USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B1904 GLN : amide:sc= 0.487 K(o=2.1,f=1.1) USER MOD Set 1.2: B1908 SER OG : rot 69:sc= 1.63 USER MOD Set 2.1: A 99 TYR OH : rot 149:sc= 0.741 USER MOD Set 2.2: A 101 SER OG : rot 180:sc= 0.653 USER MOD Set 3.1: A 60 ASN : amide:sc= 0.841 K(o=1.6,f=0.97) USER MOD Set 3.2: A 62 THR OG1 : rot 160:sc= 0.735 USER MOD Set 4.1: A 36 MET CE :methyl 162:sc= -0.0113 (180deg=-0.446) USER MOD Set 4.2: A 51 MET CE :methyl -162:sc= 0 (180deg=-0.871) USER MOD Single : A 8 GLN : amide:sc= 0.666 K(o=0.67,f=-0.32) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -49:sc= 1 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0.43 USER MOD Single : A 38 SER OG : rot -160:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0.752 K(o=0.75,f=0) USER MOD Single : A 42 ASN : amide:sc= 0.712 K(o=0.71,f=-4.5!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.373 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 145:sc= -0.522 (180deg=-2.47!) USER MOD Single : A 72 MET CE :methyl -147:sc= -0.789 (180deg=-3.22!) USER MOD Single : A 107 HIS : no HD1:sc= -0.245 X(o=-0.25,f=-0.0079) USER MOD Single : A 109 MET CE :methyl -150:sc= -0.522 (180deg=-1.04) USER MOD Single : A 110 THR OG1 : rot -78:sc= 1.23 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 73:sc= 0.779 USER MOD Single : A 124 MET CE :methyl -137:sc= 0 (180deg=-0.711) USER MOD Single : A 135 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.013) USER MOD Single : A 137 ASN : amide:sc= 0.0191 X(o=0.019,f=0) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 1.23 K(o=1.2,f=-0.061) USER MOD Single : A 144 MET CE :methyl -147:sc= -0.143 (180deg=-2.07) USER MOD Single : A 145 MET CE :methyl 145:sc= 0 (180deg=-0.0514) USER MOD Single : A 146 THR OG1 : rot -74:sc= 1.23 USER MOD Single : B1913 GLN : amide:sc= 0.971 K(o=0.97,f=-3.3) USER MOD Single : B1916 TYR OH : rot -34:sc= 1.04 USER MOD Single : B1919 TYR OH : rot 72:sc= 0.00852 USER MOD ----------------------------------------------------------------- ATOM 75 N GLU A 6 -0.655 0.348 -14.041 1.00 0.00 N ATOM 76 CA GLU A 6 -1.284 -0.099 -15.296 1.00 0.00 C ATOM 77 C GLU A 6 -0.332 -0.957 -16.157 1.00 0.00 C ATOM 78 O GLU A 6 -0.783 -1.858 -16.863 1.00 0.00 O ATOM 79 CB GLU A 6 -1.823 1.112 -16.080 1.00 0.00 C ATOM 80 CG GLU A 6 -0.739 2.054 -16.631 1.00 0.00 C ATOM 81 CD GLU A 6 -1.334 3.349 -17.229 1.00 0.00 C ATOM 82 OE1 GLU A 6 -2.373 3.297 -17.932 1.00 0.00 O ATOM 83 OE2 GLU A 6 -0.747 4.439 -17.015 1.00 0.00 O1- ATOM 0 HA GLU A 6 -2.123 -0.745 -15.036 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.427 0.750 -16.912 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.485 1.683 -15.430 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -0.044 2.312 -15.831 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -0.164 1.534 -17.397 1.00 0.00 H new ATOM 90 N GLU A 7 0.985 -0.737 -16.058 1.00 0.00 N ATOM 91 CA GLU A 7 2.006 -1.538 -16.746 1.00 0.00 C ATOM 92 C GLU A 7 2.157 -2.938 -16.131 1.00 0.00 C ATOM 93 O GLU A 7 2.211 -3.925 -16.868 1.00 0.00 O ATOM 94 CB GLU A 7 3.356 -0.802 -16.744 1.00 0.00 C ATOM 95 CG GLU A 7 3.289 0.551 -17.473 1.00 0.00 C ATOM 96 CD GLU A 7 4.684 1.166 -17.720 1.00 0.00 C ATOM 97 OE1 GLU A 7 5.576 1.074 -16.841 1.00 0.00 O ATOM 98 OE2 GLU A 7 4.895 1.773 -18.800 1.00 0.00 O1- ATOM 0 H GLU A 7 1.377 0.013 -15.489 1.00 0.00 H new ATOM 0 HA GLU A 7 1.673 -1.672 -17.775 1.00 0.00 H new ATOM 0 HB2 GLU A 7 3.677 -0.641 -15.715 1.00 0.00 H new ATOM 0 HB3 GLU A 7 4.110 -1.430 -17.219 1.00 0.00 H new ATOM 0 HG2 GLU A 7 2.780 0.419 -18.428 1.00 0.00 H new ATOM 0 HG3 GLU A 7 2.689 1.246 -16.886 1.00 0.00 H new ATOM 105 N GLN A 8 2.156 -3.059 -14.794 1.00 0.00 N ATOM 106 CA GLN A 8 2.122 -4.369 -14.132 1.00 0.00 C ATOM 107 C GLN A 8 0.811 -5.109 -14.393 1.00 0.00 C ATOM 108 O GLN A 8 0.836 -6.311 -14.640 1.00 0.00 O ATOM 109 CB GLN A 8 2.390 -4.254 -12.621 1.00 0.00 C ATOM 110 CG GLN A 8 3.863 -3.944 -12.298 1.00 0.00 C ATOM 111 CD GLN A 8 4.874 -4.901 -12.944 1.00 0.00 C ATOM 112 OE1 GLN A 8 5.911 -4.488 -13.446 1.00 0.00 O ATOM 113 NE2 GLN A 8 4.606 -6.189 -13.011 1.00 0.00 N ATOM 0 H GLN A 8 2.178 -2.266 -14.153 1.00 0.00 H new ATOM 0 HA GLN A 8 2.928 -4.957 -14.571 1.00 0.00 H new ATOM 0 HB2 GLN A 8 1.758 -3.470 -12.203 1.00 0.00 H new ATOM 0 HB3 GLN A 8 2.105 -5.186 -12.134 1.00 0.00 H new ATOM 0 HG2 GLN A 8 4.086 -2.928 -12.622 1.00 0.00 H new ATOM 0 HG3 GLN A 8 3.997 -3.970 -11.217 1.00 0.00 H new ATOM 0 HE21 GLN A 8 3.747 -6.553 -12.599 1.00 0.00 H new ATOM 0 HE22 GLN A 8 5.257 -6.822 -13.475 1.00 0.00 H new ATOM 122 N ILE A 9 -0.326 -4.412 -14.414 1.00 0.00 N ATOM 123 CA ILE A 9 -1.625 -5.029 -14.715 1.00 0.00 C ATOM 124 C ILE A 9 -1.671 -5.520 -16.163 1.00 0.00 C ATOM 125 O ILE A 9 -2.154 -6.623 -16.387 1.00 0.00 O ATOM 126 CB ILE A 9 -2.781 -4.075 -14.349 1.00 0.00 C ATOM 127 CG1 ILE A 9 -2.804 -3.954 -12.811 1.00 0.00 C ATOM 128 CG2 ILE A 9 -4.152 -4.573 -14.845 1.00 0.00 C ATOM 129 CD1 ILE A 9 -3.587 -2.763 -12.268 1.00 0.00 C ATOM 0 H ILE A 9 -0.376 -3.411 -14.225 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.754 -5.914 -14.092 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.608 -3.115 -14.836 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -3.229 -4.868 -12.396 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -1.777 -3.888 -12.452 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.924 -3.860 -14.557 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -4.133 -4.669 -15.931 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.370 -5.543 -14.399 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.544 -2.765 -11.179 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -3.152 -1.838 -12.646 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -4.626 -2.833 -12.590 1.00 0.00 H new ATOM 141 N ALA A 10 -1.117 -4.780 -17.131 1.00 0.00 N ATOM 142 CA ALA A 10 -0.995 -5.226 -18.522 1.00 0.00 C ATOM 143 C ALA A 10 -0.032 -6.429 -18.685 1.00 0.00 C ATOM 144 O ALA A 10 -0.320 -7.355 -19.447 1.00 0.00 O ATOM 145 CB ALA A 10 -0.540 -4.036 -19.375 1.00 0.00 C ATOM 0 H ALA A 10 -0.738 -3.847 -16.968 1.00 0.00 H new ATOM 0 HA ALA A 10 -1.970 -5.581 -18.857 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.444 -4.349 -20.415 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.276 -3.235 -19.304 1.00 0.00 H new ATOM 0 HB3 ALA A 10 0.423 -3.677 -19.014 1.00 0.00 H new ATOM 151 N GLU A 11 1.083 -6.460 -17.946 1.00 0.00 N ATOM 152 CA GLU A 11 2.007 -7.606 -17.904 1.00 0.00 C ATOM 153 C GLU A 11 1.333 -8.859 -17.315 1.00 0.00 C ATOM 154 O GLU A 11 1.393 -9.942 -17.903 1.00 0.00 O ATOM 155 CB GLU A 11 3.270 -7.215 -17.111 1.00 0.00 C ATOM 156 CG GLU A 11 4.265 -8.373 -16.945 1.00 0.00 C ATOM 157 CD GLU A 11 5.593 -7.884 -16.334 1.00 0.00 C ATOM 158 OE1 GLU A 11 6.552 -7.615 -17.099 1.00 0.00 O ATOM 159 OE2 GLU A 11 5.691 -7.777 -15.087 1.00 0.00 O1- ATOM 0 H GLU A 11 1.375 -5.683 -17.353 1.00 0.00 H new ATOM 0 HA GLU A 11 2.296 -7.862 -18.923 1.00 0.00 H new ATOM 0 HB2 GLU A 11 3.767 -6.388 -17.617 1.00 0.00 H new ATOM 0 HB3 GLU A 11 2.975 -6.854 -16.126 1.00 0.00 H new ATOM 0 HG2 GLU A 11 3.829 -9.142 -16.307 1.00 0.00 H new ATOM 0 HG3 GLU A 11 4.456 -8.834 -17.914 1.00 0.00 H new ATOM 166 N PHE A 12 0.637 -8.706 -16.184 1.00 0.00 N ATOM 167 CA PHE A 12 -0.110 -9.786 -15.540 1.00 0.00 C ATOM 168 C PHE A 12 -1.312 -10.233 -16.388 1.00 0.00 C ATOM 169 O PHE A 12 -1.587 -11.428 -16.449 1.00 0.00 O ATOM 170 CB PHE A 12 -0.509 -9.378 -14.109 1.00 0.00 C ATOM 171 CG PHE A 12 0.615 -8.971 -13.153 1.00 0.00 C ATOM 172 CD1 PHE A 12 0.317 -8.221 -11.994 1.00 0.00 C ATOM 173 CD2 PHE A 12 1.953 -9.359 -13.380 1.00 0.00 C ATOM 174 CE1 PHE A 12 1.324 -7.913 -11.065 1.00 0.00 C ATOM 175 CE2 PHE A 12 2.963 -9.041 -12.454 1.00 0.00 C ATOM 176 CZ PHE A 12 2.643 -8.334 -11.284 1.00 0.00 C ATOM 0 H PHE A 12 0.577 -7.818 -15.686 1.00 0.00 H new ATOM 0 HA PHE A 12 0.539 -10.658 -15.463 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -1.209 -8.546 -14.179 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -1.048 -10.212 -13.659 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -0.694 -7.882 -11.821 1.00 0.00 H new ATOM 0 HD2 PHE A 12 2.205 -9.907 -14.276 1.00 0.00 H new ATOM 0 HE1 PHE A 12 1.081 -7.349 -10.177 1.00 0.00 H new ATOM 0 HE2 PHE A 12 3.983 -9.340 -12.643 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.410 -8.115 -10.556 1.00 0.00 H new ATOM 186 N LYS A 13 -1.975 -9.315 -17.111 1.00 0.00 N ATOM 187 CA LYS A 13 -3.051 -9.598 -18.085 1.00 0.00 C ATOM 188 C LYS A 13 -2.580 -10.616 -19.121 1.00 0.00 C ATOM 189 O LYS A 13 -3.219 -11.649 -19.314 1.00 0.00 O ATOM 190 CB LYS A 13 -3.465 -8.299 -18.811 1.00 0.00 C ATOM 191 CG LYS A 13 -4.817 -7.664 -18.489 1.00 0.00 C ATOM 192 CD LYS A 13 -6.023 -8.580 -18.723 1.00 0.00 C ATOM 193 CE LYS A 13 -7.282 -7.728 -18.546 1.00 0.00 C ATOM 194 NZ LYS A 13 -8.521 -8.519 -18.771 1.00 0.00 N1+ ATOM 0 H LYS A 13 -1.772 -8.319 -17.033 1.00 0.00 H new ATOM 0 HA LYS A 13 -3.904 -10.004 -17.541 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -2.696 -7.552 -18.612 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -3.444 -8.501 -19.882 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -4.815 -7.346 -17.446 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -4.936 -6.766 -19.096 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -5.989 -9.012 -19.723 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -6.018 -9.410 -18.016 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -7.297 -7.307 -17.541 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -7.254 -6.890 -19.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -9.352 -7.907 -18.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -8.519 -8.900 -19.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -8.560 -9.304 -18.090 1.00 0.00 H new ATOM 208 N GLU A 14 -1.447 -10.327 -19.762 1.00 0.00 N ATOM 209 CA GLU A 14 -0.861 -11.174 -20.799 1.00 0.00 C ATOM 210 C GLU A 14 -0.431 -12.534 -20.234 1.00 0.00 C ATOM 211 O GLU A 14 -0.869 -13.566 -20.741 1.00 0.00 O ATOM 212 CB GLU A 14 0.304 -10.430 -21.474 1.00 0.00 C ATOM 213 CG GLU A 14 0.945 -11.253 -22.602 1.00 0.00 C ATOM 214 CD GLU A 14 1.916 -10.419 -23.467 1.00 0.00 C ATOM 215 OE1 GLU A 14 1.898 -10.571 -24.714 1.00 0.00 O ATOM 216 OE2 GLU A 14 2.719 -9.624 -22.920 1.00 0.00 O1- ATOM 0 H GLU A 14 -0.903 -9.485 -19.572 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.616 -11.384 -21.557 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -0.057 -9.484 -21.877 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.061 -10.190 -20.727 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.482 -12.097 -22.171 1.00 0.00 H new ATOM 0 HG3 GLU A 14 0.161 -11.665 -23.237 1.00 0.00 H new ATOM 223 N ALA A 15 0.358 -12.553 -19.154 1.00 0.00 N ATOM 224 CA ALA A 15 0.856 -13.792 -18.551 1.00 0.00 C ATOM 225 C ALA A 15 -0.254 -14.690 -17.975 1.00 0.00 C ATOM 226 O ALA A 15 -0.113 -15.910 -17.980 1.00 0.00 O ATOM 227 CB ALA A 15 1.854 -13.430 -17.455 1.00 0.00 C ATOM 0 H ALA A 15 0.669 -11.708 -18.674 1.00 0.00 H new ATOM 0 HA ALA A 15 1.329 -14.373 -19.343 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.235 -14.341 -16.995 1.00 0.00 H new ATOM 0 HB2 ALA A 15 2.682 -12.868 -17.888 1.00 0.00 H new ATOM 0 HB3 ALA A 15 1.359 -12.821 -16.699 1.00 0.00 H new ATOM 233 N PHE A 16 -1.361 -14.115 -17.498 1.00 0.00 N ATOM 234 CA PHE A 16 -2.532 -14.863 -17.043 1.00 0.00 C ATOM 235 C PHE A 16 -3.330 -15.443 -18.222 1.00 0.00 C ATOM 236 O PHE A 16 -3.595 -16.646 -18.277 1.00 0.00 O ATOM 237 CB PHE A 16 -3.403 -13.925 -16.207 1.00 0.00 C ATOM 238 CG PHE A 16 -4.566 -14.607 -15.523 1.00 0.00 C ATOM 239 CD1 PHE A 16 -4.377 -15.207 -14.266 1.00 0.00 C ATOM 240 CD2 PHE A 16 -5.832 -14.652 -16.132 1.00 0.00 C ATOM 241 CE1 PHE A 16 -5.453 -15.814 -13.601 1.00 0.00 C ATOM 242 CE2 PHE A 16 -6.896 -15.291 -15.478 1.00 0.00 C ATOM 243 CZ PHE A 16 -6.715 -15.861 -14.208 1.00 0.00 C ATOM 0 H PHE A 16 -1.469 -13.104 -17.417 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.206 -15.711 -16.441 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -2.781 -13.447 -15.451 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.787 -13.134 -16.851 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -3.398 -15.201 -13.810 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -5.985 -14.197 -17.099 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.309 -16.245 -12.621 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -7.863 -15.345 -15.956 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.544 -16.333 -13.702 1.00 0.00 H new ATOM 253 N SER A 17 -3.661 -14.598 -19.208 1.00 0.00 N ATOM 254 CA SER A 17 -4.394 -14.977 -20.427 1.00 0.00 C ATOM 255 C SER A 17 -3.645 -16.024 -21.266 1.00 0.00 C ATOM 256 O SER A 17 -4.269 -16.849 -21.936 1.00 0.00 O ATOM 257 CB SER A 17 -4.665 -13.711 -21.252 1.00 0.00 C ATOM 258 OG SER A 17 -5.417 -13.982 -22.422 1.00 0.00 O ATOM 0 H SER A 17 -3.421 -13.607 -19.181 1.00 0.00 H new ATOM 0 HA SER A 17 -5.334 -15.443 -20.130 1.00 0.00 H new ATOM 0 HB2 SER A 17 -5.201 -12.988 -20.638 1.00 0.00 H new ATOM 0 HB3 SER A 17 -3.717 -13.252 -21.531 1.00 0.00 H new ATOM 0 HG SER A 17 -5.567 -13.148 -22.915 1.00 0.00 H new ATOM 264 N LEU A 18 -2.314 -16.083 -21.142 1.00 0.00 N ATOM 265 CA LEU A 18 -1.447 -17.116 -21.718 1.00 0.00 C ATOM 266 C LEU A 18 -1.846 -18.557 -21.334 1.00 0.00 C ATOM 267 O LEU A 18 -1.535 -19.499 -22.066 1.00 0.00 O ATOM 268 CB LEU A 18 0.000 -16.780 -21.316 1.00 0.00 C ATOM 269 CG LEU A 18 1.104 -17.536 -22.076 1.00 0.00 C ATOM 270 CD1 LEU A 18 1.063 -17.274 -23.583 1.00 0.00 C ATOM 271 CD2 LEU A 18 2.467 -17.062 -21.574 1.00 0.00 C ATOM 0 H LEU A 18 -1.791 -15.383 -20.616 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.556 -17.103 -22.802 1.00 0.00 H new ATOM 0 HB2 LEU A 18 0.156 -15.711 -21.457 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.116 -16.981 -20.251 1.00 0.00 H new ATOM 0 HG LEU A 18 0.942 -18.599 -21.898 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.863 -17.831 -24.071 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.101 -17.595 -23.982 1.00 0.00 H new ATOM 0 HD13 LEU A 18 1.196 -16.209 -23.771 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.256 -17.593 -22.107 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.567 -15.991 -21.750 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.552 -17.264 -20.506 1.00 0.00 H new ATOM 283 N PHE A 19 -2.563 -18.723 -20.216 1.00 0.00 N ATOM 284 CA PHE A 19 -3.051 -20.003 -19.690 1.00 0.00 C ATOM 285 C PHE A 19 -4.591 -20.085 -19.618 1.00 0.00 C ATOM 286 O PHE A 19 -5.136 -21.114 -19.214 1.00 0.00 O ATOM 287 CB PHE A 19 -2.362 -20.296 -18.355 1.00 0.00 C ATOM 288 CG PHE A 19 -0.846 -20.364 -18.466 1.00 0.00 C ATOM 289 CD1 PHE A 19 -0.181 -21.601 -18.538 1.00 0.00 C ATOM 290 CD2 PHE A 19 -0.096 -19.175 -18.531 1.00 0.00 C ATOM 291 CE1 PHE A 19 1.221 -21.637 -18.651 1.00 0.00 C ATOM 292 CE2 PHE A 19 1.304 -19.207 -18.570 1.00 0.00 C ATOM 293 CZ PHE A 19 1.968 -20.443 -18.638 1.00 0.00 C ATOM 0 H PHE A 19 -2.830 -17.934 -19.628 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.781 -20.791 -20.393 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.633 -19.523 -17.636 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.734 -21.242 -17.961 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.745 -22.521 -18.507 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.607 -18.224 -18.551 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.727 -22.586 -18.748 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.869 -18.287 -18.548 1.00 0.00 H new ATOM 0 HZ PHE A 19 3.047 -20.478 -18.680 1.00 0.00 H new ATOM 303 N ASP A 20 -5.309 -19.032 -20.028 1.00 0.00 N ATOM 304 CA ASP A 20 -6.770 -19.039 -20.149 1.00 0.00 C ATOM 305 C ASP A 20 -7.205 -19.877 -21.370 1.00 0.00 C ATOM 306 O ASP A 20 -6.922 -19.525 -22.521 1.00 0.00 O ATOM 307 CB ASP A 20 -7.307 -17.600 -20.212 1.00 0.00 C ATOM 