USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 844 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 13 ASN : amide:sc= -0.688 X(o=-0.69,f=-1.1!) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0 USER MOD Set 2.2: C 21 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 13 ASN : amide:sc= -0.406 K(o=-0.41,f=-1.4!) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 21 THR OG1 : rot -70:sc= 0.00118 USER MOD Single : A 1 MET CE :methyl 179:sc= 0 (180deg=-0.00159) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -160:sc= -0.0798 (180deg=-0.469) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.55 X(o=-0.55,f=-0.27) USER MOD Single : A 29 GLN :FLIP amide:sc= 0 F(o=-0.64,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.0575 K(o=-0.058,f=-1.9) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -1.26 K(o=-1.3,f=-2.1) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.908 K(o=0.91,f=0) USER MOD Single : C 1 MET CE :methyl 174:sc= 0 (180deg=-0.0184) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0.00307 USER MOD Single : C 7 LYS NZ :NH3+ -161:sc= -0.0903 (180deg=-0.407) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= -0.242 K(o=-0.24,f=-1.5) USER MOD Single : C 29 GLN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : C 35 ASN : amide:sc= -0.0429 K(o=-0.043,f=-1.9) USER MOD Single : C 38 LYS NZ :NH3+ -169:sc= -0.0101 (180deg=-0.155) USER MOD Single : C 43 HIS : no HE2:sc= -1.22 K(o=-1.2,f=-2.1) USER MOD Single : C 48 TYR OH : rot -1:sc= 1.17 USER MOD Single : C 49 GLN : amide:sc= 0.839 K(o=0.84,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.961 2.954 -1.778 1.00 0.00 N ATOM 2 CA MET A 1 -11.996 2.376 -0.820 1.00 0.00 C ATOM 3 C MET A 1 -12.013 0.861 -0.886 1.00 0.00 C ATOM 4 O MET A 1 -13.079 0.258 -0.810 1.00 0.00 O ATOM 5 CB MET A 1 -12.317 2.801 0.611 1.00 0.00 C ATOM 6 CG MET A 1 -11.410 2.104 1.623 1.00 0.00 C ATOM 7 SD MET A 1 -9.683 2.619 1.566 1.00 0.00 S ATOM 8 CE MET A 1 -9.858 4.117 2.561 1.00 0.00 C ATOM 0 H1 MET A 1 -12.933 3.992 -1.716 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.712 2.658 -2.743 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.919 2.620 -1.550 1.00 0.00 H new ATOM 0 HA MET A 1 -11.009 2.748 -1.097 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.204 3.881 0.704 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.358 2.569 0.835 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.797 2.288 2.625 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.460 1.028 1.455 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.885 4.596 2.671 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.547 4.803 2.068 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.248 3.857 3.545 1.00 0.00 H new ATOM 20 N LEU A 2 -10.842 0.241 -1.020 1.00 0.00 N ATOM 21 CA LEU A 2 -10.707 -1.205 -0.990 1.00 0.00 C ATOM 22 C LEU A 2 -9.579 -1.533 -0.011 1.00 0.00 C ATOM 23 O LEU A 2 -8.420 -1.216 -0.266 1.00 0.00 O ATOM 24 CB LEU A 2 -10.452 -1.702 -2.418 1.00 0.00 C ATOM 25 CG LEU A 2 -10.554 -3.222 -2.621 1.00 0.00 C ATOM 26 CD1 LEU A 2 -9.158 -3.817 -2.676 1.00 0.00 C ATOM 27 CD2 LEU A 2 -11.324 -3.962 -1.528 1.00 0.00 C ATOM 0 H LEU A 2 -9.959 0.734 -1.153 1.00 0.00 H new ATOM 0 HA LEU A 2 -11.608 -1.712 -0.644 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -11.164 -1.216 -3.085 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -9.457 -1.379 -2.724 1.00 0.00 H new ATOM 0 HG LEU A 2 -11.107 -3.352 -3.551 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -9.227 -4.895 -2.820 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -8.606 -3.375 -3.506 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -8.637 -3.609 -1.742 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -11.344 -5.028 -1.755 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -10.833 -3.805 -0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -12.344 -3.582 -1.481 1.00 0.00 H new ATOM 39 N ILE A 3 -9.933 -2.168 1.112 1.00 0.00 N ATOM 40 CA ILE A 3 -8.985 -2.534 2.151 1.00 0.00 C ATOM 41 C ILE A 3 -8.404 -3.911 1.854 1.00 0.00 C ATOM 42 O ILE A 3 -9.102 -4.791 1.350 1.00 0.00 O ATOM 43 CB ILE A 3 -9.661 -2.563 3.537 1.00 0.00 C ATOM 44 CG1 ILE A 3 -10.077 -1.166 4.013 1.00 0.00 C ATOM 45 CG2 ILE A 3 -8.665 -3.109 4.570 1.00 0.00 C ATOM 46 CD1 ILE A 3 -11.468 -0.785 3.517 1.00 0.00 C ATOM 0 H ILE A 3 -10.894 -2.441 1.319 1.00 0.00 H new ATOM 0 HA ILE A 3 -8.193 -1.785 2.163 1.00 0.00 H new ATOM 0 HB ILE A 3 -10.549 -3.188 3.445 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -10.059 -1.134 5.102 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.352 -0.432 3.660 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.136 -3.132 5.553 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -8.364 -4.118 4.288 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -7.786 -2.465 4.604 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -11.722 0.212 3.877 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -11.480 -0.791 2.427 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.197 -1.503 3.892 1.00 0.00 H new ATOM 58 N LEU A 4 -7.121 -4.082 2.174 1.00 0.00 N ATOM 59 CA LEU A 4 -6.435 -5.359 2.105 1.00 0.00 C ATOM 60 C LEU A 4 -5.472 -5.442 3.286 1.00 0.00 C ATOM 61 O LEU A 4 -4.756 -4.481 3.570 1.00 0.00 O ATOM 62 CB LEU A 4 -5.674 -5.481 0.781 1.00 0.00 C ATOM 63 CG LEU A 4 -6.598 -5.533 -0.444 1.00 0.00 C ATOM 64 CD1 LEU A 4 -5.774 -5.493 -1.731 1.00 0.00 C ATOM 65 CD2 LEU A 4 -7.432 -6.815 -0.460 1.00 0.00 C ATOM 0 H LEU A 4 -6.524 -3.319 2.493 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.154 -6.177 2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.995 -4.634 0.680 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.060 -6.381 0.804 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.259 -4.669 -0.384 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.442 -5.531 -2.592 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.193 -4.571 -1.762 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.099 -6.349 -1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -8.075 -6.820 -1.340 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.769 -7.680 -0.490 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -8.047 -6.860 0.439 1.00 0.00 H new ATOM 77 N THR A 5 -5.448 -6.585 3.974 1.00 0.00 N ATOM 78 CA THR A 5 -4.532 -6.790 5.091 1.00 0.00 C ATOM 79 C THR A 5 -3.287 -7.510 4.597 1.00 0.00 C ATOM 80 O THR A 5 -3.363 -8.367 3.717 1.00 0.00 O ATOM 81 CB THR A 5 -5.191 -7.618 6.196 1.00 0.00 C ATOM 82 OG1 THR A 5 -5.709 -8.817 5.664 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.317 -6.835 6.858 1.00 0.00 C ATOM 0 H THR A 5 -6.054 -7.381 3.775 1.00 0.00 H new ATOM 0 HA THR A 5 -4.265 -5.816 5.501 1.00 0.00 H new ATOM 0 HB THR A 5 -4.431 -7.849 6.943 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.127 -9.339 6.380 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.772 -7.443 7.640 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.916 -5.921 7.295 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.070 -6.581 6.113 1.00 0.00 H new ATOM 91 N ARG A 6 -2.131 -7.157 5.170 1.00 0.00 N ATOM 92 CA ARG A 6 -0.851 -7.750 4.809 1.00 0.00 C ATOM 93 C ARG A 6 0.054 -7.838 6.029 1.00 0.00 C ATOM 94 O ARG A 6 0.149 -6.880 6.790 1.00 0.00 O ATOM 95 CB ARG A 6 -0.166 -6.861 3.766 1.00 0.00 C ATOM 96 CG ARG A 6 -0.850 -6.839 2.399 1.00 0.00 C ATOM 97 CD ARG A 6 -0.564 -8.104 1.586 1.00 0.00 C ATOM 98 NE ARG A 6 -1.309 -9.270 2.065 1.00 0.00 N ATOM 99 CZ ARG A 6 -1.301 -10.457 1.453 1.00 0.00 C ATOM 100 NH1 ARG A 6 -0.650 -10.621 0.307 1.00 0.00 N ATOM 101 NH2 ARG A 6 -1.955 -11.483 1.989 1.00 0.00 N ATOM 0 H ARG A 6 -2.063 -6.448 5.900 1.00 0.00 H new ATOM 0 HA ARG A 6 -1.026 -8.750 4.412 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -0.120 -5.842 4.151 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.862 -7.200 3.638 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -1.926 -6.733 2.535 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -0.512 -5.966 1.840 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.815 -7.923 0.541 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.504 -8.321 1.624 1.00 0.00 H new ATOM 0 HE ARG A 6 -1.865 -9.170 2.914 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.151 -9.837 -0.113 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.649 -11.531 -0.153 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -2.462 -11.363 2.866 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -1.950 -12.390 1.523 1.00 0.00 H new ATOM 115 N LYS A 7 0.716 -8.983 6.213 1.00 0.00 N ATOM 116 CA LYS A 7 1.767 -9.123 7.210 1.00 0.00 C ATOM 117 C LYS A 7 3.031 -8.521 6.597 1.00 0.00 C ATOM 118 O LYS A 7 3.137 -8.473 5.372 1.00 0.00 O ATOM 119 CB LYS A 7 1.983 -10.606 7.540 1.00 0.00 C ATOM 120 CG LYS A 7 2.096 -10.904 9.038 1.00 0.00 C ATOM 121 CD LYS A 7 0.811 -10.581 9.809 1.00 0.00 C ATOM 122 CE LYS A 7 0.904 -11.089 11.251 1.00 0.00 C ATOM 123 NZ LYS A 7 1.029 -12.556 11.312 1.00 0.00 N ATOM 0 H LYS A 7 0.536 -9.831 5.676 1.00 0.00 H new ATOM 0 HA LYS A 7 1.505 -8.615 8.138 1.00 0.00 H new ATOM 0 HB2 LYS A 7 1.156 -11.183 7.127 1.00 0.00 H new ATOM 0 HB3 LYS A 7 2.890 -10.949 7.043 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.342 -11.957 9.176 1.00 0.00 H new ATOM 0 HG3 LYS A 7 2.920 -10.327 9.457 1.00 0.00 H new ATOM 0 HD2 LYS A 7 0.641 -9.504 9.808 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.043 -11.040 9.311 1.00 0.00 H new ATOM 0 HE2 LYS A 7 1.763 -10.631 11.742 1.00 0.00 H new ATOM 0 HE3 LYS A 7 0.017 -10.777 11.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.753 -12.889 12.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.408 -12.987 10.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 2.015 -12.829 11.123 1.00 0.00 H new ATOM 137 N VAL A 8 3.994 -8.064 7.401 1.00 0.00 N ATOM 138 CA VAL A 8 5.217 -7.525 6.810 1.00 0.00 C ATOM 139 C VAL A 8 5.887 -8.580 5.926 1.00 0.00 C ATOM 140 O VAL A 8 5.923 -9.759 6.271 1.00 0.00 O ATOM 141 CB VAL A 8 6.179 -6.983 7.867 1.00 0.00 C ATOM 142 CG1 VAL A 8 5.485 -5.903 8.706 1.00 0.00 C ATOM 143 CG2 VAL A 8 6.709 -8.069 8.798 1.00 0.00 C ATOM 0 H VAL A 8 3.955 -8.055 8.420 1.00 0.00 H new ATOM 0 HA VAL A 8 4.939 -6.677 6.185 1.00 0.00 H new ATOM 0 HB VAL A 8 7.029 -6.564 7.328 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.179 -5.523 9.456 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.169 -5.086 8.058 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.614 -6.331 9.201 1.00 0.00 H new ATOM 0 HG21 VAL A 8 7.387 -7.625 9.527 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.875 -8.541 9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 8 7.244 -8.819 8.215 1.00 0.00 H new ATOM 153 N GLY A 9 6.418 -8.147 4.782 1.00 0.00 N ATOM 154 CA GLY A 9 7.085 -9.017 3.825 1.00 0.00 C ATOM 155 C GLY A 9 6.164 -9.428 2.672 1.00 0.00 C ATOM 156 O GLY A 9 6.639 -9.922 1.651 1.00 0.00 O ATOM 0 H GLY A 9 6.394 -7.169 4.494 1.00 0.00 H new ATOM 0 HA2 GLY A 9 7.961 -8.508 3.423 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.443 -9.910 4.337 1.00 0.00 H new ATOM 160 N GLU A 10 4.850 -9.230 2.820 1.00 0.00 N ATOM 161 CA GLU A 10 3.878 -9.577 1.794 1.00 0.00 C ATOM 162 C GLU A 10 3.778 -8.474 0.736 1.00 0.00 C ATOM 163 O GLU A 10 4.482 -7.467 0.807 1.00 0.00 O ATOM 164 CB GLU A 10 2.517 -9.830 2.449 1.00 0.00 C ATOM 165 CG GLU A 10 2.571 -11.019 3.410 1.00 0.00 C ATOM 166 CD GLU A 10 2.942 -12.309 2.681 1.00 0.00 C ATOM 167 OE1 GLU A 10 2.187 -12.693 1.760 1.00 0.00 O ATOM 168 OE2 GLU A 10 3.981 -12.903 3.049 1.00 0.00 O ATOM 0 H GLU A 10 4.436 -8.823 3.659 1.00 0.00 H new ATOM 0 HA GLU A 10 4.205 -10.485 1.288 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.200 -8.938 2.989 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.770 -10.017 1.678 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.300 -10.821 4.196 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.603 -11.140 3.896 1.00 0.00 H new ATOM 175 N SER A 11 2.895 -8.656 -0.254 1.00 0.00 N ATOM 176 CA SER A 11 2.767 -7.727 -1.373 1.00 0.00 C ATOM 177 C SER A 11 1.315 -7.546 -1.816 1.00 0.00 C ATOM 178 O SER A 11 0.433 -8.313 -1.428 1.00 0.00 O ATOM 179 CB