE B 48 -3.617 4.845 0.191 1.00 0.00 H new ATOM 0 HA ILE B 48 -2.955 7.597 -0.221 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.113 4.995 -1.577 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -0.611 6.788 0.386 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -1.587 5.427 0.903 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -0.207 6.279 -2.502 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -1.759 6.896 -3.119 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -0.896 7.780 -1.838 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.789 4.756 0.653 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.229 3.893 -0.525 1.00 0.00 H new ATOM 0 HD13 ILE B 48 0.762 5.275 -1.049 1.00 0.00 H new ATOM 2038 N ALA B 49 -4.599 6.104 -2.653 1.00 0.00 N ATOM 2039 CA ALA B 49 -5.370 6.370 -3.903 1.00 0.00 C ATOM 2040 C ALA B 49 -6.453 7.412 -3.625 1.00 0.00 C ATOM 2041 O ALA B 49 -6.769 8.233 -4.465 1.00 0.00 O ATOM 2042 CB ALA B 49 -6.030 5.073 -4.377 1.00 0.00 C ATOM 0 H ALA B 49 -4.623 5.136 -2.332 1.00 0.00 H new ATOM 0 HA ALA B 49 -4.694 6.743 -4.673 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -6.594 5.264 -5.290 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -5.262 4.325 -4.575 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -6.705 4.705 -3.604 1.00 0.00 H new ATOM 2048 N PHE B 50 -7.023 7.383 -2.453 1.00 0.00 N ATOM 2049 CA PHE B 50 -8.085 8.371 -2.116 1.00 0.00 C ATOM 2050 C PHE B 50 -7.487 9.776 -2.192 1.00 0.00 C ATOM 2051 O PHE B 50 -8.042 10.670 -2.802 1.00 0.00 O ATOM 2052 CB PHE B 50 -8.598 8.104 -0.693 1.00 0.00 C ATOM 2053 CG PHE B 50 -9.973 8.714 -0.525 1.00 0.00 C ATOM 2054 CD1 PHE B 50 -11.050 8.213 -1.267 1.00 0.00 C ATOM 2055 CD2 PHE B 50 -10.172 9.777 0.365 1.00 0.00 C ATOM 2056 CE1 PHE B 50 -12.324 8.775 -1.120 1.00 0.00 C ATOM 2057 CE2 PHE B 50 -11.446 10.338 0.512 1.00 0.00 C ATOM 2058 CZ PHE B 50 -12.521 9.837 -0.230 1.00 0.00 C ATOM 0 H PHE B 50 -6.799 6.717 -1.713 1.00 0.00 H new ATOM 0 HA PHE B 50 -8.915 8.283 -2.817 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -8.640 7.031 -0.506 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -7.909 8.528 0.038 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -10.898 7.393 -1.953 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -9.342 10.164 0.938 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -13.154 8.389 -1.693 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -11.599 11.158 1.198 1.00 0.00 H new ATOM 0 HZ PHE B 50 -13.504 10.270 -0.116 1.00 0.00 H new ATOM 2068 N LEU B 51 -6.350 9.967 -1.579 1.00 0.00 N ATOM 2069 CA LEU B 51 -5.690 11.307 -1.619 1.00 0.00 C ATOM 2070 C LEU B 51 -5.296 11.617 -3.061 1.00 0.00 C ATOM 2071 O LEU B 51 -5.404 12.737 -3.531 1.00 0.00 O ATOM 2072 CB LEU B 51 -4.433 11.293 -0.744 1.00 0.00 C ATOM 