USER MOD reduce.3.24.130724 H: found=0, std=0, add=825, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 825 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 Single : A 688 GLN : amide:sc= -1.96 K(o=-2,f=-0.45) USER MOD Single : A 691 TYR OH : rot 180:sc= 0 USER MOD Single : A 698 GLN : amide:sc= 0.476 K(o=0.48,f=-2.3) USER MOD Single : A 699 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 702 MET CE :methyl 151:sc= -4.24 (180deg=-9.2!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -162:sc= 1.31 (180deg=0.397) USER MOD Single : B 2 GLN : amide:sc= -0.31 K(o=-0.31,f=-0.99) USER MOD Single : B 6 LYS NZ :NH3+ -166:sc= 1.27 (180deg=1.19) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0.031 USER MOD Single : B 9 THR OG1 : rot 180:sc=-0.00119 USER MOD Single : B 11 LYS NZ :NH3+ -113:sc= 0.376 (180deg=-0.257) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc=-0.00329 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= -0.113 USER MOD Single : B 25 ASN : amide:sc= -2.24! C(o=-2.2!,f=-3.9!) USER MOD Single : B 27 LYS NZ :NH3+ 168:sc= 1.11 (180deg=1.02) USER MOD Single : B 29 LYS NZ :NH3+ -151:sc= 1.29 (180deg=1.02) USER MOD Single : B 31 GLN : amide:sc= -0.47 K(o=-0.47,f=-1.5) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= 0.617 K(o=0.62,f=-0.063) USER MOD Single : B 41 GLN : amide:sc= -0.122 K(o=-0.12,f=-3.3!) USER MOD Single : B 48 LYS NZ :NH3+ -162:sc= -0.0195 (180deg=-0.232) USER MOD Single : B 49 GLN : amide:sc= -3.47! C(o=-3.5!,f=-3.4!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 150:sc= -2.56 USER MOD Single : B 60 ASN : amide:sc= -0.198 X(o=-0.2,f=-0.39) USER MOD Single : B 62 GLN : amide:sc= 0.996 K(o=1,f=-0.15) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -139:sc= 0.97 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -1.19 K(o=-1.2,f=-0.26) USER MOD ----------------------------------------------------------------- ATOM 63 N LEU A 679 18.552 -2.382 4.862 1.00 0.00 N ATOM 64 CA LEU A 679 17.278 -2.778 4.308 1.00 0.00 C ATOM 65 C LEU A 679 17.413 -3.059 2.801 1.00 0.00 C ATOM 66 O LEU A 679 18.481 -2.824 2.234 1.00 0.00 O ATOM 67 CB LEU A 679 16.263 -1.677 4.635 1.00 0.00 C ATOM 68 CG LEU A 679 16.444 -1.072 6.035 1.00 0.00 C ATOM 69 CD1 LEU A 679 15.338 -0.056 6.279 1.00 0.00 C ATOM 70 CD2 LEU A 679 16.359 -2.145 7.120 1.00 0.00 C ATOM 0 HA LEU A 679 16.924 -3.710 4.748 1.00 0.00 H new ATOM 0 HB2 LEU A 679 16.347 -0.884 3.892 1.00 0.00 H new ATOM 0 HB3 LEU A 679 15.256 -2.086 4.552 1.00 0.00 H new ATOM 0 HG LEU A 679 17.427 -0.604 6.080 1.00 0.00 H new ATOM 0 HD11 LEU A 679 15.457 0.380 7.271 1.00 0.00 H new ATOM 0 HD12 LEU A 679 15.395 0.731 5.527 1.00 0.00 H new ATOM 0 HD13 LEU A 679 14.369 -0.551 6.214 1.00 0.00 H new ATOM 0 HD21 LEU A 679 16.491 -1.684 8.099 1.00 0.00 H new ATOM 0 HD22 LEU A 679 15.384 -2.630 7.076 1.00 0.00 H new ATOM 0 HD23 LEU A 679 17.141 -2.887 6.960 1.00 0.00 H new ATOM 82 N PRO A 680 16.353 -3.557 2.146 1.00 0.00 N ATOM 83 CA PRO A 680 16.326 -3.976 0.746 1.00 0.00 C ATOM 84 C PRO A 680 16.668 -2.901 -0.285 1.00 0.00 C ATOM 85 O PRO A 680 16.434 -3.100 -1.476 1.00 0.00 O ATOM 86 CB PRO A 680 14.911 -4.511 0.508 1.00 0.00 C ATOM 87 CG PRO A 680 14.410 -4.871 1.903 1.00 0.00 C ATOM 88 CD PRO A 680 15.065 -3.796 2.761 1.00 0.00 C ATOM 0 HA PRO A 680 17.113 -4.716 0.598 1.00 0.00 H new ATOM 0 HB2 PRO A 680 14.275 -3.761 0.037 1.00 0.00 H new ATOM 0 HB3 PRO A 680 14.919 -5.380 -0.149 1.00 0.00 H new ATOM 0 HG2 PRO A 680 13.322 -4.838 1.967 1.00 0.00 H new ATOM 0 HG3 PRO A 680 14.717 -5.874 2.201 1.00 0.00 H new ATOM 0 HD2 PRO A 680 14.463 -2.887 2.782 1.00 0.00 H new ATOM 0 HD3 PRO A 680 15.176 -4.129 3.793 1.00 0.00 H new ATOM 96 N PHE A 681 17.211 -1.766 0.153 1.00 0.00 N ATOM 97 CA PHE A 681 17.580 -0.652 -0.713 1.00 0.00 C ATOM 98 C PHE A 681 18.759 -1.034 -1.618 1.00 0.00 C ATOM 99 O PHE A 681 19.447 -2.021 -1.353 1.00 0.00 O ATOM 100 CB PHE A 681 18.002 0.529 0.168 1.00 0.00 C ATOM 101 CG PHE A 681 16.906 1.186 0.982 1.00 0.00 C ATOM 102 CD1 PHE A 681 15.606 0.659 1.022 1.00 0.00 C ATOM 103 CD2 PHE A 681 17.200 2.354 1.705 1.00 0.00 C ATOM 104 CE1 PHE A 681 14.619 1.291 1.786 1.00 0.00 C ATOM 105 CE2 PHE A 681 16.207 2.987 2.465 1.00 0.00 C ATOM 106 CZ PHE A 681 14.913 2.452 2.510 1.00 0.00 C ATOM 0 H PHE A 681 17.410 -1.594 1.139 1.00 0.00 H new ATOM 0 HA PHE A 681 16.726 -0.390 -1.338 1.00 0.00 H new ATOM 0 HB2 PHE A 681 18.777 0.185 0.853 1.00 0.00 H new ATOM 0 HB3 PHE A 681 18.455 1.287 -0.471 1.00 0.00 H new ATOM 0 HD1 PHE A 681 15.368 -0.234 0.463 1.00 0.00 H new ATOM 0 HD2 PHE A 681 18.198 2.767 1.675 1.00 0.00 H new ATOM 0 HE1 PHE A 681 13.621 0.879 1.817 1.00 0.00 H new ATOM 0 HE2 PHE A 681 16.439 3.887 3.016 1.00 0.00 H new ATOM 0 HZ PHE A 681 14.147 2.933 3.100 1.00 0.00 H new ATOM 116 N PRO A 682 19.010 -0.261 -2.687 1.00 0.00 N ATOM 117 CA PRO A 682 18.177 0.823 -3.190 1.00 0.00 C ATOM 118 C PRO A 682 17.054 0.436 -4.173 1.00 0.00 C ATOM 119 O PRO A 682 16.254 1.315 -4.482 1.00 0.00 O ATOM 120 CB PRO A 682 19.171 1.715 -3.927 1.00 0.00 C ATOM 121 CG PRO A 682 20.117 0.695 -4.559 1.00 0.00 C ATOM 122 CD PRO A 682 20.222 -0.380 -3.478 1.00 0.00 C ATOM 0 HA PRO A 682 17.641 1.267 -2.351 1.00 0.00 H new ATOM 0 HB2 PRO A 682 18.682 2.336 -4.678 1.00 0.00 H new ATOM 0 HB3 PRO A 682 19.694 2.389 -3.248 1.00 0.00 H new ATOM 0 HG2 PRO A 682 19.717 0.295 -5.491 1.00 0.00 H new ATOM 0 HG3 PRO A 682 21.088 1.133 -4.791 1.00 0.00 H new ATOM 0 HD2 PRO A 682 20.305 -1.373 -3.920 1.00 0.00 H new ATOM 0 HD3 PRO A 682 21.108 -0.230 -2.861 1.00 0.00 H new ATOM 130 N PRO A 683 16.926 -0.802 -4.695 1.00 0.00 N ATOM 131 CA PRO A 683 15.943 -1.076 -5.727 1.00 0.00 C ATOM 132 C PRO A 683 14.523 -1.178 -5.173 1.00 0.00 C ATOM 133 O PRO A 683 14.309 -1.216 -3.962 1.00 0.00 O ATOM 134 CB PRO A 683 16.369 -2.408 -6.342 1.00 0.00 C ATOM 135 CG PRO A 683 16.968 -3.138 -5.146 1.00 0.00 C ATOM 136 CD PRO A 683 17.681 -2.009 -4.408 1.00 0.00 C ATOM 0 HA PRO A 683 15.914 -0.264 -6.454 1.00 0.00 H new ATOM 0 HB2 PRO A 683 15.524 -2.949 -6.767 1.00 0.00 H new ATOM 0 HB3 PRO A 683 17.096 -2.273 -7.142 1.00 0.00 H new ATOM 0 HG2 PRO A 683 16.202 -3.608 -4.530 1.00 0.00 H new ATOM 0 HG3 PRO A 683 17.658 -3.925 -5.452 1.00 0.00 H new ATOM 0 HD2 PRO A 683 17.713 -2.203 -3.336 1.00 0.00 H new ATOM 0 HD3 PRO A 683 18.713 -1.913 -4.746 1.00 0.00 H new ATOM 144 N ASP A 684 13.561 -1.230 -6.104 1.00 0.00 N ATOM 145 CA ASP A 684 12.125 -1.402 -5.898 1.00 0.00 C ATOM 146 C ASP A 684 11.427 -0.334 -5.048 1.00 0.00 C ATOM 147 O ASP A 684 10.218 -0.171 -5.196 1.00 0.00 O ATOM 148 CB ASP A 684 11.850 -2.800 -5.341 1.00 0.00 C ATOM 149 CG ASP A 684 12.378 -3.889 -6.271 1.00 0.00 C ATOM 150 OD1 ASP A 684 11.870 -3.976 -7.413 1.00 0.00 O ATOM 151 OD2 ASP A 684 13.289 -4.628 -5.834 1.00 0.00 O ATOM 0 H ASP A 684 13.789 -1.146 -7.095 1.00 0.00 H new ATOM 0 HA ASP A 684 11.683 -1.276 -6.886 1.00 0.00 H new ATOM 0 HB2 ASP A 684 12.316 -2.900 -4.361 1.00 0.00 H new ATOM 0 HB3 ASP A 684 10.777 -2.931 -5.198 1.00 0.00 H new ATOM 156 N ILE A 685 12.132 0.394 -4.176 1.00 0.00 N ATOM 157 CA ILE A 685 11.520 1.420 -3.337 1.00 0.00 C ATOM 158 C ILE A 685 12.508 2.501 -2.918 1.00 0.00 C ATOM 159 O ILE A 685 13.714 2.389 -3.128 1.00 0.00 O ATOM 160 CB ILE A 685 10.877 0.809 -2.076 1.00 0.00 C ATOM 161 CG1 ILE A 685 11.616 -0.409 -1.500 1.00 0.00 C ATOM 162 CG2 ILE A 685 9.426 0.442 -2.362 1.00 0.00 C ATOM 163 CD1 ILE A 685 12.920 0.002 -0.825 1.00 0.00 C ATOM 0 H ILE A 685 13.137 0.287 -4.035 1.00 0.00 H new ATOM 0 HA ILE A 685 10.748 1.882 -3.952 1.00 0.00 H new ATOM 0 HB ILE A 685 10.943 1.582 -1.311 1.00 0.00 H new ATOM 0 HG12 ILE A 685 10.976 -0.918 -0.779 1.00 0.00 H new ATOM 0 HG13 ILE A 685 11.826 -1.121 -2.298 1.00 0.00 H new ATOM 0 HG21 ILE A 685 8.977 0.011 -1.467 1.00 0.00 H new ATOM 0 HG22 ILE A 685 8.874 1.337 -2.650 1.00 0.00 H new ATOM 0 HG23 ILE A 685 9.388 -0.285 -3.174 1.00 0.00 H new ATOM 0 HD11 ILE A 685 13.419 -0.882 -0.428 1.00 0.00 H new ATOM 0 HD12 ILE A 685 13.569 0.488 -1.553 1.00 0.00 H new ATOM 0 HD13 ILE A 685 12.706 0.694 -0.011 1.00 0.00 H new ATOM 175 N ASP A 686 11.958 3.557 -2.312 1.00 0.00 N ATOM 176 CA ASP A 686 12.691 4.687 -1.770 1.00 0.00 C ATOM 177 C ASP A 686 11.956 5.145 -0.510 1.00 0.00 C ATOM 178 O ASP A 686 10.727 5.242 -0.519 1.00 0.00 O ATOM 179 CB ASP A 686 12.720 5.809 -2.807 1.00 0.00 C ATOM 180 CG ASP A 686 13.448 5.394 -4.080 1.00 0.00 C ATOM 181 OD1 ASP A 686 14.697 5.439 -4.066 1.00 0.00 O ATOM 182 OD2 ASP A 686 12.749 5.039 -5.057 1.00 0.00 O ATOM 0 H ASP A 686 10.950 3.644 -2.184 1.00 0.00 H new ATOM 0 HA ASP A 686 13.718 4.415 -1.528 1.00 0.00 H new ATOM 0 HB2 ASP A 686 11.699 6.102 -3.053 1.00 0.00 H new ATOM 0 HB3 ASP A 686 13.208 6.685 -2.380 1.00 0.00 H new ATOM 187 N PRO A 687 12.674 5.427 0.586 1.00 0.00 N ATOM 188 CA PRO A 687 12.059 5.794 1.853 1.00 0.00 C ATOM 189 C PRO A 687 11.312 7.113 1.741 1.00 0.00 C ATOM 190 O PRO A 687 10.380 7.375 2.492 1.00 0.00 O ATOM 191 CB PRO A 687 13.205 5.866 2.863 1.00 0.00 C ATOM 192 CG PRO A 687 14.447 6.092 2.004 1.00 0.00 C ATOM 193 CD PRO A 687 14.119 5.403 0.681 1.00 0.00 C ATOM 0 HA PRO A 687 11.311 5.065 2.165 1.00 0.00 H new ATOM 0 HB2 PRO A 687 13.059 6.679 3.574 1.00 0.00 H new ATOM 0 HB3 PRO A 687 13.284 4.946 3.443 1.00 0.00 H new ATOM 0 HG2 PRO A 687 14.644 7.154 1.861 1.00 0.00 H new ATOM 0 HG3 PRO A 687 15.335 5.662 2.467 1.00 0.00 H new ATOM 0 HD2 PRO A 687 14.577 5.925 -0.159 1.00 0.00 H new ATOM 0 HD3 PRO A 687 14.497 4.381 0.665 1.00 0.00 H new ATOM 201 N GLN A 688 11.725 7.946 0.788 1.00 0.00 N ATOM 202 CA GLN A 688 11.080 9.213 0.487 1.00 0.00 C ATOM 203 C GLN A 688 9.738 9.010 -0.218 1.00 0.00 C ATOM 204 O GLN A 688 9.121 9.990 -0.629 1.00 0.00 O ATOM 205 CB GLN A 688 12.022 10.046 -0.391 1.00 0.00 C ATOM 206 CG GLN A 688 12.599 9.191 -1.525 1.00 0.00 C ATOM 207 CD GLN A 688 14.103 8.990 -1.396 1.00 0.00 C ATOM 208 OE1 GLN A 688 14.835 9.098 -2.377 1.00 0.00 O ATOM 209 NE2 GLN A 688 14.584 8.695 -0.194 1.00 0.00 N ATOM 0 H GLN A 688 12.532 7.752 0.195 1.00 0.00 H new ATOM 0 HA GLN A 688 10.876 9.735 1.422 1.00 0.00 H new ATOM 0 HB2 GLN A 688 11.482 10.896 -0.808 1.00 0.00 H new ATOM 0 HB3 GLN A 688 12.832 10.449 0.216 1.00 0.00 H new ATOM 0 HG2 GLN A 688 12.105 8.219 -1.531 1.00 0.00 H new ATOM 0 HG3 GLN A 688 12.380 9.666 -2.481 1.00 0.00 H new ATOM 0 HE21 GLN A 688 13.952 8.612 0.602 1.00 0.00 H new ATOM 0 HE22 GLN A 688 15.586 8.552 -0.067 1.00 0.00 H new ATOM 218 N VAL A 689 9.271 7.762 -0.365 1.00 0.00 N ATOM 219 CA VAL A 689 8.009 7.490 -1.029 1.00 0.00 C ATOM 220 C VAL A 689 7.144 6.572 -0.164 1.00 0.00 C ATOM 221 O VAL A 689 5.963 6.398 -0.451 1.00 0.00 O ATOM 222 CB VAL A 689 8.268 6.886 -2.415 1.00 0.00 C ATOM 223 CG1 VAL A 689 6.973 6.835 -3.217 1.00 0.00 C ATOM 224 CG2 VAL A 689 9.259 7.734 -3.213 1.00 0.00 C ATOM 0 H VAL A 689 9.757 6.930 -0.029 1.00 0.00 H new ATOM 0 HA VAL A 689 7.462 8.423 -1.167 1.00 0.00 H new ATOM 0 HB VAL A 689 8.673 5.886 -2.257 1.00 0.00 H new ATOM 0 HG11 VAL A 689 7.170 6.404 -4.199 1.00 0.00 H new ATOM 0 HG12 VAL A 689 6.243 6.220 -2.691 1.00 0.00 H new ATOM 0 HG13 VAL A 689 6.579 7.844 -3.336 1.00 0.00 H new ATOM 0 HG21 VAL A 689 9.422 7.280 -4.190 1.00 0.00 H new ATOM 0 HG22 VAL A 689 8.857 8.739 -3.342 1.00 0.00 H new ATOM 0 HG23 VAL A 689 10.206 7.789 -2.676 1.00 0.00 H new ATOM 234 N PHE A 690 7.715 5.985 0.897 1.00 0.00 N ATOM 235 CA PHE A 690 6.933 5.176 1.818 1.00 0.00 C ATOM 236 C PHE A 690 6.935 5.740 3.240 1.00 0.00 C ATOM 237 O PHE A 690 6.125 5.313 4.053 1.00 0.00 O ATOM 238 CB PHE A 690 7.380 3.715 1.747 1.00 0.00 C ATOM 239 CG PHE A 690 8.514 3.313 2.667 1.00 0.00 C ATOM 240 CD1 PHE A 690 8.254 2.985 4.006 1.00 0.00 C ATOM 241 CD2 PHE A 690 9.822 3.250 2.174 1.00 0.00 C ATOM 242 CE1 PHE A 690 9.304 2.599 4.851 1.00 0.00 C ATOM 243 CE2 PHE A 690 10.873 2.879 3.021 1.00 0.00 C ATOM 244 CZ PHE A 690 10.615 2.559 4.358 1.00 0.00 C ATOM 0 H PHE A 690 8.705 6.059 1.130 1.00 0.00 H new ATOM 0 HA PHE A 690 5.890 5.214 1.505 1.00 0.00 H new ATOM 0 HB2 PHE A 690 6.520 3.083 1.969 1.00 0.00 H new ATOM 0 HB3 PHE A 690 7.679 3.498 0.721 1.00 0.00 H new ATOM 0 HD1 PHE A 690 7.244 3.030 4.386 1.00 0.00 H new ATOM 0 HD2 PHE A 690 10.021 3.488 1.139 1.00 0.00 H new ATOM 0 HE1 PHE A 690 9.103 2.333 5.878 1.00 0.00 H new ATOM 0 HE2 PHE A 690 