SER A 11 3.600 -8.233 -2.553 1.00 0.00 C ATOM 180 OG SER A 11 4.968 -8.243 -2.216 1.00 0.00 O ATOM 0 H SER A 11 2.254 -9.449 -0.298 1.00 0.00 H new ATOM 0 HA SER A 11 3.131 -6.756 -1.036 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.279 -9.237 -2.830 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.437 -7.596 -3.422 1.00 0.00 H new ATOM 0 HG SER A 11 5.490 -8.570 -2.978 1.00 0.00 H new ATOM 186 N ILE A 12 1.097 -6.511 -2.634 1.00 0.00 N ATOM 187 CA ILE A 12 -0.198 -6.066 -3.142 1.00 0.00 C ATOM 188 C ILE A 12 0.014 -5.604 -4.590 1.00 0.00 C ATOM 189 O ILE A 12 1.156 -5.399 -5.004 1.00 0.00 O ATOM 190 CB ILE A 12 -0.719 -4.929 -2.237 1.00 0.00 C ATOM 191 CG1 ILE A 12 -1.019 -5.408 -0.809 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.961 -4.246 -2.818 1.00 0.00 C ATOM 193 CD1 ILE A 12 -2.225 -6.347 -0.739 1.00 0.00 C ATOM 0 H ILE A 12 1.864 -5.932 -2.976 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.944 -6.861 -3.132 1.00 0.00 H new ATOM 0 HB ILE A 12 0.090 -4.200 -2.194 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -0.143 -5.919 -0.411 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.200 -4.543 -0.171 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.289 -3.454 -2.145 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.719 -3.819 -3.791 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.760 -4.979 -2.932 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.389 -6.653 0.294 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.110 -5.830 -1.109 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.036 -7.228 -1.352 1.00 0.00 H new ATOM 205 N ASN A 13 -1.058 -5.436 -5.372 1.00 0.00 N ATOM 206 CA ASN A 13 -0.947 -5.061 -6.778 1.00 0.00 C ATOM 207 C ASN A 13 -2.020 -4.056 -7.186 1.00 0.00 C ATOM 208 O ASN A 13 -3.095 -3.998 -6.593 1.00 0.00 O ATOM 209 CB ASN A 13 -1.060 -6.314 -7.643 1.00 0.00 C ATOM 210 CG ASN A 13 0.265 -7.052 -7.704 1.00 0.00 C ATOM 211 OD1 ASN A 13 0.463 -8.055 -7.026 1.00 0.00 O ATOM 212 ND2 ASN A 13 1.186 -6.556 -8.521 1.00 0.00 N ATOM 0 H ASN A 13 -2.018 -5.556 -5.048 1.00 0.00 H new ATOM 0 HA ASN A 13 0.022 -4.585 -6.925 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.829 -6.972 -7.238 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.374 -6.039 -8.650 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.095 -7.011 -8.601 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.984 -5.720 -9.069 1.00 0.00 H new ATOM 219 N ILE A 14 -1.697 -3.264 -8.215 1.00 0.00 N ATOM 220 CA ILE A 14 -2.578 -2.237 -8.759 1.00 0.00 C ATOM 221 C ILE A 14 -2.400 -2.207 -10.276 1.00 0.00 C ATOM 222 O ILE A 14 -1.296 -2.419 -10.786 1.00 0.00 O ATOM 223 CB ILE A 14 -2.235 -0.874 -8.143 1.00 0.00 C ATOM 224 CG1 ILE A 14 -2.300 -0.943 -6.609 1.00 0.00 C ATOM 225 CG2 ILE A 14 -3.205 0.194 -8.663 1.00 0.00 C ATOM 226 CD1 ILE A 14 -1.939 0.385 -5.949 1.00 0.00 C ATOM 0 H ILE A 14 -0.800 -3.324 -8.697 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.617 -2.461 -8.518 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.219 -0.606 -8.434 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.305 -1.236 -6.304 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.621 -1.718 -6.254 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -2.955 1.159 -8.221 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.126 0.260 -9.748 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.225 -0.077 -8.390 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.001 0.282 -4.866 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -0.924 0.667 -6.229 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.634 1.157 -6.280 1.00 0.00 H new ATOM 238 N GLY A 15 -3.489 -1.942 -11.002 1.00 0.00 N ATOM 239 CA GLY A 15 -3.473 -1.926 -12.455 1.00 0.00 C ATOM 240 C GLY A 15 -2.920 -3.240 -12.995 1.00 0.00 C ATOM 241 O GLY A 15 -3.217 -4.312 -12.470 1.00 0.00 O ATOM 0 H GLY A 15 -4.401 -1.734 -10.595 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -4.482 -1.766 -12.834 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -2.863 -1.095 -12.809 1.00 0.00 H new ATOM 245 N ASP A 16 -2.111 -3.145 -14.050 1.00 0.00 N ATOM 246 CA ASP A 16 -1.430 -4.286 -14.642 1.00 0.00 C ATOM 247 C ASP A 16 0.057 -3.967 -14.813 1.00 0.00 C ATOM 248 O ASP A 16 0.785 -4.700 -15.479 1.00 0.00 O ATOM 249 CB ASP A 16 -2.112 -4.653 -15.960 1.00 0.00 C ATOM 250 CG ASP A 16 -1.611 -5.986 -16.510 1.00 0.00 C ATOM 251 OD1 ASP A 16 -1.607 -6.967 -15.730 1.00 0.00 O ATOM 252 OD2 ASP A 16 -1.235 -6.021 -17.702 1.00 0.00 O ATOM 0 H ASP A 16 -1.911 -2.262 -14.520 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.496 -5.155 -13.987 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.190 -4.705 -15.808 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.931 -3.867 -16.693 1.00 0.00 H new ATOM 257 N ASP A 17 0.503 -2.860 -14.207 1.00 0.00 N ATOM 258 CA ASP A 17 1.865 -2.362 -14.327 1.00 0.00 C ATOM 259 C ASP A 17 2.409 -1.849 -12.991 1.00 0.00 C ATOM 260 O ASP A 17 3.483 -1.249 -12.972 1.00 0.00 O ATOM 261 CB ASP A 17 1.912 -1.244 -15.372 1.00 0.00 C ATOM 262 CG ASP A 17 1.485 -1.737 -16.751 1.00 0.00 C ATOM 263 OD1 ASP A 17 2.344 -2.332 -17.442 1.00 0.00 O ATOM 264 OD2 ASP A 17 0.305 -1.515 -17.106 1.00 0.00 O ATOM 0 H ASP A 17 -0.088 -2.280 -13.611 1.00 0.00 H new ATOM 0 HA ASP A 17 2.497 -3.193 -14.640 1.00 0.00 H new ATOM 0 HB2 ASP A 17 1.260 -0.428 -15.060 1.00 0.00 H new ATOM 0 HB3 ASP A 17 2.923 -0.841 -15.427 1.00 0.00 H new ATOM 269 N ILE A 18 1.702 -2.068 -11.872 1.00 0.00 N ATOM 270 CA ILE A 18 2.164 -1.594 -10.576 1.00 0.00 C ATOM 271 C ILE A 18 2.091 -2.708 -9.533 1.00 0.00 C ATOM 272 O ILE A 18 1.191 -3.549 -9.558 1.00 0.00 O ATOM 273 CB ILE A 18 1.358 -0.362 -10.123 1.00 0.00 C ATOM 274 CG1 ILE A 18 1.445 0.803 -11.116 1.00 0.00 C ATOM 275 CG2 ILE A 18 1.885 0.136 -8.774 1.00 0.00 C ATOM 276 CD1 ILE A 18 0.348 0.736 -12.176 1.00 0.00 C ATOM 0 H ILE A 18 0.814 -2.569 -11.847 1.00 0.00 H new ATOM 0 HA ILE A 18 3.207 -1.295 -10.677 1.00 0.00 H new ATOM 0 HB ILE A 18 0.319 -0.683 -10.054 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.369 1.746 -10.575 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.420 0.792 -11.603 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.311 1.007 -8.459 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.784 -0.654 -8.030 1.00 0.00 H new ATOM 0 HG23 ILE A 18 2.936 0.409 -8.872 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.449 1.581 -12.858 1.00 0.00 H new ATOM 0 HD12 ILE A 18 0.439 -0.195 -12.736 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.628 0.774 -11.692 1.00 0.00 H new ATOM 288 N THR A 19 3.056 -2.697 -8.611 1.00 0.00 N ATOM 289 CA THR A 19 3.134 -3.645 -7.509 1.00 0.00 C ATOM 290 C THR A 19 3.537 -2.880 -6.254 1.00 0.00 C ATOM 291 O THR A 19 4.171 -1.828 -6.346 1.00 0.00 O ATOM 292 CB THR A 19 4.155 -4.740 -7.839 1.00 0.00 C ATOM 293 OG1 THR A 19 3.824 -5.367 -9.060 1.00 0.00 O ATOM 294 CG2 THR A 19 4.204 -5.813 -6.750 1.00 0.00 C ATOM 0 H THR A 19 3.815 -2.016 -8.613 1.00 0.00 H new ATOM 0 HA THR A 19 2.170 -4.127 -7.345 1.00 0.00 H new ATOM 0 HB THR A 19 5.129 -4.256 -7.909 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.484 -6.063 -9.260 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.939 -6.572 -7.019 1.00 0.00 H new ATOM 0 HG22 THR A 19 4.485 -5.356 -5.801 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.223 -6.277 -6.652 1.00 0.00 H new ATOM 302 N ILE A 20 3.169 -3.407 -5.086 1.00 0.00 N ATOM 303 CA ILE A 20 3.394 -2.772 -3.796 1.00 0.00 C ATOM 304 C ILE A 20 3.908 -3.835 -2.832 1.00 0.00 C ATOM 305 O ILE A 20 3.546 -5.006 -2.962 1.00 0.00 O ATOM 306 CB ILE A 20 2.066 -2.190 -3.285 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.407 -1.225 -4.283 1.00 0.00 C ATOM 308 CG2 ILE A 20 2.260 -1.489 -1.941 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.194 0.070 -4.467 1.00 0.00 C ATOM 0 H ILE A 20 2.696 -4.308 -5.013 1.00 0.00 H new ATOM 0 HA ILE A 20 4.122 -1.965 -3.880 1.00 0.00 H new ATOM 0 HB ILE A 20 1.393 -3.038 -3.162 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.305 -1.722 -5.248 1.00 0.00 H new ATOM 0 HG13 ILE A 20 0.400 -0.987 -3.939 1.00 0.00 H new ATOM 0 HG21 ILE A 20 1.307 -1.086 -1.600 1.00 0.00 H new ATOM 0 HG22 ILE A 20 2.634 -2.204 -1.208 1.00 0.00 H new ATOM 0 HG23 ILE A 20 2.978 -0.677 -2.055 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.679 0.710 -5.183 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.274 0.586 -3.510 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.192 -0.161 -4.839 1.00 0.00 H new ATOM 321 N THR A 21 4.744 -3.443 -1.869 1.00 0.00 N ATOM 322 CA THR A 21 5.326 -4.382 -0.919 1.00 0.00 C ATOM 323 C THR A 21 5.452 -3.722 0.450 1.00 0.00 C ATOM 324 O THR A 21 6.043 -2.651 0.581 1.00 0.00 O ATOM 325 CB THR A 21 6.705 -4.824 -1.417 1.00 0.00 C ATOM 326 OG1 THR A 21 6.605 -5.353 -2.723 1.00 0.00 O ATOM 327 CG2 THR A 21 7.295 -5.907 -0.510 1.00 0.00 C ATOM 0 H THR A 21 5.032 -2.475 -1.729 1.00 0.00 H new ATOM 0 HA THR A 21 4.680 -5.255 -0.831 1.00 0.00 H new ATOM 0 HB THR A 21 7.353 -3.947 -1.409 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.136 -6.213 -2.693 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.274 -6.203 -0.886 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.398 -5.517 0.503 1.00 0.00 H new ATOM 0 HG23 THR A 21 6.633 -6.773 -0.500 1.00 0.00 H new ATOM 335 N ILE A 22 4.894 -4.363 1.478 1.00 0.00 N ATOM 336 CA ILE A 22 5.007 -3.889 2.851 1.00 0.00 C ATOM 337 C ILE A 22 6.371 -4.314 3.394 1.00 0.00 C ATOM 338 O ILE A 22 6.536 -5.418 3.908 1.00 0.00 O ATOM 339 CB ILE A 22 3.822 -4.390 3.699 1.00 0.00 C ATOM 340 CG1 ILE A 22 4.041 -4.130 5.192 1.00 0.00 C ATOM 341 CG2 ILE A 22 3.535 -5.878 3.493 1.00 0.00 C ATOM 342 CD1 ILE A 22 4.285 -2.651 5.475 1.00 0.00 C ATOM 0 H ILE A 22 4.353 -5.222 1.379 1.00 0.00 H new ATOM 0 HA ILE A 22 4.953 -2.801 2.894 1.00 0.00 H new ATOM 0 HB ILE A 22 2.959 -3.821 3.354 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.170 -4.469 5.753 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.893 -4.713 5.542 1.00 0.00 H new ATOM 0 HG21 ILE A 22 2.691 -6.175 4.115 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.296 -6.061 2.445 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.414 -6.460 3.771 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.436 -2.505 6.545 1.00 0.00 H new ATOM 0 HD12 ILE A 22 5.171 -2.319 4.935 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.422 -2.071 5.148 1.00 0.00 H new ATOM 354 N LEU A 23 7.361 -3.428 3.273 1.00 0.00 N ATOM 355 CA LEU A 23 8.725 -3.728 3.676 1.00 0.00 C ATOM 356 C LEU A 23 8.811 -3.955 5.186 1.00 0.00 C ATOM 357 O LEU A 23 9.604 -4.786 5.632 1.00 0.00 O ATOM 358 CB LEU A 23 9.647 -2.579 3.253 1.00 0.00 C ATOM 359 CG LEU A 23 9.502 -2.214 1.772 1.00 0.00 C ATOM 360 CD1 LEU A 23 10.448 -1.070 1.432 1.00 0.00 C ATOM 361 CD2 LEU A 23 9.834 -3.398 0.867 1.00 0.00 C ATOM 0 H LEU A 23 7.235 -2.489 2.895 1.00 0.00 H new ATOM 0 HA LEU A 23 9.044 -4.646 3.183 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.429 -1.701 3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 23 10.682 -2.857 3.454 1.00 0.00 H new ATOM 0 HG LEU A 23 8.465 -1.922 1.605 1.00 0.00 H new ATOM 0 HD11 LEU A 23 10.343 -0.812 0.378 1.00 0.00 H new ATOM 0 HD12 LEU A 23 10.204 -0.202 2.044 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.475 -1.376 1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.720 -3.102 -0.176 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.862 -3.714 1.044 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.157 -4.224 1.086 1.00 0.00 H new ATOM 373 N GLY A 24 8.006 -3.233 5.973 1.00 0.00 N ATOM 374 CA GLY A 24 7.927 -3.489 7.408 1.00 0.00 C ATOM 375 C GLY A 24 7.351 -2.309 8.185 1.00 0.00 C ATOM 376 O GLY A 24 6.868 -1.345 7.592 1.00 0.00 O ATOM 0 H GLY A 24 7.408 -2.476 5.642 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.309 -4.370 7.582 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.923 -3.718 7.788 1.00 0.00 H new ATOM 380 N VAL A 25 7.408 -2.387 9.518 1.00 0.00 N ATOM 381 CA VAL A 25 6.916 -1.327 10.392 1.00 0.00 C ATOM 382 C VAL A 25 7.939 -1.022 11.482 1.00 0.00 C ATOM 383 O VAL A 25 8.819 -1.837 11.763 