USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 939 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 58 MET CE :methyl 163:sc= -2.65 (180deg=-3.91!) USER MOD Set 1.2: A 61 THR OG1 : rot -59:sc= 1.15 USER MOD Set 2.1: A 57 HIS : no HD1:sc= -2.13! K(o=-5!,f=-0.59) USER MOD Set 2.2: A 59 ASN : amide:sc= -2.86! K(o=-5!,f=-0.59) USER MOD Set 3.1: A 16 MET CE :methyl -123:sc= -1.39 (180deg=-6.57!) USER MOD Set 3.2: A 20 SER OG : rot 93:sc= -0.0653 USER MOD Set 4.1: A 11 ASN : amide:sc= 0 K(o=0.14,f=-1.1) USER MOD Set 4.2: A 14 GLN : amide:sc= 0.141 K(o=0.14,f=-1.9!) USER MOD Single : A 1 GLY N :NH3+ 173:sc= -0.184 (180deg=-0.412) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 GLN : amide:sc= 0.759 K(o=0.76,f=-1.2) USER MOD Single : A 9 SER OG : rot -54:sc= 0.0744 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 37 THR OG1 : rot 37:sc= 0.32 USER MOD Single : A 38 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0251) USER MOD Single : A 41 HIS : no HE2:sc= -0.52 K(o=-0.52,f=-3.5!) USER MOD Single : A 42 ASN : amide:sc= -1.81 K(o=-1.8,f=-8.3!) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.0078) USER MOD Single : A 46 TYR OH : rot 99:sc= -0.15 USER MOD Single : A 47 ASN : amide:sc= 1 K(o=1,f=-0.23) USER MOD Single : A 49 TYR OH : rot -127:sc= -0.241 USER MOD Single : A 51 SER OG : rot -78:sc= 1.23 USER MOD Single : A 52 HIS : no HD1:sc= -0.0794 X(o=-0.079,f=-0.53) USER MOD Single : A 55 HIS : no HD1:sc= -2.57! K(o=-2.6!,f=-0.31) USER MOD Single : A 62 GLN : amide:sc= -0.0356 K(o=-0.036,f=-1.6!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot -72:sc= 0.842 USER MOD Single : A 70 THR OG1 : rot 166:sc= 0.012 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 CYS SG : rot 71:sc= -2.49 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -107:sc= 1.32 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 TYR OH : rot -22:sc= 1.25 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 TYR OH : rot 74:sc= 0.672 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -6.13! K(o=-6.1!,f=-2.2) USER MOD Single : A 108 LYS NZ :NH3+ -166:sc= -0.0592 (180deg=-0.12) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ -138:sc= -0.0389 (180deg=-0.798) USER MOD Single : A 111 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0134) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.746 19.300 15.391 1.00 0.00 N ATOM 2 CA GLY A 1 22.315 19.218 15.223 1.00 0.00 C ATOM 3 C GLY A 1 21.954 19.666 13.856 1.00 0.00 C ATOM 4 O GLY A 1 20.780 19.824 13.526 1.00 0.00 O ATOM 0 H1 GLY A 1 23.991 19.101 16.382 1.00 0.00 H new ATOM 0 H2 GLY A 1 24.209 18.603 14.773 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.071 20.255 15.139 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.977 18.194 15.383 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.814 19.839 15.966 1.00 0.00 H new ATOM 8 N GLN A 2 22.985 19.876 13.014 1.00 0.00 N ATOM 9 CA GLN A 2 22.888 20.374 11.657 1.00 0.00 C ATOM 10 C GLN A 2 22.692 19.309 10.591 1.00 0.00 C ATOM 11 O GLN A 2 21.648 19.240 9.951 1.00 0.00 O ATOM 12 CB GLN A 2 24.130 21.231 11.324 1.00 0.00 C ATOM 13 CG GLN A 2 23.835 22.269 10.227 1.00 0.00 C ATOM 14 CD GLN A 2 25.133 22.943 9.801 1.00 0.00 C ATOM 15 OE1 GLN A 2 25.914 22.349 9.053 1.00 0.00 O ATOM 16 NE2 GLN A 2 25.379 24.183 10.285 1.00 0.00 N ATOM 0 H GLN A 2 23.949 19.689 13.290 1.00 0.00 H new ATOM 0 HA GLN A 2 21.979 20.975 11.633 1.00 0.00 H new ATOM 0 HB2 GLN A 2 24.470 21.742 12.225 1.00 0.00 H new ATOM 0 HB3 GLN A 2 24.943 20.581 11.000 1.00 0.00 H new ATOM 0 HG2 GLN A 2 23.366 21.785 9.370 1.00 0.00 H new ATOM 0 HG3 GLN A 2 23.131 23.014 10.597 1.00 0.00 H new ATOM 0 HE21 GLN A 2 24.702 24.634 10.901 1.00 0.00 H new ATOM 0 HE22 GLN A 2 26.241 24.667 10.034 1.00 0.00 H new ATOM 25 N ARG A 3 23.715 18.446 10.355 1.00 0.00 N ATOM 26 CA ARG A 3 23.771 17.430 9.306 1.00 0.00 C ATOM 27 C ARG A 3 22.965 16.143 9.566 1.00 0.00 C ATOM 28 O ARG A 3 23.470 15.025 9.467 1.00 0.00 O ATOM 29 CB ARG A 3 25.275 17.150 9.010 1.00 0.00 C ATOM 30 CG ARG A 3 25.669 16.806 7.568 1.00 0.00 C ATOM 31 CD ARG A 3 25.651 17.953 6.543 1.00 0.00 C ATOM 32 NE ARG A 3 24.252 18.397 6.202 1.00 0.00 N ATOM 33 CZ ARG A 3 23.461 17.798 5.258 1.00 0.00 C ATOM 34 NH1 ARG A 3 23.929 16.769 4.495 1.00 0.00 N ATOM 35 NH2 ARG A 3 22.180 18.238 5.085 1.00 0.00 N ATOM 0 H ARG A 3 24.559 18.452 10.928 1.00 0.00 H new ATOM 0 HA ARG A 3 23.263 17.832 8.430 1.00 0.00 H new ATOM 0 HB2 ARG A 3 25.845 18.029 9.312 1.00 0.00 H new ATOM 0 HB3 ARG A 3 25.595 16.327 9.650 1.00 0.00 H new ATOM 0 HG2 ARG A 3 26.673 16.382 7.584 1.00 0.00 H new ATOM 0 HG3 ARG A 3 24.999 16.024 7.212 1.00 0.00 H new ATOM 0 HD2 ARG A 3 26.211 18.800 6.939 1.00 0.00 H new ATOM 0 HD3 ARG A 3 26.159 17.632 5.634 1.00 0.00 H new ATOM 0 HE ARG A 3 23.869 19.196 6.707 1.00 0.00 H new ATOM 0 HH11 ARG A 3 24.883 16.433 4.622 1.00 0.00 H new ATOM 0 HH12 ARG A 3 23.324 16.336 3.797 1.00 0.00 H new ATOM 0 HH21 ARG A 3 21.823 19.004 5.655 1.00 0.00 H new ATOM 0 HH22 ARG A 3 21.581 17.800 4.385 1.00 0.00 H new ATOM 49 N GLN A 4 21.655 16.322 9.899 1.00 0.00 N ATOM 50 CA GLN A 4 20.678 15.292 10.241 1.00 0.00 C ATOM 51 C GLN A 4 19.929 14.697 9.067 1.00 0.00 C ATOM 52 O GLN A 4 19.389 13.597 9.177 1.00 0.00 O ATOM 53 CB GLN A 4 19.637 15.788 11.286 1.00 0.00 C ATOM 54 CG GLN A 4 18.825 17.046 10.896 1.00 0.00 C ATOM 55 CD GLN A 4 17.965 17.510 12.076 1.00 0.00 C ATOM 56 OE1 GLN A 4 16.881 16.962 12.289 1.00 0.00 O ATOM 57 NE2 GLN A 4 18.407 18.530 12.847 1.00 0.00 N ATOM 0 H GLN A 4 21.245 17.255 9.933 1.00 0.00 H new ATOM 0 HA GLN A 4 21.297 14.501 10.664 1.00 0.00 H new ATOM 0 HB2 GLN A 4 18.937 14.976 11.485 1.00 0.00 H new ATOM 0 HB3 GLN A 4 20.160 15.994 12.220 1.00 0.00 H new ATOM 0 HG2 GLN A 4 19.502 17.845 10.594 1.00 0.00 H new ATOM 0 HG3 GLN A 4 18.189 16.826 10.038 1.00 0.00 H new ATOM 0 HE21 GLN A 4 19.308 18.966 12.649 1.00 0.00 H new ATOM 0 HE22 GLN A 4 17.840 18.863 13.626 1.00 0.00 H new ATOM 66 N LEU A 5 19.833 15.429 7.920 1.00 0.00 N ATOM 67 CA LEU A 5 19.150 15.061 6.668 1.00 0.00 C ATOM 68 C LEU A 5 17.620 15.078 6.778 1.00 0.00 C ATOM 69 O LEU A 5 16.926 15.799 6.063 1.00 0.00 O ATOM 70 CB LEU A 5 19.649 13.730 6.004 1.00 0.00 C ATOM 71 CG LEU A 5 21.062 13.761 5.358 1.00 0.00 C ATOM 72 CD1 LEU A 5 21.109 14.671 4.119 1.00 0.00 C ATOM 73 CD2 LEU A 5 22.205 14.094 6.335 1.00 0.00 C ATOM 0 H LEU A 5 20.263 16.351 7.853 1.00 0.00 H new ATOM 0 HA LEU A 5 19.444 15.861 5.989 1.00 0.00 H new ATOM 0 HB2 LEU A 5 19.638 12.947 6.762 1.00 0.00 H new ATOM 0 HB3 LEU A 5 18.930 13.442 5.237 1.00 0.00 H new ATOM 0 HG LEU A 5 21.240 12.734 5.039 1.00 0.00 H new ATOM 0 HD11 LEU A 5 22.115 14.663 3.700 1.00 0.00 H new ATOM 0 HD12 LEU A 5 20.402 14.307 3.373 1.00 0.00 H new ATOM 0 HD13 LEU A 5 20.843 15.689 4.405 1.00 0.00 H new ATOM 0 HD21 LEU A 5 23.154 14.094 5.799 1.00 0.00 H new ATOM 0 HD22 LEU A 5 22.035 15.078 6.772 1.00 0.00 H new ATOM 0 HD23 LEU A 5 22.236 13.346 7.127 1.00 0.00 H new ATOM 85 N LEU A 6 17.078 14.247 7.706 1.00 0.00 N ATOM 86 CA LEU A 6 15.688 14.092 8.106 1.00 0.00 C ATOM 87 C LEU A 6 14.727 13.487 7.082 1.00 0.00 C ATOM 88 O LEU A 6 14.106 12.458 7.329 1.00 0.00 O ATOM 89 CB LEU A 6 15.156 15.335 8.841 1.00 0.00 C ATOM 90 CG LEU A 6 13.951 15.079 9.770 1.00 0.00 C ATOM 91 CD1 LEU A 6 14.148 15.710 11.153 1.00 0.00 C ATOM 92 CD2 LEU A 6 12.687 15.622 9.107 1.00 0.00 C ATOM 0 H LEU A 6 17.678 13.614 8.235 1.00 0.00 H new ATOM 0 HA LEU A 6 15.717 13.282 8.835 1.00 0.00 H new ATOM 0 HB2 LEU A 6 15.966 15.763 9.431 1.00 0.00 H new ATOM 0 HB3 LEU A 6 14.872 16.082 8.100 1.00 0.00 H new ATOM 0 HG LEU A 6 13.857 14.004 9.924 1.00 0.00 H new ATOM 0 HD11 LEU A 6 13.276 15.505 11.774 1.00 0.00 H new ATOM 0 HD12 LEU A 6 15.036 15.287 11.623 1.00 0.00 H new ATOM 0 HD13 LEU A 6 14.273 16.788 11.047 1.00 0.00 H new ATOM 0 HD21 LEU A 6 11.830 15.445 9.757 1.00 0.00 H new ATOM 0 HD22 LEU A 6 12.797 16.693 8.936 1.00 0.00 H new ATOM 0 HD23 LEU A 6 12.530 15.116 8.154 1.00 0.00 H new ATOM 104 N LEU A 7 14.557 14.152 5.909 1.00 0.00 N ATOM 105 CA LEU A 7 13.717 13.817 4.750 1.00 0.00 C ATOM 106 C LEU A 7 12.219 13.911 4.907 1.00 0.00 C ATOM 107 O LEU A 7 11.538 14.267 3.949 1.00 0.00 O ATOM 108 CB LEU A 7 14.143 12.516 4.007 1.00 0.00 C ATOM 109 CG LEU A 7 15.596 12.546 3.476 1.00 0.00 C ATOM 110 CD1 LEU A 7 16.039 11.149 3.012 1.00 0.00 C ATOM 111 CD2 LEU A 7 15.782 13.568 2.341 1.00 0.00 C ATOM 0 H LEU A 7 15.061 15.024 5.745 1.00 0.00 H new ATOM 0 HA LEU A 7 13.947 14.664 4.104 1.00 0.00 H new ATOM 0 HB2 LEU A 7 14.031 11.669 4.684 1.00 0.00 H new ATOM 0 HB3 LEU A 7 13.464 12.348 3.171 1.00 0.00 H new ATOM 0 HG LEU A 7 16.228 12.861 4.306 1.00 0.00 H new ATOM 0 HD11 LEU A 7 17.064 11.196 2.643 1.00 0.00 H new ATOM 0 HD12 LEU A 7 15.987 10.454 3.850 1.00 0.00 H new ATOM 0 HD13 LEU A 7 15.381 10.805 2.214 1.00 0.00 H new ATOM 0 HD21 LEU A 7 16.818 13.551 2.002 1.00 0.00 H new ATOM 0 HD22 LEU A 7 15.124 13.313 1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 7 15.536 14.565 2.705 1.00 0.00 H new ATOM 123 N ALA A 8 11.701 13.640 6.129 1.00 0.00 N ATOM 124 CA ALA A 8 10.339 13.889 6.567 1.00 0.00 C ATOM 125 C ALA A 8 9.286 12.845 6.179 1.00 0.00 C ATOM 126 O ALA A 8 8.085 13.069 6.294 1.00 0.00 O ATOM 127 CB ALA A 8 9.937 15.342 6.189 1.00 0.00 C ATOM 0 H ALA A 8 12.268 13.218 6.864 1.00 0.00 H new ATOM 0 HA ALA A 8 10.350 13.777 7.651 1.00 0.00 H new ATOM 0 HB1 ALA A 8 8.915 15.533 6.516 1.00 0.00 H new ATOM 0 HB2 ALA A 8 10.612 16.045 6.677 1.00 0.00 H new ATOM 0 HB3 ALA A 8 10.002 15.468 5.108 1.00 0.00 H new ATOM 133 N SER A 9 9.728 11.641 5.725 1.00 0.00 N ATOM 134 CA SER A 9 8.909 10.518 5.241 1.00 0.00 C ATOM 135 C SER A 9 8.398 9.583 6.351 1.00 0.00 C ATOM 136 O SER A 9 8.608 8.370 6.313 1.00 0.00 O ATOM 137 CB SER A 9 9.715 9.724 4.160 1.00 0.00 C ATOM 138 OG SER A 9 8.935 8.769 3.440 1.00 0.00 O ATOM 0 H SER A 9 10.724 11.425 5.689 1.00 0.00 H new ATOM 0 HA SER A 9 8.008 10.947 4.803 1.00 0.00 H new ATOM 0 HB2 SER A 9 10.149 10.431 3.453 1.00 0.00 H new ATOM 0 HB3 SER A 9 10.544 9.209 4.645 1.00 0.00 H new ATOM 0 HG SER A 9 8.488 8.169 4.072 1.00 0.00 H new ATOM 144 N GLU A 10 7.708 10.166 7.358 1.00 0.00 N ATOM 145 CA GLU A 10 7.168 9.504 8.536 1.00 0.00 C ATOM 146 C GLU A 10 5.662 9.631 8.607 1.00 0.00 C ATOM 147 O GLU A 10 5.014 10.126 7.687 1.00 0.00 O ATOM 148 CB GLU A 10 7.779 10.126 9.828 1.00 0.00 C ATOM 149 CG GLU A 10 7.556 11.646 10.008 1.00 0.00 C ATOM 150 CD GLU A 10 8.326 12.135 11.234 1.00 0.00 C ATOM 151 OE1 GLU A 10 9.258 12.965 11.058 1.00 0.00 O ATOM 152 OE2 GLU A 10 7.991 11.685 12.362 1.00 0.00 O ATOM 0 H GLU A 10 7.510 11.167 7.357 1.00 0.00 H new ATOM 0 HA GLU A 10 7.429 8.448 8.461 1.00 0.00 H new ATOM 0 HB2 GLU A 10 7.359 9.611 10.692 1.00 0.00 H new ATOM 0 HB3 GLU A 10 8.851 9.931 9.831 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.890 12.181 9.119 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.493 11.856 10.126 1.00 0.00 H new ATOM 159 N ASN A 11 5.098 9.208 9.773 1.00 0.00 N ATOM 160 CA ASN A 11 3.706 9.301 10.214 1.00 0.00 C ATOM 161 C ASN A 11 2.650 8.539 9.383 1.00 0.00 C ATOM 162 O ASN A 11 1.823 9.159 8.719 1.00 0.00 O ATOM 163 CB ASN A 11 3.335 10.796 10.456 1.00 0.00 C ATOM 164 CG ASN A 11 3.978 11.327 11.742 1.00 0.00 C ATOM 165 OD1 ASN A 11 4.837 10.680 12.345 1.00 0.00 O ATOM 166 ND2 ASN A 11 3.512 12.523 12.190 1.00 0.00 N ATOM 0 H ASN A 11 5.673 8.754 10.483 1.00 0.00 H new ATOM 0 HA ASN A 11 3.665 8.749 11.153 1.00 0.00 H new ATOM 0 HB2 ASN A 11 3.663 11.397 9.608 1.00 0.00 H new ATOM 0 HB3 ASN A 11 2.252 10.899 10.519 1.00 0.00 H new ATOM 0 HD21 ASN A 11 3.874 12.919 13.057 1.00 0.00 H new ATOM 0 HD22 ASN A 11 2.800 13.024 11.659 1.00 0.00 H new ATOM 173 N PRO A 12 2.617 7.188 9.400 1.00 0.00 N ATOM 174 CA PRO A 12 1.709 6.351 8.594 1.00 0.00 C ATOM 175 C PRO A 12 0.271 6.210 9.144 1.00 0.00 C ATOM 176 O PRO A 12 -0.626 5.833 8.388 1.00 0.00 O ATOM 177 CB PRO A 12 2.450 5.003 8.564 1.00 0.00 C ATOM 178 CG PRO A 12 3.208 4.939 9.896 1.00 0.00 C ATOM 179 CD PRO A 12 3.607 