2073 CG LEU B 51 -4.821 11.131 0.733 1.00 0.00 C ATOM 2074 CD1 LEU B 51 -3.558 10.881 1.564 1.00 0.00 C ATOM 2075 CD2 LEU B 51 -5.526 12.401 1.245 1.00 0.00 C ATOM 0 H LEU B 51 -5.848 9.253 -1.051 1.00 0.00 H new ATOM 0 HA LEU B 51 -6.378 12.066 -1.245 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.778 10.477 -1.048 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.874 12.218 -0.882 1.00 0.00 H new ATOM 0 HG LEU B 51 -5.503 10.286 0.829 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -3.830 10.766 2.613 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -3.066 9.973 1.214 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -2.878 11.726 1.456 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -5.795 12.270 2.293 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.855 13.255 1.146 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.428 12.578 0.659 1.00 0.00 H new ATOM 2087 N ARG B 52 -4.829 10.623 -3.761 1.00 0.00 N ATOM 2088 CA ARG B 52 -4.411 10.817 -5.174 1.00 0.00 C ATOM 2089 C ARG B 52 -5.608 11.301 -5.996 1.00 0.00 C ATOM 2090 O ARG B 52 -5.487 12.164 -6.843 1.00 0.00 O ATOM 2091 CB ARG B 52 -3.895 9.479 -5.734 1.00 0.00 C ATOM 2092 CG ARG B 52 -2.904 9.731 -6.876 1.00 0.00 C ATOM 2093 CD ARG B 52 -3.636 10.361 -8.079 1.00 0.00 C ATOM 2094 NE ARG B 52 -2.993 9.906 -9.341 1.00 0.00 N ATOM 2095 CZ ARG B 52 -3.204 8.695 -9.790 1.00 0.00 C ATOM 2096 NH1 ARG B 52 -3.973 7.861 -9.137 1.00 0.00 N ATOM 2097 NH2 ARG B 52 -2.644 8.319 -10.905 1.00 0.00 N ATOM 0 H ARG B 52 -4.718 9.672 -3.409 1.00 0.00 H new ATOM 0 HA ARG B 52 -3.617 11.562 -5.228 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -3.411 8.907 -4.942 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -4.732 8.880 -6.094 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -2.107 10.393 -6.538 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -2.435 8.794 -7.175 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -4.688 10.075 -8.070 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -3.601 11.448 -8.011 1.00 0.00 H new ATOM 0 HE ARG B 52 -2.385 10.541 -9.859 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -4.417 8.152 -8.266 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -4.128 6.920 -9.499 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -2.047 8.967 -11.420 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -2.802 7.377 -11.263 1.00 0.00 H new ATOM 2111 N SER B 53 -6.761 10.744 -5.751 1.00 0.00 N ATOM 2112 CA SER B 53 -7.975 11.162 -6.509 1.00 0.00 C ATOM 2113 C SER B 53 -8.193 12.661 -6.310 1.00 0.00 C ATOM 2114 O SER B 53 -8.662 13.357 -7.191 1.00 0.00 O ATOM 2115 CB SER B 53 -9.195 10.395 -5.993 1.00 0.00 C ATOM 2116 OG SER B 53 -10.341 10.773 -6.745 1.00 0.00 O ATOM 0 H SER B 53 -6.916 10.014 -5.056 1.00 0.00 H new ATOM 0 HA SER B 53 -7.839 10.945 -7.568 1.00 0.00 H new ATOM 0 HB2 SER B 53 -9.027 9.321 -6.079 1.00 0.00 H new ATOM 0 HB3 SER B 53 -9.353 10.609 -4.936 1.00 0.00 H new ATOM 0 HG SER B 53 -11.124 10.282 -6.418 1.00 0.00 H new ATOM 2122 N LYS B 54 -7.848 13.157 -5.152 1.00 0.00 N ATOM 2123 CA LYS B 54 -8.019 14.610 -4.869 1.00 0.00 C ATOM 2124 C LYS B 54 -6.874 15.384 -5.522 1.00 0.00 C ATOM 2125 O LYS B 54 -6.787 16.593 -5.429 1.00 0.00 O ATOM 2126 CB LYS B 54 -8.006 14.827 -3.352 1.00 0.00 C ATOM 2127 CG LYS B 54 -9.278 14.230 -2.748 1.00 0.00 C ATOM 2128 CD LYS B 54 -9.287 14.452 -1.235 1.00 0.00 C ATOM 2129 CE LYS B 54 -10.601 13.926 -0.658 1.00 0.00 C ATOM 2130 NZ LYS B 54 -10.699 12.461 -0.903 1.00 0.00 N ATOM 0 H LYS B 54 -7.452 12.613 -4.385 1.00 0.00 H new ATOM 0 HA LYS B 54 -8.967 14.965 -5.274 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -7.126 14.358 -2.913 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -7.946 15.891 -3.125 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -10.157 14.692 -3.198 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -9.331 13.164 -2.969 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -8.443 13.939 -0.775 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -9.176 15.513 -1.010 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -10.649 14.131 0.412 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -11.445 14.440 -1.119 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -11.165 12.004 -0.093 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -11.256 12.290 -1.765 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -9.745 12.064 -1.023 1.00 0.00 H new ATOM 2144 N GLY B 55 -6.006 14.682 -6.198 1.00 0.00 N ATOM 2145 CA GLY B 55 -4.861 15.341 -6.894 1.00 0.00 C ATOM 2146 C GLY B 55 -3.932 15.998 -5.875 1.00 0.00 C ATOM 2147 O GLY B 55 -3.332 17.025 -6.137 1.00 0.00 O ATOM 0 H GLY B 55 -6.041 13.668 -6.300 1.00 0.00 H new ATOM 0 HA2 GLY B 55 -4.309 14.605 -7.479 1.00 0.00 H new ATOM 0 HA3 GLY B 55 -5.233 16.090 -7.593 1.00 0.00 H new ATOM 2151 N VAL B 56 -3.801 15.408 -4.719 1.00 0.00 N ATOM 2152 CA VAL B 56 -2.906 15.983 -3.672 1.00 0.00 C ATOM 2153 C VAL B 56 -1.464 15.954 -4.177 1.00 0.00 C ATOM 2154 O VAL B 56 -0.612 16.674 -3.694 1.00 0.00 O ATOM 2155 CB VAL B 56 -3.028 15.141 -2.396 1.00 0.00 C ATOM 2156 CG1 VAL B 56 -1.930 15.533 -1.403 1.00 0.00 C ATOM 2157 CG2 VAL B 56 -4.402 15.383 -1.762 1.00 0.00 C ATOM 0 H VAL B 56 -4.278 14.547 -4.452 1.00 0.00 H new ATOM 0 HA VAL B 56 -3.192 17.013 -3.456 1.00 0.00 H new ATOM 0 HB VAL B 56 -2.918 14.086 -2.648 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -2.024 14.930 -0.500 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -0.953 15.360 -1.854 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -2.030 16.588 -1.147 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -4.494 