1.00 0.00 O ATOM 384 CB VAL A 25 5.556 -1.688 11.017 1.00 0.00 C ATOM 385 CG1 VAL A 25 4.606 -2.268 9.964 1.00 0.00 C ATOM 386 CG2 VAL A 25 5.707 -2.707 12.145 1.00 0.00 C ATOM 0 H VAL A 25 7.797 -3.187 10.017 1.00 0.00 H new ATOM 0 HA VAL A 25 6.770 -0.436 9.781 1.00 0.00 H new ATOM 0 HB VAL A 25 5.143 -0.764 11.421 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.652 -2.515 10.431 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.445 -1.533 9.175 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.044 -3.169 9.536 1.00 0.00 H new ATOM 0 HG21 VAL A 25 4.726 -2.937 12.561 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.158 -3.619 11.754 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.345 -2.293 12.926 1.00 0.00 H new ATOM 396 N SER A 26 7.813 0.158 12.090 1.00 0.00 N ATOM 397 CA SER A 26 8.676 0.601 13.175 1.00 0.00 C ATOM 398 C SER A 26 7.843 1.498 14.081 1.00 0.00 C ATOM 399 O SER A 26 7.663 2.676 13.786 1.00 0.00 O ATOM 400 CB SER A 26 9.885 1.363 12.626 1.00 0.00 C ATOM 401 OG SER A 26 10.639 0.548 11.753 1.00 0.00 O ATOM 0 H SER A 26 7.097 0.839 11.836 1.00 0.00 H new ATOM 0 HA SER A 26 9.059 -0.254 13.732 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.549 2.255 12.098 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.514 1.699 13.451 1.00 0.00 H new ATOM 0 HG SER A 26 11.406 1.055 11.413 1.00 0.00 H new ATOM 407 N GLY A 27 7.333 0.940 15.180 1.00 0.00 N ATOM 408 CA GLY A 27 6.401 1.640 16.047 1.00 0.00 C ATOM 409 C GLY A 27 5.087 1.845 15.304 1.00 0.00 C ATOM 410 O GLY A 27 4.253 0.942 15.272 1.00 0.00 O ATOM 0 H GLY A 27 7.557 -0.006 15.488 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.232 1.067 16.958 1.00 0.00 H new ATOM 0 HA3 GLY A 27 6.817 2.602 16.348 1.00 0.00 H new ATOM 414 N GLN A 28 4.915 3.025 14.707 1.00 0.00 N ATOM 415 CA GLN A 28 3.740 3.357 13.909 1.00 0.00 C ATOM 416 C GLN A 28 4.145 3.736 12.491 1.00 0.00 C ATOM 417 O GLN A 28 3.282 4.001 11.651 1.00 0.00 O ATOM 418 CB GLN A 28 2.956 4.493 14.572 1.00 0.00 C ATOM 419 CG GLN A 28 1.675 3.962 15.218 1.00 0.00 C ATOM 420 CD GLN A 28 1.933 2.731 16.079 1.00 0.00 C ATOM 421 OE1 GLN A 28 2.504 2.825 17.164 1.00 0.00 O ATOM 422 NE2 GLN A 28 1.507 1.564 15.598 1.00 0.00 N ATOM 0 H GLN A 28 5.595 3.783 14.766 1.00 0.00 H new ATOM 0 HA GLN A 28 3.096 2.479 13.853 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.576 4.977 15.327 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.707 5.251 13.830 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.227 4.745 15.831 1.00 0.00 H new ATOM 0 HG3 GLN A 28 0.953 3.714 14.440 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.037 1.526 14.693 1.00 0.00 H new ATOM 0 HE22 GLN A 28 1.651 0.708 16.134 1.00 0.00 H new ATOM 431 N GLN A 29 5.450 3.766 12.215 1.00 0.00 N ATOM 432 CA GLN A 29 5.949 3.990 10.874 1.00 0.00 C ATOM 433 C GLN A 29 5.795 2.712 10.068 1.00 0.00 C ATOM 434 O GLN A 29 5.695 1.620 10.627 1.00 0.00 O ATOM 435 CB GLN A 29 7.418 4.406 10.915 1.00 0.00 C ATOM 436 CG GLN A 29 7.517 5.838 11.438 1.00 0.00 C ATOM 437 CD GLN A 29 8.943 6.245 11.740 1.00 0.00 C ATOM 438 OE1 GLN A 29 9.916 5.611 11.093 1.00 0.00 O flip ATOM 439 NE2 GLN A 29 9.159 7.134 12.556 1.00 0.00 N flip ATOM 0 H GLN A 29 6.180 3.636 12.916 1.00 0.00 H new ATOM 0 HA GLN A 29 5.378 4.792 10.406 1.00 0.00 H new ATOM 0 HB2 GLN A 29 7.982 3.731 11.558 1.00 0.00 H new ATOM 0 HB3 GLN A 29 7.856 4.338 9.919 1.00 0.00 H new ATOM 0 HG2 GLN A 29 7.096 6.521 10.701 1.00 0.00 H new ATOM 0 HG3 GLN A 29 6.915 5.934 12.342 1.00 0.00 H new ATOM 0 HE21 GLN A 29 8.380 7.593 13.028 1.00 0.00 H new ATOM 0 HE22 GLN A 29 10.118 7.415 12.762 1.00 0.00 H new ATOM 448 N VAL A 30 5.779 2.861 8.746 1.00 0.00 N ATOM 449 CA VAL A 30 5.634 1.749 7.835 1.00 0.00 C ATOM 450 C VAL A 30 6.506 2.019 6.622 1.00 0.00 C ATOM 451 O VAL A 30 6.292 3.009 5.919 1.00 0.00 O ATOM 452 CB VAL A 30 4.166 1.629 7.411 1.00 0.00 C ATOM 453 CG1 VAL A 30 4.002 0.421 6.498 1.00 0.00 C ATOM 454 CG2 VAL A 30 3.232 1.449 8.609 1.00 0.00 C ATOM 0 H VAL A 30 5.867 3.765 8.282 1.00 0.00 H new ATOM 0 HA VAL A 30 5.937 0.817 8.312 1.00 0.00 H new ATOM 0 HB VAL A 30 3.900 2.554 6.900 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.959 0.333 6.195 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.628 0.545 5.614 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.302 -0.481 7.031 1.00 0.00 H new ATOM 0 HG21 VAL A 30 2.203 1.369 8.259 1.00 0.00 H new ATOM 0 HG22 VAL A 30 3.504 0.542 9.149 1.00 0.00 H new ATOM 0 HG23 VAL A 30 3.323 2.308 9.274 1.00 0.00 H new ATOM 464 N ARG A 31 7.491 1.153 6.365 1.00 0.00 N ATOM 465 CA ARG A 31 8.234 1.226 5.119 1.00 0.00 C ATOM 466 C ARG A 31 7.398 0.530 4.060 1.00 0.00 C ATOM 467 O ARG A 31 7.042 -0.640 4.209 1.00 0.00 O ATOM 468 CB ARG A 31 9.599 0.552 5.223 1.00 0.00 C ATOM 469 CG ARG A 31 10.642 1.502 5.809 1.00 0.00 C ATOM 470 CD ARG A 31 12.043 1.011 5.438 1.00 0.00 C ATOM 471 NE ARG A 31 12.334 -0.322 5.983 1.00 0.00 N ATOM 472 CZ ARG A 31 13.389 -1.055 5.609 1.00 0.00 C ATOM 473 NH1 ARG A 31 14.254 -0.593 4.706 1.00 0.00 N ATOM 474 NH2 ARG A 31 13.585 -2.263 6.132 1.00 0.00 N ATOM 0 H ARG A 31 7.784 0.407 6.996 1.00 0.00 H new ATOM 0 HA ARG A 31 8.418 2.271 4.868 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.521 -0.337 5.848 1.00 0.00 H new ATOM 0 HB3 ARG A 31 9.920 0.220 4.235 1.00 0.00 H new ATOM 0 HG2 ARG A 31 10.486 2.511 5.428 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.537 1.551 6.893 1.00 0.00 H new ATOM 0 HD2 ARG A 31 12.140 0.985 4.353 1.00 0.00 H new ATOM 0 HD3 ARG A 31 12.783 1.721 5.808 1.00 0.00 H new ATOM 0 HE ARG A 31 11.700 -0.708 6.682 1.00 0.00 H new ATOM 0 HH11 ARG A 31 14.115 0.329 4.292 1.00 0.00 H new ATOM 0 HH12 ARG A 31 15.054 -1.161 4.429 1.00 0.00 H new ATOM 0 HH21 ARG A 31 12.930 -2.633 6.821 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.390 -2.819 5.844 1.00 0.00 H new ATOM 488 N ILE A 32 7.100 1.269 2.993 1.00 0.00 N ATOM 489 CA ILE A 32 6.306 0.771 1.885 1.00 0.00 C ATOM 490 C ILE A 32 7.127 0.903 0.614 1.00 0.00 C ATOM 491 O ILE A 32 7.644 1.979 0.321 1.00 0.00 O ATOM 492 CB ILE A 32 5.000 1.576 1.769 1.00 0.00 C ATOM 493 CG1 ILE A 32 4.373 1.788 3.154 1.00 0.00 C ATOM 494 CG2 ILE A 32 4.053 0.835 0.823 1.00 0.00 C ATOM 495 CD1 ILE A 32 3.017 2.483 3.079 1.00 0.00 C ATOM 0 H ILE A 32 7.407 2.235 2.878 1.00 0.00 H new ATOM 0 HA ILE A 32 6.044 -0.274 2.048 1.00 0.00 H new ATOM 0 HB ILE A 32 5.203 2.566 1.360 1.00 0.00 H new ATOM 0 HG12 ILE A 32 4.257 0.824 3.649 1.00 0.00 H new ATOM 0 HG13 ILE A 32 5.049 2.382 3.769 1.00 0.00 H new ATOM 0 HG21 ILE A 32 3.121 1.393 0.730 1.00 0.00 H new ATOM 0 HG22 ILE A 32 4.519 0.740 -0.158 1.00 0.00 H new ATOM 0 HG23 ILE A 32 3.843 -0.157 1.222 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.617 2.609 4.085 1.00 0.00 H new ATOM 0 HD12 ILE A 32 3.134 3.460 2.610 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.330 1.877 2.488 1.00 0.00 H new ATOM 507 N GLY A 33 7.243 -0.191 -0.136 1.00 0.00 N ATOM 508 CA GLY A 33 7.976 -0.205 -1.382 1.00 0.00 C ATOM 509 C GLY A 33 6.979 -0.224 -2.531 1.00 0.00 C ATOM 510 O GLY A 33 5.877 -0.757 -2.394 1.00 0.00 O ATOM 0 H GLY A 33 6.828 -1.089 0.111 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.618 0.673 -1.453 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.625 -1.080 -1.430 1.00 0.00 H new ATOM 514 N ILE A 34 7.368 0.362 -3.662 1.00 0.00 N ATOM 515 CA ILE A 34 6.507 0.437 -4.830 1.00 0.00 C ATOM 516 C ILE A 34 7.337 0.093 -6.056 1.00 0.00 C ATOM 517 O ILE A 34 8.518 0.429 -6.133 1.00 0.00 O ATOM 518 CB ILE A 34 5.896 1.842 -4.923 1.00 0.00 C ATOM 519 CG1 ILE A 34 5.126 2.146 -3.628 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.987 1.921 -6.157 1.00 0.00 C ATOM 521 CD1 ILE A 34 4.530 3.553 -3.617 1.00 0.00 C ATOM 0 H ILE A 34 8.283 0.794 -3.790 1.00 0.00 H new ATOM 0 HA ILE A 34 5.683 -0.273 -4.760 1.00 0.00 H new ATOM 0 HB ILE A 34 6.679 2.592 -5.035 1.00 0.00 H new ATOM 0 HG12 ILE A 34 4.326 1.415 -3.505 1.00 0.00 H new ATOM 0 HG13 ILE A 34 5.796 2.032 -2.776 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.552 2.918 -6.225 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.573 1.719 -7.054 1.00 0.00 H new ATOM 0 HG23 ILE A 34 4.190 1.183 -6.070 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.997 3.715 -2.680 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.330 4.288 -3.711 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.837 3.661 -4.452 1.00 0.00 H new ATOM 533 N ASN A 35 6.709 -0.577 -7.023 1.00 0.00 N ATOM 534 CA ASN A 35 7.380 -1.008 -8.230 1.00 0.00 C ATOM 535 C ASN A 35 6.486 -0.703 -9.425 1.00 0.00 C ATOM 536 O ASN A 35 5.510 -1.406 -9.681 1.00 0.00 O ATOM 537 CB ASN A 35 7.712 -2.499 -8.120 1.00 0.00 C ATOM 538 CG ASN A 35 8.616 -2.976 -9.246 1.00 0.00 C ATOM 539 OD1 ASN A 35 8.940 -2.234 -10.167 1.00 0.00 O ATOM 540 ND2 ASN A 35 9.034 -4.238 -9.181 1.00 0.00 N ATOM 0 H ASN A 35 5.722 -0.831 -6.983 1.00 0.00 H new ATOM 0 HA ASN A 35 8.319 -0.472 -8.367 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.196 -2.691 -7.163 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.787 -3.076 -8.131 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.641 -4.612 -9.910 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.747 -4.831 -8.402 1.00 0.00 H new ATOM 547 N ALA A 36 6.841 0.360 -10.145 1.00 0.00 N ATOM 548 CA ALA A 36 6.098 0.832 -11.296 1.00 0.00 C ATOM 549 C ALA A 36 7.081 1.379 -12.333 1.00 0.00 C ATOM 550 O ALA A 36 8.182 1.792 -11.970 1.00 0.00 O ATOM 551 CB ALA A 36 5.138 1.927 -10.823 1.00 0.00 C ATOM 0 H ALA A 36 7.667 0.921 -9.936 1.00 0.00 H new ATOM 0 HA ALA A 36 5.527 0.025 -11.756 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.565 2.300 -11.672 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.457 1.516 -10.078 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.708 2.745 -10.382 1.00 0.00 H new ATOM 557 N PRO A 37 6.709 1.393 -13.617 1.00 0.00 N ATOM 558 CA PRO A 37 7.528 1.956 -14.672 1.00 0.00 C ATOM 559 C PRO A 37 7.581 3.474 -14.524 1.00 0.00 C ATOM 560 O PRO A 37 6.646 4.086 -14.010 1.00 0.00 O ATOM 561 CB PRO A 37 6.830 1.557 -15.976 1.00 0.00 C ATOM 562 CG PRO A 37 5.368 1.367 -15.571 1.00 0.00 C ATOM 563 CD PRO A 37 5.467 0.858 -14.138 1.00 0.00 C ATOM 0 HA PRO A 37 8.556 1.595 -14.645 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.936 2.329 -16.738 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.252 0.641 -16.390 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.809 2.301 -15.629 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.861 0.652 -16.218 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.617 1.193 -13.544 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.467 -0.232 -14.109 1.00 0.00 H new ATOM 571 N LYS A 38 8.676 4.094 -14.976 1.00 0.00 N ATOM 572 CA LYS A 38 8.790 5.547 -14.963 1.00 0.00 C ATOM 573 C LYS A 38 7.788 6.167 -15.940 1.00 0.00 C ATOM 574 O LYS A 38 7.706 7.386 -16.061 1.00 0.00 O ATOM 575 CB LYS A 38 10.233 5.957 -15.273 1.00 0.00 C ATOM 576 CG LYS A 38 11.184 5.501 -14.156 1.00 0.00 C ATOM 577 CD LYS A 38 11.011 6.328 -12.875 1.00 0.00 C ATOM 578 CE LYS A 38 11.837 7.611 -12.949 1.00 0.00 C ATOM 579 NZ LYS A 38 11.503 8.541 -11.856 1.00 0.00 N ATOM 0 H LYS A 38 9.491 3.610 -15.353 1.00 0.00 H new ATOM 0 HA LYS A 38 8.546 5.926 -13.971 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.544 5.520 -16.222 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.291 7.039 -15.387 1.00 0.00 H new ATOM 0 HG2 LYS A 38 11.004 4.449 -13.935 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.214 5.582 -14.503 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.959 6.574 -12.734 1.00 0.00 H new ATOM 0 HD3 LYS A 38 11.320 5.739 -12.011 1.00 0.00 H new ATOM 0 HE2 LYS A 38 12.898 7.363 -12.904 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.664 8.100 -13.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 12.084 9.399 -11.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.497 8.797 -11.