308 CG ASP A 20 -8.836 -17.499 -20.367 1.00 0.00 C ATOM 309 OD1 ASP A 20 -9.339 -16.354 -20.393 1.00 0.00 O ATOM 310 OD2 ASP A 20 -9.544 -18.526 -20.502 1.00 0.00 O1- ATOM 0 H ASP A 20 -4.886 -18.141 -20.288 1.00 0.00 H new ATOM 0 HA ASP A 20 -7.201 -19.508 -19.265 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.010 -17.074 -19.305 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.834 -17.085 -21.048 1.00 0.00 H new ATOM 356 N ASP A 24 -12.582 -16.492 -21.125 1.00 0.00 N ATOM 357 CA ASP A 24 -13.483 -15.929 -20.106 1.00 0.00 C ATOM 358 C ASP A 24 -12.763 -15.103 -19.015 1.00 0.00 C ATOM 359 O ASP A 24 -13.420 -14.512 -18.155 1.00 0.00 O ATOM 360 CB ASP A 24 -14.319 -17.061 -19.475 1.00 0.00 C ATOM 361 CG ASP A 24 -15.336 -17.723 -20.428 1.00 0.00 C ATOM 362 OD1 ASP A 24 -15.682 -17.150 -21.489 1.00 0.00 O ATOM 363 OD2 ASP A 24 -15.845 -18.817 -20.082 1.00 0.00 O1- ATOM 0 HA ASP A 24 -14.134 -15.221 -20.619 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.642 -17.828 -19.100 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.856 -16.661 -18.615 1.00 0.00 H new ATOM 368 N GLY A 25 -11.427 -15.039 -19.037 1.00 0.00 N ATOM 369 CA GLY A 25 -10.613 -14.321 -18.053 1.00 0.00 C ATOM 370 C GLY A 25 -10.317 -15.130 -16.787 1.00 0.00 C ATOM 371 O GLY A 25 -10.245 -14.547 -15.703 1.00 0.00 O ATOM 0 H GLY A 25 -10.869 -15.497 -19.758 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.670 -14.032 -18.517 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.126 -13.401 -17.773 1.00 0.00 H new ATOM 375 N THR A 26 -10.170 -16.458 -16.899 1.00 0.00 N ATOM 376 CA THR A 26 -9.962 -17.379 -15.760 1.00 0.00 C ATOM 377 C THR A 26 -8.936 -18.495 -16.048 1.00 0.00 C ATOM 378 O THR A 26 -8.675 -18.833 -17.204 1.00 0.00 O ATOM 379 CB THR A 26 -11.298 -17.979 -15.263 1.00 0.00 C ATOM 380 OG1 THR A 26 -11.810 -18.944 -16.164 1.00 0.00 O ATOM 381 CG2 THR A 26 -12.414 -16.951 -15.072 1.00 0.00 C ATOM 0 H THR A 26 -10.192 -16.937 -17.800 1.00 0.00 H new ATOM 0 HA THR A 26 -9.537 -16.767 -14.965 1.00 0.00 H new ATOM 0 HB THR A 26 -11.035 -18.417 -14.300 1.00 0.00 H new ATOM 0 HG1 THR A 26 -12.653 -19.302 -15.816 1.00 0.00 H new ATOM 0 HG21 THR A 26 -13.316 -17.454 -14.722 1.00 0.00 H new ATOM 0 HG22 THR A 26 -12.103 -16.209 -14.336 1.00 0.00 H new ATOM 0 HG23 THR A 26 -12.619 -16.456 -16.021 1.00 0.00 H new ATOM 389 N ILE A 27 -8.373 -19.097 -14.988 1.00 0.00 N ATOM 390 CA ILE A 27 -7.462 -20.268 -14.999 1.00 0.00 C ATOM 391 C ILE A 27 -7.829 -21.261 -13.883 1.00 0.00 C ATOM 392 O ILE A 27 -8.632 -20.939 -13.004 1.00 0.00 O ATOM 393 CB ILE A 27 -5.973 -19.858 -14.862 1.00 0.00 C ATOM 394 CG1 ILE A 27 -5.656 -19.289 -13.458 1.00 0.00 C ATOM 395 CG2 ILE A 27 -5.541 -18.945 -16.019 1.00 0.00 C ATOM 396 CD1 ILE A 27 -4.182 -18.950 -13.237 1.00 0.00 C ATOM 0 H ILE A 27 -8.548 -18.764 -14.040 1.00 0.00 H new ATOM 0 HA ILE A 27 -7.589 -20.750 -15.968 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.362 -20.757 -14.946 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -6.252 -18.390 -13.300 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.967 -20.014 -12.706 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.492 -18.674 -15.896 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.672 -19.470 -16.965 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -6.152 -18.042 -16.018 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -4.046 -18.558 -12.229 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -3.579 -19.850 -13.360 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -3.868 -18.201 -13.964 1.00 0.00 H new ATOM 408 N THR A 28 -7.225 -22.452 -13.876 1.00 0.00 N ATOM 409 CA THR A 28 -7.313 -23.381 -12.733 1.00 0.00 C ATOM 410 C THR A 28 -6.304 -23.058 -11.628 1.00 0.00 C ATOM 411 O THR A 28 -5.263 -22.437 -11.851 1.00 0.00 O ATOM 412 CB THR A 28 -7.158 -24.852 -13.146 1.00 0.00 C ATOM 413 OG1 THR A 28 -5.857 -25.095 -13.620 1.00 0.00 O ATOM 414 CG2 THR A 28 -8.167 -25.280 -14.211 1.00 0.00 C ATOM 0 H THR A 28 -6.664 -22.803 -14.653 1.00 0.00 H new ATOM 0 HA THR A 28 -8.319 -23.237 -12.338 1.00 0.00 H new ATOM 0 HB THR A 28 -7.350 -25.443 -12.251 1.00 0.00 H new ATOM 0 HG1 THR A 28 -5.618 -24.414 -14.283 1.00 0.00 H new ATOM 0 HG21 THR A 28 -8.008 -26.329 -14.462 1.00 0.00 H new ATOM 0 HG22 THR A 28 -9.179 -25.148 -13.828 1.00 0.00 H new ATOM 0 HG23 THR A 28 -8.035 -24.669 -15.104 1.00 0.00 H new ATOM 422 N THR A 29 -6.581 -23.549 -10.420 1.00 0.00 N ATOM 423 CA THR A 29 -5.655 -23.512 -9.273 1.00 0.00 C ATOM 424 C THR A 29 -4.349 -24.276 -9.539 1.00 0.00 C ATOM 425 O THR A 29 -3.313 -23.925 -8.976 1.00 0.00 O ATOM 426 CB THR A 29 -6.348 -24.073 -8.023 1.00 0.00 C ATOM 427 OG1 THR A 29 -6.878 -25.353 -8.299 1.00 0.00 O ATOM 428 CG2 THR A 29 -7.480 -23.162 -7.544 1.00 0.00 C ATOM 0 H THR A 29 -7.472 -23.994 -10.200 1.00 0.00 H new ATOM 0 HA THR A 29 -5.386 -22.468 -9.112 1.00 0.00 H new ATOM 0 HB THR A 29 -5.597 -24.135 -7.235 1.00 0.00 H new ATOM 0 HG1 THR A 29 -7.317 -25.705 -7.497 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.945 -23.594 -6.658 1.00 0.00 H new ATOM 0 HG22 THR A 29 -7.077 -22.179 -7.300 1.00 0.00 H new ATOM 0 HG23 THR A 29 -8.226 -23.063 -8.333 1.00 0.00 H new ATOM 436 N LYS A 30 -4.358 -25.269 -10.441 1.00 0.00 N ATOM 437 CA LYS A 30 -3.160 -26.001 -10.896 1.00 0.00 C ATOM 438 C LYS A 30 -2.265 -25.151 -11.809 1.00 0.00 C ATOM 439 O LYS A 30 -1.046 -25.146 -11.649 1.00 0.00 O ATOM 440 CB LYS A 30 -3.581 -27.299 -11.613 1.00 0.00 C ATOM 441 CG LYS A 30 -4.498 -28.232 -10.799 1.00 0.00 C ATOM 442 CD LYS A 30 -3.892 -28.676 -9.459 1.00 0.00 C ATOM 443 CE LYS A 30 -4.833 -29.671 -8.767 1.00 0.00 C ATOM 444 NZ LYS A 30 -4.276 -30.141 -7.472 1.00 0.00 N1+ ATOM 0 H LYS A 30 -5.216 -25.595 -10.886 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.570 -26.245 -10.013 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.090 -27.034 -12.540 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.682 -27.850 -11.889 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.443 -27.724 -10.610 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.725 -29.115 -11.396 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.918 -29.137 -9.625 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.729 -27.809 -8.818 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -5.801 -29.200 -8.598 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -5.005 -30.526 -9.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -4.938 -30.812 -7.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -3.364 -30.613 -7.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -4.136 -29.328 -6.839 1.00 0.00 H new ATOM 458 N GLU A 31 -2.863 -24.406 -12.738 1.00 0.00 N ATOM 459 CA GLU A 31 -2.161 -23.504 -13.671 1.00 0.00 C ATOM 460 C GLU A 31 -1.633 -22.222 -13.016 1.00 0.00 C ATOM 461 O GLU A 31 -0.748 -21.590 -13.590 1.00 0.00 O ATOM 462 CB GLU A 31 -3.100 -23.141 -14.831 1.00 0.00 C ATOM 463 CG GLU A 31 -3.270 -24.327 -15.798 1.00 0.00 C ATOM 464 CD GLU A 31 -4.646 -24.415 -16.479 1.00 0.00 C ATOM 465 OE1 GLU A 31 -5.645 -23.849 -15.974 1.00 0.00 O ATOM 466 OE2 GLU A 31 -4.758 -25.150 -17.489 1.00 0.00 O1- ATOM 0 H GLU A 31 -3.874 -24.408 -12.872 1.00 0.00 H new ATOM 0 HA GLU A 31 -1.286 -24.047 -14.029 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -4.073 -22.847 -14.437 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.701 -22.282 -15.371 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.503 -24.261 -16.569 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.092 -25.252 -15.250 1.00 0.00 H new ATOM 473 N LEU A 32 -2.110 -21.853 -11.819 1.00 0.00 N ATOM 474 CA LEU A 32 -1.658 -20.669 -11.074 1.00 0.00 C ATOM 475 C LEU A 32 -0.128 -20.614 -10.986 1.00 0.00 C ATOM 476 O LEU A 32 0.482 -19.660 -11.464 1.00 0.00 O ATOM 477 CB LEU A 32 -2.303 -20.686 -9.673 1.00 0.00 C ATOM 478 CG LEU A 32 -2.228 -19.373 -8.860 1.00 0.00 C ATOM 479 CD1 LEU A 32 -2.668 -19.654 -7.425 1.00 0.00 C ATOM 480 CD2 LEU A 32 -0.869 -18.711 -8.771 1.00 0.00 C ATOM 0 H LEU A 32 -2.835 -22.379 -11.332 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.972 -19.769 -11.603 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.353 -20.958 -9.785 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.829 -21.475 -9.089 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.875 -18.686 -9.405 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.619 -18.734 -6.843 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -3.691 -20.029 -7.425 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -2.008 -20.400 -6.982 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.946 -17.801 -8.176 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.162 -19.394 -8.300 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.520 -18.461 -9.773 1.00 0.00 H new ATOM 492 N GLY A 33 0.514 -21.646 -10.432 1.00 0.00 N ATOM 493 CA GLY A 33 1.967 -21.627 -10.253 1.00 0.00 C ATOM 494 C GLY A 33 2.738 -21.593 -11.575 1.00 0.00 C ATOM 495 O GLY A 33 3.828 -21.035 -11.634 1.00 0.00 O ATOM 0 H GLY A 33 0.056 -22.496 -10.103 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.242 -20.756 -9.657 1.00 0.00 H new ATOM 0 HA3 GLY A 33 2.268 -22.508 -9.687 1.00 0.00 H new ATOM 499 N THR A 34 2.156 -22.108 -12.660 1.00 0.00 N ATOM 500 CA THR A 34 2.723 -22.025 -14.016 1.00 0.00 C ATOM 501 C THR A 34 2.578 -20.624 -14.609 1.00 0.00 C ATOM 502 O THR A 34 3.508 -20.115 -15.237 1.00 0.00 O ATOM 503 CB THR A 34 2.074 -23.064 -14.933 1.00 0.00 C ATOM 504 OG1 THR A 34 2.045 -24.311 -14.262 1.00 0.00 O ATOM 505 CG2 THR A 34 2.884 -23.305 -16.201 1.00 0.00 C ATOM 0 H THR A 34 1.265 -22.602 -12.625 1.00 0.00 H new ATOM 0 HA THR A 34 3.789 -22.239 -13.938 1.00 0.00 H new ATOM 0 HB THR A 34 1.085 -22.684 -15.188 1.00 0.00 H new ATOM 0 HG1 THR A 34 1.629 -24.984 -14.840 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.381 -24.050 -16.818 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.973 -22.373 -16.759 1.00 0.00 H new ATOM 0 HG23 THR A 34 3.878 -23.665 -15.935 1.00 0.00 H new ATOM 513 N VAL A 35 1.460 -19.947 -14.329 1.00 0.00 N ATOM 514 CA VAL A 35 1.278 -18.526 -14.635 1.00 0.00 C ATOM 515 C VAL A 35 2.291 -17.674 -13.839 1.00 0.00 C ATOM 516 O VAL A 35 2.904 -16.763 -14.396 1.00 0.00 O ATOM 517 CB VAL A 35 -0.192 -18.099 -14.392 1.00 0.00 C ATOM 518 CG1 VAL A 35 -0.358 -16.578 -14.404 1.00 0.00 C ATOM 519 CG2 VAL A 35 -1.140 -18.659 -15.443 1.00 0.00 C ATOM 0 H VAL A 35 0.650 -20.374 -13.880 1.00 0.00 H new ATOM 0 HA VAL A 35 1.480 -18.354 -15.692 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.441 -18.502 -13.410 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.404 -16.325 -14.230 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.257 -16.139 -13.619 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.046 -16.186 -15.372 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.157 -18.331 -15.228 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -0.844 -18.300 -16.429 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.099 -19.748 -15.427 1.00 0.00 H new ATOM 529 N MET A 36 2.561 -18.009 -12.568 1.00 0.00 N ATOM 530 CA MET A 36 3.627 -17.375 -11.771 1.00 0.00 C ATOM 531 C MET A 36 5.034 -17.667 -12.325 1.00 0.00 C ATOM 532 O MET A 36 5.856 -16.753 -12.396 1.00 0.00 O ATOM 533 CB MET A 36 3.539 -17.771 -10.287 1.00 0.00 C ATOM 534 CG MET A 36 2.214 -17.338 -9.642 1.00 0.00 C ATOM 535 SD MET A 36 2.091 -17.486 -7.839 1.00 0.00 S ATOM 536 CE MET A 36 3.377 -16.346 -7.273 1.00 0.00 C ATOM 0 H MET A 36 2.046 -18.729 -12.061 1.00 0.00 H new ATOM 0 HA MET A 36 3.464 -16.300 -11.850 1.00 0.00 H new ATOM 0 HB2 MET A 36 3.648 -18.852 -10.195 1.00 0.00 H new ATOM 0 HB3 MET A 36 4.369 -17.319 -9.744 1.00 0.00 H new ATOM 0 HG2 MET A 36 2.031 -16.298 -9.910 1.00 0.00 H new ATOM 0 HG3 MET A 36 1.412 -17.928 -10.086 1.00 0.00 H new ATOM 0 HE1 MET A 36 3.206 -16.095 -6.226 1.00 0.00 H new ATOM 0 HE2 MET A 36 4.354 -16.818 -7.378 1.00 0.00 H new ATOM 0 HE3 MET A 36 3.347 -15.437 -7.874 1.00 0.00 H new ATOM 546 N ARG A 37 5.309 -18.890 -12.803 1.00 0.00 N ATOM 547 CA ARG A 37 6.574 -19.243 -13.484 1.00 0.00 C ATOM 548 C ARG A 37 6.790 -18.433 -14.768 1.00 0.00 C ATOM 549 O ARG A 37 7.917 -18.018 -15.036 1.00 0.00 O ATOM 550 CB ARG A 37 6.637 -20.754 -13.755 1.00 0.00 C ATOM 551 CG ARG A 37 7.039 -21.527 -12.491 1.00 0.00 C ATOM 552 CD ARG A 37 7.095 -23.039 -12.739 1.00 0.00 C ATOM 553 NE ARG A 37 5.758 -23.670 -12.793 1.00 0.00 N ATOM 554 CZ ARG A 37 5.085 -24.216 -11.792 1.00 0.00 C ATOM 555 NH1 ARG A 37 5.543 -24.255 -10.573 1.00 0.00 N1+ ATOM 556 NH2 ARG A 37 3.912 -24.749 -11.996 1.00 0.00 N ATOM 0 H ARG A 37 4.658 -19.671 -12.730 1.00 0.00 H new ATOM 0 HA ARG A 37 7.391 -18.980 -12.812 1.00 0.00 H new ATOM 0 HB2 ARG A 37 5.666 -21.104 -14.106 1.00 0.00 H new ATOM 0 HB3 ARG A 37 7.355 -20.954 -14.551 1.00 0.00 H new ATOM 0 HG2 ARG A 37 8.013 -21.179 -12.147 1.00 0.00 H new ATOM 0 HG3 ARG A 37 6.326 -21.316 -11.694 1.00 0.00 H new ATOM 0 HD2 ARG A 37 7.617 -23.228 -13.677 1.00 0.00 H new ATOM 0 HD3 ARG A 37 7.680 -23.509 -11.948 1.00 0.00 H new ATOM 0 HE ARG A 37 5.303 -23.686 -13.706 1.00 0.00 H new ATOM 0 HH11 ARG A 37 6.456 -23.854 -10.358 1.00 0.00 H new ATOM 0 HH12 ARG A 37 4.989 -24.686 -9.833 1.00 0.00 H new ATOM 0 HH21 ARG A 37 3.507 -24.747 -12.932 1.00 0.00 H new ATOM 0 HH22 ARG A 37 3.400 -25.168 -11.219 1.00 0.00 H new ATOM 570 N SER A 38 5.723 -18.131 -15.516 1.00 0.00 N ATOM 571 CA SER A 38 5.762 -17.184 -16.645 1.00 0.00 C ATOM 572 C SER A 38 6.115 -15.755 -16.187 1.00 0.00 C ATOM 573 O SER A 38 6.902 -15.067 -16.840 1.00 0.00 O ATOM 574 CB SER A 38 4.424 -17.217 -17.397 1.00 0.00 C ATOM 575 OG SER A 38 4.441 -16.354 -18.521 1.00 0.00 O ATOM 0 H SER A 38 4.801 -18.537 -15.357 1.00 0.00 H new ATOM 0 HA SER A 38 6.555 -17.496 -17.325 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.213 -18.236 -17.722 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.619 -16.924 -16.723 1.00 0.00 H new ATOM 0 HG SER A 38 3.521 -16.147 -18.788 1.00 0.00 H new ATOM 581 N LEU A 39 5.634 -15.344 -15.005 1.00 0.00 N ATOM 582 CA LEU A 39 6.023 -14.116 -14.287 1.00 0.00 C ATOM 583 C LEU A 39 7.328 -14.258 -13.462 1.00 0.00 C ATOM 584 O LEU A 39 7.524 -13.570 -12.456 1.00 0.00 O ATOM 585 CB LEU A 39 4.821 -13.587 -13.470 1.00 0.00 C ATOM 586 CG LEU A 39 3.629 -13.179 -14.357 1.00 0.00 C ATOM 587 CD1 LEU A 39 2.393 -12.843 -13.537 1.00 0.00 C ATOM 588 CD2 LEU A 39 3.966 -11.969 -15.236 1.00 0.00 C ATOM 0 H LEU A 39 4.931 -15.881 -14.498 1.00 0.00 H new ATOM 0 HA LEU A 39 6.281 -13.362 -15.030 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.499 -14.356 -12.767 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.139 -12.728 -12.879 1.00 0.00 H new ATOM 0 HG LEU A 39 3.419 -14.044 -14.986 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.579 -12.561 -14.205 1.00 0.00 H new ATOM 0 HD12 LEU A 39 2.097 -13.713 -12.951 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.616 -12.013 -12.866 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.101 -11.711 -15.847 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.229 -11.121 -14.603 1.00 0.00 H new ATOM 0 HD23 LEU A 39 4.808 -12.213 -15.884 1.00 0.00 H new ATOM 600 N GLY A 40 8.232 -15.150 -13.885 1.00 0.00 N ATOM 601 CA GLY A 40 9.610 -15.261 -13.394 1.00 0.00 C ATOM 602 C GLY A 40 9.810 -15.792 -11.969 1.00 0.00 C ATOM 603 O GLY A 40 10.901 -15.615 -11.422 1.00 0.00 O ATOM 0 H GLY A 40 8.015 -15.839 -14.605 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.159 -15.910 -14.076 1.00 0.00 H new ATOM 0 HA3 GLY A 40 10.070 -14.274 -13.454 1.00 0.00 H new ATOM 607 N GLN A 41 8.802 -16.419 -11.350 1.00 0.00 N ATOM 608 CA GLN A 41 8.867 -16.888 -9.954 1.00 0.00 C ATOM 609 C GLN A 41 8.198 -18.260 -9.764 1.00 0.00 C ATOM 610 O GLN A 41 7.087 -18.492 -10.236 1.00 0.00 O ATOM 611 CB GLN A 41 8.305 -15.798 -9.020 1.00 0.00 C ATOM 612 CG GLN A 41 6.814 -15.484 -9.233 1.00 0.00 C ATOM 613 CD GLN A 41 6.459 -14.059 -8.823 1.00 0.00 C