USER MOD reduce.3.24.130724 H: found=0, std=0, add=1034, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1036 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 124 MET CE :methyl -161:sc= -1.1 (180deg=-1.95) USER MOD Set 1.2: A 144 MET CE :methyl -144:sc= -0.553 (180deg=-1.96!) USER MOD Set 2.1: A 58 ASN : amide:sc= -1.18 K(o=-1.4,f=-3) USER MOD Set 2.2: A 59 ASN : amide:sc= -0.266 K(o=-1.4,f=-2.5) USER MOD Set 3.1: A 36 MET CE :methyl -143:sc= -1.63 (180deg=-4.81!) USER MOD Set 3.2: A 75 GLN : amide:sc= -1.68 K(o=-3.3,f=-5.9!) USER MOD Set 4.1: A 5 THR OG1 : rot 73:sc= 0.0862 USER MOD Set 4.2: A 8 GLN : amide:sc= -4.35! C(o=-4.3!,f=-8.8!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -1.85! X(o=-1.9!,f=-1.5) USER MOD Single : A 21 LYS NZ :NH3+ 171:sc= -0.0307 (180deg=-0.194) USER MOD Single : A 24 THR OG1 : rot 36:sc= 1.08 USER MOD Single : A 26 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0695) USER MOD Single : A 29 THR OG1 : rot -150:sc= -0.96 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -1.7 K(o=-1.7,f=-11!) USER MOD Single : A 42 ASN :FLIP amide:sc= -0.147 F(o=-3.1!,f=-0.15) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN :FLIP amide:sc= -2.97! C(o=-6.3!,f=-3!) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 60 ASN :FLIP amide:sc= -0.139 F(o=-1.1,f=-0.14) USER MOD Single : A 62 GLN :FLIP amide:sc= -3.13 F(o=-6.9!,f=-3.1) USER MOD Single : A 64 ASN : amide:sc= -0.377 K(o=-0.38,f=-2.1) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -43:sc= 0.611 USER MOD Single : A 72 MET CE :methyl 157:sc= -2.56! (180deg=-4.15!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 174:sc= -3.16! (180deg=-3.41) USER MOD Single : A 90 LYS NZ :NH3+ -149:sc= -1.23 (180deg=-3.24!) USER MOD Single : A 101 SER OG : rot 180:sc= -1.25 USER MOD Single : A 109 MET CE :methyl -138:sc= -0.161 (180deg=-1.83!) USER MOD Single : A 111 ASN :FLIP amide:sc= -0.126 F(o=-1.2!,f=-0.13) USER MOD Single : A 115 LYS NZ :NH3+ -165:sc= -0.0541 (180deg=-0.3) USER MOD Single : A 117 THR OG1 : rot -170:sc= -0.216 USER MOD Single : A 135 MET CE :methyl 150:sc= -0.292 (180deg=-1.21!) USER MOD Single : A 137 ASN : amide:sc= -2.13! C(o=-2.1!,f=-12!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.771 USER MOD Single : A 146 SER OG : rot -33:sc= 0.604 USER MOD Single : A 147 GLN :FLIP amide:sc= -0.386 F(o=-1.8,f=-0.39) USER MOD Single : A 148 LYS NZ :NH3+ -168:sc= -0.0333 (180deg=-0.303) USER MOD ----------------------------------------------------------------- ATOM 46 N LEU A 4 6.453 -6.390 9.810 1.00 0.37 N ATOM 47 CA LEU A 4 5.909 -7.207 8.731 1.00 0.29 C ATOM 48 C LEU A 4 5.576 -8.618 9.208 1.00 0.32 C ATOM 49 O LEU A 4 5.653 -8.914 10.400 1.00 0.36 O ATOM 50 CB LEU A 4 6.899 -7.266 7.571 1.00 0.22 C ATOM 51 CG LEU A 4 7.266 -5.910 6.972 1.00 0.25 C ATOM 52 CD1 LEU A 4 8.501 -5.341 7.649 1.00 0.37 C ATOM 53 CD2 LEU A 4 7.488 -6.032 5.478 1.00 0.27 C ATOM 0 HA LEU A 4 4.982 -6.742 8.394 1.00 0.29 H new ATOM 0 HB2 LEU A 4 7.811 -7.754 7.915 1.00 0.22 H new ATOM 0 HB3 LEU A 4 6.479 -7.893 6.785 1.00 0.22 H new ATOM 0 HG LEU A 4 6.436 -5.225 7.143 1.00 0.25 H new ATOM 0 HD11 LEU A 4 8.745 -4.375 7.207 1.00 0.37 H new ATOM 0 HD12 LEU A 4 8.306 -5.214 8.714 1.00 0.37 H new ATOM 0 HD13 LEU A 4 9.339 -6.025 7.512 1.00 0.37 H new ATOM 0 HD21 LEU A 4 7.749 -5.056 5.068 1.00 0.27 H new ATOM 0 HD22 LEU A 4 8.299 -6.734 5.287 1.00 0.27 H new ATOM 0 HD23 LEU A 4 6.576 -6.393 5.003 1.00 0.27 H new ATOM 65 N THR A 5 5.203 -9.485 8.268 1.00 0.32 N ATOM 66 CA THR A 5 4.850 -10.862 8.600 1.00 0.37 C ATOM 67 C THR A 5 6.048 -11.789 8.442 1.00 0.37 C ATOM 68 O THR A 5 6.658 -12.205 9.427 1.00 0.39 O ATOM 69 CB THR A 5 3.699 -11.372 7.711 1.00 0.42 C ATOM 70 OG1 THR A 5 2.577 -10.486 7.805 1.00 0.91 O ATOM 71 CG2 THR A 5 3.277 -12.775 8.121 1.00 0.91 C ATOM 0 H THR A 5 5.138 -9.259 7.276 1.00 0.32 H new ATOM 0 HA THR A 5 4.527 -10.866 9.641 1.00 0.37 H new ATOM 0 HB THR A 5 4.053 -11.403 6.681 1.00 0.42 H new ATOM 0 HG1 THR A 5 2.772 -9.659 7.317 1.00 0.91 H new ATOM 0 HG21 THR A 5 2.463 -13.113 7.479 1.00 0.91 H new ATOM 0 HG22 THR A 5 4.124 -13.454 8.021 1.00 0.91 H new ATOM 0 HG23 THR A 5 2.941 -12.765 9.158 1.00 0.91 H new ATOM 79 N GLU A 6 6.380 -12.090 7.188 1.00 0.35 N ATOM 80 CA GLU A 6 7.500 -12.969 6.863 1.00 0.35 C ATOM 81 C GLU A 6 7.568 -13.191 5.360 1.00 0.34 C ATOM 82 O GLU A 6 8.652 -13.219 4.782 1.00 0.32 O ATOM 83 CB GLU A 6 7.381 -14.312 7.588 1.00 0.40 C ATOM 84 CG GLU A 6 8.601 -15.203 7.424 1.00 0.94 C ATOM 85 CD GLU A 6 8.489 -16.496 8.205 1.00 1.48 C ATOM 86 OE1 GLU A 6 8.879 -16.509 9.391 1.00 2.21 O ATOM 87 OE2 GLU A 6 8.012 -17.497 7.630 1.00 1.55 O ATOM 0 H GLU A 6 5.882 -11.733 6.372 1.00 0.35 H new ATOM 0 HA GLU A 6 8.418 -12.486 7.198 1.00 0.35 H new ATOM 0 HB2 GLU A 6 7.216 -14.129 8.650 1.00 0.40 H new ATOM 0 HB3 GLU A 6 6.503 -14.840 7.215 1.00 0.40 H new ATOM 0 HG2 GLU A 6 8.739 -15.432 6.367 1.00 0.94 H new ATOM 0 HG3 GLU A 6 9.488 -14.661 7.751 1.00 0.94 H new ATOM 94 N GLU A 7 6.408 -13.365 4.730 1.00 0.38 N ATOM 95 CA GLU A 7 6.359 -13.550 3.287 1.00 0.40 C ATOM 96 C GLU A 7 6.887 -12.295 2.606 1.00 0.35 C ATOM 97 O GLU A 7 7.768 -12.358 1.746 1.00 0.33 O ATOM 98 CB GLU A 7 4.929 -13.853 2.826 1.00 0.46 C ATOM 99 CG GLU A 7 3.890 -12.885 3.367 1.00 0.49 C ATOM 100 CD GLU A 7 2.484 -13.230 2.916 1.00 0.56 C ATOM 101 OE1 GLU A 7 1.821 -14.037 3.602 1.00 0.62 O ATOM 102 OE2 GLU A 7 2.047 -12.696 1.875 1.00 0.60 O ATOM 0 H GLU A 7 5.499 -13.381 5.193 1.00 0.38 H new ATOM 0 HA GLU A 7 6.983 -14.401 3.012 1.00 0.40 H new ATOM 0 HB2 GLU A 7 4.897 -13.834 1.737 1.00 0.46 H new ATOM 0 HB3 GLU A 7 4.665 -14.864 3.135 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.929 -12.886 4.456 1.00 0.49 H new ATOM 0 HG3 GLU A 7 4.135 -11.874 3.041 1.00 0.49 H new ATOM 109 N GLN A 8 6.341 -11.151 3.009 1.00 0.33 N ATOM 110 CA GLN A 8 6.768 -9.871 2.475 1.00 0.30 C ATOM 111 C GLN A 8 8.234 -9.652 2.809 1.00 0.24 C ATOM 112 O GLN A 8 8.992 -9.064 2.030 1.00 0.22 O ATOM 113 CB GLN A 8 5.919 -8.752 3.070 1.00 0.32 C ATOM 114 CG GLN A 8 5.744 -8.878 4.570 1.00 0.32 C ATOM 115 CD GLN A 8 4.685 -7.939 5.124 1.00 0.36 C ATOM 116 OE1 GLN A 8 4.027 -8.247 6.116 1.00 0.85 O ATOM 117 NE2 GLN A 8 4.509 -6.789 4.483 1.00 0.57 N ATOM 0 H GLN A 8 5.599 -11.089 3.707 1.00 0.33 H new ATOM 0 HA GLN A 8 6.642 -9.866 1.392 1.00 0.30 H new ATOM 0 HB2 GLN A 8 6.382 -7.792 2.843 1.00 0.32 H new ATOM 0 HB3 GLN A 8 4.939 -8.754 2.594 1.00 0.32 H new ATOM 0 HG2 GLN A 8 5.474 -9.906 4.814 1.00 0.32 H new ATOM 0 HG3 GLN A 8 6.696 -8.673 5.060 1.00 0.32 H new ATOM 0 HE21 GLN A 8 5.075 -6.570 3.663 1.00 0.57 H new ATOM 0 HE22 GLN A 8 3.808 -6.125 4.810 1.00 0.57 H new ATOM 126 N ILE A 9 8.624 -10.152 3.980 1.00 0.22 N ATOM 127 CA ILE A 9 9.995 -10.042 4.439 1.00 0.18 C ATOM 128 C ILE A 9 10.901 -10.786 3.483 1.00 0.17 C ATOM 129 O ILE A 9 11.973 -10.310 3.116 1.00 0.15 O ATOM 130 CB ILE A 9 10.172 -10.603 5.865 1.00 0.20 C ATOM 131 CG1 ILE A 9 9.300 -9.819 6.852 1.00 0.21 C ATOM 132 CG2 ILE A 9 11.638 -10.549 6.276 1.00 0.21 C ATOM 133 CD1 ILE A 9 9.405 -10.302 8.283 1.00 0.24 C ATOM 0 H ILE A 9 8.002 -10.638 4.626 1.00 0.22 H new ATOM 0 HA ILE A 9 10.258 -8.985 4.466 1.00 0.18 H new ATOM 0 HB ILE A 9 9.853 -11.645 5.877 1.00 0.20 H new ATOM 0 HG12 ILE A 9 9.581 -8.767 6.813 1.00 0.21 H new ATOM 0 HG13 ILE A 9 8.260 -9.883 6.533 1.00 0.21 H new ATOM 0 HG21 ILE A 9 11.748 -10.948 7.284 1.00 0.21 H new ATOM 0 HG22 ILE A 9 12.232 -11.145 5.583 1.00 0.21 H new ATOM 0 HG23 ILE A 9 11.984 -9.516 6.255 1.00 0.21 H new ATOM 0 HD11 ILE A 9 8.759 -9.697 8.919 1.00 0.24 H new ATOM 0 HD12 ILE A 9 9.095 -11.346 8.338 1.00 0.24 H new ATOM 0 HD13 ILE A 9 10.437 -10.211 8.623 1.00 0.24 H new ATOM 145 N ALA A 10 10.440 -11.960 3.081 1.00 0.20 N ATOM 146 CA ALA A 10 11.175 -12.799 2.151 1.00 0.21 C ATOM 147 C ALA A 10 11.232 -12.139 0.784 1.00 0.20 C ATOM 148 O ALA A 10 12.092 -12.449 -0.038 1.00 0.19 O ATOM 149 CB ALA A 10 10.515 -14.165 2.046 1.00 0.26 C ATOM 0 H ALA A 10 9.551 -12.355 3.389 1.00 0.20 H new ATOM 0 HA ALA A 10 12.192 -12.927 2.521 1.00 0.21 H new ATOM 0 HB1 ALA A 10 11.074 -14.786 1.346 1.00 0.26 H new ATOM 0 HB2 ALA A 10 10.506 -14.641 3.027 1.00 0.26 H new ATOM 0 HB3 ALA A 10 9.491 -14.048 1.690 1.00 0.26 H new ATOM 155 N GLU A 11 10.294 -11.226 0.553 1.00 0.20 N ATOM 156 CA GLU A 11 10.215 -10.512 -0.718 1.00 0.21 C ATOM 157 C GLU A 11 11.387 -9.562 -0.895 1.00 0.18 C ATOM 158 O GLU A 11 12.293 -9.842 -1.676 1.00 0.18 O ATOM 159 CB GLU A 11 8.916 -9.722 -0.823 1.00 0.25 C ATOM 160 CG GLU A 11 8.412 -9.561 -2.249 1.00 0.29 C ATOM 161 CD GLU A 11 8.104 -10.888 -2.914 1.00 0.94 C ATOM 162 OE1 GLU A 11 6.989 -11.412 -2.707 1.00 0.84 O ATOM 163 OE2 GLU A 11 8.978 -11.404 -3.643 1.00 1.78 O ATOM 0 H GLU A 11 9.577 -10.963 1.229 1.00 0.20 H new ATOM 0 HA GLU A 11 10.246 -11.265 -1.506 1.00 0.21 H new ATOM 0 HB2 GLU A 11 8.149 -10.220 -0.230 1.00 0.25 H new ATOM 0 HB3 GLU A 11 9.065 -8.735 -0.386 1.00 0.25 H new ATOM 0 HG2 GLU A 11 7.513 -8.944 -2.245 1.00 0.29 H new ATOM 0 HG3 GLU A 11 9.161 -9.030 -2.837 1.00 0.29 H new ATOM 170 N PHE A 12 11.384 -8.430 -0.178 1.00 0.17 N ATOM 171 CA PHE A 12 12.487 -7.485 -0.332 1.00 0.17 C ATOM 172 C PHE A 12 13.799 -8.174 -0.015 1.00 0.14 C ATOM 173 O PHE A 12 14.863 -7.748 -0.462 1.00 0.15 O ATOM 174 CB PHE A 12 12.309 -6.214 0.504 1.00 0.20 C ATOM 175 CG PHE A 12 11.869 -6.420 1.920 1.00 0.18 C ATOM 176 CD1 PHE A 12 10.528 -6.544 2.221 1.00 0.24 C ATOM 177 CD2 PHE A 12 12.792 -6.455 2.951 1.00 0.21 C ATOM 178 CE1 PHE A 12 10.111 -6.705 3.522 1.00 0.26 C ATOM 179 CE2 PHE A 12 12.380 -6.610 4.261 1.00 0.23 C ATOM 180 CZ PHE A 12 11.036 -6.736 4.546 1.00 0.21 C ATOM 0 H PHE A 12 10.660 -8.157 0.487 1.00 0.17 H new ATOM 0 HA PHE A 12 12.494 -7.157 -1.371 1.00 0.17 H new ATOM 0 HB2 PHE A 12 13.255 -5.673 0.513 1.00 0.20 H new ATOM 0 HB3 PHE A 12 11.580 -5.574 0.007 1.00 0.20 H new ATOM 0 HD1 PHE A 12 9.798 -6.514 1.426 1.00 0.24 H new ATOM 0 HD2 PHE A 12 13.845 -6.360 2.729 1.00 0.21 H new ATOM 0 HE1 PHE A 12 9.059 -6.807 3.742 1.00 0.26 H new ATOM 0 HE2 PHE A 12 13.108 -6.632 5.059 1.00 0.23 H new ATOM 0 HZ PHE A 12 10.708 -6.859 5.568 1.00 0.21 H new ATOM 190 N LYS A 13 13.712 -9.239 0.768 1.00 0.12 N ATOM 191 CA LYS A 13 14.881 -10.031 1.093 1.00 0.12 C ATOM 192 C LYS A 13 15.425 -10.647 -0.184 1.00 0.13 C ATOM 193 O LYS A 13 16.607 -10.520 -0.495 1.00 0.16 O ATOM 194 CB LYS A 13 14.522 -11.132 2.093 1.00 0.14 C ATOM 195 CG LYS A 13 15.594 -12.199 2.240 1.00 0.24 C ATOM 196 CD LYS A 13 16.812 -11.666 2.975 1.00 1.07 C ATOM 197 CE LYS A 13 17.963 -12.658 2.942 1.00 1.30 C ATOM 198 NZ LYS A 13 19.156 -12.147 3.673 1.00 2.27 N ATOM 0 H LYS A 13 12.844 -9.572 1.188 1.00 0.12 H new ATOM 0 HA LYS A 13 15.637 -9.391 1.548 1.00 0.12 H new ATOM 0 HB2 LYS A 13 14.337 -10.679 3.067 1.00 0.14 H new ATOM 0 HB3 LYS A 13 13.592 -11.605 1.780 1.00 0.14 H new ATOM 0 HG2 LYS A 13 15.187 -13.054 2.780 1.00 0.24 H new ATOM 0 HG3 LYS A 13 15.890 -12.557 1.254 1.00 0.24 H new ATOM 0 HD2 LYS A 13 17.128 -10.726 2.523 1.00 1.07 H new ATOM 0 HD3 LYS A 13 16.547 -11.449 4.010 1.00 1.07 H new ATOM 0 HE2 LYS A 13 17.642 -13.601 3.384 1.00 1.30 H new ATOM 0 HE3 LYS A 13 18.233 -12.867 1.907 1.00 1.30 H new ATOM 0 HZ1 LYS A 13 19.919 -12.852 3.628 1.00 2.27 H new ATOM 0 HZ2 LYS A 13 19.478 -11.260 3.236 1.00 2.27 H new ATOM 0 HZ3 LYS A 13 18.905 -11.972 4.667 1.00 2.27 H new ATOM 212 N ASP A 14 14.534 -11.295 -0.930 1.00 0.14 N ATOM 213 CA ASP A 14 14.900 -11.933 -2.184 1.00 0.16 C ATOM 214 C ASP A 14 15.311 -10.886 -3.213 1.00 0.16 C ATOM 215 O ASP A 14 16.199 -11.125 -4.028 1.00 0.17 O ATOM 216 CB ASP A 14 13.738 -12.786 -2.716 1.00 0.19 C ATOM 217 CG ASP A 14 12.766 -12.007 -3.584 1.00 0.20 C ATOM 218 OD1 ASP A 14 13.151 -11.623 -4.706 1.00 0.22 O ATOM 219 OD2 ASP A 14 11.624 -11.770 -3.135 1.00 0.22 O ATOM 0 H ASP A 14 13.549 -11.390 -0.683 1.00 0.14 H new ATOM 0 HA ASP A 14 15.750 -12.590 -2.001 1.00 0.16 H new ATOM 0 HB2 ASP A 14 14.142 -13.618 -3.293 1.00 0.19 H new ATOM 0 HB3 ASP A 14 13.197 -13.216 -1.873 1.00 0.19 H new ATOM 224 N ALA A 15 14.660 -9.722 -3.166 1.00 0.16 N ATOM 225 CA ALA A 15 14.968 -8.642 -4.095 1.00 0.17 C ATOM 226 C ALA A 15 16.360 -8.082 -3.828 1.00 0.16 C ATOM 227 O ALA A 15 17.080 -7.692 -4.745 1.00 0.20 O ATOM 228 CB ALA A 15 13.925 -7.540 -3.987 1.00 0.20 C ATOM 0 H ALA A 15 13.921 -9.507 -2.497 1.00 0.16 H new ATOM 0 HA ALA A 15 14.949 -9.044 -5.108 1.00 0.17 H new ATOM 0 HB1 ALA A 15 14.167 -6.740 -4.686 1.00 0.20 H new ATOM 0 HB2 ALA A 15 12.942 -7.945 -4.226 1.00 0.20 H new ATOM 0 HB3 ALA A 15 13.918 -7.144 -2.971 1.00 0.20 H new ATOM 234 N PHE A 16 16.713 -8.018 -2.556 1.00 0.14 N ATOM 235 CA PHE A 16 18.010 -7.512 -2.136 1.00 0.14 C ATOM 236 C PHE A 16 19.172 -8.352 -2.679 1.00 0.14 C ATOM 237 O PHE A 16 20.077 -7.832 -3.331 1.00 0.15 O ATOM 238 CB PHE A 16 18.069 -7.503 -0.610 1.00 0.15 C ATOM 239 CG PHE A 16 19.095 -6.562 -0.063 1.00 0.25 C ATOM 240 CD1 PHE A 16 18.762 -5.248 0.213 1.00 0.35 C ATOM 241 CD2 PHE A 16 20.388 -6.990 0.175 1.00 0.45 C ATOM 242 CE1 PHE A 16 19.704 -4.373 0.717 1.00 0.50 C ATOM 243 CE2 PHE A 16 21.336 -6.121 0.679 1.00 0.59 C ATOM 244 CZ PHE A 16 20.994 -4.810 0.950 1.00 0.59 C ATOM 0 H PHE A 16 16.112 -8.314 -1.787 1.00 0.14 H new ATOM 0 HA PHE A 16 18.118 -6.505 -2.539 1.00 0.14 H new ATOM 0 HB2 PHE A 16 17.090 -7.230 -0.217 1.00 0.15 H new ATOM 0 HB3 PHE A 16 18.285 -8.511 -0.256 1.00 0.15 H new ATOM 0 HD1 PHE A 16 17.755 -4.903 0.032 1.00 0.35 H new ATOM 0 HD2 PHE A 16 20.659 -8.014 -0.035 1.00 0.45 H new ATOM 0 HE1 PHE A 16 19.433 -3.349 0.929 1.00 0.50 H new ATOM 0 HE2 PHE A 16 22.343 -6.466 0.861 1.00 0.59 H new ATOM 0 HZ PHE A 16 21.734 -4.128 1.343 1.00 0.59 H new ATOM 254 N VAL A 17 19.129 -9.654 -2.398 1.00 0.16 N ATOM 255 CA VAL A 17 20.192 -10.580 -2.805 1.00 0.18 C ATOM 256 C VAL A 17 20.363 -10.637 -4.312 1.00 0.16 C ATOM 257 O VAL A 17 21.480 -10.621 -4.826 1.00 0.15 O ATOM 258 CB VAL A 17 19.922 -12.018 -2.291 1.00 0.22 C ATOM 259 CG1 VAL A 17 19.020 -11.994 -1.076 1.00 0.31 C ATOM 260 CG2 VAL A 17 19.309 -12.902 -3.372 1.00 0.28 C ATOM 0 H VAL A 17 18.365 -10.096 -1.887 1.00 0.16 H new ATOM 0 HA VAL A 17 21.107 -10.191 -2.358 1.00 0.18 H new ATOM 0 HB VAL A 17 20.886 -12.443 -2.013 1.00 0.22 H new ATOM 0 HG11 VAL A 17 18.844 -13.014 -0.733 1.00 0.31 H new ATOM 0 HG12 VAL A 17 19.496 -11.421 -0.281 1.00 0.31 H new ATOM 0 HG13 VAL A 17 18.069 -11.531 -1.338 1.00 0.31 H new ATOM 0 HG21 VAL A 17 19.136 -13.900 -2.971 1.00 0.28 H new ATOM 0 HG22 VAL A 17 18.362 -12.473 -3.699 1.00 0.28 H new ATOM 0 HG23 VAL A 17 19.991 -12.965 -4.220 1.00 0.28 H new ATOM 270 N GLN A 18 19.243 -10.688 -5.007 1.00 0.17 N ATOM 271 CA GLN A 18 19.242 -10.801 -6.446 1.00 0.18 C ATOM 272 C GLN A 18 19.933 -9.604 -7.087 1.00 0.15 C ATOM 273 O GLN A 18 20.271 -9.626 -8.271 1.00 0.18 O ATOM 274 CB GLN A 18 17.815 -10.957 -6.939 1.00 0.23 C ATOM 275 CG GLN A 18 16.945 -9.766 -6.638 1.00 0.19 C ATOM 276 CD GLN A 18 15.663 -9.767 -7.436 1.00 0.39 C ATOM 277 OE1 GLN A 18 15.595 -9.209 -8.531 1.00 1.02 O ATOM 278 NE2 GLN A 18 14.638 -10.402 -6.891 1.00 0.42 N ATOM 0 H GLN A 18 18.313 -10.652 -4.589 1.00 0.17 H new ATOM 0 HA GLN A 18 19.807 -11.686 -6.738 1.00 0.18 H new ATOM 0 HB2 GLN A 18 17.827 -11.126 -8.016 1.00 0.23 H new ATOM 0 HB3 GLN A 18 17.375 -11.844 -6.482 1.00 0.23 H new ATOM 0 HG2 GLN A 18 16.707 -9.754 -5.574 1.00 0.19 H new ATOM 0 HG3 GLN A 18 17.500 -8.852 -6.850 1.00 0.19 H new ATOM 0 HE21 GLN A 18 14.741 -10.850 -5.981 1.00 0.42 H new ATOM 0 HE22 GLN A 18 13.745 -10.443 -7.381 1.00 0.42 H new ATOM 287 N PHE A 19 20.139 -8.559 -6.292 1.00 0.12 N ATOM 288 CA PHE A 19 20.811 -7.357 -6.764 1.00 0.15 C ATOM 289 C PHE A 19 22.286 -7.362 -6.364 1.00 0.18 C ATOM 290 O PHE A 19 23.127 -6.798 -7.063 1.00 0.26 O ATOM 291 CB PHE A 19 20.121 -6.109 -6.210 1.00 0.16 C ATOM 292 CG PHE A 19 19.031 -5.584 -7.103 1.00 0.18 C ATOM 293 CD1 PHE A 19 17.894 -6.337 -7.346 1.00 0.26 C ATOM 294 CD2 PHE A 19 19.142 -4.337 -7.690 1.00 0.23 C ATOM 295 CE1 PHE A 19 16.887 -5.852 -8.161 1.00 0.28 C ATOM 296 CE2 PHE A 19 18.140 -3.846 -8.505 1.00 0.25 C ATOM 297 CZ PHE A 19 17.021 -4.624 -8.764 1.00 0.24 C ATOM 0 H PHE A 19 19.849 -8.522 -5.315 1.00 0.12 H new ATOM 0 HA PHE A 19 20.751 -7.342 -7.852 1.00 0.15 H new ATOM 0 HB2 PHE A 19 19.700 -6.340 -5.232 1.00 0.16 H new ATOM 0 HB3 PHE A 19 20.866 -5.327 -6.060 1.00 0.16 H new ATOM 0 HD1 PHE A 19 17.793 -7.313 -6.894 1.00 0.26 H new ATOM 0 HD2 PHE A 19 20.023 -3.739 -7.509 1.00 0.23 H new ATOM 0 HE1 PHE A 19 15.995 -6.439 -8.324 1.00 0.28 H new ATOM 0 HE2 PHE A 19 18.228 -2.861 -8.939 1.00 0.25 H new ATOM 0 HZ PHE A 19 16.257 -4.266 -9.438 1.00 0.24 H new ATOM 307 N ASP A 20 22.595 -8.002 -5.235 1.00 0.15 N ATOM 308 CA ASP A 20 23.971 -8.068 -4.751 1.00 0.19 C ATOM 309 C ASP A 20 24.697 -9.313 -5.258 1.00 0.27 C ATOM 310 O ASP A 20 25.409 -9.259 -6.260 1.00 0.37 O ATOM 311 CB ASP A 20 24.003 -8.046 -3.221 1.00 0.20 C ATOM 312 CG ASP A 20 25.373 -8.397 -2.673 1.00 0.29 C ATOM 313 OD1 ASP A 20 26.358 -7.744 -3.075 1.00 0.34 O ATOM 314 OD2 ASP A 20 25.457 -9.322 -1.838 1.00 0.40 O ATOM 0 H ASP A 20 21.914 -8.479 -4.643 1.00 0.15 H new ATOM 0 HA ASP A 20 24.489 -7.192 -5.141 1.00 0.19 H new ATOM 0 HB2 ASP A 20 23.714 -7.056 -2.867 1.00 0.20 H new ATOM 0 HB3 ASP A 20 23.267 -8.750 -2.833 1.00 0.20 H new ATOM 319 N LYS A 21 24.489 -10.434 -4.568 1.00 0.35 N ATOM 320 CA LYS A 21 25.139 -11.697 -4.919 1.00 0.45 C ATOM 321 C LYS A 21 26.619 -11.486 -5.238 1.00 0.46 C ATOM 322 O LYS A 21 27.068 -11.723 -6.359 1.00 0.84 O ATOM 323 CB LYS A 21 24.429 -12.368 -6.096 1.00 0.53 C ATOM 324 CG LYS A 21 23.137 -13.068 -5.706 1.00 0.61 C ATOM 325 CD LYS A 21 23.407 -14.322 -4.890 1.00 0.69 C ATOM 326 CE LYS A 21 22.119 -14.934 -4.366 1.00 0.83 C ATOM 327 NZ LYS A 21 21.163 -15.244 -5.464 1.00 1.65 N ATOM 0 H LYS A 21 23.872 -10.493 -3.758 1.00 0.35 H new ATOM 0 HA LYS A 21 25.069 -12.356 -4.054 1.00 0.45 H new ATOM 0 HB2 LYS A 21 24.211 -11.616 -6.855 1.00 0.53 H new ATOM 0 HB3 LYS A 21 25.103 -13.094 -6.551 1.00 0.53 H new ATOM 0 HG2 LYS A 21 22.512 -12.386 -5.130 1.00 0.61 H new ATOM 0 HG3 LYS A 21 22.579 -13.331 -6.605 1.00 0.61 H new ATOM 0 HD2 LYS A 21 23.933 -15.051 -5.506 1.00 0.69 H new ATOM 0 HD3 LYS A 21 24.062 -14.079 -4.053 1.00 0.69 H new ATOM 0 HE2 LYS A 21 22.349 -15.847 -3.816 1.00 0.83 H new ATOM 0 HE3 LYS A 21 21.651 -14.247 -3.661 1.00 0.83 H new ATOM 0 HZ1 LYS A 21 20.367 -15.796 -5.086 1.00 1.65 H new ATOM 0 HZ2 LYS A 21 20.806 -14.357 -5.874 1.00 1.65 H new ATOM 0 HZ3 LYS A 21 21.647 -15.796 -6.201 1.00 1.65 H new ATOM 341 N GLU A 22 27.369 -11.039 -4.231 1.00 0.42 N ATOM 342 CA GLU A 22 28.804 -10.798 -4.373 1.00 0.47 C ATOM 343 C GLU A 22 29.529 -11.027 -3.048 1.00 0.45 C ATOM 344 O GLU A 22 30.753 -10.909 -2.972 1.00 0.53 O ATOM 345 CB GLU A 22 29.075 -9.371 -4.857 1.00 0.46 C ATOM 346 CG GLU A 22 28.573 -9.090 -6.263 1.00 0.66 C ATOM 347 CD GLU A 22 28.747 -7.639 -6.666 1.00 1.52 C ATOM 348 OE1 GLU A 22 27.853 -6.825 -6.354 1.00 2.47 O ATOM 349 OE2 GLU A 22 29.778 -7.316 -7.293 1.00 1.49 O ATOM 0 H GLU A 22 27.002 -10.835 -3.301 1.00 0.42 H new ATOM 0 HA GLU A 22 29.181 -11.503 -5.114 1.00 0.47 H new ATOM 0 HB2 GLU A 22 28.606 -8.669 -4.168 1.00 0.46 H new ATOM 0 HB3 GLU A 22 30.148 -9.184 -4.821 1.00 0.46 H new ATOM 0 HG2 GLU A 22 29.107 -9.726 -6.969 1.00 0.66 H new ATOM 0 HG3 GLU A 22 27.518 -9.357 -6.328 1.00 0.66 H new ATOM 356 N GLY A 23 28.769 -11.354 -2.006 1.00 0.48 N ATOM 357 CA GLY A 23 29.360 -11.584 -0.700 1.00 0.51 C ATOM 358 C GLY A 23 29.291 -10.354 0.184 1.00 0.45 C ATOM 359 O GLY A 23 29.929 -10.298 1.235 1.00 0.72 O ATOM 0 H GLY A 23 27.756 -11.464 -2.043 1.00 0.48 H new ATOM 0 HA2 GLY A 23 28.845 -12.411 -0.210 1.00 0.51 H new ATOM 0 HA3 GLY A 23 30.401 -11.884 -0.822 1.00 0.51 H new ATOM 363 N THR A 24 28.512 -9.367 -0.248 1.00 0.33 N ATOM 364 CA THR A 24 28.353 -8.125 0.500 1.00 0.33 C ATOM 365 C THR A 24 26.910 -7.635 0.419 1.00 0.27 C ATOM 366 O THR A 24 26.509 -7.038 -0.575 1.00 0.25 O ATOM 367 CB THR A 24 29.291 -7.021 -0.031 1.00 0.43 C ATOM 368 OG1 THR A 24 28.884 -6.617 -1.344 1.00 0.52 O ATOM 369 CG2 THR A 24 30.732 -7.507 -0.079 1.00 0.44 C ATOM 0 H THR A 24 27.979 -9.404 -1.117 1.00 0.33 H new ATOM 0 HA THR A 24 28.614 -8.336 1.537 1.00 0.33 H new ATOM 0 HB THR A 24 29.229 -6.172 0.650 1.00 0.43 H new ATOM 0 HG1 THR A 24 27.906 -6.634 -1.403 1.00 0.52 H new ATOM 0 HG21 THR A 24 31.372 -6.710 -0.457 1.00 0.44 H new ATOM 0 HG22 THR A 24 31.055 -7.788 0.924 1.00 0.44 H new ATOM 0 HG23 THR A 24 30.802 -8.372 -0.738 1.00 0.44 H new ATOM 377 N GLY A 25 26.137 -7.898 1.470 1.00 0.27 N ATOM 378 CA GLY A 25 24.740 -7.492 1.492 1.00 0.24 C ATOM 379 C GLY A 25 24.543 -5.991 1.573 1.00 0.20 C ATOM 380 O GLY A 25 24.056 -5.478 2.582 1.00 0.21 O ATOM 0 H GLY A 25 26.453 -8.386 2.308 1.00 0.27 H new ATOM 0 HA2 GLY A 25 24.248 -7.866 0.594 1.00 0.24 H new ATOM 0 HA3 GLY A 25 24.248 -7.961 2.344 1.00 0.24 H new ATOM 384 N LYS A 26 24.916 -5.287 0.512 1.00 0.16 N ATOM 385 CA LYS A 26 24.758 -3.839 0.455 1.00 0.14 C ATOM 386 C LYS A 26 24.616 -3.395 -0.995 1.00 0.14 C ATOM 387 O LYS A 26 25.562 -3.483 -1.776 1.00 0.17 O ATOM 388 CB LYS A 26 25.938 -3.104 1.101 1.00 0.17 C ATOM 389 CG LYS A 26 26.627 -3.867 2.220 1.00 0.37 C ATOM 390 CD LYS A 26 27.959 -3.231 2.585 1.00 0.50 C ATOM 391 CE LYS A 26 28.536 -3.837 3.854 1.00 0.56 C ATOM 392 NZ LYS A 26 28.716 -5.311 3.737 1.00 1.37 N ATOM 0 H LYS A 26 25.332 -5.697 -0.324 1.00 0.16 H new ATOM 0 HA LYS A 26 23.860 -3.585 1.017 1.00 0.14 H new ATOM 0 HB2 LYS A 26 26.673 -2.876 0.329 1.00 0.17 H new ATOM 0 HB3 LYS A 26 25.583 -2.151 1.494 1.00 0.17 H new ATOM 0 HG2 LYS A 26 25.981 -3.892 3.098 1.00 0.37 H new ATOM 0 HG3 LYS A 26 26.787 -4.901 1.913 1.00 0.37 H new ATOM 0 HD2 LYS A 26 28.664 -3.363 1.764 1.00 0.50 H new ATOM 0 HD3 LYS A 26 27.826 -2.158 2.721 1.00 0.50 H new ATOM 0 HE2 LYS A 26 29.496 -3.371 4.074 1.00 0.56 H new ATOM 0 HE3 LYS A 26 27.876 -3.618 4.693 1.00 0.56 H new ATOM 0 HZ1 LYS A 26 29.234 -5.664 4.567 1.00 1.37 H new ATOM 0 HZ2 LYS A 26 27.785 -5.772 3.688 1.00 1.37 H new ATOM 0 HZ3 LYS A 26 29.255 -5.528 2.874 1.00 1.37 H new ATOM 406 N ILE A 27 23.431 -2.915 -1.344 1.00 0.16 N ATOM 407 CA ILE A 27 23.163 -2.462 -2.707 1.00 0.19 C ATOM 408 C ILE A 27 23.284 -0.947 -2.822 1.00 0.19 C ATOM 409 O ILE A 27 23.032 -0.221 -1.866 1.00 0.22 O ATOM 410 CB ILE A 27 21.761 -2.884 -3.180 1.00 0.23 C ATOM 411 CG1 ILE A 27 20.711 -2.487 -2.143 1.00 0.28 C ATOM 412 CG2 ILE A 27 21.716 -4.382 -3.444 1.00 0.32 C ATOM 413 CD1 ILE A 27 19.337 -2.259 -2.731 1.00 0.34 C ATOM 0 H ILE A 27 22.640 -2.828 -0.706 1.00 0.16 H new ATOM 0 HA ILE A 27 23.912 -2.935 -3.342 1.00 0.19 H new ATOM 0 HB ILE A 27 21.538 -2.367 -4.113 1.00 0.23 H new ATOM 0 HG12 ILE A 27 20.648 -3.267 -1.385 1.00 0.28 H new ATOM 0 HG13 ILE A 27 21.037 -1.578 -1.638 1.00 0.28 H new ATOM 0 HG21 ILE A 27 20.717 -4.663 -3.778 1.00 0.32 H new ATOM 0 HG22 ILE A 27 22.442 -4.637 -4.216 1.00 0.32 H new ATOM 0 HG23 ILE A 27 21.957 -4.920 -2.527 1.00 0.32 H new ATOM 0 HD11 ILE A 27 18.643 -1.981 -1.938 1.00 0.34 H new ATOM 0 HD12 ILE A 27 19.385 -1.458 -3.469 1.00 0.34 H new ATOM 0 HD13 ILE A 27 18.990 -3.174 -3.211 1.00 0.34 H new ATOM 425 N ALA A 28 23.655 -0.478 -4.008 1.00 0.19 N ATOM 426 CA ALA A 28 23.813 0.951 -4.255 1.00 0.21 C ATOM 427 C ALA A 28 22.467 1.665 -4.200 1.00 0.20 C ATOM 428 O ALA A 28 21.491 1.228 -4.810 1.00 0.20 O ATOM 429 CB ALA A 28 24.486 1.186 -5.600 1.00 0.23 C ATOM 0 H ALA A 28 23.853 -1.068 -4.816 1.00 0.19 H new ATOM 0 HA ALA A 28 24.448 1.364 -3.471 1.00 0.21 H new ATOM 0 HB1 ALA A 28 24.597 2.257 -5.769 1.00 0.23 H new ATOM 0 HB2 ALA A 28 25.469 0.715 -5.602 1.00 0.23 H new ATOM 0 HB3 ALA A 28 23.875 0.755 -6.393 1.00 0.23 H new ATOM 435 N THR A 29 22.432 2.767 -3.453 1.00 0.21 N ATOM 436 CA THR A 29 21.218 3.559 -3.285 1.00 0.22 C ATOM 437 C THR A 29 20.639 4.013 -4.623 1.00 0.22 C ATOM 438 O THR A 29 19.423 4.140 -4.767 1.00 0.22 O ATOM 439 CB THR A 29 21.485 4.801 -2.416 1.00 0.26 C ATOM 440 OG1 THR A 29 22.358 5.703 -3.104 1.00 0.28 O ATOM 441 CG2 THR A 29 22.108 4.406 -1.086 1.00 0.28 C ATOM 0 H THR A 29 23.240 3.133 -2.950 1.00 0.21 H new ATOM 0 HA THR A 29 20.494 2.910 -2.792 1.00 0.22 H new ATOM 0 HB THR A 29 20.532 5.293 -2.224 1.00 0.26 H new ATOM 0 HG1 THR A 29 22.892 6.203 -2.452 1.00 0.28 H new ATOM 0 HG21 THR A 29 22.288 5.300 -0.489 1.00 0.28 H new ATOM 0 HG22 THR A 29 21.430 3.742 -0.550 1.00 0.28 H new ATOM 0 HG23 THR A 29 23.053 3.893 -1.265 1.00 0.28 H new ATOM 449 N ARG A 30 21.511 4.266 -5.596 1.00 0.23 N ATOM 450 CA ARG A 30 21.074 4.712 -6.917 1.00 0.25 C ATOM 451 C ARG A 30 20.286 3.624 -7.643 1.00 0.26 C ATOM 452 O ARG A 30 19.805 3.832 -8.758 1.00 0.43 O ATOM 453 CB ARG A 30 22.277 5.135 -7.763 1.00 0.29 C ATOM 454 CG ARG A 30 23.251 4.005 -8.053 1.00 1.36 C ATOM 455 CD ARG A 30 24.386 4.469 -8.950 1.00 1.46 C ATOM 456 NE ARG A 30 23.893 5.063 -10.190 1.00 1.85 N ATOM 457 CZ ARG A 30 24.684 5.487 -11.172 1.00 2.23 C ATOM 458 NH1 ARG A 30 26.001 5.376 -11.064 1.00 2.10 N ATOM 459 NH2 ARG A 30 24.156 6.019 -12.266 1.00 3.19 N ATOM 0 H ARG A 30 22.522 4.170 -5.495 1.00 0.23 H new ATOM 0 HA ARG A 30 20.416 5.569 -6.773 1.00 0.25 H new ATOM 0 HB2 ARG A 30 21.919 5.545 -8.707 1.00 0.29 H new ATOM 0 HB3 ARG A 30 22.807 5.936 -7.248 1.00 0.29 H new ATOM 0 HG2 ARG A 30 23.658 3.624 -7.116 1.00 1.36 H new ATOM 0 HG3 ARG A 30 22.722 3.180 -8.530 1.00 1.36 H new ATOM 0 HD2 ARG A 30 24.996 5.198 -8.416 1.00 1.46 H new ATOM 0 HD3 ARG A 30 25.032 3.623 -9.185 1.00 1.46 H new ATOM 0 HE ARG A 30 22.885 5.158 -10.310 1.00 1.85 H new ATOM 0 HH11 ARG A 30 26.411 4.964 -10.226 1.00 2.10 H new ATOM 0 HH12 ARG A 30 26.604 5.702 -11.819 1.00 2.10 H new ATOM 0 HH21 ARG A 30 23.143 6.103 -12.355 1.00 3.19 H new ATOM 0 HH22 ARG A 30 24.763 6.344 -13.019 1.00 3.19 H new ATOM 473 N GLU A 31 20.156 2.465 -7.006 1.00 0.17 N ATOM 474 CA GLU A 31 19.428 1.346 -7.590 1.00 0.18 C ATOM 475 C GLU A 31 18.407 0.793 -6.596 1.00 0.16 C ATOM 476 O GLU A 31 17.951 -0.344 -6.718 1.00 0.18 O ATOM 477 CB GLU A 31 20.410 0.249 -8.012 1.00 0.20 C ATOM 478 CG GLU A 31 19.827 -0.754 -8.993 1.00 0.26 C ATOM 479 CD GLU A 31 20.877 -1.694 -9.552 1.00 0.29 C ATOM 480 OE1 GLU A 31 21.369 -2.554 -8.791 1.00 0.28 O ATOM 481 OE2 GLU A 31 21.203 -1.576 -10.752 1.00 0.44 O ATOM 0 H GLU A 31 20.547 2.277 -6.083 1.00 0.17 H new ATOM 0 HA GLU A 31 18.891 1.698 -8.471 1.00 0.18 H new ATOM 0 HB2 GLU A 31 21.288 0.714 -8.461 1.00 0.20 H new ATOM 0 HB3 GLU A 31 20.750 -0.282 -7.123 1.00 0.20 H new ATOM 0 HG2 GLU A 31 19.051 -1.335 -8.495 1.00 0.26 H new ATOM 0 HG3 GLU A 31 19.348 -0.219 -9.813 1.00 0.26 H new ATOM 488 N LEU A 32 18.056 1.615 -5.613 1.00 0.17 N ATOM 489 CA LEU A 32 17.096 1.229 -4.584 1.00 0.19 C ATOM 490 C LEU A 32 15.657 1.349 -5.080 1.00 0.18 C ATOM 491 O LEU A 32 14.803 0.521 -4.747 1.00 0.17 O ATOM 492 CB LEU A 32 17.281 2.108 -3.346 1.00 0.24 C ATOM 493 CG LEU A 32 16.376 1.757 -2.168 1.00 0.29 C ATOM 494 CD1 LEU A 32 16.742 0.391 -1.614 1.00 0.39 C ATOM 495 CD2 LEU A 32 16.466 2.819 -1.084 1.00 0.38 C ATOM 0 H LEU A 32 18.425 2.560 -5.507 1.00 0.17 H new ATOM 0 HA LEU A 32 17.282 0.185 -4.333 1.00 0.19 H new ATOM 0 HB2 LEU A 32 18.319 2.039 -3.021 1.00 0.24 H new ATOM 0 HB3 LEU A 32 17.103 3.146 -3.626 1.00 0.24 H new ATOM 0 HG LEU A 32 15.345 1.723 -2.521 1.00 0.29 H new ATOM 0 HD11 LEU A 32 16.089 0.152 -0.774 1.00 0.39 H new ATOM 0 HD12 LEU A 32 16.621 -0.362 -2.393 1.00 0.39 H new ATOM 0 HD13 LEU A 32 17.778 0.401 -1.277 1.00 0.39 H new ATOM 0 HD21 LEU A 32 15.813 2.548 -0.254 1.00 0.38 H new ATOM 0 HD22 LEU A 32 17.494 2.890 -0.728 1.00 0.38 H new ATOM 0 HD23 LEU A 32 16.156 3.781 -1.491 1.00 0.38 H new ATOM 507 N GLY A 33 15.394 2.393 -5.863 1.00 0.22 N ATOM 508 CA GLY A 33 14.061 2.620 -6.392 1.00 0.23 C ATOM 509 C GLY A 33 13.427 1.361 -6.951 1.00 0.20 C ATOM 510 O GLY A 33 12.237 1.120 -6.757 1.00 0.19 O ATOM 0 H GLY A 33 16.086 3.089 -6.141 1.00 0.22 H new ATOM 0 HA2 GLY A 33 13.426 3.021 -5.603 1.00 0.23 H new ATOM 0 HA3 GLY A 33 14.110 3.375 -7.176 1.00 0.23 H new ATOM 514 N THR A 34 14.225 0.553 -7.640 1.00 0.19 N ATOM 515 CA THR A 34 13.736 -0.681 -8.239 1.00 0.18 C ATOM 516 C THR A 34 13.100 -1.606 -7.203 1.00 0.16 C ATOM 517 O THR A 34 12.016 -2.143 -7.429 1.00 0.17 O ATOM 518 CB THR A 34 14.865 -1.439 -8.961 1.00 0.21 C ATOM 519 OG1 THR A 34 15.571 -0.552 -9.836 1.00 0.26 O ATOM 520 CG2 THR A 34 14.304 -2.605 -9.763 1.00 0.23 C ATOM 0 H THR A 34 15.217 0.732 -7.797 1.00 0.19 H new ATOM 0 HA THR A 34 12.975 -0.389 -8.963 1.00 0.18 H new ATOM 0 HB THR A 34 15.550 -1.828 -8.208 1.00 0.21 H new ATOM 0 HG1 THR A 34 16.288 -1.042 -10.290 1.00 0.26 H new ATOM 0 HG21 THR A 34 15.119 -3.127 -10.265 1.00 0.23 H new ATOM 0 HG22 THR A 34 13.790 -3.294 -9.093 1.00 0.23 H new ATOM 0 HG23 THR A 34 13.601 -2.230 -10.506 1.00 0.23 H new ATOM 528 N LEU A 35 13.775 -1.795 -6.071 1.00 0.13 N ATOM 529 CA LEU A 35 13.261 -2.670 -5.021 1.00 0.12 C ATOM 530 C LEU A 35 11.947 -2.162 -4.449 1.00 0.14 C ATOM 531 O LEU A 35 10.940 -2.864 -4.490 1.00 0.15 O ATOM 532 CB LEU A 35 14.286 -2.833 -3.896 1.00 0.13 C ATOM 533 CG LEU A 35 15.243 -4.019 -4.053 1.00 0.14 C ATOM 534 CD1 LEU A 35 15.793 -4.090 -5.467 1.00 0.18 C ATOM 535 CD2 LEU A 35 16.376 -3.923 -3.043 1.00 0.20 C ATOM 0 H LEU A 35 14.672 -1.358 -5.859 1.00 0.13 H new ATOM 0 HA LEU A 35 13.076 -3.641 -5.481 1.00 0.12 H new ATOM 0 HB2 LEU A 35 14.875 -1.918 -3.827 1.00 0.13 H new ATOM 0 HB3 LEU A 35 13.752 -2.940 -2.952 1.00 0.13 H new ATOM 0 HG LEU A 35 14.684 -4.935 -3.863 1.00 0.14 H new ATOM 0 HD11 LEU A 35 16.470 -4.940 -5.552 1.00 0.18 H new ATOM 0 HD12 LEU A 35 14.970 -4.209 -6.172 1.00 0.18 H new ATOM 0 HD13 LEU A 35 16.335 -3.172 -5.693 1.00 0.18 H new ATOM 0 HD21 LEU A 35 17.047 -4.773 -3.167 1.00 0.20 H new ATOM 0 HD22 LEU A 35 16.929 -2.997 -3.203 1.00 0.20 H new ATOM 0 HD23 LEU A 35 15.965 -3.930 -2.033 1.00 0.20 H new ATOM 547 N MET A 36 11.942 -0.934 -3.939 1.00 0.17 N ATOM 548 CA MET A 36 10.724 -0.379 -3.359 1.00 0.21 C ATOM 549 C MET A 36 9.562 -0.498 -4.338 1.00 0.23 C ATOM 550 O MET A 36 8.419 -0.707 -3.934 1.00 0.26 O ATOM 551 CB MET A 36 10.928 1.074 -2.921 1.00 0.25 C ATOM 552 CG MET A 36 11.902 1.857 -3.784 1.00 0.21 C ATOM 553 SD MET A 36 12.927 2.992 -2.822 