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 11.692 8.084 -10.941 1.00 0.00 H new ATOM 593 N ASP A 39 7.025 5.316 -16.637 1.00 0.00 N ATOM 594 CA ASP A 39 5.919 5.722 -17.487 1.00 0.00 C ATOM 595 C ASP A 39 4.764 6.286 -16.653 1.00 0.00 C ATOM 596 O ASP A 39 3.836 6.882 -17.201 1.00 0.00 O ATOM 597 CB ASP A 39 5.447 4.499 -18.273 1.00 0.00 C ATOM 598 CG ASP A 39 4.477 4.881 -19.387 1.00 0.00 C ATOM 599 OD1 ASP A 39 4.887 5.680 -20.257 1.00 0.00 O ATOM 600 OD2 ASP A 39 3.332 4.372 -19.361 1.00 0.00 O ATOM 0 H ASP A 39 7.169 4.306 -16.620 1.00 0.00 H new ATOM 0 HA ASP A 39 6.252 6.507 -18.166 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.309 3.987 -18.701 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.963 3.796 -17.595 1.00 0.00 H new ATOM 605 N VAL A 40 4.820 6.106 -15.328 1.00 0.00 N ATOM 606 CA VAL A 40 3.807 6.588 -14.398 1.00 0.00 C ATOM 607 C VAL A 40 4.485 7.164 -13.159 1.00 0.00 C ATOM 608 O VAL A 40 5.652 6.875 -12.893 1.00 0.00 O ATOM 609 CB VAL A 40 2.829 5.468 -14.014 1.00 0.00 C ATOM 610 CG1 VAL A 40 2.191 4.851 -15.261 1.00 0.00 C ATOM 611 CG2 VAL A 40 3.516 4.360 -13.218 1.00 0.00 C ATOM 0 H VAL A 40 5.586 5.612 -14.870 1.00 0.00 H new ATOM 0 HA VAL A 40 3.229 7.373 -14.886 1.00 0.00 H new ATOM 0 HB VAL A 40 2.061 5.926 -13.391 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.502 4.060 -14.964 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.646 5.620 -15.809 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.970 4.433 -15.899 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.789 3.588 -12.967 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.316 3.924 -13.817 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.935 4.776 -12.302 1.00 0.00 H new ATOM 621 N ALA A 41 3.757 7.982 -12.401 1.00 0.00 N ATOM 622 CA ALA A 41 4.320 8.687 -11.261 1.00 0.00 C ATOM 623 C ALA A 41 3.916 8.036 -9.941 1.00 0.00 C ATOM 624 O ALA A 41 2.913 7.328 -9.870 1.00 0.00 O ATOM 625 CB ALA A 41 3.840 10.137 -11.309 1.00 0.00 C ATOM 0 H ALA A 41 2.768 8.171 -12.562 1.00 0.00 H new ATOM 0 HA ALA A 41 5.408 8.645 -11.317 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.251 10.685 -10.461 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.174 10.600 -12.237 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.751 10.162 -11.263 1.00 0.00 H new ATOM 631 N VAL A 42 4.708 8.280 -8.895 1.00 0.00 N ATOM 632 CA VAL A 42 4.409 7.804 -7.545 1.00 0.00 C ATOM 633 C VAL A 42 5.057 8.750 -6.535 1.00 0.00 C ATOM 634 O VAL A 42 6.232 9.083 -6.676 1.00 0.00 O ATOM 635 CB VAL A 42 4.921 6.361 -7.402 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.342 6.187 -7.929 1.00 0.00 C ATOM 637 CG2 VAL A 42 4.917 5.891 -5.953 1.00 0.00 C ATOM 0 H VAL A 42 5.575 8.813 -8.961 1.00 0.00 H new ATOM 0 HA VAL A 42 3.336 7.797 -7.356 1.00 0.00 H new ATOM 0 HB VAL A 42 4.230 5.763 -7.996 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.652 5.150 -7.803 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.372 6.449 -8.987 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.018 6.838 -7.374 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.286 4.867 -5.902 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.561 6.539 -5.358 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.901 5.930 -5.561 1.00 0.00 H new ATOM 647 N HIS A 43 4.307 9.185 -5.516 1.00 0.00 N ATOM 648 CA HIS A 43 4.805 10.158 -4.548 1.00 0.00 C ATOM 649 C HIS A 43 4.054 10.103 -3.224 1.00 0.00 C ATOM 650 O HIS A 43 2.984 9.503 -3.134 1.00 0.00 O ATOM 651 CB HIS A 43 4.602 11.573 -5.099 1.00 0.00 C ATOM 652 CG HIS A 43 5.204 11.824 -6.451 1.00 0.00 C ATOM 653 ND1 HIS A 43 6.543 12.143 -6.690 1.00 0.00 N ATOM 654 CD2 HIS A 43 4.529 11.779 -7.633 1.00 0.00 C ATOM 655 CE1 HIS A 43 6.640 12.282 -8.022 1.00 0.00 C ATOM 656 NE2 HIS A 43 5.450 12.069 -8.612 1.00 0.00 N ATOM 0 H HIS A 43 3.351 8.875 -5.344 1.00 0.00 H new ATOM 0 HA HIS A 43 5.855 9.918 -4.381 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.532 11.775 -5.152 1.00 0.00 H new ATOM 0 HB3 HIS A 43 5.026 12.286 -4.392 1.00 0.00 H new ATOM 0 HD1 HIS A 43 7.287 12.248 -6.001 1.00 0.00 H new ATOM 0 HD2 HIS A 43 3.481 11.560 -7.773 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.550 12.531 -8.548 1.00 0.00 H new ATOM 664 N ARG A 44 4.620 10.738 -2.193 1.00 0.00 N ATOM 665 CA ARG A 44 3.925 10.981 -0.936 1.00 0.00 C ATOM 666 C ARG A 44 2.737 11.897 -1.214 1.00 0.00 C ATOM 667 O ARG A 44 2.744 12.632 -2.202 1.00 0.00 O ATOM 668 CB ARG A 44 4.877 11.668 0.049 1.00 0.00 C ATOM 669 CG ARG A 44 5.760 10.688 0.824 1.00 0.00 C ATOM 670 CD ARG A 44 5.025 10.140 2.050 1.00 0.00 C ATOM 671 NE ARG A 44 4.750 11.203 3.022 1.00 0.00 N ATOM 672 CZ ARG A 44 4.277 11.004 4.256 1.00 0.00 C ATOM 673 NH1 ARG A 44 4.056 9.777 4.717 1.00 0.00 N ATOM 674 NH2 ARG A 44 4.020 12.042 5.039 1.00 0.00 N ATOM 0 H ARG A 44 5.575 11.097 -2.212 1.00 0.00 H new ATOM 0 HA ARG A 44 3.584 10.039 -0.506 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.513 12.365 -0.497 1.00 0.00 H new ATOM 0 HB3 ARG A 44 4.293 12.257 0.756 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.054 9.864 0.173 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.676 11.188 1.138 1.00 0.00 H new ATOM 0 HD2 ARG A 44 4.089 9.677 1.739 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.626 9.361 2.519 1.00 0.00 H new ATOM 0 HE ARG A 44 4.933 12.165 2.735 1.00 0.00 H new ATOM 0 HH11 ARG A 44 4.248 8.968 4.126 1.00 0.00 H new ATOM 0 HH12 ARG A 44 3.695 9.644 5.662 1.00 0.00 H new ATOM 0 HH21 ARG A 44 4.183 12.990 4.699 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.659 11.893 5.981 1.00 0.00 H new ATOM 688 N GLU A 45 1.716 11.868 -0.361 1.00 0.00 N ATOM 689 CA GLU A 45 0.539 12.715 -0.540 1.00 0.00 C ATOM 690 C GLU A 45 0.904 14.197 -0.394 1.00 0.00 C ATOM 691 O GLU A 45 0.201 15.056 -0.921 1.00 0.00 O ATOM 692 CB GLU A 45 -0.522 12.259 0.469 1.00 0.00 C ATOM 693 CG GLU A 45 -1.891 12.913 0.249 1.00 0.00 C ATOM 694 CD GLU A 45 -2.042 14.277 0.924 1.00 0.00 C ATOM 695 OE1 GLU A 45 -1.173 14.636 1.749 1.00 0.00 O ATOM 696 OE2 GLU A 45 -3.046 14.958 0.606 1.00 0.00 O ATOM 0 H GLU A 45 1.680 11.267 0.462 1.00 0.00 H new ATOM 0 HA GLU A 45 0.135 12.612 -1.547 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.630 11.176 0.407 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.176 12.487 1.477 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.060 13.028 -0.822 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.666 12.245 0.624 1.00 0.00 H new ATOM 703 N GLU A 46 1.999 14.506 0.315 1.00 0.00 N ATOM 704 CA GLU A 46 2.452 15.882 0.489 1.00 0.00 C ATOM 705 C GLU A 46 3.325 16.348 -0.682 1.00 0.00 C ATOM 706 O GLU A 46 3.657 17.530 -0.775 1.00 0.00 O ATOM 707 CB GLU A 46 3.216 16.021 1.810 1.00 0.00 C ATOM 708 CG GLU A 46 4.549 15.273 1.773 1.00 0.00 C ATOM 709 CD GLU A 46 5.238 15.301 3.135 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.903 16.320 3.429 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.098 14.300 3.872 1.00 0.00 O ATOM 0 H GLU A 46 2.587 13.812 0.778 1.00 0.00 H new ATOM 0 HA GLU A 46 1.569 16.521 0.513 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.396 17.076 2.017 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.605 15.636 2.626 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.380 14.240 1.469 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.201 15.723 1.024 1.00 0.00 H new ATOM 718 N ILE A 47 3.694 15.421 -1.573 1.00 0.00 N ATOM 719 CA ILE A 47 4.520 15.711 -2.739 1.00 0.00 C ATOM 720 C ILE A 47 3.676 15.621 -4.001 1.00 0.00 C ATOM 721 O ILE A 47 3.909 16.374 -4.941 1.00 0.00 O ATOM 722 CB ILE A 47 5.685 14.715 -2.782 1.00 0.00 C ATOM 723 CG1 ILE A 47 6.632 14.931 -1.597 1.00 0.00 C ATOM 724 CG2 ILE A 47 6.459 14.831 -4.096 1.00 0.00 C ATOM 725 CD1 ILE A 47 7.219 16.345 -1.547 1.00 0.00 C ATOM 0 H ILE A 47 3.422 14.441 -1.500 1.00 0.00 H new ATOM 0 HA ILE A 47 4.923 16.722 -2.674 1.00 0.00 H new ATOM 0 HB ILE A 47 5.263 13.712 -2.715 1.00 0.00 H new ATOM 0 HG12 ILE A 47 6.094 14.734 -0.669 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.446 14.208 -1.653 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.279 14.113 -4.100 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.791 14.622 -4.932 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.859 15.840 -4.195 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.881 16.434 -0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.783 16.537 -2.460 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.411 17.071 -1.460 1.00 0.00 H new ATOM 737 N TYR A 48 2.699 14.714 -4.033 1.00 0.00 N ATOM 738 CA TYR A 48 1.845 14.558 -5.197 1.00 0.00 C ATOM 739 C TYR A 48 1.141 15.871 -5.540 1.00 0.00 C ATOM 740 O TYR A 48 0.976 16.194 -6.712 1.00 0.00 O ATOM 741 CB TYR A 48 0.810 13.478 -4.895 1.00 0.00 C ATOM 742 CG TYR A 48 -0.324 13.459 -5.888 1.00 0.00 C ATOM 743 CD1 TYR A 48 -0.067 13.325 -7.262 1.00 0.00 C ATOM 744 CD2 TYR A 48 -1.641 13.590 -5.429 1.00 0.00 C ATOM 745 CE1 TYR A 48 -1.126 13.349 -8.179 1.00 0.00 C ATOM 746 CE2 TYR A 48 -2.706 13.608 -6.337 1.00 0.00 C ATOM 747 CZ TYR A 48 -2.454 13.487 -7.719 1.00 0.00 C ATOM 748 OH TYR A 48 -3.487 13.509 -8.609 1.00 0.00 O ATOM 0 H TYR A 48 2.484 14.080 -3.264 1.00 0.00 H new ATOM 0 HA TYR A 48 2.454 14.272 -6.054 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.299 12.504 -4.891 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.408 13.637 -3.894 1.00 0.00 H new ATOM 0 HD1 TYR A 48 0.947 13.203 -7.612 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -1.835 13.677 -4.370 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -0.927 13.262 -9.237 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -3.720 13.714 -5.980 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.333 13.609 -8.125 1.00 0.00 H new ATOM 758 N GLN A 49 0.732 16.630 -4.522 1.00 0.00 N ATOM 759 CA GLN A 49 0.046 17.898 -4.734 1.00 0.00 C ATOM 760 C GLN A 49 0.975 18.909 -5.402 1.00 0.00 C ATOM 761 O GLN A 49 0.507 19.864 -6.015 1.00 0.00 O ATOM 762 CB GLN A 49 -0.436 18.453 -3.395 1.00 0.00 C ATOM 763 CG GLN A 49 -1.448 17.513 -2.737 1.00 0.00 C ATOM 764 CD GLN A 49 -1.859 18.037 -1.368 1.00 0.00 C ATOM 765 OE1 GLN A 49 -2.528 19.063 -1.259 1.00 0.00 O ATOM 766 NE2 GLN A 49 -1.461 17.337 -0.313 1.00 0.00 N ATOM 0 H GLN A 49 0.866 16.384 -3.541 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.808 17.724 -5.388 1.00 0.00 H new ATOM 0 HB2 GLN A 49 0.416 18.597 -2.730 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.891 19.432 -3.547 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.328 17.415 -3.373 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.015 16.518 -2.636 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -0.907 16.490 -0.442 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -1.709 17.646 0.627 1.00 0.00 H new ATOM 775 N ARG A 50 2.293 18.703 -5.284 1.00 0.00 N ATOM 776 CA ARG A 50 3.276 19.612 -5.849 1.00 0.00 C ATOM 777 C ARG A 50 3.521 19.311 -7.324 1.00 0.00 C ATOM 778 O ARG A 50 3.714 20.237 -8.109 1.00 0.00 O ATOM 779 CB ARG A 50 4.569 19.496 -5.043 1.00 0.00 C ATOM 780 CG ARG A 50 5.602 20.491 -5.558 1.00 0.00 C ATOM 781 CD ARG A 50 6.840 20.412 -4.671 1.00 0.00 C ATOM 782 NE ARG A 50 6.583 20.996 -3.346 1.00 0.00 N ATOM 783 CZ ARG A 50 7.134 20.568 -2.207 1.00 0.00 C ATOM 784 NH1 ARG A 50 7.978 19.539 -2.202 1.00 0.00 N ATOM 785 NH2 ARG A 50 6.842 21.172 -1.060 1.00 0.00 N ATOM 0 H ARG A 50 2.698 17.904 -4.796 1.00 0.00 H new ATOM 0 HA ARG A 50 2.900 20.634 -5.791 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.367 19.684 -3.989 1.00 0.00 H new ATOM 0 HB3 ARG A 50 4.962 18.482 -5.116 1.00 0.00 H new ATOM 0 HG2 ARG A 50 5.863 20.264 -6.592 1.00 0.00 H new ATOM 0 HG3 ARG A 50 5.193 21.501 -5.547 1.00 0.00 H new ATOM 0 HD2 ARG A 50 7.145 19.371 -4.560 1.00 0.00 H new ATOM 0 HD3 ARG A 50 7.667 20.937 -5.149 1.00 0.00 H new ATOM 0 HE ARG A 50 5.938 21.784 -3.293 1.00 0.00 H new ATOM 0 HH11 ARG A 50 8.211 19.067 -3.075 1.00 0.00 H new ATOM 0 HH12 ARG A 50 8.391 19.223 -1.325 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.197 21.962 -1.049 1.00 0.00 H new ATOM 0 HH22 ARG A 50 7.263 20.845 -0.190 1.00 0.00 H new ATOM 799 N ILE A 51 3.514 18.033 -7.714 1.00 0.00 N ATOM 800 CA ILE A 51 3.652 17.662 -9.121 1.00 0.00 C ATOM 801 C ILE A 51 2.437 18.180 -9.895 1.00 0.00 C ATOM 802 O ILE A 51 2.470 18.288 -11.121 1.00 0.00 O ATOM 803 CB ILE A 51 3.863 