11.884 2.840 2.642 1.00 0.00 H new ATOM 0 HZ PHE A 690 11.428 2.280 5.012 1.00 0.00 H new ATOM 254 N TYR A 691 7.819 6.689 3.563 1.00 0.00 N ATOM 255 CA TYR A 691 7.721 7.426 4.816 1.00 0.00 C ATOM 256 C TYR A 691 6.612 8.479 4.739 1.00 0.00 C ATOM 257 O TYR A 691 6.314 9.134 5.738 1.00 0.00 O ATOM 258 CB TYR A 691 9.060 8.084 5.151 1.00 0.00 C ATOM 259 CG TYR A 691 10.152 7.136 5.608 1.00 0.00 C ATOM 260 CD1 TYR A 691 9.849 5.839 6.057 1.00 0.00 C ATOM 261 CD2 TYR A 691 11.485 7.575 5.599 1.00 0.00 C ATOM 262 CE1 TYR A 691 10.864 4.997 6.520 1.00 0.00 C ATOM 263 CE2 TYR A 691 12.510 6.734 6.058 1.00 0.00 C ATOM 264 CZ TYR A 691 12.203 5.440 6.524 1.00 0.00 C ATOM 265 OH TYR A 691 13.192 4.619 6.978 1.00 0.00 O ATOM 0 H TYR A 691 8.606 6.961 2.973 1.00 0.00 H new ATOM 0 HA TYR A 691 7.470 6.723 5.610 1.00 0.00 H new ATOM 0 HB2 TYR A 691 9.413 8.621 4.270 1.00 0.00 H new ATOM 0 HB3 TYR A 691 8.896 8.826 5.932 1.00 0.00 H new ATOM 0 HD1 TYR A 691 8.827 5.491 6.044 1.00 0.00 H new ATOM 0 HD2 TYR A 691 11.723 8.564 5.237 1.00 0.00 H new ATOM 0 HE1 TYR A 691 10.623 4.006 6.875 1.00 0.00 H new ATOM 0 HE2 TYR A 691 13.534 7.078 6.054 1.00 0.00 H new ATOM 0 HH TYR A 691 14.055 5.078 6.911 1.00 0.00 H new ATOM 275 N GLU A 692 5.997 8.652 3.561 1.00 0.00 N ATOM 276 CA GLU A 692 4.858 9.543 3.351 1.00 0.00 C ATOM 277 C GLU A 692 3.573 8.955 3.954 1.00 0.00 C ATOM 278 O GLU A 692 2.503 9.030 3.352 1.00 0.00 O ATOM 279 CB GLU A 692 4.676 9.801 1.851 1.00 0.00 C ATOM 280 CG GLU A 692 5.918 10.463 1.256 1.00 0.00 C ATOM 281 CD GLU A 692 5.657 10.925 -0.176 1.00 0.00 C ATOM 282 OE1 GLU A 692 5.430 10.046 -1.037 1.00 0.00 O ATOM 283 OE2 GLU A 692 5.686 12.155 -0.403 1.00 0.00 O ATOM 0 H GLU A 692 6.287 8.165 2.713 1.00 0.00 H new ATOM 0 HA GLU A 692 5.059 10.487 3.858 1.00 0.00 H new ATOM 0 HB2 GLU A 692 4.480 8.860 1.337 1.00 0.00 H new ATOM 0 HB3 GLU A 692 3.807 10.439 1.691 1.00 0.00 H new ATOM 0 HG2 GLU A 692 6.210 11.315 1.870 1.00 0.00 H new ATOM 0 HG3 GLU A 692 6.751 9.760 1.269 1.00 0.00 H new ATOM 290 N LEU A 693 3.683 8.364 5.147 1.00 0.00 N ATOM 291 CA LEU A 693 2.639 7.589 5.795 1.00 0.00 C ATOM 292 C LEU A 693 2.677 7.808 7.304 1.00 0.00 C ATOM 293 O LEU A 693 3.606 8.424 7.820 1.00 0.00 O ATOM 294 CB LEU A 693 2.975 6.104 5.596 1.00 0.00 C ATOM 295 CG LEU A 693 3.033 5.609 4.154 1.00 0.00 C ATOM 296 CD1 LEU A 693 3.448 4.138 4.210 1.00 0.00 C ATOM 297 CD2 LEU A 693 1.673 5.720 3.478 1.00 0.00 C ATOM 0 H LEU A 693 4.536 8.418 5.703 1.00 0.00 H new ATOM 0 HA LEU A 693 1.674 7.880 5.380 1.00 0.00 H new ATOM 0 HB2 LEU A 693 3.939 5.906 6.064 1.00 0.00 H new ATOM 0 HB3 LEU A 693 2.233 5.511 6.131 1.00 0.00 H new ATOM 0 HG LEU A 693 3.737 6.211 3.580 1.00 0.00 H new ATOM 0 HD11 LEU A 693 3.504 3.737 3.198 1.00 0.00 H new ATOM 0 HD12 LEU A 693 4.424 4.053 4.688 1.00 0.00 H new ATOM 0 HD13 LEU A 693 2.713 3.574 4.784 1.00 0.00 H new ATOM 0 HD21 LEU A 693 1.746 5.360 2.452 1.00 0.00 H new ATOM 0 HD22 LEU A 693 0.946 5.118 4.023 1.00 0.00 H new ATOM 0 HD23 LEU A 693 1.352 6.762 3.475 1.00 0.00 H new ATOM 309 N PRO A 694 1.673 7.304 8.027 1.00 0.00 N ATOM 310 CA PRO A 694 1.755 7.101 9.460 1.00 0.00 C ATOM 311 C PRO A 694 2.645 5.889 9.674 1.00 0.00 C ATOM 312 O PRO A 694 2.684 4.980 8.842 1.00 0.00 O ATOM 313 CB PRO A 694 0.318 6.848 9.911 1.00 0.00 C ATOM 314 CG PRO A 694 -0.319 6.200 8.682 1.00 0.00 C ATOM 315 CD PRO A 694 0.388 6.881 7.511 1.00 0.00 C ATOM 0 HA PRO A 694 2.173 7.937 10.021 1.00 0.00 H new ATOM 0 HB2 PRO A 694 0.277 6.191 10.780 1.00 0.00 H new ATOM 0 HB3 PRO A 694 -0.187 7.774 10.187 1.00 0.00 H new ATOM 0 HG2 PRO A 694 -0.164 5.121 8.672 1.00 0.00 H new ATOM 0 HG3 PRO A 694 -1.396 6.368 8.653 1.00 0.00 H new ATOM 0 HD2 PRO A 694 0.508 6.195 6.673 1.00 0.00 H new ATOM 0 HD3 PRO A 694 -0.188 7.732 7.146 1.00 0.00 H new ATOM 323 N GLU A 695 3.363 5.871 10.795 1.00 0.00 N ATOM 324 CA GLU A 695 4.229 4.788 11.175 1.00 0.00 C ATOM 325 C GLU A 695 3.548 3.450 10.952 1.00 0.00 C ATOM 326 O GLU A 695 4.185 2.505 10.521 1.00 0.00 O ATOM 327 CB GLU A 695 4.519 4.980 12.656 1.00 0.00 C ATOM 328 CG GLU A 695 6.020 4.936 12.899 1.00 0.00 C ATOM 329 CD GLU A 695 6.349 4.869 14.388 1.00 0.00 C ATOM 330 OE1 GLU A 695 6.365 5.945 15.024 1.00 0.00 O ATOM 331 OE2 GLU A 695 6.581 3.741 14.877 1.00 0.00 O ATOM 0 H GLU A 695 3.349 6.634 11.472 1.00 0.00 H new ATOM 0 HA GLU A 695 5.141 4.790 10.579 1.00 0.00 H new ATOM 0 HB2 GLU A 695 4.115 5.934 12.994 1.00 0.00 H new ATOM 0 HB3 GLU A 695 4.025 4.201 13.236 1.00 0.00 H new ATOM 0 HG2 GLU A 695 6.445 4.069 12.393 1.00 0.00 H new ATOM 0 HG3 GLU A 695 6.485 5.820 12.463 1.00 0.00 H new ATOM 338 N GLU A 696 2.254 3.381 11.249 1.00 0.00 N ATOM 339 CA GLU A 696 1.400 2.217 11.155 1.00 0.00 C ATOM 340 C GLU A 696 1.544 1.434 9.848 1.00 0.00 C ATOM 341 O GLU A 696 1.096 0.290 9.775 1.00 0.00 O ATOM 342 CB GLU A 696 -0.034 2.704 11.378 1.00 0.00 C ATOM 343 CG GLU A 696 -1.045 1.583 11.186 1.00 0.00 C ATOM 344 CD GLU A 696 -2.447 2.033 11.590 1.00 0.00 C ATOM 345 OE1 GLU A 696 -3.156 2.577 10.714 1.00 0.00 O ATOM 346 OE2 GLU A 696 -2.801 1.827 12.773 1.00 0.00 O ATOM 0 H GLU A 696 1.745 4.199 11.585 1.00 0.00 H new ATOM 0 HA GLU A 696 1.698 1.495 11.915 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -0.128 3.110 12.385 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -0.255 3.516 10.685 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -1.048 1.266 10.143 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -0.751 0.718 11.781 1.00 0.00 H new ATOM 353 N VAL A 697 2.164 2.015 8.815 1.00 0.00 N ATOM 354 CA VAL A 697 2.396 1.297 7.571 1.00 0.00 C ATOM 355 C VAL A 697 3.859 1.404 7.140 1.00 0.00 C ATOM 356 O VAL A 697 4.335 0.546 6.401 1.00 0.00 O ATOM 357 CB VAL A 697 1.425 1.787 6.491 1.00 0.00 C ATOM 358 CG1 VAL A 697 1.649 1.067 5.162 1.00 0.00 C ATOM 359 CG2 VAL A 697 -0.015 1.501 6.917 1.00 0.00 C ATOM 0 H VAL A 697 2.510 2.975 8.822 1.00 0.00 H new ATOM 0 HA VAL A 697 2.199 0.237 7.729 1.00 0.00 H new ATOM 0 HB VAL A 697 1.602 2.855 6.367 1.00 0.00 H new ATOM 0 HG11 VAL A 697 0.942 1.441 4.422 1.00 0.00 H new ATOM 0 HG12 VAL A 697 2.667 1.249 4.817 1.00 0.00 H new ATOM 0 HG13 VAL A 697 1.498 -0.004 5.298 1.00 0.00 H new ATOM 0 HG21 VAL A 697 -0.699 1.852 6.145 1.00 0.00 H new ATOM 0 HG22 VAL A 697 -0.146 0.428 7.058 1.00 0.00 H new ATOM 0 HG23 VAL A 697 -0.227 2.019 7.852 1.00 0.00 H new ATOM 369 N GLN A 698 4.590 2.432 7.585 1.00 0.00 N ATOM 370 CA GLN A 698 6.026 2.473 7.331 1.00 0.00 C ATOM 371 C GLN A 698 6.693 1.364 8.137 1.00 0.00 C ATOM 372 O GLN A 698 7.600 0.686 7.664 1.00 0.00 O ATOM 373 CB GLN A 698 6.646 3.776 7.833 1.00 0.00 C ATOM 374 CG GLN A 698 5.968 5.074 7.428 1.00 0.00 C ATOM 375 CD GLN A 698 6.686 6.252 8.083 1.00 0.00 C ATOM 376 OE1 GLN A 698 7.864 6.174 8.422 1.00 0.00 O ATOM 377 NE2 GLN A 698 5.987 7.360 8.276 1.00 0.00 N ATOM 0 H GLN A 698 4.220 3.225 8.109 1.00 0.00 H new ATOM 0 HA GLN A 698 6.173 2.372 6.256 1.00 0.00 H new ATOM 0 HB2 GLN A 698 6.676 3.737 8.922 1.00 0.00 H new ATOM 0 HB3 GLN A 698 7.679 3.813 7.487 1.00 0.00 H new ATOM 0 HG2 GLN A 698 5.985 5.182 6.343 1.00 0.00 H new ATOM 0 HG3 GLN A 698 4.921 5.059 7.731 1.00 0.00 H new ATOM 0 HE21 GLN A 698 5.010 7.403 7.987 1.00 0.00 H new ATOM 0 HE22 GLN A 698 6.426 8.170 8.714 1.00 0.00 H new ATOM 386 N LYS A 699 6.216 1.199 9.375 1.00 0.00 N ATOM 387 CA LYS A 699 6.754 0.311 10.388 1.00 0.00 C ATOM 388 C LYS A 699 6.444 -1.138 10.031 1.00 0.00 C ATOM 389 O LYS A 699 7.168 -2.057 10.416 1.00 0.00 O ATOM 390 CB LYS A 699 6.157 0.736 11.742 1.00 0.00 C ATOM 391 CG LYS A 699 4.764 0.156 12.030 1.00 0.00 C ATOM 392 CD LYS A 699 4.090 0.847 13.217 1.00 0.00 C ATOM 393 CE LYS A 699 5.033 1.012 14.405 1.00 0.00 C ATOM 394 NZ LYS A 699 5.397 -0.288 15.004 1.00 0.00 N ATOM 0 H LYS A 699 5.400 1.713 9.706 1.00 0.00 H new ATOM 0 HA LYS A 699 7.840 0.382 10.448 1.00 0.00 H new ATOM 0 HB2 LYS A 699 6.837 0.430 12.537 1.00 0.00 H new ATOM 0 HB3 LYS A 699 6.098 1.824 11.774 1.00 0.00 H new ATOM 0 HG2 LYS A 699 4.137 0.262 11.145 1.00 0.00 H new ATOM 0 HG3 LYS A 699 4.851 -0.911 12.233 1.00 0.00 H new ATOM 0 HD2 LYS A 699 3.727 1.827 12.906 1.00 0.00 H new ATOM 0 HD3 LYS A 699 3.220 0.268 13.525 1.00 0.00 H new ATOM 0 HE2 LYS A 699 5.937 1.529 14.082 1.00 0.00 H new ATOM 0 HE3 LYS A 699 4.559 1.640 15.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 6.038 -0.132 15.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 4.537 -0.770 15.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 5.872 -0.878 14.291 1.00 0.00 H new ATOM 408 N GLU A 700 5.360 -1.343 9.281 1.00 0.00 N ATOM 409 CA GLU A 700 4.977 -2.669 8.848 1.00 0.00 C ATOM 410 C GLU A 700 5.883 -3.051 7.692 1.00 0.00 C ATOM 411 O GLU A 700 6.233 -4.215 7.539 1.00 0.00 O ATOM 412 CB GLU A 700 3.514 -2.664 8.402 1.00 0.00 C ATOM 413 CG GLU A 700 2.579 -2.485 9.599 1.00 0.00 C ATOM 414 CD GLU A 700 2.671 -3.661 10.568 1.00 0.00 C ATOM 415 OE1 GLU A 700 2.119 -4.732 10.227 1.00 0.00 O ATOM 416 OE2 GLU A 700 3.291 -3.485 11.640 1.00 0.00 O ATOM 0 H GLU A 700 4.737 -0.600 8.965 1.00 0.00 H new ATOM 0 HA GLU A 700 5.079 -3.389 9.660 1.00 0.00 H new ATOM 0 HB2 GLU A 700 3.351 -1.860 7.685 1.00 0.00 H new ATOM 0 HB3 GLU A 700 3.282 -3.598 7.891 1.00 0.00 H new ATOM 0 HG2 GLU A 700 2.830 -1.562 10.122 1.00 0.00 H new ATOM 0 HG3 GLU A 700 1.552 -2.383 9.247 1.00 0.00 H new ATOM 423 N LEU A 701 6.264 -2.059 6.882 1.00 0.00 N ATOM 424 CA LEU A 701 7.237 -2.232 5.822 1.00 0.00 C ATOM 425 C LEU A 701 8.602 -2.542 6.436 1.00 0.00 C ATOM 426 O LEU A 701 9.346 -3.371 5.914 1.00 0.00 O ATOM 427 CB LEU A 701 7.280 -0.941 4.999 1.00 0.00 C ATOM 428 CG LEU A 701 6.740 -1.152 3.580 1.00 0.00 C ATOM 429 CD1 LEU A 701 5.255 -1.514 3.617 1.00 0.00 C ATOM 430 CD2 LEU A 701 6.902 0.132 2.765 1.00 0.00 C ATOM 0 H LEU A 701 5.898 -1.110 6.951 1.00 0.00 H new ATOM 0 HA LEU A 701 6.964 -3.062 5.171 1.00 0.00 H new ATOM 0 HB2 LEU A 701 6.694 -0.171 5.500 1.00 0.00 H new ATOM 0 HB3 LEU A 701 8.306 -0.577 4.947 1.00 0.00 H new ATOM 0 HG LEU A 701 7.303 -1.965 3.122 1.00 0.00 H new ATOM 0 HD11 LEU A 701 4.891 -1.660 2.600 1.00 0.00 H new ATOM 0 HD12 LEU A 701 5.119 -2.433 4.187 1.00 0.00 H new ATOM 0 HD13 LEU A 701 4.696 -0.707 4.091 1.00 0.00 H new ATOM 0 HD21 LEU A 701 6.516 -0.025 1.758 1.00 0.00 H new ATOM 0 HD22 LEU A 701 6.348 0.939 3.244 1.00 0.00 H new ATOM 0 HD23 LEU A 701 7.958 0.398 2.712 1.00 0.00 H new ATOM 442 N MET A 702 8.939 -1.881 7.551 1.00 0.00 N ATOM 443 CA MET A 702 10.191 -2.125 8.256 1.00 0.00 C ATOM 444 C MET A 702 10.194 -3.503 8.922 1.00 0.00 C ATOM 445 O MET A 702 11.258 -3.975 9.317 1.00 0.00 O ATOM 446 CB MET A 702 10.409 -1.067 9.342 1.00 0.00 C ATOM 447 CG MET A 702 10.557 0.363 8.818 1.00 0.00 C ATOM 448 SD MET A 702 12.182 0.820 8.154 1.00 0.00 S ATOM 449 CE MET A 702 12.026 0.191 6.467 1.00 0.00 C ATOM 0 H MET A 702 8.351 -1.168 7.983 1.00 0.00 H new ATOM 0 HA MET A 702 10.991 -2.078 7.517 1.00 0.00 H new ATOM 0 HB2 MET A 702 9.570 -1.100 10.037 1.00 0.00 H new ATOM 0 HB3 MET A 702 11.303 -1.326 9.909 1.00 0.00 H new ATOM 0 HG2 MET A 702 9.814 0.518 8.036 1.00 0.00 H new ATOM 0 HG3 MET A 702 10.315 1.050 9.629 1.00 0.00 H new ATOM 0 HE1 MET A 702 12.643 0.790 5.797 1.00 0.00 H new ATOM 0 HE2 MET A 702 12.356 -0.847 6.434 1.00 0.00 H new ATOM 0 HE3 MET A 702 10.984 0.251 6.151 1.00 0.00 H new ATOM 459 N ALA A 703 9.032 -4.153 9.051 1.00 0.00 N ATOM 460 CA ALA A 703 8.949 -5.480 9.650 1.00 0.00 C ATOM 461 C ALA A 703 8.728 -6.538 8.575 1.00 0.00 C ATOM 462 O ALA A 703 8.886 -7.735 8.819 1.00 0.00 O ATOM 463 CB ALA A 703 7.773 -5.503 10.620 1.00 0.00 C ATOM 0 H ALA A 703 8.135 -3.775 8.746 1.00 0.00 H new ATOM 0 HA ALA A 703 9.882 -5.698 10.171 1.00 0.00 H new ATOM 0 HB1 ALA A 703 7.697 -6.490 11.077 1.00 0.00 H new ATOM 0 HB2 ALA A 703 7.928 -4.754 11.397 1.00 0.00 H new ATOM 0 HB3 ALA A 703 6.852 -5.281 10.081 1.00 0.00 H new ATOM 469 N GLU A 704 8.359 -6.095 7.376 1.00 0.00 N ATOM 470 CA GLU A 704 8.018 -6.935 6.270 1.00 0.00 C ATOM 471 C GLU A 704 9.286 -7.248 5.485 1.00 0.00 C ATOM 472 O GLU A 704 9.350 -8.227 4.750 1.00 0.00 O ATOM 473 CB GLU A 704 7.026 -6.127 5.443 1.00 0.00 C ATOM 474 CG GLU A 704 6.761 -6.886 4.173 1.00 0.00 C ATOM 475 CD GLU A 704 5.462 -6.435 3.510 1.00 0.00 C ATOM 476 OE1 GLU A 704 5.382 -5.240 3.155 1.00 0.00 O ATOM 477 OE2 GLU A 704 4.561 -7.292 3.365 1.00 0.00 O ATOM 0 H GLU A 704 8.292 -5.101 7.157 1.00 0.00 H new ATOM 0 HA GLU A 704 7.580 -7.888 6.567 1.00 0.00 H new ATOM 0 HB2 GLU A 704 6.100 -5.976 5.998 1.00 0.00 H new ATOM 0 HB3 GLU A 704 7.429 -5.139 5.221 1.00 0.00 H new ATOM 0 HG2 GLU A 704 7.592 -6.742 3.482 1.00 0.00 H new ATOM 0 HG3 GLU A 704 6.708 -7.953 4.390 1.00 0.00 H new ATOM 484 N TRP A 705 10.299 -6.400 5.655 1.00 0.00 N ATOM 485 CA TRP A 705 11.575 -6.516 4.980 1.00 0.00 C ATOM 486 C TRP A 705 12.518 -7.333 5.848 1.00 0.00 C ATOM 487 O TRP A 705 13.471 -7.938 5.364 1.00 0.00 O ATOM 488 CB TRP A 705 12.110 -5.107 4.778 1.00 0.00 C ATOM 489 CG TRP A 705 11.348 -4.303 3.779 1.00 0.00 C ATOM 490 CD1 TRP A 705 10.363 -4.754 2.972 1.00 0.00 C ATOM 491 CD2 TRP A 705 11.497 -2.892 3.467 1.00 0.00 C ATOM 492 NE1 TRP A 705 9.904 -3.722 2.187 1.00 0.00 N ATOM 493 CE2 TRP A 705 10.574 -2.545 2.441 1.00 0.00 C ATOM 494 CE3 TRP A 705 12.336 -1.875 3.949 1.00 0.00 C ATOM 495 CZ2 TRP A 705 10.492 -1.254 1.913 1.00 0.00 C ATOM 496 CZ3 TRP A 705 12.273 -0.578 3.418 1.00 0.00 C ATOM 497 CH2 TRP A 705 11.360 -0.268 2.399 1.00 0.00 C ATOM 0 H TRP A 705 10.246 -5.597 6.282 1.00 0.00 H new ATOM 0 HA TRP A 705 11.478 -7.016 4.016 1.00 0.00 H new ATOM 0 HB2 TRP A 705 12.097 -4.585 5.735 1.00 0.00 H new ATOM 0 HB3 TRP A 705 13.151 -5.167 4.462 1.00 0.00 H new ATOM 0 HD1 TRP A 705 9.993 -5.768 2.947 1.00 0.00 H new ATOM 0 HE1 TRP A 705 9.157 -3.817 1.499 1.00 0.00 H new ATOM 0 HE3 TRP A 705 13.039 -2.094 4.