1.00 0.30 S ATOM 554 CE MET A 36 11.719 3.693 -1.696 1.00 0.73 C ATOM 0 H MET A 36 12.752 -0.314 -3.915 1.00 0.17 H new ATOM 0 HA MET A 36 10.481 -0.958 -2.468 1.00 0.21 H new ATOM 0 HB2 MET A 36 9.964 1.582 -2.929 1.00 0.25 H new ATOM 0 HB3 MET A 36 11.285 1.084 -1.891 1.00 0.25 H new ATOM 0 HG2 MET A 36 12.545 1.161 -4.323 1.00 0.21 H new ATOM 0 HG3 MET A 36 11.346 2.421 -4.532 1.00 0.21 H new ATOM 0 HE1 MET A 36 11.943 4.747 -1.533 1.00 0.73 H new ATOM 0 HE2 MET A 36 10.722 3.596 -2.126 1.00 0.73 H new ATOM 0 HE3 MET A 36 11.757 3.162 -0.745 1.00 0.73 H new ATOM 564 N ARG A 37 9.862 -0.382 -5.629 1.00 0.23 N ATOM 565 CA ARG A 37 8.839 -0.502 -6.659 1.00 0.27 C ATOM 566 C ARG A 37 8.292 -1.924 -6.695 1.00 0.25 C ATOM 567 O ARG A 37 7.083 -2.131 -6.611 1.00 0.28 O ATOM 568 CB ARG A 37 9.398 -0.119 -8.030 1.00 0.31 C ATOM 569 CG ARG A 37 9.621 1.375 -8.201 1.00 0.37 C ATOM 570 CD ARG A 37 10.242 1.695 -9.551 1.00 0.43 C ATOM 571 NE ARG A 37 10.529 3.121 -9.699 1.00 0.53 N ATOM 572 CZ ARG A 37 10.805 3.703 -10.862 1.00 0.71 C ATOM 573 NH1 ARG A 37 10.828 2.987 -11.979 1.00 0.94 N ATOM 574 NH2 ARG A 37 11.060 5.003 -10.911 1.00 0.79 N ATOM 0 H ARG A 37 10.802 -0.206 -5.984 1.00 0.23 H new ATOM 0 HA ARG A 37 8.028 0.185 -6.415 1.00 0.27 H new ATOM 0 HB2 ARG A 37 10.343 -0.639 -8.186 1.00 0.31 H new ATOM 0 HB3 ARG A 37 8.712 -0.466 -8.803 1.00 0.31 H new ATOM 0 HG2 ARG A 37 8.670 1.899 -8.103 1.00 0.37 H new ATOM 0 HG3 ARG A 37 10.270 1.740 -7.405 1.00 0.37 H new ATOM 0 HD2 ARG A 37 11.164 1.126 -9.670 1.00 0.43 H new ATOM 0 HD3 ARG A 37 9.566 1.377 -10.345 1.00 0.43 H new ATOM 0 HE ARG A 37 10.517 3.703 -8.861 1.00 0.53 H new ATOM 0 HH11 ARG A 37 10.633 1.986 -11.947 1.00 0.94 H new ATOM 0 HH12 ARG A 37 11.040 3.437 -12.869 1.00 0.94 H new ATOM 0 HH21 ARG A 37 11.045 5.558 -10.056 1.00 0.79 H new ATOM 0 HH22 ARG A 37 11.272 5.448 -11.804 1.00 0.79 H new ATOM 588 N THR A 38 9.186 -2.905 -6.850 1.00 0.24 N ATOM 589 CA THR A 38 8.774 -4.304 -6.869 1.00 0.29 C ATOM 590 C THR A 38 8.119 -4.679 -5.537 1.00 0.26 C ATOM 591 O THR A 38 7.439 -5.700 -5.430 1.00 0.32 O ATOM 592 CB THR A 38 9.957 -5.257 -7.174 1.00 0.38 C ATOM 593 OG1 THR A 38 9.468 -6.452 -7.795 1.00 1.07 O ATOM 594 CG2 THR A 38 10.734 -5.631 -5.919 1.00 0.67 C ATOM 0 H THR A 38 10.189 -2.755 -6.963 1.00 0.24 H new ATOM 0 HA THR A 38 8.049 -4.420 -7.674 1.00 0.29 H new ATOM 0 HB THR A 38 10.635 -4.727 -7.844 1.00 0.38 H new ATOM 0 HG1 THR A 38 10.219 -7.051 -7.988 1.00 1.07 H new ATOM 0 HG21 THR A 38 11.553 -6.300 -6.184 1.00 0.67 H new ATOM 0 HG22 THR A 38 11.137 -4.729 -5.458 1.00 0.67 H new ATOM 0 HG23 THR A 38 10.069 -6.132 -5.215 1.00 0.67 H new ATOM 602 N LEU A 39 8.338 -3.833 -4.528 1.00 0.21 N ATOM 603 CA LEU A 39 7.755 -4.034 -3.203 1.00 0.26 C ATOM 604 C LEU A 39 6.333 -3.484 -3.167 1.00 0.33 C ATOM 605 O LEU A 39 5.637 -3.587 -2.157 1.00 0.83 O ATOM 606 CB LEU A 39 8.601 -3.354 -2.118 1.00 0.24 C ATOM 607 CG LEU A 39 9.659 -4.232 -1.438 1.00 0.25 C ATOM 608 CD1 LEU A 39 10.614 -4.845 -2.447 1.00 0.29 C ATOM 609 CD2 LEU A 39 10.423 -3.409 -0.411 1.00 0.41 C ATOM 0 H LEU A 39 8.919 -2.998 -4.606 1.00 0.21 H new ATOM 0 HA LEU A 39 7.735 -5.105 -3.003 1.00 0.26 H new ATOM 0 HB2 LEU A 39 9.103 -2.495 -2.563 1.00 0.24 H new ATOM 0 HB3 LEU A 39 7.930 -2.969 -1.350 1.00 0.24 H new ATOM 0 HG LEU A 39 9.148 -5.054 -0.937 1.00 0.25 H new ATOM 0 HD11 LEU A 39 11.348 -5.460 -1.926 1.00 0.29 H new ATOM 0 HD12 LEU A 39 10.054 -5.464 -3.148 1.00 0.29 H new ATOM 0 HD13 LEU A 39 11.126 -4.052 -2.992 1.00 0.29 H new ATOM 0 HD21 LEU A 39 11.174 -4.035 0.071 1.00 0.41 H new ATOM 0 HD22 LEU A 39 10.913 -2.571 -0.908 1.00 0.41 H new ATOM 0 HD23 LEU A 39 9.730 -3.030 0.340 1.00 0.41 H new ATOM 621 N GLY A 40 5.909 -2.908 -4.287 1.00 0.48 N ATOM 622 CA GLY A 40 4.572 -2.349 -4.387 1.00 0.54 C ATOM 623 C GLY A 40 4.499 -0.862 -4.089 1.00 0.44 C ATOM 624 O GLY A 40 3.546 -0.195 -4.492 1.00 0.56 O ATOM 0 H GLY A 40 6.471 -2.818 -5.133 1.00 0.48 H new ATOM 0 HA2 GLY A 40 4.190 -2.527 -5.392 1.00 0.54 H new ATOM 0 HA3 GLY A 40 3.915 -2.880 -3.698 1.00 0.54 H new ATOM 628 N GLN A 41 5.499 -0.333 -3.389 1.00 0.41 N ATOM 629 CA GLN A 41 5.519 1.091 -3.061 1.00 0.37 C ATOM 630 C GLN A 41 6.413 1.859 -4.026 1.00 0.29 C ATOM 631 O GLN A 41 7.628 1.667 -4.044 1.00 0.35 O ATOM 632 CB GLN A 41 6.007 1.311 -1.626 1.00 0.47 C ATOM 633 CG GLN A 41 5.172 0.596 -0.580 1.00 0.66 C ATOM 634 CD GLN A 41 5.742 -0.758 -0.210 1.00 0.90 C ATOM 635 OE1 GLN A 41 6.407 -1.404 -1.018 1.00 1.79 O ATOM 636 NE2 GLN A 41 5.485 -1.194 1.016 1.00 0.85 N ATOM 0 H GLN A 41 6.299 -0.862 -3.041 1.00 0.41 H new ATOM 0 HA GLN A 41 4.499 1.464 -3.151 1.00 0.37 H new ATOM 0 HB2 GLN A 41 7.040 0.972 -1.547 1.00 0.47 H new ATOM 0 HB3 GLN A 41 6.005 2.380 -1.411 1.00 0.47 H new ATOM 0 HG2 GLN A 41 5.107 1.216 0.314 1.00 0.66 H new ATOM 0 HG3 GLN A 41 4.156 0.469 -0.955 1.00 0.66 H new ATOM 0 HE21 GLN A 41 4.929 -0.625 1.654 1.00 0.85 H new ATOM 0 HE22 GLN A 41 5.844 -2.099 1.321 1.00 0.85 H new ATOM 645 N ASN A 42 5.812 2.737 -4.819 1.00 0.34 N ATOM 646 CA ASN A 42 6.570 3.529 -5.775 1.00 0.29 C ATOM 647 C ASN A 42 6.908 4.896 -5.183 1.00 0.31 C ATOM 648 O ASN A 42 6.020 5.717 -4.960 1.00 0.36 O ATOM 649 CB ASN A 42 5.775 3.706 -7.072 1.00 0.34 C ATOM 650 CG ASN A 42 5.696 2.430 -7.890 1.00 0.43 C ATOM 651 OD1 ASN A 42 5.697 1.285 -7.215 1.00 1.03 O flip ATOM 652 ND2 ASN A 42 5.633 2.472 -9.119 1.00 0.96 N flip ATOM 0 H ASN A 42 4.808 2.917 -4.819 1.00 0.34 H new ATOM 0 HA ASN A 42 7.497 3.001 -5.999 1.00 0.29 H new ATOM 0 HB2 ASN A 42 4.766 4.042 -6.832 1.00 0.34 H new ATOM 0 HB3 ASN A 42 6.237 4.490 -7.672 1.00 0.34 H new ATOM 0 HD21 ASN A 42 5.635 3.372 -9.599 1.00 0.96 H new ATOM 0 HD22 ASN A 42 5.579 1.607 -9.657 1.00 0.96 H new ATOM 659 N PRO A 43 8.201 5.157 -4.918 1.00 0.30 N ATOM 660 CA PRO A 43 8.650 6.431 -4.351 1.00 0.35 C ATOM 661 C PRO A 43 8.851 7.508 -5.407 1.00 0.34 C ATOM 662 O PRO A 43 8.987 7.216 -6.595 1.00 0.52 O ATOM 663 CB PRO A 43 9.989 6.054 -3.731 1.00 0.40 C ATOM 664 CG PRO A 43 10.525 5.017 -4.653 1.00 0.35 C ATOM 665 CD PRO A 43 9.332 4.221 -5.108 1.00 0.27 C ATOM 0 HA PRO A 43 7.924 6.853 -3.656 1.00 0.35 H new ATOM 0 HB2 PRO A 43 10.656 6.914 -3.664 1.00 0.40 H new ATOM 0 HB3 PRO A 43 9.867 5.666 -2.720 1.00 0.40 H new ATOM 0 HG2 PRO A 43 11.037 5.473 -5.500 1.00 0.35 H new ATOM 0 HG3 PRO A 43 11.251 4.380 -4.147 1.00 0.35 H new ATOM 0 HD2 PRO A 43 9.428 3.913 -6.149 1.00 0.27 H new ATOM 0 HD3 PRO A 43 9.206 3.313 -4.518 1.00 0.27 H new ATOM 673 N THR A 44 8.870 8.759 -4.961 1.00 0.38 N ATOM 674 CA THR A 44 9.074 9.887 -5.857 1.00 0.38 C ATOM 675 C THR A 44 10.562 10.098 -6.108 1.00 0.34 C ATOM 676 O THR A 44 11.370 10.000 -5.187 1.00 0.33 O ATOM 677 CB THR A 44 8.469 11.182 -5.282 1.00 0.43 C ATOM 678 OG1 THR A 44 9.088 11.497 -4.029 1.00 0.43 O ATOM 679 CG2 THR A 44 6.967 11.037 -5.088 1.00 0.53 C ATOM 0 H THR A 44 8.746 9.016 -3.982 1.00 0.38 H new ATOM 0 HA THR A 44 8.569 9.655 -6.795 1.00 0.38 H new ATOM 0 HB THR A 44 8.652 11.989 -5.991 1.00 0.43 H new ATOM 0 HG1 THR A 44 8.700 12.322 -3.671 1.00 0.43 H new ATOM 0 HG21 THR A 44 6.562 11.963 -4.681 1.00 0.53 H new ATOM 0 HG22 THR A 44 6.495 10.825 -6.047 1.00 0.53 H new ATOM 0 HG23 THR A 44 6.767 10.219 -4.396 1.00 0.53 H new ATOM 687 N GLU A 45 10.917 10.384 -7.355 1.00 0.36 N ATOM 688 CA GLU A 45 12.312 10.596 -7.727 1.00 0.37 C ATOM 689 C GLU A 45 13.027 11.512 -6.731 1.00 0.33 C ATOM 690 O GLU A 45 14.214 11.337 -6.457 1.00 0.30 O ATOM 691 CB GLU A 45 12.395 11.192 -9.134 1.00 0.43 C ATOM 692 CG GLU A 45 13.815 11.329 -9.655 1.00 0.48 C ATOM 693 CD GLU A 45 13.871 11.947 -11.038 1.00 0.58 C ATOM 694 OE1 GLU A 45 13.728 11.201 -12.029 1.00 0.66 O ATOM 695 OE2 GLU A 45 14.060 13.179 -11.130 1.00 0.63 O ATOM 0 H GLU A 45 10.257 10.475 -8.128 1.00 0.36 H new ATOM 0 HA GLU A 45 12.812 9.627 -7.711 1.00 0.37 H new ATOM 0 HB2 GLU A 45 11.825 10.565 -9.819 1.00 0.43 H new ATOM 0 HB3 GLU A 45 11.922 12.174 -9.132 1.00 0.43 H new ATOM 0 HG2 GLU A 45 14.394 11.941 -8.964 1.00 0.48 H new ATOM 0 HG3 GLU A 45 14.285 10.346 -9.681 1.00 0.48 H new ATOM 702 N ALA A 46 12.291 12.475 -6.187 1.00 0.35 N ATOM 703 CA ALA A 46 12.849 13.429 -5.232 1.00 0.35 C ATOM 704 C ALA A 46 13.368 12.754 -3.961 1.00 0.32 C ATOM 705 O ALA A 46 14.475 13.043 -3.504 1.00 0.33 O ATOM 706 CB ALA A 46 11.803 14.474 -4.874 1.00 0.40 C ATOM 0 H ALA A 46 11.302 12.617 -6.392 1.00 0.35 H new ATOM 0 HA ALA A 46 13.703 13.905 -5.714 1.00 0.35 H new ATOM 0 HB1 ALA A 46 12.225 15.182 -4.161 1.00 0.40 H new ATOM 0 HB2 ALA A 46 11.496 15.005 -5.775 1.00 0.40 H new ATOM 0 HB3 ALA A 46 10.937 13.984 -4.429 1.00 0.40 H new ATOM 712 N GLU A 47 12.567 11.861 -3.388 1.00 0.30 N ATOM 713 CA GLU A 47 12.956 11.176 -2.159 1.00 0.30 C ATOM 714 C GLU A 47 14.158 10.261 -2.386 1.00 0.26 C ATOM 715 O GLU A 47 14.979 10.068 -1.491 1.00 0.26 O ATOM 716 CB GLU A 47 11.776 10.382 -1.586 1.00 0.33 C ATOM 717 CG GLU A 47 11.500 9.069 -2.303 1.00 0.37 C ATOM 718 CD GLU A 47 12.187 7.890 -1.645 1.00 0.88 C ATOM 719 OE1 GLU A 47 11.698 7.431 -0.591 1.00 1.43 O ATOM 720 OE2 GLU A 47 13.210 7.421 -2.184 1.00 1.15 O ATOM 0 H GLU A 47 11.651 11.596 -3.751 1.00 0.30 H new ATOM 0 HA GLU A 47 13.249 11.936 -1.435 1.00 0.30 H new ATOM 0 HB2 GLU A 47 11.969 10.174 -0.534 1.00 0.33 H new ATOM 0 HB3 GLU A 47 10.880 11.002 -1.629 1.00 0.33 H new ATOM 0 HG2 GLU A 47 10.425 8.891 -2.327 1.00 0.37 H new ATOM 0 HG3 GLU A 47 11.833 9.148 -3.338 1.00 0.37 H new ATOM 727 N LEU A 48 14.253 9.696 -3.582 1.00 0.24 N ATOM 728 CA LEU A 48 15.355 8.802 -3.913 1.00 0.22 C ATOM 729 C LEU A 48 16.694 9.532 -3.905 1.00 0.20 C ATOM 730 O LEU A 48 17.609 9.157 -3.176 1.00 0.19 O ATOM 731 CB LEU A 48 15.125 8.183 -5.292 1.00 0.25 C ATOM 732 CG LEU A 48 13.869 7.321 -5.421 1.00 0.27 C ATOM 733 CD1 LEU A 48 13.496 7.148 -6.885 1.00 0.31 C ATOM 734 CD2 LEU A 48 14.082 5.966 -4.762 1.00 0.29 C ATOM 0 H LEU A 48 13.583 9.840 -4.337 1.00 0.24 H new ATOM 0 HA LEU A 48 15.388 8.022 -3.153 1.00 0.22 H new ATOM 0 HB2 LEU A 48 15.072 8.985 -6.028 1.00 0.25 H new ATOM 0 HB3 LEU A 48 15.992 7.573 -5.547 1.00 0.25 H new ATOM 0 HG LEU A 48 13.048 7.825 -4.911 1.00 0.27 H new ATOM 0 HD11 LEU A 48 12.600 6.532 -6.962 1.00 0.31 H new ATOM 0 HD12 LEU A 48 13.304 8.125 -7.329 1.00 0.31 H new ATOM 0 HD13 LEU A 48 14.316 6.663 -7.415 1.00 0.31 H new ATOM 0 HD21 LEU A 48 13.178 5.366 -4.864 1.00 0.29 H new ATOM 0 HD22 LEU A 48 14.914 5.453 -5.245 1.00 0.29 H new ATOM 0 HD23 LEU A 48 14.307 6.107 -3.705 1.00 0.29 H new ATOM 746 N GLN A 49 16.794 10.586 -4.707 1.00 0.23 N ATOM 747 CA GLN A 49 18.029 11.355 -4.813 1.00 0.25 C ATOM 748 C GLN A 49 18.496 11.902 -3.466 1.00 0.25 C ATOM 749 O GLN A 49 19.698 11.950 -3.204 1.00 0.26 O ATOM 750 CB GLN A 49 17.852 12.497 -5.813 1.00 0.31 C ATOM 751 CG GLN A 49 16.858 13.555 -5.372 1.00 0.36 C ATOM 752 CD GLN A 49 16.006 14.067 -6.518 1.00 0.36 C ATOM 753 OE1 GLN A 49 15.737 13.199 -7.487 1.00 0.40 O flip ATOM 754 NE2 GLN A 49 15.589 15.226 -6.528 1.00 0.33 N flip ATOM 0 H GLN A 49 16.033 10.928 -5.294 1.00 0.23 H new ATOM 0 HA GLN A 49 18.803 10.674 -5.167 1.00 0.25 H new ATOM 0 HB2 GLN A 49 18.819 12.970 -5.983 1.00 0.31 H new ATOM 0 HB3 GLN A 49 17.527 12.083 -6.768 1.00 0.31 H new ATOM 0 HG2 GLN A 49 16.210 13.141 -4.599 1.00 0.36 H new ATOM 0 HG3 GLN A 49 17.396 14.390 -4.923 1.00 0.36 H new ATOM 0 HE21 GLN A 49 15.821 15.858 -5.762 1.00 0.33 H new ATOM 0 HE22 GLN A 49 15.012 15.554 -7.302 1.00 0.33 H new ATOM 763 N ASP A 50 17.563 12.321 -2.612 1.00 0.25 N ATOM 764 CA ASP A 50 17.944 12.864 -1.310 1.00 0.29 C ATOM 765 C ASP A 50 18.624 11.797 -0.452 1.00 0.27 C ATOM 766 O ASP A 50 19.718 12.020 0.066 1.00 0.30 O ATOM 767 CB ASP A 50 16.734 13.472 -0.579 1.00 0.33 C ATOM 768 CG ASP A 50 15.997 12.486 0.309 1.00 0.33 C ATOM 769 OD1 ASP A 50 16.543 12.118 1.371 1.00 0.35 O ATOM 770 OD2 ASP A 50 14.867 12.099 -0.045 1.00 0.33 O ATOM 0 H ASP A 50 16.559 12.296 -2.792 1.00 0.25 H new ATOM 0 HA ASP A 50 18.661 13.667 -1.483 1.00 0.29 H new ATOM 0 HB2 ASP A 50 17.072 14.311 0.028 1.00 0.33 H new ATOM 0 HB3 ASP A 50 16.039 13.872 -1.317 1.00 0.33 H new ATOM 775 N LEU A 51 17.981 10.638 -0.305 1.00 0.25 N ATOM 776 CA LEU A 51 18.545 9.552 0.491 1.00 0.27 C ATOM 777 C LEU A 51 19.788 8.974 -0.176 1.00 0.24 C ATOM 778 O LEU A 51 20.631 8.367 0.484 1.00 0.27 O ATOM 779 CB LEU A 51 17.499 8.455 0.725 1.00 0.30 C ATOM 780 CG LEU A 51 16.871 7.852 -0.532 1.00 0.29 C ATOM 781 CD1 LEU A 51 17.787 6.802 -1.136 1.00 0.30 C ATOM 782 CD2 LEU A 51 15.515 7.247 -0.206 1.00 0.35 C ATOM 0 H LEU A 51 17.075 10.430 -0.725 1.00 0.25 H new ATOM 0 HA LEU A 51 18.840 9.960 1.458 1.00 0.27 H new ATOM 0 HB2 LEU A 51 17.965 7.652 1.296 1.00 0.30 H new ATOM 0 HB3 LEU A 51 16.702 8.866 1.345 1.00 0.30 H new ATOM 0 HG LEU A 51 16.731 8.648 -1.264 1.00 0.29 H new ATOM 0 HD11 LEU A 51 17.323 6.385 -2.029 1.00 0.30 H new ATOM 0 HD12 LEU A 51 18.740 7.260 -1.402 1.00 0.30 H new ATOM 0 HD13 LEU A 51 17.957 6.007 -0.410 1.00 0.30 H new ATOM 0 HD21 LEU A 51 15.080 6.821 -1.110 1.00 0.35 H new ATOM 0 HD22 LEU A 51 15.637 6.463 0.542 1.00 0.35 H new ATOM 0 HD23 LEU A 51 14.855 8.022 0.184 1.00 0.35 H new ATOM 794 N ILE A 52 19.894 9.166 -1.488 1.00 0.20 N ATOM 795 CA ILE A 52 21.041 8.669 -2.241 1.00 0.21 C ATOM 796 C ILE A 52 22.289 9.487 -1.925 1.00 0.25 C ATOM 797 O ILE A 52 23.303 8.945 -1.488 1.00 0.29 O ATOM 798 CB ILE A 52 20.773 8.691 -3.763 1.00 0.23 C ATOM 799 CG1 ILE A 52 19.827 7.552 -4.147 1.00 0.25 C ATOM 800 CG2 ILE A 52 22.077 8.590 -4.546 1.00 0.28 C ATOM 801 CD1 ILE A 52 19.325 7.633 -5.573 1.00 0.31 C ATOM 0 H ILE A 52 19.202 9.661 -2.050 1.00 0.20 H new ATOM 0 HA ILE A 52 21.205 7.635 -1.937 1.00 0.21 H new ATOM 0 HB ILE A 52 20.301 9.640 -4.016 1.00 0.23 H new ATOM 0 HG12 ILE A 52 20.341 6.601 -4.005 1.00 0.25 H new ATOM 0 HG13 ILE A 52 18.973 7.557 -3.470 1.00 0.25 H new ATOM 0 HG21 ILE A 52 21.862 8.608 -5.614 1.00 0.28 H new ATOM 0 HG22 ILE A 52 22.720 9.432 -4.291 1.00 0.28 H new ATOM 0 HG23 ILE A 52 22.582 7.658 -4.293 1.00 0.28 H new ATOM 0 HD11 ILE A 52 18.660 6.793 -5.773 1.00 0.31 H new ATOM 0 HD12 ILE A 52 18.782 8.567 -5.715 1.00 0.31 H new ATOM 0 HD13 ILE A 52 20.171 7.597 -6.259 1.00 0.31 H new ATOM 813 N ALA A 53 22.206 10.795 -2.149 1.00 0.29 N ATOM 814 CA ALA A 53 23.327 11.688 -1.885 1.00 0.36 C ATOM 815 C ALA A 53 23.703 11.618 -0.416 1.00 0.38 C ATOM 816 O ALA A 53 24.879 11.589 -0.054 1.00 0.45 O ATOM 817 CB ALA A 53 22.964 13.113 -2.272 1.00 0.40 C ATOM 0 H ALA A 53 21.374 11.259 -2.513 1.00 0.29 H new ATOM 0 HA ALA A 53 24.182 11.375 -2.484 1.00 0.36 H new ATOM 0 HB1 ALA A 53 23.809 13.771 -2.070 1.00 0.40 H new ATOM 0 HB2 ALA A 53 22.720 13.151 -3.334 1.00 0.40 H new ATOM 0 HB3 ALA A 53 22.102 13.440 -1.690 1.00 0.40 H new ATOM 823 N GLU A 54 22.674 11.593 0.417 1.00 0.40 N ATOM 824 CA GLU A 54 22.835 11.509 1.857 1.00 0.47 C ATOM 825 C GLU A 54 23.629 10.266 2.261 1.00 0.40 C ATOM 826 O GLU A 54 24.612 10.362 2.996 1.00 0.45 O ATOM 827 CB GLU A 54 21.450 11.514 2.512 1.00 0.59 C ATOM 828 CG GLU A 54 21.365 10.701 3.786 1.00 0.69 C ATOM 829 CD GLU A 54 20.134 11.028 4.609 1.00 1.02 C ATOM 830 OE1 GLU A 54 19.060 