16.144 -9.276 1.00 0.00 C ATOM 804 CG1 ILE A 51 5.278 15.736 -8.832 1.00 0.00 C ATOM 805 CG2 ILE A 51 3.742 15.715 -10.739 1.00 0.00 C ATOM 806 CD1 ILE A 51 5.452 15.734 -7.318 1.00 0.00 C ATOM 0 H ILE A 51 3.415 17.243 -7.077 1.00 0.00 H new ATOM 0 HA ILE A 51 4.542 18.128 -9.543 1.00 0.00 H new ATOM 0 HB ILE A 51 3.100 15.667 -8.661 1.00 0.00 H new ATOM 0 HG12 ILE A 51 5.501 14.742 -9.219 1.00 0.00 H new ATOM 0 HG13 ILE A 51 6.002 16.420 -9.274 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.896 14.639 -10.816 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.749 15.967 -11.111 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.495 16.233 -11.333 1.00 0.00 H new ATOM 0 HD11 ILE A 51 6.471 15.438 -7.069 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.259 16.734 -6.928 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.750 15.029 -6.872 1.00 0.00 H new ATOM 1635 N MET C 1 12.184 -0.002 -7.703 1.00 0.00 N ATOM 1636 CA MET C 1 11.657 0.123 -6.331 1.00 0.00 C ATOM 1637 C MET C 1 11.779 1.554 -5.838 1.00 0.00 C ATOM 1638 O MET C 1 12.849 2.140 -5.928 1.00 0.00 O ATOM 1639 CB MET C 1 12.425 -0.782 -5.366 1.00 0.00 C ATOM 1640 CG MET C 1 11.946 -0.589 -3.929 1.00 0.00 C ATOM 1641 SD MET C 1 10.293 -1.237 -3.603 1.00 0.00 S ATOM 1642 CE MET C 1 10.777 -2.960 -3.371 1.00 0.00 C ATOM 0 H1 MET C 1 12.092 -0.988 -8.022 1.00 0.00 H new ATOM 0 H2 MET C 1 11.646 0.620 -8.340 1.00 0.00 H new ATOM 0 H3 MET C 1 13.187 0.274 -7.716 1.00 0.00 H new ATOM 0 HA MET C 1 10.609 -0.174 -6.359 1.00 0.00 H new ATOM 0 HB2 MET C 1 12.295 -1.824 -5.659 1.00 0.00 H new ATOM 0 HB3 MET C 1 13.491 -0.564 -5.429 1.00 0.00 H new ATOM 0 HG2 MET C 1 12.653 -1.073 -3.255 1.00 0.00 H new ATOM 0 HG3 MET C 1 11.959 0.475 -3.694 1.00 0.00 H new ATOM 0 HE1 MET C 1 9.912 -3.541 -3.049 1.00 0.00 H new ATOM 0 HE2 MET C 1 11.154 -3.362 -4.311 1.00 0.00 H new ATOM 0 HE3 MET C 1 11.557 -3.020 -2.612 1.00 0.00 H new ATOM 1654 N LEU C 2 10.689 2.113 -5.313 1.00 0.00 N ATOM 1655 CA LEU C 2 10.708 3.432 -4.704 1.00 0.00 C ATOM 1656 C LEU C 2 10.056 3.294 -3.327 1.00 0.00 C ATOM 1657 O LEU C 2 8.859 3.030 -3.231 1.00 0.00 O ATOM 1658 CB LEU C 2 9.982 4.415 -5.634 1.00 0.00 C ATOM 1659 CG LEU C 2 10.081 5.891 -5.224 1.00 0.00 C ATOM 1660 CD1 LEU C 2 8.843 6.294 -4.445 1.00 0.00 C ATOM 1661 CD2 LEU C 2 11.281 6.236 -4.340 1.00 0.00 C ATOM 0 H LEU C 2 9.774 1.662 -5.300 1.00 0.00 H new ATOM 0 HA LEU C 2 11.715 3.827 -4.566 1.00 0.00 H new ATOM 0 HB2 LEU C 2 10.386 4.305 -6.640 1.00 0.00 H new ATOM 0 HB3 LEU C 2 8.929 4.137 -5.681 1.00 0.00 H new ATOM 0 HG LEU C 2 10.191 6.429 -6.166 1.00 0.00 H new ATOM 0 HD11 LEU C 2 8.920 7.342 -4.157 1.00 0.00 H new ATOM 0 HD12 LEU C 2 7.959 6.152 -5.067 1.00 0.00 H new ATOM 0 HD13 LEU C 2 8.759 5.677 -3.550 1.00 0.00 H new ATOM 0 HD21 LEU C 2 11.265 7.300 -4.103 1.00 0.00 H new ATOM 0 HD22 LEU C 2 11.231 5.658 -3.417 1.00 0.00 H new ATOM 0 HD23 LEU C 2 12.203 5.996 -4.869 1.00 0.00 H new ATOM 1673 N ILE C 3 10.850 3.472 -2.270 1.00 0.00 N ATOM 1674 CA ILE C 3 10.379 3.374 -0.902 1.00 0.00 C ATOM 1675 C ILE C 3 9.886 4.738 -0.441 1.00 0.00 C ATOM 1676 O ILE C 3 10.450 5.771 -0.805 1.00 0.00 O ATOM 1677 CB ILE C 3 11.504 2.902 0.043 1.00 0.00 C ATOM 1678 CG1 ILE C 3 11.963 1.469 -0.245 1.00 0.00 C ATOM 1679 CG2 ILE C 3 10.979 2.918 1.479 1.00 0.00 C ATOM 1680 CD1 ILE C 3 13.043 1.402 -1.321 1.00 0.00 C ATOM 0 H ILE C 3 11.844 3.689 -2.348 1.00 0.00 H new ATOM 0 HA ILE C 3 9.570 2.644 -0.871 1.00 0.00 H new ATOM 0 HB ILE C 3 12.346 3.577 -0.108 1.00 0.00 H new ATOM 0 HG12 ILE C 3 12.343 1.022 0.674 1.00 0.00 H new ATOM 0 HG13 ILE C 3 11.106 0.873 -0.559 1.00 0.00 H new ATOM 0 HG21 ILE C 3 11.765 2.586 2.157 1.00 0.00 H new ATOM 0 HG22 ILE C 3 10.675 3.931 1.744 1.00 0.00 H new ATOM 0 HG23 ILE C 3 10.123 2.249 1.561 1.00 0.00 H new ATOM 0 HD11 ILE C 3 13.330 0.363 -1.484 1.00 0.00 H new ATOM 0 HD12 ILE C 3 12.658 1.822 -2.250 1.00 0.00 H new ATOM 0 HD13 ILE C 3 13.914 1.973 -0.999 1.00 0.00 H new ATOM 1692 N LEU C 4 8.825 4.729 0.367 1.00 0.00 N ATOM 1693 CA LEU C 4 8.318 5.909 1.046 1.00 0.00 C ATOM 1694 C LEU C 4 7.900 5.477 2.443 1.00 0.00 C ATOM 1695 O LEU C 4 7.240 4.447 2.598 1.00 0.00 O ATOM 1696 CB LEU C 4 7.103 6.476 0.300 1.00 0.00 C ATOM 1697 CG LEU C 4 7.435 7.018 -1.093 1.00 0.00 C ATOM 1698 CD1 LEU C 4 6.145 7.472 -1.779 1.00 0.00 C ATOM 1699 CD2 LEU C 4 8.392 8.209 -1.021 1.00 0.00 C ATOM 0 H LEU C 4 8.289 3.885 0.567 1.00 0.00 H new ATOM 0 HA LEU C 4 9.083 6.684 1.083 1.00 0.00 H new ATOM 0 HB2 LEU C 4 6.348 5.695 0.206 1.00 0.00 H new ATOM 0 HB3 LEU C 4 6.662 7.275 0.896 1.00 0.00 H new ATOM 0 HG LEU C 4 7.916 6.219 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU C 4 6.377 7.859 -2.771 1.00 0.00 H new ATOM 0 HD12 LEU C 4 5.464 6.626 -1.870 1.00 0.00 H new ATOM 0 HD13 LEU C 4 5.674 8.255 -1.186 1.00 0.00 H new ATOM 0 HD21 LEU C 4 8.605 8.566 -2.029 1.00 0.00 H new ATOM 0 HD22 LEU C 4 7.933 9.010 -0.441 1.00 0.00 H new ATOM 0 HD23 LEU C 4 9.321 7.901 -0.542 1.00 0.00 H new ATOM 1711 N THR C 5 8.270 6.252 3.462 1.00 0.00 N ATOM 1712 CA THR C 5 7.818 5.955 4.813 1.00 0.00 C ATOM 1713 C THR C 5 6.462 6.594 5.035 1.00 0.00 C ATOM 1714 O THR C 5 6.097 7.564 4.366 1.00 0.00 O ATOM 1715 CB THR C 5 8.803 6.459 5.868 1.00 0.00 C ATOM 1716 OG1 THR C 5 9.139 7.810 5.616 1.00 0.00 O ATOM 1717 CG2 THR C 5 10.066 5.614 5.848 1.00 0.00 C ATOM 0 H THR C 5 8.869 7.073 3.378 1.00 0.00 H new ATOM 0 HA THR C 5 7.750 4.872 4.917 1.00 0.00 H new ATOM 0 HB THR C 5 8.331 6.382 6.848 1.00 0.00 H new ATOM 0 HG1 THR C 5 9.769 8.123 6.298 1.00 0.00 H new ATOM 0 HG21 THR C 5 10.761 5.981 6.603 1.00 0.00 H new ATOM 0 HG22 THR C 5 9.813 4.576 6.062 1.00 0.00 H new ATOM 0 HG23 THR C 5 10.531 5.678 4.864 1.00 0.00 H new ATOM 1725 N ARG C 6 5.709 6.043 5.987 1.00 0.00 N ATOM 1726 CA ARG C 6 4.400 6.556 6.335 1.00 0.00 C ATOM 1727 C ARG C 6 4.131 6.263 7.806 1.00 0.00 C ATOM 1728 O ARG C 6 4.795 5.404 8.379 1.00 0.00 O ATOM 1729 CB ARG C 6 3.382 5.888 5.404 1.00 0.00 C ATOM 1730 CG ARG C 6 2.146 6.758 5.211 1.00 0.00 C ATOM 1731 CD ARG C 6 1.445 6.365 3.914 1.00 0.00 C ATOM 1732 NE ARG C 6 0.888 5.012 3.981 1.00 0.00 N ATOM 1733 CZ ARG C 6 0.255 4.400 2.978 1.00 0.00 C ATOM 1734 NH1 ARG C 6 0.026 5.030 1.834 1.00 0.00 N ATOM 1735 NH2 ARG C 6 -0.159 3.142 3.106 1.00 0.00 N ATOM 0 H ARG C 6 5.996 5.230 6.533 1.00 0.00 H new ATOM 0 HA ARG C 6 4.331 7.636 6.206 1.00 0.00 H new ATOM 0 HB2 ARG C 6 3.845 5.693 4.437 1.00 0.00 H new ATOM 0 HB3 ARG C 6 3.088 4.923 5.817 1.00 0.00 H new ATOM 0 HG2 ARG C 6 1.467 6.636 6.055 1.00 0.00 H new ATOM 0 HG3 ARG C 6 2.430 7.810 5.179 1.00 0.00 H new ATOM 0 HD2 ARG C 6 0.646 7.076 3.703 1.00 0.00 H new ATOM 0 HD3 ARG C 6 2.152 6.426 3.087 1.00 0.00 H new ATOM 0 HE ARG C 6 0.991 4.501 4.857 1.00 0.00 H new ATOM 0 HH11 ARG C 6 0.335 5.994 1.712 1.00 0.00 H new ATOM 0 HH12 ARG C 6 -0.459 4.550 1.076 1.00 0.00 H new ATOM 0 HH21 ARG C 6 0.007 2.637 3.976 1.00 0.00 H new ATOM 0 HH22 ARG C 6 -0.642 2.683 2.334 1.00 0.00 H new ATOM 1749 N LYS C 7 3.168 6.960 8.410 1.00 0.00 N ATOM 1750 CA LYS C 7 2.745 6.723 9.786 1.00 0.00 C ATOM 1751 C LYS C 7 1.244 6.469 9.738 1.00 0.00 C ATOM 1752 O LYS C 7 0.565 7.034 8.880 1.00 0.00 O ATOM 1753 CB LYS C 7 3.070 7.964 10.633 1.00 0.00 C ATOM 1754 CG LYS C 7 3.315 7.691 12.121 1.00 0.00 C ATOM 1755 CD LYS C 7 4.741 7.195 12.374 1.00 0.00 C ATOM 1756 CE LYS C 7 5.090 7.158 13.868 1.00 0.00 C ATOM 1757 NZ LYS C 7 4.987 8.493 14.488 1.00 0.00 N ATOM 0 H LYS C 7 2.656 7.713 7.950 1.00 0.00 H new ATOM 0 HA LYS C 7 3.258 5.872 10.235 1.00 0.00 H new ATOM 0 HB2 LYS C 7 3.955 8.446 10.218 1.00 0.00 H new ATOM 0 HB3 LYS C 7 2.247 8.673 10.540 1.00 0.00 H new ATOM 0 HG2 LYS C 7 3.139 8.602 12.693 1.00 0.00 H new ATOM 0 HG3 LYS C 7 2.602 6.948 12.478 1.00 0.00 H new ATOM 0 HD2 LYS C 7 4.856 6.197 11.952 1.00 0.00 H new ATOM 0 HD3 LYS C 7 5.446 7.844 11.855 1.00 0.00 H new ATOM 0 HE2 LYS C 7 4.421 6.467 14.381 1.00 0.00 H new ATOM 0 HE3 LYS C 7 6.103 6.775 13.995 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 5.522 8.504 15.380 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 5.378 9.207 13.841 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 3.988 8.710 14.681 1.00 0.00 H new ATOM 1771 N VAL C 8 0.704 5.634 10.633 1.00 0.00 N ATOM 1772 CA VAL C 8 -0.722 5.329 10.578 1.00 0.00 C ATOM 1773 C VAL C 8 -1.534 6.626 10.599 1.00 0.00 C ATOM 1774 O VAL C 8 -1.410 7.433 11.520 1.00 0.00 O ATOM 1775 CB VAL C 8 -1.136 4.338 11.672 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -0.263 3.084 11.597 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -1.024 4.910 13.083 1.00 0.00 C ATOM 0 H VAL C 8 1.219 5.171 11.382 1.00 0.00 H new ATOM 0 HA VAL C 8 -0.939 4.824 9.637 1.00 0.00 H new ATOM 0 HB VAL C 8 -2.185 4.107 11.487 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -0.563 2.385 12.377 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -0.385 2.613 10.621 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.782 3.359 11.739 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -1.332 4.156 13.807 1.00 0.00 H new ATOM 0 HG22 VAL C 8 0.009 5.199 13.278 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -1.668 5.784 13.173 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.369 6.823 9.575 1.00 0.00 N ATOM 1788 CA GLY C 9 -3.180 8.025 9.427 1.00 0.00 C ATOM 1789 C GLY C 9 -2.797 8.862 8.203 1.00 0.00 C ATOM 1790 O GLY C 9 -3.405 9.906 7.971 1.00 0.00 O ATOM 0 H GLY C 9 -2.499 6.146 8.823 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -4.230 7.741 9.351 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -3.079 8.637 10.324 1.00 0.00 H new ATOM 1794 N GLU C 10 -1.805 8.423 7.420 1.00 0.00 N ATOM 1795 CA GLU C 10 -1.343 9.155 6.245 1.00 0.00 C ATOM 1796 C GLU C 10 -1.700 8.426 4.944 1.00 0.00 C ATOM 1797 O GLU C 10 -2.468 7.463 4.953 1.00 0.00 O ATOM 1798 CB GLU C 10 0.170 9.371 6.336 1.00 0.00 C ATOM 1799 CG GLU C 10 0.584 10.297 7.476 1.00 0.00 C ATOM 1800 CD GLU C 10 2.084 10.572 7.397 1.00 0.00 C ATOM 1801 OE1 GLU C 10 2.846 9.591 7.237 1.00 0.00 O ATOM 1802 OE2 GLU C 10 2.466 11.761 7.492 1.00 0.00 O ATOM 0 H GLU C 10 -1.303 7.551 7.587 1.00 0.00 H new ATOM 0 HA GLU C 10 -1.850 10.120 6.226 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.660 8.406 6.466 1.00 0.00 H new ATOM 0 HB3 GLU C 10 0.527 9.786 5.393 1.00 0.00 H new ATOM 0 HG2 GLU C 10 0.029 11.233 7.416 1.00 0.00 H new ATOM 0 HG3 GLU C 10 0.338 9.841 8.435 1.00 0.00 H new ATOM 1809 N SER C 11 -1.139 8.889 3.823 1.00 0.00 N ATOM 1810 CA SER C 11 -1.499 8.443 2.484 1.00 0.00 C ATOM 1811 C SER C 11 -0.327 8.585 1.508 1.00 0.00 C ATOM 1812 O SER C 11 0.691 9.199 1.830 1.00 0.00 O ATOM 1813 CB SER C 11 -2.682 9.274 1.974 1.00 0.00 C ATOM 1814 OG SER C 11 -3.821 9.090 2.785 1.00 0.00 O ATOM 0 H SER C 11 -0.407 9.599 3.827 1.00 0.00 H new ATOM 0 HA SER C 11 -1.769 7.388 2.541 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.409 10.329 1.959 1.00 0.00 H new ATOM 0 HB3 SER C 11 -2.913 8.990 0.947 1.00 0.00 H new ATOM 0 HG SER C 11 -4.560 9.632 2.439 1.00 0.00 H new ATOM 1820 N ILE C 12 -0.492 8.010 0.312 1.00 0.00 N ATOM 1821 CA ILE C 12 0.470 8.023 -0.788 1.00 0.00 C ATOM 1822 C ILE C 12 -0.325 8.096 -2.097 1.00 0.00 C ATOM 1823 O ILE C 12 -1.529 7.853 -2.089 1.00 0.00 O ATOM 1824 CB ILE C 12 1.355 6.761 -0.715 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.323 6.890 0.466 1.00 0.00 C ATOM 1826 CG2 ILE C 12 2.152 6.489 -1.994 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.214 5.659 0.645 1.00 0.00 C ATOM 0 H ILE C 12 -1.343 7.499 0.076 1.00 0.00 H new ATOM 0 HA ILE C 12 1.136 8.884 -0.729 1.00 0.00 H new ATOM 0 HB ILE C 12 0.680 5.915 -0.584 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.951 7.768 0.319 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.753 7.055 1.380 1.00 0.00 H new ATOM 0 HG21 ILE C 12 2.749 5.586 -1.865 1.00 0.00 H new ATOM 0 HG22 ILE C 12 1.465 6.353 -2.829 1.00 0.00 H new ATOM 0 HG23 ILE C 12 2.810 7.333 -2.199 1.00 0.00 H new ATOM 0 HD11 ILE C 12 3.877 5.811 1.497 1.00 0.00 H new ATOM 0 HD12 ILE C 12 2.591 4.782 0.821 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.809 5.506 -0.255 1.00 0.00 H new ATOM 1839 N ASN C 13 0.328 8.425 -3.215 1.00 0.00 N ATOM 1840 CA ASN C 13 -0.343 8.557 -4.500 1.00 0.00 C ATOM 1841 C ASN C 13 0.420 7.844 -5.609 1.00 0.00 C ATOM 1842 O ASN C 13 1.637 7.682 -5.540 1.00 0.00 O ATOM 1843 CB ASN C 13 -0.486 10.042 -4.829 1.00 0.00 C ATOM 1844 CG ASN C 13 -1.609 10.674 -4.018 1.00 0.00 C ATOM 1845 OD1 ASN C 13 -1.364 11.338 -3.017 1.00 0.00 O ATOM 1846 ND2 ASN C 13 -2.849 10.471 -4.451 1.00 0.00 N ATOM 0 H ASN C 13 1.331 8.605 -3.250 1.00 0.00 H new ATOM 0 HA ASN C 13 -1.325 8.089 -4.431 1.00 0.00 H new ATOM 0 HB2 ASN C 13 0.452 10.556 -4.621 1.00 0.00 H new ATOM 0 HB3 ASN C 13 -0.687 10.165 -5.893 1.00 0.00 H new ATOM 0 HD21 ASN C 13 -3.638 10.874 -3.946 1.00 0.00 H new ATOM 0 HD22 ASN C 13 -3.012 9.912 -5.289 1.00 0.00 H new ATOM 1853 N ILE C 14 -0.325 7.428 -6.640 1.00 0.00 N ATOM 1854 CA ILE C 14 0.216 6.723 -7.792 1.00 0.00 C ATOM 1855 C ILE C 14 -0.561 7.161 -9.032 1.00 0.00 C ATOM 1856 O ILE C 14 -1.773 7.389 -8.965 1.00 0.00 O ATOM 1857 CB ILE C 14 0.092 5.204 -7.586 1.00 0.00 C ATOM 1858 CG1 ILE C 14 0.807 4.783 -6.290 1.00 0.00 C ATOM 1859 CG2 ILE C 14 0.694 4.464 -8.787 1.00 0.00 C ATOM 1860 CD1 ILE C 14 0.700 3.279 -6.023 1.00 0.00 C ATOM 0 H ILE C 14 -1.333 7.577 -6.691 1.00 0.00 H new ATOM 0 HA ILE C 14 1.272 6.961 -7.917 1.00 0.00 H new ATOM 0 HB ILE C 14 -0.963 4.943 -7.502 1.00 0.00 H new ATOM 0 HG12 ILE C 14 1.858 5.064 -6.351 1.00 0.00 H new ATOM 0 HG13 ILE C 14 0.380 5.329 -5.449 1.00 0.00 H new ATOM 0 HG21 ILE C 14 0.603 3.389 -8.635 1.00 0.00 H new ATOM 0 HG22 ILE C 14 0.161 4.748 -9.694 1.00 0.00 H new ATOM 0 HG23 ILE C 14 1.747 4.728 -8.887 1.00 0.00 H new ATOM 0 HD11 ILE C 14 1.221 3.036 -5.097 1.00 0.00 H new ATOM 0 HD12 ILE C 14 -0.350 2.999 -5.933 1.00 0.00 H new ATOM 0 HD13 ILE C 14 1.152 2.730 -6.849 1.00 0.00 H new ATOM 1872 N GLY C 15 0.135 7.278 -10.167 1.00 0.00 N ATOM 1873 CA GLY C 15 -0.470 7.734 -11.404 1.00 0.00 C ATOM 1874 C GLY C 15 -1.128 9.093 -11.196 1.00 0.00 C ATOM 1875 O GLY C 15 -0.576 9.962 -10.520 1.00 0.00 O ATOM 0 H GLY C 15 1.128 7.058 -10.245 1.00 0.00 H new ATOM 0 HA2 GLY C 15 0.288 7.804 -12.184 1.00 0.00 H new ATOM 0 HA3 GLY C 15 -1.211 7.011 -11.744 1.00 0.00 H new ATOM 1879 N ASP C 16 -2.310 9.268 -11.782 1.00 0.00 N ATOM 1880 CA ASP C 16 -3.099 10.486 -11.654 1.00 0.00 C ATOM 1881 C ASP C 16 -4.536 10.137 -11.261 1.00 0.00 C ATOM 1882 O ASP C 16 -5.418 10.995 -11.289 1.00 0.00 O ATOM 1883 CB ASP C 16 -3.058 11.271 -12.967 1.00 0.00 C ATOM 1884 CG ASP C 16 -1.633 11.678 -13.336 1.00 0.00 C ATOM 1885 OD1 ASP C 16 -1.178 12.719 -12.811 1.00 0.00 O ATOM 1886 OD2 ASP C 16 -1.009 10.951 -14.142 1.00 0.00 O ATOM 0 H ASP C 16 -2.751 8.557 -12.366 1.00 0.00 H new ATOM 0 HA ASP C 16 -2.677 11.114 -10.869 1.00 0.00 H new ATOM 0 HB2 ASP C 16 -3.482 10.665 -13.767 1.00 0.00 H new ATOM 0 HB3 ASP C 16 -3.680 12.162 -12.878 1.00 0.00 H new ATOM 1891 N ASP C 17 -4.769 8.870 -10.893 1.00 0.00 N ATOM 1892 CA ASP C 17 -6.097 8.360 -10.589 1.00 0.00 C ATOM 1893 C ASP C 17 -6.091 7.381 -9.414 1.00 0.00 C ATOM 1894 O ASP C 17 -7.109 6.739 -9.153 1.00 0.00 O ATOM 1895 CB ASP C 17 -6.673 7.675 -11.834 1.00 0.00 C ATOM 1896 CG ASP C 17 -6.837 8.650 -12.996 1.00 0.00 C ATOM 1897 OD1 ASP C 17 -7.852 9.384 -12.995 1.00 0.00 O ATOM 1898 OD2 ASP C 17 -5.949 8.656 -13.878 1.00 0.00 O ATOM 0 H ASP C 17 -4.031 8.172 -10.800 1.00 0.00 H new ATOM 0 HA ASP C 17 -6.719 9.207 -10.298 1.00 0.00 H new ATOM 0 HB2 ASP C 17 -6.017 6.858 -12.135 1.00 0.00 H new ATOM 0 HB3 ASP C 17 -7.640 7.234 -11.591 1.00 0.00 H new ATOM 1903 N ILE C 18 -4.969 7.241 -8.691 1.00 0.00 N ATOM 1904 CA ILE C 18 -4.902 6.304 -7.579 1.00 0.00 C ATOM 1905 C ILE C 18 -4.315 6.965 -6.335 1.00 0.00 C ATOM 1906 O ILE C 18 -3.432 7.817 -6.416 1.00 0.00 O ATOM 1907 CB ILE C 18 -4.083 5.059 -7.965 1.00 0.00 C ATOM 1908 CG1 ILE C 18 -4.662 4.327 -9.186 1.00 0.00 C ATOM 1909 CG2 ILE C 18 -4.063 4.074 -6.790 1.00 0.00 C ATOM 1910 CD1 ILE C 18 -4.041 4.824 -10.492 1.00 0.00 C ATOM 0 H ILE C 18 -4.109 7.762 -8.860 1.00 0.00 H new ATOM 0 HA ILE C 18 -5.920 5.991 -7.346 1.00 0.00 H new ATOM 0 HB ILE C 18 -3.080 5.406 -8.214 1.00 0.00 H new ATOM 0 HG12 ILE C 18 -4.487 3.256 -9.085 1.00 0.00 H new ATOM 0 HG13 ILE C 18 -5.742 4.472 -9.219 1.00 0.00 H new ATOM 0 HG21 ILE C 18 -3.483 3.193 -7.064 1.00 0.00 H new ATOM 0 HG22 ILE C 18 -3.609 4.552 -5.922 1.00 0.00 H new ATOM 0 HG23 ILE C 18 -5.083 3.776 -6.548 1.00 0.00 H new ATOM 0 HD11 ILE C 18 -4.477 4.282 -11.331 1.00 0.00 H new ATOM 0 HD12 ILE C 18 -4.239 5.890 -10.606 1.00 0.00 H new ATOM 0 HD13 ILE C 18 -2.964 4.655 -10.470 1.00 0.00 H new ATOM 1922 N THR C 19 -4.827 6.553 -5.172 1.00 0.00 N ATOM 1923 CA THR C 19 -4.380 7.015 -3.867 1.00 0.00 C ATOM 1924 C THR C 19 -4.339 5.813 -2.927 1.00 0.00 C ATOM 1925 O THR C 19 -5.073 4.848 -3.128 1.00 0.00 O ATOM 1926 CB THR C 19 -5.346 8.085 -3.348 1.00 0.00 C ATOM 1927 OG1 THR C 19 -5.485 9.120 -4.296 1.00 0.00 O ATOM 1928 CG2 THR C 19 -4.858 8.693 -2.035 1.00 0.00 C ATOM 0 H THR C 19 -5.583 5.871 -5.117 1.00 0.00 H new ATOM 0 HA THR C 19 -3.386 7.459 -3.930 1.00 0.00 H new ATOM 0 HB THR C 19 -6.305 7.596 -3.178 1.00 0.00 H new ATOM 0 HG1 THR C 19 -6.106 9.796 -3.953 1.00 0.00 H new ATOM 0 HG21 THR C 19 -5.568 9.448 -1.697 1.00 0.00 H new ATOM 0 HG22 THR C 19 -4.774 7.911 -1.281 1.00 0.00 H new ATOM 0 HG23 THR C 19 -3.883 9.155 -2.188 1.00 0.00 H new ATOM 1936 N ILE C 20 -3.486 5.876 -1.901 1.00 0.00 N ATOM 1937 CA ILE C 20 -3.264 4.782 -0.965 1.00 0.00 C ATOM 1938 C ILE C 20 -3.307 5.348 0.451 1.00 0.00 C ATOM 1939 O ILE C 20 -2.950 6.505 0.661 1.00 0.00 O ATOM 1940 CB ILE C 20 -1.889 4.145 -1.243 1.00 0.00 C ATOM 1941 CG1 ILE C 20 -1.652 3.822 -2.727 1.00 0.00 C ATOM 1942 CG2 ILE C 20 -1.714 2.876 -0.406 1.00 0.00 C ATOM 1943 CD1 ILE C 20 -2.554 2.702 -3.243 1.00 0.00 C ATOM 0 H ILE C 20 -2.924 6.703 -1.698 1.00 0.00 H new ATOM 0 HA ILE C 20 -4.032 4.017 -1.079 1.00 0.00 H new ATOM 0 HB ILE C 20 -1.146 4.890 -0.960 1.00 0.00 H new ATOM 0 HG12 ILE C 20 -1.821 4.720 -3.321 1.00 0.00 H new ATOM 0 HG13 ILE C 20 -0.610 3.537 -2.870 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -0.738 2.436 -0.612 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.783 3.126 0.653 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -2.496 2.161 -0.662 1.00 0.00 H new ATOM 0 HD11 ILE C 20 -2.341 2.519 -4.296 1.00 0.00 H new ATOM 0 HD12 ILE C 20 -2.368 1.793 -2.672 1.00 0.00 H new ATOM 0 HD13 ILE C 20 -3.598 2.994 -3.130 1.00 0.00 H new ATOM 1955 N THR C 21 -3.739 4.543 1.426 1.00 0.00 N ATOM 1956 CA THR C 21 -3.867 4.988 2.812 1.00 0.00 C ATOM 1957 C THR C 21 -3.392 3.895 3.765 1.00 0.00 C ATOM 1958 O THR C 21 -3.433 2.712 3.428 1.00 0.00 O ATOM 1959 CB THR C 21 -5.333 5.339 3.088 1.00 0.00 C ATOM 1960 OG1 THR C 21 -5.782 6.294 2.150 1.00 0.00 O ATOM 1961 CG2 THR C 21 -5.545 5.932 4.480 1.00 0.00 C ATOM 0 H THR C 21 -4.008 3.571 1.276 1.00 0.00 H new ATOM 0 HA THR C 21 -3.246 5.869 2.972 1.00 0.00 H new ATOM 0 HB THR C 21 -5.891 4.406 3.014 1.00 0.00 H new ATOM 0 HG1 THR C 21 -6.720 6.514 2.330 1.00 0.00 H new ATOM 0 HG21 THR C 21 -6.601 6.162 4.621 1.00 0.00 H new ATOM 0 HG22 THR C 21 -5.226 5.213 5.234 1.00 0.00 H new ATOM 0 HG23 THR C 21 -4.959 6.846 4.579 1.00 0.00 H new ATOM 1969 N ILE C 22 -2.936 4.293 4.955 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.496 3.375 5.999 1.00 0.00 C ATOM 1971 C ILE C 22 -3.473 3.441 7.167 1.00 0.00 C ATOM 1972 O ILE C 22 -3.342 4.278 8.061 1.00 0.00 O ATOM 1973 CB ILE C 22 -1.039 3.674 6.386 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -0.550 2.869 7.590 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -0.805 5.158 6.678 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -0.698 1.371 7.362 1.00 0.00 C ATOM 0 H ILE C 22 -2.862 5.275 5.220 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.502 2.346 5.640 1.00 0.00 H new ATOM 0 HB ILE C 22 -0.465 3.374 5.509 1.00 0.00 H new ATOM 0 HG12 ILE C 22 0.496 3.106 7.786 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -1.114 3.160 8.476 1.00 0.00 H new ATOM 0 HG21 ILE C 22 0.240 5.316 6.946 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -1.045 5.745 5.792 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.443 5.471 7.504 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -0.340 0.832 8.239 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -1.748 1.131 7.192 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -0.113 1.076 6.491 1.00 0.00 H new ATOM 1988 N LEU C 23 -4.466 2.551 7.160 1.00 0.00 N ATOM 1989 CA LEU C 23 -5.502 2.557 8.179 1.00 0.00 C ATOM 1990 C LEU C 23 -4.915 2.199 9.545 1.00 0.00 C ATOM 1991 O LEU C 23 -5.402 2.687 10.562 1.00 0.00 O ATOM 1992 CB LEU C 23 -6.607 1.565 7.801 1.00 0.00 C ATOM 1993 CG LEU C 23 -7.097 1.737 6.359 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -8.252 0.773 6.104 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -7.612 3.148 6.090 1.00 0.00 C ATOM 0 H LEU C 23 -4.570 1.819 6.457 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.927 3.559 8.241 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -6.237 0.549 7.934 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -7.449 1.690 8.482 1.00 0.00 H new ATOM 0 HG LEU C 23 -6.248 1.539 5.704 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -8.605 0.891 5.079 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -7.911 -0.251 6.255 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -9.066 0.990 6.795 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -7.948 3.222 5.056 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -8.445 3.365 6.759 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -6.811 3.867 6.263 1.00 0.00 H new ATOM 2007 N GLY C 24 -3.877 1.353 9.574 1.00 0.00 N ATOM 2008 CA GLY C 24 -3.175 1.062 10.820 1.00 0.00 C ATOM 2009 C GLY C 24 -2.448 -0.277 10.782 1.00 0.00 C ATOM 2010 O GLY C 24 -2.356 -0.907 9.728 1.00 0.00 O ATOM 0 H GLY C 24 -3.512 0.865 8.756 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -2.456 1.856 11.022 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -3.889 1.061 11.644 1.00 0.00 H new ATOM 2014 N VAL C 25 -1.930 -0.718 11.934 1.00 0.00 N ATOM 2015 CA VAL C 25 -1.231 -1.995 12.044 1.00 0.00 C ATOM 2016 C VAL C 25 -1.700 -2.756 13.281 1.00 0.00 C ATOM 2017 O VAL C 25 -2.286 -2.175 14.193 1.00 0.00 O ATOM 2018 CB VAL C 25 0.295 -1.795 12.086 1.00 0.00 C ATOM 2019 CG1 VAL C 25 0.748 -0.781 11.032 1.00 0.00 C ATOM 2020 CG2 VAL C 25 0.782 -1.336 13.461 1.00 0.00 C ATOM 0 H VAL C 25 -1.985 -0.199 12.810 1.00 0.00 H new ATOM 0 HA VAL C 25 -1.469 -2.583 11.158 1.00 0.00 H new ATOM 0 HB VAL C 25 0.736 -2.769 11.871 1.00 0.00 H new ATOM 0 HG11 VAL C 25 1.830 -0.660 11.085 1.00 0.00 H new ATOM 0 HG12 VAL C 25 0.471 -1.139 10.040 1.00 0.00 H new ATOM 0 HG13 VAL C 25 0.266 0.178 11.219 1.00 0.00 H new ATOM 0 HG21 VAL C 25 1.864 -1.209 13.440 1.00 0.00 H new ATOM 0 HG22 VAL C 25 0.310 -0.387 13.716 1.00 0.00 H new ATOM 0 HG23 VAL C 25 0.519 -2.084 14.209 1.00 0.00 H new ATOM 2030 N SER C 26 -1.437 -4.065 13.300 1.00 0.00 N ATOM 2031 CA SER C 26 -1.759 -4.937 14.422 1.00 0.00 C ATOM 2032 C SER C 26 -0.723 -6.058 14.451 1.00 0.00 C ATOM 2033 O SER C 26 -0.763 -6.960 13.616 1.00 0.00 O ATOM 2034 CB SER C 26 -3.161 -5.531 14.248 1.00 0.00 C ATOM 2035 OG SER C 26 -4.125 -4.505 14.185 1.00 0.00 O ATOM 0 H SER C 26 -0.988 -4.551 12.524 1.00 0.00 H new ATOM 0 HA SER C 26 -1.743 -4.373 15.354 1.00 0.00 H new ATOM 0 HB2 SER C 26 -3.199 -6.130 13.338 1.00 0.00 H new ATOM 0 HB3 SER C 26 -3.386 -6.199 15.079 1.00 0.00 H new ATOM 0 HG SER C 26 -5.015 -4.899 14.072 1.00 0.00 H new ATOM 2041 N GLY C 27 0.208 -6.004 15.406 1.00 0.00 N ATOM 2042 CA GLY C 27 1.325 -6.932 15.446 1.00 0.00 C ATOM 2043 C GLY C 27 2.233 -6.674 14.254 1.00 0.00 C ATOM 2044 O GLY C 27 3.078 -5.787 14.304 1.00 0.00 O ATOM 0 H GLY C 27 0.204 -5.321 16.163 1.00 0.00 H new ATOM 0 HA2 GLY C 27 1.881 -6.810 16.375 1.00 0.00 H new ATOM 0 HA3 GLY C 27 0.961 -7.959 15.425 1.00 0.00 H new ATOM 2048 N GLN C 28 2.055 -7.455 13.185 1.00 0.00 N ATOM 2049 CA GLN C 28 2.764 -7.255 11.927 1.00 0.00 C ATOM 2050 C GLN C 28 1.780 -7.138 10.767 1.00 0.00 C ATOM 2051 O GLN C 28 2.201 -6.954 9.625 1.00 0.00 O ATOM 2052 CB GLN C 28 3.740 -8.404 11.669 1.00 0.00 