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 9.772 -1.020 1.143 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 12.933 0.188 3.797 1.00 0.00 H new ATOM 0 HH2 TRP A 705 11.326 0.731 1.989 1.00 0.00 H new ATOM 575 N MET B 1 -12.092 11.564 -16.569 1.00 0.00 N ATOM 576 CA MET B 1 -11.832 11.470 -15.119 1.00 0.00 C ATOM 577 C MET B 1 -10.869 10.324 -14.827 1.00 0.00 C ATOM 578 O MET B 1 -11.105 9.218 -15.297 1.00 0.00 O ATOM 579 CB MET B 1 -13.138 11.302 -14.327 1.00 0.00 C ATOM 580 CG MET B 1 -13.895 10.003 -14.624 1.00 0.00 C ATOM 581 SD MET B 1 -14.568 9.849 -16.299 1.00 0.00 S ATOM 582 CE MET B 1 -15.356 8.225 -16.139 1.00 0.00 C ATOM 0 H1 MET B 1 -12.486 12.501 -16.791 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.202 11.430 -17.091 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.772 10.828 -16.848 1.00 0.00 H new ATOM 0 HA MET B 1 -11.370 12.403 -14.797 1.00 0.00 H new ATOM 0 HB2 MET B 1 -12.910 11.340 -13.262 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.792 12.147 -14.544 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.223 9.164 -14.444 1.00 0.00 H new ATOM 0 HG3 MET B 1 -14.716 9.912 -13.913 1.00 0.00 H new ATOM 0 HE1 MET B 1 -15.830 7.956 -17.083 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.603 7.479 -15.885 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.110 8.262 -15.352 1.00 0.00 H new ATOM 594 N GLN B 2 -9.796 10.569 -14.062 1.00 0.00 N ATOM 595 CA GLN B 2 -8.805 9.541 -13.761 1.00 0.00 C ATOM 596 C GLN B 2 -7.761 10.013 -12.748 1.00 0.00 C ATOM 597 O GLN B 2 -6.969 10.910 -13.030 1.00 0.00 O ATOM 598 CB GLN B 2 -8.113 9.109 -15.052 1.00 0.00 C ATOM 599 CG GLN B 2 -7.811 10.294 -15.973 1.00 0.00 C ATOM 600 CD GLN B 2 -6.874 9.952 -17.127 1.00 0.00 C ATOM 601 OE1 GLN B 2 -5.971 10.721 -17.445 1.00 0.00 O ATOM 602 NE2 GLN B 2 -7.069 8.806 -17.765 1.00 0.00 N ATOM 0 H GLN B 2 -9.597 11.477 -13.641 1.00 0.00 H new ATOM 0 HA GLN B 2 -9.332 8.699 -13.312 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -7.183 8.594 -14.809 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -8.745 8.394 -15.579 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -8.748 10.675 -16.379 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -7.369 11.097 -15.384 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -7.827 8.186 -17.480 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -6.461 8.544 -18.541 1.00 0.00 H new ATOM 611 N ILE B 3 -7.764 9.400 -11.563 1.00 0.00 N ATOM 612 CA ILE B 3 -6.955 9.868 -10.439 1.00 0.00 C ATOM 613 C ILE B 3 -5.504 9.417 -10.566 1.00 0.00 C ATOM 614 O ILE B 3 -5.212 8.427 -11.236 1.00 0.00 O ATOM 615 CB ILE B 3 -7.560 9.452 -9.088 1.00 0.00 C ATOM 616 CG1 ILE B 3 -7.415 7.962 -8.746 1.00 0.00 C ATOM 617 CG2 ILE B 3 -9.029 9.875 -9.032 1.00 0.00 C ATOM 618 CD1 ILE B 3 -8.025 7.007 -9.766 1.00 0.00 C ATOM 0 H ILE B 3 -8.323 8.572 -11.357 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.961 10.958 -10.471 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.979 9.972 -8.327 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -6.355 7.730 -8.641 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.879 7.780 -7.777 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.456 9.579 -8.074 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.101 10.957 -9.143 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -9.578 9.390 -9.839 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.873 5.979 -9.438 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -9.093 7.205 -9.856 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -7.546 7.154 -10.734 1.00 0.00 H new ATOM 630 N PHE B 4 -4.595 10.156 -9.920 1.00 0.00 N ATOM 631 CA PHE B 4 -3.163 9.943 -10.062 1.00 0.00 C ATOM 632 C PHE B 4 -2.639 9.140 -8.878 1.00 0.00 C ATOM 633 O PHE B 4 -2.311 9.697 -7.833 1.00 0.00 O ATOM 634 CB PHE B 4 -2.425 11.281 -10.161 1.00 0.00 C ATOM 635 CG PHE B 4 -2.991 12.307 -11.123 1.00 0.00 C ATOM 636 CD1 PHE B 4 -3.934 11.950 -12.091 1.00 0.00 C ATOM 637 CD2 PHE B 4 -2.556 13.638 -11.039 1.00 0.00 C ATOM 638 CE1 PHE B 4 -4.457 12.912 -12.964 1.00 0.00 C ATOM 639 CE2 PHE B 4 -3.070 14.604 -11.915 1.00 0.00 C ATOM 640 CZ PHE B 4 -4.020 14.240 -12.880 1.00 0.00 C ATOM 0 H PHE B 4 -4.838 10.917 -9.286 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.983 9.384 -10.980 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -2.397 11.727 -9.167 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.393 11.079 -10.449 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -4.262 10.924 -12.166 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -1.823 13.919 -10.297 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -5.195 12.631 -13.700 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -2.734 15.628 -11.847 1.00 0.00 H new ATOM 0 HZ PHE B 4 -4.414 14.983 -13.558 1.00 0.00 H new ATOM 650 N VAL B 5 -2.557 7.825 -9.032 1.00 0.00 N ATOM 651 CA VAL B 5 -2.099 6.960 -7.959 1.00 0.00 C ATOM 652 C VAL B 5 -0.575 6.880 -7.992 1.00 0.00 C ATOM 653 O VAL B 5 -0.011 6.219 -8.861 1.00 0.00 O ATOM 654 CB VAL B 5 -2.731 5.572 -8.109 1.00 0.00 C ATOM 655 CG1 VAL B 5 -2.281 4.664 -6.970 1.00 0.00 C ATOM 656 CG2 VAL B 5 -4.255 5.676 -8.078 1.00 0.00 C ATOM 0 H VAL B 5 -2.803 7.336 -9.892 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.403 7.367 -6.995 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.411 5.155 -9.064 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -2.736 3.681 -7.087 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -1.196 4.566 -6.990 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -2.589 5.095 -6.018 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -4.690 4.682 -8.186 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -4.571 6.109 -7.129 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.593 6.311 -8.897 1.00 0.00 H new ATOM 666 N LYS B 6 0.098 7.549 -7.050 1.00 0.00 N ATOM 667 CA LYS B 6 1.551 7.540 -6.976 1.00 0.00 C ATOM 668 C LYS B 6 2.033 6.296 -6.237 1.00 0.00 C ATOM 669 O LYS B 6 1.690 6.074 -5.077 1.00 0.00 O ATOM 670 CB LYS B 6 2.030 8.822 -6.294 1.00 0.00 C ATOM 671 CG LYS B 6 3.534 8.979 -6.525 1.00 0.00 C ATOM 672 CD LYS B 6 4.083 10.203 -5.800 1.00 0.00 C ATOM 673 CE LYS B 6 4.280 9.863 -4.325 1.00 0.00 C ATOM 674 NZ LYS B 6 4.921 10.977 -3.601 1.00 0.00 N ATOM 0 H LYS B 6 -0.352 8.107 -6.324 1.00 0.00 H new ATOM 0 HA LYS B 6 1.973 7.507 -7.981 1.00 0.00 H new ATOM 0 HB2 LYS B 6 1.496 9.683 -6.695 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.816 8.783 -5.226 1.00 0.00 H new ATOM 0 HG2 LYS B 6 4.052 8.085 -6.177 1.00 0.00 H new ATOM 0 HG3 LYS B 6 3.732 9.067 -7.593 1.00 0.00 H new ATOM 0 HD2 LYS B 6 5.029 10.510 -6.245 1.00 0.00 H new ATOM 0 HD3 LYS B 6 3.395 11.042 -5.904 1.00 0.00 H new ATOM 0 HE2 LYS B 6 3.316 9.637 -3.869 1.00 0.00 H new ATOM 0 HE3 LYS B 6 4.893 8.966 -4.235 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 5.257 10.642 -2.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 5.727 11.332 -4.154 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 4.232 11.743 -3.463 1.00 0.00 H new ATOM 688 N THR B 7 2.834 5.489 -6.930 1.00 0.00 N ATOM 689 CA THR B 7 3.382 4.249 -6.401 1.00 0.00 C ATOM 690 C THR B 7 4.571 4.517 -5.481 1.00 0.00 C ATOM 691 O THR B 7 5.022 5.652 -5.342 1.00 0.00 O ATOM 692 CB THR B 7 3.760 3.325 -7.563 1.00 0.00 C ATOM 693 OG1 THR B 7 3.876 2.003 -7.084 1.00 0.00 O ATOM 694 CG2 THR B 7 5.088 3.732 -8.189 1.00 0.00 C ATOM 0 H THR B 7 3.123 5.684 -7.889 1.00 0.00 H new ATOM 0 HA THR B 7 2.624 3.753 -5.794 1.00 0.00 H new ATOM 0 HB THR B 7 2.980 3.399 -8.321 1.00 0.00 H new ATOM 0 HG1 THR B 7 4.116 1.407 -7.824 1.00 0.00 H new ATOM 0 HG21 THR B 7 5.326 3.056 -9.010 1.00 0.00 H new ATOM 0 HG22 THR B 7 5.014 4.751 -8.568 1.00 0.00 H new ATOM 0 HG23 THR B 7 5.876 3.681 -7.437 1.00 0.00 H new ATOM 702 N LEU B 8 5.070 3.447 -4.859 1.00 0.00 N ATOM 703 CA LEU B 8 6.162 3.462 -3.889 1.00 0.00 C ATOM 704 C LEU B 8 7.524 3.847 -4.489 1.00 0.00 C ATOM 705 O LEU B 8 8.551 3.627 -3.849 1.00 0.00 O ATOM 706 CB LEU B 8 6.239 2.082 -3.236 1.00 0.00 C ATOM 707 CG LEU B 8 5.061 1.778 -2.306 1.00 0.00 C ATOM 708 CD1 LEU B 8 5.295 0.406 -1.673 1.00 0.00 C ATOM 709 CD2 LEU B 8 4.962 2.822 -1.191 1.00 0.00 C ATOM 0 H LEU B 8 4.708 2.508 -5.026 1.00 0.00 H new ATOM 0 HA LEU B 8 5.941 4.237 -3.155 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.281 1.322 -4.016 1.00 0.00 H new ATOM 0 HB3 LEU B 8 7.167 2.009 -2.669 1.00 0.00 H new ATOM 0 HG LEU B 8 4.136 1.796 -2.883 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.467 0.167 -1.005 1.00 0.00 H new ATOM 0 HD12 LEU B 8 5.359 -0.350 -2.456 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.226 0.421 -1.106 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.118 2.584 -0.544 1.00 0.00 H new ATOM 0 HD22 LEU B 8 5.881 2.817 -0.605 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.817 3.809 -1.629 1.00 0.00 H new ATOM 721 N THR B 9 7.559 4.418 -5.696 1.00 0.00 N ATOM 722 CA THR B 9 8.807 4.846 -6.326 1.00 0.00 C ATOM 723 C THR B 9 8.697 6.271 -6.876 1.00 0.00 C ATOM 724 O THR B 9 9.627 6.761 -7.514 1.00 0.00 O ATOM 725 CB THR B 9 9.205 3.880 -7.446 1.00 0.00 C ATOM 726 OG1 THR B 9 8.217 3.887 -8.452 1.00 0.00 O ATOM 727 CG2 THR B 9 9.362 2.458 -6.915 1.00 0.00 C ATOM 0 H THR B 9 6.728 4.595 -6.260 1.00 0.00 H new ATOM 0 HA THR B 9 9.581 4.838 -5.559 1.00 0.00 H new ATOM 0 HB THR B 9 10.161 4.210 -7.854 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.475 3.270 -9.168 1.00 0.00 H new ATOM 0 HG21 THR B 9 9.645 1.794 -7.732 1.00 0.00 H new ATOM 0 HG22 THR B 9 10.136 2.440 -6.148 1.00 0.00 H new ATOM 0 HG23 THR B 9 8.418 2.124 -6.486 1.00 0.00 H new ATOM 735 N GLY B 10 7.565 6.942 -6.635 1.00 0.00 N ATOM 736 CA GLY B 10 7.339 8.306 -7.090 1.00 0.00 C ATOM 737 C GLY B 10 6.733 8.341 -8.491 1.00 0.00 C ATOM 738 O GLY B 10 6.446 9.418 -9.011 1.00 0.00 O ATOM 0 H GLY B 10 6.781 6.547 -6.116 1.00 0.00 H new ATOM 0 HA2 GLY B 10 6.674 8.817 -6.393 1.00 0.00 H new ATOM 0 HA3 GLY B 10 8.283 8.851 -7.088 1.00 0.00 H new ATOM 742 N LYS B 11 6.540 7.167 -9.094 1.00 0.00 N ATOM 743 CA LYS B 11 5.912 7.022 -10.393 1.00 0.00 C ATOM 744 C LYS B 11 4.409 7.131 -10.186 1.00 0.00 C ATOM 745 O LYS B 11 3.913 6.891 -9.087 1.00 0.00 O ATOM 746 CB LYS B 11 6.365 5.677 -10.976 1.00 0.00 C ATOM 747 CG LYS B 11 5.572 5.195 -12.193 1.00 0.00 C ATOM 748 CD LYS B 11 4.379 4.326 -11.778 1.00 0.00 C ATOM 749 CE LYS B 11 3.621 3.843 -13.016 1.00 0.00 C ATOM 750 NZ LYS B 11 4.449 2.956 -13.852 1.00 0.00 N ATOM 0 H LYS B 11 6.823 6.279 -8.680 1.00 0.00 H new ATOM 0 HA LYS B 11 6.197 7.794 -11.107 1.00 0.00 H new ATOM 0 HB2 LYS B 11 7.416 5.755 -11.255 1.00 0.00 H new ATOM 0 HB3 LYS B 11 6.298 4.919 -10.195 1.00 0.00 H new ATOM 0 HG2 LYS B 11 5.217 6.055 -12.761 1.00 0.00 H new ATOM 0 HG3 LYS B 11 6.226 4.625 -12.853 1.00 0.00 H new ATOM 0 HD2 LYS B 11 4.727 3.471 -11.199 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.711 4.897 -11.133 1.00 0.00 H new ATOM 0 HE2 LYS B 11 2.719 3.314 -12.707 1.00 0.00 H new ATOM 0 HE3 LYS B 11 3.300 4.703 -13.