14.787 -0.854 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -4.508 16.439 -1.514 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -5.183 15.095 -2.466 1.00 0.00 H new ATOM 2167 N ASP B 57 -1.202 15.111 -5.136 1.00 0.00 N ATOM 2168 CA ASP B 57 0.170 14.986 -5.703 1.00 0.00 C ATOM 2169 C ASP B 57 1.041 14.206 -4.719 1.00 0.00 C ATOM 2170 O ASP B 57 2.179 14.548 -4.457 1.00 0.00 O ATOM 2171 CB ASP B 57 0.762 16.381 -5.970 1.00 0.00 C ATOM 2172 CG ASP B 57 1.828 16.295 -7.065 1.00 0.00 C ATOM 2173 OD1 ASP B 57 1.538 15.733 -8.108 1.00 0.00 O ATOM 2174 OD2 ASP B 57 2.920 16.795 -6.841 1.00 0.00 O ATOM 0 H ASP B 57 -1.894 14.492 -5.559 1.00 0.00 H new ATOM 0 HA ASP B 57 0.132 14.451 -6.652 1.00 0.00 H new ATOM 0 HB2 ASP B 57 -0.028 17.069 -6.273 1.00 0.00 H new ATOM 0 HB3 ASP B 57 1.200 16.781 -5.055 1.00 0.00 H new ATOM 2179 N LEU B 58 0.500 13.146 -4.179 1.00 0.00 N ATOM 2180 CA LEU B 58 1.259 12.311 -3.217 1.00 0.00 C ATOM 2181 C LEU B 58 2.469 11.689 -3.911 1.00 0.00 C ATOM 2182 O LEU B 58 3.546 11.611 -3.355 1.00 0.00 O ATOM 2183 CB LEU B 58 0.344 11.198 -2.699 1.00 0.00 C ATOM 2184 CG LEU B 58 1.136 10.252 -1.749 1.00 0.00 C ATOM 2185 CD1 LEU B 58 0.270 9.869 -0.537 1.00 0.00 C ATOM 2186 CD2 LEU B 58 1.562 8.975 -2.500 1.00 0.00 C ATOM 0 H LEU B 58 -0.449 12.823 -4.370 1.00 0.00 H new ATOM 0 HA LEU B 58 1.603 12.930 -2.388 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.504 11.631 -2.169 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -0.060 10.630 -3.537 1.00 0.00 H new ATOM 0 HG LEU B 58 2.026 10.778 -1.403 1.00 0.00 H new ATOM 0 HD11 LEU B 58 0.835 9.207 0.119 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -0.010 10.770 0.009 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -0.630 9.358 -0.880 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.115 8.323 -1.824 1.00 0.00 H new ATOM 0 HD22 LEU B 58 0.676 8.454 -2.863 1.00 0.00 H new ATOM 0 HD23 LEU B 58 2.197 9.244 -3.344 1.00 0.00 H new ATOM 2198 N ASN B 59 2.295 11.236 -5.123 1.00 0.00 N ATOM 2199 CA ASN B 59 3.427 10.603 -5.863 1.00 0.00 C ATOM 2200 C ASN B 59 4.692 11.442 -5.678 1.00 0.00 C ATOM 2201 O ASN B 59 5.775 10.925 -5.478 1.00 0.00 O ATOM 2202 CB ASN B 59 3.076 10.518 -7.355 1.00 0.00 C ATOM 2203 CG ASN B 59 2.762 11.915 -7.909 1.00 0.00 C ATOM 2204 OD1 ASN B 59 3.634 12.584 -8.432 1.00 0.00 O ATOM 2205 ND2 ASN B 59 1.545 12.381 -7.831 1.00 0.00 N ATOM 0 H ASN B 59 1.414 11.277 -5.636 1.00 0.00 H new ATOM 0 HA ASN B 59 3.601 9.600 -5.474 1.00 0.00 H new ATOM 0 HB2 ASN B 59 3.907 10.079 -7.907 1.00 0.00 H new ATOM 0 HB3 ASN B 59 2.217 9.862 -7.497 1.00 0.00 H new ATOM 0 HD21 ASN B 59 1.327 13.303 -8.208 1.00 0.00 H new ATOM 0 HD22 ASN B 59 0.812 11.823 -7.393 1.00 0.00 H new ATOM 2212 N ALA B 60 4.550 12.734 -5.723 1.00 0.00 N ATOM 2213 