10.459 4.321 1.00 1.47 O ATOM 831 OE2 GLU A 54 20.244 11.850 5.541 1.00 1.27 O ATOM 0 H GLU A 54 21.702 11.631 0.111 1.00 0.40 H new ATOM 0 HA GLU A 54 23.404 12.372 2.202 1.00 0.47 H new ATOM 0 HB2 GLU A 54 21.168 12.544 2.731 1.00 0.59 H new ATOM 0 HB3 GLU A 54 20.721 11.129 1.799 1.00 0.59 H new ATOM 0 HG2 GLU A 54 21.358 9.640 3.535 1.00 0.69 H new ATOM 0 HG3 GLU A 54 22.257 10.881 4.387 1.00 0.69 H new ATOM 838 N ALA A 55 23.200 9.102 1.778 1.00 0.33 N ATOM 839 CA ALA A 55 23.876 7.846 2.099 1.00 0.31 C ATOM 840 C ALA A 55 25.311 7.839 1.579 1.00 0.33 C ATOM 841 O ALA A 55 26.194 7.232 2.183 1.00 0.41 O ATOM 842 CB ALA A 55 23.099 6.665 1.533 1.00 0.37 C ATOM 0 H ALA A 55 22.391 9.002 1.165 1.00 0.33 H new ATOM 0 HA ALA A 55 23.914 7.754 3.184 1.00 0.31 H new ATOM 0 HB1 ALA A 55 23.615 5.738 1.781 1.00 0.37 H new ATOM 0 HB2 ALA A 55 22.098 6.649 1.963 1.00 0.37 H new ATOM 0 HB3 ALA A 55 23.027 6.762 0.450 1.00 0.37 H new ATOM 848 N GLU A 56 25.539 8.511 0.456 1.00 0.34 N ATOM 849 CA GLU A 56 26.872 8.578 -0.136 1.00 0.44 C ATOM 850 C GLU A 56 27.823 9.399 0.730 1.00 0.52 C ATOM 851 O GLU A 56 29.039 9.352 0.546 1.00 0.65 O ATOM 852 CB GLU A 56 26.800 9.184 -1.540 1.00 0.50 C ATOM 853 CG GLU A 56 26.161 8.265 -2.569 1.00 0.61 C ATOM 854 CD GLU A 56 26.101 8.891 -3.950 1.00 1.09 C ATOM 855 OE1 GLU A 56 27.065 8.714 -4.724 1.00 1.31 O ATOM 856 OE2 GLU A 56 25.090 9.556 -4.256 1.00 1.88 O ATOM 0 H GLU A 56 24.821 9.016 -0.062 1.00 0.34 H new ATOM 0 HA GLU A 56 27.258 7.561 -0.200 1.00 0.44 H new ATOM 0 HB2 GLU A 56 26.235 10.115 -1.496 1.00 0.50 H new ATOM 0 HB3 GLU A 56 27.808 9.438 -1.869 1.00 0.50 H new ATOM 0 HG2 GLU A 56 26.725 7.334 -2.620 1.00 0.61 H new ATOM 0 HG3 GLU A 56 25.152 8.009 -2.246 1.00 0.61 H new ATOM 863 N ASN A 57 27.263 10.152 1.671 1.00 0.54 N ATOM 864 CA ASN A 57 28.064 10.994 2.554 1.00 0.68 C ATOM 865 C ASN A 57 28.576 10.222 3.768 1.00 0.70 C ATOM 866 O ASN A 57 29.656 10.514 4.285 1.00 0.98 O ATOM 867 CB ASN A 57 27.245 12.199 3.017 1.00 0.79 C ATOM 868 CG ASN A 57 28.033 13.117 3.932 1.00 0.96 C ATOM 869 OD1 ASN A 57 28.015 12.960 5.153 1.00 1.37 O ATOM 870 ND2 ASN A 57 28.732 14.080 3.344 1.00 1.66 N ATOM 0 H ASN A 57 26.258 10.197 1.842 1.00 0.54 H new ATOM 0 HA ASN A 57 28.929 11.334 1.985 1.00 0.68 H new ATOM 0 HB2 ASN A 57 26.907 12.761 2.146 1.00 0.79 H new ATOM 0 HB3 ASN A 57 26.353 11.850 3.537 1.00 0.79 H new ATOM 0 HD21 ASN A 57 29.283 14.727 3.908 1.00 1.66 H new ATOM 0 HD22 ASN A 57 28.718 14.173 2.328 1.00 1.66 H new ATOM 877 N ASN A 58 27.805 9.239 4.224 1.00 0.64 N ATOM 878 CA ASN A 58 28.195 8.445 5.387 1.00 0.70 C ATOM 879 C ASN A 58 28.284 6.959 5.051 1.00 0.63 C ATOM 880 O ASN A 58 29.285 6.307 5.348 1.00 0.89 O ATOM 881 CB ASN A 58 27.205 8.666 6.532 1.00 0.79 C ATOM 882 CG ASN A 58 25.768 8.440 6.106 1.00 1.13 C ATOM 883 OD1 ASN A 58 25.241 7.334 6.219 1.00 2.14 O ATOM 884 ND2 ASN A 58 25.127 9.492 5.610 1.00 1.12 N ATOM 0 H ASN A 58 26.912 8.973 3.810 1.00 0.64 H new ATOM 0 HA ASN A 58 29.186 8.776 5.697 1.00 0.70 H new ATOM 0 HB2 ASN A 58 27.448 7.992 7.354 1.00 0.79 H new ATOM 0 HB3 ASN A 58 27.313 9.682 6.911 1.00 0.79 H new ATOM 0 HD21 ASN A 58 24.158 9.401 5.304 1.00 1.12 H new ATOM 0 HD22 ASN A 58 25.604 10.391 5.535 1.00 1.12 H new ATOM 891 N ASN A 59 27.236 6.430 4.430 1.00 0.54 N ATOM 892 CA ASN A 59 27.199 5.019 4.056 1.00 0.72 C ATOM 893 C ASN A 59 28.095 4.742 2.851 1.00 0.82 C ATOM 894 O ASN A 59 28.079 3.638 2.306 1.00 1.69 O ATOM 895 CB ASN A 59 25.764 4.589 3.748 1.00 0.81 C ATOM 896 CG ASN A 59 24.857 4.691 4.958 1.00 0.88 C ATOM 897 OD1 ASN A 59 25.298 4.528 6.095 1.00 1.09 O ATOM 898 ND2 ASN A 59 23.578 4.961 4.717 1.00 0.93 N ATOM 0 H ASN A 59 26.400 6.956 4.174 1.00 0.54 H new ATOM 0 HA ASN A 59 27.574 4.440 4.900 1.00 0.72 H new ATOM 0 HB2 ASN A 59 25.366 5.210 2.946 1.00 0.81 H new ATOM 0 HB3 ASN A 59 25.766 3.561 3.384 1.00 0.81 H new ATOM 0 HD21 ASN A 59 22.919 5.041 5.491 1.00 0.93 H new ATOM 0 HD22 ASN A 59 23.256 5.089 3.758 1.00 0.93 H new ATOM 905 N ASN A 60 28.857 5.761 2.437 1.00 0.78 N ATOM 906 CA ASN A 60 29.777 5.658 1.299 1.00 0.73 C ATOM 907 C ASN A 60 29.035 5.792 -0.028 1.00 0.61 C ATOM 908 O ASN A 60 29.397 6.614 -0.871 1.00 0.68 O ATOM 909 CB ASN A 60 30.560 4.340 1.331 1.00 0.76 C ATOM 910 CG ASN A 60 31.353 4.167 2.613 1.00 1.00 C ATOM 911 OD1 ASN A 60 30.735 3.548 3.612 1.00 1.32 O flip ATOM 912 ND2 ASN A 60 32.506 4.586 2.704 1.00 1.74 N flip ATOM 0 H ASN A 60 28.853 6.679 2.881 1.00 0.78 H new ATOM 0 HA ASN A 60 30.485 6.482 1.385 1.00 0.73 H new ATOM 0 HB2 ASN A 60 29.867 3.506 1.221 1.00 0.76 H new ATOM 0 HB3 ASN A 60 31.239 4.304 0.479 1.00 0.76 H new ATOM 0 HD21 ASN A 60 32.942 5.056 1.911 1.00 1.74 H new ATOM 0 HD22 ASN A 60 33.026 4.463 3.573 1.00 1.74 H new ATOM 919 N GLY A 61 27.995 4.983 -0.208 1.00 0.53 N ATOM 920 CA GLY A 61 27.221 5.028 -1.436 1.00 0.47 C ATOM 921 C GLY A 61 26.318 3.820 -1.607 1.00 0.41 C ATOM 922 O GLY A 61 25.667 3.665 -2.641 1.00 0.56 O ATOM 0 H GLY A 61 27.674 4.297 0.475 1.00 0.53 H new ATOM 0 HA2 GLY A 61 26.614 5.933 -1.445 1.00 0.47 H new ATOM 0 HA3 GLY A 61 27.900 5.091 -2.286 1.00 0.47 H new ATOM 926 N GLN A 62 26.279 2.963 -0.591 1.00 0.28 N ATOM 927 CA GLN A 62 25.451 1.764 -0.629 1.00 0.22 C ATOM 928 C GLN A 62 24.699 1.581 0.685 1.00 0.19 C ATOM 929 O GLN A 62 25.101 2.109 1.722 1.00 0.22 O ATOM 930 CB GLN A 62 26.296 0.526 -0.950 1.00 0.22 C ATOM 931 CG GLN A 62 27.669 0.503 -0.288 1.00 0.31 C ATOM 932 CD GLN A 62 27.621 0.482 1.231 1.00 1.15 C ATOM 933 OE1 GLN A 62 26.544 -0.054 1.791 1.00 1.44 O flip ATOM 934 NE2 GLN A 62 28.545 0.953 1.896 1.00 1.87 N flip ATOM 0 H GLN A 62 26.813 3.078 0.270 1.00 0.28 H new ATOM 0 HA GLN A 62 24.716 1.887 -1.425 1.00 0.22 H new ATOM 0 HB2 GLN A 62 25.745 -0.363 -0.643 1.00 0.22 H new ATOM 0 HB3 GLN A 62 26.427 0.463 -2.030 1.00 0.22 H new ATOM 0 HG2 GLN A 62 28.215 -0.374 -0.636 1.00 0.31 H new ATOM 0 HG3 GLN A 62 28.232 1.378 -0.612 1.00 0.31 H new ATOM 0 HE21 GLN A 62 29.356 1.356 1.428 1.00 1.87 H new ATOM 0 HE22 GLN A 62 28.499 0.940 2.915 1.00 1.87 H new ATOM 943 N LEU A 63 23.600 0.837 0.632 1.00 0.19 N ATOM 944 CA LEU A 63 22.781 0.594 1.810 1.00 0.19 C ATOM 945 C LEU A 63 22.719 -0.893 2.148 1.00 0.18 C ATOM 946 O LEU A 63 22.812 -1.748 1.267 1.00 0.19 O ATOM 947 CB LEU A 63 21.368 1.145 1.592 1.00 0.23 C ATOM 948 CG LEU A 63 20.646 0.640 0.341 1.00 0.25 C ATOM 949 CD1 LEU A 63 19.964 -0.691 0.612 1.00 0.28 C ATOM 950 CD2 LEU A 63 19.633 1.668 -0.133 1.00 0.39 C ATOM 0 H LEU A 63 23.256 0.391 -0.218 1.00 0.19 H new ATOM 0 HA LEU A 63 23.242 1.110 2.652 1.00 0.19 H new ATOM 0 HB2 LEU A 63 20.762 0.897 2.464 1.00 0.23 H new ATOM 0 HB3 LEU A 63 21.425 2.232 1.542 1.00 0.23 H new ATOM 0 HG LEU A 63 21.386 0.489 -0.445 1.00 0.25 H new ATOM 0 HD11 LEU A 63 19.457 -1.031 -0.291 1.00 0.28 H new ATOM 0 HD12 LEU A 63 20.710 -1.428 0.909 1.00 0.28 H new ATOM 0 HD13 LEU A 63 19.235 -0.570 1.413 1.00 0.28 H new ATOM 0 HD21 LEU A 63 19.127 1.296 -1.024 1.00 0.39 H new ATOM 0 HD22 LEU A 63 18.900 1.846 0.654 1.00 0.39 H new ATOM 0 HD23 LEU A 63 20.145 2.601 -0.370 1.00 0.39 H new ATOM 962 N ASN A 64 22.555 -1.183 3.434 1.00 0.18 N ATOM 963 CA ASN A 64 22.471 -2.556 3.922 1.00 0.18 C ATOM 964 C ASN A 64 21.013 -2.984 4.062 1.00 0.17 C ATOM 965 O ASN A 64 20.123 -2.145 4.203 1.00 0.17 O ATOM 966 CB ASN A 64 23.186 -2.691 5.266 1.00 0.20 C ATOM 967 CG ASN A 64 24.551 -2.034 5.266 1.00 0.26 C ATOM 968 OD1 ASN A 64 25.220 -1.962 4.234 1.00 0.74 O ATOM 969 ND2 ASN A 64 24.973 -1.547 6.427 1.00 0.61 N ATOM 0 H ASN A 64 22.477 -0.477 4.166 1.00 0.18 H new ATOM 0 HA ASN A 64 22.960 -3.207 3.197 1.00 0.18 H new ATOM 0 HB2 ASN A 64 22.571 -2.244 6.047 1.00 0.20 H new ATOM 0 HB3 ASN A 64 23.295 -3.747 5.511 1.00 0.20 H new ATOM 0 HD21 ASN A 64 25.884 -1.092 6.488 1.00 0.61 H new ATOM 0 HD22 ASN A 64 24.386 -1.628 7.258 1.00 0.61 H new ATOM 976 N PHE A 65 20.775 -4.290 4.018 1.00 0.17 N ATOM 977 CA PHE A 65 19.422 -4.827 4.121 1.00 0.17 C ATOM 978 C PHE A 65 18.671 -4.290 5.341 1.00 0.19 C ATOM 979 O PHE A 65 17.451 -4.142 5.299 1.00 0.18 O ATOM 980 CB PHE A 65 19.449 -6.356 4.172 1.00 0.19 C ATOM 981 CG PHE A 65 18.077 -6.961 4.249 1.00 0.18 C ATOM 982 CD1 PHE A 65 17.297 -7.095 3.111 1.00 0.20 C ATOM 983 CD2 PHE A 65 17.576 -7.416 5.458 1.00 0.19 C ATOM 984 CE1 PHE A 65 16.040 -7.668 3.179 1.00 0.21 C ATOM 985 CE2 PHE A 65 16.324 -7.992 5.530 1.00 0.19 C ATOM 986 CZ PHE A 65 15.522 -8.044 4.391 1.00 0.19 C ATOM 0 H PHE A 65 21.502 -4.998 3.912 1.00 0.17 H new ATOM 0 HA PHE A 65 18.889 -4.498 3.229 1.00 0.17 H new ATOM 0 HB2 PHE A 65 19.959 -6.735 3.286 1.00 0.19 H new ATOM 0 HB3 PHE A 65 20.031 -6.676 5.036 1.00 0.19 H new ATOM 0 HD1 PHE A 65 17.675 -6.748 2.161 1.00 0.20 H new ATOM 0 HD2 PHE A 65 18.172 -7.319 6.354 1.00 0.19 H new ATOM 0 HE1 PHE A 65 15.466 -7.819 2.277 1.00 0.21 H new ATOM 0 HE2 PHE A 65 15.967 -8.400 6.464 1.00 0.19 H new ATOM 0 HZ PHE A 65 14.498 -8.379 4.463 1.00 0.19 H new ATOM 996 N THR A 66 19.386 -4.000 6.424 1.00 0.23 N ATOM 997 CA THR A 66 18.736 -3.500 7.632 1.00 0.25 C ATOM 998 C THR A 66 18.112 -2.130 7.414 1.00 0.24 C ATOM 999 O THR A 66 16.924 -1.939 7.665 1.00 0.24 O ATOM 1000 CB THR A 66 19.696 -3.407 8.829 1.00 0.30 C ATOM 1001 OG1 THR A 66 20.326 -4.675 9.056 1.00 0.33 O ATOM 1002 CG2 THR A 66 18.934 -2.979 10.078 1.00 0.32 C ATOM 0 H THR A 66 20.399 -4.100 6.491 1.00 0.23 H new ATOM 0 HA THR A 66 17.958 -4.230 7.858 1.00 0.25 H new ATOM 0 HB THR A 66 20.462 -2.664 8.606 1.00 0.30 H new ATOM 0 HG1 THR A 66 20.937 -4.605 9.819 1.00 0.33 H new ATOM 0 HG21 THR A 66 19.623 -2.916 10.921 1.00 0.32 H new ATOM 0 HG22 THR A 66 18.477 -2.004 9.909 1.00 0.32 H new ATOM 0 HG23 THR A 66 18.157 -3.711 10.299 1.00 0.32 H new ATOM 1010 N GLU A 67 18.908 -1.168 6.957 1.00 0.25 N ATOM 1011 CA GLU A 67 18.387 0.171 6.735 1.00 0.26 C ATOM 1012 C GLU A 67 17.263 0.144 5.707 1.00 0.23 C ATOM 1013 O GLU A 67 16.245 0.810 5.884 1.00 0.23 O ATOM 1014 CB GLU A 67 19.496 1.146 6.320 1.00 0.29 C ATOM 1015 CG GLU A 67 20.186 0.802 5.012 1.00 0.27 C ATOM 1016 CD GLU A 67 21.294 1.781 4.674 1.00 0.45 C ATOM 1017 OE1 GLU A 67 20.986 2.863 4.133 1.00 0.66 O ATOM 1018 OE2 GLU A 67 22.470 1.465 4.954 1.00 0.61 O ATOM 0 H GLU A 67 19.897 -1.289 6.738 1.00 0.25 H new ATOM 0 HA GLU A 67 17.978 0.532 7.679 1.00 0.26 H new ATOM 0 HB2 GLU A 67 19.070 2.146 6.238 1.00 0.29 H new ATOM 0 HB3 GLU A 67 20.245 1.182 7.112 1.00 0.29 H new ATOM 0 HG2 GLU A 67 20.600 -0.205 5.075 1.00 0.27 H new ATOM 0 HG3 GLU A 67 19.452 0.795 4.207 1.00 0.27 H new ATOM 1025 N PHE A 68 17.439 -0.629 4.635 1.00 0.22 N ATOM 1026 CA PHE A 68 16.404 -0.731 3.612 1.00 0.20 C ATOM 1027 C PHE A 68 15.117 -1.295 4.196 1.00 0.18 C ATOM 1028 O PHE A 68 14.058 -0.685 4.080 1.00 0.19 O ATOM 1029 CB PHE A 68 16.846 -1.617 2.447 1.00 0.19 C ATOM 1030 CG PHE A 68 15.750 -1.824 1.436 1.00 0.18 C ATOM 1031 CD1 PHE A 68 14.968 -0.766 0.998 1.00 0.25 C ATOM 1032 CD2 PHE A 68 15.513 -3.087 0.912 1.00 0.17 C ATOM 1033 CE1 PHE A 68 13.973 -0.968 0.058 1.00 0.27 C ATOM 1034 CE2 PHE A 68 14.522 -3.293 -0.021 1.00 0.18 C ATOM 1035 CZ PHE A 68 13.702 -2.180 -0.408 1.00 0.23 C ATOM 0 H PHE A 68 18.275 -1.185 4.456 1.00 0.22 H new ATOM 0 HA PHE A 68 16.229 0.279 3.241 1.00 0.20 H new ATOM 0 HB2 PHE A 68 17.708 -1.165 1.957 1.00 0.19 H new ATOM 0 HB3 PHE A 68 17.169 -2.584 2.832 1.00 0.19 H new ATOM 0 HD1 PHE A 68 15.137 0.224 1.394 1.00 0.25 H new ATOM 0 HD2 PHE A 68 16.115 -3.921 1.241 1.00 0.17 H new ATOM 0 HE1 PHE A 68 13.406 -0.123 -0.303 1.00 0.27 H new ATOM 0 HE2 PHE A 68 14.365 -4.271 -0.452 1.00 0.18 H new ATOM 0 HZ PHE A 68 12.867 -2.329 -1.077 1.00 0.23 H new ATOM 1045 N CYS A 69 15.212 -2.477 4.800 1.00 0.18 N ATOM 1046 CA CYS A 69 14.050 -3.117 5.408 1.00 0.19 C ATOM 1047 C CYS A 69 13.343 -2.126 6.319 1.00 0.20 C ATOM 1048 O CYS A 69 12.114 -2.104 6.407 1.00 0.20 O ATOM 1049 CB CYS A 69 14.461 -4.365 6.196 1.00 0.21 C ATOM 1050 SG CYS A 69 15.026 -4.038 7.883 1.00 0.26 S ATOM 0 H CYS A 69 16.079 -3.009 4.881 1.00 0.18 H new ATOM 0 HA CYS A 69 13.369 -3.430 4.617 1.00 0.19 H new ATOM 0 HB2 CYS A 69 13.613 -5.048 6.237 1.00 0.21 H new ATOM 0 HB3 CYS A 69 15.256 -4.876 5.653 1.00 0.21 H new ATOM 0 HG CYS A 69 15.808 -3.000 7.885 1.00 0.26 H new ATOM 1056 N GLY A 70 14.141 -1.302 6.990 1.00 0.22 N ATOM 1057 CA GLY A 70 13.593 -0.294 7.867 1.00 0.25 C ATOM 1058 C GLY A 70 12.844 0.762 7.075 1.00 0.25 C ATOM 1059 O GLY A 70 11.833 1.302 7.527 1.00 0.27 O ATOM 0 H GLY A 70 15.160 -1.318 6.939 1.00 0.22 H new ATOM 0 HA2 GLY A 70 12.920 -0.759 8.587 1.00 0.25 H new ATOM 0 HA3 GLY A 70 14.396 0.174 8.437 1.00 0.25 H new ATOM 1063 N ILE A 71 13.357 1.041 5.878 1.00 0.25 N ATOM 1064 CA ILE A 71 12.772 2.029 4.980 1.00 0.27 C ATOM 1065 C ILE A 71 11.474 1.547 4.354 1.00 0.26 C ATOM 1066 O ILE A 71 10.450 2.214 4.457 1.00 0.29 O ATOM 1067 CB ILE A 71 13.759 2.406 3.864 1.00 0.28 C ATOM 1068 CG1 ILE A 71 14.886 3.238 4.463 1.00 0.30 C ATOM 1069 CG2 ILE A 71 13.052 3.164 2.746 1.00 0.30 C ATOM 1070 CD1 ILE A 71 15.943 3.656 3.461 1.00 0.33 C ATOM 0 H ILE A 71 14.191 0.587 5.505 1.00 0.25 H new ATOM 0 HA ILE A 71 12.551 2.905 5.590 1.00 0.27 H new ATOM 0 HB ILE A 71 14.175 1.499 3.425 1.00 0.28 H new ATOM 0 HG12 ILE A 71 14.461 4.131 4.921 1.00 0.30 H new ATOM 0 HG13 ILE A 71 15.361 2.667 5.260 1.00 0.30 H new ATOM 0 HG21 ILE A 71 13.772 3.420 1.968 1.00 0.30 H new ATOM 0 HG22 ILE A 71 12.267 2.538 2.322 1.00 0.30 H new ATOM 0 HG23 ILE A 71 12.612 4.077 3.147 1.00 0.30 H new ATOM 0 HD11 ILE A 71 16.710 4.244 3.965 1.00 0.33 H new ATOM 0 HD12 ILE A 71 16.398 2.769 3.020 1.00 0.33 H new ATOM 0 HD13 ILE A 71 15.483 4.256 2.676 1.00 0.33 H new ATOM 1082 N MET A 72 11.516 0.402 3.683 1.00 0.24 N ATOM 1083 CA MET A 72 10.319 -0.131 3.055 1.00 0.25 C ATOM 1084 C MET A 72 9.200 -0.186 4.084 1.00 0.27 C ATOM 1085 O MET A 72 8.029 0.015 3.761 1.00 0.31 O ATOM 1086 CB MET A 72 10.587 -1.511 2.447 1.00 0.23 C ATOM 1087 CG MET A 72 10.956 -2.584 3.462 1.00 0.26 C ATOM 1088 SD MET A 72 9.524 -3.253 4.333 1.00 0.49 S ATOM 1089 CE MET A 72 8.469 -3.712 2.961 1.00 0.33 C ATOM 0 H MET A 72 12.354 -0.166 3.562 1.00 0.24 H new ATOM 0 HA MET A 72 10.017 0.524 2.238 1.00 0.25 H new ATOM 0 HB2 MET A 72 9.700 -1.833 1.902 1.00 0.23 H new ATOM 0 HB3 MET A 72 11.394 -1.424 1.719 1.00 0.23 H new ATOM 0 HG2 MET A 72 11.476 -3.395 2.952 1.00 0.26 H new ATOM 0 HG3 MET A 72 11.653 -2.165 4.188 1.00 0.26 H new ATOM 0 HE1 MET A 72 7.766 -4.480 3.284 1.00 0.33 H new ATOM 0 HE2 MET A 72 7.918 -2.837 2.617 1.00 0.33 H new ATOM 0 HE3 MET A 72 9.080 -4.099 2.146 1.00 0.33 H new ATOM 1099 N ALA A 73 9.579 -0.464 5.328 1.00 0.26 N ATOM 1100 CA ALA A 73 8.625 -0.514 6.423 1.00 0.29 C ATOM 1101 C ALA A 73 7.937 0.836 6.604 1.00 0.31 C ATOM 1102 O ALA A 73 6.709 0.913 6.607 1.00 0.36 O ATOM 1103 CB ALA A 73 9.324 -0.935 7.707 1.00 0.29 C ATOM 0 H ALA A 73 10.543 -0.658 5.600 1.00 0.26 H new ATOM 0 HA ALA A 73 7.860 -1.253 6.183 1.00 0.29 H new ATOM 0 HB1 ALA A 73 8.600 -0.969 8.521 1.00 0.29 H new ATOM 0 HB2 ALA A 73 9.767 -1.922 7.573 1.00 0.29 H new ATOM 0 HB3 ALA A 73 10.107 -0.216 7.948 1.00 0.29 H new ATOM 1109 N LYS A 74 8.728 1.906 6.758 1.00 0.31 N