C ATOM 2053 CG GLN C 28 4.932 -8.446 12.620 1.00 0.00 C ATOM 2054 CD GLN C 28 5.846 -7.231 12.480 1.00 0.00 C ATOM 2055 OE1 GLN C 28 6.904 -7.311 11.860 1.00 0.00 O ATOM 2056 NE2 GLN C 28 5.458 -6.094 13.047 1.00 0.00 N ATOM 0 H GLN C 28 1.411 -8.246 13.172 1.00 0.00 H new ATOM 0 HA GLN C 28 3.329 -6.326 12.003 1.00 0.00 H new ATOM 0 HB2 GLN C 28 3.199 -9.347 11.743 1.00 0.00 H new ATOM 0 HB3 GLN C 28 4.109 -8.328 10.646 1.00 0.00 H new ATOM 0 HG2 GLN C 28 4.570 -8.506 13.646 1.00 0.00 H new ATOM 0 HG3 GLN C 28 5.509 -9.352 12.432 1.00 0.00 H new ATOM 0 HE21 GLN C 28 4.575 -6.053 13.556 1.00 0.00 H new ATOM 0 HE22 GLN C 28 6.043 -5.262 12.973 1.00 0.00 H new ATOM 2065 N GLN C 29 0.475 -7.245 11.046 1.00 0.00 N ATOM 2066 CA GLN C 29 -0.543 -6.996 10.042 1.00 0.00 C ATOM 2067 C GLN C 29 -0.614 -5.500 9.797 1.00 0.00 C ATOM 2068 O GLN C 29 -0.262 -4.703 10.667 1.00 0.00 O ATOM 2069 CB GLN C 29 -1.906 -7.496 10.520 1.00 0.00 C ATOM 2070 CG GLN C 29 -1.947 -9.023 10.509 1.00 0.00 C ATOM 2071 CD GLN C 29 -3.159 -9.572 11.234 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -4.258 -8.824 11.234 1.00 0.00 O flip ATOM 2073 NE2 GLN C 29 -3.098 -10.664 11.785 1.00 0.00 N flip ATOM 0 H GLN C 29 0.108 -7.503 11.962 1.00 0.00 H new ATOM 0 HA GLN C 29 -0.285 -7.526 9.125 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -2.103 -7.128 11.527 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -2.692 -7.100 9.877 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -1.952 -9.376 9.478 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -1.041 -9.412 10.974 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -2.231 -11.201 11.758 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -3.914 -11.036 12.271 1.00 0.00 H new ATOM 2082 N VAL C 30 -1.073 -5.123 8.608 1.00 0.00 N ATOM 2083 CA VAL C 30 -1.210 -3.737 8.225 1.00 0.00 C ATOM 2084 C VAL C 30 -2.499 -3.607 7.434 1.00 0.00 C ATOM 2085 O VAL C 30 -2.628 -4.211 6.371 1.00 0.00 O ATOM 2086 CB VAL C 30 -0.008 -3.316 7.371 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -0.101 -1.834 7.028 1.00 0.00 C ATOM 2088 CG2 VAL C 30 1.312 -3.545 8.111 1.00 0.00 C ATOM 0 H VAL C 30 -1.360 -5.781 7.884 1.00 0.00 H new ATOM 0 HA VAL C 30 -1.242 -3.090 9.102 1.00 0.00 H new ATOM 0 HB VAL C 30 -0.027 -3.924 6.467 1.00 0.00 H new ATOM 0 HG11 VAL C 30 0.758 -1.546 6.421 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -1.018 -1.647 6.470 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -0.109 -1.248 7.947 1.00 0.00 H new ATOM 0 HG21 VAL C 30 2.143 -3.236 7.477 1.00 0.00 H new ATOM 0 HG22 VAL C 30 1.320 -2.960 9.030 1.00 0.00 H new ATOM 0 HG23 VAL C 30 1.414 -4.603 8.353 1.00 0.00 H new ATOM 2098 N ARG C 31 -3.453 -2.824 7.948 1.00 0.00 N ATOM 2099 CA ARG C 31 -4.637 -2.490 7.180 1.00 0.00 C ATOM 2100 C ARG C 31 -4.253 -1.363 6.241 1.00 0.00 C ATOM 2101 O ARG C 31 -3.910 -0.265 6.686 1.00 0.00 O ATOM 2102 CB ARG C 31 -5.794 -2.032 8.069 1.00 0.00 C ATOM 2103 CG ARG C 31 -6.550 -3.213 8.671 1.00 0.00 C ATOM 2104 CD ARG C 31 -7.971 -2.780 9.045 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.994 -1.693 10.032 1.00 0.00 N ATOM 2106 CZ ARG C 31 -9.102 -1.018 10.350 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -10.270 -1.318 9.785 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -9.051 -0.032 11.241 1.00 0.00 N ATOM 0 H ARG C 31 -3.422 -2.418 8.883 1.00 0.00 H new ATOM 0 HA ARG C 31 -4.978 -3.376 6.644 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -5.409 -1.401 8.870 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.481 -1.421 7.484 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -6.586 -4.036 7.957 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -6.027 -3.580 9.554 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -8.497 -2.459 8.146 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -8.514 -3.637 9.443 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.122 -1.441 10.497 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -10.327 -2.072 9.100 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -11.108 -0.794 10.037 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.164 0.210 11.683 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -9.898 0.482 11.482 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.318 -1.659 4.946 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.990 -0.715 3.893 1.00 0.00 C ATOM 2124 C ILE C 32 -5.272 -0.428 3.127 1.00 0.00 C ATOM 2125 O ILE C 32 -6.071 -1.335 2.905 1.00 0.00 O ATOM 2126 CB ILE C 32 -2.930 -1.316 2.956 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -1.786 -1.951 3.759 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -2.401 -0.226 2.018 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -0.676 -2.499 2.859 1.00 0.00 C ATOM 0 H ILE C 32 -4.604 -2.574 4.599 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.581 0.205 4.311 1.00 0.00 H new ATOM 0 HB ILE C 32 -3.389 -2.105 2.360 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -1.366 -1.209 4.438 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -2.182 -2.758 4.375 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -1.649 -0.651 1.353 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.224 0.175 1.426 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -1.953 0.575 2.607 1.00 0.00 H new ATOM 0 HD11 ILE C 32 0.109 -2.937 3.475 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -1.087 -3.262 2.198 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -0.258 -1.688 2.262 1.00 0.00 H new ATOM 2141 N GLY C 33 -5.468 0.828 2.732 1.00 0.00 N ATOM 2142 CA GLY C 33 -6.640 1.239 1.980 1.00 0.00 C ATOM 2143 C GLY C 33 -6.198 1.735 0.619 1.00 0.00 C ATOM 2144 O GLY C 33 -5.094 2.264 0.474 1.00 0.00 O ATOM 0 H GLY C 33 -4.815 1.587 2.927 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -7.331 0.403 1.871 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -7.174 2.026 2.513 1.00 0.00 H new ATOM 2148 N ILE C 34 -7.053 1.573 -0.391 1.00 0.00 N ATOM 2149 CA ILE C 34 -6.749 2.019 -1.739 1.00 0.00 C ATOM 2150 C ILE C 34 -7.970 2.718 -2.306 1.00 0.00 C ATOM 2151 O ILE C 34 -9.105 2.341 -2.010 1.00 0.00 O ATOM 2152 CB ILE C 34 -6.324 0.818 -2.596 1.00 0.00 C ATOM 2153 CG1 ILE C 34 -5.083 0.168 -1.965 1.00 0.00 C ATOM 2154 CG2 ILE C 34 -6.032 1.292 -4.025 1.00 0.00 C ATOM 2155 CD1 ILE C 34 -4.647 -1.099 -2.702 1.00 0.00 C ATOM 0 H ILE C 34 -7.967 1.132 -0.293 1.00 0.00 H new ATOM 0 HA ILE C 34 -5.919 2.726 -1.735 1.00 0.00 H new ATOM 0 HB ILE C 34 -7.123 0.078 -2.637 1.00 0.00 H new ATOM 0 HG12 ILE C 34 -4.262 0.885 -1.964 1.00 0.00 H new ATOM 0 HG13 ILE C 34 -5.294 -0.076 -0.924 1.00 0.00 H new ATOM 0 HG21 ILE C 34 -5.730 0.441 -4.636 1.00 0.00 H new ATOM 0 HG22 ILE C 34 -6.929 1.743 -4.449 1.00 0.00 H new ATOM 0 HG23 ILE C 34 -5.229 2.029 -4.007 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -3.766 -1.518 -2.215 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -5.456 -1.829 -2.680 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -4.408 -0.854 -3.737 1.00 0.00 H new ATOM 2167 N ASN C 35 -7.732 3.747 -3.119 1.00 0.00 N ATOM 2168 CA ASN C 35 -8.790 4.545 -3.702 1.00 0.00 C ATOM 2169 C ASN C 35 -8.480 4.772 -5.176 1.00 0.00 C ATOM 2170 O ASN C 35 -7.640 5.600 -5.525 1.00 0.00 O ATOM 2171 CB ASN C 35 -8.914 5.861 -2.924 1.00 0.00 C ATOM 2172 CG ASN C 35 -10.170 6.632 -3.291 1.00 0.00 C ATOM 2173 OD1 ASN C 35 -10.877 6.287 -4.233 1.00 0.00 O ATOM 2174 ND2 ASN C 35 -10.459 7.692 -2.543 1.00 0.00 N ATOM 0 H ASN C 35 -6.794 4.045 -3.388 1.00 0.00 H new ATOM 0 HA ASN C 35 -9.750 4.032 -3.637 1.00 0.00 H new ATOM 0 HB2 ASN C 35 -8.920 5.649 -1.855 1.00 0.00 H new ATOM 0 HB3 ASN C 35 -8.039 6.481 -3.121 1.00 0.00 H new ATOM 0 HD21 ASN C 35 -11.291 8.247 -2.745 1.00 0.00 H new ATOM 0 HD22 ASN C 35 -9.849 7.950 -1.767 1.00 0.00 H new ATOM 2181 N ALA C 36 -9.173 4.017 -6.027 1.00 0.00 N ATOM 2182 CA ALA C 36 -8.997 4.059 -7.464 1.00 0.00 C ATOM 2183 C ALA C 36 -10.346 3.825 -8.138 1.00 0.00 C ATOM 2184 O ALA C 36 -11.227 3.209 -7.535 1.00 0.00 O ATOM 2185 CB ALA C 36 -7.998 2.968 -7.856 1.00 0.00 C ATOM 0 H ALA C 36 -9.883 3.350 -5.724 1.00 0.00 H new ATOM 0 HA ALA C 36 -8.615 5.029 -7.783 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -7.850 2.981 -8.936 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -7.046 3.150 -7.357 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -8.385 1.995 -7.555 1.00 0.00 H new ATOM 2191 N PRO C 37 -10.535 4.303 -9.374 1.00 0.00 N ATOM 2192 CA PRO C 37 -11.759 4.094 -10.125 1.00 0.00 C ATOM 2193 C PRO C 37 -11.858 2.647 -10.591 1.00 0.00 C ATOM 2194 O PRO C 37 -10.841 1.981 -10.787 1.00 0.00 O ATOM 2195 CB PRO C 37 -11.646 5.037 -11.324 1.00 0.00 C ATOM 2196 CG PRO C 37 -10.139 5.141 -11.551 1.00 0.00 C ATOM 2197 CD PRO C 37 -9.579 5.083 -10.134 1.00 0.00 C ATOM 0 HA PRO C 37 -12.649 4.292 -9.528 1.00 0.00 H new ATOM 0 HB2 PRO C 37 -12.158 4.637 -12.199 1.00 0.00 H new ATOM 0 HB3 PRO C 37 -12.089 6.010 -11.113 1.00 0.00 H new ATOM 0 HG2 PRO C 37 -9.765 4.323 -12.167 1.00 0.00 H new ATOM 0 HG3 PRO C 37 -9.869 6.069 -12.055 1.00 0.00 H new ATOM 0 HD2 PRO C 37 -8.593 4.618 -10.120 1.00 0.00 H new ATOM 0 HD3 PRO C 37 -9.466 6.083 -9.715 1.00 0.00 H new ATOM 2205 N LYS C 38 -13.087 2.148 -10.777 1.00 0.00 N ATOM 2206 CA LYS C 38 -13.307 0.806 -11.309 1.00 0.00 C ATOM 2207 C LYS C 38 -12.801 0.713 -12.747 1.00 0.00 C ATOM 2208 O LYS C 38 -12.804 -0.365 -13.340 1.00 0.00 O ATOM 2209 CB LYS C 38 -14.794 0.453 -11.209 1.00 0.00 C ATOM 2210 CG LYS C 38 -15.264 0.375 -9.749 1.00 0.00 C ATOM 2211 CD LYS C 38 -14.601 -0.770 -8.974 1.00 0.00 C ATOM 2212 CE LYS C 38 -14.904 -2.135 -9.595 1.00 0.00 C ATOM 2213 NZ LYS C 38 -16.355 -2.407 -9.624 1.00 0.00 N ATOM 0 H LYS C 38 -13.944 2.659 -10.565 1.00 0.00 H new ATOM 0 HA LYS C 38 -12.744 0.083 -10.719 1.00 0.00 H new ATOM 0 HB2 LYS C 38 -15.382 1.201 -11.741 1.00 0.00 H new ATOM 0 HB3 LYS C 38 -14.975 -0.503 -11.701 1.00 0.00 H new ATOM 0 HG2 LYS C 38 -15.046 1.320 -9.251 1.00 0.00 H new ATOM 0 HG3 LYS C 38 -16.346 0.245 -9.726 1.00 0.00 H new ATOM 0 HD2 LYS C 38 -13.522 -0.614 -8.950 1.00 0.00 H new ATOM 0 HD3 LYS C 38 -14.948 -0.757 -7.941 1.00 0.00 H new ATOM 0 HE2 LYS C 38 -14.506 -2.171 -10.609 1.00 0.00 H new ATOM 0 HE3 LYS C 38 -14.398 -2.915 -9.026 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 -16.516 -3.403 -9.874 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 -16.763 -2.215 -8.687 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 -16.809 -1.795 -10.331 1.00 0.00 H new ATOM 2227 N ASP C 39 -12.362 1.844 -13.311 1.00 0.00 N ATOM 2228 CA ASP C 39 -11.705 1.906 -14.603 1.00 0.00 C ATOM 2229 C ASP C 39 -10.328 1.230 -14.560 1.00 0.00 C ATOM 2230 O ASP C 39 -9.702 1.038 -15.603 1.00 0.00 O ATOM 2231 CB ASP C 39 -11.556 3.374 -15.009 1.00 0.00 C ATOM 2232 CG ASP C 39 -12.908 4.000 -15.335 1.00 0.00 C ATOM 2233 OD1 ASP C 39 -13.342 3.849 -16.500 1.00 0.00 O ATOM 2234 OD2 ASP C 39 -13.491 4.624 -14.423 1.00 0.00 O ATOM 0 H ASP C 39 -12.460 2.756 -12.865 1.00 0.00 H new ATOM 0 HA ASP C 39 -12.312 1.373 -15.335 1.00 0.00 H new ATOM 0 HB2 ASP C 39 -11.081 3.930 -14.201 1.00 0.00 H new ATOM 0 HB3 ASP C 39 -10.900 3.449 -15.876 1.00 0.00 H new ATOM 2239 N VAL C 40 -9.861 0.869 -13.360 1.00 0.00 N ATOM 2240 CA VAL C 40 -8.602 0.164 -13.166 1.00 0.00 C ATOM 2241 C VAL C 40 -8.773 -0.912 -12.097 1.00 0.00 C ATOM 2242 O VAL C 40 -9.712 -0.864 -11.304 1.00 0.00 O ATOM 2243 CB VAL C 40 -7.473 1.134 -12.783 1.00 0.00 C ATOM 2244 CG1 VAL C 40 -7.350 2.265 -13.804 1.00 0.00 C ATOM 2245 CG2 VAL C 40 -7.679 1.758 -11.403 1.00 0.00 C ATOM 0 H VAL C 40 -10.357 1.063 -12.490 1.00 0.00 H new ATOM 0 HA VAL C 40 -8.323 -0.309 -14.107 1.00 0.00 H new ATOM 0 HB VAL C 40 -6.561 0.537 -12.767 1.00 0.00 H new ATOM 0 HG11 VAL C 40 -6.544 2.936 -13.508 1.00 0.00 H new ATOM 0 HG12 VAL C 40 -7.131 1.846 -14.786 1.00 0.00 H new ATOM 0 HG13 VAL C 40 -8.287 2.820 -13.847 1.00 0.00 H new ATOM 0 HG21 VAL C 40 -6.853 2.434 -11.183 1.00 0.00 H new ATOM 0 HG22 VAL C 40 -8.616 2.314 -11.391 1.00 0.00 H new ATOM 0 HG23 VAL C 40 -7.714 0.971 -10.650 1.00 0.00 H new ATOM 2255 N ALA C 41 -7.866 -1.890 -12.072 1.00 0.00 N ATOM 2256 CA ALA C 41 -7.962 -3.016 -11.157 1.00 