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 4.653 3.424 -14.758 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 5.342 2.749 -13.360 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 3.937 2.068 -14.029 1.00 0.00 H new ATOM 764 N THR B 12 3.677 7.486 -11.238 1.00 0.00 N ATOM 765 CA THR B 12 2.253 7.747 -11.134 1.00 0.00 C ATOM 766 C THR B 12 1.498 6.869 -12.120 1.00 0.00 C ATOM 767 O THR B 12 1.966 6.603 -13.227 1.00 0.00 O ATOM 768 CB THR B 12 2.014 9.232 -11.405 1.00 0.00 C ATOM 769 OG1 THR B 12 2.662 9.996 -10.412 1.00 0.00 O ATOM 770 CG2 THR B 12 0.530 9.578 -11.374 1.00 0.00 C ATOM 0 H THR B 12 4.055 7.599 -12.179 1.00 0.00 H new ATOM 0 HA THR B 12 1.888 7.508 -10.135 1.00 0.00 H new ATOM 0 HB THR B 12 2.408 9.455 -12.397 1.00 0.00 H new ATOM 0 HG1 THR B 12 2.513 10.949 -10.583 1.00 0.00 H new ATOM 0 HG21 THR B 12 0.400 10.642 -11.571 1.00 0.00 H new ATOM 0 HG22 THR B 12 0.006 9.001 -12.136 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.121 9.338 -10.393 1.00 0.00 H new ATOM 778 N ILE B 13 0.318 6.426 -11.688 1.00 0.00 N ATOM 779 CA ILE B 13 -0.587 5.612 -12.476 1.00 0.00 C ATOM 780 C ILE B 13 -1.868 6.423 -12.614 1.00 0.00 C ATOM 781 O ILE B 13 -2.231 7.151 -11.694 1.00 0.00 O ATOM 782 CB ILE B 13 -0.865 4.293 -11.739 1.00 0.00 C ATOM 783 CG1 ILE B 13 0.413 3.647 -11.187 1.00 0.00 C ATOM 784 CG2 ILE B 13 -1.565 3.329 -12.695 1.00 0.00 C ATOM 785 CD1 ILE B 13 0.084 2.560 -10.164 1.00 0.00 C ATOM 0 H ILE B 13 -0.038 6.633 -10.755 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.170 5.365 -13.452 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.502 4.515 -10.883 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.990 3.217 -12.006 1.00 0.00 H new ATOM 0 HG13 ILE B 13 1.038 4.410 -10.723 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.767 2.389 -12.181 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -2.505 3.768 -13.031 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -0.924 3.141 -13.556 1.00 0.00 H new ATOM 0 HD11 ILE B 13 1.009 2.120 -9.790 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.471 2.997 -9.334 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.521 1.786 -10.637 1.00 0.00 H new ATOM 797 N THR B 14 -2.555 6.308 -13.748 1.00 0.00 N ATOM 798 CA THR B 14 -3.731 7.130 -13.989 1.00 0.00 C ATOM 799 C THR B 14 -4.814 6.318 -14.684 1.00 0.00 C ATOM 800 O THR B 14 -4.657 5.919 -15.836 1.00 0.00 O ATOM 801 CB THR B 14 -3.338 8.364 -14.808 1.00 0.00 C ATOM 802 OG1 THR B 14 -2.277 9.049 -14.177 1.00 0.00 O ATOM 803 CG2 THR B 14 -4.525 9.312 -14.918 1.00 0.00 C ATOM 0 H THR B 14 -2.320 5.663 -14.502 1.00 0.00 H new ATOM 0 HA THR B 14 -4.138 7.468 -13.036 1.00 0.00 H new ATOM 0 HB THR B 14 -3.028 8.034 -15.800 1.00 0.00 H new ATOM 0 HG1 THR B 14 -2.033 9.835 -14.709 1.00 0.00 H new ATOM 0 HG21 THR B 14 -4.239 10.187 -15.501 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.353 8.802 -15.411 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.834 9.626 -13.921 1.00 0.00 H new ATOM 811 N LEU B 15 -5.914 6.079 -13.964 1.00 0.00 N ATOM 812 CA LEU B 15 -7.025 5.268 -14.425 1.00 0.00 C ATOM 813 C LEU B 15 -8.337 5.886 -13.985 1.00 0.00 C ATOM 814 O LEU B 15 -8.406 6.613 -12.998 1.00 0.00 O ATOM 815 CB LEU B 15 -6.874 3.794 -13.987 1.00 0.00 C ATOM 816 CG LEU B 15 -6.513 3.482 -12.519 1.00 0.00 C ATOM 817 CD1 LEU B 15 -5.152 4.027 -12.094 1.00 0.00 C ATOM 818 CD2 LEU B 15 -7.565 3.973 -11.533 1.00 0.00 C ATOM 0 H LEU B 15 -6.052 6.456 -13.026 1.00 0.00 H new ATOM 0 HA LEU B 15 -7.022 5.252 -15.515 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -7.813 3.287 -14.210 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -6.109 3.340 -14.617 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.472 2.393 -12.488 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -4.966 3.770 -11.051 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -4.374 3.590 -12.720 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -5.143 5.111 -12.207 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.256 3.725 -10.518 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -7.674 5.054 -11.625 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -8.519 3.492 -11.749 1.00 0.00 H new ATOM 830 N GLU B 16 -9.382 5.583 -14.748 1.00 0.00 N ATOM 831 CA GLU B 16 -10.651 6.256 -14.634 1.00 0.00 C ATOM 832 C GLU B 16 -11.494 5.649 -13.528 1.00 0.00 C ATOM 833 O GLU B 16 -11.354 4.471 -13.204 1.00 0.00 O ATOM 834 CB GLU B 16 -11.388 6.122 -15.962 1.00 0.00 C ATOM 835 CG GLU B 16 -10.552 6.643 -17.129 1.00 0.00 C ATOM 836 CD GLU B 16 -9.358 5.753 -17.473 1.00 0.00 C ATOM 837 OE1 GLU B 16 -9.544 4.514 -17.512 1.00 0.00 O ATOM 838 OE2 GLU B 16 -8.267 6.320 -17.692 1.00 0.00 O ATOM 0 H GLU B 16 -9.362 4.857 -15.465 1.00 0.00 H new ATOM 0 HA GLU B 16 -10.477 7.304 -14.391 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -11.640 5.076 -16.134 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.328 6.672 -15.914 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -11.190 6.737 -18.008 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -10.191 7.643 -16.889 1.00 0.00 H new ATOM 845 N VAL B 17 -12.372 6.462 -12.954 1.00 0.00 N ATOM 846 CA VAL B 17 -13.236 6.059 -11.850 1.00 0.00 C ATOM 847 C VAL B 17 -14.524 6.875 -11.853 1.00 0.00 C ATOM 848 O VAL B 17 -14.688 7.801 -12.647 1.00 0.00 O ATOM 849 CB VAL B 17 -12.534 6.228 -10.493 1.00 0.00 C ATOM 850 CG1 VAL B 17 -11.460 5.165 -10.264 1.00 0.00 C ATOM 851 CG2 VAL B 17 -11.914 7.620 -10.353 1.00 0.00 C ATOM 0 H VAL B 17 -12.506 7.430 -13.245 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.470 5.004 -11.992 1.00 0.00 H new ATOM 0 HB VAL B 17 -13.306 6.105 -9.733 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -10.991 5.325 -9.293 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -11.916 4.175 -10.288 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -10.705 5.236 -11.047 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.426 7.705 -9.382 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -11.179 7.772 -11.143 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -12.695 8.376 -10.434 1.00 0.00 H new ATOM 861 N GLU B 18 -15.437 6.518 -10.949 1.00 0.00 N ATOM 862 CA GLU B 18 -16.718 7.181 -10.794 1.00 0.00 C ATOM 863 C GLU B 18 -17.045 7.292 -9.311 1.00 0.00 C ATOM 864 O GLU B 18 -16.508 6.535 -8.501 1.00 0.00 O ATOM 865 CB GLU B 18 -17.806 6.362 -11.500 1.00 0.00 C ATOM 866 CG GLU B 18 -17.459 6.153 -12.968 1.00 0.00 C ATOM 867 CD GLU B 18 -18.579 5.427 -13.712 1.00 0.00 C ATOM 868 OE1 GLU B 18 -19.702 5.979 -13.754 1.00 0.00 O ATOM 869 OE2 GLU B 18 -18.308 4.324 -14.237 1.00 0.00 O ATOM 0 H GLU B 18 -15.298 5.746 -10.296 1.00 0.00 H new ATOM 0 HA GLU B 18 -16.674 8.177 -11.235 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -17.918 5.396 -11.007 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -18.764 6.875 -11.418 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -17.274 7.118 -13.440 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.537 5.578 -13.046 1.00 0.00 H new ATOM 876 N PRO B 19 -17.923 8.227 -8.938 1.00 0.00 N ATOM 877 CA PRO B 19 -18.337 8.423 -7.563 1.00 0.00 C ATOM 878 C PRO B 19 -19.274 7.305 -7.109 1.00 0.00 C ATOM 879 O PRO B 19 -19.867 7.394 -6.035 1.00 0.00 O ATOM 880 CB PRO B 19 -19.050 9.767 -7.555 1.00 0.00 C ATOM 881 CG PRO B 19 -19.620 9.874 -8.967 1.00 0.00 C ATOM 882 CD PRO B 19 -18.579 9.165 -9.826 1.00 0.00 C ATOM 0 HA PRO B 19 -17.491 8.406 -6.876 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -19.836 9.800 -6.801 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -18.363 10.585 -7.336 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -20.596 9.395 -9.043 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -19.750 10.913 -9.270 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -19.047 8.650 -10.665 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.865 9.875 -10.245 1.00 0.00 H new ATOM 890 N SER B 20 -19.407 6.257 -7.927 1.00 0.00 N ATOM 891 CA SER B 20 -20.266 5.124 -7.637 1.00 0.00 C ATOM 892 C SER B 20 -19.504 3.811 -7.784 1.00 0.00 C ATOM 893 O SER B 20 -20.100 2.741 -7.669 1.00 0.00 O ATOM 894 CB SER B 20 -21.496 5.152 -8.539 1.00 0.00 C ATOM 895 OG SER B 20 -22.200 6.367 -8.372 1.00 0.00 O ATOM 0 H SER B 20 -18.913 6.178 -8.816 1.00 0.00 H new ATOM 0 HA SER B 20 -20.599 5.196 -6.602 1.00 0.00 H new ATOM 0 HB2 SER B 20 -21.194 5.039 -9.580 1.00 0.00 H new ATOM 0 HB3 SER B 20 -22.148 4.311 -8.303 1.00 0.00 H new ATOM 0 HG SER B 20 -22.986 6.373 -8.958 1.00 0.00 H new ATOM 901 N ASP B 21 -18.192 3.885 -8.040 1.00 0.00 N ATOM 902 CA ASP B 21 -17.323 2.720 -7.964 1.00 0.00 C ATOM 903 C ASP B 21 -17.126 2.364 -6.485 1.00 0.00 C ATOM 904 O ASP B 21 -18.068 2.399 -5.699 1.00 0.00 O ATOM 905 CB ASP B 21 -15.998 2.998 -8.680 1.00 0.00 C ATOM 906 CG ASP B 21 -16.160 3.197 -10.183 1.00 0.00 C ATOM 907 OD1 ASP B 21 -17.239 2.846 -10.711 1.00 0.00 O ATOM 908 OD2 ASP B 21 -15.194 3.703 -10.794 1.00 0.00 O ATOM 0 H ASP B 21 -17.714 4.747 -8.302 1.00 0.00 H new ATOM 0 HA ASP B 21 -17.774 1.866 -8.470 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -15.539 3.888 -8.249 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -15.314 2.168 -8.501 1.00 0.00 H new ATOM 913 N THR B 22 -15.898 2.021 -6.104 1.00 0.00 N ATOM 914 CA THR B 22 -15.500 1.719 -4.739 1.00 0.00 C ATOM 915 C THR B 22 -13.989 1.530 -4.745 1.00 0.00 C ATOM 916 O THR B 22 -13.404 1.378 -5.816 1.00 0.00 O ATOM 917 CB THR B 22 -16.218 0.461 -4.230 1.00 0.00 C ATOM 918 OG1 THR B 22 -15.661 0.051 -3.001 1.00 0.00 O ATOM 919 CG2 THR B 22 -16.101 -0.699 -5.215 1.00 0.00 C ATOM 0 H THR B 22 -15.126 1.944 -6.766 1.00 0.00 H new ATOM 0 HA THR B 22 -15.776 2.530 -4.065 1.00 0.00 H new ATOM 0 HB THR B 22 -17.270 0.720 -4.112 1.00 0.00 H new ATOM 0 HG1 THR B 22 -16.126 -0.751 -2.683 1.00 0.00 H new ATOM 0 HG21 THR B 22 -16.623 -1.569 -4.816 1.00 0.00 H new ATOM 0 HG22 THR B 22 -16.547 -0.414 -6.168 1.00 0.00 H new ATOM 0 HG23 THR B 22 -15.050 -0.944 -5.366 1.00 0.00 H new ATOM 927 N ILE B 23 -13.346 1.535 -3.574 1.00 0.00 N ATOM 928 CA ILE B 23 -11.909 1.330 -3.507 1.00 0.00 C ATOM 929 C ILE B 23 -11.560 -0.017 -4.137 1.00 0.00 C ATOM 930 O ILE B 23 -10.488 -0.168 -4.721 1.00 0.00 O ATOM 931 CB ILE B 23 -11.446 1.386 -2.051 1.00 0.00 C ATOM 932 CG1 ILE B 23 -11.831 2.693 -1.350 1.00 0.00 C ATOM 933 CG2 ILE B 23 -9.927 1.217 -1.991 1.00 0.00 C ATOM 934 CD1 ILE B 23 -11.403 3.945 -2.124 1.00 0.00 C ATOM 0 H ILE B 23 -13.799 1.678 -2.671 1.00 0.00 H new ATOM 0 HA ILE B 23 -11.397 2.118 -4.059 1.00 0.00 H new ATOM 0 HB ILE B 23 -11.951 0.574 -1.527 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -12.911 2.715 -1.206 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -11.376 2.714 -0.360 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -9.597 1.257 -0.953 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.651 0.255 -2.423 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -9.449 2.018 -2.555 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -11.706 4.835 -1.573 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -10.320 3.945 -2.246 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -11.878 3.947 -3.105 1.00 0.00 H new ATOM 946 N GLU B 24 -12.461 -0.996 -4.024 1.00 0.00 N ATOM 947 CA GLU B 24 -12.268 -2.305 -4.623 1.00 0.00 C ATOM 948 C GLU B 24 -12.159 -2.200 -6.143 1.00 0.00 C ATOM 949 O GLU B 24 -11.460 -2.994 -6.773 1.00 0.00 O ATOM 950 CB GLU B 24 -13.428 -3.216 -4.208 1.00 0.00 C ATOM 951 CG GLU B 24 -13.395 -4.516 -5.007 1.00 0.00 C ATOM 952 CD GLU B 24 -14.331 -5.563 -4.405 1.00 0.00 C ATOM 953 OE1 GLU B 24 -15.563 -5.362 -4.498 1.00 0.00 O ATOM 954 OE2 GLU B 24 -13.807 -6.561 -3.858 1.00 0.00 O ATOM 0 H GLU B 24 -13.340 -0.897 -3.515 1.00 0.00 H new ATOM 0 HA GLU B 24 -11.332 -2.734 -4.266 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -13.364 -3.435 -3.142 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -14.377 -2.705 -4.372 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -13.684 -4.318 -6.039 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -12.377 -4.905 -5.030 1.00 0.00 H new ATOM 961 N ASN B 25 -12.842 -1.221 -6.743 1.00 0.00 N ATOM 962 CA ASN B 25 -12.765 -1.013 -8.179 1.00 0.00 C ATOM 963 C ASN B 25 -11.437 -0.357 -8.528 1.00 0.00 C ATOM 964 O ASN B 25 -10.834 -0.675 -9.549 1.00 0.00 O ATOM 965 CB ASN B 25 -13.913 -0.126 -8.671 1.00 0.00 C ATOM 966 CG ASN B 25 -14.308 -0.509 -10.087 1.00 0.00 C ATOM 967 OD1 ASN B 25 -13.554 -1.146 -10.815 1.00 0.00 O ATOM 968 ND2 ASN B 25 -15.510 -0.116 -10.484 1.00 0.00 N ATOM 0 H ASN B 25 -13.451 -0.566 -6.253 1.00 0.00 H new ATOM 0 HA ASN B 25 -12.844 -1.983 -8.669 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -14.771 -0.229 -8.007 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -13.611 0.921 -8.641 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -15.836 -0.342 -11.424 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -16.109 0.412 -9.850 1.00 0.00 H new ATOM 975 N VAL B 26 -10.976 0.566 -7.676 1.00 0.00 N ATOM 976 CA VAL B 26 -9.716 1.252 -7.912 1.00 0.00 C ATOM 977 C VAL B 26 -8.580 0.235 -7.887 1.00 0.00 C ATOM 978 O VAL B 26 -7.619 0.370 -8.639 1.00 0.00 O ATOM 979 CB VAL B 26 -9.512 2.356 -6.871 1.00 0.00 C ATOM 980 CG1 VAL B 26 -8.279 3.181 -7.236 1.00 0.00 C ATOM 981 CG2 VAL B 26 -10.712 3.304 -6.844 1.00 0.00 C ATOM 0 H VAL B 26 -11.459 0.849 -6.823 1.00 0.00 H new ATOM 0 HA VAL B 26 -9.729 1.729 -8.892 1.00 0.00 H new ATOM 0 HB VAL B 26 -9.392 1.882 -5.897 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -8.134 3.967 -6.495 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -7.402 2.535 -7.256 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -8.420 3.631 -8.219 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -10.546 4.080 -6.097 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -10.835 3.764 -7.825 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -11.612 2.744 -6.591 1.00 0.00 H new ATOM 991 N LYS B 27 -8.689 -0.786 -7.029 1.00 0.00 N ATOM 992 CA LYS B 27 -7.704 -1.857 -6.986 1.00 0.00 C ATOM 993 C LYS B 27 -7.727 -2.653 -8.289 1.00 0.00 C ATOM 994 O LYS B 27 -6.682 -3.096 -8.753 1.00 0.00 O ATOM 995 CB LYS B 27 -7.989 -2.788 -5.803 1.00 0.00 C ATOM 996 CG LYS B 27 -7.789 -2.086 -4.459 1.00 0.00 C ATOM 997 CD LYS B 27 -8.247 -3.009 -3.330 1.00 0.00 C ATOM 998 CE LYS B 27 -8.069 -2.321 -1.978 1.00 0.00 C ATOM 999 NZ LYS B 27 -8.666 -3.122 -0.893 1.00 0.00 N ATOM 0 H LYS B 27 -9.451 -0.887 -6.358 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.716 -1.414 -6.861 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -9.013 -3.157 -5.870 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -7.333 -3.657 -5.859 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -6.739 -1.824 -4.326 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -8.356 -1.155 -4.435 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -9.293 -3.279 -3.473 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -7.673 -3.935 -3.353 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -7.008 -2.169 -1.781 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -8.533 -1.335 -2.004 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -8.360 -2.744 0.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -9.703 -3.077 -0.958 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -8.357 -4.111 -0.981 1.00 0.00 H new ATOM 1013 N ALA B 28 -8.909 -2.835 -8.884 1.00 0.00 N ATOM 1014 CA ALA B 28 -9.050 -3.576 -10.129 1.00 0.00 C ATOM 1015 C ALA B 28 -8.531 -2.761 -11.314 1.00 0.00 C ATOM 1016 O ALA B 28 -8.025 -3.327 -12.278 1.00 0.00 O ATOM 1017 CB ALA B 28 -10.530 -3.912 -10.325 1.00 0.00 C ATOM 0 H ALA B 28 -9.788 -2.473 -8.514 1.00 0.00 H new ATOM 0 HA ALA B 28 -8.460 -4.491 -10.076 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -10.657 -4.468 -11.254 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -10.879 -4.518 -9.489 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -11.109 -2.990 -10.372 1.00 0.00 H new ATOM 1023 N LYS B 29 -8.652 -1.432 -11.250 1.00 0.00 N ATOM 1024 CA LYS B 29 -8.136 -0.549 -12.292 1.00 0.00 C ATOM 1025 C LYS B 29 -6.615 -0.453 -12.193 1.00 0.00 C ATOM 1026 O LYS B 29 -5.939 -0.314 -13.209 1.00 0.00 O ATOM 1027 CB LYS B 29 -8.776 0.831 -12.138 1.00 0.00 C ATOM 1028 CG LYS B 29 -10.262 0.782 -12.495 1.00 0.00 C ATOM 1029 CD LYS B 29 -11.065 1.730 -11.605 1.00 0.00 C ATOM 1030 CE LYS B 29 -12.566 1.591 -11.872 1.00 0.00 C ATOM 1031 NZ LYS B 29 -12.950 2.215 -13.149 1.00 0.00 N ATOM 0 H LYS B 29 -9.108 -0.944 -10.479 1.00 0.00 H new ATOM 0 HA LYS B 29 -8.386 -0.952 -13.274 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.655 1.181 -11.113 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -8.266 1.548 -12.782 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.399 1.055 -13.541 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -10.635 -0.236 -12.380 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.857 1.515 -10.557 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.753 2.758 -11.788 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -12.837 0.535 -11.886 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -13.125 2.053 -11.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.934 2.546 -13.092 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.324 3.023 -13.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.863 1.518 -13.916 1.00 0.00 H new ATOM 1045 N ILE B 30 -6.068 -0.529 -10.976 1.00 0.00 N ATOM 1046 CA ILE B 30 -4.626 -0.571 -10.770 1.00 0.00 C ATOM 1047 C ILE B 30 -4.097 -1.952 -11.142 1.00 0.00 C ATOM 1048 O ILE B 30 -2.962 -2.081 -11.597 1.00 0.00 O ATOM 1049 CB ILE B 30 -4.318 -0.242 -9.306 1.00 0.00 C ATOM 1050 CG1 ILE B 30 -4.659 1.231 -9.049 1.00 0.00 C ATOM 1051 CG2 ILE B 30 -2.840 -0.489 -8.983 1.00 0.00 C ATOM 1052 CD1 ILE B 30 -4.707 1.534 -7.551 1.00 0.00 C ATOM 0 H ILE B 30 -6.612 -0.563 -10.114 1.00 0.00 H new ATOM 0 HA ILE B 30 -4.134 0.166 -11.405 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.917 -0.890 -8.666 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.915 1.868 -9.528 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.622 1.469 -9.502 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.651 -0.247 -7.937 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.598 -1.537 -9.162 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.218 0.141 -9.619 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.951 2.586 -7.400 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.468 0.913 -7.078 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.736 1.319 -7.105 1.00 0.00 H new ATOM 1064 N GLN B 31 -4.914 -2.992 -10.955 1.00 0.00 N ATOM 1065 CA GLN B 31 -4.544 -4.341 -11.348 1.00 0.00 C ATOM 1066 C GLN B 31 -4.502 -4.453 -12.875 1.00 0.00 C ATOM 1067 O GLN B 31 -3.996 -5.423 -13.431 1.00 0.00 O ATOM 1068 CB GLN B 31 -5.519 -5.345 -10.727 1.00 0.00 C ATOM 1069 CG GLN B 31 -5.011 -6.727 -11.110 1.00 0.00 C ATOM 1070 CD GLN B 31 -5.501 -7.853 -10.215 1.00 0.00 C ATOM 1071 OE1 GLN B 31 -6.642 -7.862 -9.763 1.00 0.00 O ATOM 1072 NE2 GLN B 31 -4.617 -8.813 -9.958 1.00 0.00 N ATOM 0 H GLN B 31 -5.839 -2.918 -10.531 1.00 0.00 H new ATOM 0 HA GLN B 31 -3.545 -4.572 -10.977 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -5.557 -5.231 -9.644 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -6.531 -5.186 -11.100 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -5.313 -6.939 -12.136 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.921 -6.716 -11.094 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.679 -8.763 -10.356 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -4.877 -9.599 -9.363 1.00 0.00 H new ATOM 1081 N ASP B 32 -5.038 -3.442 -13.554 1.00 0.00 N ATOM 1082 CA ASP B 32 -5.026 -3.358 -15.006 1.00 0.00 C ATOM 1083 C ASP B 32 -3.782 -2.618 -15.478 1.00 0.00 C ATOM 1084 O ASP B 32 -3.175 -2.972 -16.488 1.00 0.00 O ATOM 1085 CB ASP B 32 -6.245 -2.553 -15.442 1.00 0.00 C ATOM 1086 CG ASP B 32 -6.774 -3.022 -16.794 1.00 0.00 C ATOM 1087 OD1 ASP B 32 -7.379 -4.116 -16.828 1.00 0.00 O ATOM 1088 OD2 ASP B 32 -6.572 -2.283 -17.782 1.00 0.00 O ATOM 0 H ASP B 32 -5.497 -2.651 -13.103 1.00 0.00 H new ATOM 0 HA ASP B 32 -5.036 -4.363 -15.429 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -7.030 -2.646 -14.692 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.982 -1.497 -15.500 1.00 0.00 H new ATOM 1093 N LYS B 33 -3.419 -1.581 -14.721 1.00 0.00 N ATOM 1094 CA LYS B 33 -2.307 -0.703 -15.036 1.00 0.00 C ATOM 1095 C LYS B 33 -0.956 -1.301 -14.667 1.00 0.00 C ATOM 1096 O LYS B 33 0.036 -1.031 -15.342 1.00 0.00 O ATOM 1097 CB LYS B 33 -2.507 0.586 -14.246 1.00 0.00 C ATOM 1098 CG LYS B 33 -3.630 1.441 -14.828 1.00 0.00 C ATOM 1099 CD LYS B 33 -3.254 1.998 -16.200 1.00 0.00 C ATOM 1100 CE LYS B 33 -4.286 3.049 -16.585 1.00 0.00 C ATOM 1101 NZ LYS B 33 -4.068 3.543 -17.960 1.00 0.00 N ATOM 0 H LYS B 33 -3.902 -1.329 -13.859 1.00 0.00 H new ATOM 0 HA LYS B 33 -2.296 -0.535 -16.113 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.735 0.344 -13.208 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.579 1.158 -14.243 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.538 0.843 -14.913 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.852 2.264 -14.148 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.257 2.437 -16.172 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -3.230 1.199 -16.941 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.287 2.625 -16.504 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.236 3.883 -15.885 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.788 4.257 -18.190 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -3.122 3.970 -18.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.140 2.750 -18.629 1.00 0.00 H new ATOM 1115 N GLU B 34 -0.909 -2.108 -13.606 1.00 0.00 N ATOM 1116 CA GLU B 34 0.342 -2.682 -13.127 1.00 0.00 C ATOM 1117 C GLU B 34 0.258 -4.184 -12.857 1.00 0.00 C ATOM 1118 O GLU B 34 1.284 -4.831 -12.658 1.00 0.00 O ATOM 1119 CB GLU B 34 0.720 -1.971 -11.832 1.00 0.00 C ATOM 1120 CG GLU B 34 1.126 -0.514 -12.056 1.00 0.00 C ATOM 1121 CD GLU B 34 2.394 -0.368 -12.901 1.00 0.00 C ATOM 1122 OE1 GLU B 34 3.247 -1.282 -12.846 1.00 0.00 O ATOM 1123 OE2 GLU B 34 2.501 0.661 -13.604 1.00 0.00 O ATOM 0 H GLU B 34 -1.729 -2.378 -13.062 1.00 0.00 H new ATOM 0 HA GLU B 34 1.089 -2.544 -13.909 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -0.124 -2.007 -11.143 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.543 -2.504 -11.356 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.308 0.014 -12.545 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.283 -0.034 -11.090 1.00 0.00 H new ATOM 1130 N GLY B 35 -0.951 -4.749 -12.847 1.00 0.00 N ATOM 1131 CA GLY B 35 -1.126 -6.177 -12.592 1.00 0.00 C ATOM 1132 C GLY B 35 -0.987 -6.499 -11.107 1.00 0.00 C ATOM 1133 O GLY B 35 -0.821 -7.661 -10.738 1.00 0.00 O ATOM 0 H GLY B 35 -1.819 -4.240 -13.012 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -2.108 -6.493 -12.944 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -0.387 -6.743 -13.159 1.00 0.00 H new ATOM 1137 N ILE B 36 -1.054 -5.473 -10.257 1.00 0.00 N ATOM 1138 CA ILE B 36 -0.881 -5.634 -8.822 1.00 0.00 C ATOM 1139 C ILE B 36 -2.140 -6.274 -8.248 1.00 0.00 C ATOM 1140 O ILE B 36 -3.247 -5.882 -8.614 1.00 0.00 O ATOM 1141 CB ILE B 36 -0.628 -4.266 -8.189 1.00 0.00 C ATOM 1142 CG1 ILE B 36 0.732 -3.749 -8.664 1.00 0.00 C ATOM 1143 CG2 ILE B 36 -0.634 -4.341 -6.659 1.00 0.00 C ATOM 1144 CD1 ILE B 36 0.864 -2.241 -8.434 1.00 0.00 C ATOM 0 H ILE B 36 -1.230 -4.511 -10.548 1.00 0.00 H new ATOM 0 HA ILE B 36 -0.027 -6.276 -8.607 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.428 -3.592 -8.494 1.00 0.00 H new ATOM 0 HG12 ILE B 36 1.528 -4.271 -8.133 1.00 0.00 H new ATOM 0 HG13 ILE B 36 0.858 -3.970 -9.724 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -0.451 -3.349 -6.245 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.603 -4.704 -6.316 1.00 0.00 H new ATOM 0 HG23 ILE B 36 0.148 -5.023 -6.325 1.00 0.00 H new ATOM 0 HD11 ILE B 36 1.841 -1.904 -8.782 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.082 -1.719 -8.986 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.763 -2.025 -7.370 1.00 0.00 H new ATOM 1156 N PRO B 37 -1.988 -7.251 -7.351 1.00 0.00 N ATOM 1157 CA PRO B 37 -3.111 -7.946 -6.758 1.00 0.00 C ATOM 1158 C