ATOM 614 OE1 GLN A 41 6.052 -13.791 -7.701 1.00 0.00 O ATOM 615 NE2 GLN A 41 6.608 -13.092 -9.705 1.00 0.00 N ATOM 0 H GLN A 41 7.911 -16.618 -11.804 1.00 0.00 H new ATOM 0 HA GLN A 41 9.910 -17.053 -9.685 1.00 0.00 H new ATOM 0 HB2 GLN A 41 8.454 -16.111 -7.986 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.880 -14.883 -9.162 1.00 0.00 H new ATOM 0 HG2 GLN A 41 6.560 -15.632 -10.283 1.00 0.00 H new ATOM 0 HG3 GLN A 41 6.211 -16.186 -8.657 1.00 0.00 H new ATOM 0 HE21 GLN A 41 6.947 -13.305 -10.643 1.00 0.00 H new ATOM 0 HE22 GLN A 41 6.385 -12.130 -9.450 1.00 0.00 H new ATOM 624 N ASN A 42 8.875 -19.179 -9.069 1.00 0.00 N ATOM 625 CA ASN A 42 8.449 -20.573 -8.896 1.00 0.00 C ATOM 626 C ASN A 42 8.058 -20.877 -7.427 1.00 0.00 C ATOM 627 O ASN A 42 8.908 -21.323 -6.648 1.00 0.00 O ATOM 628 CB ASN A 42 9.566 -21.489 -9.431 1.00 0.00 C ATOM 629 CG ASN A 42 9.184 -22.959 -9.362 1.00 0.00 C ATOM 630 OD1 ASN A 42 8.031 -23.335 -9.526 1.00 0.00 O ATOM 631 ND2 ASN A 42 10.130 -23.841 -9.132 1.00 0.00 N ATOM 0 H ASN A 42 9.756 -18.970 -8.599 1.00 0.00 H new ATOM 0 HA ASN A 42 7.542 -20.762 -9.470 1.00 0.00 H new ATOM 0 HB2 ASN A 42 9.790 -21.221 -10.464 1.00 0.00 H new ATOM 0 HB3 ASN A 42 10.476 -21.324 -8.855 1.00 0.00 H new ATOM 0 HD21 ASN A 42 9.902 -24.834 -9.091 1.00 0.00 H new ATOM 0 HD22 ASN A 42 11.092 -23.532 -8.995 1.00 0.00 H new ATOM 638 N PRO A 43 6.799 -20.622 -7.017 1.00 0.00 N ATOM 639 CA PRO A 43 6.293 -20.955 -5.680 1.00 0.00 C ATOM 640 C PRO A 43 6.191 -22.475 -5.448 1.00 0.00 C ATOM 641 O PRO A 43 6.023 -23.257 -6.388 1.00 0.00 O ATOM 642 CB PRO A 43 4.923 -20.282 -5.592 1.00 0.00 C ATOM 643 CG PRO A 43 4.454 -20.327 -7.043 1.00 0.00 C ATOM 644 CD PRO A 43 5.729 -20.049 -7.822 1.00 0.00 C ATOM 0 HA PRO A 43 6.974 -20.603 -4.905 1.00 0.00 H new ATOM 0 HB2 PRO A 43 4.246 -20.819 -4.928 1.00 0.00 H new ATOM 0 HB3 PRO A 43 4.993 -19.261 -5.217 1.00 0.00 H new ATOM 0 HG2 PRO A 43 4.027 -21.297 -7.300 1.00 0.00 H new ATOM 0 HG3 PRO A 43 3.687 -19.578 -7.243 1.00 0.00 H new ATOM 0 HD2 PRO A 43 5.693 -20.504 -8.812 1.00 0.00 H new ATOM 0 HD3 PRO A 43 5.876 -18.979 -7.969 1.00 0.00 H new ATOM 652 N THR A 44 6.257 -22.899 -4.182 1.00 0.00 N ATOM 653 CA THR A 44 6.022 -24.297 -3.769 1.00 0.00 C ATOM 654 C THR A 44 4.531 -24.657 -3.803 1.00 0.00 C ATOM 655 O THR A 44 3.663 -23.781 -3.794 1.00 0.00 O ATOM 656 CB THR A 44 6.582 -24.583 -2.364 1.00 0.00 C ATOM 657 OG1 THR A 44 5.851 -23.886 -1.378 1.00 0.00 O ATOM 658 CG2 THR A 44 8.056 -24.198 -2.219 1.00 0.00 C ATOM 0 H THR A 44 6.477 -22.279 -3.403 1.00 0.00 H new ATOM 0 HA THR A 44 6.552 -24.919 -4.491 1.00 0.00 H new ATOM 0 HB THR A 44 6.488 -25.660 -2.226 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.223 -24.084 -0.493 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.393 -24.423 -1.207 1.00 0.00 H new ATOM 0 HG22 THR A 44 8.652 -24.764 -2.935 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.174 -23.132 -2.412 1.00 0.00 H new ATOM 666 N GLU A 45 4.205 -25.952 -3.793 1.00 0.00 N ATOM 667 CA GLU A 45 2.811 -26.426 -3.712 1.00 0.00 C ATOM 668 C GLU A 45 2.109 -25.953 -2.423 1.00 0.00 C ATOM 669 O GLU A 45 0.929 -25.604 -2.453 1.00 0.00 O ATOM 670 CB GLU A 45 2.772 -27.963 -3.788 1.00 0.00 C ATOM 671 CG GLU A 45 3.408 -28.563 -5.054 1.00 0.00 C ATOM 672 CD GLU A 45 2.815 -28.019 -6.372 1.00 0.00 C ATOM 673 OE1 GLU A 45 1.575 -27.848 -6.468 1.00 0.00 O ATOM 674 OE2 GLU A 45 3.588 -27.791 -7.334 1.00 0.00 O1- ATOM 0 H GLU A 45 4.893 -26.703 -3.840 1.00 0.00 H new ATOM 0 HA GLU A 45 2.273 -25.998 -4.558 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.283 -28.369 -2.915 1.00 0.00 H new ATOM 0 HB3 GLU A 45 1.734 -28.289 -3.731 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.479 -28.363 -5.040 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.285 -29.646 -5.032 1.00 0.00 H new ATOM 681 N ALA A 46 2.840 -25.884 -1.304 1.00 0.00 N ATOM 682 CA ALA A 46 2.336 -25.367 -0.031 1.00 0.00 C ATOM 683 C ALA A 46 2.084 -23.846 -0.077 1.00 0.00 C ATOM 684 O ALA A 46 1.038 -23.381 0.376 1.00 0.00 O ATOM 685 CB ALA A 46 3.336 -25.738 1.071 1.00 0.00 C ATOM 0 H ALA A 46 3.812 -26.191 -1.259 1.00 0.00 H new ATOM 0 HA ALA A 46 1.368 -25.821 0.179 1.00 0.00 H new ATOM 0 HB1 ALA A 46 2.978 -25.361 2.029 1.00 0.00 H new ATOM 0 HB2 ALA A 46 3.436 -26.822 1.122 1.00 0.00 H new ATOM 0 HB3 ALA A 46 4.306 -25.295 0.846 1.00 0.00 H new ATOM 691 N GLU A 47 2.999 -23.070 -0.667 1.00 0.00 N ATOM 692 CA GLU A 47 2.835 -21.621 -0.851 1.00 0.00 C ATOM 693 C GLU A 47 1.657 -21.300 -1.786 1.00 0.00 C ATOM 694 O GLU A 47 0.857 -20.412 -1.490 1.00 0.00 O ATOM 695 CB GLU A 47 4.156 -21.040 -1.388 1.00 0.00 C ATOM 696 CG GLU A 47 4.155 -19.522 -1.627 1.00 0.00 C ATOM 697 CD GLU A 47 3.881 -18.676 -0.367 1.00 0.00 C ATOM 698 OE1 GLU A 47 4.167 -19.122 0.770 1.00 0.00 O ATOM 699 OE2 GLU A 47 3.424 -17.519 -0.523 1.00 0.00 O1- ATOM 0 H GLU A 47 3.880 -23.430 -1.033 1.00 0.00 H new ATOM 0 HA GLU A 47 2.600 -21.160 0.108 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.953 -21.280 -0.684 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.399 -21.539 -2.326 1.00 0.00 H new ATOM 0 HG2 GLU A 47 5.121 -19.232 -2.041 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.402 -19.286 -2.379 1.00 0.00 H new ATOM 706 N LEU A 48 1.493 -22.063 -2.873 1.00 0.00 N ATOM 707 CA LEU A 48 0.330 -21.964 -3.756 1.00 0.00 C ATOM 708 C LEU A 48 -0.972 -22.290 -3.017 1.00 0.00 C ATOM 709 O LEU A 48 -1.915 -21.509 -3.101 1.00 0.00 O ATOM 710 CB LEU A 48 0.513 -22.889 -4.972 1.00 0.00 C ATOM 711 CG LEU A 48 1.570 -22.393 -5.974 1.00 0.00 C ATOM 712 CD1 LEU A 48 1.927 -23.519 -6.944 1.00 0.00 C ATOM 713 CD2 LEU A 48 1.053 -21.203 -6.775 1.00 0.00 C ATOM 0 H LEU A 48 2.168 -22.770 -3.164 1.00 0.00 H new ATOM 0 HA LEU A 48 0.255 -20.933 -4.101 1.00 0.00 H new ATOM 0 HB2 LEU A 48 0.795 -23.882 -4.622 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -0.443 -22.991 -5.486 1.00 0.00 H new ATOM 0 HG LEU A 48 2.450 -22.084 -5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.676 -23.165 -7.653 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.327 -24.366 -6.387 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.033 -23.830 -7.485 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.821 -20.874 -7.475 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.160 -21.497 -7.328 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.807 -20.387 -6.096 1.00 0.00 H new ATOM 725 N GLN A 49 -1.029 -23.385 -2.250 1.00 0.00 N ATOM 726 CA GLN A 49 -2.209 -23.746 -1.455 1.00 0.00 C ATOM 727 C GLN A 49 -2.576 -22.655 -0.428 1.00 0.00 C ATOM 728 O GLN A 49 -3.750 -22.314 -0.282 1.00 0.00 O ATOM 729 CB GLN A 49 -1.963 -25.108 -0.783 1.00 0.00 C ATOM 730 CG GLN A 49 -3.168 -25.600 0.038 1.00 0.00 C ATOM 731 CD GLN A 49 -2.993 -27.012 0.603 1.00 0.00 C ATOM 732 OE1 GLN A 49 -1.952 -27.652 0.511 1.00 0.00 O ATOM 733 NE2 GLN A 49 -4.017 -27.563 1.224 1.00 0.00 N ATOM 0 H GLN A 49 -0.258 -24.047 -2.163 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.069 -23.826 -2.120 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -1.726 -25.847 -1.548 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -1.092 -25.033 -0.131 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -3.342 -24.908 0.862 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.058 -25.578 -0.591 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.895 -27.051 1.314 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.932 -28.501 1.615 1.00 0.00 H new ATOM 742 N ASP A 50 -1.580 -22.058 0.231 1.00 0.00 N ATOM 743 CA ASP A 50 -1.766 -20.944 1.169 1.00 0.00 C ATOM 744 C ASP A 50 -2.329 -19.677 0.495 1.00 0.00 C ATOM 745 O ASP A 50 -3.186 -19.010 1.078 1.00 0.00 O ATOM 746 CB ASP A 50 -0.437 -20.641 1.887 1.00 0.00 C ATOM 747 CG ASP A 50 -0.023 -21.683 2.949 1.00 0.00 C ATOM 748 OD1 ASP A 50 1.123 -21.588 3.453 1.00 0.00 O ATOM 749 OD2 ASP A 50 -0.840 -22.549 3.347 1.00 0.00 O1- ATOM 0 H ASP A 50 -0.605 -22.338 0.127 1.00 0.00 H new ATOM 0 HA ASP A 50 -2.513 -21.255 1.899 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.355 -20.569 1.141 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.513 -19.665 2.366 1.00 0.00 H new ATOM 754 N MET A 51 -1.915 -19.362 -0.740 1.00 0.00 N ATOM 755 CA MET A 51 -2.502 -18.263 -1.527 1.00 0.00 C ATOM 756 C MET A 51 -3.900 -18.609 -2.073 1.00 0.00 C ATOM 757 O MET A 51 -4.804 -17.771 -2.026 1.00 0.00 O ATOM 758 CB MET A 51 -1.556 -17.852 -2.668 1.00 0.00 C ATOM 759 CG MET A 51 -0.247 -17.254 -2.130 1.00 0.00 C ATOM 760 SD MET A 51 0.888 -16.552 -3.358 1.00 0.00 S ATOM 761 CE MET A 51 1.266 -18.037 -4.314 1.00 0.00 C ATOM 0 H MET A 51 -1.166 -19.859 -1.223 1.00 0.00 H new ATOM 0 HA MET A 51 -2.629 -17.418 -0.851 1.00 0.00 H new ATOM 0 HB2 MET A 51 -1.332 -18.721 -3.287 1.00 0.00 H new ATOM 0 HB3 MET A 51 -2.053 -17.124 -3.309 1.00 0.00 H new ATOM 0 HG2 MET A 51 -0.499 -16.473 -1.412 1.00 0.00 H new ATOM 0 HG3 MET A 51 0.283 -18.032 -1.581 1.00 0.00 H new ATOM 0 HE1 MET A 51 2.173 -17.874 -4.896 1.00 0.00 H new ATOM 0 HE2 MET A 51 1.416 -18.877 -3.636 1.00 0.00 H new ATOM 0 HE3 MET A 51 0.437 -18.257 -4.987 1.00 0.00 H new ATOM 771 N ILE A 52 -4.118 -19.845 -2.539 1.00 0.00 N ATOM 772 CA ILE A 52 -5.415 -20.317 -3.058 1.00 0.00 C ATOM 773 C ILE A 52 -6.485 -20.350 -1.955 1.00 0.00 C ATOM 774 O ILE A 52 -7.653 -20.106 -2.248 1.00 0.00 O ATOM 775 CB ILE A 52 -5.271 -21.673 -3.797 1.00 0.00 C ATOM 776 CG1 ILE A 52 -4.480 -21.475 -5.109 1.00 0.00 C ATOM 777 CG2 ILE A 52 -6.637 -22.290 -4.151 1.00 0.00 C ATOM 778 CD1 ILE A 52 -3.813 -22.755 -5.630 1.00 0.00 C ATOM 0 H ILE A 52 -3.390 -20.559 -2.568 1.00 0.00 H new ATOM 0 HA ILE A 52 -5.761 -19.597 -3.800 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.746 -22.348 -3.121 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -5.154 -21.091 -5.874 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -3.714 -20.716 -4.949 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.485 -23.238 -4.667 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -7.207 -22.461 -3.238 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.187 -21.608 -4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.277 -22.536 -6.553 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.112 -23.130 -4.884 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.575 -23.510 -5.823 1.00 0.00 H new ATOM 790 N ASN A 53 -6.125 -20.550 -0.683 1.00 0.00 N ATOM 791 CA ASN A 53 -7.072 -20.511 0.440 1.00 0.00 C ATOM 792 C ASN A 53 -7.836 -19.168 0.561 1.00 0.00 C ATOM 793 O ASN A 53 -8.993 -19.155 0.981 1.00 0.00 O ATOM 794 CB ASN A 53 -6.294 -20.837 1.726 1.00 0.00 C ATOM 795 CG ASN A 53 -7.196 -20.928 2.946 1.00 0.00 C ATOM 796 OD1 ASN A 53 -7.276 -20.020 3.761 1.00 0.00 O ATOM 797 ND2 ASN A 53 -7.906 -22.023 3.113 1.00 0.00 N ATOM 0 H ASN A 53 -5.164 -20.745 -0.400 1.00 0.00 H new ATOM 0 HA ASN A 53 -7.850 -21.254 0.263 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -5.766 -21.782 1.597 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -5.538 -20.070 1.894 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -8.522 -22.113 3.921 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -7.841 -22.782 2.434 1.00 0.00 H new ATOM 804 N GLU A 54 -7.227 -18.048 0.153 1.00 0.00 N ATOM 805 CA GLU A 54 -7.876 -16.723 0.098 1.00 0.00 C ATOM 806 C GLU A 54 -8.749 -16.510 -1.159 1.00 0.00 C ATOM 807 O GLU A 54 -9.581 -15.600 -1.192 1.00 0.00 O ATOM 808 CB GLU A 54 -6.804 -15.620 0.147 1.00 0.00 C ATOM 809 CG GLU A 54 -5.940 -15.653 1.414 1.00 0.00 C ATOM 810 CD GLU A 54 -5.010 -14.430 1.458 1.00 0.00 C ATOM 811 OE1 GLU A 54 -3.818 -14.544 1.090 1.00 0.00 O ATOM 812 OE2 GLU A 54 -5.454 -13.321 1.842 1.00 0.00 O1- ATOM 0 H GLU A 54 -6.254 -18.032 -0.154 1.00 0.00 H new ATOM 0 HA GLU A 54 -8.539 -16.673 0.962 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.157 -15.716 -0.725 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -7.292 -14.648 0.077 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -6.578 -15.665 2.297 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -5.349 -16.569 1.436 1.00 0.00 H new ATOM 819 N VAL A 55 -8.549 -17.328 -2.199 1.00 0.00 N ATOM 820 CA VAL A 55 -9.105 -17.161 -3.557 1.00 0.00 C ATOM 821 C VAL A 55 -10.234 -18.152 -3.870 1.00 0.00 C ATOM 822 O VAL A 55 -11.252 -17.767 -4.444 1.00 0.00 O ATOM 823 CB VAL A 55 -7.950 -17.296 -4.571 1.00 0.00 C ATOM 824 CG1 VAL A 55 -8.391 -17.447 -6.029 1.00 0.00 C ATOM 825 CG2 VAL A 55 -7.016 -16.083 -4.479 1.00 0.00 C ATOM 0 H VAL A 55 -7.970 -18.164 -2.119 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.560 -16.173 -3.625 1.00 0.00 H new ATOM 0 HB VAL A 55 -7.443 -18.220 -4.292 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.512 -17.535 -6.668 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -9.006 -18.341 -6.132 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.970 -16.572 -6.327 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -6.206 -16.192 -5.200 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.577 -15.174 -4.698 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -6.600 -16.019 -3.473 1.00 0.00 H new ATOM 835 N ASP A 56 -10.069 -19.417 -3.484 1.00 0.00 N ATOM 836 CA ASP A 56 -10.948 -20.544 -3.814 1.00 0.00 C ATOM 837 C ASP A 56 -11.497 -21.244 -2.554 1.00 0.00 C ATOM 838 O ASP A 56 -11.447 -22.469 -2.415 1.00 0.00 O ATOM 839 CB ASP A 56 -10.242 -21.509 -4.778 1.00 0.00 C ATOM 840 CG ASP A 56 -11.204 -22.568 -5.340 1.00 0.00 C ATOM 841 OD1 ASP A 56 -10.740 -23.685 -5.663 1.00 0.00 O ATOM 842 OD2 ASP A 56 -12.421 -22.295 -5.475 1.00 0.00 O1- ATOM 0 H ASP A 56 -9.280 -19.700 -2.903 1.00 0.00 H new ATOM 0 HA ASP A 56 -11.824 -20.153 -4.330 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.804 -20.944 -5.601 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.421 -22.004 -4.259 1.00 0.00 H new ATOM 847 N ALA A 57 -12.023 -20.460 -1.607 1.00 0.00 N ATOM 848 CA ALA A 57 -12.656 -20.980 -0.389 1.00 0.00 C ATOM 849 C ALA A 57 -13.879 -21.885 -0.677 1.00 0.00 C ATOM 850 O ALA A 57 -14.221 -22.749 0.134 1.00 0.00 O ATOM 851 CB ALA A 57 -13.052 -19.784 0.481 1.00 0.00 C ATOM 0 H ALA A 57 -12.022 -19.442 -1.664 1.00 0.00 H new ATOM 0 HA ALA A 57 -11.941 -21.618 0.130 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.526 -20.140 1.395 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -12.162 -19.208 0.734 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -13.750 -19.151 -0.067 1.00 0.00 H new ATOM 857 N ASP A 58 -14.518 -21.715 -1.840 1.00 0.00 N ATOM 858 CA ASP A 58 -15.617 -22.561 -2.330 1.00 0.00 C ATOM 859 C ASP A 58 -15.153 -23.916 -2.916 1.00 0.00 C ATOM 860 O ASP A 58 -15.976 -24.813 -3.114 1.00 0.00 O ATOM 861 CB ASP A 58 -16.431 -21.779 -3.377 1.00 0.00 C ATOM 862 CG ASP A 58 -17.140 -20.519 -2.841 1.00 0.00 C ATOM 863 OD1 ASP A 58 -17.490 -19.640 -3.665 1.00 0.00 O ATOM 864 OD2 ASP A 58 -17.393 -20.405 -1.616 1.00 0.00 O1- ATOM 0 H ASP A 58 -14.279 -20.963 -2.487 1.00 0.00 H new ATOM 0 HA ASP A 58 -16.234 -22.808 -1.466 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -15.765 -21.486 -4.188 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -17.180 -22.445 -3.805 1.00 0.00 H new ATOM 869 N GLY A 59 -13.853 -24.090 -3.187 1.00 0.00 N ATOM 870 CA GLY A 59 -13.265 -25.336 -3.699 1.00 0.00 C ATOM 871 C GLY A 59 -13.635 -25.682 -5.150 1.00 0.00 C ATOM 872 O GLY A 59 -13.744 -26.864 -5.488 1.00 0.00 O ATOM 0 H GLY A 59 -13.163 -23.350 -3.053 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.180 -25.265 -3.624 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.576 -26.158 -3.055 1.00 0.00 H new ATOM 876 N ASN A 60 -13.866 -24.682 -6.008 1.00 0.00 N ATOM 877 CA ASN A 60 -14.236 -24.869 -7.418 1.00 0.00 C ATOM 878 C ASN A 60 -13.046 -25.265 -8.321 1.00 0.00 C ATOM 879 O ASN A 60 -13.247 -25.767 -9.428 1.00 0.00 O ATOM 880 CB ASN A 60 -14.907 -23.577 -7.921 1.00 0.00 C ATOM 881 CG ASN A 60 -15.704 -23.815 -9.196 1.00 0.00 C ATOM 882 OD1 ASN A 60 -16.697 -24.532 -9.205 1.00 0.00 O ATOM 