CA ALA B 60 5.721 13.636 -5.530 1.00 0.00 C ATOM 2214 C ALA B 60 6.113 13.644 -4.051 1.00 0.00 C ATOM 2215 O ALA B 60 7.276 13.756 -3.694 1.00 0.00 O ATOM 2216 CB ALA B 60 5.340 15.053 -5.963 1.00 0.00 C ATOM 0 H ALA B 60 3.664 13.211 -5.887 1.00 0.00 H new ATOM 0 HA ALA B 60 6.561 13.284 -6.128 1.00 0.00 H new ATOM 0 HB1 ALA B 60 6.193 15.718 -5.824 1.00 0.00 H new ATOM 0 HB2 ALA B 60 5.052 15.047 -7.014 1.00 0.00 H new ATOM 0 HB3 ALA B 60 4.503 15.405 -5.360 1.00 0.00 H new ATOM 2222 N LEU B 61 5.136 13.535 -3.192 1.00 0.00 N ATOM 2223 CA LEU B 61 5.404 13.549 -1.728 1.00 0.00 C ATOM 2224 C LEU B 61 6.322 12.383 -1.374 1.00 0.00 C ATOM 2225 O LEU B 61 7.226 12.511 -0.580 1.00 0.00 O ATOM 2226 CB LEU B 61 4.077 13.391 -0.973 1.00 0.00 C ATOM 2227 CG LEU B 61 4.311 13.501 0.539 1.00 0.00 C ATOM 2228 CD1 LEU B 61 4.786 14.921 0.893 1.00 0.00 C ATOM 2229 CD2 LEU B 61 3.007 13.189 1.286 1.00 0.00 C ATOM 0 H LEU B 61 4.153 13.436 -3.447 1.00 0.00 H new ATOM 0 HA LEU B 61 5.879 14.490 -1.449 1.00 0.00 H new ATOM 0 HB2 LEU B 61 3.373 14.158 -1.296 1.00 0.00 H new ATOM 0 HB3 LEU B 61 3.628 12.426 -1.210 1.00 0.00 H new ATOM 0 HG LEU B 61 5.077 12.785 0.836 1.00 0.00 H new ATOM 0 HD11 LEU B 61 4.950 14.992 1.968 1.00 0.00 H new ATOM 0 HD12 LEU B 61 5.717 15.134 0.369 1.00 0.00 H new ATOM 0 HD13 LEU B 61 4.027 15.644 0.593 1.00 0.00 H new ATOM 0 HD21 LEU B 61 3.175 13.268 2.360 1.00 0.00 H new ATOM 0 HD22 LEU B 61 2.237 13.900 0.986 1.00 0.00 H new ATOM 0 HD23 LEU B 61 2.681 12.178 1.043 1.00 0.00 H new ATOM 2241 N PHE B 62 6.079 11.244 -1.952 1.00 0.00 N ATOM 2242 CA PHE B 62 6.922 10.045 -1.664 1.00 0.00 C ATOM 2243 C PHE B 62 8.310 10.189 -2.302 1.00 0.00 C ATOM 2244 O PHE B 62 9.313 9.821 -1.721 1.00 0.00 O ATOM 2245 CB PHE B 62 6.252 8.801 -2.270 1.00 0.00 C ATOM 2246 CG PHE B 62 5.283 8.189 -1.287 1.00 0.00 C ATOM 2247 CD1 PHE B 62 4.363 8.995 -0.611 1.00 0.00 C ATOM 2248 CD2 PHE B 62 5.308 6.807 -1.057 1.00 0.00 C ATOM 2249 CE1 PHE B 62 3.468 8.419 0.298 1.00 0.00 C ATOM 2250 CE2 PHE B 62 4.416 6.234 -0.150 1.00 0.00 C ATOM 2251 CZ PHE B 62 3.495 7.038 0.528 1.00 0.00 C ATOM 0 H PHE B 62 5.325 11.086 -2.620 1.00 0.00 H new ATOM 0 HA PHE B 62 7.025 9.951 -0.583 1.00 0.00 H new ATOM 0 HB2 PHE B 62 5.727 9.073 -3.185 1.00 0.00 H new ATOM 0 HB3 PHE B 62 7.012 8.069 -2.544 1.00 0.00 H new ATOM 0 HD1 PHE B 62 4.343 10.060 -0.790 1.00 0.00 H new ATOM 0 HD2 PHE B 62 6.018 6.185 -1.582 1.00 0.00 H new ATOM 0 HE1 PHE B 62 2.756 9.040 0.822 1.00 0.00 H new ATOM 0 HE2 PHE B 62 4.437 5.169 0.028 1.00 0.00 H new ATOM 0 HZ PHE B 62 2.804 6.594 1.229 1.00 0.00 H new ATOM 2261 N ASP B 63 8.362 10.676 -3.509 1.00 0.00 N ATOM 2262 CA ASP B 63 9.668 10.791 -4.219 1.00 0.00 C ATOM 2263 C ASP B 63 10.680 11.516 -3.341 1.00 0.00 C ATOM 2264 O ASP B 63 11.832 11.126 -3.245 1.00 