6.391 10.132 1.00 0.00 C ATOM 0 HA PRO A 12 1.524 6.794 7.616 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.753 4.171 8.466 1.00 0.00 H new ATOM 0 HB3 PRO A 12 3.134 4.947 7.717 1.00 0.00 H new ATOM 0 HG2 PRO A 12 2.579 4.557 10.700 1.00 0.00 H new ATOM 0 HG3 PRO A 12 4.078 4.286 9.834 1.00 0.00 H new ATOM 0 HD2 PRO A 12 3.599 6.633 11.195 1.00 0.00 H new ATOM 0 HD3 PRO A 12 4.616 6.586 9.768 1.00 0.00 H new ATOM 187 N GLN A 13 0.005 6.530 10.439 1.00 0.00 N ATOM 188 CA GLN A 13 -1.285 6.459 11.110 1.00 0.00 C ATOM 189 C GLN A 13 -2.265 7.601 10.821 1.00 0.00 C ATOM 190 O GLN A 13 -3.352 7.660 11.389 1.00 0.00 O ATOM 191 CB GLN A 13 -1.078 6.275 12.636 1.00 0.00 C ATOM 192 CG GLN A 13 -0.237 7.386 13.294 1.00 0.00 C ATOM 193 CD GLN A 13 -0.149 7.182 14.804 1.00 0.00 C ATOM 194 OE1 GLN A 13 0.902 6.901 15.383 1.00 0.00 O ATOM 195 NE2 GLN A 13 -1.310 7.335 15.493 1.00 0.00 N ATOM 0 H GLN A 13 0.740 6.862 11.063 1.00 0.00 H new ATOM 0 HA GLN A 13 -1.776 5.587 10.678 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -2.053 6.236 13.122 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -0.594 5.314 12.813 1.00 0.00 H new ATOM 0 HG2 GLN A 13 0.765 7.391 12.865 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -0.681 8.358 13.080 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -2.170 7.568 14.997 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -1.321 7.217 16.506 1.00 0.00 H new ATOM 204 N GLN A 14 -1.876 8.530 9.911 1.00 0.00 N ATOM 205 CA GLN A 14 -2.649 9.683 9.469 1.00 0.00 C ATOM 206 C GLN A 14 -3.067 9.568 8.002 1.00 0.00 C ATOM 207 O GLN A 14 -3.821 10.396 7.503 1.00 0.00 O ATOM 208 CB GLN A 14 -1.878 11.009 9.741 1.00 0.00 C ATOM 209 CG GLN A 14 -0.709 11.300 8.770 1.00 0.00 C ATOM 210 CD GLN A 14 0.303 12.297 9.339 1.00 0.00 C ATOM 211 OE1 GLN A 14 0.352 12.614 10.529 1.00 0.00 O ATOM 212 NE2 GLN A 14 1.201 12.774 8.437 1.00 0.00 N ATOM 0 H GLN A 14 -0.967 8.478 9.452 1.00 0.00 H new ATOM 0 HA GLN A 14 -3.567 9.702 10.056 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -2.584 11.838 9.693 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -1.487 10.982 10.758 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -0.198 10.366 8.534 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -1.109 11.690 7.834 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.137 12.495 7.458 1.00 0.00 H new ATOM 0 HE22 GLN A 14 1.938 13.411 8.739 1.00 0.00 H new ATOM 221 N PHE A 15 -2.591 8.534 7.254 1.00 0.00 N ATOM 222 CA PHE A 15 -2.909 8.302 5.850 1.00 0.00 C ATOM 223 C PHE A 15 -3.813 7.073 5.712 1.00 0.00 C ATOM 224 O PHE A 15 -3.946 6.501 4.626 1.00 0.00 O ATOM 225 CB PHE A 15 -1.635 8.174 4.959 1.00 0.00 C ATOM 226 CG PHE A 15 -0.704 9.360 5.114 1.00 0.00 C ATOM 227 CD1 PHE A 15 -1.075 10.632 4.702 1.00 0.00 C ATOM 228 CD2 PHE A 15 0.570 9.188 5.637 1.00 0.00 C ATOM 229 CE1 PHE A 15 -0.199 11.695 4.804 1.00 0.00 C ATOM 230 CE2 PHE A 15 1.450 10.248 5.738 1.00 0.00 C ATOM 231 CZ PHE A 15 1.066 11.506 5.319 1.00 0.00 C ATOM 0 H PHE A 15 -1.960 7.830 7.638 1.00 0.00 H new ATOM 0 HA PHE A 15 -3.446 9.178 5.486 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -1.102 7.260 5.220 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -1.932 8.082 3.914 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.063 10.793 4.296 1.00 0.00 H new ATOM 0 HD2 PHE A 15 0.879 8.208 5.971 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -0.506 12.678 4.479 1.00 0.00 H new ATOM 0 HE2 PHE A 15 2.438 10.093 6.145 1.00 0.00 H new ATOM 0 HZ PHE A 15 1.752 12.337 5.394 1.00 0.00 H new ATOM 241 N MET A 16 -4.516 6.682 6.831 1.00 0.00 N ATOM 242 CA MET A 16 -5.481 5.571 6.971 1.00 0.00 C ATOM 243 C MET A 16 -6.719 5.722 6.087 1.00 0.00 C ATOM 244 O MET A 16 -7.263 4.753 5.570 1.00 0.00 O ATOM 245 CB MET A 16 -5.903 5.362 8.456 1.00 0.00 C ATOM 246 CG MET A 16 -6.885 4.198 8.797 1.00 0.00 C ATOM 247 SD MET A 16 -6.259 2.487 8.686 1.00 0.00 S ATOM 248 CE MET A 16 -7.841 1.597 8.975 1.00 0.00 C ATOM 0 H MET A 16 -4.402 7.183 7.712 1.00 0.00 H new ATOM 0 HA MET A 16 -4.951 4.684 6.624 1.00 0.00 H new ATOM 0 HB2 MET A 16 -4.995 5.211 9.040 1.00 0.00 H new ATOM 0 HB3 MET A 16 -6.356 6.290 8.805 1.00 0.00 H new ATOM 0 HG2 MET A 16 -7.249 4.355 9.812 1.00 0.00 H new ATOM 0 HG3 MET A 16 -7.746 4.282 8.133 1.00 0.00 H new ATOM 0 HE1 MET A 16 -7.733 0.933 9.832 1.00 0.00 H new ATOM 0 HE2 MET A 16 -8.634 2.319 9.172 1.00 0.00 H new ATOM 0 HE3 MET A 16 -8.095 1.011 8.092 1.00 0.00 H new ATOM 258 N ASP A 17 -7.163 6.976 5.799 1.00 0.00 N ATOM 259 CA ASP A 17 -8.251 7.311 4.872 1.00 0.00 C ATOM 260 C ASP A 17 -7.907 6.931 3.421 1.00 0.00 C ATOM 261 O ASP A 17 -8.646 6.204 2.770 1.00 0.00 O ATOM 262 CB ASP A 17 -8.626 8.823 4.997 1.00 0.00 C ATOM 263 CG ASP A 17 -9.949 9.188 4.306 1.00 0.00 C ATOM 264 OD1 ASP A 17 -11.000 8.615 4.699 1.00 0.00 O ATOM 265 OD2 ASP A 17 -9.918 10.042 3.380 1.00 0.00 O ATOM 0 H ASP A 17 -6.750 7.804 6.228 1.00 0.00 H new ATOM 0 HA ASP A 17 -9.123 6.719 5.150 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.693 9.086 6.053 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -7.824 9.424 4.569 1.00 0.00 H new ATOM 270 N TYR A 18 -6.734 7.387 2.909 1.00 0.00 N ATOM 271 CA TYR A 18 -6.188 7.029 1.603 1.00 0.00 C ATOM 272 C TYR A 18 -5.654 5.596 1.432 1.00 0.00 C ATOM 273 O TYR A 18 -6.055 4.874 0.513 1.00 0.00 O ATOM 274 CB TYR A 18 -5.090 8.091 1.267 1.00 0.00 C ATOM 275 CG TYR A 18 -4.434 7.961 -0.091 1.00 0.00 C ATOM 276 CD1 TYR A 18 -3.057 7.853 -0.182 1.00 0.00 C ATOM 277 CD2 TYR A 18 -5.195 7.891 -1.245 1.00 0.00 C ATOM 278 CE1 TYR A 18 -2.455 7.655 -1.410 1.00 0.00 C ATOM 279 CE2 TYR A 18 -4.594 7.673 -2.469 1.00 0.00 C ATOM 280 CZ TYR A 18 -3.226 7.542 -2.550 1.00 0.00 C ATOM 281 OH TYR A 18 -2.629 7.273 -3.799 1.00 0.00 O ATOM 0 H TYR A 18 -6.135 8.034 3.422 1.00 0.00 H new ATOM 0 HA TYR A 18 -7.022 7.038 0.901 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -5.538 9.082 1.339 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.314 8.036 2.030 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -2.451 7.924 0.709 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -6.267 8.008 -1.188 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -1.379 7.588 -1.478 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -5.197 7.605 -3.362 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.323 7.226 -4.490 1.00 0.00 H new ATOM 291 N PHE A 19 -4.732 5.146 2.330 1.00 0.00 N ATOM 292 CA PHE A 19 -4.072 3.843 2.269 1.00 0.00 C ATOM 293 C PHE A 19 -4.974 2.691 2.659 1.00 0.00 C ATOM 294 O PHE A 19 -4.925 1.648 2.019 1.00 0.00 O ATOM 295 CB PHE A 19 -2.692 3.848 2.994 1.00 0.00 C ATOM 296 CG PHE A 19 -1.651 4.701 2.281 1.00 0.00 C ATOM 297 CD1 PHE A 19 -1.520 4.765 0.897 1.00 0.00 C ATOM 298 CD2 PHE A 19 -0.713 5.382 3.039 1.00 0.00 C ATOM 299 CE1 PHE A 19 -0.477 5.458 0.315 1.00 0.00 C ATOM 300 CE2 PHE A 19 0.333 6.077 2.462 1.00 0.00 C ATOM 301 CZ PHE A 19 0.451 6.118 1.089 1.00 0.00 C ATOM 0 H PHE A 19 -4.432 5.705 3.129 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.849 3.659 1.218 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.823 4.218 4.011 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.324 2.825 3.072 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.244 4.266 0.270 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.802 5.370 4.115 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.388 5.483 -0.761 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.055 6.586 3.084 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.262 6.661 0.626 1.00 0.00 H new ATOM 311 N SER A 20 -5.910 2.875 3.648 1.00 0.00 N ATOM 312 CA SER A 20 -6.923 1.845 3.976 1.00 0.00 C ATOM 313 C SER A 20 -8.006 1.719 2.922 1.00 0.00 C ATOM 314 O SER A 20 -8.524 0.620 2.745 1.00 0.00 O ATOM 315 CB SER A 20 -7.582 1.867 5.380 1.00 0.00 C ATOM 316 OG SER A 20 -8.180 0.610 5.718 1.00 0.00 O ATOM 0 H SER A 20 -5.973 3.719 4.217 1.00 0.00 H new ATOM 0 HA SER A 20 -6.282 0.963 3.992 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.831 2.123 6.128 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.341 2.648 5.411 1.00 0.00 H new ATOM 0 HG SER A 20 -7.537 0.066 6.219 1.00 0.00 H new ATOM 322 N GLU A 21 -8.360 2.826 2.194 1.00 0.00 N ATOM 323 CA GLU A 21 -9.276 2.787 1.050 1.00 0.00 C ATOM 324 C GLU A 21 -8.664 2.099 -0.171 1.00 0.00 C ATOM 325 O GLU A 21 -9.233 1.138 -0.664 1.00 0.00 O ATOM 326 CB GLU A 21 -9.762 4.207 0.678 1.00 0.00 C ATOM 327 CG GLU A 21 -10.838 4.284 -0.424 1.00 0.00 C ATOM 328 CD GLU A 21 -11.264 5.740 -0.613 1.00 0.00 C ATOM 329 OE1 GLU A 21 -11.055 6.280 -1.732 1.00 0.00 O ATOM 330 OE2 GLU A 21 -11.803 6.332 0.361 1.00 0.00 O ATOM 0 H GLU A 21 -8.007 3.761 2.400 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.133 2.190 1.362 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.155 4.682 1.577 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.900 4.793 0.359 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.447 3.883 -1.359 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.699 3.674 -0.151 1.00 0.00 H new ATOM 337 N GLU A 22 -7.425 2.478 -0.616 1.00 0.00 N ATOM 338 CA GLU A 22 -6.686 1.841 -1.718 1.00 0.00 C ATOM 339 C GLU A 22 -6.243 0.415 -1.422 1.00 0.00 C ATOM 340 O GLU A 22 -6.351 -0.466 -2.276 1.00 0.00 O ATOM 341 CB GLU A 22 -5.443 2.682 -2.097 1.00 0.00 C ATOM 342 CG GLU A 22 -5.777 3.964 -2.882 1.00 0.00 C ATOM 343 CD GLU A 22 -6.349 3.607 -4.254 1.00 0.00 C ATOM 344 OE1 GLU A 22 -5.618 2.962 -5.053 1.00 0.00 O ATOM 345 OE2 GLU A 22 -7.525 3.974 -4.521 1.00 0.00 O ATOM 0 H GLU A 22 -6.914 3.255 -0.198 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.390 1.794 -2.549 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.908 2.953 -1.187 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -4.768 2.068 -2.693 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.496 4.564 -2.325 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -4.880 4.571 -3.000 1.00 0.00 H new ATOM 352 N PHE A 23 -5.792 0.140 -0.156 1.00 0.00 N ATOM 353 CA PHE A 23 -5.473 -1.206 0.302 1.00 0.00 C ATOM 354 C PHE A 23 -6.720 -2.062 0.490 1.00 0.00 C ATOM 355 O PHE A 23 -6.770 -3.099 -0.136 1.00 0.00 O ATOM 356 CB PHE A 23 -4.647 -1.184 1.633 1.00 0.00 C ATOM 357 CG PHE A 23 -4.252 -2.521 2.213 1.00 0.00 C ATOM 358 CD1 PHE A 23 -3.717 -3.503 1.410 1.00 0.00 C ATOM 359 CD2 PHE A 23 -4.459 -2.797 3.552 1.00 0.00 C ATOM 360 CE1 PHE A 23 -3.402 -4.739 1.917 1.00 0.00 C ATOM 361 CE2 PHE A 23 -4.083 -4.010 4.079 1.00 0.00 C ATOM 362 CZ PHE A 23 -3.585 -5.000 3.256 1.00 0.00 C ATOM 0 H PHE A 23 -5.648 0.859 0.553 1.00 0.00 H new ATOM 0 HA PHE A 23 -4.865 -1.655 -0.484 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -3.738 -0.608 1.459 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -5.227 -0.646 2.383 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.542 -3.297 0.364 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -4.919 -2.055 4.188 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -3.011 -5.506 1.266 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -4.178 -4.189 5.140 1.00 0.00 H new ATOM 0 HZ PHE A 23 -3.341 -5.972 3.660 1.00 0.00 H new ATOM 372 N ARG A 24 -7.798 -1.686 1.252 1.00 0.00 N ATOM 373 CA ARG A 24 -8.999 -2.538 1.350 1.00 0.00 C ATOM 374 C ARG A 24 -9.851 -2.611 0.094 1.00 0.00 C ATOM 375 O ARG A 24 -10.425 -3.656 -0.161 1.00 0.00 O ATOM 376 CB ARG A 24 -9.838 -2.392 2.640 1.00 0.00 C ATOM 377 CG ARG A 24 -10.702 -3.636 3.021 1.00 0.00 C ATOM 378 CD ARG A 24 -11.308 -3.440 4.418 1.00 0.00 C ATOM 379 NE ARG A 24 -12.190 -2.220 4.529 1.00 0.00 N ATOM 380 CZ ARG A 24 -13.395 -2.007 3.915 1.00 0.00 C ATOM 381 NH1 ARG A 24 -13.943 -2.913 3.062 1.00 0.00 N ATOM 382 NH2 ARG A 24 -14.065 -0.843 4.170 1.00 0.00 N ATOM 0 H ARG A 24 -7.847 -0.820 1.788 1.00 0.00 H new ATOM 0 HA ARG A 24 -8.542 -3.523 1.442 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -9.165 -2.171 3.468 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -10.499 -1.532 2.528 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -11.495 -3.778 2.287 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -10.087 -4.536 3.004 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -11.890 -4.324 4.680 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -10.501 -3.362 5.147 1.00 0.00 H new ATOM 0 HE ARG A 24 -11.850 -1.469 5.130 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -13.454 -3.785 2.862 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -14.843 -2.720 2.623 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -13.666 -0.154 4.807 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -14.964 -0.664 3.723 1.00 0.00 H new ATOM 396 N ASN A 25 -9.912 -1.581 -0.807 1.00 0.00 N ATOM 397 CA ASN A 25 -10.634 -1.682 -2.090 1.00 0.00 C ATOM 398 C ASN A 25 -10.041 -2.703 -3.048 1.00 0.00 C ATOM 399 O ASN A 25 -10.740 -3.600 -3.488 1.00 0.00 O ATOM 400 CB ASN A 25 -10.714 -0.318 -2.830 1.00 0.00 C ATOM 401 CG ASN A 25 -11.955 0.405 -2.319 1.00 0.00 C ATOM 402 OD1 ASN A 25 -12.204 0.490 -1.115 1.00 0.00 O ATOM 403 ND2 ASN A 25 -12.783 0.933 -3.256 1.00 0.00 N ATOM 0 H ASN A 25 -9.465 -0.677 -0.655 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.632 -2.013 -1.804 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -9.819 0.275 -2.640 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.774 -0.469 -3.908 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -13.636 1.415 -2.970 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -12.553 0.848 -4.246 1.00 0.00 H new ATOM 410 N ASP A 26 -8.718 -2.646 -3.328 1.00 0.00 N ATOM 411 CA ASP A 26 -8.030 -3.639 -4.153 1.00 0.00 C ATOM 412 C ASP A 26 -7.733 -4.954 -3.441 1.00 0.00 C ATOM 413 O ASP A 26 -7.880 -5.997 -4.056 1.00 0.00 O ATOM 414 CB ASP A 26 -6.739 -3.016 -4.738 1.00 0.00 C ATOM 415 CG ASP A 26 -7.068 -1.990 -5.825 1.00 0.00 C ATOM 416 OD1 ASP A 26 -7.507 -2.414 -6.927 1.00 0.00 O ATOM 417 OD2 ASP A 26 -6.871 -0.772 -5.570 1.00 0.00 O ATOM 0 H ASP A 26 -8.107 -1.906 -2.983 1.00 0.00 H new ATOM 0 HA ASP A 26 -8.716 -3.908 -4.956 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -6.169 -2.537 -3.942 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.108 -3.802 -5.154 1.00 0.00 H new ATOM 422 N PHE A 27 -7.359 -4.978 -2.128 1.00 0.00 N ATOM 423 CA PHE A 27 -7.085 -6.190 -1.322 1.00 0.00 C ATOM 424 C PHE A 27 -8.330 -6.992 -1.048 1.00 0.00 C ATOM 425 O PHE A 27 -8.310 -8.195 -1.266 1.00 0.00 O ATOM 426 CB PHE A 27 -6.385 -5.889 0.044 1.00 0.00 C ATOM 427 CG PHE A 27 -5.945 -7.046 0.926 1.00 0.00 C ATOM 428 CD1 PHE A 27 -6.754 -7.545 1.946 1.00 0.00 C ATOM 429 CD2 PHE A 27 -4.655 -7.514 0.821 1.00 0.00 C ATOM 430 CE1 PHE A 27 -6.272 -8.470 2.855 1.00 0.00 C ATOM 431 CE2 PHE A 27 -4.150 -8.359 1.781 1.00 0.00 C ATOM 432 CZ PHE A 27 -4.951 -8.851 2.779 1.00 0.00 C ATOM 0 H PHE A 27 -7.238 -4.120 -1.590 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.401 -6.770 -1.942 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.503 -5.284 -0.166 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -7.064 -5.270 0.630 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -7.775 -7.203 2.028 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -4.039 -7.218 -0.015 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.921 -8.886 3.611 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -3.107 -8.639 1.748 1.00 0.00 H new ATOM 0 HZ PHE A 27 -4.545 -9.538 3.507 1.00 0.00 H new ATOM 442 N LEU A 28 -9.449 -6.345 -0.601 1.00 0.00 N ATOM 443 CA LEU A 28 -10.749 -6.968 -0.370 1.00 0.00 C ATOM 444 C LEU A 28 -11.411 -7.454 -1.657 1.00 0.00 C ATOM 445 O LEU A 28 -11.986 -8.535 -1.656 1.00 0.00 O ATOM 446 CB LEU A 28 -11.640 -6.099 0.544 1.00 0.00 C ATOM 447 CG LEU A 28 -12.574 -6.868 1.482 1.00 0.00 C ATOM 448 CD1 LEU A 28 -13.879 -6.158 1.835 1.00 0.00 C ATOM 449 CD2 LEU A 28 -11.864 -7.425 2.726 1.00 0.00 C ATOM 0 H LEU A 28 -9.449 -5.347 -0.392 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.584 -7.888 0.191 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.996 -5.458 1.147 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -12.244 -5.444 -0.084 1.00 0.00 H new ATOM 0 HG LEU A 28 -12.881 -7.722 0.878 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -14.467 -6.788 2.503 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -13.657 -5.212 2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -14.447 -5.966 0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -12.583 -7.958 3.347 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -11.073 -8.109 2.418 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -11.431 -6.603 3.296 1.00 0.00 H new ATOM 461 N GLU A 29 -11.216 -6.723 -2.816 1.00 0.00 N ATOM 462 CA GLU A 29 -11.627 -7.194 -4.155 1.00 0.00 C ATOM 463 C GLU A 29 -10.797 -8.380 -4.657 1.00 0.00 C ATOM 464 O GLU A 29 -11.345 -9.372 -5.116 1.00 0.00 O ATOM 465 CB GLU A 29 -11.715 -6.055 -5.223 1.00 0.00 C ATOM 466 CG GLU A 29 -10.608 -5.920 -6.291 1.00 0.00 C ATOM 467 CD GLU A 29 -10.922 -4.742 -7.213 1.00 0.00 C ATOM 468 OE1 GLU A 29 -10.167 -3.735 -7.175 1.00 0.00 O ATOM 469 OE2 GLU A 29 -11.924 -4.838 -7.972 1.00 0.00 O ATOM 0 H GLU A 29 -10.773 -5.804 -2.826 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.645 -7.558 -4.016 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -12.662 -6.175 -5.749 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -11.766 -5.108 -4.686 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -9.642 -5.770 -5.810 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -10.536 -6.840 -6.872 1.00 0.00 H new ATOM 476 N LEU A 30 -9.442 -8.334 -4.507 1.00 0.00 N ATOM 477 CA LEU A 30 -8.474 -9.375 -4.872 1.00 0.00 C ATOM 478 C LEU A 30 -8.596 -10.656 -4.066 1.00 0.00 C ATOM 479 O LEU A 30 -8.527 -11.751 -4.610 1.00 0.00 O ATOM 480 CB LEU A 30 -7.042 -8.834 -4.706 1.00 0.00 C ATOM 481 CG LEU A 30 -5.954 -9.596 -5.472 1.00 0.00 C ATOM 482 CD1 LEU A 30 -5.260 -8.594 -6.390 1.00 0.00 C ATOM 483 CD2 LEU A 30 -4.934 -10.309 -4.568 1.00 0.00 C ATOM 0 H LEU A 30 -8.984 -7.517 -4.104 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.696 -9.628 -5.909 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.026 -7.793 -5.028 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -6.790 -8.844 -3.646 1.00 0.00 H new ATOM 0 HG LEU A 30 -6.429 -10.398 -6.037 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.476 -9.100 -6.954 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -5.988 -8.169 -7.081 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.819 -7.797 -5.791 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.198 -10.824 -5.185 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.430 -9.575 -3.939 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.450 -11.033 -3.938 1.00 0.00 H new ATOM 495 N LEU A 31 -8.890 -10.510 -2.743 1.00 0.00 N ATOM 496 CA LEU A 31 -9.241 -11.507 -1.732 1.00 0.00 C ATOM 497 C LEU A 31 -10.575 -12.148 -2.067 1.00 0.00 C ATOM 498 O LEU A 31 -10.760 -13.356 -1.948 1.00 0.00 O ATOM 499 CB LEU A 31 -9.341 -10.819 -0.338 1.00 0.00 C ATOM 500 CG LEU A 31 -9.727 -11.654 0.906 1.00 0.00 C ATOM 501 CD1 LEU A 31 -9.984 -10.726 2.119 1.00 0.00 C ATOM 502 CD2 LEU A 31 -8.654 -12.719 1.205 1.00 0.00 C ATOM 0 H LEU A 31 -8.881 -9.578 -2.329 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.469 -12.276 -1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -8.375 -10.358 -0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.068 -10.011 -0.426 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.655 -12.187 0.700 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.255 -11.328 2.987 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -9.081 -10.157 2.339 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.798 -10.039 1.886 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.947 -13.294 2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.557 -13.388 0.350 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.698 -12.230 1.393 1.00 0.00 H new ATOM 514 N ARG A 32 -11.550 -11.343 -2.558 1.00 0.00 N ATOM 515 CA ARG A 32 -12.824 -11.863 -2.983 1.00 0.00 C ATOM 516 C ARG A 32 -12.854 -12.610 -4.325 1.00 0.00 C ATOM 517 O ARG A 32 -13.417 -13.700 -4.376 1.00 0.00 O ATOM 518 CB ARG A 32 -13.769 -10.659 -3.036 1.00 0.00 C ATOM 519 CG ARG A 32 -14.461 -10.418 -1.696 1.00 0.00 C ATOM 520 CD ARG A 32 -15.559 -9.340 -1.714 1.00 0.00 C ATOM 521 NE ARG A 32 -14.954 -8.025 -2.112 1.00 0.00 N ATOM 522 CZ ARG A 32 -15.607 -6.827 -1.999 1.00 0.00 C ATOM 523 NH1 ARG A 32 -16.887 -6.768 -1.530 1.00 0.00 N ATOM 524 NH2 ARG A 32 -14.961 -5.678 -2.357 1.00 0.00 N ATOM 0 H ARG A 32 -11.454 -10.333 -2.660 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.113 -12.634 -2.268 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -13.207 -9.769 -3.320 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -14.521 -10.821 -3.809 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.900 -11.356 -1.357 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.707 -10.135 -0.961 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -16.347 -9.618 -2.414 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -16.021 -9.258 -0.730 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.005 -8.024 -2.487 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -17.370 -7.624 -1.258 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -17.360 -5.868 -1.451 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.003 -5.719 -2.704 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.437 -4.779 -2.277 1.00 0.00 H new ATOM 538 N ARG A 33 -12.255 -12.080 -5.430 1.00 0.00 N ATOM 539 CA ARG A 33 -12.083 -12.781 -6.709 1.00 0.00 C ATOM 540 C ARG A 33 -11.084 -13.863 -6.822 1.00 0.00 C ATOM 541 O ARG A 33 -11.347 -14.890 -7.431 1.00 0.00 O ATOM 542 CB ARG A 33 -11.973 -11.906 -7.965 1.00 0.00 C ATOM 543 CG ARG A 33 -11.051 -10.690 -7.838 1.00 0.00 C ATOM 544 CD ARG A 33 -10.427 -10.223 -9.154 1.00 0.00 C ATOM 545 NE ARG A 33 -9.632 -8.979 -8.860 1.00 0.00 N ATOM 546 CZ ARG A 33 -9.129 -8.162 -9.835 1.00 0.00 C ATOM 547 NH1 ARG A 33 -9.336 -8.439 -11.155 1.00 0.00 N ATOM 548 NH2 ARG A 33 -8.409 -7.057 -9.479 1.00 0.00 N ATOM 0 H ARG A 33 -11.875 -11.133 -5.443 1.00 0.00 H new ATOM 0 HA ARG A 33 -13.058 -13.267 -6.672 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -11.619 -12.525 -8.789 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.970 -11.558 -8.234 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.618 -9.865 -7.407 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -10.251 -10.929 -7.137 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.785 -10.999 -9.571 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -11.201 -10.018 -9.894 1.00 0.00 H new ATOM 0 HE ARG A 33 -9.460 -8.733 -7.885 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.872 -9.264 -11.425 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -8.955 -7.821 -11.872 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.251 -6.847 -8.493 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -8.030 -6.442 -10.199 1.00 0.00 H new ATOM 562 N ARG A 34 -9.861 -13.625 -6.315 1.00 0.00 N ATOM 563 CA ARG A 34 -8.770 -14.553 -6.483 1.00 0.00 C ATOM 564 C ARG A 34 -8.756 -15.689 -5.459 1.00 0.00 C ATOM 565 O ARG A 34 -8.132 -16.728 -5.661 1.00 0.00 O ATOM 566 CB ARG A 34 -7.442 -13.790 -6.630 1.00 0.00 C ATOM 567 CG ARG A 34 -7.615 -12.625 -7.627 1.00 0.00 C ATOM 568 CD ARG A 34 -6.385 -12.432 -8.507 1.00 0.00 C ATOM 569 NE ARG A 34 -6.678 -11.322 -9.479 1.00 0.00 N ATOM 570 CZ ARG A 34 -5.800 -10.928 -10.451 1.00 0.00 C ATOM 571 NH1 ARG A 34 -4.566 -11.499 -10.556 1.00 0.00 N ATOM 572 NH2 ARG A 34 -6.168 -9.947 -11.328 1.00 0.00 N ATOM 0 H ARG A 34 -9.620 -12.787 -5.785 1.00 0.00 H new ATOM 0 HA ARG A 34 -8.927 -15.090 -7.418 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.123 -13.407 -5.661 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -6.661 -14.466 -6.978 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -8.484 -12.814 -8.257 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -7.814 -11.705 -7.077 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.516 -12.185 -7.898 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -6.150 -13.353 -9.040 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.574 -10.840 -9.410 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -4.286 -12.232 -9.904 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -3.923 -11.194 -11.287 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -7.090 -9.516 -11.254 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -5.521 -9.645 -12.057 1.00 0.00 H new ATOM 586 N PHE A 35 -9.440 -15.479 -4.298 1.00 0.00 N ATOM 587 CA PHE A 35 -9.450 -16.412 -3.182 1.00 0.00 C ATOM 588 C PHE A 35 -10.868 -16.925 -2.827 1.00 0.00 C ATOM 589 O PHE A 35 -10.990 -18.101 -2.473 1.00 0.00 O ATOM 590 CB PHE A 35 -8.638 -15.865 -1.940 1.00 0.00 C ATOM 591 CG PHE A 35 -7.183 -15.528 -2.208 1.00 0.00 C ATOM 592 CD1 PHE A 35 -6.889 -14.373 -2.911 1.00 0.00 C ATOM 593 CD2 PHE A 35 -6.116 -16.222 -1.651 1.00 0.00 C ATOM 594 CE1 PHE A 35 -5.602 -13.949 -3.122 1.00 0.00 C ATOM 595 CE2 PHE A 35 -4.817 -15.780 -1.829 1.00 0.00 C ATOM 596 CZ PHE A 35 -4.555 -14.648 -2.567 1.00 0.00 C ATOM 0 H PHE A 35 -9.999 -14.642 -4.130 1.00 0.00 H new ATOM 0 HA PHE A 35 -8.915 -17.301 -3.517 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -9.137 -14.971 -1.567 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -8.680 -16.609 -1.144 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -7.703 -13.784 -3.308 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -6.302 -17.115 -1.073 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -5.411 -13.071 -3.721 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -4.000 -16.329 -1.384 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.538 -14.312 -2.709 1.00 0.00 H new ATOM 606 N GLY A 36 -11.995 -16.111 -2.832 1.00 0.00 N ATOM 607 CA GLY A 36 -13.313 -16.542 -2.347 1.00 0.00 C ATOM 608 C GLY A 36 -13.376 -16.462 -0.875 1.00 0.00 C ATOM 609 O GLY A 36 -13.193 -15.383 -0.343 1.00 0.00 O ATOM 0 H GLY A 36 -11.983 -15.151 -3.176 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -14.090 -15.915 -2.784 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -13.509 -17.565 -2.670 1.00 0.00 H new ATOM 613 N THR A 37 -13.584 -17.576 -0.140 1.00 0.00 N ATOM 614 CA THR A 37 -13.409 -17.518 1.297 1.00 0.00 C ATOM 615 C THR A 37 -12.542 -18.732 1.579 1.00 0.00 C ATOM 616 O THR A 37 -12.996 -19.872 1.527 1.00 0.00 O ATOM 617 CB THR A 37 -14.735 -17.555 2.073 1.00 0.00 C ATOM 618 OG1 THR A 37 -15.583 -18.630 1.684 1.00 0.00 O ATOM 619 CG2 THR A 37 -15.550 -16.266 1.866 1.00 0.00 C ATOM 0 H THR A 37 -13.862 -18.484 -0.513 1.00 0.00 H new ATOM 0 HA THR A 37 -12.961 -16.580 1.624 1.00 0.00 H new ATOM 0 HB THR A 37 -14.436 -17.676 3.114 1.00 0.00 H new ATOM 0 HG1 THR A 37 -15.039 -19.422 1.491 1.00 0.00 H new ATOM 0 HG21 THR A 37 -16.481 -16.329 2.430 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.972 -15.410 2.215 1.00 0.00 H new ATOM 0 HG23 THR A 37 -15.776 -16.144 0.807 1.00 0.00 H new ATOM 627 N LYS A 38 -11.280 -18.478 1.929 1.00 0.00 N ATOM 628 CA LYS A 38 -10.284 -19.478 2.234 1.00 0.00 C ATOM 629 C LYS A 38 -9.514 -19.025 3.437 1.00 0.00 C ATOM 630 O LYS A 38 -9.212 -17.842 3.559 1.00 0.00 O ATOM 631 CB LYS A 38 -9.303 -19.656 1.065 1.00 0.00 C ATOM 632 CG LYS A 38 -8.551 -20.986 1.187 1.00 0.00 C ATOM 633 CD LYS A 38 -7.429 -21.092 0.167 1.00 0.00 C ATOM 634 CE LYS A 38 -7.863 -21.141 -1.305 1.00 0.00 C ATOM 635 NZ LYS A 38 -8.719 -22.319 -1.576 1.00 0.00 N ATOM 0 H LYS A 38 -10.920 -17.527 2.008 1.00 0.00 H new ATOM 0 HA LYS A 38 -10.784 -20.429 2.417 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -9.846 -19.625 0.120 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -8.592 -18.830 1.052 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -8.140 -21.081 2.192 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -9.248 -21.812 1.049 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.761 -20.241 0.301 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.850 -21.989 0.385 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.405 -20.230 -1.557 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.981 -21.175 -1.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -8.912 -22.381 -2.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -8.231 -23.182 -1.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -9.616 -22.222 -1.059 1.00 0.00 H new ATOM 649 N ARG A 39 -9.064 -19.960 4.324 1.00 0.00 N ATOM 650 CA ARG A 39 -8.111 -19.675 5.390 1.00 0.00 C ATOM 651 C ARG A 39 -6.707 -19.540 4.755 1.00 0.00 C ATOM 652 O ARG A 39 -6.127 -20.466 4.198 1.00 0.00 O ATOM 653 CB ARG A 39 -8.163 -20.656 6.577 1.00 0.00 C ATOM 654 CG ARG A 39 -7.556 -22.052 6.376 1.00 0.00 C ATOM 655 CD ARG A 39 -8.264 -22.964 5.358 1.00 0.00 C ATOM 656 NE ARG A 39 -9.717 -23.107 5.737 1.00 0.00 N ATOM 657 CZ ARG A 39 -10.729 -23.294 4.831 1.00 0.00 C ATOM 658 NH1 ARG A 39 -10.474 -23.361 3.492 1.00 0.00 N ATOM 659 NH2 ARG A 39 -12.014 -23.410 5.277 1.00 0.00 N ATOM 0 H ARG A 39 -9.367 -20.934 4.302 1.00 0.00 H new ATOM 0 HA ARG A 39 -8.390 -18.732 5.860 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -7.656 -20.188 7.421 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -9.207 -20.782 6.862 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.518 -21.932 6.064 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -7.542 -22.561 7.340 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -8.178 -22.544 4.356 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -7.785 -23.943 5.336 1.00 0.00 H new ATOM 0 HE ARG A 39 -9.961 -23.062 6.726 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -9.517 -23.272 3.150 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -11.240 -23.501 2.833 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -12.214 -23.357 6.276 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -12.774 -23.549 4.611 1.00 0.00 H new ATOM 673 N VAL A 40 -6.206 -18.303 4.715 1.00 0.00 N ATOM 674 CA VAL A 40 -5.023 -17.895 3.959 1.00 0.00 C ATOM 675 C VAL A 40 -4.312 -16.839 4.766 1.00 0.00 C ATOM 676 O VAL A 40 -4.938 -16.170 5.584 1.00 0.00 O ATOM 677 CB VAL A 40 -5.378 -17.417 2.532 1.00 0.00 C ATOM 678 CG1 VAL A 40 -6.203 -16.108 2.509 1.00 0.00 C ATOM 679 CG2 VAL A 40 -4.138 -17.328 1.615 1.00 0.00 C ATOM 0 H VAL A 40 -6.630 -17.530 5.228 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.361 -18.748 3.808 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.028 -18.191 2.123 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.417 -15.831 1.477 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.140 -16.259 3.046 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -5.634 -15.311 2.988 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -4.441 -16.988 0.625 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.423 -16.622 2.038 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.674 -18.311 1.535 1.00 0.00 H new ATOM 689 N HIS A 41 -2.978 -16.672 4.573 1.00 0.00 N ATOM 690 CA HIS A 41 -2.140 -15.738 5.314 1.00 0.00 C ATOM 691 C HIS A 41 -2.119 -14.373 4.640 1.00 0.00 C ATOM 692 O HIS A 41 -1.765 -14.246 3.466 1.00 0.00 O ATOM 693 CB HIS A 41 -0.706 -16.320 5.464 1.00 0.00 C ATOM 694 CG HIS A 41 0.162 -15.612 6.466 1.00 0.00 C ATOM 695 ND1 HIS A 41 0.853 -14.436 6.265 1.00 0.00 N ATOM 696 CD2 HIS A 41 0.342 -15.935 7.769 1.00 0.00 C ATOM 697 CE1 HIS A 41 1.394 -14.089 7.466 1.00 0.00 C ATOM 698 NE2 HIS A 41 1.085 -14.962 8.414 1.00 0.00 N ATOM 0 H HIS A 41 -2.457 -17.205 3.876 1.00 0.00 H new ATOM 0 HA HIS A 41 -2.561 -15.600 6.310 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -0.783 -17.369 5.749 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -0.213 -16.289 4.492 1.00 0.00 H new ATOM 0 HD1 HIS A 41 0.942 -13.925 5.387 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -0.041 -16.828 8.239 1.00 0.00 H new ATOM 0 HE1 HIS A 41 2.001 -13.210 7.626 1.00 0.00 H new ATOM 706 N ASN A 42 -2.490 -13.277 5.364 1.00 0.00 N ATOM 707 CA ASN A 42 -2.580 -11.888 4.863 1.00 0.00 C ATOM 708 C ASN A 42 -1.343 -11.304 4.147 1.00 0.00 C ATOM 709 O ASN A 42 -1.454 -10.525 3.203 1.00 0.00 O ATOM 710 CB ASN A 42 -3.023 -10.917 5.997 1.00 0.00 C ATOM 711 CG ASN A 42 -4.537 -10.740 6.015 1.00 0.00 C ATOM 712 OD1 ASN A 42 -5.213 -11.161 5.084 1.00 0.00 O ATOM 713 ND2 ASN A 42 -5.059 -10.005 7.021 1.00 0.00 N ATOM 0 H ASN A 42 -2.743 -13.349 6.350 1.00 0.00 H new ATOM 0 HA ASN A 42 -3.332 -11.970 4.078 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -2.688 -11.303 6.960 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.543 -9.948 5.857 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.054 -9.780 7.025 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.458 -9.675 7.776 1.00 0.00 H new ATOM 720 N ASN A 43 -0.107 -11.748 4.540 1.00 0.00 N ATOM 721 CA ASN A 43 1.161 -11.406 3.868 1.00 0.00 C ATOM 722 C ASN A 43 1.273 -12.054 2.471 1.00 0.00 C ATOM 723 O ASN A 43 1.852 -11.470 1.566 1.00 0.00 O ATOM 724 CB ASN A 43 2.416 -11.671 4.764 1.00 0.00 C ATOM 725 CG ASN A 43 3.677 -10.859 4.395 1.00 0.00 C ATOM 726 OD1 ASN A 43 4.533 -11.282 3.617 1.00 0.00 O ATOM 727 ND2 ASN A 43 3.856 -9.668 5.030 1.00 0.00 N ATOM 0 H ASN A 43 0.022 -12.361 5.345 1.00 0.00 H new ATOM 0 HA ASN A 43 1.141 -10.328 3.706 1.00 0.00 H new ATOM 0 HB2 ASN A 43 2.155 -11.453 5.800 1.00 0.00 H new ATOM 0 HB3 ASN A 43 2.660 -12.732 4.713 1.00 0.00 H new ATOM 0 HD21 ASN A 43 4.701 -9.123 4.862 1.00 0.00 H new ATOM 0 HD22 ASN A 43 3.145 -9.321 5.674 1.00 0.00 H new ATOM 734 N ILE A 44 0.618 -13.232 2.228 1.00 0.00 N ATOM 735 CA ILE A 44 0.498 -13.919 0.932 1.00 0.00 C ATOM 736 C ILE A 44 -0.454 -13.163 0.010 1.00 0.00 C ATOM 737 O ILE A 44 -0.212 -13.002 -1.182 1.00 0.00 O ATOM 738 CB ILE A 44 0.051 -15.370 1.087 1.00 0.00 C ATOM 739 CG1 ILE A 44 1.048 -16.066 2.049 1.00 0.00 C ATOM 740 CG2 ILE A 44 -0.053 -16.065 -0.304 1.00 0.00 C ATOM 741 CD1 ILE A 44 0.825 -17.572 2.122 1.00 0.00 C ATOM 0 H ILE A 44 0.143 -13.739 2.975 1.00 0.00 H new ATOM 0 HA ILE A 44 1.491 -13.933 0.483 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.949 -15.434 1.517 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.067 -15.867 1.718 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.947 -15.637 3.046 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.373 -17.098 -0.171 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.779 -15.537 -0.921 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.921 -16.047 -0.794 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.547 -18.014 2.808 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.185 -17.773 2.479 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.953 -18.007 1.131 1.00 0.00 H new ATOM 753 N VAL A 45 -1.559 -12.628 0.603 1.00 0.00 N ATOM 754 CA VAL A 45 -2.574 -11.812 -0.072 1.00 0.00 C ATOM 755 C VAL A 45 -2.038 -10.400 -0.386 1.00 0.00 C ATOM 756 O VAL A 45 -2.232 -9.920 -1.497 1.00 0.00 O ATOM 757 CB VAL A 45 -3.915 -11.814 0.679 1.00 0.00 C ATOM 758 CG1 VAL A 45 -4.325 -13.265 1.033 1.00 0.00 C ATOM 759 CG2 VAL A 45 -5.032 -11.175 -0.178 1.00 0.00 C ATOM 0 H VAL A 45 -1.761 -12.765 1.593 1.00 0.00 H new ATOM 0 HA VAL A 45 -2.790 -12.274 -1.035 1.00 0.00 H new ATOM 0 HB VAL A 45 -3.787 -11.230 1.590 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.276 -13.255 1.565 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -4.427 -13.848 0.118 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.560 -13.715 1.666 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.970 -11.189 0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.766 -10.145 -0.414 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -5.149 -11.740 -1.103 1.00 0.00 H new ATOM 769 N TYR A 46 -1.270 -9.752 0.562 1.00 0.00 N ATOM 770 CA TYR A 46 -0.562 -8.442 0.466 1.00 0.00 C ATOM 771 C TYR A 46 0.492 -8.435 -0.623 1.00 0.00 C ATOM 772 O TYR A 46 0.459 -7.568 -1.479 1.00 0.00 O ATOM 773 CB TYR A 46 0.083 -7.952 1.824 1.00 0.00 C ATOM 774 CG TYR A 46 0.048 -6.450 2.159 1.00 0.00 C ATOM 775 CD1 TYR A 46 0.051 -5.359 1.282 1.00 0.00 C ATOM 776 CD2 TYR A 46 -0.051 -6.136 3.509 1.00 0.00 C ATOM 777 CE1 TYR A 46 -0.214 -4.078 1.731 1.00 0.00 C ATOM 778 CE2 TYR A 46 -0.517 -4.910 3.914 1.00 0.00 C ATOM 779 CZ TYR A 46 -0.591 -3.863 3.033 1.00 0.00 C ATOM 780 OH TYR A 46 -1.052 -2.606 3.479 1.00 0.00 O ATOM 0 H TYR A 46 -1.127 -10.175 1.479 1.00 0.00 H new ATOM 0 HA TYR A 46 -1.351 -7.735 0.209 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -0.413 -8.483 2.636 1.00 0.00 H new ATOM 0 HB3 TYR A 46 1.126 -8.267 1.827 1.00 0.00 H new ATOM 0 HD1 TYR A 46 0.264 -5.521 0.236 1.00 0.00 H new ATOM 0 HD2 TYR A 46 0.242 -6.866 4.249 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -0.124 -3.242 1.053 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -0.829 -4.769 4.938 1.00 0.00 H new ATOM 0 HH TYR A 46 -2.032 -2.606 3.501 1.00 0.00 H new ATOM 790 N ASN A 47 1.404 -9.448 -0.651 1.00 0.00 N ATOM 791 CA ASN A 47 2.466 -9.702 -1.640 1.00 0.00 C ATOM 792 C ASN A 47 1.922 -10.072 -3.001 1.00 0.00 C ATOM 793 O ASN A 47 2.542 -9.813 -4.026 1.00 0.00 O ATOM 794 CB ASN A 47 3.446 -10.803 -1.152 1.00 0.00 C ATOM 795 CG ASN A 47 4.371 -10.099 -0.175 1.00 0.00 C ATOM 796 OD1 ASN A 47 5.486 -9.712 -0.520 1.00 0.00 O ATOM 797 ND2 ASN A 47 3.831 -9.793 1.023 1.00 0.00 N ATOM 0 H ASN A 47 1.407 -10.159 0.080 1.00 0.00 H new ATOM 0 HA ASN A 47 3.007 -8.761 -1.743 1.00 0.00 H new ATOM 0 HB2 ASN A 47 2.912 -11.622 -0.670 1.00 0.00 H new ATOM 0 HB3 ASN A 47 4.004 -11.232 -1.984 1.00 0.00 H new ATOM 0 HD21 ASN A 47 4.352 -9.218 1.685 1.00 0.00 H new ATOM 0 HD22 ASN A 47 2.902 -10.137 1.266 1.00 0.00 H new ATOM 804 N GLU A 48 0.700 -10.656 -3.023 1.00 0.00 N ATOM 805 CA GLU A 48 -0.074 -10.953 -4.243 1.00 0.00 C ATOM 806 C GLU A 48 -0.704 -9.689 -4.848 1.00 0.00 C ATOM 807 O GLU A 48 -0.532 -9.392 -6.031 1.00 0.00 O ATOM 808 CB GLU A 48 -1.172 -12.035 -4.035 1.00 0.00 C ATOM 809 CG GLU A 48 -1.839 -12.468 -5.358 1.00 0.00 C ATOM 810 CD GLU A 48 -2.588 -13.795 -5.258 1.00 0.00 C ATOM 811 OE1 GLU A 48 -3.775 -13.836 -5.680 1.00 0.00 O ATOM 812 OE2 GLU A 48 -1.974 -14.792 -4.792 1.00 0.00 O ATOM 0 H GLU A 48 0.217 -10.939 -2.170 1.00 0.00 H new ATOM 0 HA GLU A 48 0.656 -11.359 -4.943 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -0.730 -12.907 -3.553 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.934 -11.648 -3.358 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -2.534 -11.691 -5.676 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.075 -12.549 -6.131 1.00 0.00 H new ATOM 819 N TYR A 49 -1.384 -8.886 -3.973 1.00 0.00 N ATOM 820 CA TYR A 49 -2.060 -7.602 -4.179 1.00 0.00 C ATOM 821 C TYR A 49 -1.129 -6.530 -4.755 1.00 0.00 C ATOM 822 O TYR A 49 -1.421 -5.953 -5.794 1.00 0.00 O ATOM 823 CB TYR A 49 -2.851 -7.239 -2.856 1.00 0.00 C ATOM 824 CG TYR A 49 -2.945 -5.798 -2.454 1.00 0.00 C ATOM 825 CD1 TYR A 49 -3.905 -4.936 -2.921 1.00 0.00 C ATOM 826 CD2 TYR A 49 -1.920 -5.292 -1.695 1.00 0.00 C ATOM 827 CE1 TYR A 49 -3.753 -3.587 -2.694 1.00 0.00 C ATOM 828 CE2 TYR A 49 -1.733 -3.948 -1.530 1.00 0.00 C ATOM 829 CZ TYR A 49 -2.659 -3.076 -2.038 1.00 0.00 C ATOM 830 OH TYR A 49 -2.521 -1.682 -1.910 1.00 0.00 O ATOM 0 H TYR A 49 -1.471 -9.174 -2.998 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.809 -7.671 -4.968 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -3.866 -7.621 -2.961 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -2.389 -7.784 -2.033 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -4.765 -5.309 -3.457 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -1.239 -5.978 -1.212 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -4.518 -2.909 -3.042 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -0.865 -3.578 -1.005 1.00 0.00 H new ATOM 0 HH TYR A 49 -1.638 -1.409 -2.236 1.00 0.00 H new ATOM 840 N ILE A 50 0.046 -6.274 -4.148 1.00 0.00 N ATOM 841 CA ILE A 50 0.995 -5.243 -4.603 1.00 0.00 C ATOM 842 C ILE A 50 1.806 -5.434 -5.871 1.00 0.00 C ATOM 843 O ILE A 50 2.538 -4.538 -6.286 1.00 0.00 O ATOM 844 CB ILE A 50 1.995 -4.850 -3.561 1.00 0.00 C ATOM 845 CG1 ILE A 50 2.813 -6.030 -2.986 1.00 0.00 C ATOM 846 CG2 ILE A 50 1.259 -4.119 -2.468 1.00 0.00 C ATOM 847 CD1 ILE A 50 3.595 -5.772 -1.693 1.00 0.00 C ATOM 0 H ILE A 50 0.364 -6.781 -3.322 1.00 0.00 H new ATOM 0 HA ILE A 50 0.244 -4.486 -4.831 1.00 0.00 H new ATOM 0 HB ILE A 50 2.738 -4.210 -4.036 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.130 -6.861 -2.808 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.519 -6.356 -3.749 1.00 0.00 H new ATOM 0 HG21 ILE A 50 1.964 -3.819 -1.692 1.00 0.00 H new ATOM 0 HG22 ILE A 50 0.778 -3.233 -2.883 1.00 0.00 H new ATOM 0 HG23 ILE A 50 0.502 -4.775 -2.037 1.00 0.00 H new ATOM 0 HD11 ILE A 50 4.123 -6.679 -1.400 1.00 0.00 H new ATOM 0 HD12 ILE A 50 4.315 -4.970 -1.857 1.00 0.00 H new ATOM 0 HD13 ILE A 50 2.904 -5.483 -0.901 1.00 0.00 H new ATOM 859 N SER A 51 1.671 -6.597 -6.525 1.00 0.00 N ATOM 860 CA SER A 51 2.290 -6.965 -7.807 1.00 0.00 C ATOM 861 C SER A 51 1.674 -6.225 -9.030 1.00 0.00 C ATOM 862 O SER A 51 2.183 -6.241 -10.146 1.00 0.00 O ATOM 863 CB SER A 51 2.353 -8.515 -8.018 1.00 0.00 C ATOM 864 OG SER A 51 1.079 -9.155 -8.160 1.00 0.00 O ATOM 0 H SER A 51 1.093 -7.350 -6.151 1.00 0.00 H new ATOM 0 HA SER A 51 3.320 -6.614 -7.742 1.00 0.00 H new ATOM 0 HB2 SER A 51 2.949 -8.722 -8.907 1.00 0.00 H new ATOM 0 HB3 SER A 51 2.876 -8.962 -7.172 1.00 0.00 H new ATOM 0 HG SER A 51 0.666 -9.261 -7.278 1.00 0.00 H new ATOM 870 N HIS A 52 0.545 -5.527 -8.757 1.00 0.00 N ATOM 871 CA HIS A 52 -0.263 -4.648 -9.587 1.00 0.00 C ATOM 872 C HIS A 52 0.168 -3.169 -9.359 1.00 0.00 C ATOM 873 O HIS A 52 1.301 -2.890 -8.973 1.00 0.00 O ATOM 874 CB HIS A 52 -1.744 -4.881 -9.165 1.00 0.00 C ATOM 875 CG HIS A 52 -2.264 -6.306 -9.328 1.00 0.00 C ATOM 876 ND1 HIS A 52 -3.151 -6.705 -10.313 1.00 0.00 N ATOM 877 CD2 HIS A 52 -2.113 -7.398 -8.520 1.00 0.00 C ATOM 878 CE1 HIS A 52 -3.497 -7.991 -10.042 1.00 0.00 C ATOM 879 NE2 HIS A 52 -2.897 -8.452 -8.968 1.00 0.00 N ATOM 0 H HIS A 52 0.141 -5.587 -7.822 1.00 0.00 H new ATOM 0 HA HIS A 52 -0.136 -4.858 -10.649 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -1.854 -4.591 -8.120 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -2.378 -4.214 -9.749 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -1.472 -7.436 -7.652 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -4.186 -8.568 -10.641 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -2.987 -9.380 -8.555 1.00 0.00 H new ATOM 887 N ARG A 53 -0.728 -2.147 -9.563 1.00 0.00 N ATOM 888 CA ARG A 53 -0.451 -0.704 -9.418 1.00 0.00 C ATOM 889 C ARG A 53 -0.111 -0.206 -8.009 1.00 0.00 C ATOM 890 O ARG A 53 0.743 0.645 -7.775 1.00 0.00 O ATOM 891 CB ARG A 53 -1.637 0.123 -10.046 1.00 0.00 C ATOM 892 CG ARG A 53 -2.639 0.870 -9.118 1.00 0.00 C ATOM 893 CD ARG A 53 -3.737 0.065 -8.389 1.00 0.00 C ATOM 894 NE ARG A 53 -4.925 -0.143 -9.292 1.00 0.00 N ATOM 895 CZ ARG A 53 -6.136 0.477 -9.127 1.00 0.00 C ATOM 896 NH1 ARG A 53 -6.341 1.376 -8.122 1.00 0.00 N ATOM 897 NH2 ARG A 53 -7.157 0.185 -9.986 1.00 0.00 N ATOM 0 H ARG A 53 -1.692 -2.329 -9.842 1.00 0.00 H new ATOM 0 HA ARG A 53 0.477 -0.539 -9.965 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -1.198 0.865 -10.713 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.217 -0.561 -10.666 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -2.056 1.391 -8.359 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -3.135 1.633 -9.718 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -3.340 -0.899 -8.073 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.046 0.594 -7.487 1.00 0.00 H new ATOM 0 HE ARG A 53 -4.821 -0.787 -10.076 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -5.585 1.599 -7.475 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.251 1.826 -8.018 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -7.013 -0.488 -10.739 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.063 0.639 -9.874 1.00 0.00 H new ATOM 911 N GLU A 54 -0.920 -0.751 -7.092 1.00 0.00 N ATOM 912 CA GLU A 54 -1.233 -0.559 -5.698 1.00 0.00 C ATOM 913 C GLU A 54 -0.189 -0.745 -4.642 1.00 0.00 C ATOM 914 O GLU A 54 -0.573 -0.819 -3.475 1.00 0.00 O ATOM 915 CB GLU A 54 -2.434 -1.481 -5.399 1.00 0.00 C ATOM 916 CG GLU A 54 -2.120 -2.952 -5.723 1.00 0.00 C ATOM 917 CD GLU A 54 -3.368 -3.622 -6.314 1.00 0.00 C ATOM 918 OE1 GLU A 54 -3.888 -3.102 -7.338 1.00 0.00 O ATOM 919 OE2 GLU A 54 -3.816 -4.671 -5.792 1.00 0.00 O ATOM 0 H GLU A 54 -1.500 -1.524 -7.419 1.00 0.00 H new ATOM 0 HA GLU A 54 -1.404 0.514 -5.613 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.708 -1.391 -4.348 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -3.296 -1.156 -5.982 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -1.293 -3.011 -6.430 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -1.806 -3.476 -4.820 1.00 0.00 H new ATOM 926 N HIS A 55 1.120 -0.867 -5.011 1.00 0.00 N ATOM 927 CA HIS A 55 2.286 -1.055 -4.131 1.00 0.00 C ATOM 928 C HIS A 55 2.408 -0.175 -2.876 1.00 0.00 C ATOM 929 O HIS A 55 3.040 0.877 -2.838 1.00 0.00 O ATOM 930 CB HIS A 55 3.652 -1.175 -4.866 1.00 0.00 C ATOM 931 CG HIS A 55 4.751 -1.647 -3.929 1.00 0.00 C ATOM 932 ND1 HIS A 55 5.759 -0.834 -3.446 1.00 0.00 N ATOM 933 CD2 HIS A 55 4.793 -2.776 -3.167 1.00 0.00 C ATOM 934 CE1 HIS A 55 6.358 -1.503 -2.430 1.00 0.00 C ATOM 935 NE2 HIS A 55 5.798 -2.675 -2.215 1.00 0.00 N ATOM 0 H HIS A 55 1.393 -0.833 -5.993 1.00 0.00 H new ATOM 0 HA HIS A 55 2.025 -2.035 -3.732 1.00 0.00 H new ATOM 0 HB2 HIS A 55 3.558 -1.873 -5.698 1.00 0.00 H new ATOM 0 HB3 HIS A 55 3.924 -0.208 -5.289 1.00 0.00 H new ATOM 0 HD2 HIS A 55 4.139 -3.627 -3.287 1.00 0.00 H new ATOM 0 HE1 HIS A 55 7.195 -1.120 -1.865 1.00 0.00 H new ATOM 0 HE2 HIS A 55 6.049 -3.361 -1.503 1.00 0.00 H new ATOM 943 N ILE A 56 1.758 -0.710 -1.822 1.00 0.00 N ATOM 944 CA ILE A 56 1.614 -0.294 -0.453 1.00 0.00 C ATOM 945 C ILE A 56 2.216 -1.416 0.352 1.00 0.00 C ATOM 946 O ILE A 56 2.012 -2.587 0.059 1.00 0.00 O ATOM 947 CB ILE A 56 0.155 -0.174 -0.070 1.00 0.00 C ATOM 948 CG1 ILE A 56 -0.415 1.036 -0.822 1.00 0.00 C ATOM 949 CG2 ILE A 56 -0.113 -0.016 1.457 1.00 0.00 C ATOM 950 CD1 ILE A 56 -1.885 1.108 -0.493 1.00 0.00 C ATOM 0 H ILE A 56 1.249 -1.583 -1.961 1.00 0.00 H new ATOM 0 HA ILE A 56 2.085 0.675 -0.286 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.331 -1.111 -0.343 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.093 1.952 -0.520 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -0.265 0.928 -1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.186 0.062 1.632 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.279 -0.884 1.987 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.381 0.885 1.822 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.332 1.958 -1.009 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.375 0.189 -0.815 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.012 1.229 0.583 1.00 0.00 H new ATOM 962 N HIS A 57 2.897 -1.100 1.463 1.00 0.00 N ATOM 963 CA HIS A 57 3.335 -2.085 2.435 1.00 0.00 C ATOM 964 C HIS A 57 2.449 -1.879 3.655 1.00 0.00 C ATOM 965 O HIS A 57 2.018 -0.753 3.894 1.00 0.00 O ATOM 966 CB HIS A 57 4.824 -1.879 2.802 1.00 0.00 C ATOM 967 CG HIS A 57 5.523 -3.181 3.080 1.00 0.00 C ATOM 968 ND1 HIS A 57 6.892 -3.324 3.168 1.00 0.00 N ATOM 969 CD2 HIS A 57 5.007 -4.425 3.292 1.00 0.00 C ATOM 970 CE1 HIS A 57 7.131 -4.633 3.437 1.00 0.00 C ATOM 971 NE2 HIS A 57 6.015 -5.327 3.530 1.00 0.00 N ATOM 0 H HIS A 57 3.156 -0.144 1.705 1.00 0.00 H new ATOM 0 HA HIS A 57 3.251 -3.098 2.040 1.00 0.00 H new ATOM 0 HB2 HIS A 57 5.330 -1.363 1.986 1.00 0.00 H new ATOM 0 HB3 HIS A 57 4.895 -1.235 3.679 1.00 0.00 H new ATOM 0 HD2 HIS A 57 3.955 -4.667 3.275 1.00 0.00 H new ATOM 0 HE1 HIS A 57 8.118 -5.055 3.560 1.00 0.00 H new ATOM 0 HE2 HIS A 57 5.920 -6.322 3.735 1.00 0.00 H new ATOM 979 N MET A 58 2.173 -2.917 4.514 1.00 0.00 N ATOM 980 CA MET A 58 1.304 -2.889 5.730 1.00 0.00 C ATOM 981 C MET A 58 1.580 -1.816 6.737 1.00 0.00 C ATOM 982 O MET A 58 0.748 -1.356 7.506 1.00 0.00 O ATOM 983 CB MET A 58 1.247 -4.264 6.467 