883 ND2 ASN A 60 -15.321 -23.233 -10.310 1.00 0.00 N ATOM 0 H ASN A 60 -13.800 -23.701 -5.738 1.00 0.00 H new ATOM 0 HA ASN A 60 -14.929 -25.708 -7.475 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -15.567 -23.185 -7.147 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -14.145 -22.819 -8.104 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -15.849 -23.380 -11.170 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -14.496 -22.634 -10.315 1.00 0.00 H new ATOM 890 N GLY A 61 -11.808 -25.044 -7.865 1.00 0.00 N ATOM 891 CA GLY A 61 -10.569 -25.314 -8.598 1.00 0.00 C ATOM 892 C GLY A 61 -10.198 -24.249 -9.636 1.00 0.00 C ATOM 893 O GLY A 61 -9.394 -24.530 -10.527 1.00 0.00 O ATOM 0 H GLY A 61 -11.636 -24.656 -6.937 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -9.752 -25.406 -7.883 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -10.662 -26.276 -9.101 1.00 0.00 H new ATOM 897 N THR A 62 -10.763 -23.038 -9.546 1.00 0.00 N ATOM 898 CA THR A 62 -10.593 -21.948 -10.530 1.00 0.00 C ATOM 899 C THR A 62 -10.303 -20.581 -9.899 1.00 0.00 C ATOM 900 O THR A 62 -10.574 -20.344 -8.720 1.00 0.00 O ATOM 901 CB THR A 62 -11.803 -21.827 -11.469 1.00 0.00 C ATOM 902 OG1 THR A 62 -12.987 -21.567 -10.737 1.00 0.00 O ATOM 903 CG2 THR A 62 -12.041 -23.091 -12.295 1.00 0.00 C ATOM 0 H THR A 62 -11.368 -22.777 -8.768 1.00 0.00 H new ATOM 0 HA THR A 62 -9.713 -22.235 -11.105 1.00 0.00 H new ATOM 0 HB THR A 62 -11.569 -21.001 -12.141 1.00 0.00 H new ATOM 0 HG1 THR A 62 -13.663 -21.183 -11.334 1.00 0.00 H new ATOM 0 HG21 THR A 62 -12.908 -22.947 -12.939 1.00 0.00 H new ATOM 0 HG22 THR A 62 -11.163 -23.296 -12.908 1.00 0.00 H new ATOM 0 HG23 THR A 62 -12.221 -23.933 -11.627 1.00 0.00 H new ATOM 911 N ILE A 63 -9.743 -19.679 -10.711 1.00 0.00 N ATOM 912 CA ILE A 63 -9.278 -18.331 -10.352 1.00 0.00 C ATOM 913 C ILE A 63 -9.600 -17.365 -11.498 1.00 0.00 C ATOM 914 O ILE A 63 -9.350 -17.696 -12.656 1.00 0.00 O ATOM 915 CB ILE A 63 -7.750 -18.335 -10.091 1.00 0.00 C ATOM 916 CG1 ILE A 63 -7.320 -19.439 -9.103 1.00 0.00 C ATOM 917 CG2 ILE A 63 -7.273 -16.941 -9.635 1.00 0.00 C ATOM 918 CD1 ILE A 63 -5.807 -19.510 -8.917 1.00 0.00 C ATOM 0 H ILE A 63 -9.592 -19.881 -11.699 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.786 -18.011 -9.442 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.260 -18.570 -11.036 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -7.792 -19.260 -8.137 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -7.683 -20.402 -9.461 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -6.198 -16.965 -9.457 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -7.496 -16.208 -10.411 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -7.787 -16.664 -8.715 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.564 -20.305 -8.211 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -5.332 -19.718 -9.876 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.443 -18.558 -8.531 1.00 0.00 H new ATOM 930 N ASP A 64 -10.106 -16.167 -11.198 1.00 0.00 N ATOM 931 CA ASP A 64 -10.280 -15.088 -12.184 1.00 0.00 C ATOM 932 C ASP A 64 -9.039 -14.185 -12.252 1.00 0.00 C ATOM 933 O ASP A 64 -8.319 -14.050 -11.263 1.00 0.00 O ATOM 934 CB ASP A 64 -11.500 -14.204 -11.869 1.00 0.00 C ATOM 935 CG ASP A 64 -12.811 -14.915 -11.468 1.00 0.00 C ATOM 936 OD1 ASP A 64 -13.008 -16.119 -11.755 1.00 0.00 O ATOM 937 OD2 ASP A 64 -13.688 -14.232 -10.885 1.00 0.00 O1- ATOM 0 H ASP A 64 -10.410 -15.912 -10.258 1.00 0.00 H new ATOM 0 HA ASP A 64 -10.434 -15.583 -13.143 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.224 -13.526 -11.061 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.705 -13.589 -12.745 1.00 0.00 H new ATOM 942 N PHE A 65 -8.839 -13.482 -13.370 1.00 0.00 N ATOM 943 CA PHE A 65 -7.758 -12.501 -13.537 1.00 0.00 C ATOM 944 C PHE A 65 -7.584 -11.545 -12.334 1.00 0.00 C ATOM 945 O PHE A 65 -6.495 -11.528 -11.756 1.00 0.00 O ATOM 946 CB PHE A 65 -7.949 -11.738 -14.858 1.00 0.00 C ATOM 947 CG PHE A 65 -7.043 -10.528 -15.001 1.00 0.00 C ATOM 948 CD1 PHE A 65 -7.582 -9.225 -14.987 1.00 0.00 C ATOM 949 CD2 PHE A 65 -5.650 -10.704 -15.096 1.00 0.00 C ATOM 950 CE1 PHE A 65 -6.732 -8.106 -15.067 1.00 0.00 C ATOM 951 CE2 PHE A 65 -4.806 -9.584 -15.173 1.00 0.00 C ATOM 952 CZ PHE A 65 -5.343 -8.289 -15.162 1.00 0.00 C ATOM 0 H PHE A 65 -9.429 -13.578 -14.196 1.00 0.00 H new ATOM 0 HA PHE A 65 -6.823 -13.060 -13.577 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -7.766 -12.418 -15.690 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -8.987 -11.414 -14.933 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -8.650 -9.085 -14.915 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -5.230 -11.699 -15.110 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -7.147 -7.109 -15.055 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -3.737 -9.721 -15.241 1.00 0.00 H new ATOM 0 HZ PHE A 65 -4.689 -7.432 -15.227 1.00 0.00 H new ATOM 962 N PRO A 66 -8.614 -10.794 -11.881 1.00 0.00 N ATOM 963 CA PRO A 66 -8.462 -9.886 -10.743 1.00 0.00 C ATOM 964 C PRO A 66 -8.305 -10.609 -9.397 1.00 0.00 C ATOM 965 O PRO A 66 -7.721 -10.053 -8.465 1.00 0.00 O ATOM 966 CB PRO A 66 -9.703 -8.988 -10.776 1.00 0.00 C ATOM 967 CG PRO A 66 -10.767 -9.879 -11.415 1.00 0.00 C ATOM 968 CD PRO A 66 -9.965 -10.702 -12.422 1.00 0.00 C ATOM 0 HA PRO A 66 -7.540 -9.312 -10.831 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -9.994 -8.668 -9.776 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -9.530 -8.085 -11.362 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.260 -10.512 -10.677 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -11.546 -9.292 -11.902 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -10.401 -11.692 -12.552 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.961 -10.224 -13.402 1.00 0.00 H new ATOM 976 N GLU A 67 -8.775 -11.854 -9.284 1.00 0.00 N ATOM 977 CA GLU A 67 -8.591 -12.683 -8.088 1.00 0.00 C ATOM 978 C GLU A 67 -7.154 -13.225 -7.980 1.00 0.00 C ATOM 979 O GLU A 67 -6.637 -13.374 -6.875 1.00 0.00 O ATOM 980 CB GLU A 67 -9.630 -13.821 -8.078 1.00 0.00 C ATOM 981 CG GLU A 67 -10.170 -14.096 -6.668 1.00 0.00 C ATOM 982 CD GLU A 67 -10.980 -12.920 -6.077 1.00 0.00 C ATOM 983 OE1 GLU A 67 -10.781 -12.587 -4.885 1.00 0.00 O ATOM 984 OE2 GLU A 67 -11.828 -12.328 -6.786 1.00 0.00 O1- ATOM 0 H GLU A 67 -9.298 -12.320 -10.026 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.750 -12.058 -7.209 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.457 -13.562 -8.739 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.177 -14.729 -8.476 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.802 -14.984 -6.696 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.334 -14.321 -6.005 1.00 0.00 H new ATOM 991 N PHE A 68 -6.467 -13.452 -9.106 1.00 0.00 N ATOM 992 CA PHE A 68 -5.035 -13.767 -9.140 1.00 0.00 C ATOM 993 C PHE A 68 -4.163 -12.581 -8.694 1.00 0.00 C ATOM 994 O PHE A 68 -3.226 -12.755 -7.911 1.00 0.00 O ATOM 995 CB PHE A 68 -4.651 -14.248 -10.546 1.00 0.00 C ATOM 996 CG PHE A 68 -3.160 -14.397 -10.797 1.00 0.00 C ATOM 997 CD1 PHE A 68 -2.548 -13.715 -11.869 1.00 0.00 C ATOM 998 CD2 PHE A 68 -2.381 -15.220 -9.962 1.00 0.00 C ATOM 999 CE1 PHE A 68 -1.172 -13.869 -12.114 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -1.000 -15.351 -10.192 1.00 0.00 C ATOM 1001 CZ PHE A 68 -0.399 -14.686 -11.273 1.00 0.00 C ATOM 0 H PHE A 68 -6.896 -13.422 -10.031 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.846 -14.566 -8.423 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.131 -15.210 -10.727 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.057 -13.547 -11.275 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -3.139 -13.072 -12.504 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.844 -15.751 -9.144 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.710 -13.360 -12.947 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.400 -15.964 -9.536 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.659 -14.803 -11.458 1.00 0.00 H new ATOM 1011 N LEU A 69 -4.487 -11.356 -9.124 1.00 0.00 N ATOM 1012 CA LEU A 69 -3.674 -10.171 -8.809 1.00 0.00 C ATOM 1013 C LEU A 69 -3.592 -9.854 -7.303 1.00 0.00 C ATOM 1014 O LEU A 69 -2.633 -9.210 -6.872 1.00 0.00 O ATOM 1015 CB LEU A 69 -4.190 -8.945 -9.589 1.00 0.00 C ATOM 1016 CG LEU A 69 -4.226 -9.048 -11.129 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -4.198 -7.644 -11.728 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -3.076 -9.851 -11.730 1.00 0.00 C ATOM 0 H LEU A 69 -5.310 -11.157 -9.693 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.658 -10.409 -9.122 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.200 -8.725 -9.242 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.568 -8.090 -9.323 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.145 -9.580 -11.373 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.223 -7.712 -12.816 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.065 -7.082 -11.379 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -3.286 -7.134 -11.417 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -3.177 -9.874 -12.815 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.128 -9.384 -11.463 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -3.101 -10.869 -11.341 1.00 0.00 H new ATOM 1030 N THR A 70 -4.538 -10.343 -6.490 1.00 0.00 N ATOM 1031 CA THR A 70 -4.540 -10.124 -5.033 1.00 0.00 C ATOM 1032 C THR A 70 -3.281 -10.675 -4.351 1.00 0.00 C ATOM 1033 O THR A 70 -2.726 -10.023 -3.468 1.00 0.00 O ATOM 1034 CB THR A 70 -5.834 -10.670 -4.390 1.00 0.00 C ATOM 1035 OG1 THR A 70 -6.121 -9.950 -3.209 1.00 0.00 O ATOM 1036 CG2 THR A 70 -5.792 -12.145 -3.981 1.00 0.00 C ATOM 0 H THR A 70 -5.324 -10.902 -6.821 1.00 0.00 H new ATOM 0 HA THR A 70 -4.520 -9.046 -4.873 1.00 0.00 H new ATOM 0 HB THR A 70 -6.586 -10.556 -5.171 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.943 -10.298 -2.805 1.00 0.00 H new ATOM 0 HG21 THR A 70 -6.748 -12.428 -3.541 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.601 -12.761 -4.860 1.00 0.00 H new ATOM 0 HG23 THR A 70 -4.997 -12.298 -3.251 1.00 0.00 H new ATOM 1044 N MET A 71 -2.767 -11.834 -4.794 1.00 0.00 N ATOM 1045 CA MET A 71 -1.537 -12.428 -4.250 1.00 0.00 C ATOM 1046 C MET A 71 -0.270 -11.844 -4.888 1.00 0.00 C ATOM 1047 O MET A 71 0.757 -11.728 -4.215 1.00 0.00 O ATOM 1048 CB MET A 71 -1.596 -13.958 -4.352 1.00 0.00 C ATOM 1049 CG MET A 71 -1.198 -14.521 -5.723 1.00 0.00 C ATOM 1050 SD MET A 71 -1.848 -16.169 -6.088 1.00 0.00 S ATOM 1051 CE MET A 71 -3.618 -15.791 -6.151 1.00 0.00 C ATOM 0 H MET A 71 -3.193 -12.385 -5.539 1.00 0.00 H new ATOM 0 HA MET A 71 -1.476 -12.165 -3.194 1.00 0.00 H new ATOM 0 HB2 MET A 71 -0.940 -14.385 -3.594 1.00 0.00 H new ATOM 0 HB3 MET A 71 -2.609 -14.286 -4.119 1.00 0.00 H new ATOM 0 HG2 MET A 71 -1.540 -13.832 -6.495 1.00 0.00 H new ATOM 0 HG3 MET A 71 -0.110 -14.554 -5.784 1.00 0.00 H new ATOM 0 HE1 MET A 71 -4.096 -16.413 -6.908 1.00 0.00 H new ATOM 0 HE2 MET A 71 -4.068 -15.993 -5.179 1.00 0.00 H new ATOM 0 HE3 MET A 71 -3.757 -14.740 -6.404 1.00 0.00 H new ATOM 1061 N MET A 72 -0.347 -11.407 -6.151 1.00 0.00 N ATOM 1062 CA MET A 72 0.768 -10.745 -6.841 1.00 0.00 C ATOM 1063 C MET A 72 1.167 -9.453 -6.123 1.00 0.00 C ATOM 1064 O MET A 72 2.356 -9.199 -5.936 1.00 0.00 O ATOM 1065 CB MET A 72 0.440 -10.480 -8.318 1.00 0.00 C ATOM 1066 CG MET A 72 0.167 -11.786 -9.080 1.00 0.00 C ATOM 1067 SD MET A 72 1.552 -12.969 -9.141 1.00 0.00 S ATOM 1068 CE MET A 72 2.686 -12.081 -10.240 1.00 0.00 C ATOM 0 H MET A 72 -1.185 -11.502 -6.724 1.00 0.00 H new ATOM 0 HA MET A 72 1.621 -11.423 -6.814 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.432 -9.829 -8.387 1.00 0.00 H new ATOM 0 HB3 MET A 72 1.270 -9.951 -8.787 1.00 0.00 H new ATOM 0 HG2 MET A 72 -0.689 -12.281 -8.621 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.119 -11.536 -10.102 1.00 0.00 H new ATOM 0 HE1 MET A 72 3.248 -12.798 -10.839 1.00 0.00 H new ATOM 0 HE2 MET A 72 2.116 -11.426 -10.899 1.00 0.00 H new ATOM 0 HE3 MET A 72 3.377 -11.484 -9.645 1.00 0.00 H new ATOM 1078 N ALA A 73 0.188 -8.700 -5.610 1.00 0.00 N ATOM 1079 CA ALA A 73 0.433 -7.515 -4.793 1.00 0.00 C ATOM 1080 C ALA A 73 1.310 -7.814 -3.554 1.00 0.00 C ATOM 1081 O ALA A 73 2.249 -7.068 -3.269 1.00 0.00 O ATOM 1082 CB ALA A 73 -0.927 -6.935 -4.386 1.00 0.00 C ATOM 0 H ALA A 73 -0.802 -8.900 -5.753 1.00 0.00 H new ATOM 0 HA ALA A 73 0.997 -6.790 -5.379 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.775 -6.046 -3.773 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.491 -6.667 -5.280 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -1.484 -7.678 -3.815 1.00 0.00 H new ATOM 1222 N GLU A 82 13.214 -0.153 8.546 1.00 0.00 N ATOM 1223 CA GLU A 82 13.746 1.020 9.253 1.00 0.00 C ATOM 1224 C GLU A 82 14.786 0.640 10.322 1.00 0.00 C ATOM 1225 O GLU A 82 15.842 1.262 10.429 1.00 0.00 O ATOM 1226 CB GLU A 82 12.551 1.776 9.871 1.00 0.00 C ATOM 1227 CG GLU A 82 12.917 3.166 10.406 1.00 0.00 C ATOM 1228 CD GLU A 82 11.800 3.835 11.233 1.00 0.00 C ATOM 1229 OE1 GLU A 82 10.613 3.434 11.158 1.00 0.00 O ATOM 1230 OE2 GLU A 82 12.119 4.791 11.985 1.00 0.00 O1- ATOM 0 HA GLU A 82 14.276 1.659 8.547 1.00 0.00 H new ATOM 0 HB2 GLU A 82 11.769 1.879 9.119 1.00 0.00 H new ATOM 0 HB3 GLU A 82 12.136 1.180 10.684 1.00 0.00 H new ATOM 0 HG2 GLU A 82 13.811 3.082 11.023 1.00 0.00 H new ATOM 0 HG3 GLU A 82 13.169 3.813 9.565 1.00 0.00 H new ATOM 1237 N GLU A 83 14.526 -0.423 11.087 1.00 0.00 N ATOM 1238 CA GLU A 83 15.434 -0.872 12.148 1.00 0.00 C ATOM 1239 C GLU A 83 16.669 -1.602 11.592 1.00 0.00 C ATOM 1240 O GLU A 83 17.755 -1.514 12.171 1.00 0.00 O ATOM 1241 CB GLU A 83 14.679 -1.719 13.177 1.00 0.00 C ATOM 1242 CG GLU A 83 13.644 -0.859 13.917 1.00 0.00 C ATOM 1243 CD GLU A 83 14.278 0.285 14.734 1.00 0.00 C ATOM 1244 OE1 GLU A 83 14.987 0.006 15.732 1.00 0.00 O ATOM 1245 OE2 GLU A 83 14.073 1.470 14.373 1.00 0.00 O1- ATOM 0 H GLU A 83 13.686 -0.994 10.991 1.00 0.00 H new ATOM 0 HA GLU A 83 15.814 0.015 12.655 1.00 0.00 H new ATOM 0 HB2 GLU A 83 14.181 -2.551 12.679 1.00 0.00 H new ATOM 0 HB3 GLU A 83 15.382 -2.149 13.891 1.00 0.00 H new ATOM 0 HG2 GLU A 83 12.947 -0.437 13.193 1.00 0.00 H new ATOM 0 HG3 GLU A 83 13.063 -1.495 14.585 1.00 0.00 H new ATOM 1252 N GLU A 84 16.541 -2.263 10.437 1.00 0.00 N ATOM 1253 CA GLU A 84 17.679 -2.851 9.720 1.00 0.00 C ATOM 1254 C GLU A 84 18.610 -1.771 9.164 1.00 0.00 C ATOM 1255 O GLU A 84 19.824 -1.864 9.332 1.00 0.00 O ATOM 1256 CB GLU A 84 17.184 -3.735 8.568 1.00 0.00 C ATOM 1257 CG GLU A 84 18.190 -4.823 8.165 1.00 0.00 C ATOM 1258 CD GLU A 84 18.428 -5.893 9.256 1.00 0.00 C ATOM 1259 OE1 GLU A 84 17.476 -6.274 9.980 1.00 0.00 O ATOM 1260 OE2 GLU A 84 19.575 -6.384 9.380 1.00 0.00 O1- ATOM 0 H GLU A 84 15.645 -2.406 9.972 1.00 0.00 H new ATOM 0 HA GLU A 84 18.238 -3.456 10.434 1.00 0.00 H new ATOM 0 HB2 GLU A 84 16.245 -4.207 8.858 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.971 -3.107 7.703 1.00 0.00 H new ATOM 0 HG2 GLU A 84 17.835 -5.315 7.259 1.00 0.00 H new ATOM 0 HG3 GLU A 84 19.141 -4.351 7.919 1.00 0.00 H new ATOM 1267 N ILE A 85 18.038 -0.722 8.556 1.00 0.00 N ATOM 1268 CA ILE A 85 18.779 0.453 8.083 1.00 0.00 C ATOM 1269 C ILE A 85 19.527 1.110 9.248 1.00 0.00 C ATOM 1270 O ILE A 85 20.723 1.366 9.128 1.00 0.00 O ATOM 1271 CB ILE A 85 17.843 1.439 7.361 1.00 0.00 C ATOM 1272 CG1 ILE A 85 17.310 0.870 6.030 1.00 0.00 C ATOM 1273 CG2 ILE A 85 18.572 2.760 7.078 1.00 0.00 C ATOM 1274 CD1 ILE A 85 16.097 1.669 5.550 1.00 0.00 C ATOM 0 H ILE A 85 17.035 -0.666 8.377 1.00 0.00 H new ATOM 0 HA ILE A 85 19.523 0.133 7.353 1.00 0.00 H new ATOM 0 HB ILE A 85 16.996 1.610 8.025 1.00 0.00 H new ATOM 0 HG12 ILE A 85 18.095 0.902 5.275 1.00 0.00 H new ATOM 0 HG13 ILE A 85 17.035 -0.177 6.160 1.00 0.00 H new ATOM 0 HG21 ILE A 85 17.896 3.446 6.567 1.00 0.00 H new ATOM 0 HG22 ILE A 85 18.898 3.204 8.018 1.00 0.00 H new ATOM 0 HG23 ILE A 85 19.440 2.569 6.447 