ATOM 1110 CA LYS A 74 8.155 3.239 6.932 1.00 0.35 C ATOM 1111 C LYS A 74 7.464 3.697 5.656 1.00 0.38 C ATOM 1112 O LYS A 74 6.621 4.591 5.680 1.00 0.44 O ATOM 1113 CB LYS A 74 9.232 4.249 7.340 1.00 0.38 C ATOM 1114 CG LYS A 74 10.408 4.324 6.382 1.00 0.43 C ATOM 1115 CD LYS A 74 11.455 5.321 6.856 1.00 0.48 C ATOM 1116 CE LYS A 74 12.152 4.842 8.120 1.00 1.38 C ATOM 1117 NZ LYS A 74 13.190 5.804 8.582 1.00 2.11 N ATOM 0 H LYS A 74 9.747 1.873 6.765 1.00 0.31 H new ATOM 0 HA LYS A 74 7.415 3.183 7.730 1.00 0.35 H new ATOM 0 HB2 LYS A 74 8.777 5.237 7.418 1.00 0.38 H new ATOM 0 HB3 LYS A 74 9.601 3.989 8.332 1.00 0.38 H new ATOM 0 HG2 LYS A 74 10.862 3.338 6.285 1.00 0.43 H new ATOM 0 HG3 LYS A 74 10.054 4.611 5.392 1.00 0.43 H new ATOM 0 HD2 LYS A 74 12.193 5.476 6.069 1.00 0.48 H new ATOM 0 HD3 LYS A 74 10.982 6.285 7.044 1.00 0.48 H new ATOM 0 HE2 LYS A 74 11.414 4.698 8.909 1.00 1.38 H new ATOM 0 HE3 LYS A 74 12.613 3.872 7.934 1.00 1.38 H new ATOM 0 HZ1 LYS A 74 13.641 5.440 9.446 1.00 2.11 H new ATOM 0 HZ2 LYS A 74 13.909 5.922 7.840 1.00 2.11 H new ATOM 0 HZ3 LYS A 74 12.747 6.723 8.784 1.00 2.11 H new ATOM 1131 N GLN A 75 7.838 3.084 4.540 1.00 0.36 N ATOM 1132 CA GLN A 75 7.248 3.415 3.251 1.00 0.42 C ATOM 1133 C GLN A 75 5.825 2.883 3.158 1.00 0.51 C ATOM 1134 O GLN A 75 5.070 3.256 2.259 1.00 0.63 O ATOM 1135 CB GLN A 75 8.096 2.846 2.111 1.00 0.43 C ATOM 1136 CG GLN A 75 9.376 3.626 1.853 1.00 0.69 C ATOM 1137 CD GLN A 75 9.123 4.970 1.195 1.00 0.90 C ATOM 1138 OE1 GLN A 75 8.081 5.592 1.399 1.00 1.48 O ATOM 1139 NE2 GLN A 75 10.080 5.424 0.395 1.00 0.80 N ATOM 0 H GLN A 75 8.549 2.353 4.503 1.00 0.36 H new ATOM 0 HA GLN A 75 7.220 4.501 3.160 1.00 0.42 H new ATOM 0 HB2 GLN A 75 8.351 1.812 2.341 1.00 0.43 H new ATOM 0 HB3 GLN A 75 7.500 2.831 1.199 1.00 0.43 H new ATOM 0 HG2 GLN A 75 9.898 3.781 2.797 1.00 0.69 H new ATOM 0 HG3 GLN A 75 10.035 3.034 1.218 1.00 0.69 H new ATOM 0 HE21 GLN A 75 10.929 4.876 0.253 1.00 0.80 H new ATOM 0 HE22 GLN A 75 9.967 6.321 -0.078 1.00 0.80 H new ATOM 1289 N MET A 85 7.346 15.675 9.139 1.00 12.20 N ATOM 1290 CA MET A 85 8.572 16.291 9.620 1.00 13.28 C ATOM 1291 C MET A 85 8.426 17.807 9.667 1.00 14.20 C ATOM 1292 O MET A 85 8.700 18.436 10.689 1.00 15.28 O ATOM 1293 CB MET A 85 9.743 15.896 8.718 1.00 13.04 C ATOM 1294 CG MET A 85 11.064 15.775 9.452 1.00 14.20 C ATOM 1295 SD MET A 85 11.003 14.567 10.792 1.00 15.12 S ATOM 1296 CE MET A 85 12.736 14.146 10.971 1.00 16.29 C ATOM 0 HA MET A 85 8.769 15.935 10.631 1.00 13.28 H new ATOM 0 HB2 MET A 85 9.516 14.944 8.238 1.00 13.04 H new ATOM 0 HB3 MET A 85 9.845 16.636 7.925 1.00 13.04 H new ATOM 0 HG2 MET A 85 11.844 15.490 8.746 1.00 14.20 H new ATOM 0 HG3 MET A 85 11.341 16.748 9.857 1.00 14.20 H new ATOM 0 HE1 MET A 85 12.864 13.490 11.832 1.00 16.29 H new ATOM 0 HE2 MET A 85 13.081 13.635 10.072 1.00 16.29 H new ATOM 0 HE3 MET A 85 13.318 15.056 11.118 1.00 16.29 H new ATOM 1306 N ARG A 86 7.992 18.385 8.554 1.00 13.88 N ATOM 1307 CA ARG A 86 7.792 19.821 8.463 1.00 14.84 C ATOM 1308 C ARG A 86 6.733 20.284 9.454 1.00 15.43 C ATOM 1309 O ARG A 86 6.774 21.414 9.936 1.00 16.55 O ATOM 1310 CB ARG A 86 7.372 20.208 7.046 1.00 14.45 C ATOM 1311 CG ARG A 86 8.471 20.036 6.013 1.00 14.20 C ATOM 1312 CD ARG A 86 8.031 20.535 4.647 1.00 14.13 C ATOM 1313 NE ARG A 86 9.053 20.319 3.626 1.00 14.82 N ATOM 1314 CZ ARG A 86 8.943 20.740 2.369 1.00 15.11 C ATOM 1315 NH1 ARG A 86 7.857 21.393 1.976 1.00 14.78 N ATOM 1316 NH2 ARG A 86 9.919 20.507 1.503 1.00 15.88 N ATOM 0 H ARG A 86 7.771 17.875 7.698 1.00 13.88 H new ATOM 0 HA ARG A 86 8.736 20.309 8.705 1.00 14.84 H new ATOM 0 HB2 ARG A 86 6.513 19.603 6.754 1.00 14.45 H new ATOM 0 HB3 ARG A 86 7.045 21.248 7.045 1.00 14.45 H new ATOM 0 HG2 ARG A 86 9.360 20.580 6.332 1.00 14.20 H new ATOM 0 HG3 ARG A 86 8.748 18.984 5.946 1.00 14.20 H new ATOM 0 HD2 ARG A 86 7.113 20.025 4.354 1.00 14.13 H new ATOM 0 HD3 ARG A 86 7.799 21.598 4.708 1.00 14.13 H new ATOM 0 HE ARG A 86 9.900 19.816 3.892 1.00 14.82 H new ATOM 0 HH11 ARG A 86 7.103 21.574 2.639 1.00 14.78 H new ATOM 0 HH12 ARG A 86 7.776 21.714 1.011 1.00 14.78 H new ATOM 0 HH21 ARG A 86 10.755 20.004 1.800 1.00 15.88 H new ATOM 0 HH22 ARG A 86 9.834 20.830 0.539 1.00 15.88 H new ATOM 1330 N GLU A 87 5.789 19.398 9.758 1.00 14.77 N ATOM 1331 CA GLU A 87 4.714 19.719 10.690 1.00 15.43 C ATOM 1332 C GLU A 87 5.281 19.969 12.080 1.00 16.43 C ATOM 1333 O GLU A 87 4.886 20.915 12.759 1.00 17.50 O ATOM 1334 CB GLU A 87 3.687 18.585 10.742 1.00 14.60 C ATOM 1335 CG GLU A 87 2.280 19.047 11.089 1.00 15.22 C ATOM 1336 CD GLU A 87 2.185 19.648 12.478 1.00 14.94 C ATOM 1337 OE1 GLU A 87 2.102 18.875 13.456 1.00 14.72 O ATOM 1338 OE2 GLU A 87 2.193 20.893 12.589 1.00 15.08 O ATOM 0 H GLU A 87 5.747 18.454 9.373 1.00 14.77 H new ATOM 0 HA GLU A 87 4.216 20.623 10.340 1.00 15.43 H new ATOM 0 HB2 GLU A 87 3.666 18.082 9.775 1.00 14.60 H new ATOM 0 HB3 GLU A 87 4.010 17.849 11.478 1.00 14.60 H new ATOM 0 HG2 GLU A 87 1.953 19.784 10.356 1.00 15.22 H new ATOM 0 HG3 GLU A 87 1.596 18.201 11.016 1.00 15.22 H new ATOM 1345 N ALA A 88 6.232 19.133 12.485 1.00 16.17 N ATOM 1346 CA ALA A 88 6.854 19.274 13.795 1.00 17.18 C ATOM 1347 C ALA A 88 7.774 20.485 13.804 1.00 18.20 C ATOM 1348 O ALA A 88 7.771 21.277 14.753 1.00 19.32 O ATOM 1349 CB ALA A 88 7.614 18.011 14.173 1.00 16.77 C ATOM 0 H ALA A 88 6.586 18.356 11.928 1.00 16.17 H new ATOM 0 HA ALA A 88 6.072 19.425 14.539 1.00 17.18 H new ATOM 0 HB1 ALA A 88 8.070 18.141 15.155 1.00 16.77 H new ATOM 0 HB2 ALA A 88 6.925 17.167 14.201 1.00 16.77 H new ATOM 0 HB3 ALA A 88 8.392 17.820 13.434 1.00 16.77 H new ATOM 1355 N PHE A 89 8.561 20.629 12.741 1.00 17.88 N ATOM 1356 CA PHE A 89 9.462 21.761 12.624 1.00 18.88 C ATOM 1357 C PHE A 89 8.691 23.055 12.845 1.00 19.75 C ATOM 1358 O PHE A 89 9.157 23.954 13.538 1.00 20.90 O ATOM 1359 CB PHE A 89 10.142 21.781 11.253 1.00 18.44 C ATOM 1360 CG PHE A 89 10.896 23.053 10.991 1.00 19.53 C ATOM 1361 CD1 PHE A 89 12.156 23.243 11.527 1.00 20.04 C ATOM 1362 CD2 PHE A 89 10.340 24.061 10.221 1.00 20.12 C ATOM 1363 CE1 PHE A 89 12.851 24.414 11.301 1.00 21.09 C ATOM 1364 CE2 PHE A 89 11.029 25.235 9.992 1.00 21.19 C ATOM 1365 CZ PHE A 89 12.287 25.411 10.534 1.00 21.66 C ATOM 0 H PHE A 89 8.590 19.978 11.956 1.00 17.88 H new ATOM 0 HA PHE A 89 10.237 21.667 13.385 1.00 18.88 H new ATOM 0 HB2 PHE A 89 10.828 20.937 11.181 1.00 18.44 H new ATOM 0 HB3 PHE A 89 9.388 21.646 10.478 1.00 18.44 H new ATOM 0 HD1 PHE A 89 12.602 22.466 12.130 1.00 20.04 H new ATOM 0 HD2 PHE A 89 9.357 23.927 9.795 1.00 20.12 H new ATOM 0 HE1 PHE A 89 13.835 24.549 11.724 1.00 21.09 H new ATOM 0 HE2 PHE A 89 10.585 26.014 9.390 1.00 21.19 H new ATOM 0 HZ PHE A 89 12.828 26.329 10.357 1.00 21.66 H new ATOM 1375 N LYS A 90 7.508 23.137 12.239 1.00 19.26 N ATOM 1376 CA LYS A 90 6.653 24.311 12.375 1.00 20.11 C ATOM 1377 C LYS A 90 6.174 24.477 13.814 1.00 20.94 C ATOM 1378 O LYS A 90 6.035 25.601 14.304 1.00 22.05 O ATOM 1379 CB LYS A 90 5.446 24.205 11.442 1.00 19.45 C ATOM 1380 CG LYS A 90 5.810 24.227 9.966 1.00 18.94 C ATOM 1381 CD LYS A 90 4.734 23.572 9.111 1.00 18.35 C ATOM 1382 CE LYS A 90 3.522 24.472 8.924 1.00 17.84 C ATOM 1383 NZ LYS A 90 2.804 24.731 10.204 1.00 18.07 N ATOM 0 H LYS A 90 7.120 22.402 11.648 1.00 19.26 H new ATOM 0 HA LYS A 90 7.244 25.185 12.101 1.00 20.11 H new ATOM 0 HB2 LYS A 90 4.909 23.282 11.661 1.00 19.45 H new ATOM 0 HB3 LYS A 90 4.763 25.028 11.651 1.00 19.45 H new ATOM 0 HG2 LYS A 90 5.955 25.258 9.642 1.00 18.94 H new ATOM 0 HG3 LYS A 90 6.758 23.710 9.817 1.00 18.94 H new ATOM 0 HD2 LYS A 90 5.151 23.319 8.136 1.00 18.35 H new ATOM 0 HD3 LYS A 90 4.422 22.637 9.576 1.00 18.35 H new ATOM 0 HE2 LYS A 90 3.840 25.420 8.491 1.00 17.84 H new ATOM 0 HE3 LYS A 90 2.837 24.011 8.213 1.00 17.84 H new ATOM 0 HZ1 LYS A 90 1.790 24.863 10.013 1.00 18.07 H new ATOM 0 HZ2 LYS A 90 2.933 23.922 10.844 1.00 18.07 H new ATOM 0 HZ3 LYS A 90 3.187 25.589 10.649 1.00 18.07 H new ATOM 1397 N ILE A 91 5.936 23.355 14.498 1.00 20.46 N ATOM 1398 CA ILE A 91 5.475 23.405 15.882 1.00 21.30 C ATOM 1399 C ILE A 91 6.404 24.292 16.693 1.00 22.45 C ATOM 1400 O ILE A 91 5.953 25.159 17.443 1.00 23.52 O ATOM 1401 CB ILE A 91 5.388 22.004 16.528 1.00 20.67 C ATOM 1402 CG1 ILE A 91 4.350 21.149 15.798 1.00 19.54 C ATOM 1403 CG2 ILE A 91 5.044 22.117 18.008 1.00 21.70 C ATOM 1404 CD1 ILE A 91 4.273 19.719 16.290 1.00 18.86 C ATOM 0 H ILE A 91 6.054 22.415 14.120 1.00 20.46 H new ATOM 0 HA ILE A 91 4.466 23.818 15.878 1.00 21.30 H new ATOM 0 HB ILE A 91 6.361 21.520 16.441 1.00 20.67 H new ATOM 0 HG12 ILE A 91 3.370 21.613 15.908 1.00 19.54 H new ATOM 0 HG13 ILE A 91 4.583 21.144 14.733 1.00 19.54 H new ATOM 0 HG21 ILE A 91 4.987 21.120 18.445 1.00 21.70 H new ATOM 0 HG22 ILE A 91 5.816 22.694 18.518 1.00 21.70 H new ATOM 0 HG23 ILE A 91 4.083 22.618 18.121 1.00 21.70 H new ATOM 0 HD11 ILE A 91 3.515 19.179 15.723 1.00 18.86 H new ATOM 0 HD12 ILE A 91 5.240 19.235 16.155 1.00 18.86 H new ATOM 0 HD13 ILE A 91 4.009 19.712 17.347 1.00 18.86 H new ATOM 1416 N PHE A 92 7.704 24.073 16.541 1.00 22.30 N ATOM 1417 CA PHE A 92 8.685 24.895 17.236 1.00 23.42 C ATOM 1418 C PHE A 92 8.854 26.222 16.503 1.00 24.20 C ATOM 1419 O PHE A 92 8.994 27.273 17.123 1.00 25.36 O ATOM 1420 CB PHE A 92 10.037 24.187 17.324 1.00 23.12 C ATOM 1421 CG PHE A 92 9.955 22.771 17.820 1.00 22.46 C ATOM 1422 CD1 PHE A 92 9.777 21.721 16.935 1.00 22.24 C ATOM 1423 CD2 PHE A 92 10.060 22.492 19.173 1.00 22.15 C ATOM 1424 CE1 PHE A 92 9.705 20.418 17.390 1.00 21.74 C ATOM 1425 CE2 PHE A 92 9.988 21.191 19.635 1.00 21.64 C ATOM 1426 CZ PHE A 92 9.810 20.152 18.741 1.00 21.45 C ATOM 0 H PHE A 92 8.100 23.342 15.950 1.00 22.30 H new ATOM 0 HA PHE A 92 8.323 25.072 18.249 1.00 23.42 H new ATOM 0 HB2 PHE A 92 10.501 24.189 16.338 1.00 23.12 H new ATOM 0 HB3 PHE A 92 10.691 24.755 17.986 1.00 23.12 H new ATOM 0 HD1 PHE A 92 9.693 21.923 15.877 1.00 22.24 H new ATOM 0 HD2 PHE A 92 10.200 23.301 19.875 1.00 22.15 H new ATOM 0 HE1 PHE A 92 9.567 19.608 16.689 1.00 21.74 H new ATOM 0 HE2 PHE A 92 10.071 20.987 20.692 1.00 21.64 H new ATOM 0 HZ PHE A 92 9.753 19.134 19.098 1.00 21.45 H new ATOM 1436 N ASP A 93 8.824 26.158 15.172 1.00 23.63 N ATOM 1437 CA ASP A 93 8.984 27.341 14.327 1.00 24.39 C ATOM 1438 C ASP A 93 7.734 28.219 14.333 1.00 25.20 C ATOM 1439 O ASP A 93 7.563 29.040 13.444 1.00 26.19 O ATOM 1440 CB ASP A 93 9.316 26.927 12.892 1.00 23.63 C ATOM 1441 CG ASP A 93 9.741 28.103 12.034 1.00 24.48 C ATOM 1442 OD1 ASP A 93 10.286 29.079 12.591 1.00 24.81 O ATOM 1443 OD2 ASP A 93 9.529 28.049 10.801 1.00 24.88 O ATOM 0 H ASP A 93 8.689 25.291 14.652 1.00 23.63 H new ATOM 0 HA ASP A 93 9.807 27.925 14.739 1.00 24.39 H new ATOM 0 HB2 ASP A 93 10.114 26.184 12.906 1.00 23.63 H new ATOM 0 HB3 ASP A 93 8.445 26.450 12.444 1.00 23.63 H new ATOM 1448 N ARG A 94 6.856 27.972 15.310 1.00 24.82 N ATOM 1449 CA ARG A 94 5.603 28.723 15.530 1.00 25.61 C ATOM 1450 C ARG A 94 5.340 29.861 14.536 1.00 25.96 C ATOM 1451 O ARG A 94 4.236 29.975 14.004 1.00 26.03 O ATOM 1452 CB ARG A 94 5.600 29.301 16.943 1.00 26.84 C ATOM 1453 CG ARG A 94 5.880 28.273 18.023 1.00 26.72 C ATOM 1454 CD ARG A 94 5.562 28.818 19.404 1.00 27.97 C ATOM 1455 NE ARG A 94 4.123 28.949 19.619 1.00 28.57 N ATOM 1456 CZ ARG A 94 3.512 28.624 20.755 1.00 29.55 C ATOM 1457 NH1 ARG A 94 4.213 28.154 21.778 1.00 30.03 N ATOM 1458 NH2 ARG A 94 2.200 28.768 20.867 1.00 30.10 N ATOM 0 H ARG A 94 6.995 27.226 15.991 1.00 24.82 H new ATOM 0 HA ARG A 94 4.804 27.998 15.378 1.00 25.61 H new ATOM 0 HB2 ARG A 94 6.348 30.092 17.004 1.00 26.84 H new ATOM 0 HB3 ARG A 94 4.631 29.762 17.135 1.00 26.84 H new ATOM 0 HG2 ARG A 94 5.286 27.378 17.838 1.00 26.72 H new ATOM 0 HG3 ARG A 94 6.928 27.975 17.980 1.00 26.72 H new ATOM 0 HD2 ARG A 94 5.984 28.157 20.161 1.00 27.97 H new ATOM 0 HD3 ARG A 94 6.038 29.791 19.529 1.00 27.97 H new ATOM 0 HE ARG A 94 3.554 29.311 18.854 1.00 28.57 H new ATOM 0 HH11 ARG A 94 5.223 28.041 21.695 1.00 30.03 H new ATOM 0 HH12 ARG A 94 3.742 27.906 22.648 1.00 30.03 H new ATOM 0 HH21 ARG A 94 1.658 29.128 20.082 1.00 30.10 H new ATOM 0 HH22 ARG A 94 1.732 28.519 21.738 1.00 30.10 H new ATOM 1472 N ASP A 95 6.343 30.697 14.286 1.00 26.27 N ATOM 1473 CA ASP A 95 6.175 31.830 13.374 1.00 26.74 C ATOM 1474 C ASP A 95 6.082 31.352 11.927 1.00 25.70 C ATOM 1475 O ASP A 95 5.107 31.635 11.233 1.00 25.63 O ATOM 1476 CB ASP A 95 7.331 32.823 13.497 1.00 27.69 C ATOM 1477 CG ASP A 95 8.005 32.792 14.850 1.00 28.38 C ATOM 1478 OD1 ASP A 95 7.336 33.150 15.845 1.00 28.47 O ATOM 1479 OD2 ASP A 95 9.194 32.413 14.919 1.00 28.88 O ATOM 0 H ASP A 95 7.273 30.615 14.696 1.00 26.27 H new ATOM 0 HA ASP A 95 5.248 32.331 13.654 1.00 26.74 H new ATOM 0 HB2 ASP A 95 8.070 32.607 12.726 1.00 27.69 H new ATOM 0 HB3 ASP A 95 6.958 33.830 13.308 1.00 27.69 H new ATOM 1484 N GLY A 96 7.102 30.626 11.478 1.00 24.96 N ATOM 1485 CA GLY A 96 7.116 30.132 10.115 1.00 24.00 C ATOM 1486 C GLY A 96 8.102 30.884 9.243 1.00 24.47 C ATOM 1487 O GLY A 96 7.876 31.057 8.045 1.00 24.19 O ATOM 0 H GLY A 96 7.918 30.372 12.035 1.00 24.96 H new ATOM 0 HA2 GLY A 96 7.370 29.072 10.117 1.00 24.00 H new ATOM 0 HA3 GLY A 96 6.117 30.219 9.689 1.00 24.00 H new ATOM 1491 N ASP A 97 9.199 31.330 9.847 1.00 25.28 N ATOM 1492 CA ASP A 97 10.226 32.070 9.120 1.00 25.89 C ATOM 1493 C ASP A 97 11.161 31.110 8.396 1.00 25.11 C ATOM 1494 O ASP A 97 12.076 31.531 7.687 1.00 25.54 O ATOM 1495 CB ASP A 97 11.034 32.948 10.079 1.00 27.15 C ATOM 1496 CG ASP A 97 10.169 33.606 11.136 1.00 27.81 C ATOM 1497 OD1 ASP A 97 9.497 34.609 10.815 1.00 28.07 O ATOM 1498 OD2 ASP A 97 10.166 33.118 12.287 1.00 28.13 O ATOM 0 H ASP A 97 9.400 31.192 10.837 1.00 25.28 H new ATOM 0 HA ASP A 97 9.731 32.707 8.387 1.00 25.89 H new ATOM 0 HB2 ASP A 97 11.797 32.341 10.566 1.00 27.15 H new ATOM 0 HB3 ASP A 97 11.554 33.718 9.510 1.00 27.15 H new ATOM 1503 N GLY A 98 10.920 29.817 8.578 1.00 24.03 N ATOM 1504 CA GLY A 98 11.746 28.808 7.944 1.00 23.27 C ATOM 1505 C GLY A 98 12.812 28.283 8.884 1.00 23.53 C ATOM 1506 O GLY A 98 13.483 27.295 8.585 1.00 22.95 O ATOM 0 H GLY A 98 10.164 29.449 9.156 1.00 24.03 H new ATOM 0 HA2 GLY A 98 11.118 27.982 7.609 1.00 23.27 H new ATOM 0 HA3 GLY A 98 12.219 29.230 7.057 1.00 23.27 H new ATOM 1510 N PHE A 99 12.978 28.965 10.013 1.00 24.50 N ATOM 1511 CA PHE A 99 13.957 28.571 11.020 1.00 24.94 C ATOM 1512 C PHE A 99 13.451 28.830 12.441 1.00 25.47 C ATOM 1513 O PHE A 99 12.807 29.849 12.718 1.00 26.19 O ATOM 1514 CB PHE A 99 15.285 29.293 10.775 1.00 25.98 C ATOM 1515 CG PHE A 99 15.145 30.593 10.037 1.00 26.68 C ATOM 1516 CD1 PHE A 99 14.688 31.720 10.699 1.00 27.05 C ATOM 1517 CD2 PHE A 99 15.469 30.692 8.694 1.00 27.04 C ATOM 1518 CE1 PHE A 99 14.555 32.924 10.038 1.00 27.77 C ATOM 1519 CE2 PHE A 99 15.340 31.896 8.025 1.00 27.76 C ATOM 1520 CZ PHE A 99 14.886 32.983 8.643 1.00 28.11 C ATOM 0 H PHE A 99 12.443 29.799 10.254 1.00 24.50 H new ATOM 0 HA PHE A 99 14.116 27.497 10.928 1.00 24.94 H new ATOM 0 HB2 PHE A 99 15.767 29.481 11.734 1.00 25.98 H new ATOM 0 HB3 PHE A 99 15.946 28.635 10.210 1.00 25.98 H