1.00 0.00 C ATOM 984 CG MET A 58 2.070 -4.529 7.756 1.00 0.00 C ATOM 985 SD MET A 58 1.485 -3.896 9.371 1.00 0.00 S ATOM 986 CE MET A 58 -0.291 -4.242 9.202 1.00 0.00 C ATOM 0 H MET A 58 2.575 -3.842 4.363 1.00 0.00 H new ATOM 0 HA MET A 58 0.336 -2.646 5.290 1.00 0.00 H new ATOM 0 HB2 MET A 58 0.202 -4.447 6.716 1.00 0.00 H new ATOM 0 HB3 MET A 58 1.540 -5.024 5.743 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.179 -5.609 7.853 1.00 0.00 H new ATOM 0 HG3 MET A 58 3.067 -4.121 7.592 1.00 0.00 H new ATOM 0 HE1 MET A 58 -0.763 -4.207 10.184 1.00 0.00 H new ATOM 0 HE2 MET A 58 -0.747 -3.494 8.553 1.00 0.00 H new ATOM 0 HE3 MET A 58 -0.429 -5.232 8.768 1.00 0.00 H new ATOM 996 N ASN A 59 2.841 -1.399 6.673 1.00 0.00 N ATOM 997 CA ASN A 59 3.588 -0.456 7.436 1.00 0.00 C ATOM 998 C ASN A 59 3.169 1.022 7.094 1.00 0.00 C ATOM 999 O ASN A 59 3.419 1.958 7.849 1.00 0.00 O ATOM 1000 CB ASN A 59 5.078 -0.887 7.176 1.00 0.00 C ATOM 1001 CG ASN A 59 5.199 -2.435 7.307 1.00 0.00 C ATOM 1002 OD1 ASN A 59 5.206 -2.983 8.409 1.00 0.00 O ATOM 1003 ND2 ASN A 59 5.172 -3.188 6.161 1.00 0.00 N ATOM 0 H ASN A 59 3.444 -1.798 5.954 1.00 0.00 H new ATOM 0 HA ASN A 59 3.405 -0.460 8.510 1.00 0.00 H new ATOM 0 HB2 ASN A 59 5.392 -0.569 6.182 1.00 0.00 H new ATOM 0 HB3 ASN A 59 5.740 -0.398 7.891 1.00 0.00 H new ATOM 0 HD21 ASN A 59 5.158 -4.206 6.220 1.00 0.00 H new ATOM 0 HD22 ASN A 59 5.166 -2.730 5.250 1.00 0.00 H new ATOM 1010 N ALA A 60 2.424 1.216 5.941 1.00 0.00 N ATOM 1011 CA ALA A 60 1.769 2.452 5.450 1.00 0.00 C ATOM 1012 C ALA A 60 0.402 2.782 6.103 1.00 0.00 C ATOM 1013 O ALA A 60 -0.246 3.790 5.819 1.00 0.00 O ATOM 1014 CB ALA A 60 1.540 2.357 3.916 1.00 0.00 C ATOM 0 H ALA A 60 2.267 0.441 5.297 1.00 0.00 H new ATOM 0 HA ALA A 60 2.457 3.251 5.725 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.058 3.269 3.563 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.499 2.234 3.412 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.902 1.501 3.696 1.00 0.00 H new ATOM 1020 N THR A 61 -0.048 1.890 7.012 1.00 0.00 N ATOM 1021 CA THR A 61 -1.311 1.890 7.748 1.00 0.00 C ATOM 1022 C THR A 61 -1.107 2.393 9.187 1.00 0.00 C ATOM 1023 O THR A 61 0.015 2.569 9.662 1.00 0.00 O ATOM 1024 CB THR A 61 -1.912 0.455 7.750 1.00 0.00 C ATOM 1025 OG1 THR A 61 -1.315 -0.437 8.695 1.00 0.00 O ATOM 1026 CG2 THR A 61 -1.813 -0.247 6.370 1.00 0.00 C ATOM 0 H THR A 61 0.522 1.083 7.265 1.00 0.00 H new ATOM 0 HA THR A 61 -2.007 2.568 7.254 1.00 0.00 H new ATOM 0 HB THR A 61 -2.950 0.639 8.025 1.00 0.00 H new ATOM 0 HG1 THR A 61 -0.357 -0.522 8.505 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.249 -1.244 6.437 1.00 0.00 H new ATOM 0 HG22 THR A 61 -2.354 0.337 5.625 1.00 0.00 H new ATOM 0 HG23 THR A 61 -0.766 -0.328 6.077 1.00 0.00 H new ATOM 1034 N GLN A 62 -2.217 2.532 9.976 1.00 0.00 N ATOM 1035 CA GLN A 62 -2.191 2.863 11.400 1.00 0.00 C ATOM 1036 C GLN A 62 -2.060 1.635 12.297 1.00 0.00 C ATOM 1037 O GLN A 62 -2.022 1.723 13.526 1.00 0.00 O ATOM 1038 CB GLN A 62 -3.443 3.681 11.802 1.00 0.00 C ATOM 1039 CG GLN A 62 -4.748 2.884 12.004 1.00 0.00 C ATOM 1040 CD GLN A 62 -5.887 3.865 12.238 1.00 0.00 C ATOM 1041 OE1 GLN A 62 -5.696 5.082 12.234 1.00 0.00 O ATOM 1042 NE2 GLN A 62 -7.106 3.324 12.480 1.00 0.00 N ATOM 0 H GLN A 62 -3.163 2.411 9.614 1.00 0.00 H new ATOM 0 HA GLN A 62 -1.298 3.469 11.553 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -3.221 4.213 12.727 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -3.619 4.435 11.035 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -4.954 2.268 11.129 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -4.651 2.208 12.854 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -7.225 2.311 12.475 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -7.905 3.930 12.667 1.00 0.00 H new ATOM 1051 N TRP A 63 -1.987 0.437 11.658 1.00 0.00 N ATOM 1052 CA TRP A 63 -1.807 -0.868 12.248 1.00 0.00 C ATOM 1053 C TRP A 63 -0.293 -1.145 12.284 1.00 0.00 C ATOM 1054 O TRP A 63 0.345 -1.401 11.269 1.00 0.00 O ATOM 1055 CB TRP A 63 -2.599 -1.968 11.462 1.00 0.00 C ATOM 1056 CG TRP A 63 -4.030 -1.592 11.018 1.00 0.00 C ATOM 1057 CD1 TRP A 63 -5.110 -1.227 11.780 1.00 0.00 C ATOM 1058 CD2 TRP A 63 -4.516 -1.638 9.654 1.00 0.00 C ATOM 1059 NE1 TRP A 63 -6.226 -1.035 10.978 1.00 0.00 N ATOM 1060 CE2 TRP A 63 -5.858 -1.284 9.671 1.00 0.00 C ATOM 1061 CE3 TRP A 63 -3.912 -1.974 8.473 1.00 0.00 C ATOM 1062 CZ2 TRP A 63 -6.586 -1.268 8.517 1.00 0.00 C ATOM 1063 CZ3 TRP A 63 -4.637 -1.887 7.297 1.00 0.00 C ATOM 1064 CH2 TRP A 63 -5.973 -1.543 7.312 1.00 0.00 C ATOM 0 H TRP A 63 -2.061 0.381 10.642 1.00 0.00 H new ATOM 0 HA TRP A 63 -2.210 -0.893 13.260 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -2.025 -2.236 10.575 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -2.657 -2.860 12.086 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -5.094 -1.106 12.853 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.154 -0.759 11.298 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -2.883 -2.303 8.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.641 -1.040 8.547 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -4.150 -2.091 6.355 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -6.533 -1.490 6.390 1.00 0.00 H new ATOM 1075 N GLU A 64 0.327 -1.064 13.494 1.00 0.00 N ATOM 1076 CA GLU A 64 1.762 -1.232 13.764 1.00 0.00 C ATOM 1077 C GLU A 64 2.270 -2.668 13.711 1.00 0.00 C ATOM 1078 O GLU A 64 3.466 -2.950 13.743 1.00 0.00 O ATOM 1079 CB GLU A 64 2.150 -0.589 15.115 1.00 0.00 C ATOM 1080 CG GLU A 64 1.335 -1.192 16.254 1.00 0.00 C ATOM 1081 CD GLU A 64 1.507 -0.401 17.544 1.00 0.00 C ATOM 1082 OE1 GLU A 64 0.487 0.138 18.051 1.00 0.00 O ATOM 1083 OE2 GLU A 64 2.661 -0.327 18.045 1.00 0.00 O ATOM 0 H GLU A 64 -0.200 -0.869 14.345 1.00 0.00 H new ATOM 0 HA GLU A 64 2.254 -0.715 12.941 1.00 0.00 H new ATOM 0 HB2 GLU A 64 3.213 -0.740 15.303 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.983 0.487 15.072 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.281 -1.213 15.977 1.00 0.00 H new ATOM 0 HG3 GLU A 64 1.643 -2.225 16.416 1.00 0.00 H new ATOM 1090 N THR A 65 1.311 -3.610 13.666 1.00 0.00 N ATOM 1091 CA THR A 65 1.480 -5.046 13.642 1.00 0.00 C ATOM 1092 C THR A 65 0.405 -5.503 12.673 1.00 0.00 C ATOM 1093 O THR A 65 -0.575 -4.785 12.485 1.00 0.00 O ATOM 1094 CB THR A 65 1.284 -5.687 15.036 1.00 0.00 C ATOM 1095 OG1 THR A 65 0.059 -5.307 15.663 1.00 0.00 O ATOM 1096 CG2 THR A 65 2.404 -5.232 15.986 1.00 0.00 C ATOM 0 H THR A 65 0.325 -3.350 13.644 1.00 0.00 H new ATOM 0 HA THR A 65 2.487 -5.340 13.346 1.00 0.00 H new ATOM 0 HB THR A 65 1.287 -6.763 14.864 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.010 -5.743 16.538 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.258 -5.688 16.965 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.369 -5.538 15.583 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.379 -4.147 16.084 1.00 0.00 H new ATOM 1104 N LEU A 66 0.478 -6.731 12.070 1.00 0.00 N ATOM 1105 CA LEU A 66 -0.553 -7.294 11.177 1.00 0.00 C ATOM 1106 C LEU A 66 -1.812 -7.690 11.952 1.00 0.00 C ATOM 1107 O LEU A 66 -2.929 -7.627 11.455 1.00 0.00 O ATOM 1108 CB LEU A 66 0.022 -8.486 10.355 1.00 0.00 C ATOM 1109 CG LEU A 66 -0.644 -8.913 9.006 1.00 0.00 C ATOM 1110 CD1 LEU A 66 -0.218 -8.040 7.811 1.00 0.00 C ATOM 1111 CD2 LEU A 66 -2.175 -9.071 9.006 1.00 0.00 C ATOM 0 H LEU A 66 1.273 -7.356 12.202 1.00 0.00 H new ATOM 0 HA LEU A 66 -0.849 -6.518 10.471 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.065 -8.255 10.140 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.017 -9.359 11.007 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.245 -9.920 8.888 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.717 -8.391 6.908 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.497 -7.003 8.000 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.862 -8.107 7.678 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.510 -9.369 8.013 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.462 -9.834 9.730 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.639 -8.122 9.275 1.00 0.00 H new ATOM 1123 N THR A 67 -1.648 -8.005 13.264 1.00 0.00 N ATOM 1124 CA THR A 67 -2.549 -8.408 14.321 1.00 0.00 C ATOM 1125 C THR A 67 -3.611 -7.383 14.526 1.00 0.00 C ATOM 1126 O THR A 67 -4.765 -7.764 14.565 1.00 0.00 O ATOM 1127 CB THR A 67 -1.762 -8.619 15.616 1.00 0.00 C ATOM 1128 OG1 THR A 67 -0.706 -9.537 15.376 1.00 0.00 O ATOM 1129 CG2 THR A 67 -2.668 -9.209 16.700 1.00 0.00 C ATOM 0 H THR A 67 -0.702 -7.966 13.643 1.00 0.00 H new ATOM 0 HA THR A 67 -3.029 -9.344 14.035 1.00 0.00 H new ATOM 0 HB THR A 67 -1.372 -7.656 15.947 1.00 0.00 H new ATOM 0 HG1 THR A 67 -1.075 -10.438 15.264 1.00 0.00 H new ATOM 0 HG21 THR A 67 -2.094 -9.353 17.615 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.495 -8.526 16.894 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.061 -10.168 16.363 1.00 0.00 H new ATOM 1137 N ASP A 68 -3.262 -6.073 14.524 1.00 0.00 N ATOM 1138 CA ASP A 68 -4.161 -4.922 14.587 1.00 0.00 C ATOM 1139 C ASP A 68 -4.984 -4.628 13.334 1.00 0.00 C ATOM 1140 O ASP A 68 -6.089 -4.098 13.425 1.00 0.00 O ATOM 1141 CB ASP A 68 -3.389 -3.658 15.078 1.00 0.00 C ATOM 1142 CG ASP A 68 -4.150 -2.925 16.186 1.00 0.00 C ATOM 1143 OD1 ASP A 68 -3.648 -2.918 17.342 1.00 0.00 O ATOM 1144 OD2 ASP A 68 -5.237 -2.360 15.891 1.00 0.00 O ATOM 0 H ASP A 68 -2.284 -5.788 14.475 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.919 -5.208 15.316 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -2.406 -3.952 15.445 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -3.227 -2.982 14.239 1.00 0.00 H new ATOM 1149 N PHE A 69 -4.480 -5.027 12.129 1.00 0.00 N ATOM 1150 CA PHE A 69 -5.171 -4.991 10.829 1.00 0.00 C ATOM 1151 C PHE A 69 -6.216 -6.108 10.796 1.00 0.00 C ATOM 1152 O PHE A 69 -7.334 -5.942 10.314 1.00 0.00 O ATOM 1153 CB PHE A 69 -4.125 -5.114 9.668 1.00 0.00 C ATOM 1154 CG PHE A 69 -4.644 -5.362 8.255 1.00 0.00 C ATOM 1155 CD1 PHE A 69 -5.838 -4.840 7.780 1.00 0.00 C ATOM 1156 CD2 PHE A 69 -3.940 -6.223 7.434 1.00 0.00 C ATOM 1157 CE1 PHE A 69 -6.346 -5.233 6.559 1.00 0.00 C ATOM 1158 CE2 PHE A 69 -4.466 -6.658 6.236 1.00 0.00 C ATOM 1159 CZ PHE A 69 -5.683 -6.180 5.804 1.00 0.00 C ATOM 0 H PHE A 69 -3.534 -5.399 12.048 1.00 0.00 H new ATOM 0 HA PHE A 69 -5.688 -4.041 10.692 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -3.537 -4.196 9.651 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -3.442 -5.926 9.919 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -6.377 -4.117 8.374 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -2.960 -6.561 7.737 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -7.265 -4.799 6.193 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -3.923 -7.374 5.636 1.00 0.00 H new ATOM 0 HZ PHE A 69 -6.115 -6.543 4.883 1.00 0.00 H new ATOM 1169 N THR A 70 -5.866 -7.273 11.405 1.00 0.00 N ATOM 1170 CA THR A 70 -6.726 -8.440 11.612 1.00 0.00 C ATOM 1171 C THR A 70 -7.784 -8.163 12.677 1.00 0.00 C ATOM 1172 O THR A 70 -8.945 -8.539 12.519 1.00 0.00 O ATOM 1173 CB THR A 70 -5.932 -9.715 11.821 1.00 0.00 C ATOM 1174 OG1 THR A 70 -4.714 -9.493 12.468 1.00 0.00 O ATOM 1175 CG2 THR A 70 -5.606 -10.303 10.439 1.00 0.00 C ATOM 0 H THR A 70 -4.928 -7.417 11.778 1.00 0.00 H new ATOM 0 HA THR A 70 -7.280 -8.623 10.691 1.00 0.00 H new ATOM 0 HB THR A 70 -6.536 -10.380 12.439 1.00 0.00 H new ATOM 0 HG1 THR A 70 -4.346 -10.348 12.775 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.034 -11.223 10.561 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.533 -10.520 9.908 1.00 0.00 H new ATOM 0 HG23 THR A 70 -5.020 -9.584 9.867 1.00 0.00 H new ATOM 1183 N LYS A 71 -7.406 -7.377 13.744 1.00 0.00 N ATOM 1184 CA LYS A 71 -8.378 -6.834 14.725 1.00 0.00 C ATOM 1185 C LYS A 71 -9.429 -5.841 14.153 1.00 0.00 C ATOM 1186 O LYS A 71 -10.577 -5.857 14.581 1.00 0.00 O ATOM 1187 CB LYS A 71 -7.757 -6.158 15.997 1.00 0.00 C ATOM 1188 CG LYS A 71 -6.754 -6.995 16.823 1.00 0.00 C ATOM 1189 CD LYS A 71 -7.136 -8.477 16.940 1.00 0.00 C ATOM 1190 CE LYS A 71 -6.133 -9.399 17.650 1.00 0.00 C ATOM 1191 NZ LYS A 71 -6.797 -10.636 18.126 1.00 0.00 N ATOM 0 H LYS A 71 -6.438 -7.115 13.933 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.872 -7.762 15.013 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -7.255 -5.243 15.682 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -8.574 -5.863 16.656 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -5.767 -6.918 16.366 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.676 -6.569 17.823 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.088 -8.541 17.467 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.301 -8.865 15.935 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -5.323 -9.656 16.968 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -5.685 -8.874 18.