1.00 0.00 H new ATOM 0 HD11 ILE A 85 15.736 1.252 4.610 1.00 0.00 H new ATOM 0 HD12 ILE A 85 15.306 1.615 6.298 1.00 0.00 H new ATOM 0 HD13 ILE A 85 16.383 2.710 5.399 1.00 0.00 H new ATOM 1286 N ARG A 86 18.867 1.325 10.396 1.00 0.00 N ATOM 1287 CA ARG A 86 19.510 1.856 11.611 1.00 0.00 C ATOM 1288 C ARG A 86 20.704 1.018 12.065 1.00 0.00 C ATOM 1289 O ARG A 86 21.769 1.578 12.308 1.00 0.00 O ATOM 1290 CB ARG A 86 18.497 1.952 12.758 1.00 0.00 C ATOM 1291 CG ARG A 86 17.782 3.296 12.830 1.00 0.00 C ATOM 1292 CD ARG A 86 17.009 3.361 14.148 1.00 0.00 C ATOM 1293 NE ARG A 86 16.375 4.671 14.320 1.00 0.00 N ATOM 1294 CZ ARG A 86 15.163 5.027 13.962 1.00 0.00 C ATOM 1295 NH1 ARG A 86 14.239 4.175 13.630 1.00 0.00 N1+ ATOM 1296 NH2 ARG A 86 14.881 6.293 13.939 1.00 0.00 N ATOM 0 H ARG A 86 17.871 1.136 10.510 1.00 0.00 H new ATOM 0 HA ARG A 86 19.880 2.848 11.352 1.00 0.00 H new ATOM 0 HB2 ARG A 86 17.756 1.161 12.644 1.00 0.00 H new ATOM 0 HB3 ARG A 86 19.012 1.773 13.702 1.00 0.00 H new ATOM 0 HG2 ARG A 86 18.502 4.112 12.772 1.00 0.00 H new ATOM 0 HG3 ARG A 86 17.102 3.410 11.986 1.00 0.00 H new ATOM 0 HD2 ARG A 86 16.249 2.580 14.167 1.00 0.00 H new ATOM 0 HD3 ARG A 86 17.686 3.168 14.981 1.00 0.00 H new ATOM 0 HE ARG A 86 16.941 5.390 14.770 1.00 0.00 H new ATOM 0 HH11 ARG A 86 14.440 3.175 13.640 1.00 0.00 H new ATOM 0 HH12 ARG A 86 13.313 4.506 13.360 1.00 0.00 H new ATOM 0 HH21 ARG A 86 15.592 6.979 14.194 1.00 0.00 H new ATOM 0 HH22 ARG A 86 13.949 6.603 13.665 1.00 0.00 H new ATOM 1310 N GLU A 87 20.568 -0.302 12.168 1.00 0.00 N ATOM 1311 CA GLU A 87 21.671 -1.160 12.625 1.00 0.00 C ATOM 1312 C GLU A 87 22.820 -1.230 11.600 1.00 0.00 C ATOM 1313 O GLU A 87 23.993 -1.156 11.971 1.00 0.00 O ATOM 1314 CB GLU A 87 21.124 -2.550 12.988 1.00 0.00 C ATOM 1315 CG GLU A 87 22.155 -3.497 13.630 1.00 0.00 C ATOM 1316 CD GLU A 87 22.716 -3.021 14.989 1.00 0.00 C ATOM 1317 OE1 GLU A 87 23.626 -3.684 15.538 1.00 0.00 O ATOM 1318 OE2 GLU A 87 22.273 -1.996 15.554 1.00 0.00 O1- ATOM 0 H GLU A 87 19.709 -0.805 11.943 1.00 0.00 H new ATOM 0 HA GLU A 87 22.107 -0.717 13.520 1.00 0.00 H new ATOM 0 HB2 GLU A 87 20.286 -2.428 13.674 1.00 0.00 H new ATOM 0 HB3 GLU A 87 20.732 -3.019 12.085 1.00 0.00 H new ATOM 0 HG2 GLU A 87 21.693 -4.475 13.766 1.00 0.00 H new ATOM 0 HG3 GLU A 87 22.986 -3.630 12.937 1.00 0.00 H new ATOM 1325 N ALA A 88 22.489 -1.282 10.307 1.00 0.00 N ATOM 1326 CA ALA A 88 23.441 -1.193 9.203 1.00 0.00 C ATOM 1327 C ALA A 88 24.134 0.180 9.097 1.00 0.00 C ATOM 1328 O ALA A 88 25.245 0.268 8.581 1.00 0.00 O ATOM 1329 CB ALA A 88 22.674 -1.500 7.912 1.00 0.00 C ATOM 0 H ALA A 88 21.524 -1.390 9.994 1.00 0.00 H new ATOM 0 HA ALA A 88 24.242 -1.911 9.380 1.00 0.00 H new ATOM 0 HB1 ALA A 88 23.354 -1.443 7.062 1.00 0.00 H new ATOM 0 HB2 ALA A 88 22.250 -2.502 7.970 1.00 0.00 H new ATOM 0 HB3 ALA A 88 21.872 -0.773 7.784 1.00 0.00 H new ATOM 1335 N PHE A 89 23.514 1.252 9.590 1.00 0.00 N ATOM 1336 CA PHE A 89 24.166 2.548 9.760 1.00 0.00 C ATOM 1337 C PHE A 89 25.077 2.548 10.999 1.00 0.00 C ATOM 1338 O PHE A 89 26.206 3.032 10.946 1.00 0.00 O ATOM 1339 CB PHE A 89 23.102 3.632 9.904 1.00 0.00 C ATOM 1340 CG PHE A 89 22.583 4.220 8.614 1.00 0.00 C ATOM 1341 CD1 PHE A 89 23.488 4.643 7.623 1.00 0.00 C ATOM 1342 CD2 PHE A 89 21.205 4.456 8.449 1.00 0.00 C ATOM 1343 CE1 PHE A 89 23.031 5.320 6.492 1.00 0.00 C ATOM 1344 CE2 PHE A 89 20.743 5.153 7.322 1.00 0.00 C ATOM 1345 CZ PHE A 89 21.664 5.586 6.355 1.00 0.00 C ATOM 0 H PHE A 89 22.537 1.244 9.885 1.00 0.00 H new ATOM 0 HA PHE A 89 24.783 2.746 8.883 1.00 0.00 H new ATOM 0 HB2 PHE A 89 22.259 3.216 10.456 1.00 0.00 H new ATOM 0 HB3 PHE A 89 23.513 4.440 10.510 1.00 0.00 H new ATOM 0 HD1 PHE A 89 24.543 4.442 7.739 1.00 0.00 H new ATOM 0 HD2 PHE A 89 20.504 4.101 9.189 1.00 0.00 H new ATOM 0 HE1 PHE A 89 23.726 5.636 5.729 1.00 0.00 H new ATOM 0 HE2 PHE A 89 19.689 5.354 7.200 1.00 0.00 H new ATOM 0 HZ PHE A 89 21.312 6.133 5.492 1.00 0.00 H new ATOM 1355 N ARG A 90 24.617 1.975 12.118 1.00 0.00 N ATOM 1356 CA ARG A 90 25.327 1.976 13.407 1.00 0.00 C ATOM 1357 C ARG A 90 26.692 1.278 13.361 1.00 0.00 C ATOM 1358 O ARG A 90 27.607 1.683 14.074 1.00 0.00 O ATOM 1359 CB ARG A 90 24.407 1.362 14.466 1.00 0.00 C ATOM 1360 CG ARG A 90 24.815 1.790 15.882 1.00 0.00 C ATOM 1361 CD ARG A 90 23.762 1.320 16.887 1.00 0.00 C ATOM 1362 NE ARG A 90 23.769 -0.150 17.038 1.00 0.00 N ATOM 1363 CZ ARG A 90 24.516 -0.877 17.847 1.00 0.00 C ATOM 1364 NH1 ARG A 90 25.299 -0.348 18.746 1.00 0.00 N1+ ATOM 1365 NH2 ARG A 90 24.497 -2.173 17.752 1.00 0.00 N ATOM 0 H ARG A 90 23.722 1.487 12.155 1.00 0.00 H new ATOM 0 HA ARG A 90 25.560 3.009 13.665 1.00 0.00 H new ATOM 0 HB2 ARG A 90 23.378 1.666 14.275 1.00 0.00 H new ATOM 0 HB3 ARG A 90 24.438 0.275 14.390 1.00 0.00 H new ATOM 0 HG2 ARG A 90 25.787 1.366 16.134 1.00 0.00 H new ATOM 0 HG3 ARG A 90 24.918 2.874 15.929 1.00 0.00 H new ATOM 0 HD2 ARG A 90 23.949 1.786 17.854 1.00 0.00 H new ATOM 0 HD3 ARG A 90 22.775 1.648 16.560 1.00 0.00 H new ATOM 0 HE ARG A 90 23.118 -0.665 16.445 1.00 0.00 H new ATOM 0 HH11 ARG A 90 25.351 0.666 18.844 1.00 0.00 H new ATOM 0 HH12 ARG A 90 25.860 -0.948 19.351 1.00 0.00 H new ATOM 0 HH21 ARG A 90 23.906 -2.625 17.054 1.00 0.00 H new ATOM 0 HH22 ARG A 90 25.073 -2.739 18.375 1.00 0.00 H new ATOM 1379 N VAL A 91 26.870 0.289 12.479 1.00 0.00 N ATOM 1380 CA VAL A 91 28.184 -0.329 12.191 1.00 0.00 C ATOM 1381 C VAL A 91 29.177 0.617 11.486 1.00 0.00 C ATOM 1382 O VAL A 91 30.384 0.380 11.550 1.00 0.00 O ATOM 1383 CB VAL A 91 28.031 -1.631 11.377 1.00 0.00 C ATOM 1384 CG1 VAL A 91 27.392 -2.750 12.204 1.00 0.00 C ATOM 1385 CG2 VAL A 91 27.242 -1.459 10.089 1.00 0.00 C ATOM 0 H VAL A 91 26.105 -0.113 11.937 1.00 0.00 H new ATOM 0 HA VAL A 91 28.608 -0.560 13.168 1.00 0.00 H new ATOM 0 HB VAL A 91 29.051 -1.906 11.109 1.00 0.00 H new ATOM 0 HG11 VAL A 91 27.303 -3.648 11.593 1.00 0.00 H new ATOM 0 HG12 VAL A 91 28.016 -2.962 13.072 1.00 0.00 H new ATOM 0 HG13 VAL A 91 26.402 -2.437 12.536 1.00 0.00 H new ATOM 0 HG21 VAL A 91 27.177 -2.416 9.572 1.00 0.00 H new ATOM 0 HG22 VAL A 91 26.238 -1.103 10.322 1.00 0.00 H new ATOM 0 HG23 VAL A 91 27.744 -0.734 9.449 1.00 0.00 H new ATOM 1395 N PHE A 92 28.703 1.694 10.846 1.00 0.00 N ATOM 1396 CA PHE A 92 29.528 2.739 10.216 1.00 0.00 C ATOM 1397 C PHE A 92 29.747 3.979 11.113 1.00 0.00 C ATOM 1398 O PHE A 92 30.631 4.792 10.837 1.00 0.00 O ATOM 1399 CB PHE A 92 28.886 3.182 8.896 1.00 0.00 C ATOM 1400 CG PHE A 92 28.568 2.080 7.905 1.00 0.00 C ATOM 1401 CD1 PHE A 92 27.440 2.214 7.074 1.00 0.00 C ATOM 1402 CD2 PHE A 92 29.401 0.949 7.764 1.00 0.00 C ATOM 1403 CE1 PHE A 92 27.143 1.232 6.120 1.00 0.00 C ATOM 1404 CE2 PHE A 92 29.088 -0.033 6.819 1.00 0.00 C ATOM 1405 CZ PHE A 92 27.968 0.108 5.999 1.00 0.00 C ATOM 0 H PHE A 92 27.703 1.870 10.748 1.00 0.00 H new ATOM 0 HA PHE A 92 30.507 2.293 10.044 1.00 0.00 H new ATOM 0 HB2 PHE A 92 27.963 3.714 9.125 1.00 0.00 H new ATOM 0 HB3 PHE A 92 29.553 3.896 8.413 1.00 0.00 H new ATOM 0 HD1 PHE A 92 26.800 3.078 7.172 1.00 0.00 H new ATOM 0 HD2 PHE A 92 30.278 0.842 8.385 1.00 0.00 H new ATOM 0 HE1 PHE A 92 26.280 1.342 5.480 1.00 0.00 H new ATOM 0 HE2 PHE A 92 29.717 -0.906 6.723 1.00 0.00 H new ATOM 0 HZ PHE A 92 27.737 -0.653 5.268 1.00 0.00 H new ATOM 1415 N ASP A 93 28.946 4.148 12.172 1.00 0.00 N ATOM 1416 CA ASP A 93 29.010 5.279 13.114 1.00 0.00 C ATOM 1417 C ASP A 93 30.388 5.365 13.801 1.00 0.00 C ATOM 1418 O ASP A 93 30.958 4.360 14.238 1.00 0.00 O ATOM 1419 CB ASP A 93 27.841 5.149 14.109 1.00 0.00 C ATOM 1420 CG ASP A 93 27.707 6.254 15.174 1.00 0.00 C ATOM 1421 OD1 ASP A 93 26.567 6.469 15.639 1.00 0.00 O ATOM 1422 OD2 ASP A 93 28.718 6.829 15.644 1.00 0.00 O1- ATOM 0 H ASP A 93 28.211 3.481 12.407 1.00 0.00 H new ATOM 0 HA ASP A 93 28.902 6.222 12.579 1.00 0.00 H new ATOM 0 HB2 ASP A 93 26.913 5.113 13.539 1.00 0.00 H new ATOM 0 HB3 ASP A 93 27.937 4.192 14.623 1.00 0.00 H new ATOM 1482 N GLY A 98 25.092 8.365 17.060 1.00 0.00 N ATOM 1483 CA GLY A 98 23.825 8.532 16.330 1.00 0.00 C ATOM 1484 C GLY A 98 23.971 9.240 14.973 1.00 0.00 C ATOM 1485 O GLY A 98 22.995 9.786 14.452 1.00 0.00 O ATOM 0 HA2 GLY A 98 23.378 7.551 16.170 1.00 0.00 H new ATOM 0 HA3 GLY A 98 23.132 9.100 16.951 1.00 0.00 H new ATOM 1489 N TYR A 99 25.185 9.265 14.413 1.00 0.00 N ATOM 1490 CA TYR A 99 25.514 9.937 13.152 1.00 0.00 C ATOM 1491 C TYR A 99 26.690 9.237 12.426 1.00 0.00 C ATOM 1492 O TYR A 99 27.394 8.411 13.010 1.00 0.00 O ATOM 1493 CB TYR A 99 25.789 11.437 13.421 1.00 0.00 C ATOM 1494 CG TYR A 99 27.263 11.779 13.444 1.00 0.00 C ATOM 1495 CD1 TYR A 99 28.045 11.374 14.537 1.00 0.00 C ATOM 1496 CD2 TYR A 99 27.874 12.320 12.300 1.00 0.00 C ATOM 1497 CE1 TYR A 99 29.448 11.473 14.480 1.00 0.00 C ATOM 1498 CE2 TYR A 99 29.273 12.386 12.217 1.00 0.00 C ATOM 1499 CZ TYR A 99 30.067 11.961 13.305 1.00 0.00 C ATOM 1500 OH TYR A 99 31.423 11.989 13.214 1.00 0.00 O ATOM 0 H TYR A 99 25.990 8.804 14.838 1.00 0.00 H new ATOM 0 HA TYR A 99 24.662 9.867 12.476 1.00 0.00 H new ATOM 0 HB2 TYR A 99 25.296 12.033 12.653 1.00 0.00 H new ATOM 0 HB3 TYR A 99 25.343 11.716 14.376 1.00 0.00 H new ATOM 0 HD1 TYR A 99 27.569 10.985 15.425 1.00 0.00 H new ATOM 0 HD2 TYR A 99 27.267 12.685 11.485 1.00 0.00 H new ATOM 0 HE1 TYR A 99 30.048 11.178 15.328 1.00 0.00 H new ATOM 0 HE2 TYR A 99 29.743 12.762 11.320 1.00 0.00 H new ATOM 0 HH TYR A 99 31.691 11.862 12.280 1.00 0.00 H new ATOM 1510 N ILE A 100 26.904 9.570 11.150 1.00 0.00 N ATOM 1511 CA ILE A 100 28.007 9.075 10.307 1.00 0.00 C ATOM 1512 C ILE A 100 28.678 10.259 9.599 1.00 0.00 C ATOM 1513 O ILE A 100 27.999 11.139 9.072 1.00 0.00 O ATOM 1514 CB ILE A 100 27.477 8.020 9.306 1.00 0.00 C ATOM 1515 CG1 ILE A 100 27.047 6.743 10.050 1.00 0.00 C ATOM 1516 CG2 ILE A 100 28.534 7.627 8.263 1.00 0.00 C ATOM 1517 CD1 ILE A 100 26.058 5.955 9.212 1.00 0.00 C ATOM 0 H ILE A 100 26.292 10.217 10.652 1.00 0.00 H new ATOM 0 HA ILE A 100 28.759 8.584 10.924 1.00 0.00 H new ATOM 0 HB ILE A 100 26.628 8.476 8.796 1.00 0.00 H new ATOM 0 HG12 ILE A 100 27.921 6.129 10.268 1.00 0.00 H new ATOM 0 HG13 ILE A 100 26.596 7.006 11.007 1.00 0.00 H new ATOM 0 HG21 ILE A 100 28.116 6.885 7.583 1.00 0.00 H new ATOM 0 HG22 ILE A 100 28.833 8.510 7.698 1.00 0.00 H new ATOM 0 HG23 ILE A 100 29.404 7.207 8.767 1.00 0.00 H new ATOM 0 HD11 ILE A 100 25.762 5.054 9.750 1.00 0.00 H new ATOM 0 HD12 ILE A 100 25.177 6.567 9.017 1.00 0.00 H new ATOM 0 HD13 ILE A 100 26.523 5.677 8.266 1.00 0.00 H new ATOM 1529 N SER A 101 30.010 10.304 9.545 1.00 0.00 N ATOM 1530 CA SER A 101 30.698 11.382 8.821 1.00 0.00 C ATOM 1531 C SER A 101 30.448 11.307 7.311 1.00 0.00 C ATOM 1532 O SER A 101 30.400 10.221 6.737 1.00 0.00 O ATOM 1533 CB SER A 101 32.199 11.397 9.126 1.00 0.00 C ATOM 1534 OG SER A 101 32.410 11.582 10.515 1.00 0.00 O ATOM 0 H SER A 101 30.628 9.621 9.984 1.00 0.00 H new ATOM 0 HA SER A 101 30.274 12.321 9.178 1.00 0.00 H new ATOM 0 HB2 SER A 101 32.653 10.461 8.802 1.00 0.00 H new ATOM 0 HB3 SER A 101 32.684 12.197 8.566 1.00 0.00 H new ATOM 0 HG SER A 101 33.372 11.589 10.702 1.00 0.00 H new ATOM 1540 N ALA A 102 30.310 12.452 6.639 1.00 0.00 N ATOM 1541 CA ALA A 102 29.949 12.495 5.218 1.00 0.00 C ATOM 1542 C ALA A 102 30.977 11.782 4.319 1.00 0.00 C ATOM 1543 O ALA A 102 30.596 11.039 3.416 1.00 0.00 O ATOM 1544 CB ALA A 102 29.773 13.958 4.802 1.00 0.00 C ATOM 0 H ALA A 102 30.444 13.371 7.060 1.00 0.00 H new ATOM 0 HA ALA A 102 29.013 11.952 5.085 1.00 0.00 H new ATOM 0 HB1 ALA A 102 29.504 14.006 3.747 1.00 0.00 H new ATOM 0 HB2 ALA A 102 28.983 14.414 5.399 1.00 0.00 H new ATOM 0 HB3 ALA A 102 30.706 14.497 4.964 1.00 0.00 H new ATOM 1550 N ALA A 103 32.272 11.940 4.610 1.00 0.00 N ATOM 1551 CA ALA A 103 33.343 11.210 3.930 1.00 0.00 C ATOM 1552 C ALA A 103 33.313 9.694 4.224 1.00 0.00 C ATOM 1553 O ALA A 103 33.663 8.894 3.357 1.00 0.00 O ATOM 1554 CB ALA A 103 34.681 11.831 4.346 1.00 0.00 C ATOM 0 H ALA A 103 32.607 12.582 5.328 1.00 0.00 H new ATOM 0 HA ALA A 103 33.201 11.300 2.853 1.00 0.00 H new ATOM 0 HB1 ALA A 103 35.496 11.303 3.851 1.00 0.00 H new ATOM 0 HB2 ALA A 103 34.700 12.882 4.056 1.00 0.00 H new ATOM 0 HB3 ALA A 103 34.799 11.750 5.427 1.00 0.00 H new ATOM 1560 N GLU A 104 32.862 9.282 5.414 1.00 0.00 N ATOM 1561 CA GLU A 104 32.719 7.869 5.788 1.00 0.00 C ATOM 1562 C GLU A 104 31.530 7.209 5.076 1.00 0.00 C ATOM 1563 O GLU A 104 31.685 6.121 4.527 1.00 0.00 O ATOM 1564 CB GLU A 104 32.609 7.735 7.319 1.00 0.00 C ATOM 1565 CG GLU A 104 32.604 6.283 7.826 1.00 0.00 C ATOM 1566 CD GLU A 104 33.896 5.495 7.506 1.00 0.00 C ATOM 1567 OE1 GLU A 104 34.984 6.105 7.368 1.00 0.00 O ATOM 1568 OE2 GLU A 104 33.835 4.245 7.427 1.00 0.00 O1- ATOM 0 H GLU A 104 32.583 9.927 6.153 1.00 0.00 H new ATOM 0 HA GLU A 104 33.612 7.338 5.460 1.00 0.00 H new ATOM 0 HB2 GLU A 104 33.442 8.266 7.780 1.00 0.00 H new ATOM 0 HB3 GLU A 104 31.695 8.227 7.651 1.00 0.00 H new ATOM 0 HG2 GLU A 104 32.453 6.287 8.905 1.00 0.00 H new ATOM 0 HG3 GLU A 104 31.755 5.760 7.387 1.00 0.00 H new ATOM 1575 N LEU A 105 30.366 7.872 5.011 1.00 0.00 N ATOM 1576 CA LEU A 105 29.206 7.375 4.256 1.00 0.00 C ATOM 1577 C LEU A 105 29.463 7.422 2.742 1.00 0.00 C ATOM 1578 O LEU A 105 29.126 6.466 2.046 1.00 0.00 O ATOM 1579 CB LEU A 105 27.930 8.142 4.679 1.00 0.00 C ATOM 1580 CG LEU A 105 26.615 7.352 4.507 1.00 0.00 C ATOM 1581 CD1 LEU A 105 26.490 6.092 5.371 1.00 0.00 C ATOM 1582 CD2 LEU A 105 25.426 8.241 4.838 1.00 0.00 C ATOM 0 H LEU A 105 30.202 8.764 5.478 1.00 0.00 H new ATOM 0 HA LEU A 105 29.046 6.324 4.498 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.028 8.434 5.725 1.00 0.00 H new ATOM 0 HB3 LEU A 105 27.865 9.061 4.096 1.00 0.00 H new ATOM 0 HG LEU A 105 26.628 7.032 3.465 1.00 0.00 H new ATOM 0 HD11 LEU A 105 25.532 5.611 5.176 1.00 0.00 H new ATOM 0 HD12 LEU A 105 27.299 5.403 5.128 1.00 0.00 H new ATOM 0 HD13 LEU A 105 26.551 6.366 6.424 1.00 0.00 H new ATOM 0 HD21 LEU A 105 24.503 7.675 4.714 1.00 0.00 H new ATOM 0 HD22 LEU A 105 25.505 8.585 5.869 1.00 0.00 H new ATOM 0 HD23 LEU A 105 25.417 9.101 4.168 1.00 0.00 H new ATOM 1594 N ARG A 106 30.151 8.446 2.218 1.00 0.00 N ATOM 1595 CA ARG A 106 30.618 8.437 0.820 1.00 0.00 C ATOM 1596 C ARG A 106 31.595 7.287 0.556 1.00 0.00 C ATOM 1597 O ARG A 106 31.487 6.644 -0.486 1.00 0.00 O ATOM 1598 CB ARG A 106 31.185 9.814 0.423 1.00 0.00 C ATOM 1599 CG ARG A 106 31.684 9.829 -1.033 1.00 0.00 C ATOM 1600 CD ARG A 106 32.028 11.242 -1.521 1.00 0.00 C ATOM 1601 NE ARG A 106 32.774 11.192 -2.796 1.00 0.00 N ATOM 1602 CZ ARG A 106 32.379 11.556 -4.004 1.00 0.00 C ATOM 1603 NH1 ARG A 106 31.217 12.075 -4.271 1.00 0.00 N1+ ATOM 1604 NH2 ARG A 106 33.158 11.409 -5.030 1.00 0.00 N ATOM 0 H ARG A 106 30.397 9.289 2.737 1.00 0.00 H new ATOM 0 HA ARG A 106 29.760 8.252 0.174 1.00 0.00 H new ATOM 0 HB2 ARG A 106 30.415 10.575 0.551 1.00 0.00 H new ATOM 0 HB3 ARG A 106 32.006 10.075 1.091 1.00 0.00 H new ATOM 0 HG2 ARG A 106 32.566 9.194 -1.118 1.00 0.00 H new ATOM 0 HG3 ARG A 106 30.919 9.401 -1.680 1.00 0.00 H new ATOM 0 HD2 ARG A 106 31.112 11.819 -1.653 1.00 0.00 H new ATOM 0 HD3 ARG A 106 32.623 11.757 -0.767 1.00 0.00 H new ATOM 0 HE ARG A 106 33.724 10.826 -2.736 1.00 0.00 H new ATOM 0 HH11 ARG A 106 30.541 12.225 -3.522 1.00 0.00 H new ATOM 0 HH12 ARG A 106 30.981 12.332 -5.230 1.00 0.00 H new ATOM 0 HH21 ARG A 106 34.088 11.008 -4.911 1.00 0.00 H new ATOM 0 HH22 ARG A 106 32.840 11.694 -5.956 1.00 0.00 H new ATOM 1618 N HIS A 107 32.486 6.966 1.502 1.00 0.00 N ATOM 1619 CA HIS A 107 33.337 5.775 1.417 1.00 0.00 C ATOM 1620 C HIS A 107 32.500 4.494 1.371 1.00 0.00 C ATOM 1621 O HIS A 107 32.555 3.807 0.358 1.00 0.00 O ATOM 1622 CB HIS A 107 34.385 5.732 2.538 1.00 0.00 C ATOM 1623 CG HIS A 107 35.209 4.466 2.523 1.00 0.00 C ATOM 1624 ND1 HIS A 107 36.386 4.269 1.796 1.00 0.00 N ATOM 1625 CD2 HIS A 107 34.880 3.299 3.154 1.00 0.00 C ATOM 1626 CE1 HIS A 107 36.757 2.998 2.031 1.00 0.00 C ATOM 