0.00 O ATOM 2265 CB ASP B 63 9.482 11.576 -5.517 1.00 0.00 C ATOM 2266 CG ASP B 63 10.839 11.767 -6.197 1.00 0.00 C ATOM 2267 OD1 ASP B 63 11.371 10.793 -6.702 1.00 0.00 O ATOM 2268 OD2 ASP B 63 11.325 12.887 -6.203 1.00 0.00 O ATOM 0 H ASP B 63 7.553 11.001 -4.038 1.00 0.00 H new ATOM 0 HA ASP B 63 10.034 9.789 -4.442 1.00 0.00 H new ATOM 0 HB2 ASP B 63 8.802 11.044 -6.182 1.00 0.00 H new ATOM 0 HB3 ASP B 63 9.029 12.545 -5.307 1.00 0.00 H new ATOM 2273 N ARG B 64 10.265 12.569 -2.709 1.00 0.00 N ATOM 2274 CA ARG B 64 11.196 13.341 -1.841 1.00 0.00 C ATOM 2275 C ARG B 64 11.669 12.468 -0.663 1.00 0.00 C ATOM 2276 O ARG B 64 12.521 12.859 0.110 1.00 0.00 O ATOM 2277 CB ARG B 64 10.473 14.605 -1.343 1.00 0.00 C ATOM 2278 CG ARG B 64 9.482 14.273 -0.190 1.00 0.00 C ATOM 2279 CD ARG B 64 10.050 14.778 1.139 1.00 0.00 C ATOM 2280 NE ARG B 64 10.178 16.267 1.096 1.00 0.00 N ATOM 2281 CZ ARG B 64 9.190 17.031 1.485 1.00 0.00 C ATOM 2282 NH1 ARG B 64 8.069 16.511 1.900 1.00 0.00 N ATOM 2283 NH2 ARG B 64 9.332 18.330 1.457 1.00 0.00 N ATOM 0 H ARG B 64 9.314 12.935 -2.754 1.00 0.00 H new ATOM 0 HA ARG B 64 12.079 13.637 -2.407 1.00 0.00 H new ATOM 0 HB2 ARG B 64 11.206 15.333 -0.997 1.00 0.00 H new ATOM 0 HB3 ARG B 64 9.932 15.066 -2.169 1.00 0.00 H new ATOM 0 HG2 ARG B 64 8.515 14.737 -0.383 1.00 0.00 H new ATOM 0 HG3 ARG B 64 9.314 13.197 -0.140 1.00 0.00 H new ATOM 0 HD2 ARG B 64 9.398 14.483 1.961 1.00 0.00 H new ATOM 0 HD3 ARG B 64 11.023 14.324 1.326 1.00 0.00 H new ATOM 0 HE ARG B 64 11.043 16.691 0.760 1.00 0.00 H new ATOM 0 HH11 ARG B 64 7.955 15.498 1.924 1.00 0.00 H new ATOM 0 HH12 ARG B 64 7.306 17.117 2.201 1.00 0.00 H new ATOM 0 HH21 ARG B 64 10.208 18.740 1.134 1.00 0.00 H new ATOM 0 HH22 ARG B 64 8.567 18.933 1.758 1.00 0.00 H new ATOM 2297 N ILE B 65 11.118 11.284 -0.529 1.00 0.00 N ATOM 2298 CA ILE B 65 11.532 10.372 0.591 1.00 0.00 C ATOM 2299 C ILE B 65 12.624 9.425 0.096 1.00 0.00 C ATOM 2300 O ILE B 65 13.683 9.323 0.683 1.00 0.00 O ATOM 2301 CB ILE B 65 10.331 9.537 1.043 1.00 0.00 C ATOM 2302 CG1 ILE B 65 9.138 10.461 1.311 1.00 0.00 C ATOM 2303 CG2 ILE B 65 10.688 8.772 2.319 1.00 0.00 C ATOM 2304 CD1 ILE B 65 9.515 11.528 2.341 1.00 0.00 C ATOM 0 H ILE B 65 10.399 10.908 -1.147 1.00 0.00 H new ATOM 0 HA ILE B 65 11.903 10.972 1.422 1.00 0.00 H new ATOM 0 HB ILE B 65 10.068 8.826 0.260 1.00 0.00 H new ATOM 0 HG12 ILE B 65 8.822 10.937 0.383 1.00 0.00 H new ATOM 0 HG13 ILE B 65 8.292 9.878 1.674 1.00 0.00 H new ATOM 0 HG21 ILE B 65 9.832 8.178 2.639 1.00 0.00 H new ATOM 0 HG22 ILE B 65 11.534 8.113 2.123 1.00 0.00 H new ATOM 0 HG23 ILE B 65 10.953 9.479 3.105 1.00 0.00 H new ATOM 0 HD11 ILE B 65 8.659 12.178 2.522 1.00 0.00 H new ATOM 0 HD12 ILE B 65 9.808 11.046 3.274 1.00 0.00 H new ATOM 0 HD13 ILE B 65 10.347 12.122 1.962 1.00 0.00 H new