PRO B 37 -3.824 -7.046 -5.755 1.00 0.00 C ATOM 1159 O PRO B 37 -3.173 -6.410 -4.924 1.00 0.00 O ATOM 1160 CB PRO B 37 -2.495 -9.155 -6.051 1.00 0.00 C ATOM 1161 CG PRO B 37 -1.091 -8.678 -5.698 1.00 0.00 C ATOM 1162 CD PRO B 37 -0.724 -7.763 -6.861 1.00 0.00 C ATOM 0 HA PRO B 37 -3.854 -8.239 -7.500 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.061 -9.432 -5.162 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -2.471 -10.031 -6.699 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -1.075 -8.145 -4.747 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.395 -9.512 -5.608 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -0.070 -6.954 -6.535 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -0.191 -8.309 -7.640 1.00 0.00 H new ATOM 1170 N PRO B 38 -5.161 -6.982 -5.811 1.00 0.00 N ATOM 1171 CA PRO B 38 -5.984 -6.359 -4.785 1.00 0.00 C ATOM 1172 C PRO B 38 -5.670 -6.921 -3.397 1.00 0.00 C ATOM 1173 O PRO B 38 -5.956 -6.275 -2.392 1.00 0.00 O ATOM 1174 CB PRO B 38 -7.433 -6.663 -5.185 1.00 0.00 C ATOM 1175 CG PRO B 38 -7.318 -7.800 -6.199 1.00 0.00 C ATOM 1176 CD PRO B 38 -5.994 -7.507 -6.875 1.00 0.00 C ATOM 0 HA PRO B 38 -5.796 -5.287 -4.722 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -8.029 -6.959 -4.322 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -7.916 -5.789 -5.622 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.319 -8.777 -5.715 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -8.145 -7.796 -6.909 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.562 -8.407 -7.312 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -6.110 -6.785 -7.683 1.00 0.00 H new ATOM 1184 N ASP B 39 -5.083 -8.118 -3.347 1.00 0.00 N ATOM 1185 CA ASP B 39 -4.696 -8.772 -2.105 1.00 0.00 C ATOM 1186 C ASP B 39 -3.411 -8.196 -1.493 1.00 0.00 C ATOM 1187 O ASP B 39 -3.072 -8.545 -0.362 1.00 0.00 O ATOM 1188 CB ASP B 39 -4.548 -10.268 -2.367 1.00 0.00 C ATOM 1189 CG ASP B 39 -4.440 -11.074 -1.076 1.00 0.00 C ATOM 1190 OD1 ASP B 39 -5.351 -10.939 -0.227 1.00 0.00 O ATOM 1191 OD2 ASP B 39 -3.446 -11.823 -0.941 1.00 0.00 O ATOM 0 H ASP B 39 -4.862 -8.663 -4.180 1.00 0.00 H new ATOM 0 HA ASP B 39 -5.480 -8.589 -1.370 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -5.404 -10.620 -2.942 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -3.661 -10.442 -2.977 1.00 0.00 H new ATOM 1196 N GLN B 40 -2.687 -7.322 -2.209 1.00 0.00 N ATOM 1197 CA GLN B 40 -1.490 -6.693 -1.645 1.00 0.00 C ATOM 1198 C GLN B 40 -1.534 -5.174 -1.696 1.00 0.00 C ATOM 1199 O GLN B 40 -0.896 -4.533 -0.865 1.00 0.00 O ATOM 1200 CB GLN B 40 -0.228 -7.173 -2.369 1.00 0.00 C ATOM 1201 CG GLN B 40 -0.098 -8.681 -2.206 1.00 0.00 C ATOM 1202 CD GLN B 40 1.120 -9.262 -2.919 1.00 0.00 C ATOM 1203 OE1 GLN B 40 1.035 -10.316 -3.540 1.00 0.00 O ATOM 1204 NE2 GLN B 40 2.262 -8.588 -2.839 1.00 0.00 N ATOM 0 H GLN B 40 -2.907 -7.040 -3.164 1.00 0.00 H new ATOM 0 HA GLN B 40 -1.464 -6.994 -0.598 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.280 -6.913 -3.426 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.651 -6.674 -1.961 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -0.038 -8.921 -1.144 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -0.998 -9.160 -2.591 1.00 0.00 H new ATOM 0 HE21 GLN B 40 2.303 -7.714 -2.315 1.00 0.00 H new ATOM 0 HE22 GLN B 40 3.098 -8.945 -3.301 1.00 0.00 H new ATOM 1213 N GLN B 41 -2.256 -4.569 -2.636 1.00 0.00 N ATOM 1214 CA GLN B 41 -2.260 -3.117 -2.688 1.00 0.00 C ATOM 1215 C GLN B 41 -3.120 -2.527 -1.576 1.00 0.00 C ATOM 1216 O GLN B 41 -4.089 -3.132 -1.119 1.00 0.00 O ATOM 1217 CB GLN B 41 -2.697 -2.614 -4.060 1.00 0.00 C ATOM 1218 CG GLN B 41 -4.088 -3.100 -4.448 1.00 0.00 C ATOM 1219 CD GLN B 41 -4.442 -2.598 -5.836 1.00 0.00 C ATOM 1220 OE1 GLN B 41 -4.501 -1.394 -6.068 1.00 0.00 O ATOM 1221 NE2 GLN B 41 -4.684 -3.510 -6.774 1.00 0.00 N ATOM 0 H GLN B 41 -2.822 -5.040 -3.342 1.00 0.00 H new ATOM 0 HA GLN B 41 -1.237 -2.776 -2.526 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -2.683 -1.524 -4.064 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -1.978 -2.945 -4.810 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -4.121 -4.189 -4.426 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -4.822 -2.744 -3.725 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -4.626 -4.503 -6.547 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -4.927 -3.216 -7.720 1.00 0.00 H new ATOM 1230 N ARG B 42 -2.736 -1.320 -1.157 1.00 0.00 N ATOM 1231 CA ARG B 42 -3.433 -0.538 -0.150 1.00 0.00 C ATOM 1232 C ARG B 42 -3.480 0.897 -0.654 1.00 0.00 C ATOM 1233 O ARG B 42 -2.515 1.358 -1.260 1.00 0.00 O ATOM 1234 CB ARG B 42 -2.664 -0.593 1.167 1.00 0.00 C ATOM 1235 CG ARG B 42 -2.485 -2.022 1.682 1.00 0.00 C ATOM 1236 CD ARG B 42 -1.557 -2.021 2.895 1.00 0.00 C ATOM 1237 NE ARG B 42 -2.125 -1.239 4.005 1.00 0.00 N ATOM 1238 CZ ARG B 42 -1.933 -1.513 5.299 1.00 0.00 C ATOM 1239 NH1 ARG B 42 -1.199 -2.557 5.676 1.00 0.00 N ATOM 1240 NH2 ARG B 42 -2.482 -0.736 6.230 1.00 0.00 N ATOM 0 H ARG B 42 -1.907 -0.852 -1.523 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.437 -0.927 0.020 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -1.685 -0.134 1.032 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -3.192 -0.003 1.917 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -3.452 -2.445 1.953 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -2.070 -2.653 0.896 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -1.382 -3.046 3.222 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -0.589 -1.607 2.614 1.00 0.00 H new ATOM 0 HE ARG B 42 -2.705 -0.433 3.771 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -0.773 -3.162 4.973 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -1.062 -2.753 6.668 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -3.048 0.067 5.955 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -2.337 -0.943 7.218 1.00 0.00 H new ATOM 1254 N LEU B 43 -4.587 1.605 -0.410 1.00 0.00 N ATOM 1255 CA LEU B 43 -4.762 2.952 -0.931 1.00 0.00 C ATOM 1256 C LEU B 43 -4.946 3.933 0.219 1.00 0.00 C ATOM 1257 O LEU B 43 -5.526 3.598 1.252 1.00 0.00 O ATOM 1258 CB LEU B 43 -5.956 3.019 -1.888 1.00 0.00 C ATOM 1259 CG LEU B 43 -5.699 2.343 -3.239 1.00 0.00 C ATOM 1260 CD1 LEU B 43 -5.819 0.819 -3.177 1.00 0.00 C ATOM 1261 CD2 LEU B 43 -6.738 2.837 -4.241 1.00 0.00 C ATOM 0 H LEU B 43 -5.371 1.263 0.145 1.00 0.00 H new ATOM 0 HA LEU B 43 -3.868 3.225 -1.491 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -6.817 2.549 -1.414 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -6.217 4.064 -2.058 1.00 0.00 H new ATOM 0 HG LEU B 43 -4.680 2.597 -3.531 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -5.626 0.398 -4.164 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -5.092 0.425 -2.466 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -6.824 0.546 -2.856 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -6.566 2.363 -5.207 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -7.736 2.583 -3.885 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -6.655 3.919 -4.348 1.00 0.00 H new ATOM 1273 N ILE B 44 -4.442 5.153 0.022 1.00 0.00 N ATOM 1274 CA ILE B 44 -4.432 6.198 1.032 1.00 0.00 C ATOM 1275 C ILE B 44 -4.570 7.549 0.332 1.00 0.00 C ATOM 1276 O ILE B 44 -4.162 7.686 -0.820 1.00 0.00 O ATOM 1277 CB ILE B 44 -3.112 6.103 1.819 1.00 0.00 C ATOM 1278 CG1 ILE B 44 -2.992 4.734 2.503 1.00 0.00 C ATOM 1279 CG2 ILE B 44 -3.029 7.227 2.851 1.00 0.00 C ATOM 1280 CD1 ILE B 44 -1.742 4.630 3.375 1.00 0.00 C ATOM 0 H ILE B 44 -4.023 5.441 -0.862 1.00 0.00 H new ATOM 0 HA ILE B 44 -5.260 6.085 1.732 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.282 6.211 1.121 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.876 4.558 3.116 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.969 3.952 1.744 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -2.091 7.148 3.400 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.072 8.191 2.344 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.865 7.145 3.546 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -1.702 3.644 3.837 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -0.855 4.778 2.759 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -1.776 5.394 4.152 1.00 0.00 H new ATOM 1292 N PHE B 45 -5.142 8.550 1.016 1.00 0.00 N ATOM 1293 CA PHE B 45 -5.331 9.864 0.409 1.00 0.00 C ATOM 1294 C PHE B 45 -4.983 11.007 1.358 1.00 0.00 C ATOM 1295 O PHE B 45 -4.993 12.174 0.972 1.00 0.00 O ATOM 1296 CB PHE B 45 -6.771 9.937 -0.116 1.00 0.00 C ATOM 1297 CG PHE B 45 -7.210 11.278 -0.657 1.00 0.00 C ATOM 1298 CD1 PHE B 45 -6.453 11.936 -1.638 1.00 0.00 C ATOM 1299 CD2 PHE B 45 -8.391 11.866 -0.179 1.00 0.00 C ATOM 1300 CE1 PHE B 45 -6.871 13.181 -2.123 1.00 0.00 C ATOM 1301 CE2 PHE B 45 -8.807 13.112 -0.667 1.00 0.00 C ATOM 1302 CZ PHE B 45 -8.044 13.772 -1.640 1.00 0.00 C ATOM 0 H PHE B 45 -5.476 8.472 1.977 1.00 0.00 H new ATOM 0 HA PHE B 45 -4.637 9.988 -0.422 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -6.888 9.193 -0.904 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -7.446 9.654 0.692 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -5.549 11.483 -2.018 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -8.982 11.356 0.568 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.285 13.689 -2.875 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -9.714 13.563 -0.294 1.00 0.00 H new ATOM 0 HZ PHE B 45 -8.360 14.734 -2.016 1.00 0.00 H new ATOM 1312 N ALA B 46 -4.672 10.654 2.605 1.00 0.00 N ATOM 1313 CA ALA B 46 -4.291 11.588 3.653 1.00 0.00 C ATOM 1314 C ALA B 46 -3.898 10.830 4.926 1.00 0.00 C ATOM 1315 O ALA B 46 -3.969 11.371 6.028 1.00 0.00 O ATOM 1316 CB ALA B 46 -5.458 12.542 3.918 1.00 0.00 C ATOM 0 H ALA B 46 -4.680 9.683 2.918 1.00 0.00 H new ATOM 0 HA ALA B 46 -3.425 12.167 3.334 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -5.181 13.246 4.703 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -5.695 13.090 3.006 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -6.330 11.970 4.235 1.00 0.00 H new ATOM 1322 N GLY B 47 -3.492 9.567 4.764 1.00 0.00 N ATOM 1323 CA GLY B 47 -3.277 8.637 5.864 1.00 0.00 C ATOM 1324 C GLY B 47 -4.607 8.100 6.392 1.00 0.00 C ATOM 1325 O GLY B 47 -4.623 7.287 7.312 1.00 0.00 O ATOM 0 H GLY B 47 -3.302 9.161 3.848 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.653 7.809 5.528 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -2.737 9.137 6.668 1.00 0.00 H new ATOM 1329 N LYS B 48 -5.721 8.554 5.808 1.00 0.00 N ATOM 1330 CA LYS B 48 -7.065 8.126 6.176 1.00 0.00 C ATOM 1331 C LYS B 48 -7.433 6.832 5.462 1.00 0.00 C ATOM 1332 O LYS B 48 -8.565 6.663 5.015 1.00 0.00 O ATOM 1333 CB LYS B 48 -8.069 9.251 5.910 1.00 0.00 C ATOM 1334 CG LYS B 48 -8.325 9.556 4.431 1.00 0.00 C ATOM 1335 CD LYS B 48 -9.823 9.433 4.135 1.00 0.00 C ATOM 1336 CE LYS B 48 -10.199 10.156 2.841 1.00 0.00 C ATOM 1337 NZ LYS B 48 -10.120 11.624 3.002 1.00 0.00 N ATOM 0 H LYS B 48 -5.708 9.241 5.054 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.094 7.913 7.245 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.017 8.990 6.381 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -7.711 10.159 6.396 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -7.977 10.561 4.191 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -7.762 8.865 3.804 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.094 8.380 4.057 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.394 9.849 4.965 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -9.532 9.840 2.039 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -11.210 9.874 2.