1627 NE2 HIS A 107 35.871 2.394 2.844 1.00 0.00 N ATOM 0 H HIS A 107 32.636 7.522 2.344 1.00 0.00 H new ATOM 0 HA HIS A 107 33.887 5.840 0.478 1.00 0.00 H new ATOM 0 HB2 HIS A 107 35.048 6.592 2.442 1.00 0.00 H new ATOM 0 HB3 HIS A 107 33.883 5.822 3.501 1.00 0.00 H new ATOM 0 HD2 HIS A 107 34.013 3.121 3.774 1.00 0.00 H new ATOM 0 HE1 HIS A 107 37.641 2.529 1.625 1.00 0.00 H new ATOM 0 HE2 HIS A 107 35.924 1.430 3.174 1.00 0.00 H new ATOM 1635 N VAL A 108 31.684 4.166 2.383 1.00 0.00 N ATOM 1636 CA VAL A 108 30.942 2.883 2.384 1.00 0.00 C ATOM 1637 C VAL A 108 30.042 2.725 1.172 1.00 0.00 C ATOM 1638 O VAL A 108 29.966 1.641 0.595 1.00 0.00 O ATOM 1639 CB VAL A 108 30.067 2.655 3.634 1.00 0.00 C ATOM 1640 CG1 VAL A 108 30.937 2.215 4.779 1.00 0.00 C ATOM 1641 CG2 VAL A 108 29.250 3.826 4.150 1.00 0.00 C ATOM 0 H VAL A 108 31.518 4.754 3.200 1.00 0.00 H new ATOM 0 HA VAL A 108 31.740 2.140 2.371 1.00 0.00 H new ATOM 0 HB VAL A 108 29.347 1.913 3.289 1.00 0.00 H new ATOM 0 HG11 VAL A 108 30.320 2.053 5.663 1.00 0.00 H new ATOM 0 HG12 VAL A 108 31.444 1.287 4.515 1.00 0.00 H new ATOM 0 HG13 VAL A 108 31.678 2.986 4.990 1.00 0.00 H new ATOM 0 HG21 VAL A 108 28.687 3.517 5.031 1.00 0.00 H new ATOM 0 HG22 VAL A 108 29.917 4.646 4.415 1.00 0.00 H new ATOM 0 HG23 VAL A 108 28.559 4.157 3.375 1.00 0.00 H new ATOM 1651 N MET A 109 29.386 3.805 0.753 1.00 0.00 N ATOM 1652 CA MET A 109 28.415 3.741 -0.329 1.00 0.00 C ATOM 1653 C MET A 109 29.059 3.613 -1.724 1.00 0.00 C ATOM 1654 O MET A 109 28.374 3.277 -2.690 1.00 0.00 O ATOM 1655 CB MET A 109 27.458 4.934 -0.241 1.00 0.00 C ATOM 1656 CG MET A 109 26.658 4.971 1.071 1.00 0.00 C ATOM 1657 SD MET A 109 25.312 3.771 1.198 1.00 0.00 S ATOM 1658 CE MET A 109 26.110 2.512 2.228 1.00 0.00 C ATOM 0 H MET A 109 29.512 4.736 1.150 1.00 0.00 H new ATOM 0 HA MET A 109 27.843 2.822 -0.200 1.00 0.00 H new ATOM 0 HB2 MET A 109 28.029 5.858 -0.338 1.00 0.00 H new ATOM 0 HB3 MET A 109 26.765 4.898 -1.081 1.00 0.00 H new ATOM 0 HG2 MET A 109 27.346 4.807 1.900 1.00 0.00 H new ATOM 0 HG3 MET A 109 26.242 5.971 1.194 1.00 0.00 H new ATOM 0 HE1 MET A 109 25.700 1.531 1.987 1.00 0.00 H new ATOM 0 HE2 MET A 109 27.183 2.513 2.038 1.00 0.00 H new ATOM 0 HE3 MET A 109 25.927 2.733 3.280 1.00 0.00 H new ATOM 1668 N THR A 110 30.372 3.856 -1.839 1.00 0.00 N ATOM 1669 CA THR A 110 31.156 3.714 -3.084 1.00 0.00 C ATOM 1670 C THR A 110 32.303 2.700 -2.993 1.00 0.00 C ATOM 1671 O THR A 110 32.938 2.408 -4.007 1.00 0.00 O ATOM 1672 CB THR A 110 31.674 5.070 -3.589 1.00 0.00 C ATOM 1673 OG1 THR A 110 32.675 5.591 -2.744 1.00 0.00 O ATOM 1674 CG2 THR A 110 30.584 6.121 -3.732 1.00 0.00 C ATOM 0 H THR A 110 30.938 4.166 -1.049 1.00 0.00 H new ATOM 0 HA THR A 110 30.452 3.311 -3.812 1.00 0.00 H new ATOM 0 HB THR A 110 32.081 4.859 -4.578 1.00 0.00 H new ATOM 0 HG1 THR A 110 32.260 5.983 -1.947 1.00 0.00 H new ATOM 0 HG21 THR A 110 31.021 7.052 -4.092 1.00 0.00 H new ATOM 0 HG22 THR A 110 29.834 5.773 -4.443 1.00 0.00 H new ATOM 0 HG23 THR A 110 30.114 6.292 -2.763 1.00 0.00 H new ATOM 1682 N ASN A 111 32.543 2.114 -1.816 1.00 0.00 N ATOM 1683 CA ASN A 111 33.475 1.008 -1.576 1.00 0.00 C ATOM 1684 C ASN A 111 32.782 -0.364 -1.524 1.00 0.00 C ATOM 1685 O ASN A 111 33.422 -1.385 -1.779 1.00 0.00 O ATOM 1686 CB ASN A 111 34.250 1.307 -0.274 1.00 0.00 C ATOM 1687 CG ASN A 111 35.451 0.401 -0.062 1.00 0.00 C ATOM 1688 OD1 ASN A 111 35.493 -0.427 0.838 1.00 0.00 O ATOM 1689 ND2 ASN A 111 36.478 0.534 -0.871 1.00 0.00 N ATOM 0 H ASN A 111 32.070 2.413 -0.963 1.00 0.00 H new ATOM 0 HA ASN A 111 34.165 0.942 -2.417 1.00 0.00 H new ATOM 0 HB2 ASN A 111 34.586 2.344 -0.290 1.00 0.00 H new ATOM 0 HB3 ASN A 111 33.573 1.204 0.574 1.00 0.00 H new ATOM 0 HD21 ASN A 111 37.304 -0.051 -0.747 1.00 0.00 H new ATOM 0 HD22 ASN A 111 36.449 1.222 -1.623 1.00 0.00 H new ATOM 1696 N LEU A 112 31.482 -0.387 -1.212 1.00 0.00 N ATOM 1697 CA LEU A 112 30.703 -1.587 -0.892 1.00 0.00 C ATOM 1698 C LEU A 112 29.385 -1.613 -1.677 1.00 0.00 C ATOM 1699 O LEU A 112 28.981 -0.621 -2.293 1.00 0.00 O ATOM 1700 CB LEU A 112 30.457 -1.656 0.637 1.00 0.00 C ATOM 1701 CG LEU A 112 31.643 -1.255 1.544 1.00 0.00 C ATOM 1702 CD1 LEU A 112 31.211 -0.935 2.955 1.00 0.00 C ATOM 1703 CD2 LEU A 112 32.724 -2.330 1.577 1.00 0.00 C ATOM 0 H LEU A 112 30.922 0.464 -1.174 1.00 0.00 H new ATOM 0 HA LEU A 112 31.270 -2.469 -1.191 1.00 0.00 H new ATOM 0 HB2 LEU A 112 29.611 -1.011 0.876 1.00 0.00 H new ATOM 0 HB3 LEU A 112 30.163 -2.675 0.890 1.00 0.00 H new ATOM 0 HG LEU A 112 32.057 -0.350 1.100 1.00 0.00 H new ATOM 0 HD11 LEU A 112 32.083 -0.660 3.549 1.00 0.00 H new ATOM 0 HD12 LEU A 112 30.505 -0.104 2.940 1.00 0.00 H new ATOM 0 HD13 LEU A 112 30.733 -1.809 3.396 1.00 0.00 H new ATOM 0 HD21 LEU A 112 33.538 -2.007 2.226 1.00 0.00 H new ATOM 0 HD22 LEU A 112 32.302 -3.259 1.960 1.00 0.00 H new ATOM 0 HD23 LEU A 112 33.106 -2.493 0.569 1.00 0.00 H new ATOM 1715 N GLY A 113 28.694 -2.751 -1.640 1.00 0.00 N ATOM 1716 CA GLY A 113 27.384 -2.911 -2.268 1.00 0.00 C ATOM 1717 C GLY A 113 27.399 -2.801 -3.791 1.00 0.00 C ATOM 1718 O GLY A 113 28.294 -3.305 -4.471 1.00 0.00 O ATOM 0 H GLY A 113 29.029 -3.592 -1.171 1.00 0.00 H new ATOM 0 HA2 GLY A 113 26.977 -3.883 -1.990 1.00 0.00 H new ATOM 0 HA3 GLY A 113 26.708 -2.156 -1.868 1.00 0.00 H new ATOM 1722 N GLU A 114 26.382 -2.129 -4.324 1.00 0.00 N ATOM 1723 CA GLU A 114 26.211 -1.848 -5.753 1.00 0.00 C ATOM 1724 C GLU A 114 27.100 -0.683 -6.245 1.00 0.00 C ATOM 1725 O GLU A 114 27.178 -0.449 -7.452 1.00 0.00 O ATOM 1726 CB GLU A 114 24.722 -1.577 -6.033 1.00 0.00 C ATOM 1727 CG GLU A 114 23.820 -2.761 -5.635 1.00 0.00 C ATOM 1728 CD GLU A 114 24.107 -4.057 -6.427 1.00 0.00 C ATOM 1729 OE1 GLU A 114 23.990 -5.161 -5.842 1.00 0.00 O ATOM 1730 OE2 GLU A 114 24.424 -3.994 -7.639 1.00 0.00 O1- ATOM 0 H GLU A 114 25.625 -1.750 -3.755 1.00 0.00 H new ATOM 0 HA GLU A 114 26.538 -2.723 -6.315 1.00 0.00 H new ATOM 0 HB2 GLU A 114 24.409 -0.687 -5.487 1.00 0.00 H new ATOM 0 HB3 GLU A 114 24.588 -1.363 -7.093 1.00 0.00 H new ATOM 0 HG2 GLU A 114 23.947 -2.961 -4.571 1.00 0.00 H new ATOM 0 HG3 GLU A 114 22.778 -2.478 -5.784 1.00 0.00 H new ATOM 1737 N LYS A 115 27.785 0.010 -5.315 1.00 0.00 N ATOM 1738 CA LYS A 115 28.673 1.178 -5.494 1.00 0.00 C ATOM 1739 C LYS A 115 28.007 2.338 -6.251 1.00 0.00 C ATOM 1740 O LYS A 115 27.966 2.368 -7.484 1.00 0.00 O ATOM 1741 CB LYS A 115 30.014 0.742 -6.096 1.00 0.00 C ATOM 1742 CG LYS A 115 30.767 -0.097 -5.052 1.00 0.00 C ATOM 1743 CD LYS A 115 32.247 -0.257 -5.383 1.00 0.00 C ATOM 1744 CE LYS A 115 32.572 -1.641 -5.948 1.00 0.00 C ATOM 1745 NZ LYS A 115 34.003 -1.755 -6.332 1.00 0.00 N1+ ATOM 0 H LYS A 115 27.727 -0.256 -4.332 1.00 0.00 H new ATOM 0 HA LYS A 115 28.879 1.591 -4.507 1.00 0.00 H new ATOM 0 HB2 LYS A 115 29.851 0.160 -7.003 1.00 0.00 H new ATOM 0 HB3 LYS A 115 30.604 1.614 -6.378 1.00 0.00 H new ATOM 0 HG2 LYS A 115 30.666 0.372 -4.073 1.00 0.00 H new ATOM 0 HG3 LYS A 115 30.306 -1.082 -4.982 1.00 0.00 H new ATOM 0 HD2 LYS A 115 32.539 0.505 -6.105 1.00 0.00 H new ATOM 0 HD3 LYS A 115 32.838 -0.087 -4.483 1.00 0.00 H new ATOM 0 HE2 LYS A 115 32.332 -2.403 -5.206 1.00 0.00 H new ATOM 0 HE3 LYS A 115 31.945 -1.835 -6.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 34.186 -2.706 -6.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 34.225 -1.045 -7.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 34.601 -1.594 -5.496 1.00 0.00 H new ATOM 1759 N LEU A 116 27.506 3.317 -5.494 1.00 0.00 N ATOM 1760 CA LEU A 116 26.802 4.494 -6.021 1.00 0.00 C ATOM 1761 C LEU A 116 27.690 5.357 -6.942 1.00 0.00 C ATOM 1762 O LEU A 116 28.915 5.403 -6.795 1.00 0.00 O ATOM 1763 CB LEU A 116 26.252 5.347 -4.860 1.00 0.00 C ATOM 1764 CG LEU A 116 25.270 4.661 -3.890 1.00 0.00 C ATOM 1765 CD1 LEU A 116 24.722 5.713 -2.924 1.00 0.00 C ATOM 1766 CD2 LEU A 116 24.077 4.003 -4.588 1.00 0.00 C ATOM 0 H LEU A 116 27.579 3.316 -4.477 1.00 0.00 H new ATOM 0 HA LEU A 116 25.976 4.126 -6.630 1.00 0.00 H new ATOM 0 HB2 LEU A 116 27.098 5.716 -4.280 1.00 0.00 H new ATOM 0 HB3 LEU A 116 25.754 6.218 -5.286 1.00 0.00 H new ATOM 0 HG LEU A 116 25.830 3.875 -3.383 1.00 0.00 H new ATOM 0 HD11 LEU A 116 24.025 5.242 -2.231 1.00 0.00 H new ATOM 0 HD12 LEU A 116 25.545 6.158 -2.365 1.00 0.00 H new ATOM 0 HD13 LEU A 116 24.205 6.490 -3.487 1.00 0.00 H new ATOM 0 HD21 LEU A 116 23.429 3.541 -3.843 1.00 0.00 H new ATOM 0 HD22 LEU A 116 23.516 4.758 -5.138 1.00 0.00 H new ATOM 0 HD23 LEU A 116 24.435 3.241 -5.280 1.00 0.00 H new ATOM 1778 N THR A 117 27.060 6.070 -7.877 1.00 0.00 N ATOM 1779 CA THR A 117 27.719 7.054 -8.763 1.00 0.00 C ATOM 1780 C THR A 117 28.179 8.290 -7.970 1.00 0.00 C ATOM 1781 O THR A 117 27.662 8.574 -6.891 1.00 0.00 O ATOM 1782 CB THR A 117 26.791 7.511 -9.911 1.00 0.00 C ATOM 1783 OG1 THR A 117 25.918 6.486 -10.351 1.00 0.00 O ATOM 1784 CG2 THR A 117 27.561 7.958 -11.157 1.00 0.00 C ATOM 0 H THR A 117 26.058 5.984 -8.050 1.00 0.00 H new ATOM 0 HA THR A 117 28.585 6.551 -9.194 1.00 0.00 H new ATOM 0 HB THR A 117 26.235 8.341 -9.476 1.00 0.00 H new ATOM 0 HG1 THR A 117 25.220 6.340 -9.679 1.00 0.00 H new ATOM 0 HG21 THR A 117 26.856 8.267 -11.929 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.211 8.795 -10.902 1.00 0.00 H new ATOM 0 HG23 THR A 117 28.165 7.130 -11.528 1.00 0.00 H new ATOM 1792 N ASP A 118 29.107 9.078 -8.515 1.00 0.00 N ATOM 1793 CA ASP A 118 29.636 10.305 -7.894 1.00 0.00 C ATOM 1794 C ASP A 118 28.551 11.347 -7.535 1.00 0.00 C ATOM 1795 O ASP A 118 28.489 11.835 -6.406 1.00 0.00 O ATOM 1796 CB ASP A 118 30.639 10.908 -8.885 1.00 0.00 C ATOM 1797 CG ASP A 118 31.397 12.133 -8.340 1.00 0.00 C ATOM 1798 OD1 ASP A 118 31.545 12.265 -7.101 1.00 0.00 O ATOM 1799 OD2 ASP A 118 31.893 12.943 -9.159 1.00 0.00 O1- ATOM 0 H ASP A 118 29.526 8.880 -9.424 1.00 0.00 H new ATOM 0 HA ASP A 118 30.098 10.039 -6.944 1.00 0.00 H new ATOM 0 HB2 ASP A 118 31.362 10.142 -9.167 1.00 0.00 H new ATOM 0 HB3 ASP A 118 30.109 11.196 -9.793 1.00 0.00 H new ATOM 1804 N GLU A 119 27.653 11.658 -8.476 1.00 0.00 N ATOM 1805 CA GLU A 119 26.507 12.550 -8.231 1.00 0.00 C ATOM 1806 C GLU A 119 25.443 11.905 -7.329 1.00 0.00 C ATOM 1807 O GLU A 119 24.789 12.591 -6.551 1.00 0.00 O ATOM 1808 CB GLU A 119 25.865 12.948 -9.571 1.00 0.00 C ATOM 1809 CG GLU A 119 26.673 14.022 -10.315 1.00 0.00 C ATOM 1810 CD GLU A 119 26.647 15.409 -9.636 1.00 0.00 C ATOM 1811 OE1 GLU A 119 27.573 16.218 -9.885 1.00 0.00 O ATOM 1812 OE2 GLU A 119 25.705 15.716 -8.864 1.00 0.00 O1- ATOM 0 H GLU A 119 27.697 11.300 -9.430 1.00 0.00 H new ATOM 0 HA GLU A 119 26.888 13.431 -7.714 1.00 0.00 H new ATOM 0 HB2 GLU A 119 25.773 12.064 -10.203 1.00 0.00 H new ATOM 0 HB3 GLU A 119 24.855 13.317 -9.391 1.00 0.00 H new ATOM 0 HG2 GLU A 119 27.708 13.690 -10.400 1.00 0.00 H new ATOM 0 HG3 GLU A 119 26.284 14.118 -11.329 1.00 0.00 H new ATOM 1819 N GLU A 120 25.280 10.583 -7.406 1.00 0.00 N ATOM 1820 CA GLU A 120 24.302 9.800 -6.639 1.00 0.00 C ATOM 1821 C GLU A 120 24.651 9.752 -5.145 1.00 0.00 C ATOM 1822 O GLU A 120 23.785 9.958 -4.295 1.00 0.00 O ATOM 1823 CB GLU A 120 24.290 8.392 -7.244 1.00 0.00 C ATOM 1824 CG GLU A 120 23.133 7.480 -6.852 1.00 0.00 C ATOM 1825 CD GLU A 120 23.121 6.237 -7.759 1.00 0.00 C ATOM 1826 OE1 GLU A 120 24.206 5.781 -8.201 1.00 0.00 O ATOM 1827 OE2 GLU A 120 22.013 5.726 -8.043 1.00 0.00 O1- ATOM 0 H GLU A 120 25.845 10.004 -8.027 1.00 0.00 H new ATOM 0 HA GLU A 120 23.318 10.264 -6.702 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.291 8.490 -8.330 1.00 0.00 H new ATOM 0 HB3 GLU A 120 25.221 7.897 -6.967 1.00 0.00 H new ATOM 0 HG2 GLU A 120 23.232 7.180 -5.809 1.00 0.00 H new ATOM 0 HG3 GLU A 120 22.188 8.016 -6.941 1.00 0.00 H new ATOM 1834 N VAL A 121 25.927 9.533 -4.816 1.00 0.00 N ATOM 1835 CA VAL A 121 26.421 9.546 -3.434 1.00 0.00 C ATOM 1836 C VAL A 121 26.505 10.969 -2.871 1.00 0.00 C ATOM 1837 O VAL A 121 26.243 11.169 -1.689 1.00 0.00 O ATOM 1838 CB VAL A 121 27.757 8.784 -3.328 1.00 0.00 C ATOM 1839 CG1 VAL A 121 28.965 9.565 -3.849 1.00 0.00 C ATOM 1840 CG2 VAL A 121 28.043 8.383 -1.882 1.00 0.00 C ATOM 0 H VAL A 121 26.653 9.340 -5.506 1.00 0.00 H new ATOM 0 HA VAL A 121 25.699 9.021 -2.809 1.00 0.00 H new ATOM 0 HB VAL A 121 27.627 7.907 -3.963 1.00 0.00 H new ATOM 0 HG11 VAL A 121 29.865 8.960 -3.739 1.00 0.00 H new ATOM 0 HG12 VAL A 121 28.816 9.806 -4.902 1.00 0.00 H new ATOM 0 HG13 VAL A 121 29.076 10.487 -3.278 1.00 0.00 H new ATOM 0 HG21 VAL A 121 28.991 7.847 -1.834 1.00 0.00 H new ATOM 0 HG22 VAL A 121 28.100 9.277 -1.261 1.00 0.00 H new ATOM 0 HG23 VAL A 121 27.243 7.739 -1.518 1.00 0.00 H new ATOM 1850 N ASP A 122 26.797 11.985 -3.691 1.00 0.00 N ATOM 1851 CA ASP A 122 26.714 13.378 -3.237 1.00 0.00 C ATOM 1852 C ASP A 122 25.253 13.817 -3.015 1.00 0.00 C ATOM 1853 O ASP A 122 24.966 14.504 -2.037 1.00 0.00 O ATOM 1854 CB ASP A 122 27.433 14.313 -4.220 1.00 0.00 C ATOM 1855 CG ASP A 122 27.718 15.693 -3.601 1.00 0.00 C ATOM 1856 OD1 ASP A 122 28.215 15.763 -2.452 1.00 0.00 O ATOM 1857 OD2 ASP A 122 27.469 16.719 -4.279 1.00 0.00 O1- ATOM 0 H ASP A 122 27.090 11.872 -4.662 1.00 0.00 H new ATOM 0 HA ASP A 122 27.220 13.444 -2.274 1.00 0.00 H new ATOM 0 HB2 ASP A 122 28.371 13.856 -4.534 1.00 0.00 H new ATOM 0 HB3 ASP A 122 26.823 14.436 -5.115 1.00 0.00 H new ATOM 1862 N GLU A 123 24.307 13.355 -3.846 1.00 0.00 N ATOM 1863 CA GLU A 123 22.864 13.561 -3.642 1.00 0.00 C ATOM 1864 C GLU A 123 22.385 13.004 -2.291 1.00 0.00 C ATOM 1865 O GLU A 123 21.498 13.598 -1.673 1.00 0.00 O ATOM 1866 CB GLU A 123 22.053 12.990 -4.828 1.00 0.00 C ATOM 1867 CG GLU A 123 20.541 13.281 -4.793 1.00 0.00 C ATOM 1868 CD GLU A 123 20.166 14.780 -4.876 1.00 0.00 C ATOM 1869 OE1 GLU A 123 21.028 15.633 -5.209 1.00 0.00 O ATOM 1870 OE2 GLU A 123 18.979 15.115 -4.648 1.00 0.00 O1- ATOM 0 H GLU A 123 24.524 12.822 -4.688 1.00 0.00 H new ATOM 0 HA GLU A 123 22.686 14.636 -3.608 1.00 0.00 H new ATOM 0 HB2 GLU A 123 22.462 13.393 -5.754 1.00 0.00 H new ATOM 0 HB3 GLU A 123 22.198 11.910 -4.859 1.00 0.00 H new ATOM 0 HG2 GLU A 123 20.065 12.756 -5.621 1.00 0.00 H new ATOM 0 HG3 GLU A 123 20.127 12.868 -3.873 1.00 0.00 H new ATOM 1877 N MET A 124 23.028 11.942 -1.780 1.00 0.00 N ATOM 1878 CA MET A 124 22.812 11.456 -0.417 1.00 0.00 C ATOM 1879 C MET A 124 23.312 12.494 0.593 1.00 0.00 C ATOM 1880 O MET A 124 22.518 12.958 1.406 1.00 0.00 O ATOM 1881 CB MET A 124 23.431 10.057 -0.219 1.00 0.00 C ATOM 1882 CG MET A 124 23.603 9.660 1.249 1.00 0.00 C ATOM 1883 SD MET A 124 24.296 8.004 1.514 1.00 0.00 S ATOM 1884 CE MET A 124 22.933 6.936 0.977 1.00 0.00 C ATOM 0 H MET A 124 23.713 11.398 -2.305 1.00 0.00 H new ATOM 0 HA MET A 124 21.744 11.331 -0.241 1.00 0.00 H new ATOM 0 HB2 MET A 124 22.801 9.318 -0.714 1.00 0.00 H new ATOM 0 HB3 MET A 124 24.404 10.027 -0.710 1.00 0.00 H new ATOM 0 HG2 MET A 124 24.249 10.391 1.735 1.00 0.00 H new ATOM 0 HG3 MET A 124 22.632 9.715 1.742 1.00 0.00 H new ATOM 0 HE1 MET A 124 22.817 6.112 1.681 1.00 0.00 H new ATOM 0 HE2 MET A 124 22.010 7.515 0.941 1.00 0.00 H new ATOM 0 HE3 MET A 124 23.151 6.538 -0.014 1.00 0.00 H new ATOM 1894 N ILE A 125 24.582 12.917 0.539 1.00 0.00 N ATOM 1895 CA ILE A 125 25.146 13.856 1.532 1.00 0.00 C ATOM 1896 C ILE A 125 24.346 15.172 1.607 1.00 0.00 C ATOM 1897 O ILE A 125 24.108 15.671 2.708 1.00 0.00 O ATOM 1898 CB ILE A 125 26.646 14.141 1.272 1.00 0.00 C ATOM 1899 CG1 ILE A 125 27.521 12.876 1.122 1.00 0.00 C ATOM 1900 CG2 ILE A 125 27.236 15.052 2.366 1.00 0.00 C ATOM 1901 CD1 ILE A 125 27.404 11.837 2.243 1.00 0.00 C ATOM 0 H ILE A 125 25.243 12.626 -0.181 1.00 0.00 H new ATOM 0 HA ILE A 125 25.063 13.363 2.501 1.00 0.00 H new ATOM 0 HB ILE A 125 26.670 14.649 0.308 1.00 0.00 H new ATOM 0 HG12 ILE A 125 27.266 12.393 0.179 1.00 0.00 H new ATOM 0 HG13 ILE A 125 28.563 13.187 1.050 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.290 15.235 2.158 1.00 0.00 H new ATOM 0 HG22 ILE A 125 26.699 16.000 2.379 1.00 0.00 H new ATOM 0 HG23 ILE A 125 