0.00 C ATOM 2257 C ALA C 41 -7.048 -2.833 -9.945 1.00 0.00 C ATOM 2258 O ALA C 41 -6.057 -2.107 -10.004 1.00 0.00 O ATOM 2259 CB ALA C 41 -7.583 -4.287 -11.915 1.00 0.00 C ATOM 0 H ALA C 41 -7.051 -1.919 -12.684 1.00 0.00 H new ATOM 0 HA ALA C 41 -8.984 -3.086 -10.784 1.00 0.00 H new ATOM 0 HB1 ALA C 41 -7.649 -5.144 -11.245 1.00 0.00 H new ATOM 0 HB2 ALA C 41 -8.266 -4.428 -12.753 1.00 0.00 H new ATOM 0 HB3 ALA C 41 -6.563 -4.197 -12.289 1.00 0.00 H new ATOM 2265 N VAL C 42 -7.389 -3.504 -8.840 1.00 0.00 N ATOM 2266 CA VAL C 42 -6.545 -3.554 -7.650 1.00 0.00 C ATOM 2267 C VAL C 42 -6.844 -4.844 -6.890 1.00 0.00 C ATOM 2268 O VAL C 42 -8.007 -5.198 -6.708 1.00 0.00 O ATOM 2269 CB VAL C 42 -6.778 -2.307 -6.782 1.00 0.00 C ATOM 2270 CG1 VAL C 42 -8.258 -2.024 -6.546 1.00 0.00 C ATOM 2271 CG2 VAL C 42 -6.109 -2.443 -5.420 1.00 0.00 C ATOM 0 H VAL C 42 -8.260 -4.027 -8.749 1.00 0.00 H new ATOM 0 HA VAL C 42 -5.492 -3.555 -7.931 1.00 0.00 H new ATOM 0 HB VAL C 42 -6.339 -1.481 -7.341 1.00 0.00 H new ATOM 0 HG11 VAL C 42 -8.364 -1.133 -5.927 1.00 0.00 H new ATOM 0 HG12 VAL C 42 -8.755 -1.863 -7.503 1.00 0.00 H new ATOM 0 HG13 VAL C 42 -8.715 -2.874 -6.039 1.00 0.00 H new ATOM 0 HG21 VAL C 42 -6.294 -1.544 -4.832 1.00 0.00 H new ATOM 0 HG22 VAL C 42 -6.518 -3.308 -4.898 1.00 0.00 H new ATOM 0 HG23 VAL C 42 -5.035 -2.575 -5.554 1.00 0.00 H new ATOM 2281 N HIS C 43 -5.799 -5.548 -6.446 1.00 0.00 N ATOM 2282 CA HIS C 43 -5.937 -6.832 -5.764 1.00 0.00 C ATOM 2283 C HIS C 43 -4.710 -7.118 -4.907 1.00 0.00 C ATOM 2284 O HIS C 43 -3.704 -6.413 -5.011 1.00 0.00 O ATOM 2285 CB HIS C 43 -6.040 -7.955 -6.801 1.00 0.00 C ATOM 2286 CG HIS C 43 -7.104 -7.751 -7.845 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -8.453 -8.071 -7.696 1.00 0.00 N ATOM 2288 CD2 HIS C 43 -6.895 -7.224 -9.085 1.00 0.00 C ATOM 2289 CE1 HIS C 43 -9.028 -7.723 -8.856 1.00 0.00 C ATOM 2290 NE2 HIS C 43 -8.122 -7.210 -9.706 1.00 0.00 N ATOM 0 H HIS C 43 -4.832 -5.240 -6.551 1.00 0.00 H new ATOM 0 HA HIS C 43 -6.830 -6.787 -5.140 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -5.076 -8.060 -7.300 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -6.235 -8.894 -6.282 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -8.905 -8.482 -6.879 1.00 0.00 H new ATOM 0 HD2 HIS C 43 -5.955 -6.886 -9.496 1.00 0.00 H new ATOM 0 HE1 HIS C 43 -10.079 -7.839 -9.078 1.00 0.00 H new ATOM 2298 N ARG C 44 -4.773 -8.152 -4.062 1.00 0.00 N ATOM 2299 CA ARG C 44 -3.579 -8.609 -3.365 1.00 0.00 C ATOM 2300 C ARG C 44 -2.757 -9.463 -4.326 1.00 0.00 C ATOM 2301 O ARG C 44 -3.259 -9.867 -5.372 1.00 0.00 O ATOM 2302 CB ARG C 44 -3.969 -9.343 -2.075 1.00 0.00 C ATOM 2303 CG ARG C 44 -4.225 -10.833 -2.304 1.00 0.00 C ATOM 2304 CD ARG C 44 -4.900 -11.450 -1.078 1.00 0.00 C ATOM 2305 NE ARG C 44 -6.339 -11.170 -1.090 1.00 0.00 N ATOM 2306 CZ ARG C 44 -7.290 -12.103 -1.196 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -7.000 -13.400 -1.199 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -8.562 -11.746 -1.305 1.00 0.00 N ATOM 0 H ARG C 44 -5.622 -8.676 -3.850 1.00 0.00 H new ATOM 0 HA ARG C 44 -2.958 -7.769 -3.054 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -3.175 -9.223 -1.338 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -4.864 -8.884 -1.656 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.856 -10.970 -3.182 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -3.283 -11.344 -2.505 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -4.733 -12.527 -1.067 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -4.453 -11.049 -0.169 1.00 0.00 H new ATOM 0 HE ARG C 44 -6.634 -10.197 -1.012 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -6.030 -13.706 -1.119 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -7.747 -14.089 -1.281 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -8.816 -10.758 -1.308 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -9.287 -12.459 -1.386 1.00 0.00 H new ATOM 2322 N GLU C 45 -1.498 -9.740 -3.990 1.00 0.00 N ATOM 2323 CA GLU C 45 -0.595 -10.434 -4.902 1.00 0.00 C ATOM 2324 C GLU C 45 -1.083 -11.840 -5.273 1.00 0.00 C ATOM 2325 O GLU C 45 -0.704 -12.358 -6.324 1.00 0.00 O ATOM 2326 CB GLU C 45 0.802 -10.440 -4.277 1.00 0.00 C ATOM 2327 CG GLU C 45 1.886 -10.866 -5.268 1.00 0.00 C ATOM 2328 CD GLU C 45 2.120 -12.376 -5.317 1.00 0.00 C ATOM 2329 OE1 GLU C 45 1.535 -13.097 -4.478 1.00 0.00 O ATOM 2330 OE2 GLU C 45 2.888 -12.802 -6.208 1.00 0.00 O ATOM 0 H GLU C 45 -1.082 -9.494 -3.092 1.00 0.00 H new ATOM 0 HA GLU C 45 -0.566 -9.900 -5.852 1.00 0.00 H new ATOM 0 HB2 GLU C 45 1.031 -9.444 -3.899 1.00 0.00 H new ATOM 0 HB3 GLU C 45 0.811 -11.115 -3.422 1.00 0.00 H new ATOM 0 HG2 GLU C 45 1.611 -10.518 -6.264 1.00 0.00 H new ATOM 0 HG3 GLU C 45 2.821 -10.371 -5.004 1.00 0.00 H new ATOM 2337 N GLU C 46 -1.914 -12.471 -4.437 1.00 0.00 N ATOM 2338 CA GLU C 46 -2.482 -13.782 -4.745 1.00 0.00 C ATOM 2339 C GLU C 46 -3.537 -13.666 -5.840 1.00 0.00 C ATOM 2340 O GLU C 46 -3.506 -14.386 -6.836 1.00 0.00 O ATOM 2341 CB GLU C 46 -3.180 -14.330 -3.493 1.00 0.00 C ATOM 2342 CG GLU C 46 -3.745 -15.734 -3.725 1.00 0.00 C ATOM 2343 CD GLU C 46 -2.627 -16.761 -3.908 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -2.009 -17.127 -2.882 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -2.401 -17.174 -5.064 1.00 0.00 O ATOM 0 H GLU C 46 -2.208 -12.090 -3.538 1.00 0.00 H new ATOM 0 HA GLU C 46 -1.675 -14.437 -5.073 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -2.472 -14.355 -2.664 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -3.987 -13.657 -3.203 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -4.370 -16.021 -2.879 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -4.385 -15.729 -4.607 1.00 0.00 H new ATOM 2352 N ILE C 47 -4.476 -12.742 -5.634 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.646 -12.594 -6.480 1.00 0.00 C ATOM 2354 C ILE C 47 -5.281 -11.931 -7.799 1.00 0.00 C ATOM 2355 O ILE C 47 -5.902 -12.218 -8.820 1.00 0.00 O ATOM 2356 CB ILE C 47 -6.678 -11.772 -5.704 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -7.095 -12.485 -4.415 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -7.910 -11.506 -6.560 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -7.481 -13.948 -4.628 1.00 0.00 C ATOM 0 H ILE C 47 -4.439 -12.072 -4.866 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.063 -13.570 -6.729 1.00 0.00 H new ATOM 0 HB ILE C 47 -6.211 -10.822 -5.444 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -6.275 -12.434 -3.699 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.938 -11.955 -3.972 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -8.630 -10.920 -5.989 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -7.620 -10.953 -7.453 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -8.362 -12.454 -6.851 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.765 -14.392 -3.674 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -8.321 -14.006 -5.320 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.632 -14.492 -5.042 1.00 0.00 H new ATOM 2371 N TYR C 48 -4.280 -11.049 -7.805 1.00 0.00 N ATOM 2372 CA TYR C 48 -3.884 -10.377 -9.031 1.00 0.00 C ATOM 2373 C TYR C 48 -3.525 -11.396 -10.111 1.00 0.00 C ATOM 2374 O TYR C 48 -3.888 -11.226 -11.274 1.00 0.00 O ATOM 2375 CB TYR C 48 -2.685 -9.472 -8.757 1.00 0.00 C ATOM 2376 CG TYR C 48 -2.019 -9.006 -10.028 1.00 0.00 C ATOM 2377 CD1 TYR C 48 -2.790 -8.516 -11.092 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.625 -9.082 -10.144 1.00 0.00 C ATOM 2379 CE1 TYR C 48 -2.175 -8.141 -12.294 1.00 0.00 C ATOM 2380 CE2 TYR C 48 0.003 -8.687 -11.332 1.00 0.00 C ATOM 2381 CZ TYR C 48 -0.770 -8.221 -12.415 1.00 0.00 C ATOM 2382 OH TYR C 48 -0.153 -7.852 -13.573 1.00 0.00 O ATOM 0 H TYR C 48 -3.737 -10.789 -6.981 1.00 0.00 H new ATOM 0 HA TYR C 48 -4.721 -9.776 -9.385 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -3.010 -8.606 -8.181 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -1.960 -10.008 -8.145 1.00 0.00 H new ATOM 0 HD1 TYR C 48 -3.861 -8.427 -10.985 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.034 -9.446 -9.316 1.00 0.00 H new ATOM 0 HE1 TYR C 48 -2.772 -7.793 -13.124 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.078 -8.739 -11.418 1.00 0.00 H new ATOM 0 HH TYR C 48 -0.826 -7.564 -14.225 1.00 0.00 H new ATOM 2392 N GLN C 49 -2.811 -12.460 -9.728 1.00 0.00 N ATOM 2393 CA GLN C 49 -2.392 -13.483 -10.672 1.00 0.00 C ATOM 2394 C GLN C 49 -3.596 -14.228 -11.244 1.00 0.00 C ATOM 2395 O GLN C 49 -3.496 -14.840 -12.306 1.00 0.00 O ATOM 2396 CB GLN C 49 -1.467 -14.478 -9.975 1.00 0.00 C ATOM 2397 CG GLN C 49 -0.207 -13.790 -9.453 1.00 0.00 C ATOM 2398 CD GLN C 49 0.667 -14.784 -8.700 1.00 0.00 C ATOM 2399 OE1 GLN C 49 1.256 -15.680 -9.295 1.00 0.00 O ATOM 2400 NE2 GLN C 49 0.756 -14.638 -7.384 1.00 0.00 N ATOM 0 H GLN C 49 -2.514 -12.629 -8.767 1.00 0.00 H new ATOM 0 HA GLN C 49 -1.864 -12.995 -11.491 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -1.995 -14.951 -9.147 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -1.190 -15.270 -10.671 1.00 0.00 H new ATOM 0 HG2 GLN C 49 0.352 -13.361 -10.285 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -0.481 -12.966 -8.795 1.00 0.00 H new ATOM 0 HE21 GLN C 49 0.253 -13.882 -6.920 1.00 0.00 H new ATOM 0 HE22 GLN C 49 1.327 -15.282 -6.837 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.732 -14.182 -10.544 1.00 0.00 N ATOM 2410 CA ARG C 50 -5.919 -14.915 -10.952 1.00 0.00 C ATOM 2411 C ARG C 50 -6.750 -14.136 -11.968 1.00 0.00 C ATOM 2412 O ARG C 50 -7.298 -14.739 -12.887 1.00 0.00 O ATOM 2413 CB ARG C 50 -6.739 -15.255 -9.705 1.00 0.00 C ATOM 2414 CG ARG C 50 -7.900 -16.165 -10.090 1.00 0.00 C ATOM 2415 CD ARG C 50 -8.628 -16.613 -8.826 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.816 -17.554 -8.045 1.00 0.00 N ATOM 2417 CZ ARG C 50 -7.920 -17.729 -6.722 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.806 -17.035 -6.012 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -7.133 -18.604 -6.099 1.00 0.00 N ATOM 0 H ARG C 50 -4.849 -13.640 -9.688 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.613 -15.835 -11.451 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.108 -15.747 -8.965 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -7.116 -14.342 -9.245 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -8.587 -15.638 -10.752 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -7.532 -17.032 -10.638 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -8.868 -15.743 -8.215 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -9.573 -17.083 -9.096 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.125 -18.113 -8.545 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -9.415 -16.361 -6.475 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -8.876 -17.177 -5.004 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -6.449 -19.143 -6.630 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -7.214 -18.735 -5.091 1.00 0.00 H new ATOM 2433 N ILE C 51 -6.853 -12.809 -11.827 1.00 0.00 N ATOM 2434 CA ILE C 51 -7.569 -12.000 -12.810 1.00 0.00 C ATOM 2435 C ILE C 51 -6.879 -12.124 -14.173 1.00 0.00 C ATOM 2436 O ILE C 51 -7.468 -11.830 -15.211 1.00 0.00 O ATOM 2437 CB ILE C 51 -7.694 -10.535 -12.344 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -8.758 -10.378 -11.251 1.00 0.00 C ATOM 2439 CG2 ILE C 51 -8.140 -9.612 -13.479 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -8.289 -10.927 -9.906 1.00 0.00 C ATOM 0 H ILE C 51 -6.454 -12.282 -11.051 1.00 0.00 H new ATOM 0 HA ILE C 51 -8.588 -12.374 -12.912 1.00 0.00 H new ATOM 0 HB ILE C 51 -6.702 -10.267 -11.980 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -9.012 -9.324 -11.142 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -9.668 -10.895 -11.555 1.00 0.00 H new ATOM 0 HG21 ILE C 51 -8.216 -8.590 -13.108 1.00 0.00 H new ATOM 0 HG22 ILE C 51 -7.411 -9.652 -14.288 1.00 0.00 H new ATOM 0 HG23 ILE C 51 -9.112 -9.936 -13.851 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -9.076 -10.793 -9.164 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -8.061 -11.988 -10.006 1.00 0.00 H new ATOM 0 HD13 ILE C 51 -7.395 -10.392 -9.587 1.00 0.00 H new