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -10.657 12.086 2.241 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -10.522 11.894 3.922 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -9.126 11.925 2.956 1.00 0.00 H new ATOM 1351 N GLN B 49 -6.446 5.937 5.369 1.00 0.00 N ATOM 1352 CA GLN B 49 -6.456 4.700 4.596 1.00 0.00 C ATOM 1353 C GLN B 49 -7.876 4.207 4.316 1.00 0.00 C ATOM 1354 O GLN B 49 -8.593 3.793 5.227 1.00 0.00 O ATOM 1355 CB GLN B 49 -5.586 3.646 5.292 1.00 0.00 C ATOM 1356 CG GLN B 49 -4.387 4.300 5.997 1.00 0.00 C ATOM 1357 CD GLN B 49 -3.290 3.296 6.326 1.00 0.00 C ATOM 1358 OE1 GLN B 49 -3.486 2.083 6.261 1.00 0.00 O ATOM 1359 NE2 GLN B 49 -2.116 3.807 6.683 1.00 0.00 N ATOM 0 H GLN B 49 -5.564 6.069 5.864 1.00 0.00 H new ATOM 0 HA GLN B 49 -6.022 4.898 3.616 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -6.185 3.097 6.019 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -5.231 2.921 4.560 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -3.979 5.085 5.361 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -4.726 4.778 6.916 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -1.992 4.819 6.725 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -1.339 3.188 6.915 1.00 0.00 H new ATOM 1368 N LEU B 50 -8.262 4.267 3.041 1.00 0.00 N ATOM 1369 CA LEU B 50 -9.637 4.082 2.605 1.00 0.00 C ATOM 1370 C LEU B 50 -10.171 2.678 2.903 1.00 0.00 C ATOM 1371 O LEU B 50 -9.406 1.741 3.127 1.00 0.00 O ATOM 1372 CB LEU B 50 -9.754 4.388 1.105 1.00 0.00 C ATOM 1373 CG LEU B 50 -9.303 5.790 0.664 1.00 0.00 C ATOM 1374 CD1 LEU B 50 -9.836 6.878 1.591 1.00 0.00 C ATOM 1375 CD2 LEU B 50 -7.787 5.936 0.580 1.00 0.00 C ATOM 0 H LEU B 50 -7.614 4.449 2.274 1.00 0.00 H new ATOM 0 HA LEU B 50 -10.252 4.779 3.175 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -9.167 3.651 0.558 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -10.794 4.252 0.807 1.00 0.00 H new ATOM 0 HG LEU B 50 -9.721 5.913 -0.335 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -9.494 7.853 1.243 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -10.926 6.855 1.590 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -9.470 6.705 2.603 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -7.536 6.948 0.263 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -7.348 5.742 1.559 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -7.392 5.222 -0.142 1.00 0.00 H new ATOM 1387 N GLU B 51 -11.504 2.555 2.895 1.00 0.00 N ATOM 1388 CA GLU B 51 -12.219 1.305 3.121 1.00 0.00 C ATOM 1389 C GLU B 51 -12.225 0.450 1.854 1.00 0.00 C ATOM 1390 O GLU B 51 -11.329 0.553 1.018 1.00 0.00 O ATOM 1391 CB GLU B 51 -13.647 1.599 3.596 1.00 0.00 C ATOM 1392 CG GLU B 51 -13.595 2.373 4.907 1.00 0.00 C ATOM 1393 CD GLU B 51 -14.989 2.673 5.452 1.00 0.00 C ATOM 1394 OE1 GLU B 51 -15.807 1.726 5.520 1.00 0.00 O ATOM 1395 OE2 GLU B 51 -15.228 3.851 5.803 1.00 0.00 O ATOM 0 H GLU B 51 -12.126 3.346 2.726 1.00 0.00 H new ATOM 0 HA GLU B 51 -11.706 0.740 3.899 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -14.182 2.176 2.841 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -14.196 0.667 3.733 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -13.034 1.799 5.644 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -13.057 3.308 4.754 1.00 0.00 H new ATOM 1402 N ASP B 52 -13.246 -0.395 1.717 1.00 0.00 N ATOM 1403 CA ASP B 52 -13.368 -1.326 0.601 1.00 0.00 C ATOM 1404 C ASP B 52 -14.824 -1.471 0.132 1.00 0.00 C ATOM 1405 O ASP B 52 -15.156 -2.411 -0.587 1.00 0.00 O ATOM 1406 CB ASP B 52 -12.771 -2.672 1.021 1.00 0.00 C ATOM 1407 CG ASP B 52 -12.430 -3.555 -0.179 1.00 0.00 C ATOM 1408 OD1 ASP B 52 -11.518 -3.162 -0.942 1.00 0.00 O ATOM 1409 OD2 ASP B 52 -13.082 -4.612 -0.324 1.00 0.00 O ATOM 0 H ASP B 52 -14.016 -0.452 2.383 1.00 0.00 H new ATOM 0 HA ASP B 52 -12.816 -0.936 -0.254 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -11.870 -2.499 1.610 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -13.478 -3.195 1.665 1.00 0.00 H new ATOM 1414 N GLY B 53 -15.698 -0.540 0.536 1.00 0.00 N ATOM 1415 CA GLY B 53 -17.113 -0.561 0.174 1.00 0.00 C ATOM 1416 C GLY B 53 -17.706 0.848 0.075 1.00 0.00 C ATOM 1417 O GLY B 53 -18.922 1.006 -0.021 1.00 0.00 O ATOM 0 H GLY B 53 -15.438 0.251 1.126 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -17.234 -1.072 -0.781 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -17.668 -1.135 0.916 1.00 0.00 H new ATOM 1421 N ARG B 54 -16.838 1.864 0.104 1.00 0.00 N ATOM 1422 CA ARG B 54 -17.183 3.278 0.020 1.00 0.00 C ATOM 1423 C ARG B 54 -17.120 3.755 -1.430 1.00 0.00 C ATOM 1424 O ARG B 54 -17.175 2.936 -2.343 1.00 0.00 O ATOM 1425 CB ARG B 54 -16.158 4.020 0.866 1.00 0.00 C ATOM 1426 CG ARG B 54 -16.427 3.893 2.358 1.00 0.00 C ATOM 1427 CD ARG B 54 -17.761 4.564 2.685 1.00 0.00 C ATOM 1428 NE ARG B 54 -17.757 5.121 4.038 1.00 0.00 N ATOM 1429 CZ ARG B 54 -18.338 4.562 5.101 1.00 0.00 C ATOM 1430 NH1 ARG B 54 -18.985 3.403 4.998 1.00 0.00 N ATOM 1431 NH2 ARG B 54 -18.274 5.166 6.286 1.00 0.00 N ATOM 0 H ARG B 54 -15.833 1.712 0.191 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.197 3.459 0.378 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -15.163 3.633 0.646 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -16.159 5.074 0.589 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -16.454 2.842 2.647 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -15.622 4.360 2.926 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -17.959 5.357 1.963 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -18.569 3.838 2.590 1.00 0.00 H new ATOM 0 HE ARG B 54 -17.272 6.007 4.180 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -19.042 2.929 4.097 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -19.424 2.989 5.820 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -17.782 6.054 6.380 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -18.718 4.740 7.100 1.00 0.00 H new ATOM 1445 N THR B 55 -17.004 5.070 -1.652 1.00 0.00 N ATOM 1446 CA THR B 55 -16.934 5.628 -3.001 1.00 0.00 C ATOM 1447 C THR B 55 -16.006 6.830 -3.044 1.00 0.00 C ATOM 1448 O THR B 55 -15.716 7.434 -2.018 1.00 0.00 O ATOM 1449 CB THR B 55 -18.316 6.073 -3.481 1.00 0.00 C ATOM 1450 OG1 THR B 55 -18.921 6.905 -2.520 1.00 0.00 O ATOM 1451 CG2 THR B 55 -19.193 4.863 -3.746 1.00 0.00 C ATOM 0 H THR B 55 -16.957 5.767 -0.909 1.00 0.00 H new ATOM 0 HA THR B 55 -16.552 4.842 -3.653 1.00 0.00 H new ATOM 0 HB THR B 55 -18.199 6.634 -4.408 1.00 0.00 H new ATOM 0 HG1 THR B 55 -19.804 7.185 -2.839 1.00 0.00 H new ATOM 0 HG21 THR B 55 -20.174 5.193 -4.087 1.00 0.00 H new ATOM 0 HG22 THR B 55 -18.732 4.241 -4.513 1.00 0.00 H new ATOM 0 HG23 THR B 55 -19.303 4.285 -2.828 1.00 0.00 H new ATOM 1459 N LEU B 56 -15.543 7.179 -4.248 1.00 0.00 N ATOM 1460 CA LEU B 56 -14.607 8.279 -4.447 1.00 0.00 C ATOM 1461 C LEU B 56 -15.217 9.563 -3.893 1.00 0.00 C ATOM 1462 O LEU B 56 -14.538 10.382 -3.275 1.00 0.00 O ATOM 1463 CB LEU B 56 -14.352 8.450 -5.950 1.00 0.00 C ATOM 1464 CG LEU B 56 -13.526 7.342 -6.618 1.00 0.00 C ATOM 1465 CD1 LEU B 56 -12.050 7.507 -6.260 1.00 0.00 C ATOM 1466 CD2 LEU B 56 -13.961 5.921 -6.255 1.00 0.00 C ATOM 0 H LEU B 56 -15.810 6.704 -5.110 1.00 0.00 H new ATOM 0 HA LEU B 56 -13.670 8.066 -3.933 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.314 8.516 -6.457 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.843 9.401 -6.107 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.696 7.459 -7.688 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -11.469 6.718 -6.737 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -11.697 8.478 -6.608 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -11.929 7.444 -5.179 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.324 5.203 -6.771 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -13.872 5.777 -5.178 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.997 5.769 -6.557 1.00 0.00 H new ATOM 1478 N SER B 57 -16.521 9.719 -4.124 1.00 0.00 N ATOM 1479 CA SER B 57 -17.313 10.835 -3.625 1.00 0.00 C ATOM 1480 C SER B 57 -17.299 10.903 -2.101 1.00 0.00 C ATOM 1481 O SER B 57 -17.367 11.991 -1.530 1.00 0.00 O ATOM 1482 CB SER B 57 -18.753 10.657 -4.103 1.00 0.00 C ATOM 1483 OG SER B 57 -19.496 11.834 -3.856 1.00 0.00 O ATOM 0 H SER B 57 -17.065 9.056 -4.676 1.00 0.00 H new ATOM 0 HA SER B 57 -16.882 11.761 -4.005 1.00 0.00 H new ATOM 0 HB2 SER B 57 -18.765 10.427 -5.168 1.00 0.00 H new ATOM 0 HB3 SER B 57 -19.213 9.813 -3.590 1.00 0.00 H new ATOM 0 HG SER B 57 -20.417 11.711 -4.167 1.00 0.00 H new ATOM 1489 N ASP B 58 -17.211 9.748 -1.434 1.00 0.00 N ATOM 1490 CA ASP B 58 -17.208 9.685 0.023 1.00 0.00 C ATOM 1491 C ASP B 58 -15.977 10.372 0.619 1.00 0.00 C ATOM 1492 O ASP B 58 -15.955 10.666 1.813 1.00 0.00 O ATOM 1493 CB ASP B 58 -17.270 8.230 0.487 1.00 0.00 C ATOM 1494 CG ASP B 58 -17.575 8.141 1.982 1.00 0.00 C ATOM 1495 OD1 ASP B 58 -18.695 8.552 2.364 1.00 0.00 O ATOM 1496 OD2 ASP B 58 -16.693 7.664 2.730 1.00 0.00 O ATOM 0 H ASP B 58 -17.140 8.838 -1.889 1.00 0.00 H new ATOM 0 HA ASP B 58 -18.090 10.218 0.378 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.037 7.698 -0.076 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.321 7.737 0.277 1.00 0.00 H new ATOM 1501 N TYR B 59 -14.956 10.630 -0.205 1.00 0.00 N ATOM 1502 CA TYR B 59 -13.735 11.279 0.239 1.00 0.00 C ATOM 1503 C TYR B 59 -13.547 12.634 -0.444 1.00 0.00 C ATOM 1504 O TYR B 59 -12.489 13.246 -0.319 1.00 0.00 O ATOM 1505 CB TYR B 59 -12.552 10.371 -0.086 1.00 0.00 C ATOM 1506 CG TYR B 59 -12.858 8.895 -0.133 1.00 0.00 C ATOM 1507 CD1 TYR B 59 -13.121 8.171 1.035 1.00 0.00 C ATOM 1508 CD2 TYR B 59 -12.870 8.248 -1.375 1.00 0.00 C ATOM 1509 CE1 TYR B 59 -13.369 6.798 0.969 1.00 0.00 C ATOM 1510 CE2 TYR B 59 -13.104 6.873 -1.451 1.00 0.00 C ATOM 1511 CZ TYR B 59 -13.359 6.145 -0.274 1.00 0.00 C ATOM 1512 OH TYR B 59 -13.591 4.813 -0.340 1.00 0.00 O ATOM 0 H TYR B 59 -14.961 10.392 -1.197 1.00 0.00 H new ATOM 0 HA TYR B 59 -13.799 11.452 1.313 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -12.142 10.670 -1.051 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -11.773 10.539 0.658 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -13.132 8.675 1.990 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -12.698 8.815 -2.278 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -13.568 6.240 1.872 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -13.089 6.372 -2.407 1.00 0.00 H new ATOM 0 HH TYR B 59 -14.012 4.596 -1.198 1.00 0.00 H new ATOM 1522 N ASN B 60 -14.573 13.099 -1.165 1.00 0.00 N ATOM 1523 CA ASN B 60 -14.512 14.289 -1.998 1.00 0.00 C ATOM 1524 C ASN B 60 -13.315 14.245 -2.954 1.00 0.00 C ATOM 1525 O ASN B 60 -12.795 15.282 -3.365 1.00 0.00 O ATOM 1526 CB ASN B 60 -14.540 15.538 -1.117 1.00 0.00 C ATOM 1527 CG ASN B 60 -14.818 16.791 -1.940 1.00 0.00 C ATOM 1528 OD1 ASN B 60 -15.805 16.854 -2.669 1.00 0.00 O ATOM 1529 ND2 ASN B 60 -13.956 17.797 -1.831 1.00 0.00 N ATOM 0 H ASN B 60 -15.485 12.643 -1.181 1.00 0.00 H new ATOM 0 HA ASN B 60 -15.392 14.326 -2.640 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -15.306 15.427 -0.350 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -13.585 15.643 -0.602 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -14.104 18.655 -2.362 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -13.147 17.711 -1.216 1.00 0.00 H new ATOM 1536 N ILE B 61 -12.881 13.034 -3.305 1.00 0.00 N ATOM 1537 CA ILE B 61 -11.819 12.823 -4.276 1.00 0.00 C ATOM 1538 C ILE B 61 -12.308 13.227 -5.663 1.00 0.00 C ATOM 1539 O ILE B 61 -13.339 12.745 -6.136 1.00 0.00 O ATOM 1540 CB ILE B 61 -11.380 11.353 -4.226 1.00 0.00 C ATOM 1541 CG1 ILE B 61 -10.343 11.239 -3.103 1.00 0.00 C ATOM 1542 CG2 ILE B 61 -10.784 10.891 -5.554 1.00 0.00 C ATOM 1543 CD1 ILE B 61 -9.932 9.794 -2.833 1.00 0.00 C ATOM 0 H ILE B 61 -13.262 12.170 -2.919 1.00 0.00 H new ATOM 0 HA ILE B 61 -10.954 13.442 -4.039 1.00 0.00 H new ATOM 0 HB ILE B 61 -12.242 10.712 -4.039 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -9.460 11.821 -3.367 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -10.751 11.674 -2.191 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.486 9.845 -5.475 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.528 10.998 -6.343 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -9.912 11.499 -5.793 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -9.196 9.769 -2.029 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -10.808 9.215 -2.541 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -9.498 9.364 -3.736 1.00 0.00 H new ATOM 1555 N GLN B 62 -11.556 14.116 -6.313 1.00 0.00 N ATOM 1556 CA GLN B 62 -11.818 14.541 -7.674 1.00 0.00 C ATOM 1557 C GLN B 62 -10.967 13.716 -8.637 1.00 0.00 C ATOM 1558 O GLN B 62 -10.139 12.909 -8.219 1.00 0.00 O ATOM 1559 CB GLN B 62 -11.502 16.029 -7.828 1.00 0.00 C ATOM 1560 CG GLN B 62 -12.150 16.827 -6.697 1.00 0.00 C ATOM 1561 CD GLN B 62 -13.661 16.634 -6.630 