27.137 14.566 3.337 1.00 0.00 H new ATOM 0 HD11 ILE A 125 28.063 10.995 2.029 1.00 0.00 H new ATOM 0 HD12 ILE A 125 27.691 12.291 3.191 1.00 0.00 H new ATOM 0 HD13 ILE A 125 26.374 11.485 2.307 1.00 0.00 H new ATOM 1913 N ARG A 126 23.858 15.692 0.467 1.00 0.00 N ATOM 1914 CA ARG A 126 23.051 16.931 0.365 1.00 0.00 C ATOM 1915 C ARG A 126 21.780 16.940 1.234 1.00 0.00 C ATOM 1916 O ARG A 126 21.287 18.021 1.559 1.00 0.00 O ATOM 1917 CB ARG A 126 22.653 17.161 -1.107 1.00 0.00 C ATOM 1918 CG ARG A 126 23.821 17.568 -2.023 1.00 0.00 C ATOM 1919 CD ARG A 126 23.400 17.494 -3.501 1.00 0.00 C ATOM 1920 NE ARG A 126 24.547 17.248 -4.394 1.00 0.00 N ATOM 1921 CZ ARG A 126 24.517 16.825 -5.646 1.00 0.00 C ATOM 1922 NH1 ARG A 126 23.438 16.474 -6.281 1.00 0.00 N1+ ATOM 1923 NH2 ARG A 126 25.630 16.740 -6.301 1.00 0.00 N ATOM 0 H ARG A 126 24.017 15.252 -0.439 1.00 0.00 H new ATOM 0 HA ARG A 126 23.686 17.733 0.743 1.00 0.00 H new ATOM 0 HB2 ARG A 126 22.203 16.248 -1.496 1.00 0.00 H new ATOM 0 HB3 ARG A 126 21.888 17.936 -1.147 1.00 0.00 H new ATOM 0 HG2 ARG A 126 24.144 18.581 -1.781 1.00 0.00 H new ATOM 0 HG3 ARG A 126 24.673 16.911 -1.849 1.00 0.00 H new ATOM 0 HD2 ARG A 126 22.665 16.699 -3.629 1.00 0.00 H new ATOM 0 HD3 ARG A 126 22.913 18.427 -3.786 1.00 0.00 H new ATOM 0 HE ARG A 126 25.471 17.425 -4.000 1.00 0.00 H new ATOM 0 HH11 ARG A 126 22.534 16.515 -5.811 1.00 0.00 H new ATOM 0 HH12 ARG A 126 23.496 16.157 -7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 126 26.508 16.997 -5.850 1.00 0.00 H new ATOM 0 HH22 ARG A 126 25.629 16.416 -7.268 1.00 0.00 H new ATOM 1937 N GLU A 127 21.242 15.774 1.598 1.00 0.00 N ATOM 1938 CA GLU A 127 20.024 15.625 2.420 1.00 0.00 C ATOM 1939 C GLU A 127 20.229 14.794 3.706 1.00 0.00 C ATOM 1940 O GLU A 127 19.542 15.015 4.704 1.00 0.00 O ATOM 1941 CB GLU A 127 18.892 15.076 1.538 1.00 0.00 C ATOM 1942 CG GLU A 127 19.133 13.649 1.018 1.00 0.00 C ATOM 1943 CD GLU A 127 18.098 13.192 -0.032 1.00 0.00 C ATOM 1944 OE1 GLU A 127 18.123 11.992 -0.392 1.00 0.00 O ATOM 1945 OE2 GLU A 127 17.257 14.004 -0.492 1.00 0.00 O1- ATOM 0 H GLU A 127 21.647 14.879 1.325 1.00 0.00 H new ATOM 0 HA GLU A 127 19.750 16.613 2.791 1.00 0.00 H new ATOM 0 HB2 GLU A 127 17.963 15.091 2.108 1.00 0.00 H new ATOM 0 HB3 GLU A 127 18.754 15.742 0.687 1.00 0.00 H new ATOM 0 HG2 GLU A 127 20.130 13.594 0.581 1.00 0.00 H new ATOM 0 HG3 GLU A 127 19.115 12.956 1.860 1.00 0.00 H new ATOM 1952 N ALA A 128 21.196 13.875 3.706 1.00 0.00 N ATOM 1953 CA ALA A 128 21.660 13.100 4.856 1.00 0.00 C ATOM 1954 C ALA A 128 22.380 13.983 5.898 1.00 0.00 C ATOM 1955 O ALA A 128 22.237 13.755 7.101 1.00 0.00 O ATOM 1956 CB ALA A 128 22.496 11.957 4.275 1.00 0.00 C ATOM 0 H ALA A 128 21.705 13.639 2.854 1.00 0.00 H new ATOM 0 HA ALA A 128 20.838 12.680 5.436 1.00 0.00 H new ATOM 0 HB1 ALA A 128 22.876 11.335 5.086 1.00 0.00 H new ATOM 0 HB2 ALA A 128 21.876 11.352 3.614 1.00 0.00 H new ATOM 0 HB3 ALA A 128 23.333 12.369 3.711 1.00 0.00 H new ATOM 1962 N ASP A 129 23.097 15.028 5.467 1.00 0.00 N ATOM 1963 CA ASP A 129 23.620 16.093 6.331 1.00 0.00 C ATOM 1964 C ASP A 129 22.715 17.336 6.224 1.00 0.00 C ATOM 1965 O ASP A 129 22.568 17.932 5.153 1.00 0.00 O ATOM 1966 CB ASP A 129 25.087 16.389 5.979 1.00 0.00 C ATOM 1967 CG ASP A 129 25.738 17.472 6.856 1.00 0.00 C ATOM 1968 OD1 ASP A 129 25.051 18.146 7.657 1.00 0.00 O ATOM 1969 OD2 ASP A 129 26.963 17.675 6.711 1.00 0.00 O1- ATOM 0 H ASP A 129 23.335 15.159 4.484 1.00 0.00 H new ATOM 0 HA ASP A 129 23.607 15.772 7.373 1.00 0.00 H new ATOM 0 HB2 ASP A 129 25.664 15.469 6.069 1.00 0.00 H new ATOM 0 HB3 ASP A 129 25.143 16.699 4.936 1.00 0.00 H new ATOM 2024 N GLY A 134 29.661 18.344 6.988 1.00 0.00 N ATOM 2025 CA GLY A 134 30.290 17.046 6.720 1.00 0.00 C ATOM 2026 C GLY A 134 29.887 15.942 7.705 1.00 0.00 C ATOM 2027 O GLY A 134 30.663 15.013 7.939 1.00 0.00 O ATOM 0 HA2 GLY A 134 30.030 16.730 5.710 1.00 0.00 H new ATOM 0 HA3 GLY A 134 31.373 17.166 6.748 1.00 0.00 H new ATOM 2031 N GLN A 135 28.705 16.043 8.316 1.00 0.00 N ATOM 2032 CA GLN A 135 28.165 15.082 9.286 1.00 0.00 C ATOM 2033 C GLN A 135 26.738 14.663 8.906 1.00 0.00 C ATOM 2034 O GLN A 135 25.760 15.341 9.231 1.00 0.00 O ATOM 2035 CB GLN A 135 28.230 15.661 10.711 1.00 0.00 C ATOM 2036 CG GLN A 135 29.663 15.795 11.254 1.00 0.00 C ATOM 2037 CD GLN A 135 30.312 17.135 10.906 1.00 0.00 C ATOM 2038 OE1 GLN A 135 29.847 18.202 11.283 1.00 0.00 O ATOM 2039 NE2 GLN A 135 31.408 17.139 10.177 1.00 0.00 N ATOM 0 H GLN A 135 28.072 16.824 8.144 1.00 0.00 H new ATOM 0 HA GLN A 135 28.781 14.183 9.265 1.00 0.00 H new ATOM 0 HB2 GLN A 135 27.754 16.642 10.718 1.00 0.00 H new ATOM 0 HB3 GLN A 135 27.654 15.022 11.381 1.00 0.00 H new ATOM 0 HG2 GLN A 135 29.648 15.676 12.337 1.00 0.00 H new ATOM 0 HG3 GLN A 135 30.274 14.987 10.853 1.00 0.00 H new ATOM 0 HE21 GLN A 135 31.809 16.258 9.854 1.00 0.00 H new ATOM 0 HE22 GLN A 135 31.856 18.023 9.935 1.00 0.00 H new ATOM 2048 N VAL A 136 26.604 13.513 8.242 1.00 0.00 N ATOM 2049 CA VAL A 136 25.296 12.891 8.011 1.00 0.00 C ATOM 2050 C VAL A 136 24.699 12.448 9.340 1.00 0.00 C ATOM 2051 O VAL A 136 25.332 11.713 10.096 1.00 0.00 O ATOM 2052 CB VAL A 136 25.384 11.696 7.043 1.00 0.00 C ATOM 2053 CG1 VAL A 136 24.155 10.792 7.152 1.00 0.00 C ATOM 2054 CG2 VAL A 136 25.690 12.173 5.623 1.00 0.00 C ATOM 0 H VAL A 136 27.389 12.991 7.853 1.00 0.00 H new ATOM 0 HA VAL A 136 24.651 13.636 7.545 1.00 0.00 H new ATOM 0 HB VAL A 136 26.223 11.065 7.334 1.00 0.00 H new ATOM 0 HG11 VAL A 136 24.252 9.960 6.455 1.00 0.00 H new ATOM 0 HG12 VAL A 136 24.076 10.406 8.168 1.00 0.00 H new ATOM 0 HG13 VAL A 136 23.260 11.365 6.911 1.00 0.00 H new ATOM 0 HG21 VAL A 136 25.748 11.314 4.955 1.00 0.00 H new ATOM 0 HG22 VAL A 136 24.899 12.842 5.285 1.00 0.00 H new ATOM 0 HG23 VAL A 136 26.642 12.704 5.615 1.00 0.00 H new ATOM 2064 N ASN A 137 23.451 12.824 9.613 1.00 0.00 N ATOM 2065 CA ASN A 137 22.731 12.305 10.770 1.00 0.00 C ATOM 2066 C ASN A 137 21.746 11.221 10.339 1.00 0.00 C ATOM 2067 O ASN A 137 20.595 11.485 9.984 1.00 0.00 O ATOM 2068 CB ASN A 137 22.101 13.461 11.570 1.00 0.00 C ATOM 2069 CG ASN A 137 23.109 14.249 12.399 1.00 0.00 C ATOM 2070 OD1 ASN A 137 23.070 14.241 13.621 1.00 0.00 O ATOM 2071 ND2 ASN A 137 24.049 14.941 11.794 1.00 0.00 N ATOM 0 H ASN A 137 22.919 13.486 9.048 1.00 0.00 H new ATOM 0 HA ASN A 137 23.422 11.816 11.456 1.00 0.00 H new ATOM 0 HB2 ASN A 137 21.601 14.140 10.879 1.00 0.00 H new ATOM 0 HB3 ASN A 137 21.334 13.058 12.232 1.00 0.00 H new ATOM 0 HD21 ASN A 137 24.733 15.461 12.343 1.00 0.00 H new ATOM 0 HD22 ASN A 137 24.095 14.957 10.775 1.00 0.00 H new ATOM 2078 N TYR A 138 22.224 9.974 10.377 1.00 0.00 N ATOM 2079 CA TYR A 138 21.487 8.825 9.864 1.00 0.00 C ATOM 2080 C TYR A 138 20.167 8.567 10.605 1.00 0.00 C ATOM 2081 O TYR A 138 19.261 8.000 10.010 1.00 0.00 O ATOM 2082 CB TYR A 138 22.385 7.582 9.849 1.00 0.00 C ATOM 2083 CG TYR A 138 22.537 6.859 11.174 1.00 0.00 C ATOM 2084 CD1 TYR A 138 21.530 5.985 11.634 1.00 0.00 C ATOM 2085 CD2 TYR A 138 23.710 7.026 11.927 1.00 0.00 C ATOM 2086 CE1 TYR A 138 21.679 5.313 12.862 1.00 0.00 C ATOM 2087 CE2 TYR A 138 23.869 6.352 13.152 1.00 0.00 C ATOM 2088 CZ TYR A 138 22.850 5.500 13.629 1.00 0.00 C ATOM 2089 OH TYR A 138 23.002 4.861 14.821 1.00 0.00 O ATOM 0 H TYR A 138 23.136 9.736 10.766 1.00 0.00 H new ATOM 0 HA TYR A 138 21.200 9.062 8.840 1.00 0.00 H new ATOM 0 HB2 TYR A 138 21.987 6.879 9.117 1.00 0.00 H new ATOM 0 HB3 TYR A 138 23.375 7.877 9.502 1.00 0.00 H new ATOM 0 HD1 TYR A 138 20.640 5.831 11.041 1.00 0.00 H new ATOM 0 HD2 TYR A 138 24.494 7.675 11.565 1.00 0.00 H new ATOM 0 HE1 TYR A 138 20.899 4.656 13.217 1.00 0.00 H new ATOM 0 HE2 TYR A 138 24.772 6.487 13.728 1.00 0.00 H new ATOM 0 HH TYR A 138 23.867 5.103 15.214 1.00 0.00 H new ATOM 2099 N GLU A 139 20.019 9.009 11.859 1.00 0.00 N ATOM 2100 CA GLU A 139 18.758 8.930 12.616 1.00 0.00 C ATOM 2101 C GLU A 139 17.625 9.776 12.006 1.00 0.00 C ATOM 2102 O GLU A 139 16.462 9.369 12.035 1.00 0.00 O ATOM 2103 CB GLU A 139 19.010 9.370 14.070 1.00 0.00 C ATOM 2104 CG GLU A 139 19.553 8.231 14.944 1.00 0.00 C ATOM 2105 CD GLU A 139 18.546 7.074 15.122 1.00 0.00 C ATOM 2106 OE1 GLU A 139 18.965 5.948 15.469 1.00 0.00 O ATOM 2107 OE2 GLU A 139 17.323 7.263 14.912 1.00 0.00 O1- ATOM 0 H GLU A 139 20.780 9.438 12.386 1.00 0.00 H new ATOM 0 HA GLU A 139 18.426 7.892 12.576 1.00 0.00 H new ATOM 0 HB2 GLU A 139 19.718 10.199 14.078 1.00 0.00 H new ATOM 0 HB3 GLU A 139 18.080 9.742 14.500 1.00 0.00 H new ATOM 0 HG2 GLU A 139 20.469 7.843 14.498 1.00 0.00 H new ATOM 0 HG3 GLU A 139 19.819 8.628 15.924 1.00 0.00 H new ATOM 2114 N GLU A 140 17.946 10.926 11.407 1.00 0.00 N ATOM 2115 CA GLU A 140 16.991 11.704 10.606 1.00 0.00 C ATOM 2116 C GLU A 140 16.807 11.077 9.215 1.00 0.00 C ATOM 2117 O GLU A 140 15.692 10.995 8.695 1.00 0.00 O ATOM 2118 CB GLU A 140 17.479 13.157 10.462 1.00 0.00 C ATOM 2119 CG GLU A 140 17.744 13.888 11.790 1.00 0.00 C ATOM 2120 CD GLU A 140 16.546 13.868 12.764 1.00 0.00 C ATOM 2121 OE1 GLU A 140 16.767 13.739 13.994 1.00 0.00 O ATOM 2122 OE2 GLU A 140 15.381 14.018 12.321 1.00 0.00 O1- ATOM 0 H GLU A 140 18.874 11.346 11.462 1.00 0.00 H new ATOM 0 HA GLU A 140 16.030 11.697 11.120 1.00 0.00 H new ATOM 0 HB2 GLU A 140 18.397 13.160 9.874 1.00 0.00 H new ATOM 0 HB3 GLU A 140 16.736 13.720 9.897 1.00 0.00 H new ATOM 0 HG2 GLU A 140 18.605 13.432 12.279 1.00 0.00 H new ATOM 0 HG3 GLU A 140 18.009 14.923 11.577 1.00 0.00 H new ATOM 2129 N PHE A 141 17.905 10.596 8.622 1.00 0.00 N ATOM 2130 CA PHE A 141 17.923 10.055 7.265 1.00 0.00 C ATOM 2131 C PHE A 141 17.122 8.752 7.126 1.00 0.00 C ATOM 2132 O PHE A 141 16.326 8.639 6.200 1.00 0.00 O ATOM 2133 CB PHE A 141 19.379 9.862 6.828 1.00 0.00 C ATOM 2134 CG PHE A 141 19.615 9.597 5.355 1.00 0.00 C ATOM 2135 CD1 PHE A 141 20.768 8.895 4.965 1.00 0.00 C ATOM 2136 CD2 PHE A 141 18.735 10.078 4.365 1.00 0.00 C ATOM 2137 CE1 PHE A 141 21.029 8.668 3.609 1.00 0.00 C ATOM 2138 CE2 PHE A 141 18.999 9.860 3.008 1.00 0.00 C ATOM 2139 CZ PHE A 141 20.148 9.149 2.623 1.00 0.00 C ATOM 0 H PHE A 141 18.816 10.573 9.080 1.00 0.00 H new ATOM 0 HA PHE A 141 17.429 10.772 6.609 1.00 0.00 H new ATOM 0 HB2 PHE A 141 19.940 10.754 7.108 1.00 0.00 H new ATOM 0 HB3 PHE A 141 19.798 9.031 7.395 1.00 0.00 H new ATOM 0 HD1 PHE A 141 21.455 8.530 5.714 1.00 0.00 H new ATOM 0 HD2 PHE A 141 17.848 10.620 4.656 1.00 0.00 H new ATOM 0 HE1 PHE A 141 21.913 8.120 3.317 1.00 0.00 H new ATOM 0 HE2 PHE A 141 18.320 10.238 2.258 1.00 0.00 H new ATOM 0 HZ PHE A 141 20.354 8.973 1.577 1.00 0.00 H new ATOM 2149 N VAL A 142 17.256 7.797 8.054 1.00 0.00 N ATOM 2150 CA VAL A 142 16.491 6.532 8.061 1.00 0.00 C ATOM 2151 C VAL A 142 14.977 6.784 8.131 1.00 0.00 C ATOM 2152 O VAL A 142 14.217 6.178 7.376 1.00 0.00 O ATOM 2153 CB VAL A 142 16.988 5.578 9.172 1.00 0.00 C ATOM 2154 CG1 VAL A 142 16.784 6.127 10.576 1.00 0.00 C ATOM 2155 CG2 VAL A 142 16.284 4.227 9.080 1.00 0.00 C ATOM 0 H VAL A 142 17.907 7.877 8.835 1.00 0.00 H new ATOM 0 HA VAL A 142 16.674 6.028 7.112 1.00 0.00 H new ATOM 0 HB VAL A 142 18.059 5.470 9.003 1.00 0.00 H new ATOM 0 HG11 VAL A 142 17.155 5.407 11.306 1.00 0.00 H new ATOM 0 HG12 VAL A 142 17.329 7.065 10.683 1.00 0.00 H new ATOM 0 HG13 VAL A 142 15.722 6.303 10.747 1.00 0.00 H new ATOM 0 HG21 VAL A 142 16.649 3.572 9.871 1.00 0.00 H new ATOM 0 HG22 VAL A 142 15.209 4.368 9.193 1.00 0.00 H new ATOM 0 HG23 VAL A 142 16.490 3.775 8.110 1.00 0.00 H new ATOM 2165 N GLN A 143 14.540 7.741 8.958 1.00 0.00 N ATOM 2166 CA GLN A 143 13.141 8.178 9.055 1.00 0.00 C ATOM 2167 C GLN A 143 12.635 8.817 7.753 1.00 0.00 C ATOM 2168 O GLN A 143 11.546 8.475 7.291 1.00 0.00 O ATOM 2169 CB GLN A 143 12.998 9.162 10.233 1.00 0.00 C ATOM 2170 CG GLN A 143 12.640 8.449 11.548 1.00 0.00 C ATOM 2171 CD GLN A 143 11.126 8.315 11.746 1.00 0.00 C ATOM 2172 OE1 GLN A 143 10.376 9.283 11.727 1.00 0.00 O ATOM 2173 NE2 GLN A 143 10.607 7.128 11.967 1.00 0.00 N ATOM 0 H GLN A 143 15.161 8.244 9.592 1.00 0.00 H new ATOM 0 HA GLN A 143 12.524 7.297 9.229 1.00 0.00 H new ATOM 0 HB2 GLN A 143 13.932 9.710 10.362 1.00 0.00 H new ATOM 0 HB3 GLN A 143 12.227 9.896 9.999 1.00 0.00 H new ATOM 0 HG2 GLN A 143 13.094 7.458 11.556 1.00 0.00 H new ATOM 0 HG3 GLN A 143 13.066 9.002 12.385 1.00 0.00 H new ATOM 0 HE21 GLN A 143 11.208 6.304 11.988 1.00 0.00 H new ATOM 0 HE22 GLN A 143 9.603 7.030 12.117 1.00 0.00 H new ATOM 2182 N MET A 144 13.419 9.704 7.129 1.00 0.00 N ATOM 2183 CA MET A 144 13.079 10.324 5.838 1.00 0.00 C ATOM 2184 C MET A 144 13.017 9.298 4.694 1.00 0.00 C ATOM 2185 O MET A 144 12.081 9.294 3.895 1.00 0.00 O ATOM 2186 CB MET A 144 14.106 11.427 5.538 1.00 0.00 C ATOM 2187 CG MET A 144 13.958 12.005 4.127 1.00 0.00 C ATOM 2188 SD MET A 144 14.949 13.498 3.854 1.00 0.00 S ATOM 2189 CE MET A 144 16.390 12.731 3.077 1.00 0.00 C ATOM 0 H MET A 144 14.314 10.015 7.506 1.00 0.00 H new ATOM 0 HA MET A 144 12.080 10.755 5.910 1.00 0.00 H new ATOM 0 HB2 MET A 144 13.996 12.229 6.268 1.00 0.00 H new ATOM 0 HB3 MET A 144 15.112 11.024 5.657 1.00 0.00 H new ATOM 0 HG2 MET A 144 14.248 11.247 3.399 1.00 0.00 H new ATOM 0 HG3 MET A 144 12.908 12.236 3.945 1.00 0.00 H new ATOM 0 HE1 MET A 144 17.288 13.285 3.349 1.00 0.00 H new ATOM 0 HE2 MET A 144 16.482 11.700 3.419 1.00 0.00 H new ATOM 0 HE3 MET A 144 16.269 12.744 1.994 1.00 0.00 H new ATOM 2199 N MET A 145 14.009 8.412 4.625 1.00 0.00 N ATOM 2200 CA MET A 145 14.194 7.427 3.560 1.00 0.00 C ATOM 2201 C MET A 145 13.075 6.370 3.554 1.00 0.00 C ATOM 2202 O MET A 145 12.550 6.018 2.494 1.00 0.00 O ATOM 2203 CB MET A 145 15.603 6.841 3.753 1.00 0.00 C ATOM 2204 CG MET A 145 16.124 5.981 2.607 1.00 0.00 C ATOM 2205 SD MET A 145 17.939 5.850 2.574 1.00 0.00 S ATOM 2206 CE MET A 145 18.292 5.179 4.219 1.00 0.00 C ATOM 0 H MET A 145 14.736 8.358 5.339 1.00 0.00 H new ATOM 0 HA MET A 145 14.121 7.885 2.573 1.00 0.00 H new ATOM 0 HB2 MET A 145 16.300 7.664 3.911 1.00 0.00 H new ATOM 0 HB3 MET A 145 15.606 6.241 4.663 1.00 0.00 H new ATOM 0 HG2 MET A 145 15.696 4.982 2.688 1.00 0.00 H new ATOM 0 HG3 MET A 145 15.779 6.400 1.662 1.00 0.00 H new ATOM 0 HE1 MET A 145 19.143 4.500 4.160 1.00 0.00 H new ATOM 0 HE2 MET A 145 18.526 5.995 4.902 1.00 0.00 H new ATOM 0 HE3 MET A 145 17.420 4.637 4.586 1.00 0.00 H new ATOM 2216 N THR A 146 12.638 5.931 4.740 1.00 0.00 N ATOM 2217 CA THR A 146 11.521 4.980 4.931 1.00 0.00 C ATOM 2218 C THR A 146 10.122 5.620 4.994 1.00 0.00 C ATOM 2219 O THR A 146 9.131 4.890 5.080 1.00 0.00 O ATOM 2220 CB THR A 146 11.731 4.102 6.177 1.00 0.00 C ATOM 2221 OG1 THR A 146 11.804 4.873 7.355 1.00 0.00 O ATOM 2222 CG2 THR A 146 12.990 3.245 6.067 1.00 0.00 C ATOM 0 H THR A 146 13.058 6.231 5.620 1.00 0.00 H new ATOM 0 HA THR A 146 11.542 4.370 4.028 1.00 0.00 H new ATOM 0 HB THR A 146 10.861 3.448 6.231 1.00 0.00 H new ATOM 0 HG1 THR A 146 12.668 5.335 7.391 1.00 0.00 H new ATOM 0 HG21 THR A 146 13.099 2.641 6.968 1.00 0.00 H new ATOM 0 HG22 THR A 146 12.910 2.590 5.199 1.00 0.00 H new ATOM 0 HG23 THR A 146 13.861 3.891 5.955 1.00 0.00 H new ATOM 2373 N GLN B1904 30.630 -7.900 7.785 1.00 0.00 N ATOM 2374 CA GLN B1904 29.362 -7.233 8.113 1.00 0.00 C ATOM 2375 C GLN B1904 29.239 -5.859 7.435 1.00 0.00 C ATOM 2376 O GLN B1904 28.173 -5.499 6.938 1.00 0.00 O ATOM 2377 CB GLN B1904 29.251 -7.105 9.645 1.00 0.00 C ATOM 2378 CG GLN B1904 27.953 -6.432 10.129 1.00 0.00 C ATOM 2379 CD GLN B1904 26.691 -7.238 9.804 1.00 0.00 C ATOM 2380 OE1 GLN B1904 26.638 -8.455 9.939 1.00 0.00 O ATOM 2381 NE2 GLN B1904 25.619 -6.604 9.380 1.00 0.00 N ATOM 0 HA GLN B1904 28.540 -7.838 7.732 1.00 0.00 H new ATOM 0 HB2 GLN B1904 29.319 -8.099 10.087 1.00 0.00 H new ATOM 0 HB3 GLN B1904 30.103 -6.533 10.013 1.00 0.00 H new ATOM 0 HG2 GLN B1904 28.011 -6.281 11.207 1.00 0.00 H new ATOM 0 HG3 GLN B1904 27.872 -5.445 9.673 1.00 0.00 H new ATOM 0 HE21 GLN B1904 25.639 -5.591 9.260 1.00 0.00 H new ATOM 0 HE22 GLN B1904 24.767 -7.125 9.171 