new ATOM 0 HD1 PHE A 99 14.432 31.656 11.746 1.00 27.05 H new ATOM 0 HD2 PHE A 99 15.826 29.821 8.164 1.00 27.04 H new ATOM 0 HE1 PHE A 99 14.209 33.804 10.560 1.00 27.77 H new ATOM 0 HE2 PHE A 99 15.613 31.955 6.982 1.00 27.76 H new ATOM 0 HZ PHE A 99 14.767 33.907 8.097 1.00 28.11 H new ATOM 1530 N ILE A 100 13.743 27.882 13.332 1.00 25.18 N ATOM 1531 CA ILE A 100 13.342 27.971 14.729 1.00 25.71 C ATOM 1532 C ILE A 100 14.415 28.656 15.562 1.00 26.98 C ATOM 1533 O ILE A 100 15.514 28.127 15.731 1.00 27.09 O ATOM 1534 CB ILE A 100 13.105 26.572 15.333 1.00 24.88 C ATOM 1535 CG1 ILE A 100 12.173 25.742 14.454 1.00 23.56 C ATOM 1536 CG2 ILE A 100 12.538 26.690 16.738 1.00 25.54 C ATOM 1537 CD1 ILE A 100 12.336 24.252 14.657 1.00 22.62 C ATOM 0 H ILE A 100 14.263 27.035 13.103 1.00 25.18 H new ATOM 0 HA ILE A 100 12.418 28.550 14.752 1.00 25.71 H new ATOM 0 HB ILE A 100 14.067 26.061 15.383 1.00 24.88 H new ATOM 0 HG12 ILE A 100 11.141 26.021 14.665 1.00 23.56 H new ATOM 0 HG13 ILE A 100 12.360 25.983 13.408 1.00 23.56 H new ATOM 0 HG21 ILE A 100 12.376 25.694 17.150 1.00 25.54 H new ATOM 0 HG22 ILE A 100 13.240 27.234 17.369 1.00 25.54 H new ATOM 0 HG23 ILE A 100 11.590 27.227 16.704 1.00 25.54 H new ATOM 0 HD11 ILE A 100 11.646 23.718 14.004 1.00 22.62 H new ATOM 0 HD12 ILE A 100 13.359 23.962 14.418 1.00 22.62 H new ATOM 0 HD13 ILE A 100 12.120 24.001 15.695 1.00 22.62 H new ATOM 1549 N SER A 101 14.095 29.829 16.084 1.00 27.98 N ATOM 1550 CA SER A 101 15.029 30.565 16.921 1.00 29.24 C ATOM 1551 C SER A 101 15.016 29.993 18.338 1.00 29.53 C ATOM 1552 O SER A 101 14.004 29.445 18.769 1.00 29.01 O ATOM 1553 CB SER A 101 14.656 32.046 16.938 1.00 30.23 C ATOM 1554 OG SER A 101 15.359 32.745 17.950 1.00 31.40 O ATOM 0 H SER A 101 13.197 30.292 15.943 1.00 27.98 H new ATOM 0 HA SER A 101 16.035 30.465 16.513 1.00 29.24 H new ATOM 0 HB2 SER A 101 14.877 32.489 15.967 1.00 30.23 H new ATOM 0 HB3 SER A 101 13.583 32.151 17.100 1.00 30.23 H new ATOM 0 HG SER A 101 15.100 33.690 17.935 1.00 31.40 H new ATOM 1560 N PRO A 102 16.141 30.092 19.075 1.00 30.40 N ATOM 1561 CA PRO A 102 16.241 29.580 20.444 1.00 30.84 C ATOM 1562 C PRO A 102 14.959 29.769 21.254 1.00 31.00 C ATOM 1563 O PRO A 102 14.476 28.834 21.888 1.00 30.80 O ATOM 1564 CB PRO A 102 17.377 30.415 21.022 1.00 32.14 C ATOM 1565 CG PRO A 102 18.287 30.648 19.864 1.00 32.10 C ATOM 1566 CD PRO A 102 17.413 30.699 18.633 1.00 31.10 C ATOM 0 HA PRO A 102 16.411 28.504 20.470 1.00 30.84 H new ATOM 0 HB2 PRO A 102 17.010 31.355 21.435 1.00 32.14 H new ATOM 0 HB3 PRO A 102 17.887 29.889 21.829 1.00 32.14 H new ATOM 0 HG2 PRO A 102 18.839 31.580 19.986 1.00 32.10 H new ATOM 0 HG3 PRO A 102 19.024 29.849 19.783 1.00 32.10 H new ATOM 0 HD2 PRO A 102 17.268 31.723 18.288 1.00 31.10 H new ATOM 0 HD3 PRO A 102 17.855 30.143 17.806 1.00 31.10 H new ATOM 1574 N ALA A 103 14.402 30.975 21.216 1.00 31.44 N ATOM 1575 CA ALA A 103 13.178 31.273 21.957 1.00 31.71 C ATOM 1576 C ALA A 103 12.038 30.340 21.553 1.00 30.52 C ATOM 1577 O ALA A 103 11.282 29.868 22.397 1.00 30.50 O ATOM 1578 CB ALA A 103 12.772 32.722 21.741 1.00 32.55 C ATOM 0 H ALA A 103 14.776 31.760 20.683 1.00 31.44 H new ATOM 0 HA ALA A 103 13.382 31.113 23.016 1.00 31.71 H new ATOM 0 HB1 ALA A 103 11.859 32.931 22.298 1.00 32.55 H new ATOM 0 HB2 ALA A 103 13.569 33.379 22.090 1.00 32.55 H new ATOM 0 HB3 ALA A 103 12.597 32.896 20.679 1.00 32.55 H new ATOM 1584 N GLU A 104 11.932 30.075 20.257 1.00 29.57 N ATOM 1585 CA GLU A 104 10.886 29.204 19.723 1.00 28.37 C ATOM 1586 C GLU A 104 11.144 27.739 20.069 1.00 27.59 C ATOM 1587 O GLU A 104 10.239 27.021 20.498 1.00 27.15 O ATOM 1588 CB GLU A 104 10.815 29.358 18.208 1.00 27.67 C ATOM 1589 CG GLU A 104 10.888 30.795 17.730 1.00 28.56 C ATOM 1590 CD GLU A 104 11.004 30.885 16.224 1.00 28.05 C ATOM 1591 OE1 GLU A 104 10.327 30.103 15.525 1.00 28.09 O ATOM 1592 OE2 GLU A 104 11.777 31.740 15.742 1.00 27.67 O ATOM 0 H GLU A 104 12.562 30.453 19.549 1.00 29.57 H new ATOM 0 HA GLU A 104 9.940 29.500 20.177 1.00 28.37 H new ATOM 0 HB2 GLU A 104 11.632 28.794 17.757 1.00 27.67 H new ATOM 0 HB3 GLU A 104 9.886 28.914 17.851 1.00 27.67 H new ATOM 0 HG2 GLU A 104 9.998 31.332 18.058 1.00 28.56 H new ATOM 0 HG3 GLU A 104 11.745 31.287 18.190 1.00 28.56 H new ATOM 1599 N LEU A 105 12.387 27.309 19.894 1.00 27.51 N ATOM 1600 CA LEU A 105 12.767 25.927 20.155 1.00 26.86 C ATOM 1601 C LEU A 105 12.557 25.552 21.620 1.00 27.51 C ATOM 1602 O LEU A 105 11.842 24.599 21.922 1.00 26.94 O ATOM 1603 CB LEU A 105 14.231 25.708 19.762 1.00 26.95 C ATOM 1604 CG LEU A 105 14.779 24.305 20.024 1.00 26.49 C ATOM 1605 CD1 LEU A 105 14.128 23.291 19.094 1.00 25.10 C ATOM 1606 CD2 LEU A 105 16.290 24.290 19.860 1.00 26.84 C ATOM 0 H LEU A 105 13.152 27.901 19.571 1.00 27.51 H new ATOM 0 HA LEU A 105 12.126 25.283 19.553 1.00 26.86 H new ATOM 0 HB2 LEU A 105 14.341 25.930 18.701 1.00 26.95 H new ATOM 0 HB3 LEU A 105 14.846 26.427 20.304 1.00 26.95 H new ATOM 0 HG LEU A 105 14.539 24.026 21.050 1.00 26.49 H new ATOM 0 HD11 LEU A 105 14.532 22.299 19.297 1.00 25.10 H new ATOM 0 HD12 LEU A 105 13.051 23.285 19.259 1.00 25.10 H new ATOM 0 HD13 LEU A 105 14.334 23.562 18.059 1.00 25.10 H new ATOM 0 HD21 LEU A 105 16.667 23.285 20.050 1.00 26.84 H new ATOM 0 HD22 LEU A 105 16.549 24.589 18.844 1.00 26.84 H new ATOM 0 HD23 LEU A 105 16.740 24.986 20.569 1.00 26.84 H new ATOM 1618 N ARG A 106 13.173 26.308 22.521 1.00 28.76 N ATOM 1619 CA ARG A 106 13.064 26.043 23.954 1.00 29.56 C ATOM 1620 C ARG A 106 11.627 26.140 24.445 1.00 29.58 C ATOM 1621 O ARG A 106 11.092 25.203 25.027 1.00 29.39 O ATOM 1622 CB ARG A 106 13.908 27.044 24.740 1.00 30.94 C ATOM 1623 CG ARG A 106 15.334 27.169 24.247 1.00 31.13 C ATOM 1624 CD ARG A 106 16.134 28.126 25.114 1.00 32.40 C ATOM 1625 NE ARG A 106 15.693 29.508 24.951 1.00 32.96 N ATOM 1626 CZ ARG A 106 15.892 30.460 25.858 1.00 33.97 C ATOM 1627 NH1 ARG A 106 16.521 30.180 26.991 1.00 34.53 N ATOM 1628 NH2 ARG A 106 15.463 31.695 25.631 1.00 34.47 N ATOM 0 H ARG A 106 13.755 27.112 22.286 1.00 28.76 H new ATOM 0 HA ARG A 106 13.422 25.026 24.116 1.00 29.56 H new ATOM 0 HB2 ARG A 106 13.431 28.023 24.692 1.00 30.94 H new ATOM 0 HB3 ARG A 106 13.922 26.747 25.789 1.00 30.94 H new ATOM 0 HG2 ARG A 106 15.810 26.188 24.249 1.00 31.13 H new ATOM 0 HG3 ARG A 106 15.335 27.521 23.216 1.00 31.13 H new ATOM 0 HD2 ARG A 106 16.037 27.835 26.160 1.00 32.40 H new ATOM 0 HD3 ARG A 106 17.191 28.050 24.859 1.00 32.40 H new ATOM 0 HE ARG A 106 15.204 29.758 24.092 1.00 32.96 H new ATOM 0 HH11 ARG A 106 16.854 29.232 27.169 1.00 34.53 H new ATOM 0 HH12 ARG A 106 16.672 30.912 27.685 1.00 34.53 H new ATOM 0 HH21 ARG A 106 14.980 31.915 24.760 1.00 34.47 H new ATOM 0 HH22 ARG A 106 15.616 32.424 26.328 1.00 34.47 H new ATOM 1642 N PHE A 107 11.016 27.284 24.197 1.00 29.92 N ATOM 1643 CA PHE A 107 9.649 27.556 24.643 1.00 30.13 C ATOM 1644 C PHE A 107 8.675 26.444 24.273 1.00 29.04 C ATOM 1645 O PHE A 107 7.744 26.162 25.025 1.00 29.31 O ATOM 1646 CB PHE A 107 9.154 28.886 24.071 1.00 30.44 C ATOM 1647 CG PHE A 107 7.785 29.279 24.554 1.00 30.81 C ATOM 1648 CD1 PHE A 107 7.513 29.376 25.911 1.00 30.89 C ATOM 1649 CD2 PHE A 107 6.770 29.555 23.652 1.00 31.17 C ATOM 1650 CE1 PHE A 107 6.256 29.738 26.357 1.00 31.32 C ATOM 1651 CE2 PHE A 107 5.511 29.918 24.092 1.00 31.59 C ATOM 1652 CZ PHE A 107 5.254 30.009 25.446 1.00 31.68 C ATOM 0 H PHE A 107 11.446 28.053 23.683 1.00 29.92 H new ATOM 0 HA PHE A 107 9.683 27.611 25.731 1.00 30.13 H new ATOM 0 HB2 PHE A 107 9.862 29.671 24.335 1.00 30.44 H new ATOM 0 HB3 PHE A 107 9.141 28.821 22.983 1.00 30.44 H new ATOM 0 HD1 PHE A 107 8.293 29.166 26.628 1.00 30.89 H new ATOM 0 HD2 PHE A 107 6.965 29.486 22.592 1.00 31.17 H new ATOM 0 HE1 PHE A 107 6.058 29.809 27.416 1.00 31.32 H new ATOM 0 HE2 PHE A 107 4.729 30.130 23.378 1.00 31.59 H new ATOM 0 HZ PHE A 107 4.271 30.292 25.792 1.00 31.68 H new ATOM 1662 N VAL A 108 8.888 25.804 23.131 1.00 27.85 N ATOM 1663 CA VAL A 108 7.987 24.744 22.696 1.00 26.77 C ATOM 1664 C VAL A 108 8.349 23.395 23.317 1.00 26.50 C ATOM 1665 O VAL A 108 7.483 22.703 23.852 1.00 26.41 O ATOM 1666 CB VAL A 108 7.962 24.616 21.161 1.00 25.58 C ATOM 1667 CG1 VAL A 108 7.209 23.366 20.743 1.00 24.43 C ATOM 1668 CG2 VAL A 108 7.337 25.852 20.531 1.00 25.89 C ATOM 0 H VAL A 108 9.664 25.996 22.497 1.00 27.85 H new ATOM 0 HA VAL A 108 6.993 25.027 23.042 1.00 26.77 H new ATOM 0 HB VAL A 108 8.990 24.533 20.807 1.00 25.58 H new ATOM 0 HG11 VAL A 108 7.202 23.292 19.656 1.00 24.43 H new ATOM 0 HG12 VAL A 108 7.700 22.488 21.163 1.00 24.43 H new ATOM 0 HG13 VAL A 108 6.184 23.419 21.110 1.00 24.43 H new ATOM 0 HG21 VAL A 108 7.328 25.743 19.447 1.00 25.89 H new ATOM 0 HG22 VAL A 108 6.315 25.967 20.892 1.00 25.89 H new ATOM 0 HG23 VAL A 108 7.919 26.733 20.802 1.00 25.89 H new ATOM 1678 N MET A 109 9.621 23.024 23.246 1.00 26.48 N ATOM 1679 CA MET A 109 10.070 21.749 23.798 1.00 26.33 C ATOM 1680 C MET A 109 9.919 21.712 25.317 1.00 27.50 C ATOM 1681 O MET A 109 9.798 20.643 25.912 1.00 27.46 O ATOM 1682 CB MET A 109 11.523 21.487 23.408 1.00 26.26 C ATOM 1683 CG MET A 109 12.497 22.535 23.918 1.00 27.48 C ATOM 1684 SD MET A 109 14.076 22.478 23.053 1.00 27.39 S ATOM 1685 CE MET A 109 14.592 20.797 23.392 1.00 26.90 C ATOM 0 H MET A 109 10.357 23.583 22.815 1.00 26.48 H new ATOM 0 HA MET A 109 9.439 20.965 23.380 1.00 26.33 H new ATOM 0 HB2 MET A 109 11.821 20.511 23.791 1.00 26.26 H new ATOM 0 HB3 MET A 109 11.594 21.438 22.321 1.00 26.26 H new ATOM 0 HG2 MET A 109 12.056 23.525 23.801 1.00 27.48 H new ATOM 0 HG3 MET A 109 12.664 22.385 24.985 1.00 27.48 H new ATOM 0 HE1 MET A 109 15.656 20.784 23.629 1.00 26.90 H new ATOM 0 HE2 MET A 109 14.027 20.406 24.238 1.00 26.90 H new ATOM 0 HE3 MET A 109 14.408 20.176 22.515 1.00 26.90 H new ATOM 1695 N ILE A 110 9.931 22.886 25.936 1.00 28.57 N ATOM 1696 CA ILE A 110 9.797 22.991 27.384 1.00 29.77 C ATOM 1697 C ILE A 110 8.331 23.064 27.797 1.00 29.90 C ATOM 1698 O ILE A 110 7.946 22.538 28.842 1.00 30.43 O ATOM 1699 CB ILE A 110 10.537 24.231 27.921 1.00 30.96 C ATOM 1700 CG1 ILE A 110 12.029 24.144 27.587 1.00 31.00 C ATOM 1701 CG2 ILE A 110 10.333 24.363 29.425 1.00 32.20 C ATOM 1702 CD1 ILE A 110 12.782 25.438 27.820 1.00 32.05 C ATOM 0 H ILE A 110 10.032 23.781 25.457 1.00 28.57 H new ATOM 0 HA ILE A 110 10.244 22.094 27.813 1.00 29.77 H new ATOM 0 HB ILE A 110 10.125 25.118 27.440 1.00 30.96 H new ATOM 0 HG12 ILE A 110 12.482 23.357 28.190 1.00 31.00 H new ATOM 0 HG13 ILE A 110 12.142 23.851 26.543 1.00 31.00 H new ATOM 0 HG21 ILE A 110 10.862 25.244 29.788 1.00 32.20 H new ATOM 0 HG22 ILE A 110 9.269 24.464 29.640 1.00 32.20 H new ATOM 0 HG23 ILE A 110 10.721 23.475 29.924 1.00 32.20 H new ATOM 0 HD11 ILE A 110 13.832 25.300 27.562 1.00 32.05 H new ATOM 0 HD12 ILE A 110 12.356 26.224 27.197 1.00 32.05 H new ATOM 0 HD13 ILE A 110 12.701 25.722 28.869 1.00 32.05 H new ATOM 1714 N ASN A 111 7.516 23.716 26.972 1.00 29.51 N ATOM 1715 CA ASN A 111 6.091 23.849 27.262 1.00 29.69 C ATOM 1716 C ASN A 111 5.432 22.474 27.305 1.00 28.92 C ATOM 1717 O ASN A 111 4.592 22.204 28.164 1.00 29.42 O ATOM 1718 CB ASN A 111 5.401 24.728 26.217 1.00 29.42 C ATOM 1719 CG ASN A 111 4.063 25.257 26.697 1.00 30.42 C ATOM 1720 OD1 ASN A 111 4.002 25.650 27.964 1.00 30.38 O flip ATOM 1721 ND2 ASN A 111 3.100 25.326 25.934 1.00 31.39 N flip ATOM 0 H ASN A 111 7.815 24.158 26.103 1.00 29.51 H new ATOM 0 HA ASN A 111 5.985 24.326 28.236 1.00 29.69 H new ATOM 0 HB2 ASN A 111 6.051 25.566 25.966 1.00 29.42 H new ATOM 0 HB3 ASN A 111 5.254 24.153 25.303 1.00 29.42 H new ATOM 0 HD21 ASN A 111 3.191 25.013 24.968 1.00 31.39 H new ATOM 0 HD22 ASN A 111 2.210 25.697 26.268 1.00 31.39 H new ATOM 1728 N LEU A 112 5.817 21.609 26.371 1.00 27.75 N ATOM 1729 CA LEU A 112 5.273 20.256 26.316 1.00 26.97 C ATOM 1730 C LEU A 112 5.698 19.464 27.550 1.00 27.67 C ATOM 1731 O LEU A 112 5.178 18.381 27.820 1.00 27.59 O ATOM 1732 CB LEU A 112 5.701 19.544 25.026 1.00 25.59 C ATOM 1733 CG LEU A 112 7.197 19.262 24.880 1.00 25.50 C ATOM 1734 CD1 LEU A 112 7.559 17.937 25.535 1.00 25.51 C ATOM 1735 CD2 LEU A 112 7.592 19.254 23.411 1.00 24.36 C ATOM 0 H LEU A 112 6.501 21.820 25.644 1.00 27.75 H new ATOM 0 HA LEU A 112 4.185 20.321 26.310 1.00 26.97 H new ATOM 0 HB2 LEU A 112 5.165 18.597 24.962 1.00 25.59 H new ATOM 0 HB3 LEU A 112 5.381 20.149 24.178 1.00 25.59 H new ATOM 0 HG LEU A 112 7.748 20.055 25.385 1.00 25.50 H new ATOM 0 HD11 LEU A 112 8.627 17.754 25.420 1.00 25.51 H new ATOM 0 HD12 LEU A 112 7.309 17.975 26.595 1.00 25.51 H new ATOM 0 HD13 LEU A 112 7.000 17.131 25.059 1.00 25.51 H new ATOM 0 HD21 LEU A 112 8.659 19.052 23.322 1.00 24.36 H new ATOM 0 HD22 LEU A 112 7.031 18.479 22.888 1.00 24.36 H new ATOM 0 HD23 LEU A 112 7.368 20.225 22.969 1.00 24.36 H new ATOM 1747 N GLY A 113 6.651 20.024 28.293 1.00 28.44 N ATOM 1748 CA GLY A 113 7.144 19.383 29.500 1.00 29.23 C ATOM 1749 C GLY A 113 8.410 18.571 29.289 1.00 29.21 C ATOM 1750 O GLY A 113 8.357 17.401 28.912 1.00 29.01 O ATOM 0 H GLY A 113 7.093 20.918 28.077 1.00 28.44 H new ATOM 0 HA2 GLY A 113 7.335 20.147 30.254 1.00 29.23 H new ATOM 0 HA3 GLY A 113 6.367 18.730 29.897 1.00 29.23 H new ATOM 1754 N GLU A 114 9.551 19.210 29.543 1.00 29.51 N ATOM 1755 CA GLU A 114 10.856 18.564 29.410 1.00 29.65 C ATOM 1756 C GLU A 114 11.858 19.117 30.415 1.00 30.86 C ATOM 1757 O GLU A 114 12.682 18.380 30.955 1.00 31.02 O ATOM 1758 CB GLU A 114 11.404 18.718 27.989 1.00 28.56 C ATOM 1759 CG GLU A 114 10.679 17.867 26.962 1.00 27.33 C ATOM 1760 CD GLU A 114 11.384 17.845 25.619 1.00 26.52 C ATOM 1761 OE1 GLU A 114 12.366 17.086 25.478 1.00 26.29 O ATOM 1762 OE2 GLU A 114 10.953 18.584 24.710 1.00 26.19 O ATOM 0 H GLU A 114 9.597 20.183 29.845 1.00 29.51 H new ATOM 0 HA GLU A 114 10.712 17.504 29.618 1.00 29.65 H new ATOM 0 HB2 GLU A 114 11.336 19.765 27.694 1.00 28.56 H new ATOM 0 HB3 GLU A 114 12.462 18.454 27.986 1.00 28.56 H new ATOM 0 HG2 GLU A 114 10.590 16.848 27.338 1.00 27.33 H new ATOM 0 HG3 GLU A 114 9.666 18.248 26.830 1.00 27.33 H new ATOM 1769 N LYS A 115 11.778 20.411 30.651 1.00 31.76 N ATOM 1770 CA LYS A 115 12.669 21.087 31.590 1.00 32.97 C ATOM 1771 C LYS A 115 14.115 20.938 31.147 1.00 32.97 C ATOM 1772 O LYS A 115 14.914 20.256 31.792 1.00 33.55 O ATOM 1773 CB LYS A 115 12.485 20.536 33.008 1.00 34.07 C ATOM 1774 CG LYS A 115 11.187 20.969 33.675 1.00 34.37 C ATOM 1775 CD LYS A 115 9.977 20.301 33.040 1.00 34.03 C ATOM 1776 CE LYS A 115 8.691 20.688 33.753 1.00 34.21 C ATOM 1777 NZ LYS A 115 8.693 20.258 35.179 1.00 34.46 N ATOM 0 H LYS A 115 11.099 21.027 30.203 1.00 31.76 H new ATOM 0 HA LYS A 115 12.414 22.147 31.601 1.00 32.97 H new ATOM 0 HB2 LYS A 115 12.517 19.447 32.971 1.00 34.07 H new ATOM 0 HB3 LYS A 115 13.324 20.859 33.624 1.00 34.07 H new ATOM 0 HG2 LYS A 115 11.223 20.722 34.736 1.00 34.37 H new ATOM 0 HG3 LYS A 115 11.084 22.052 33.603 1.00 34.37 H new ATOM 0 HD2 LYS A 115 9.912 20.585 31.990 1.00 34.03 H new ATOM 0 HD3 LYS A 115 10.100 19.218 33.070 1.00 34.03 H new ATOM 0 HE2 LYS A 115 8.558 21.769 33.700 1.00 34.21 H new ATOM 0 HE3 LYS A 115 7.842 