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -6.100 -11.243 18.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.554 -10.388 18.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.204 -11.146 17.316 1.00 0.00 H new ATOM 1205 N TRP A 72 -9.042 -4.974 13.173 1.00 0.00 N ATOM 1206 CA TRP A 72 -9.906 -3.995 12.490 1.00 0.00 C ATOM 1207 C TRP A 72 -10.754 -4.589 11.360 1.00 0.00 C ATOM 1208 O TRP A 72 -11.966 -4.428 11.354 1.00 0.00 O ATOM 1209 CB TRP A 72 -9.103 -2.736 12.006 1.00 0.00 C ATOM 1210 CG TRP A 72 -9.884 -1.610 11.291 1.00 0.00 C ATOM 1211 CD1 TRP A 72 -10.561 -0.535 11.800 1.00 0.00 C ATOM 1212 CD2 TRP A 72 -10.078 -1.565 9.862 1.00 0.00 C ATOM 1213 NE1 TRP A 72 -11.161 0.175 10.776 1.00 0.00 N ATOM 1214 CE2 TRP A 72 -10.853 -0.442 9.577 1.00 0.00 C ATOM 1215 CE3 TRP A 72 -9.648 -2.395 8.866 1.00 0.00 C ATOM 1216 CZ2 TRP A 72 -11.175 -0.117 8.284 1.00 0.00 C ATOM 1217 CZ3 TRP A 72 -9.956 -2.062 7.570 1.00 0.00 C ATOM 1218 CH2 TRP A 72 -10.691 -0.931 7.273 1.00 0.00 C ATOM 0 H TRP A 72 -8.081 -4.946 12.832 1.00 0.00 H new ATOM 0 HA TRP A 72 -10.617 -3.669 13.250 1.00 0.00 H new ATOM 0 HB2 TRP A 72 -8.609 -2.301 12.875 1.00 0.00 H new ATOM 0 HB3 TRP A 72 -8.318 -3.079 11.332 1.00 0.00 H new ATOM 0 HD1 TRP A 72 -10.618 -0.279 12.848 1.00 0.00 H new ATOM 0 HE1 TRP A 72 -11.734 1.012 10.886 1.00 0.00 H new ATOM 0 HE3 TRP A 72 -9.082 -3.287 9.091 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 -11.786 0.745 8.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 -9.616 -2.698 6.766 1.00 0.00 H new ATOM 0 HH2 TRP A 72 -10.890 -0.679 6.242 1.00 0.00 H new ATOM 1229 N LEU A 73 -10.145 -5.282 10.356 1.00 0.00 N ATOM 1230 CA LEU A 73 -10.767 -5.926 9.175 1.00 0.00 C ATOM 1231 C LEU A 73 -11.696 -7.099 9.457 1.00 0.00 C ATOM 1232 O LEU A 73 -12.734 -7.300 8.824 1.00 0.00 O ATOM 1233 CB LEU A 73 -9.642 -6.232 8.171 1.00 0.00 C ATOM 1234 CG LEU A 73 -9.820 -7.232 6.992 1.00 0.00 C ATOM 1235 CD1 LEU A 73 -10.080 -6.485 5.685 1.00 0.00 C ATOM 1236 CD2 LEU A 73 -8.532 -8.060 6.835 1.00 0.00 C ATOM 0 H LEU A 73 -9.133 -5.411 10.356 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.478 -5.223 8.742 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -9.351 -5.279 7.730 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -8.792 -6.586 8.754 1.00 0.00 H new ATOM 0 HG LEU A 73 -10.670 -7.878 7.210 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -10.201 -7.203 4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -10.987 -5.889 5.781 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -9.237 -5.830 5.467 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -8.650 -8.763 6.010 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.694 -7.394 6.627 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.339 -8.610 7.756 1.00 0.00 H new ATOM 1248 N GLY A 74 -11.322 -7.881 10.509 1.00 0.00 N ATOM 1249 CA GLY A 74 -12.077 -8.947 11.175 1.00 0.00 C ATOM 1250 C GLY A 74 -13.357 -8.485 11.835 1.00 0.00 C ATOM 1251 O GLY A 74 -14.316 -9.216 12.059 1.00 0.00 O ATOM 0 H GLY A 74 -10.405 -7.760 10.938 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.317 -9.718 10.443 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -11.440 -9.411 11.929 1.00 0.00 H new ATOM 1255 N ARG A 75 -13.352 -7.190 12.221 1.00 0.00 N ATOM 1256 CA ARG A 75 -14.419 -6.494 12.941 1.00 0.00 C ATOM 1257 C ARG A 75 -15.553 -5.962 12.094 1.00 0.00 C ATOM 1258 O ARG A 75 -16.629 -5.649 12.597 1.00 0.00 O ATOM 1259 CB ARG A 75 -13.780 -5.315 13.679 1.00 0.00 C ATOM 1260 CG ARG A 75 -13.997 -5.275 15.195 1.00 0.00 C ATOM 1261 CD ARG A 75 -13.311 -4.043 15.805 1.00 0.00 C ATOM 1262 NE ARG A 75 -13.516 -4.029 17.298 1.00 0.00 N ATOM 1263 CZ ARG A 75 -12.680 -4.650 18.190 1.00 0.00 C ATOM 1264 NH1 ARG A 75 -11.577 -5.333 17.768 1.00 0.00 N ATOM 1265 NH2 ARG A 75 -12.959 -4.582 19.525 1.00 0.00 N ATOM 0 H ARG A 75 -12.559 -6.579 12.024 1.00 0.00 H new ATOM 0 HA ARG A 75 -14.875 -7.237 13.596 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -12.707 -5.329 13.486 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -14.169 -4.391 13.252 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -15.064 -5.250 15.415 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -13.599 -6.182 15.649 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -12.246 -4.058 15.576 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -13.719 -3.133 15.365 1.00 0.00 H new ATOM 0 HE ARG A 75 -14.324 -3.528 17.667 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -11.361 -5.389 16.773 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -10.968 -5.788 18.448 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -13.782 -4.073 19.849 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -12.345 -5.040 20.198 1.00 0.00 H new ATOM 1279 N GLU A 76 -15.309 -5.800 10.773 1.00 0.00 N ATOM 1280 CA GLU A 76 -16.225 -5.192 9.826 1.00 0.00 C ATOM 1281 C GLU A 76 -17.199 -6.174 9.221 1.00 0.00 C ATOM 1282 O GLU A 76 -18.204 -5.773 8.639 1.00 0.00 O ATOM 1283 CB GLU A 76 -15.407 -4.492 8.714 1.00 0.00 C ATOM 1284 CG GLU A 76 -14.634 -3.284 9.268 1.00 0.00 C ATOM 1285 CD GLU A 76 -13.809 -2.646 8.157 1.00 0.00 C ATOM 1286 OE1 GLU A 76 -12.852 -3.311 7.681 1.00 0.00 O ATOM 1287 OE2 GLU A 76 -14.123 -1.489 7.768 1.00 0.00 O ATOM 0 H GLU A 76 -14.437 -6.104 10.340 1.00 0.00 H new ATOM 0 HA GLU A 76 -16.829 -4.468 10.373 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -14.708 -5.202 8.271 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -16.076 -4.165 7.918 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -15.330 -2.554 9.682 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -13.982 -3.600 10.082 1.00 0.00 H new ATOM 1294 N GLY A 77 -16.897 -7.504 9.317 1.00 0.00 N ATOM 1295 CA GLY A 77 -17.768 -8.514 8.710 1.00 0.00 C ATOM 1296 C GLY A 77 -17.305 -8.853 7.324 1.00 0.00 C ATOM 1297 O GLY A 77 -18.060 -9.315 6.477 1.00 0.00 O ATOM 0 H GLY A 77 -16.078 -7.877 9.798 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -17.774 -9.413 9.326 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -18.793 -8.144 8.676 1.00 0.00 H new ATOM 1301 N LEU A 78 -15.986 -8.646 7.090 1.00 0.00 N ATOM 1302 CA LEU A 78 -15.313 -8.981 5.841 1.00 0.00 C ATOM 1303 C LEU A 78 -14.419 -10.143 6.053 1.00 0.00 C ATOM 1304 O LEU A 78 -14.300 -10.972 5.177 1.00 0.00 O ATOM 1305 CB LEU A 78 -14.464 -7.870 5.199 1.00 0.00 C ATOM 1306 CG LEU A 78 -15.058 -6.484 5.452 1.00 0.00 C ATOM 1307 CD1 LEU A 78 -13.918 -5.487 5.546 1.00 0.00 C ATOM 1308 CD2 LEU A 78 -16.117 -6.161 4.394 1.00 0.00 C ATOM 0 H LEU A 78 -15.362 -8.234 7.784 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.134 -9.179 5.152 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.451 -7.910 5.599 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.390 -8.043 4.125 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.593 -6.438 6.400 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.320 -4.490 5.727 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -13.257 -5.766 6.367 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.356 -5.488 4.612 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.532 -5.172 4.585 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.660 -6.178 3.405 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.914 -6.904 4.438 1.00 0.00 H new ATOM 1320 N CYS A 79 -13.769 -10.269 7.224 1.00 0.00 N ATOM 1321 CA CYS A 79 -12.866 -11.372 7.533 1.00 0.00 C ATOM 1322 C CYS A 79 -13.082 -12.073 8.878 1.00 0.00 C ATOM 1323 O CYS A 79 -13.544 -11.500 9.856 1.00 0.00 O ATOM 1324 CB CYS A 79 -11.392 -10.931 7.386 1.00 0.00 C ATOM 1325 SG CYS A 79 -11.054 -10.125 5.773 1.00 0.00 S ATOM 0 H CYS A 79 -13.863 -9.596 7.985 1.00 0.00 H new ATOM 0 HA CYS A 79 -13.117 -12.130 6.792 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -11.141 -10.242 8.192 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -10.744 -11.800 7.496 1.00 0.00 H new ATOM 0 HG CYS A 79 -11.620 -8.955 5.746 1.00 0.00 H new ATOM 1331 N LYS A 80 -12.694 -13.366 8.961 1.00 0.00 N ATOM 1332 CA LYS A 80 -12.633 -14.226 10.131 1.00 0.00 C ATOM 1333 C LYS A 80 -11.150 -14.470 10.390 1.00 0.00 C ATOM 1334 O LYS A 80 -10.363 -14.499 9.455 1.00 0.00 O ATOM 1335 CB LYS A 80 -13.408 -15.570 9.923 1.00 0.00 C ATOM 1336 CG LYS A 80 -14.429 -15.867 11.026 1.00 0.00 C ATOM 1337 CD LYS A 80 -15.608 -14.880 11.035 1.00 0.00 C ATOM 1338 CE LYS A 80 -16.560 -15.053 12.227 1.00 0.00 C ATOM 1339 NZ LYS A 80 -17.182 -16.398 12.234 1.00 0.00 N ATOM 0 H LYS A 80 -12.391 -13.865 8.125 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.117 -13.752 10.985 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -13.922 -15.538 8.963 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -12.691 -16.389 9.873 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.811 -16.880 10.897 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -13.929 -15.836 11.994 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.216 -13.863 11.041 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.174 -14.998 10.111 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.012 -14.899 13.157 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.338 -14.291 12.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -17.819 -16.482 13.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -17.724 -16.534 11.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.440 -17.123 12.298 1.00 0.00 H new ATOM 1353 N VAL A 81 -10.668 -14.571 11.648 1.00 0.00 N ATOM 1354 CA VAL A 81 -9.246 -14.663 11.936 1.00 0.00 C ATOM 1355 C VAL A 81 -8.926 -15.728 12.970 1.00 0.00 C ATOM 1356 O VAL A 81 -9.655 -15.937 13.939 1.00 0.00 O ATOM 1357 CB VAL A 81 -8.699 -13.321 12.432 1.00 0.00 C ATOM 1358 CG1 VAL A 81 -9.761 -12.448 13.126 1.00 0.00 C ATOM 1359 CG2 VAL A 81 -8.057 -12.535 11.289 1.00 0.00 C ATOM 0 H VAL A 81 -11.261 -14.590 12.478 1.00 0.00 H new ATOM 0 HA VAL A 81 -8.768 -14.940 10.996 1.00 0.00 H new ATOM 0 HB VAL A 81 -7.945 -13.568 13.179 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.306 -11.513 13.453 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -10.569 -12.234 12.427 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -10.160 -12.979 13.990 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.677 -11.586 11.668 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -7.235 -13.113 10.867 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -8.801 -12.344 10.516 1.00 0.00 H new ATOM 1369 N ASP A 82 -7.735 -16.369 12.779 1.00 0.00 N ATOM 1370 CA ASP A 82 -7.140 -17.348 13.700 1.00 0.00 C ATOM 1371 C ASP A 82 -5.614 -17.220 13.703 1.00 0.00 C ATOM 1372 O ASP A 82 -5.010 -16.806 12.713 1.00 0.00 O ATOM 1373 CB ASP A 82 -7.488 -18.829 13.341 1.00 0.00 C ATOM 1374 CG ASP A 82 -8.986 -19.102 13.501 1.00 0.00 C ATOM 1375 OD1 ASP A 82 -9.479 -19.032 14.659 1.00 0.00 O ATOM 1376 OD2 ASP A 82 -9.654 -19.385 12.471 1.00 0.00 O ATOM 0 H ASP A 82 -7.158 -16.205 11.954 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.563 -17.121 14.679 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.186 -19.038 12.315 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -6.922 -19.504 13.983 1.00 0.00 H new ATOM 1381 N GLU A 83 -4.921 -17.596 14.820 1.00 