1.00 0.00 H new ATOM 2390 N GLU B1905 30.325 -5.091 7.395 1.00 0.00 N ATOM 2391 CA GLU B1905 30.388 -3.733 6.839 1.00 0.00 C ATOM 2392 C GLU B1905 29.920 -3.693 5.370 1.00 0.00 C ATOM 2393 O GLU B1905 29.044 -2.904 5.011 1.00 0.00 O ATOM 2394 CB GLU B1905 31.845 -3.270 7.016 1.00 0.00 C ATOM 2395 CG GLU B1905 32.206 -1.846 6.595 1.00 0.00 C ATOM 2396 CD GLU B1905 33.735 -1.665 6.571 1.00 0.00 C ATOM 2397 OE1 GLU B1905 34.403 -2.000 7.580 1.00 0.00 O ATOM 2398 OE2 GLU B1905 34.287 -1.201 5.546 1.00 0.00 O1- ATOM 0 H GLU B1905 31.223 -5.406 7.762 1.00 0.00 H new ATOM 0 HA GLU B1905 29.709 -3.057 7.358 1.00 0.00 H new ATOM 0 HB2 GLU B1905 32.104 -3.382 8.069 1.00 0.00 H new ATOM 0 HB3 GLU B1905 32.482 -3.954 6.456 1.00 0.00 H new ATOM 0 HG2 GLU B1905 31.793 -1.636 5.608 1.00 0.00 H new ATOM 0 HG3 GLU B1905 31.760 -1.131 7.286 1.00 0.00 H new ATOM 2405 N GLU B1906 30.423 -4.606 4.533 1.00 0.00 N ATOM 2406 CA GLU B1906 30.103 -4.687 3.099 1.00 0.00 C ATOM 2407 C GLU B1906 28.630 -5.010 2.799 1.00 0.00 C ATOM 2408 O GLU B1906 28.101 -4.584 1.772 1.00 0.00 O ATOM 2409 CB GLU B1906 31.042 -5.735 2.466 1.00 0.00 C ATOM 2410 CG GLU B1906 30.917 -5.861 0.939 1.00 0.00 C ATOM 2411 CD GLU B1906 31.940 -6.853 0.342 1.00 0.00 C ATOM 2412 OE1 GLU B1906 31.543 -7.698 -0.498 1.00 0.00 O ATOM 2413 OE2 GLU B1906 33.148 -6.787 0.677 1.00 0.00 O1- ATOM 0 H GLU B1906 31.078 -5.326 4.837 1.00 0.00 H new ATOM 0 HA GLU B1906 30.259 -3.700 2.662 1.00 0.00 H new ATOM 0 HB2 GLU B1906 32.072 -5.479 2.714 1.00 0.00 H new ATOM 0 HB3 GLU B1906 30.838 -6.706 2.916 1.00 0.00 H new ATOM 0 HG2 GLU B1906 29.908 -6.188 0.686 1.00 0.00 H new ATOM 0 HG3 GLU B1906 31.058 -4.881 0.484 1.00 0.00 H new ATOM 2420 N VAL B1907 27.966 -5.742 3.697 1.00 0.00 N ATOM 2421 CA VAL B1907 26.568 -6.200 3.525 1.00 0.00 C ATOM 2422 C VAL B1907 25.569 -5.230 4.153 1.00 0.00 C ATOM 2423 O VAL B1907 24.485 -5.015 3.612 1.00 0.00 O ATOM 2424 CB VAL B1907 26.331 -7.654 3.983 1.00 0.00 C ATOM 2425 CG1 VAL B1907 27.371 -8.609 3.385 1.00 0.00 C ATOM 2426 CG2 VAL B1907 26.330 -7.851 5.497 1.00 0.00 C ATOM 0 H VAL B1907 28.382 -6.042 4.579 1.00 0.00 H new ATOM 0 HA VAL B1907 26.390 -6.202 2.450 1.00 0.00 H new ATOM 0 HB VAL B1907 25.331 -7.883 3.616 1.00 0.00 H new ATOM 0 HG11 VAL B1907 27.173 -9.624 3.729 1.00 0.00 H new ATOM 0 HG12 VAL B1907 27.312 -8.577 2.297 1.00 0.00 H new ATOM 0 HG13 VAL B1907 28.369 -8.306 3.703 1.00 0.00 H new ATOM 0 HG21 VAL B1907 26.156 -8.902 5.727 1.00 0.00 H new ATOM 0 HG22 VAL B1907 27.293 -7.545 5.904 1.00 0.00 H new ATOM 0 HG23 VAL B1907 25.539 -7.247 5.942 1.00 0.00 H new ATOM 2436 N SER B1908 25.971 -4.578 5.246 1.00 0.00 N ATOM 2437 CA SER B1908 25.226 -3.493 5.893 1.00 0.00 C ATOM 2438 C SER B1908 25.007 -2.330 4.931 1.00 0.00 C ATOM 2439 O SER B1908 23.903 -1.800 4.834 1.00 0.00 O ATOM 2440 CB SER B1908 25.990 -3.002 7.122 1.00 0.00 C ATOM 2441 OG SER B1908 26.129 -4.066 8.045 1.00 0.00 O ATOM 0 H SER B1908 26.848 -4.795 5.719 1.00 0.00 H new ATOM 0 HA SER B1908 24.253 -3.880 6.194 1.00 0.00 H new ATOM 0 HB2 SER B1908 26.972 -2.630 6.829 1.00 0.00 H new ATOM 0 HB3 SER B1908 25.459 -2.171 7.586 1.00 0.00 H new ATOM 0 HG SER B1908 26.743 -4.737 7.681 1.00 0.00 H new ATOM 2447 N ALA B1909 26.024 -1.986 4.137 1.00 0.00 N ATOM 2448 CA ALA B1909 25.926 -0.913 3.156 1.00 0.00 C ATOM 2449 C ALA B1909 24.739 -1.143 2.207 1.00 0.00 C ATOM 2450 O ALA B1909 23.950 -0.230 1.984 1.00 0.00 O ATOM 2451 CB ALA B1909 27.260 -0.834 2.402 1.00 0.00 C ATOM 0 H ALA B1909 26.935 -2.445 4.159 1.00 0.00 H new ATOM 0 HA ALA B1909 25.738 0.039 3.653 1.00 0.00 H new ATOM 0 HB1 ALA B1909 27.212 -0.037 1.660 1.00 0.00 H new ATOM 0 HB2 ALA B1909 28.065 -0.626 3.107 1.00 0.00 H new ATOM 0 HB3 ALA B1909 27.452 -1.783 1.902 1.00 0.00 H new ATOM 2457 N ILE B1910 24.555 -2.369 1.710 1.00 0.00 N ATOM 2458 CA ILE B1910 23.554 -2.696 0.679 1.00 0.00 C ATOM 2459 C ILE B1910 22.119 -2.393 1.147 1.00 0.00 C ATOM 2460 O ILE B1910 21.305 -1.908 0.364 1.00 0.00 O ATOM 2461 CB ILE B1910 23.676 -4.168 0.223 1.00 0.00 C ATOM 2462 CG1 ILE B1910 25.163 -4.528 0.021 1.00 0.00 C ATOM 2463 CG2 ILE B1910 22.835 -4.375 -1.053 1.00 0.00 C ATOM 2464 CD1 ILE B1910 25.472 -5.730 -0.873 1.00 0.00 C ATOM 0 H ILE B1910 25.101 -3.175 2.013 1.00 0.00 H new ATOM 0 HA ILE B1910 23.764 -2.053 -0.175 1.00 0.00 H new ATOM 0 HB ILE B1910 23.286 -4.841 0.986 1.00 0.00 H new ATOM 0 HG12 ILE B1910 25.669 -3.657 -0.396 1.00 0.00 H new ATOM 0 HG13 ILE B1910 25.603 -4.713 1.001 1.00 0.00 H new ATOM 0 HG21 ILE B1910 22.918 -5.412 -1.379 1.00 0.00 H new ATOM 0 HG22 ILE B1910 21.791 -4.143 -0.842 1.00 0.00 H new ATOM 0 HG23 ILE B1910 23.201 -3.717 -1.841 1.00 0.00 H new ATOM 0 HD11 ILE B1910 26.551 -5.873 -0.930 1.00 0.00 H new ATOM 0 HD12 ILE B1910 25.009 -6.624 -0.454 1.00 0.00 H new ATOM 0 HD13 ILE B1910 25.076 -5.551 -1.873 1.00 0.00 H new ATOM 2476 N ILE B1911 21.824 -2.611 2.434 1.00 0.00 N ATOM 2477 CA ILE B1911 20.531 -2.284 3.066 1.00 0.00 C ATOM 2478 C ILE B1911 20.217 -0.782 2.937 1.00 0.00 C ATOM 2479 O ILE B1911 19.096 -0.404 2.591 1.00 0.00 O ATOM 2480 CB ILE B1911 20.556 -2.773 4.533 1.00 0.00 C ATOM 2481 CG1 ILE B1911 20.493 -4.320 4.583 1.00 0.00 C ATOM 2482 CG2 ILE B1911 19.419 -2.189 5.387 1.00 0.00 C ATOM 2483 CD1 ILE B1911 21.308 -4.905 5.740 1.00 0.00 C ATOM 0 H ILE B1911 22.490 -3.029 3.084 1.00 0.00 H new ATOM 0 HA ILE B1911 19.720 -2.800 2.552 1.00 0.00 H new ATOM 0 HB ILE B1911 21.494 -2.417 4.958 1.00 0.00 H new ATOM 0 HG12 ILE B1911 19.454 -4.635 4.680 1.00 0.00 H new ATOM 0 HG13 ILE B1911 20.863 -4.726 3.641 1.00 0.00 H new ATOM 0 HG21 ILE B1911 19.495 -2.572 6.405 1.00 0.00 H new ATOM 0 HG22 ILE B1911 19.497 -1.102 5.402 1.00 0.00 H new ATOM 0 HG23 ILE B1911 18.458 -2.478 4.961 1.00 0.00 H new ATOM 0 HD11 ILE B1911 21.229 -5.992 5.728 1.00 0.00 H new ATOM 0 HD12 ILE B1911 22.353 -4.616 5.631 1.00 0.00 H new ATOM 0 HD13 ILE B1911 20.923 -4.524 6.686 1.00 0.00 H new ATOM 2495 N ILE B1912 21.224 0.070 3.142 1.00 0.00 N ATOM 2496 CA ILE B1912 21.131 1.524 2.958 1.00 0.00 C ATOM 2497 C ILE B1912 21.076 1.878 1.459 1.00 0.00 C ATOM 2498 O ILE B1912 20.275 2.727 1.084 1.00 0.00 O ATOM 2499 CB ILE B1912 22.310 2.212 3.682 1.00 0.00 C ATOM 2500 CG1 ILE B1912 22.253 1.961 5.209 1.00 0.00 C ATOM 2501 CG2 ILE B1912 22.352 3.728 3.427 1.00 0.00 C ATOM 2502 CD1 ILE B1912 23.652 1.823 5.806 1.00 0.00 C ATOM 0 H ILE B1912 22.148 -0.236 3.447 1.00 0.00 H new ATOM 0 HA ILE B1912 20.206 1.893 3.401 1.00 0.00 H new ATOM 0 HB ILE B1912 23.216 1.768 3.269 1.00 0.00 H new ATOM 0 HG12 ILE B1912 21.729 2.784 5.695 1.00 0.00 H new ATOM 0 HG13 ILE B1912 21.680 1.056 5.409 1.00 0.00 H new ATOM 0 HG21 ILE B1912 23.199 4.163 3.958 1.00 0.00 H new ATOM 0 HG22 ILE B1912 22.459 3.914 2.358 1.00 0.00 H new ATOM 0 HG23 ILE B1912 21.428 4.183 3.784 1.00 0.00 H new ATOM 0 HD11 ILE B1912 23.574 1.648 6.879 1.00 0.00 H new ATOM 0 HD12 ILE B1912 24.166 0.984 5.338 1.00 0.00 H new ATOM 0 HD13 ILE B1912 24.216 2.739 5.628 1.00 0.00 H new ATOM 2514 N GLN B1913 21.847 1.217 0.577 1.00 0.00 N ATOM 2515 CA GLN B1913 21.818 1.487 -0.880 1.00 0.00 C ATOM 2516 C GLN B1913 20.445 1.180 -1.503 1.00 0.00 C ATOM 2517 O GLN B1913 19.931 1.982 -2.288 1.00 0.00 O ATOM 2518 CB GLN B1913 22.904 0.710 -1.656 1.00 0.00 C ATOM 2519 CG GLN B1913 24.305 0.861 -1.049 1.00 0.00 C ATOM 2520 CD GLN B1913 25.483 0.637 -1.984 1.00 0.00 C ATOM 2521 OE1 GLN B1913 25.371 0.296 -3.150 1.00 0.00 O ATOM 2522 NE2 GLN B1913 26.680 0.749 -1.452 1.00 0.00 N ATOM 0 H GLN B1913 22.504 0.485 0.847 1.00 0.00 H new ATOM 0 HA GLN B1913 22.022 2.554 -0.971 1.00 0.00 H new ATOM 0 HB2 GLN B1913 22.638 -0.347 -1.681 1.00 0.00 H new ATOM 0 HB3 GLN B1913 22.923 1.058 -2.689 1.00 0.00 H new ATOM 0 HG2 GLN B1913 24.388 1.864 -0.631 1.00 0.00 H new ATOM 0 HG3 GLN B1913 24.393 0.161 -0.218 1.00 0.00 H new ATOM 0 HE21 GLN B1913 26.780 1.034 -0.478 1.00 0.00 H new ATOM 0 HE22 GLN B1913 27.508 0.551 -2.014 1.00 0.00 H new ATOM 2531 N ARG B1914 19.823 0.058 -1.109 1.00 0.00 N ATOM 2532 CA ARG B1914 18.446 -0.310 -1.477 1.00 0.00 C ATOM 2533 C ARG B1914 17.467 0.785 -1.068 1.00 0.00 C ATOM 2534 O ARG B1914 16.778 1.336 -1.923 1.00 0.00 O ATOM 2535 CB ARG B1914 18.044 -1.631 -0.805 1.00 0.00 C ATOM 2536 CG ARG B1914 18.599 -2.880 -1.508 1.00 0.00 C ATOM 2537 CD ARG B1914 18.357 -4.147 -0.673 1.00 0.00 C ATOM 2538 NE ARG B1914 16.948 -4.272 -0.243 1.00 0.00 N ATOM 2539 CZ ARG B1914 16.036 -5.157 -0.592 1.00 0.00 C ATOM 2540 NH1 ARG B1914 16.252 -6.146 -1.409 1.00 0.00 N1+ ATOM 2541 NH2 ARG B1914 14.845 -5.025 -0.101 1.00 0.00 N ATOM 0 H ARG B1914 20.274 -0.635 -0.512 1.00 0.00 H new ATOM 0 HA ARG B1914 18.410 -0.432 -2.560 1.00 0.00 H new ATOM 0 HB2 ARG B1914 18.392 -1.623 0.228 1.00 0.00 H new ATOM 0 HB3 ARG B1914 16.956 -1.696 -0.775 1.00 0.00 H new ATOM 0 HG2 ARG B1914 18.127 -2.990 -2.484 1.00 0.00 H new ATOM 0 HG3 ARG B1914 19.668 -2.756 -1.683 1.00 0.00 H new ATOM 0 HD2 ARG B1914 18.636 -5.024 -1.257 1.00 0.00 H new ATOM 0 HD3 ARG B1914 19.003 -4.130 0.205 1.00 0.00 H new ATOM 0 HE ARG B1914 16.635 -3.567 0.424 1.00 0.00 H new ATOM 0 HH11 ARG B1914 17.175 -6.273 -1.823 1.00 0.00 H new ATOM 0 HH12 ARG B1914 15.498 -6.795 -1.635 1.00 0.00 H new ATOM 0 HH21 ARG B1914 14.638 -4.254 0.534 1.00 0.00 H new ATOM 0 HH22 ARG B1914 14.114 -5.692 -0.349 1.00 0.00 H new ATOM 2555 N ALA B1915 17.469 1.149 0.215 1.00 0.00 N ATOM 2556 CA ALA B1915 16.598 2.181 0.770 1.00 0.00 C ATOM 2557 C ALA B1915 16.828 3.561 0.135 1.00 0.00 C ATOM 2558 O ALA B1915 15.875 4.301 -0.114 1.00 0.00 O ATOM 2559 CB ALA B1915 16.818 2.201 2.283 1.00 0.00 C ATOM 0 H ALA B1915 18.087 0.727 0.908 1.00 0.00 H new ATOM 0 HA ALA B1915 15.559 1.942 0.541 1.00 0.00 H new ATOM 0 HB1 ALA B1915 16.181 2.963 2.733 1.00 0.00 H new ATOM 0 HB2 ALA B1915 16.567 1.226 2.700 1.00 0.00 H new ATOM 0 HB3 ALA B1915 17.862 2.429 2.496 1.00 0.00 H new ATOM 2565 N TYR B1916 18.076 3.883 -0.198 1.00 0.00 N ATOM 2566 CA TYR B1916 18.431 5.135 -0.842 1.00 0.00 C ATOM 2567 C TYR B1916 17.845 5.239 -2.251 1.00 0.00 C ATOM 2568 O TYR B1916 17.131 6.194 -2.554 1.00 0.00 O ATOM 2569 CB TYR B1916 19.955 5.303 -0.845 1.00 0.00 C ATOM 2570 CG TYR B1916 20.369 6.606 -1.479 1.00 0.00 C ATOM 2571 CD1 TYR B1916 21.236 6.634 -2.590 1.00 0.00 C ATOM 2572 CD2 TYR B1916 19.822 7.801 -0.972 1.00 0.00 C ATOM 2573 CE1 TYR B1916 21.547 7.861 -3.189 1.00 0.00 C ATOM 2574 CE2 TYR B1916 20.117 9.025 -1.587 1.00 0.00 C ATOM 2575 CZ TYR B1916 20.971 9.050 -2.705 1.00 0.00 C ATOM 2576 OH TYR B1916 21.240 10.213 -3.331 1.00 0.00 O ATOM 0 H TYR B1916 18.874 3.272 -0.024 1.00 0.00 H new ATOM 0 HA TYR B1916 17.993 5.953 -0.269 1.00 0.00 H new ATOM 0 HB2 TYR B1916 20.328 5.261 0.178 1.00 0.00 H new ATOM 0 HB3 TYR B1916 20.412 4.474 -1.385 1.00 0.00 H new ATOM 0 HD1 TYR B1916 21.657 5.717 -2.976 1.00 0.00 H new ATOM 0 HD2 TYR B1916 19.174 7.774 -0.108 1.00 0.00 H new ATOM 0 HE1 TYR B1916 22.231 7.895 -4.024 1.00 0.00 H new ATOM 0 HE2 TYR B1916 19.692 9.942 -1.206 1.00 0.00 H new ATOM 0 HH TYR B1916 22.158 10.195 -3.674 1.00 0.00 H new ATOM 2586 N ARG B1917 18.046 4.218 -3.094 1.00 0.00 N ATOM 2587 CA ARG B1917 17.411 4.154 -4.420 1.00 0.00 C ATOM 2588 C ARG B1917 15.883 4.077 -4.326 1.00 0.00 C ATOM 2589 O ARG B1917 15.202 4.674 -5.158 1.00 0.00 O ATOM 2590 CB ARG B1917 17.919 2.905 -5.167 1.00 0.00 C ATOM 2591 CG ARG B1917 19.368 2.979 -5.678 1.00 0.00 C ATOM 2592 CD ARG B1917 19.603 4.024 -6.776 1.00 0.00 C ATOM 2593 NE ARG B1917 18.663 3.885 -7.909 1.00 0.00 N ATOM 2594 CZ ARG B1917 18.670 4.578 -9.034 1.00 0.00 C ATOM 2595 NH1 ARG B1917 19.600 5.439 -9.322 1.00 0.00 N1+ ATOM 2596 NH2 ARG B1917 17.720 4.412 -9.910 1.00 0.00 N ATOM 0 H ARG B1917 18.646 3.421 -2.881 1.00 0.00 H new ATOM 0 HA ARG B1917 17.674 5.067 -4.954 1.00 0.00 H new ATOM 0 HB2 ARG B1917 17.831 2.045 -4.503 1.00 0.00 H new ATOM 0 HB3 ARG B1917 17.262 2.720 -6.017 1.00 0.00 H new ATOM 0 HG2 ARG B1917 20.025 3.200 -4.837 1.00 0.00 H new ATOM 0 HG3 ARG B1917 19.656 1.999 -6.059 1.00 0.00 H new ATOM 0 HD2 ARG B1917 19.505 5.022 -6.349 1.00 0.00 H new ATOM 0 HD3 ARG B1917 20.625 3.934 -7.144 1.00 0.00 H new ATOM 0 HE ARG B1917 17.932 3.180 -7.812 1.00 0.00 H new ATOM 0 HH11 ARG B1917 20.365 5.602 -8.667 1.00 0.00 H new ATOM 0 HH12 ARG B1917 19.565 5.952 -10.203 1.00 0.00 H new ATOM 0 HH21 ARG B1917 16.969 3.746 -9.728 1.00 0.00 H new ATOM 0 HH22 ARG B1917 17.727 4.948 -10.778 1.00 0.00 H new ATOM 2610 N ARG B1918 15.333 3.411 -3.300 1.00 0.00 N ATOM 2611 CA ARG B1918 13.887 3.401 -3.001 1.00 0.00 C ATOM 2612 C ARG B1918 13.368 4.826 -2.823 1.00 0.00 C ATOM 2613 O ARG B1918 12.364 5.189 -3.431 1.00 0.00 O ATOM 2614 CB ARG B1918 13.608 2.557 -1.739 1.00 0.00 C ATOM 2615 CG ARG B1918 12.184 1.992 -1.676 1.00 0.00 C ATOM 2616 CD ARG B1918 12.060 0.698 -2.486 1.00 0.00 C ATOM 2617 NE ARG B1918 12.837 -0.398 -1.876 1.00 0.00 N ATOM 2618 CZ ARG B1918 12.887 -1.660 -2.249 1.00 0.00 C ATOM 2619 NH1 ARG B1918 12.228 -2.141 -3.261 1.00 0.00 N1+ ATOM 2620 NH2 ARG B1918 13.619 -2.504 -1.599 1.00 0.00 N ATOM 0 H ARG B1918 15.884 2.856 -2.645 1.00 0.00 H new ATOM 0 HA ARG B1918 13.360 2.949 -3.841 1.00 0.00 H new ATOM 0 HB2 ARG B1918 14.319 1.731 -1.701 1.00 0.00 H new ATOM 0 HB3 ARG B1918 13.785 3.171 -0.856 1.00 0.00 H new ATOM 0 HG2 ARG B1918 11.912 1.801 -0.638 1.00 0.00 H new ATOM 0 HG3 ARG B1918 11.480 2.731 -2.058 1.00 0.00 H new ATOM 0 HD2 ARG B1918 11.011 0.409 -2.553 1.00 0.00 H new ATOM 0 HD3 ARG B1918 12.409 0.870 -3.504 1.00 0.00 H new ATOM 0 HE ARG B1918 13.405 -0.148 -1.066 1.00 0.00 H new ATOM 0 HH11 ARG B1918 11.630 -1.530 -3.817 1.00 0.00 H new ATOM 0 HH12 ARG B1918 12.309 -3.129 -3.499 1.00 0.00 H new ATOM 0 HH21 ARG B1918 14.162 -2.194 -0.793 1.00 0.00 H new ATOM 0 HH22 ARG B1918 13.654 -3.480 -1.892 1.00 0.00 H new ATOM 2634 N TYR B1919 14.085 5.654 -2.063 1.00 0.00 N ATOM 2635 CA TYR B1919 13.782 7.074 -1.899 1.00 0.00 C ATOM 2636 C TYR B1919 13.972 7.879 -3.200 1.00 0.00 C ATOM 2637 O TYR B1919 13.115 8.694 -3.539 1.00 0.00 O ATOM 2638 CB TYR B1919 14.616 7.642 -0.747 1.00 0.00 C ATOM 2639 CG TYR B1919 14.340 9.099 -0.448 1.00 0.00 C ATOM 2640 CD1 TYR B1919 13.307 9.454 0.442 1.00 0.00 C ATOM 2641 CD2 TYR B1919 15.118 10.095 -1.065 1.00 0.00 C ATOM 2642 CE1 TYR B1919 13.061 10.809 0.730 1.00 0.00 C ATOM 2643 CE2 TYR B1919 14.863 11.451 -0.790 1.00 0.00 C ATOM 2644 CZ TYR B1919 13.841 11.814 0.115 1.00 0.00 C ATOM 2645 OH TYR B1919 13.602 13.123 0.399 1.00 0.00 O ATOM 0 H TYR B1919 14.905 5.352 -1.537 1.00 0.00 H new ATOM 0 HA TYR B1919 12.724 7.169 -1.653 1.00 0.00 H new ATOM 0 HB2 TYR B1919 14.424 7.055 0.151 1.00 0.00 H new ATOM 0 HB3 TYR B1919 15.673 7.524 -0.985 1.00 0.00 H new ATOM 0 HD1 TYR B1919 12.704 8.686 0.903 1.00 0.00 H new ATOM 0 HD2 TYR B1919 15.908 9.820 -1.748 1.00 0.00 H new ATOM 0 HE1 TYR B1919 12.276 11.081 1.421 1.00 0.00 H new ATOM 0 HE2 TYR B1919 15.451 12.217 -1.273 1.00 0.00 H new ATOM 0 HH TYR B1919 13.910 13.322 1.308 1.00 0.00 H new ATOM 2655 N LEU B1920 15.029 7.613 -3.982 1.00 0.00 N ATOM 2656 CA LEU B1920 15.245 8.261 -5.288 1.00 0.00 C ATOM 2657 C LEU B1920 14.082 8.009 -6.269 1.00 0.00 C ATOM 2658 O LEU B1920 13.695 8.916 -7.008 1.00 0.00 O ATOM 2659 CB LEU B1920 16.579 7.809 -5.927 1.00 0.00 C ATOM 2660 CG LEU B1920 17.906 8.179 -5.224 1.00 0.00 C ATOM 2661 CD1 LEU B1920 19.058 8.192 -6.230 1.00 0.00 C ATOM 2662 CD2 LEU B1920 17.834 9.523 -4.535 1.00 0.00 C ATOM 0 H LEU B1920 15.757 6.945 -3.729 1.00 0.00 H new ATOM 0 HA LEU B1920 15.291 9.332 -5.093 1.00 0.00 H new ATOM 0 HB2 LEU B1920 16.548 6.724 -6.023 1.00 0.00 H new ATOM 0 HB3 LEU B1920 16.616 8.217 -6.937 1.00 0.00 H new ATOM 0 HG LEU B1920 18.082 7.418 -4.464 1.00 0.00 H new ATOM 0 HD11 LEU B1920 19.984 8.454 -5.719 1.00 0.00 H new ATOM 0 HD12 LEU B1920 19.159 7.205 -6.680 1.00 0.00 H new ATOM 0 HD13 LEU B1920 18.853 8.927 -7.009 1.00 0.00 H new ATOM 0 HD21 LEU B1920 18.789 9.738 -4.056 1.00 0.00 H new ATOM 0 HD22 LEU B1920 17.614 10.297 -5.270 1.00 0.00 H new ATOM 0 HD23 LEU B1920 17.047 9.504 -3.781 1.00 0.00 H new