20.237 33.239 1.00 34.21 H new ATOM 0 HZ1 LYS A 115 7.726 20.306 35.557 1.00 34.46 H new ATOM 0 HZ2 LYS A 115 9.043 19.281 35.246 1.00 34.46 H new ATOM 0 HZ3 LYS A 115 9.312 20.886 35.730 1.00 34.46 H new ATOM 1791 N VAL A 116 14.438 21.581 30.032 1.00 32.39 N ATOM 1792 CA VAL A 116 15.781 21.529 29.480 1.00 32.39 C ATOM 1793 C VAL A 116 16.603 22.738 29.912 1.00 33.53 C ATOM 1794 O VAL A 116 16.066 23.823 30.137 1.00 33.96 O ATOM 1795 CB VAL A 116 15.743 21.472 27.941 1.00 31.13 C ATOM 1796 CG1 VAL A 116 14.693 20.480 27.465 1.00 29.96 C ATOM 1797 CG2 VAL A 116 15.486 22.851 27.354 1.00 31.21 C ATOM 0 H VAL A 116 13.783 22.146 29.492 1.00 32.39 H new ATOM 0 HA VAL A 116 16.250 20.623 29.864 1.00 32.39 H new ATOM 0 HB VAL A 116 16.717 21.132 27.591 1.00 31.13 H new ATOM 0 HG11 VAL A 116 14.683 20.456 26.375 1.00 29.96 H new ATOM 0 HG12 VAL A 116 14.930 19.487 27.848 1.00 29.96 H new ATOM 0 HG13 VAL A 116 13.712 20.785 27.830 1.00 29.96 H new ATOM 0 HG21 VAL A 116 15.464 22.785 26.266 1.00 31.21 H new ATOM 0 HG22 VAL A 116 14.529 23.227 27.714 1.00 31.21 H new ATOM 0 HG23 VAL A 116 16.281 23.531 27.660 1.00 31.21 H new ATOM 1807 N THR A 117 17.906 22.536 30.032 1.00 34.07 N ATOM 1808 CA THR A 117 18.813 23.608 30.418 1.00 35.18 C ATOM 1809 C THR A 117 19.290 24.374 29.189 1.00 34.78 C ATOM 1810 O THR A 117 19.476 23.791 28.123 1.00 33.80 O ATOM 1811 CB THR A 117 20.035 23.066 31.182 1.00 36.10 C ATOM 1812 OG1 THR A 117 20.681 22.045 30.411 1.00 35.42 O ATOM 1813 CG2 THR A 117 19.627 22.504 32.534 1.00 36.81 C ATOM 0 H THR A 117 18.361 21.638 29.867 1.00 34.07 H new ATOM 0 HA THR A 117 18.260 24.278 31.076 1.00 35.18 H new ATOM 0 HB THR A 117 20.727 23.892 31.346 1.00 36.10 H new ATOM 0 HG1 THR A 117 21.356 21.597 30.962 1.00 35.42 H new ATOM 0 HG21 THR A 117 20.509 22.128 33.053 1.00 36.81 H new ATOM 0 HG22 THR A 117 19.163 23.290 33.130 1.00 36.81 H new ATOM 0 HG23 THR A 117 18.916 21.690 32.390 1.00 36.81 H new ATOM 1821 N ASP A 118 19.484 25.679 29.342 1.00 35.59 N ATOM 1822 CA ASP A 118 19.937 26.518 28.239 1.00 35.40 C ATOM 1823 C ASP A 118 21.161 25.912 27.561 1.00 35.21 C ATOM 1824 O ASP A 118 21.288 25.949 26.337 1.00 34.50 O ATOM 1825 CB ASP A 118 20.265 27.924 28.743 1.00 36.59 C ATOM 1826 CG ASP A 118 19.084 28.585 29.424 1.00 36.85 C ATOM 1827 OD1 ASP A 118 18.837 28.286 30.611 1.00 37.02 O ATOM 1828 OD2 ASP A 118 18.405 29.404 28.770 1.00 36.95 O ATOM 0 H ASP A 118 19.335 26.179 30.219 1.00 35.59 H new ATOM 0 HA ASP A 118 19.131 26.579 27.507 1.00 35.40 H new ATOM 0 HB2 ASP A 118 21.100 27.871 29.441 1.00 36.59 H new ATOM 0 HB3 ASP A 118 20.589 28.541 27.905 1.00 36.59 H new ATOM 1833 N GLU A 119 22.059 25.355 28.365 1.00 35.91 N ATOM 1834 CA GLU A 119 23.277 24.743 27.849 1.00 35.91 C ATOM 1835 C GLU A 119 22.970 23.622 26.857 1.00 34.60 C ATOM 1836 O GLU A 119 23.629 23.503 25.823 1.00 34.24 O ATOM 1837 CB GLU A 119 24.131 24.208 29.000 1.00 36.90 C ATOM 1838 CG GLU A 119 23.412 23.199 29.878 1.00 36.71 C ATOM 1839 CD GLU A 119 24.281 22.690 31.011 1.00 37.77 C ATOM 1840 OE1 GLU A 119 25.022 21.708 30.796 1.00 38.22 O ATOM 1841 OE2 GLU A 119 24.221 23.274 32.114 1.00 38.19 O ATOM 0 H GLU A 119 21.966 25.315 29.380 1.00 35.91 H new ATOM 0 HA GLU A 119 23.833 25.515 27.317 1.00 35.91 H new ATOM 0 HB2 GLU A 119 25.028 23.745 28.590 1.00 36.90 H new ATOM 0 HB3 GLU A 119 24.458 25.045 29.617 1.00 36.90 H new ATOM 0 HG2 GLU A 119 22.514 23.657 30.291 1.00 36.71 H new ATOM 0 HG3 GLU A 119 23.088 22.357 29.267 1.00 36.71 H new ATOM 1848 N GLU A 120 21.974 22.795 27.166 1.00 33.92 N ATOM 1849 CA GLU A 120 21.614 21.701 26.275 1.00 32.68 C ATOM 1850 C GLU A 120 21.035 22.269 24.986 1.00 31.73 C ATOM 1851 O GLU A 120 21.238 21.722 23.902 1.00 30.88 O ATOM 1852 CB GLU A 120 20.624 20.741 26.952 1.00 32.23 C ATOM 1853 CG GLU A 120 19.163 21.145 26.816 1.00 31.98 C ATOM 1854 CD GLU A 120 18.476 20.461 25.649 1.00 31.39 C ATOM 1855 OE1 GLU A 120 18.527 21.009 24.528 1.00 31.34 O ATOM 1856 OE2 GLU A 120 17.887 19.380 25.856 1.00 31.03 O ATOM 0 H GLU A 120 21.411 22.861 28.014 1.00 33.92 H new ATOM 0 HA GLU A 120 22.509 21.126 26.038 1.00 32.68 H new ATOM 0 HB2 GLU A 120 20.754 19.746 26.527 1.00 32.23 H new ATOM 0 HB3 GLU A 120 20.872 20.671 28.011 1.00 32.23 H new ATOM 0 HG2 GLU A 120 18.635 20.901 27.738 1.00 31.98 H new ATOM 0 HG3 GLU A 120 19.099 22.226 26.688 1.00 31.98 H new ATOM 1863 N ILE A 121 20.310 23.374 25.123 1.00 31.93 N ATOM 1864 CA ILE A 121 19.712 24.047 23.981 1.00 31.19 C ATOM 1865 C ILE A 121 20.786 24.538 23.008 1.00 31.38 C ATOM 1866 O ILE A 121 20.713 24.267 21.812 1.00 30.48 O ATOM 1867 CB ILE A 121 18.835 25.239 24.433 1.00 31.66 C ATOM 1868 CG1 ILE A 121 17.567 24.738 25.137 1.00 31.30 C ATOM 1869 CG2 ILE A 121 18.474 26.127 23.251 1.00 31.21 C ATOM 1870 CD1 ILE A 121 16.759 23.756 24.315 1.00 29.89 C ATOM 0 H ILE A 121 20.123 23.823 26.020 1.00 31.93 H new ATOM 0 HA ILE A 121 19.080 23.320 23.470 1.00 31.19 H new ATOM 0 HB ILE A 121 19.411 25.835 25.141 1.00 31.66 H new ATOM 0 HG12 ILE A 121 17.848 24.265 26.078 1.00 31.30 H new ATOM 0 HG13 ILE A 121 16.938 25.593 25.385 1.00 31.30 H new ATOM 0 HG21 ILE A 121 17.857 26.957 23.595 1.00 31.21 H new ATOM 0 HG22 ILE A 121 19.385 26.516 22.796 1.00 31.21 H new ATOM 0 HG23 ILE A 121 17.920 25.545 22.514 1.00 31.21 H new ATOM 0 HD11 ILE A 121 15.879 23.447 24.879 1.00 29.89 H new ATOM 0 HD12 ILE A 121 16.446 24.231 23.385 1.00 29.89 H new ATOM 0 HD13 ILE A 121 17.370 22.882 24.089 1.00 29.89 H new ATOM 1882 N ASP A 122 21.775 25.268 23.520 1.00 32.59 N ATOM 1883 CA ASP A 122 22.843 25.781 22.669 1.00 32.95 C ATOM 1884 C ASP A 122 23.583 24.641 21.979 1.00 32.41 C ATOM 1885 O ASP A 122 24.080 24.796 20.863 1.00 32.19 O ATOM 1886 CB ASP A 122 23.832 26.630 23.481 1.00 34.41 C ATOM 1887 CG ASP A 122 24.886 25.804 24.196 1.00 35.02 C ATOM 1888 OD1 ASP A 122 25.782 25.261 23.514 1.00 35.33 O ATOM 1889 OD2 ASP A 122 24.824 25.712 25.437 1.00 35.24 O ATOM 0 H ASP A 122 21.858 25.514 24.506 1.00 32.59 H new ATOM 0 HA ASP A 122 22.384 26.412 21.908 1.00 32.95 H new ATOM 0 HB2 ASP A 122 24.325 27.338 22.815 1.00 34.41 H new ATOM 0 HB3 ASP A 122 23.279 27.216 24.216 1.00 34.41 H new ATOM 1894 N GLU A 123 23.648 23.494 22.653 1.00 32.28 N ATOM 1895 CA GLU A 123 24.336 22.323 22.118 1.00 31.88 C ATOM 1896 C GLU A 123 23.671 21.813 20.842 1.00 30.51 C ATOM 1897 O GLU A 123 24.321 21.681 19.805 1.00 30.32 O ATOM 1898 CB GLU A 123 24.360 21.210 23.167 1.00 32.05 C ATOM 1899 CG GLU A 123 25.137 19.977 22.734 1.00 31.72 C ATOM 1900 CD GLU A 123 26.607 20.265 22.498 1.00 32.49 C ATOM 1901 OE1 GLU A 123 27.393 20.172 23.465 1.00 32.95 O ATOM 1902 OE2 GLU A 123 26.972 20.586 21.347 1.00 32.69 O ATOM 0 H GLU A 123 23.231 23.352 23.573 1.00 32.28 H new ATOM 0 HA GLU A 123 25.355 22.620 21.870 1.00 31.88 H new ATOM 0 HB2 GLU A 123 24.797 21.599 24.087 1.00 32.05 H new ATOM 0 HB3 GLU A 123 23.335 20.920 23.399 1.00 32.05 H new ATOM 0 HG2 GLU A 123 25.040 19.205 23.497 1.00 31.72 H new ATOM 0 HG3 GLU A 123 24.698 19.578 21.820 1.00 31.72 H new ATOM 1909 N MET A 124 22.378 21.519 20.924 1.00 29.62 N ATOM 1910 CA MET A 124 21.639 21.018 19.769 1.00 28.28 C ATOM 1911 C MET A 124 21.678 22.013 18.610 1.00 28.13 C ATOM 1912 O MET A 124 21.922 21.627 17.468 1.00 27.52 O ATOM 1913 CB MET A 124 20.191 20.695 20.150 1.00 27.46 C ATOM 1914 CG MET A 124 19.453 21.842 20.816 1.00 28.01 C ATOM 1915 SD MET A 124 17.821 21.362 21.416 1.00 27.29 S ATOM 1916 CE MET A 124 17.058 20.776 19.905 1.00 26.32 C ATOM 0 H MET A 124 21.822 21.618 21.773 1.00 29.62 H new ATOM 0 HA MET A 124 22.124 20.099 19.439 1.00 28.28 H new ATOM 0 HB2 MET A 124 19.648 20.401 19.252 1.00 27.46 H new ATOM 0 HB3 MET A 124 20.186 19.836 20.821 1.00 27.46 H new ATOM 0 HG2 MET A 124 20.047 22.216 21.650 1.00 28.01 H new ATOM 0 HG3 MET A 124 19.348 22.663 20.106 1.00 28.01 H new ATOM 0 HE1 MET A 124 15.975 20.764 20.025 1.00 26.32 H new ATOM 0 HE2 MET A 124 17.325 21.439 19.082 1.00 26.32 H new ATOM 0 HE3 MET A 124 17.410 19.768 19.687 1.00 26.32 H new ATOM 1926 N ILE A 125 21.433 23.289 18.904 1.00 28.78 N ATOM 1927 CA ILE A 125 21.444 24.315 17.864 1.00 28.80 C ATOM 1928 C ILE A 125 22.784 24.378 17.140 1.00 29.32 C ATOM 1929 O ILE A 125 22.842 24.207 15.930 1.00 28.74 O ATOM 1930 CB ILE A 125 21.151 25.718 18.438 1.00 29.69 C ATOM 1931 CG1 ILE A 125 19.810 25.729 19.177 1.00 29.31 C ATOM 1932 CG2 ILE A 125 21.161 26.754 17.317 1.00 29.77 C ATOM 1933 CD1 ILE A 125 19.549 27.007 19.946 1.00 30.29 C ATOM 0 H ILE A 125 21.227 23.634 19.842 1.00 28.78 H new ATOM 0 HA ILE A 125 20.659 24.030 17.163 1.00 28.80 H new ATOM 0 HB ILE A 125 21.932 25.974 19.154 1.00 29.69 H new ATOM 0 HG12 ILE A 125 19.007 25.579 18.456 1.00 29.31 H new ATOM 0 HG13 ILE A 125 19.779 24.887 19.868 1.00 29.31 H new ATOM 0 HG21 ILE A 125 20.953 27.741 17.731 1.00 29.77 H new ATOM 0 HG22 ILE A 125 22.139 26.761 16.837 1.00 29.77 H new ATOM 0 HG23 ILE A 125 20.397 26.501 16.581 1.00 29.77 H new ATOM 0 HD11 ILE A 125 18.581 26.941 20.443 1.00 30.29 H new ATOM 0 HD12 ILE A 125 20.331 27.149 20.692 1.00 30.29 H new ATOM 0 HD13 ILE A 125 19.546 27.852 19.257 1.00 30.29 H new ATOM 1945 N ARG A 126 23.856 24.616 17.893 1.00 30.48 N ATOM 1946 CA ARG A 126 25.197 24.727 17.318 1.00 31.17 C ATOM 1947 C ARG A 126 25.566 23.520 16.457 1.00 30.45 C ATOM 1948 O ARG A 126 26.207 23.665 15.415 1.00 30.52 O ATOM 1949 CB ARG A 126 26.240 24.911 18.429 1.00 32.45 C ATOM 1950 CG ARG A 126 26.455 23.678 19.291 1.00 32.40 C ATOM 1951 CD ARG A 126 27.703 23.809 20.151 1.00 33.74 C ATOM 1952 NE ARG A 126 27.705 25.043 20.934 1.00 34.27 N ATOM 1953 CZ ARG A 126 28.718 25.421 21.710 1.00 35.37 C ATOM 1954 NH1 ARG A 126 29.803 24.664 21.807 1.00 36.06 N ATOM 1955 NH2 ARG A 126 28.648 26.559 22.389 1.00 35.85 N ATOM 0 H ARG A 126 23.823 24.736 18.905 1.00 30.48 H new ATOM 0 HA ARG A 126 25.192 25.603 16.669 1.00 31.17 H new ATOM 0 HB2 ARG A 126 27.190 25.195 17.977 1.00 32.45 H new ATOM 0 HB3 ARG A 126 25.932 25.738 19.068 1.00 32.45 H new ATOM 0 HG2 ARG A 126 25.586 23.524 19.930 1.00 32.40 H new ATOM 0 HG3 ARG A 126 26.542 22.798 18.654 1.00 32.40 H new ATOM 0 HD2 ARG A 126 27.771 22.954 20.823 1.00 33.74 H new ATOM 0 HD3 ARG A 126 28.586 23.784 19.513 1.00 33.74 H new ATOM 0 HE ARG A 126 26.885 25.648 20.883 1.00 34.27 H new ATOM 0 HH11 ARG A 126 29.863 23.789 21.286 1.00 36.06 H new ATOM 0 HH12 ARG A 126 30.578 24.957 22.403 1.00 36.06 H new ATOM 0 HH21 ARG A 126 27.817 27.146 22.317 1.00 35.85 H new ATOM 0 HH22 ARG A 126 29.425 26.847 22.983 1.00 35.85 H new ATOM 1969 N GLU A 127 25.161 22.332 16.892 1.00 29.84 N ATOM 1970 CA GLU A 127 25.475 21.102 16.169 1.00 29.22 C ATOM 1971 C GLU A 127 24.883 21.091 14.764 1.00 28.15 C ATOM 1972 O GLU A 127 25.572 20.765 13.797 1.00 28.09 O ATOM 1973 CB GLU A 127 24.969 19.889 16.944 1.00 28.76 C ATOM 1974 CG GLU A 127 25.684 18.598 16.577 1.00 28.80 C ATOM 1975 CD GLU A 127 25.343 17.459 17.517 1.00 28.73 C ATOM 1976 OE1 GLU A 127 24.202 17.433 18.026 1.00 28.78 O ATOM 1977 OE2 GLU A 127 26.214 16.594 17.743 1.00 28.70 O ATOM 0 H GLU A 127 24.614 22.193 17.742 1.00 29.84 H new ATOM 0 HA GLU A 127 26.560 21.056 16.075 1.00 29.22 H new ATOM 0 HB2 GLU A 127 25.091 20.072 18.012 1.00 28.76 H new ATOM 0 HB3 GLU A 127 23.901 19.769 16.761 1.00 28.76 H new ATOM 0 HG2 GLU A 127 25.418 18.316 15.558 1.00 28.80 H new ATOM 0 HG3 GLU A 127 26.761 18.766 16.591 1.00 28.80 H new ATOM 1984 N ALA A 128 23.607 21.445 14.649 1.00 27.36 N ATOM 1985 CA ALA A 128 22.938 21.447 13.356 1.00 26.33 C ATOM 1986 C ALA A 128 23.041 22.802 12.666 1.00 26.81 C ATOM 1987 O ALA A 128 22.825 22.902 11.461 1.00 26.28 O ATOM 1988 CB ALA A 128 21.480 21.043 13.516 1.00 25.22 C ATOM 0 H ALA A 128 23.020 21.732 15.432 1.00 27.36 H new ATOM 0 HA ALA A 128 23.443 20.718 12.723 1.00 26.33 H new ATOM 0 HB1 ALA A 128 20.992 21.049 12.541 1.00 25.22 H new ATOM 0 HB2 ALA A 128 21.425 20.042 13.944 1.00 25.22 H new ATOM 0 HB3 ALA A 128 20.977 21.749 14.178 1.00 25.22 H new ATOM 1994 N ASP A 129 23.375 23.839 13.428 1.00 27.88 N ATOM 1995 CA ASP A 129 23.497 25.186 12.876 1.00 28.48 C ATOM 1996 C ASP A 129 24.706 25.294 11.956 1.00 29.02 C ATOM 1997 O ASP A 129 25.723 25.893 12.308 1.00 30.17 O ATOM 1998 CB ASP A 129 23.600 26.221 13.995 1.00 29.57 C ATOM 1999 CG ASP A 129 23.488 27.638 13.473 1.00 30.10 C ATOM 2000 OD1 ASP A 129 22.580 27.897 12.656 1.00 30.56 O ATOM 2001 OD2 ASP A 129 24.313 28.489 13.879 1.00 30.12 O ATOM 0 H ASP A 129 23.566 23.774 14.428 1.00 27.88 H new ATOM 0 HA ASP A 129 22.599 25.387 12.291 1.00 28.48 H new ATOM 0 HB2 ASP A 129 22.813 26.042 14.727 1.00 29.57 H new ATOM 0 HB3 ASP A 129 24.551 26.100 14.513 1.00 29.57 H new ATOM 2006 N PHE A 130 24.584 24.703 10.778 1.00 28.23 N ATOM 2007 CA PHE A 130 25.658 24.712 9.791 1.00 28.72 C ATOM 2008 C PHE A 130 25.838 26.097 9.178 1.00 29.48 C ATOM 2009 O PHE A 130 26.960 26.524 8.908 1.00 30.47 O ATOM 2010 CB PHE A 130 25.369 23.690 8.689 1.00 27.68 C ATOM 2011 CG PHE A 130 25.124 22.301 9.209 1.00 26.94 C ATOM 2012 CD1 PHE A 130 26.100 21.639 9.936 1.00 26.44 C ATOM 2013 CD2 PHE A 130 23.921 21.655 8.966 1.00 26.82 C ATOM 2014 CE1 PHE A 130 25.883 20.359 10.411 1.00 25.82 C ATOM 2015 CE2 PHE A 130 23.698 20.375 9.439 1.00 26.23 C ATOM 2016 CZ PHE A 130 24.662 19.736 10.178 1.00 25.72 C ATOM 0 H PHE A 130 23.745 24.206 10.478 1.00 28.23 H new ATOM 0 HA PHE A 130 26.583 24.444 10.301 1.00 28.72 H new ATOM 0 HB2 PHE A 130 24.497 24.016 8.122 1.00 27.68 H new ATOM 0 HB3 PHE A 130 26.210 23.667 7.996 1.00 27.68 H new ATOM 0 HD1 PHE A 130 27.042 22.129 10.134 1.00 26.44 H new ATOM 0 HD2 PHE A 130 23.150 22.157 8.401 1.00 26.82 H new ATOM 0 HE1 PHE A 130 26.658 19.845 10.960 1.00 25.82 H new ATOM 0 HE2 PHE A 130 22.763 19.877 9.227 1.00 26.23 H new ATOM 0 HZ PHE A 130 24.472 18.751 10.578 1.00 25.72 H new ATOM 2026 N ASP A 131 24.726 26.796 8.963 1.00 29.07 N ATOM 2027 CA ASP A 131 24.768 28.131 8.374 1.00 29.81 C ATOM 2028 C ASP A 131 25.318 29.138 9.375 1.00 31.01 C ATOM 2029 O ASP A 131 25.541 30.303 9.047 1.00 31.82 O ATOM 2030 CB ASP A 131 23.372 28.583 7.959 1.00 29.11 C ATOM 2031 CG ASP A 131 22.428 27.436 7.666 1.00 27.70 C ATOM 2032 OD1 ASP A 131 22.696 26.688 6.698 1.00 27.31 O ATOM 2033 OD2 ASP A 131 21.427 27.284 8.397 1.00 27.01 O ATOM 0 H ASP A 131 23.789 26.462 9.187 1.00 29.07 H new ATOM 0 HA ASP A 131 25.415 28.083 7.498 1.00 29.81 H new ATOM 0 HB2 ASP A 131 22.948 29.199 8.752 1.00 29.11 H new ATOM 0 HB3 ASP A 131 23.451 29.213 7.073 1.00 29.11 H new ATOM 2038 N GLY A 132 25.535 28.672 10.598 1.00 31.16 N ATOM 2039 CA GLY A 132 26.031 29.534 11.651 1.00 32.30 C ATOM 2040 C GLY A 132 25.131 30.717 11.910 1.00 32.54 C ATOM 2041 O GLY A 132 25.592 31.854 12.002 1.00 33.59 O ATOM 0 H GLY A 132 25.375 27.705 10.880 1.00 31.16 H new ATOM 0 HA2 GLY A 132 26.136 28.955 12.569 1.00 32.30 H new ATOM 0 HA3 GLY A 132 27.025 29.891 11.384 1.00 32.30 H new ATOM 2045 N ASP A 133 23.836 30.443 12.038 1.00 31.60 N ATOM 2046 CA ASP A 133 22.865 31.475 12.321 1.00 31.81 C ATOM 2047 C ASP A 133 22.314 31.258 13.709 1.00 31.80 C ATOM 2048 O ASP A 133 22.343 30.148 14.240 1.00 31.29 O ATOM 2049 CB ASP A 133 21.690 31.446 