1.00 0.00 C ATOM 1562 OE1 GLN B 62 -14.352 16.687 -7.643 1.00 0.00 O ATOM 1563 NE2 GLN B 62 -14.181 16.402 -5.429 1.00 0.00 N ATOM 0 H GLN B 62 -10.739 14.563 -5.897 1.00 0.00 H new ATOM 0 HA GLN B 62 -12.872 14.385 -7.905 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -10.423 16.182 -7.818 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -11.866 16.388 -8.791 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -11.707 16.528 -5.747 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -11.929 17.886 -6.832 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -13.575 16.365 -4.609 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -15.186 16.261 -5.327 1.00 0.00 H new ATOM 1572 N LYS B 63 -11.183 13.928 -9.934 1.00 0.00 N ATOM 1573 CA LYS B 63 -10.569 13.155 -11.005 1.00 0.00 C ATOM 1574 C LYS B 63 -9.087 13.404 -11.225 1.00 0.00 C ATOM 1575 O LYS B 63 -8.474 12.774 -12.074 1.00 0.00 O ATOM 1576 CB LYS B 63 -11.315 13.481 -12.276 1.00 0.00 C ATOM 1577 CG LYS B 63 -11.075 14.931 -12.682 1.00 0.00 C ATOM 1578 CD LYS B 63 -12.092 15.345 -13.732 1.00 0.00 C ATOM 1579 CE LYS B 63 -13.477 15.531 -13.108 1.00 0.00 C ATOM 1580 NZ LYS B 63 -14.461 15.997 -14.107 1.00 0.00 N ATOM 0 H LYS B 63 -11.806 14.661 -10.275 1.00 0.00 H new ATOM 0 HA LYS B 63 -10.638 12.106 -10.715 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -10.990 12.815 -13.076 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -12.382 13.310 -12.132 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -11.154 15.580 -11.810 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -10.065 15.046 -13.075 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -11.774 16.274 -14.205 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -12.140 14.589 -14.515 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -13.813 14.588 -12.677 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -13.416 16.251 -12.292 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -15.389 16.113 -13.652 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -14.151 16.909 -14.500 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -14.536 15.297 -14.873 1.00 0.00 H new ATOM 1594 N GLU B 64 -8.530 14.322 -10.454 1.00 0.00 N ATOM 1595 CA GLU B 64 -7.102 14.627 -10.456 1.00 0.00 C ATOM 1596 C GLU B 64 -6.563 14.765 -9.032 1.00 0.00 C ATOM 1597 O GLU B 64 -5.442 15.235 -8.843 1.00 0.00 O ATOM 1598 CB GLU B 64 -6.813 15.925 -11.223 1.00 0.00 C ATOM 1599 CG GLU B 64 -7.653 16.080 -12.487 1.00 0.00 C ATOM 1600 CD GLU B 64 -7.198 17.290 -13.301 1.00 0.00 C ATOM 1601 OE1 GLU B 64 -7.639 18.413 -12.969 1.00 0.00 O ATOM 1602 OE2 GLU B 64 -6.412 17.087 -14.252 1.00 0.00 O ATOM 0 H GLU B 64 -9.064 14.889 -9.795 1.00 0.00 H new ATOM 0 HA GLU B 64 -6.602 13.795 -10.952 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -6.997 16.775 -10.566 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -5.757 15.953 -11.491 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -7.573 15.178 -13.094 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -8.703 16.192 -12.219 1.00 0.00 H new ATOM 1609 N SER B 65 -7.350 14.366 -8.024 1.00 0.00 N ATOM 1610 CA SER B 65 -6.973 14.605 -6.631 1.00 0.00 C ATOM 1611 C SER B 65 -5.703 13.879 -6.189 1.00 0.00 C ATOM 1612 O SER B 65 -5.179 14.200 -5.126 1.00 0.00 O ATOM 1613 CB SER B 65 -8.125 14.234 -5.704 1.00 0.00 C ATOM 1614 OG SER B 65 -9.104 15.247 -5.768 1.00 0.00 O ATOM 0 H SER B 65 -8.240 13.883 -8.147 1.00 0.00 H new ATOM 0 HA SER B 65 -6.753 15.670 -6.565 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.553 13.276 -5.999 1.00 0.00 H new ATOM 0 HB3 SER B 65 -7.765 14.121 -4.681 1.00 0.00 H new ATOM 0 HG SER B 65 -9.452 15.423 -4.869 1.00 0.00 H new ATOM 1620 N THR B 66 -5.210 12.917 -6.980 1.00 0.00 N ATOM 1621 CA THR B 66 -4.027 12.115 -6.665 1.00 0.00 C ATOM 1622 C THR B 66 -4.246 11.262 -5.410 1.00 0.00 C ATOM 1623 O THR B 66 -5.044 11.599 -4.539 1.00 0.00 O ATOM 1624 CB THR B 66 -2.812 13.045 -6.499 1.00 0.00 C ATOM 1625 OG1 THR B 66 -2.669 13.838 -7.656 1.00 0.00 O ATOM 1626 CG2 THR B 66 -1.491 12.307 -6.271 1.00 0.00 C ATOM 0 H THR B 66 -5.633 12.672 -7.875 1.00 0.00 H new ATOM 0 HA THR B 66 -3.840 11.425 -7.488 1.00 0.00 H new ATOM 0 HB THR B 66 -3.012 13.643 -5.610 1.00 0.00 H new ATOM 0 HG1 THR B 66 -1.897 14.432 -7.552 1.00 0.00 H new ATOM 0 HG21 THR B 66 -0.683 13.031 -6.164 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.562 11.706 -5.365 1.00 0.00 H new ATOM 0 HG23 THR B 66 -1.285 11.658 -7.122 1.00 0.00 H new ATOM 1634 N LEU B 67 -3.525 10.143 -5.316 1.00 0.00 N ATOM 1635 CA LEU B 67 -3.542 9.243 -4.169 1.00 0.00 C ATOM 1636 C LEU B 67 -2.164 8.596 -4.056 1.00 0.00 C ATOM 1637 O LEU B 67 -1.255 8.916 -4.821 1.00 0.00 O ATOM 1638 CB LEU B 67 -4.602 8.142 -4.330 1.00 0.00 C ATOM 1639 CG LEU B 67 -6.036 8.620 -4.072 1.00 0.00 C ATOM 1640 CD1 LEU B 67 -6.729 8.987 -5.382 1.00 0.00 C ATOM 1641 CD2 LEU B 67 -6.829 7.484 -3.425 1.00 0.00 C ATOM 0 H LEU B 67 -2.897 9.832 -6.058 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.788 9.815 -3.275 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.540 7.736 -5.340 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.372 7.326 -3.644 1.00 0.00 H new ATOM 0 HG LEU B 67 -5.996 9.495 -3.424 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -7.745 9.323 -5.174 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -6.176 9.786 -5.875 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -6.762 8.114 -6.033 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.851 7.814 -3.237 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -6.843 6.623 -4.094 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -6.360 7.204 -2.482 1.00 0.00 H new ATOM 1653 N HIS B 68 -2.009 7.678 -3.104 1.00 0.00 N ATOM 1654 CA HIS B 68 -0.771 6.944 -2.933 1.00 0.00 C ATOM 1655 C HIS B 68 -1.074 5.456 -2.938 1.00 0.00 C ATOM 1656 O HIS B 68 -2.217 5.039 -2.751 1.00 0.00 O ATOM 1657 CB HIS B 68 -0.106 7.343 -1.619 1.00 0.00 C ATOM 1658 CG HIS B 68 0.313 8.788 -1.596 1.00 0.00 C ATOM 1659 ND1 HIS B 68 -0.402 9.831 -1.001 1.00 0.00 N ATOM 1660 CD2 HIS B 68 1.454 9.281 -2.158 1.00 0.00 C ATOM 1661 CE1 HIS B 68 0.331 10.933 -1.222 1.00 0.00 C ATOM 1662 NE2 HIS B 68 1.446 10.636 -1.914 1.00 0.00 N ATOM 0 H HIS B 68 -2.738 7.428 -2.436 1.00 0.00 H new ATOM 0 HA HIS B 68 -0.089 7.178 -3.750 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.796 7.156 -0.796 1.00 0.00 H new ATOM 0 HB3 HIS B 68 0.768 6.713 -1.453 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.211 8.721 -2.687 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.062 11.925 -0.889 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.162 11.300 -2.207 1.00 0.00 H new ATOM 1670 N LEU B 69 -0.030 4.661 -3.151 1.00 0.00 N ATOM 1671 CA LEU B 69 -0.140 3.220 -3.149 1.00 0.00 C ATOM 1672 C LEU B 69 0.990 2.661 -2.303 1.00 0.00 C ATOM 1673 O LEU B 69 2.122 3.137 -2.388 1.00 0.00 O ATOM 1674 CB LEU B 69 -0.073 2.722 -4.594 1.00 0.00 C ATOM 1675 CG LEU B 69 -0.788 1.384 -4.777 1.00 0.00 C ATOM 1676 CD1 LEU B 69 -2.295 1.563 -4.606 1.00 0.00 C ATOM 1677 CD2 LEU B 69 -0.515 0.865 -6.186 1.00 0.00 C ATOM 0 H LEU B 69 0.913 5.005 -3.329 1.00 0.00 H new ATOM 0 HA LEU B 69 -1.087 2.888 -2.723 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.521 3.465 -5.254 1.00 0.00 H new ATOM 0 HB3 LEU B 69 0.970 2.619 -4.893 1.00 0.00 H new ATOM 0 HG LEU B 69 -0.421 0.679 -4.031 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -2.793 0.602 -4.739 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -2.505 1.946 -3.607 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -2.664 2.269 -5.350 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -1.021 -0.090 -6.326 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -0.886 1.583 -6.917 1.00 0.00 H new ATOM 0 HD23 LEU B 69 0.558 0.730 -6.323 1.00 0.00 H new ATOM 1689 N VAL B 70 0.678 1.652 -1.492 1.00 0.00 N ATOM 1690 CA VAL B 70 1.637 1.068 -0.570 1.00 0.00 C ATOM 1691 C VAL B 70 1.345 -0.426 -0.430 1.00 0.00 C ATOM 1692 O VAL B 70 0.618 -0.868 0.457 1.00 0.00 O ATOM 1693 CB VAL B 70 1.654 1.865 0.744 1.00 0.00 C ATOM 1694 CG1 VAL B 70 0.258 2.144 1.311 1.00 0.00 C ATOM 1695 CG2 VAL B 70 2.528 1.173 1.789 1.00 0.00 C ATOM 0 H VAL B 70 -0.246 1.221 -1.459 1.00 0.00 H new ATOM 0 HA VAL B 70 2.657 1.137 -0.949 1.00 0.00 H new ATOM 0 HB VAL B 70 2.085 2.836 0.499 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.348 2.710 2.238 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.320 2.721 0.589 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.249 1.200 1.510 1.00 0.00 H new ATOM 0 HG21 VAL B 70 2.524 1.756 2.710 1.00 0.00 H new ATOM 0 HG22 VAL B 70 2.136 0.176 1.989 1.00 0.00 H new ATOM 0 HG23 VAL B 70 3.548 1.093 1.414 1.00 0.00 H new ATOM 1705 N LEU B 71 1.939 -1.194 -1.346 1.00 0.00 N ATOM 1706 CA LEU B 71 1.713 -2.621 -1.507 1.00 0.00 C ATOM 1707 C LEU B 71 2.220 -3.440 -0.325 1.00 0.00 C ATOM 1708 O LEU B 71 3.029 -2.963 0.473 1.00 0.00 O ATOM 1709 CB LEU B 71 2.447 -3.093 -2.769 1.00 0.00 C ATOM 1710 CG LEU B 71 2.191 -2.210 -3.992 1.00 0.00 C ATOM 1711 CD1 LEU B 71 2.830 -2.856 -5.219 1.00 0.00 C ATOM 1712 CD2 LEU B 71 0.694 -2.044 -4.230 1.00 0.00 C ATOM 0 H LEU B 71 2.612 -0.821 -2.016 1.00 0.00 H new ATOM 0 HA LEU B 71 0.636 -2.774 -1.578 1.00 0.00 H new ATOM 0 HB2 LEU B 71 3.518 -3.119 -2.568 1.00 0.00 H new ATOM 0 HB3 LEU B 71 2.140 -4.114 -2.997 1.00 0.00 H new ATOM 0 HG LEU B 71 2.628 -1.227 -3.815 1.00 0.00 H new ATOM 0 HD11 LEU B 71 2.651 -2.231 -6.094 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.903 -2.958 -5.059 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.392 -3.841 -5.381 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.532 -1.413 -5.104 1.00 0.00 H new ATOM 0 HD22 LEU B 71 0.242 -3.021 -4.399 1.00 0.00 H new ATOM 0 HD23 LEU B 71 0.236 -1.579 -3.357 1.00 0.00 H new ATOM 1724 N ARG B 72 1.744 -4.684 -0.222 1.00 0.00 N ATOM 1725 CA ARG B 72 2.289 -5.665 0.700 1.00 0.00 C ATOM 1726 C ARG B 72 3.337 -6.463 -0.078 1.00 0.00 C ATOM 1727 O ARG B 72 3.298 -6.482 -1.307 1.00 0.00 O ATOM 1728 CB ARG B 72 1.151 -6.568 1.185 1.00 0.00 C ATOM 1729 CG ARG B 72 0.140 -5.770 2.011 1.00 0.00 C ATOM 1730 CD ARG B 72 -1.041 -6.646 2.428 1.00 0.00 C ATOM 1731 NE ARG B 72 -0.648 -7.652 3.420 1.00 0.00 N ATOM 1732 CZ ARG B 72 -1.394 -8.713 3.737 1.00 0.00 C ATOM 1733 NH1 ARG B 72 -2.548 -8.948 3.117 1.00 0.00 N ATOM 1734 NH2 ARG B 72 -0.985 -9.551 4.685 1.00 0.00 N ATOM 0 H ARG B 72 0.966 -5.033 -0.782 1.00 0.00 H new ATOM 0 HA ARG B 72 2.747 -5.204 1.575 1.00 0.00 H new ATOM 0 HB2 ARG B 72 0.651 -7.022 0.329 1.00 0.00 H new ATOM 0 HB3 ARG B 72 1.557 -7.382 1.786 1.00 0.00 H new ATOM 0 HG2 ARG B 72 0.628 -5.366 2.898 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -0.220 -4.921 1.430 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -1.832 -6.019 2.840 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -1.453 -7.143 1.550 1.00 0.00 H new ATOM 0 HE ARG B 72 0.247 -7.534 3.895 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -2.874 -8.313 2.388 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -3.106 -9.763 3.371 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -0.103 -9.383 5.169 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -1.553 -10.362 4.929 1.00 0.00 H new ATOM 1748 N LEU B 73 4.266 -7.122 0.615 1.00 0.00 N ATOM 1749 CA LEU B 73 5.297 -7.942 -0.020 1.00 0.00 C ATOM 1750 C LEU B 73 5.183 -9.380 0.473 1.00 0.00 C ATOM 1751 O LEU B 73 5.773 -10.287 -0.111 1.00 0.00 O ATOM 1752 CB LEU B 73 6.697 -7.401 0.276 1.00 0.00 C ATOM 1753 CG LEU B 73 7.115 -6.218 -0.608 1.00 0.00 C ATOM 1754 CD1 LEU B 73 6.382 -4.925 -0.258 1.00 0.00 C ATOM 1755 CD2 LEU B 73 8.611 -5.983 -0.407 1.00 0.00 C ATOM 0 H LEU B 73 4.325 -7.102 1.633 1.00 0.00 H new ATOM 0 HA LEU B 73 5.143 -7.909 -1.099 1.00 0.00 H new ATOM 0 HB2 LEU B 73 6.742 -7.093 1.321 1.00 0.00 H new ATOM 0 HB3 LEU B 73 7.420 -8.207 0.150 1.00 0.00 H new ATOM 0 HG LEU B 73 6.865 -6.471 -1.638 1.00 0.00 H new ATOM 0 HD11 LEU B 73 6.720 -4.125 -0.917 1.00 0.00 H new ATOM 0 HD12 LEU B 73 5.309 -5.070 -0.384 1.00 0.00 H new ATOM 0 HD13 LEU B 73 6.593 -4.656 0.777 1.00 0.00 H new ATOM 0 HD21 LEU B 73 8.934 -5.146 -1.025 1.00 0.00 H new ATOM 0 HD22 LEU B 73 8.806 -5.756 0.641 1.00 0.00 H new ATOM 0 HD23 LEU B 73 9.162 -6.879 -0.693 1.00 0.00 H new