11.341 1.00 30.84 C ATOM 2050 CG ASP A 133 22.032 30.859 9.995 1.00 30.25 C ATOM 2051 OD1 ASP A 133 22.988 31.366 9.368 1.00 29.45 O ATOM 2052 OD2 ASP A 133 21.354 29.901 9.569 1.00 30.65 O ATOM 0 H ASP A 133 23.441 29.507 11.948 1.00 31.60 H new ATOM 0 HA ASP A 133 23.370 32.436 12.229 1.00 31.81 H new ATOM 0 HB2 ASP A 133 20.876 30.870 11.782 1.00 30.84 H new ATOM 0 HB3 ASP A 133 21.322 32.462 11.200 1.00 30.84 H new ATOM 2057 N GLY A 134 21.812 32.317 14.288 1.00 32.44 N ATOM 2058 CA GLY A 134 21.215 32.224 15.602 1.00 32.56 C ATOM 2059 C GLY A 134 19.875 31.520 15.546 1.00 31.38 C ATOM 2060 O GLY A 134 19.036 31.695 16.428 1.00 31.48 O ATOM 0 H GLY A 134 21.802 33.250 13.877 1.00 32.44 H new ATOM 0 HA2 GLY A 134 21.885 31.684 16.271 1.00 32.56 H new ATOM 0 HA3 GLY A 134 21.087 33.223 16.018 1.00 32.56 H new ATOM 2064 N MET A 135 19.676 30.726 14.492 1.00 30.31 N ATOM 2065 CA MET A 135 18.429 29.999 14.301 1.00 29.12 C ATOM 2066 C MET A 135 18.660 28.674 13.574 1.00 28.02 C ATOM 2067 O MET A 135 19.628 28.517 12.815 1.00 28.13 O ATOM 2068 CB MET A 135 17.444 30.867 13.517 1.00 28.97 C ATOM 2069 CG MET A 135 18.080 31.600 12.346 1.00 29.26 C ATOM 2070 SD MET A 135 17.320 33.207 12.035 1.00 30.55 S ATOM 2071 CE MET A 135 17.658 34.049 13.580 1.00 31.50 C ATOM 0 H MET A 135 20.368 30.573 13.758 1.00 30.31 H new ATOM 0 HA MET A 135 18.013 29.770 15.282 1.00 29.12 H new ATOM 0 HB2 MET A 135 16.634 30.239 13.146 1.00 28.97 H new ATOM 0 HB3 MET A 135 16.997 31.596 14.193 1.00 28.97 H new ATOM 0 HG2 MET A 135 19.143 31.737 12.543 1.00 29.26 H new ATOM 0 HG3 MET A 135 17.999 30.985 11.450 1.00 29.26 H new ATOM 0 HE1 MET A 135 17.757 35.119 13.397 1.00 31.50 H new ATOM 0 HE2 MET A 135 16.838 33.874 14.277 1.00 31.50 H new ATOM 0 HE3 MET A 135 18.585 33.667 14.007 1.00 31.50 H new ATOM 2081 N ILE A 136 17.751 27.727 13.799 1.00 27.01 N ATOM 2082 CA ILE A 136 17.849 26.408 13.180 1.00 25.91 C ATOM 2083 C ILE A 136 16.926 26.297 11.973 1.00 24.90 C ATOM 2084 O ILE A 136 15.721 26.481 12.089 1.00 24.54 O ATOM 2085 CB ILE A 136 17.495 25.282 14.172 1.00 25.40 C ATOM 2086 CG1 ILE A 136 18.405 25.340 15.398 1.00 26.49 C ATOM 2087 CG2 ILE A 136 17.605 23.925 13.489 1.00 24.33 C ATOM 2088 CD1 ILE A 136 18.062 24.306 16.452 1.00 26.17 C ATOM 0 H ILE A 136 16.939 27.849 14.405 1.00 27.01 H new ATOM 0 HA ILE A 136 18.886 26.293 12.864 1.00 25.91 H new ATOM 0 HB ILE A 136 16.466 25.423 14.504 1.00 25.40 H new ATOM 0 HG12 ILE A 136 19.438 25.196 15.082 1.00 26.49 H new ATOM 0 HG13 ILE A 136 18.343 26.334 15.841 1.00 26.49 H new ATOM 0 HG21 ILE A 136 17.353 23.138 14.200 1.00 24.33 H new ATOM 0 HG22 ILE A 136 16.917 23.886 12.645 1.00 24.33 H new ATOM 0 HG23 ILE A 136 18.625 23.779 13.133 1.00 24.33 H new ATOM 0 HD11 ILE A 136 18.747 24.404 17.294 1.00 26.17 H new ATOM 0 HD12 ILE A 136 17.040 24.462 16.796 1.00 26.17 H new ATOM 0 HD13 ILE A 136 18.152 23.307 16.025 1.00 26.17 H new ATOM 2100 N ASN A 137 17.492 25.966 10.821 1.00 24.49 N ATOM 2101 CA ASN A 137 16.705 25.830 9.607 1.00 23.59 C ATOM 2102 C ASN A 137 16.161 24.412 9.507 1.00 22.27 C ATOM 2103 O ASN A 137 16.773 23.477 10.017 1.00 22.13 O ATOM 2104 CB ASN A 137 17.562 26.166 8.384 1.00 23.94 C ATOM 2105 CG ASN A 137 16.765 26.231 7.094 1.00 23.25 C ATOM 2106 OD1 ASN A 137 15.703 25.629 6.967 1.00 22.19 O ATOM 2107 ND2 ASN A 137 17.285 26.962 6.120 1.00 23.92 N ATOM 0 H ASN A 137 18.489 25.788 10.703 1.00 24.49 H new ATOM 0 HA ASN A 137 15.867 26.526 9.640 1.00 23.59 H new ATOM 0 HB2 ASN A 137 18.056 27.124 8.547 1.00 23.94 H new ATOM 0 HB3 ASN A 137 18.347 25.416 8.281 1.00 23.94 H new ATOM 0 HD21 ASN A 137 16.800 27.039 5.226 1.00 23.92 H new ATOM 0 HD22 ASN A 137 18.170 27.448 6.264 1.00 23.92 H new ATOM 2114 N TYR A 138 15.001 24.263 8.875 1.00 21.38 N ATOM 2115 CA TYR A 138 14.374 22.956 8.721 1.00 20.08 C ATOM 2116 C TYR A 138 15.402 21.869 8.439 1.00 19.79 C ATOM 2117 O TYR A 138 15.327 20.786 9.006 1.00 19.22 O ATOM 2118 CB TYR A 138 13.337 22.987 7.598 1.00 19.28 C ATOM 2119 CG TYR A 138 12.734 21.631 7.304 1.00 17.91 C ATOM 2120 CD1 TYR A 138 11.877 21.021 8.210 1.00 17.16 C ATOM 2121 CD2 TYR A 138 13.019 20.965 6.119 1.00 17.42 C ATOM 2122 CE1 TYR A 138 11.320 19.785 7.943 1.00 15.93 C ATOM 2123 CE2 TYR A 138 12.465 19.731 5.843 1.00 16.17 C ATOM 2124 CZ TYR A 138 11.635 19.134 6.770 1.00 15.40 C ATOM 2125 OH TYR A 138 11.062 17.915 6.489 1.00 14.17 O ATOM 0 H TYR A 138 14.476 25.033 8.461 1.00 21.38 H new ATOM 0 HA TYR A 138 13.880 22.721 9.664 1.00 20.08 H new ATOM 0 HB2 TYR A 138 12.540 23.681 7.867 1.00 19.28 H new ATOM 0 HB3 TYR A 138 13.804 23.374 6.692 1.00 19.28 H new ATOM 0 HD1 TYR A 138 11.642 21.520 9.138 1.00 17.16 H new ATOM 0 HD2 TYR A 138 13.685 21.420 5.401 1.00 17.42 H new ATOM 0 HE1 TYR A 138 10.641 19.331 8.650 1.00 15.93 H new ATOM 0 HE2 TYR A 138 12.680 19.236 4.908 1.00 16.17 H new ATOM 0 HH TYR A 138 11.389 17.592 5.623 1.00 14.17 H new ATOM 2135 N GLU A 139 16.366 22.176 7.579 1.00 20.30 N ATOM 2136 CA GLU A 139 17.406 21.214 7.211 1.00 20.23 C ATOM 2137 C GLU A 139 18.228 20.779 8.422 1.00 20.87 C ATOM 2138 O GLU A 139 18.500 19.590 8.614 1.00 20.48 O ATOM 2139 CB GLU A 139 18.328 21.825 6.157 1.00 20.94 C ATOM 2140 CG GLU A 139 18.938 23.153 6.574 1.00 22.25 C ATOM 2141 CD GLU A 139 19.797 23.767 5.487 1.00 22.99 C ATOM 2142 OE1 GLU A 139 19.253 24.527 4.657 1.00 23.36 O ATOM 2143 OE2 GLU A 139 21.014 23.487 5.463 1.00 23.27 O ATOM 0 H GLU A 139 16.452 23.084 7.121 1.00 20.30 H new ATOM 0 HA GLU A 139 16.913 20.331 6.805 1.00 20.23 H new ATOM 0 HB2 GLU A 139 19.130 21.120 5.936 1.00 20.94 H new ATOM 0 HB3 GLU A 139 17.766 21.967 5.234 1.00 20.94 H new ATOM 0 HG2 GLU A 139 18.141 23.848 6.838 1.00 22.25 H new ATOM 0 HG3 GLU A 139 19.542 23.006 7.469 1.00 22.25 H new ATOM 2150 N GLU A 140 18.599 21.745 9.244 1.00 21.93 N ATOM 2151 CA GLU A 140 19.407 21.485 10.426 1.00 22.74 C ATOM 2152 C GLU A 140 18.608 20.729 11.479 1.00 22.24 C ATOM 2153 O GLU A 140 19.062 19.720 12.022 1.00 22.29 O ATOM 2154 CB GLU A 140 19.892 22.803 11.015 1.00 24.01 C ATOM 2155 CG GLU A 140 20.418 23.789 9.981 1.00 24.56 C ATOM 2156 CD GLU A 140 20.918 25.076 10.612 1.00 25.83 C ATOM 2157 OE1 GLU A 140 20.279 25.552 11.570 1.00 26.30 O ATOM 2158 OE2 GLU A 140 21.951 25.606 10.153 1.00 26.40 O ATOM 0 H GLU A 140 18.351 22.726 9.114 1.00 21.93 H new ATOM 0 HA GLU A 140 20.258 20.873 10.129 1.00 22.74 H new ATOM 0 HB2 GLU A 140 19.071 23.269 11.561 1.00 24.01 H new ATOM 0 HB3 GLU A 140 20.680 22.597 11.739 1.00 24.01 H new ATOM 0 HG2 GLU A 140 21.228 23.324 9.419 1.00 24.56 H new ATOM 0 HG3 GLU A 140 19.627 24.020 9.268 1.00 24.56 H new ATOM 2165 N PHE A 141 17.415 21.230 11.756 1.00 21.88 N ATOM 2166 CA PHE A 141 16.538 20.635 12.754 1.00 21.51 C ATOM 2167 C PHE A 141 16.170 19.197 12.390 1.00 20.36 C ATOM 2168 O PHE A 141 16.322 18.285 13.203 1.00 20.46 O ATOM 2169 CB PHE A 141 15.278 21.496 12.891 1.00 21.36 C ATOM 2170 CG PHE A 141 14.137 20.827 13.602 1.00 20.89 C ATOM 2171 CD1 PHE A 141 14.031 20.885 14.982 1.00 20.72 C ATOM 2172 CD2 PHE A 141 13.163 20.153 12.884 1.00 20.72 C ATOM 2173 CE1 PHE A 141 12.975 20.277 15.634 1.00 20.40 C ATOM 2174 CE2 PHE A 141 12.105 19.546 13.529 1.00 20.40 C ATOM 2175 CZ PHE A 141 12.009 19.606 14.906 1.00 20.24 C ATOM 0 H PHE A 141 17.028 22.056 11.299 1.00 21.88 H new ATOM 0 HA PHE A 141 17.065 20.601 13.708 1.00 21.51 H new ATOM 0 HB2 PHE A 141 15.535 22.411 13.425 1.00 21.36 H new ATOM 0 HB3 PHE A 141 14.946 21.791 11.896 1.00 21.36 H new ATOM 0 HD1 PHE A 141 14.781 21.411 15.554 1.00 20.72 H new ATOM 0 HD2 PHE A 141 13.232 20.102 11.807 1.00 20.72 H new ATOM 0 HE1 PHE A 141 12.904 20.326 16.711 1.00 20.40 H new ATOM 0 HE2 PHE A 141 11.352 19.024 12.957 1.00 20.40 H new ATOM 0 HZ PHE A 141 11.182 19.130 15.412 1.00 20.24 H new ATOM 2185 N VAL A 142 15.685 19.007 11.168 1.00 19.36 N ATOM 2186 CA VAL A 142 15.281 17.679 10.703 1.00 18.22 C ATOM 2187 C VAL A 142 16.417 16.677 10.823 1.00 18.56 C ATOM 2188 O VAL A 142 16.194 15.504 11.121 1.00 18.08 O ATOM 2189 CB VAL A 142 14.787 17.687 9.243 1.00 17.23 C ATOM 2190 CG1 VAL A 142 15.876 18.140 8.291 1.00 17.77 C ATOM 2191 CG2 VAL A 142 14.304 16.306 8.854 1.00 16.07 C ATOM 0 H VAL A 142 15.561 19.751 10.481 1.00 19.36 H new ATOM 0 HA VAL A 142 14.455 17.382 11.350 1.00 18.22 H new ATOM 0 HB VAL A 142 13.962 18.396 9.172 1.00 17.23 H new ATOM 0 HG11 VAL A 142 15.493 18.134 7.271 1.00 17.77 H new ATOM 0 HG12 VAL A 142 16.192 19.150 8.554 1.00 17.77 H new ATOM 0 HG13 VAL A 142 16.727 17.463 8.363 1.00 17.77 H new ATOM 0 HG21 VAL A 142 13.956 16.320 7.821 1.00 16.07 H new ATOM 0 HG22 VAL A 142 15.123 15.593 8.952 1.00 16.07 H new ATOM 0 HG23 VAL A 142 13.484 16.009 9.509 1.00 16.07 H new ATOM 2201 N TRP A 143 17.635 17.146 10.591 1.00 19.50 N ATOM 2202 CA TRP A 143 18.805 16.288 10.676 1.00 20.05 C ATOM 2203 C TRP A 143 18.939 15.715 12.079 1.00 20.61 C ATOM 2204 O TRP A 143 19.051 14.505 12.274 1.00 20.44 O ATOM 2205 CB TRP A 143 20.069 17.085 10.328 1.00 21.15 C ATOM 2206 CG TRP A 143 21.309 16.501 10.929 1.00 22.13 C ATOM 2207 CD1 TRP A 143 22.060 15.506 10.404 1.00 22.20 C ATOM 2208 CD2 TRP A 143 21.922 16.851 12.176 1.00 23.25 C ATOM 2209 NE1 TRP A 143 23.113 15.213 11.235 1.00 23.30 N ATOM 2210 CE2 TRP A 143 23.047 16.024 12.330 1.00 23.94 C ATOM 2211 CE3 TRP A 143 21.634 17.781 13.173 1.00 23.82 C ATOM 2212 CZ2 TRP A 143 23.879 16.093 13.440 1.00 25.11 C ATOM 2213 CZ3 TRP A 143 22.459 17.849 14.277 1.00 24.98 C ATOM 2214 CH2 TRP A 143 23.569 17.008 14.400 1.00 25.59 C ATOM 0 H TRP A 143 17.837 18.115 10.343 1.00 19.50 H new ATOM 0 HA TRP A 143 18.686 15.470 9.965 1.00 20.05 H new ATOM 0 HB2 TRP A 143 20.180 17.125 9.244 1.00 21.15 H new ATOM 0 HB3 TRP A 143 19.952 18.112 10.675 1.00 21.15 H new ATOM 0 HD1 TRP A 143 21.860 15.012 9.465 1.00 22.20 H new ATOM 0 HE1 TRP A 143 23.827 14.505 11.062 1.00 23.30 H new ATOM 0 HE3 TRP A 143 20.781 18.437 13.083 1.00 23.82 H new ATOM 0 HZ2 TRP A 143 24.738 15.446 13.538 1.00 25.11 H new ATOM 0 HZ3 TRP A 143 22.244 18.563 15.058 1.00 24.98 H new ATOM 0 HH2 TRP A 143 24.195 17.086 15.277 1.00 25.59 H new ATOM 2225 N MET A 144 18.930 16.615 13.038 1.00 21.37 N ATOM 2226 CA MET A 144 19.076 16.280 14.444 1.00 22.12 C ATOM 2227 C MET A 144 18.107 15.195 14.906 1.00 21.40 C ATOM 2228 O MET A 144 18.527 14.170 15.440 1.00 21.75 O ATOM 2229 CB MET A 144 18.888 17.558 15.244 1.00 22.89 C ATOM 2230 CG MET A 144 18.765 17.349 16.743 1.00 23.65 C ATOM 2231 SD MET A 144 17.064 17.487 17.327 1.00 23.25 S ATOM 2232 CE MET A 144 16.609 19.087 16.661 1.00 22.97 C ATOM 0 H MET A 144 18.820 17.614 12.864 1.00 21.37 H new ATOM 0 HA MET A 144 20.070 15.862 14.604 1.00 22.12 H new ATOM 0 HB2 MET A 144 19.731 18.221 15.050 1.00 22.89 H new ATOM 0 HB3 MET A 144 17.993 18.068 14.886 1.00 22.89 H new ATOM 0 HG2 MET A 144 19.155 16.365 17.002 1.00 23.65 H new ATOM 0 HG3 MET A 144 19.383 18.083 17.260 1.00 23.65 H new ATOM 0 HE1 MET A 144 15.954 19.601 17.365 1.00 22.97 H new ATOM 0 HE2 MET A 144 17.507 19.683 16.500 1.00 22.97 H new ATOM 0 HE3 MET A 144 16.088 18.952 15.713 1.00 22.97 H new ATOM 2242 N ILE A 145 16.814 15.420 14.706 1.00 20.47 N ATOM 2243 CA ILE A 145 15.805 14.450 15.120 1.00 19.79 C ATOM 2244 C ILE A 145 15.856 13.192 14.260 1.00 18.96 C ATOM 2245 O ILE A 145 15.275 12.165 14.612 1.00 18.60 O ATOM 2246 CB ILE A 145 14.387 15.045 15.058 1.00 19.06 C ATOM 2247 CG1 ILE A 145 14.153 15.700 13.697 1.00 18.09 C ATOM 2248 CG2 ILE A 145 14.184 16.047 16.186 1.00 20.01 C ATOM 2249 CD1 ILE A 145 12.768 16.289 13.537 1.00 17.41 C ATOM 0 H ILE A 145 16.440 16.259 14.263 1.00 20.47 H new ATOM 0 HA ILE A 145 16.034 14.187 16.153 1.00 19.79 H new ATOM 0 HB ILE A 145 13.660 14.243 15.183 1.00 19.06 H new ATOM 0 HG12 ILE A 145 14.892 16.487 13.550 1.00 18.09 H new ATOM 0 HG13 ILE A 145 14.316 14.959 12.914 1.00 18.09 H new ATOM 0 HG21 ILE A 145 13.177 16.460 16.129 1.00 20.01 H new ATOM 0 HG22 ILE A 145 14.318 15.547 17.145 1.00 20.01 H new ATOM 0 HG23 ILE A 145 14.912 16.853 16.092 1.00 20.01 H new ATOM 0 HD11 ILE A 145 12.675 16.736 12.547 1.00 17.41 H new ATOM 0 HD12 ILE A 145 12.023 15.502 13.651 1.00 17.41 H new ATOM 0 HD13 ILE A 145 12.608 17.054 14.297 1.00 17.41 H new ATOM 2261 N SER A 146 16.557 13.276 13.134 1.00 18.76 N ATOM 2262 CA SER A 146 16.684 12.140 12.228 1.00 18.09 C ATOM 2263 C SER A 146 17.701 11.138 12.759 1.00 18.99 C ATOM 2264 O SER A 146 17.958 10.108 12.135 1.00 18.73 O ATOM 2265 CB SER A 146 17.096 12.611 10.832 1.00 17.78 C ATOM 2266 OG SER A 146 17.134 11.529 9.919 1.00 17.22 O ATOM 0 H SER A 146 17.045 14.117 12.827 1.00 18.76 H new ATOM 0 HA SER A 146 15.713 11.650 12.163 1.00 18.09 H new ATOM 0 HB2 SER A 146 16.394 13.365 10.477 1.00 17.78 H new ATOM 0 HB3 SER A 146 18.076 13.085 10.879 1.00 17.78 H new ATOM 0 HG SER A 146 17.410 10.714 10.389 1.00 17.22 H new ATOM 2272 N GLN A 147 18.277 11.445 13.919 1.00 20.13 N ATOM 2273 CA GLN A 147 19.264 10.571 14.537 1.00 21.14 C ATOM 2274 C GLN A 147 19.026 10.470 16.039 1.00 21.86 C ATOM 2275 O GLN A 147 18.947 9.375 16.595 1.00 22.11 O ATOM 2276 CB GLN A 147 20.679 11.088 14.280 1.00 22.13 C ATOM 2277 CG GLN A 147 20.821 11.869 12.986 1.00 21.65 C ATOM 2278 CD GLN A 147 22.265 12.042 12.578 1.00 22.67 C ATOM 2279 OE1 GLN A 147 22.884 13.101 13.073 1.00 22.79 O flip ATOM 2280 NE2 GLN A 147 22.817 11.231 11.835 1.00 23.48 N flip ATOM 0 H GLN A 147 18.075 12.293 14.448 1.00 20.13 H new ATOM 0 HA GLN A 147 19.160 9.582 14.091 1.00 21.14 H new ATOM 0 HB2 GLN A 147 20.980 11.724 15.112 1.00 22.13 H new ATOM 0 HB3 GLN A 147 21.367 10.242 14.260 1.00 22.13 H new ATOM 0 HG2 GLN A 147 20.280 11.354 12.192 1.00 21.65 H new ATOM 0 HG3 GLN A 147 20.359 12.849 13.103 1.00 21.65 H new ATOM 0 HE21 GLN A 147 22.297 10.429 11.479 1.00 23.48 H new ATOM 0 HE22 GLN A 147 23.795 11.360 11.576 1.00 23.48 H new ATOM 2289 N LYS A 148 18.914 11.624 16.688 1.00 22.30 N ATOM 2290 CA LYS A 148 18.694 11.677 18.128 1.00 23.11 C ATOM 2291 C LYS A 148 17.208 11.572 18.459 1.00 22.36 C ATOM 2292 O LYS A 148 16.532 12.622 18.484 1.00 22.12 O ATOM 2293 CB LYS A 148 19.271 12.973 18.695 1.00 24.04 C ATOM 2294 CG LYS A 148 20.701 13.237 18.253 1.00 24.96 C ATOM 2295 CD LYS A 148 21.217 14.566 18.780 1.00 25.58 C ATOM 2296 CE LYS A 148 22.605 14.872 18.244 1.00 25.71 C ATOM 2297 NZ LYS A 148 23.564 13.768 18.523 1.00 26.17 N ATOM 2298 OXT LYS A 148 16.734 10.441 18.694 1.00 22.11 O ATOM 0 H LYS A 148 18.972 12.537 16.238 1.00 22.30 H new ATOM 0 HA LYS A 148 19.203 10.828 18.585 1.00 23.11 H new ATOM 0 HB2 LYS A 148 18.642 13.808 18.386 1.00 24.04 H new ATOM 0 HB3 LYS A 148 19.236 12.933 19.784 1.00 24.04 H new ATOM 0 HG2 LYS A 148 21.345 12.431 18.605 1.00 24.96 H new ATOM 0 HG3 LYS A 148 20.752 13.233 17.164 1.00 24.96 H new ATOM 0 HD2 LYS A 148 20.531 15.364 18.495 1.00 25.58 H new ATOM 0 HD3 LYS A 148 21.243 14.542 19.869 1.00 25.58 H new ATOM 0 HE2 LYS A 148 22.550 15.042 17.169 1.00 25.71 H new ATOM 0 HE3 LYS A 148 22.973 15.794 18.694 1.00 25.71 H new ATOM 0 HZ1 LYS A 148 24.533 14.092 18.329 1.00 26.17 H new ATOM 0 HZ2 LYS A 148 23.487 13.485 19.521 1.00 26.17 H new ATOM 0 HZ3 LYS A 148 23.343 12.954 17.915 1.00 26.17 H new