0.00 N ATOM 1382 CA GLU A 83 -3.465 -17.560 14.921 1.00 0.00 C ATOM 1383 C GLU A 83 -2.936 -18.949 15.259 1.00 0.00 C ATOM 1384 O GLU A 83 -3.501 -19.692 16.066 1.00 0.00 O ATOM 1385 CB GLU A 83 -2.950 -16.499 15.926 1.00 0.00 C ATOM 1386 CG GLU A 83 -1.415 -16.310 15.887 1.00 0.00 C ATOM 1387 CD GLU A 83 -0.961 -15.132 16.748 1.00 0.00 C ATOM 1388 OE1 GLU A 83 0.261 -14.824 16.707 1.00 0.00 O ATOM 1389 OE2 GLU A 83 -1.809 -14.529 17.458 1.00 0.00 O ATOM 0 H GLU A 83 -5.378 -17.931 15.668 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.079 -17.255 13.948 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -3.432 -15.544 15.714 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -3.247 -16.789 16.934 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.929 -17.222 16.234 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -1.095 -16.151 14.857 1.00 0.00 H new ATOM 1396 N THR A 84 -1.810 -19.294 14.579 1.00 0.00 N ATOM 1397 CA THR A 84 -1.086 -20.554 14.616 1.00 0.00 C ATOM 1398 C THR A 84 0.348 -20.311 14.967 1.00 0.00 C ATOM 1399 O THR A 84 0.792 -19.165 15.037 1.00 0.00 O ATOM 1400 CB THR A 84 -1.078 -21.260 13.223 1.00 0.00 C ATOM 1401 OG1 THR A 84 -0.303 -20.657 12.196 1.00 0.00 O ATOM 1402 CG2 THR A 84 -2.479 -21.300 12.609 1.00 0.00 C ATOM 0 H THR A 84 -1.365 -18.631 13.945 1.00 0.00 H new ATOM 0 HA THR A 84 -1.589 -21.178 15.354 1.00 0.00 H new ATOM 0 HB THR A 84 -0.651 -22.227 13.487 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.898 -20.234 11.543 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.438 -21.798 11.640 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.150 -21.848 13.270 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.848 -20.283 12.479 1.00 0.00 H new ATOM 1410 N PRO A 85 1.143 -21.392 15.133 1.00 0.00 N ATOM 1411 CA PRO A 85 2.579 -21.287 15.176 1.00 0.00 C ATOM 1412 C PRO A 85 3.315 -20.886 13.879 1.00 0.00 C ATOM 1413 O PRO A 85 4.533 -20.720 13.933 1.00 0.00 O ATOM 1414 CB PRO A 85 3.023 -22.665 15.677 1.00 0.00 C ATOM 1415 CG PRO A 85 1.799 -23.306 16.322 1.00 0.00 C ATOM 1416 CD PRO A 85 0.699 -22.762 15.434 1.00 0.00 C ATOM 0 HA PRO A 85 2.851 -20.447 15.816 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.393 -23.276 14.854 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.837 -22.573 16.396 1.00 0.00 H new ATOM 0 HG2 PRO A 85 1.844 -24.395 16.305 1.00 0.00 H new ATOM 0 HG3 PRO A 85 1.676 -23.008 17.363 1.00 0.00 H new ATOM 0 HD2 PRO A 85 0.586 -23.355 14.527 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -0.266 -22.768 15.941 1.00 0.00 H new ATOM 1424 N LYS A 86 2.605 -20.732 12.729 1.00 0.00 N ATOM 1425 CA LYS A 86 3.144 -20.371 11.439 1.00 0.00 C ATOM 1426 C LYS A 86 2.585 -19.041 10.928 1.00 0.00 C ATOM 1427 O LYS A 86 2.626 -18.771 9.725 1.00 0.00 O ATOM 1428 CB LYS A 86 2.838 -21.483 10.410 1.00 0.00 C ATOM 1429 CG LYS A 86 3.668 -22.755 10.647 1.00 0.00 C ATOM 1430 CD LYS A 86 5.184 -22.581 10.446 1.00 0.00 C ATOM 1431 CE LYS A 86 5.945 -23.914 10.516 1.00 0.00 C ATOM 1432 NZ LYS A 86 7.398 -23.705 10.319 1.00 0.00 N ATOM 0 H LYS A 86 1.595 -20.868 12.702 1.00 0.00 H new ATOM 0 HA LYS A 86 4.221 -20.255 11.561 1.00 0.00 H new ATOM 0 HB2 LYS A 86 1.778 -21.732 10.455 1.00 0.00 H new ATOM 0 HB3 LYS A 86 3.035 -21.107 9.406 1.00 0.00 H new ATOM 0 HG2 LYS A 86 3.488 -23.106 11.663 1.00 0.00 H new ATOM 0 HG3 LYS A 86 3.313 -23.535 9.973 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.367 -22.112 9.479 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.573 -21.904 11.207 1.00 0.00 H new ATOM 0 HE2 LYS A 86 5.769 -24.387 11.482 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.565 -24.595 9.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 7.890 -24.620 10.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.564 -23.275 9.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 7.762 -23.074 11.061 1.00 0.00 H new ATOM 1446 N GLY A 87 2.003 -18.175 11.808 1.00 0.00 N ATOM 1447 CA GLY A 87 1.495 -16.862 11.402 1.00 0.00 C ATOM 1448 C GLY A 87 0.085 -16.518 11.788 1.00 0.00 C ATOM 1449 O GLY A 87 -0.545 -17.129 12.650 1.00 0.00 O ATOM 0 H GLY A 87 1.882 -18.378 12.800 1.00 0.00 H new ATOM 0 HA2 GLY A 87 2.154 -16.101 11.821 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.574 -16.791 10.317 1.00 0.00 H new ATOM 1453 N TRP A 88 -0.449 -15.500 11.053 1.00 0.00 N ATOM 1454 CA TRP A 88 -1.804 -14.955 11.127 1.00 0.00 C ATOM 1455 C TRP A 88 -2.529 -15.370 9.837 1.00 0.00 C ATOM 1456 O TRP A 88 -2.176 -15.007 8.711 1.00 0.00 O ATOM 1457 CB TRP A 88 -1.830 -13.399 11.352 1.00 0.00 C ATOM 1458 CG TRP A 88 -1.921 -12.959 12.822 1.00 0.00 C ATOM 1459 CD1 TRP A 88 -0.943 -12.784 13.761 1.00 0.00 C ATOM 1460 CD2 TRP A 88 -3.164 -12.692 13.499 1.00 0.00 C ATOM 1461 NE1 TRP A 88 -1.505 -12.433 14.980 1.00 0.00 N ATOM 1462 CE2 TRP A 88 -2.876 -12.443 14.839 1.00 0.00 C ATOM 1463 CE3 TRP A 88 -4.445 -12.645 13.045 1.00 0.00 C ATOM 1464 CZ2 TRP A 88 -3.881 -12.234 15.745 1.00 0.00 C ATOM 1465 CZ3 TRP A 88 -5.437 -12.389 13.961 1.00 0.00 C ATOM 1466 CH2 TRP A 88 -5.173 -12.205 15.292 1.00 0.00 C ATOM 0 H TRP A 88 0.109 -15.017 10.349 1.00 0.00 H new ATOM 0 HA TRP A 88 -2.316 -15.360 12.000 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -0.930 -12.968 10.914 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -2.679 -12.982 10.810 1.00 0.00 H new ATOM 0 HD1 TRP A 88 0.115 -12.902 13.580 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -0.993 -12.207 15.832 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -4.675 -12.803 12.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -3.660 -12.095 16.793 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -6.460 -12.331 13.619 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -5.984 -12.037 15.985 1.00 0.00 H new ATOM 1477 N TYR A 89 -3.590 -16.199 10.014 1.00 0.00 N ATOM 1478 CA TYR A 89 -4.398 -16.807 8.978 1.00 0.00 C ATOM 1479 C TYR A 89 -5.771 -16.227 9.124 1.00 0.00 C ATOM 1480 O TYR A 89 -6.356 -16.220 10.205 1.00 0.00 O ATOM 1481 CB TYR A 89 -4.493 -18.360 9.106 1.00 0.00 C ATOM 1482 CG TYR A 89 -3.129 -18.916 8.836 1.00 0.00 C ATOM 1483 CD1 TYR A 89 -2.168 -18.889 9.824 1.00 0.00 C ATOM 1484 CD2 TYR A 89 -2.771 -19.322 7.566 1.00 0.00 C ATOM 1485 CE1 TYR A 89 -0.849 -19.118 9.517 1.00 0.00 C ATOM 1486 CE2 TYR A 89 -1.452 -19.610 7.269 1.00 0.00 C ATOM 1487 CZ TYR A 89 -0.478 -19.455 8.234 1.00 0.00 C ATOM 1488 OH TYR A 89 0.882 -19.588 7.873 1.00 0.00 O ATOM 0 H TYR A 89 -3.905 -16.463 10.947 1.00 0.00 H new ATOM 0 HA TYR A 89 -3.944 -16.604 8.008 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -4.832 -18.643 10.102 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -5.218 -18.760 8.397 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -2.454 -18.687 10.846 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -3.526 -19.415 6.800 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -0.097 -19.033 10.287 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -1.184 -19.956 6.282 1.00 0.00 H new ATOM 0 HH TYR A 89 1.438 -19.084 8.503 1.00 0.00 H new ATOM 1498 N ILE A 90 -6.313 -15.711 8.019 1.00 0.00 N ATOM 1499 CA ILE A 90 -7.622 -15.126 7.896 1.00 0.00 C ATOM 1500 C ILE A 90 -8.428 -16.011 6.964 1.00 0.00 C ATOM 1501 O ILE A 90 -7.943 -16.476 5.934 1.00 0.00 O ATOM 1502 CB ILE A 90 -7.627 -13.653 7.433 1.00 0.00 C ATOM 1503 CG1 ILE A 90 -7.508 -13.370 5.905 1.00 0.00 C ATOM 1504 CG2 ILE A 90 -6.477 -12.898 8.130 1.00 0.00 C ATOM 1505 CD1 ILE A 90 -7.976 -11.961 5.515 1.00 0.00 C ATOM 0 H ILE A 90 -5.804 -15.697 7.135 1.00 0.00 H new ATOM 0 HA ILE A 90 -8.071 -15.083 8.888 1.00 0.00 H new ATOM 0 HB ILE A 90 -8.624 -13.311 7.709 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.470 -13.500 5.597 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -8.097 -14.106 5.358 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -6.476 -11.857 7.806 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.615 -12.942 9.210 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.526 -13.361 7.867 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -7.868 -11.827 4.439 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -9.022 -11.835 5.793 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -7.370 -11.219 6.036 1.00 0.00 H new ATOM 1517 N GLN A 91 -9.713 -16.214 7.277 1.00 0.00 N ATOM 1518 CA GLN A 91 -10.720 -16.846 6.470 1.00 0.00 C ATOM 1519 C GLN A 91 -11.660 -15.704 6.241 1.00 0.00 C ATOM 1520 O GLN A 91 -12.200 -15.158 7.178 1.00 0.00 O ATOM 1521 CB GLN A 91 -11.318 -18.102 7.143 1.00 0.00 C ATOM 1522 CG GLN A 91 -12.854 -18.190 7.111 1.00 0.00 C ATOM 1523 CD GLN A 91 -13.353 -19.489 7.722 1.00 0.00 C ATOM 1524 OE1 GLN A 91 -13.981 -19.527 8.779 1.00 0.00 O ATOM 1525 NE2 GLN A 91 -13.038 -20.607 7.023 1.00 0.00 N ATOM 0 H GLN A 91 -10.088 -15.910 8.176 1.00 0.00 H new ATOM 0 HA GLN A 91 -10.371 -17.279 5.533 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -10.909 -18.987 6.655 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -10.989 -18.130 8.182 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.279 -17.345 7.654 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.202 -18.115 6.081 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -12.516 -20.532 6.150 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -13.323 -21.523 7.370 1.00 0.00 H new ATOM 1534 N TYR A 92 -11.875 -15.261 5.009 1.00 0.00 N ATOM 1535 CA TYR A 92 -12.750 -14.163 4.640 1.00 0.00 C ATOM 1536 C TYR A 92 -14.249 -14.572 4.660 1.00 0.00 C ATOM 1537 O TYR A 92 -14.587 -15.741 4.539 1.00 0.00 O ATOM 1538 CB TYR A 92 -12.027 -13.255 3.592 1.00 0.00 C ATOM 1539 CG TYR A 92 -12.889 -12.579 2.584 1.00 0.00 C ATOM 1540 CD1 TYR A 92 -13.557 -13.359 1.689 1.00 0.00 C ATOM 1541 CD2 TYR A 92 -13.179 -11.239 2.670 1.00 0.00 C ATOM 1542 CE1 TYR A 92 -14.652 -12.883 1.007 1.00 0.00 C ATOM 1543 CE2 TYR A 92 -14.306 -10.746 2.066 1.00 0.00 C ATOM 1544 CZ TYR A 92 -15.029 -11.581 1.236 1.00 0.00 C ATOM 1545 OH TYR A 92 -16.331 -11.282 0.868 1.00 0.00 O ATOM 0 H TYR A 92 -11.418 -15.682 4.200 1.00 0.00 H new ATOM 0 HA TYR A 92 -12.931 -13.371 5.367 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -11.471 -12.489 4.132 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -11.296 -13.865 3.061 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.220 -14.370 1.512 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -12.521 -10.576 3.212 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.196 -13.510 0.316 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -14.622 -9.727 2.235 1.00 0.00 H new ATOM 0 HH TYR A 92 -16.953 -11.683 1.510 1.00 0.00 H new ATOM 1555 N ILE A 93 -15.176 -13.635 4.956 1.00 0.00 N ATOM 1556 CA ILE A 93 -16.625 -13.729 5.123 1.00 0.00 C ATOM 1557 C ILE A 93 -17.245 -13.595 3.733 1.00 0.00 C ATOM 1558 O ILE A 93 -17.002 -12.599 3.063 1.00 0.00 O ATOM 1559 CB ILE A 93 -17.057 -12.479 5.921 1.00 0.00 C ATOM 1560 CG1 ILE A 93 -16.406 -12.380 7.326 1.00 0.00 C ATOM 1561 CG2 ILE A 93 -18.588 -12.259 5.928 1.00 0.00 C ATOM 1562 CD1 ILE A 93 -17.157 -12.915 8.522 1.00 0.00 C ATOM 0 H ILE A 93 -14.874 -12.671 5.100 1.00 0.00 H new ATOM 0 HA ILE A 93 -16.920 -14.657 5.613 1.00 0.00 H new ATOM 0 HB ILE A 93 -16.649 -11.632 5.369 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -15.448 -12.897 7.281 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -16.192 -11.328 7.516 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -18.825 -11.365 6.505 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -18.942 -12.134 4.905 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -19.078 -13.122 6.379 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -16.561 -12.767 9.422 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -18.105 -12.386 8.623 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -17.349 -13.979 8.385 1.00 0.00 H new ATOM 1574 N ASP A 94 -18.068 -14.538 3.194 1.00 0.00 N ATOM 1575 CA ASP A 94 -18.520 -14.466 1.786 1.00 0.00 C ATOM 1576 C ASP A 94 -19.581 -13.446 1.388 1.00 0.00 C ATOM 1577 O ASP A 94 -20.369 -13.696 0.477 1.00 0.00 O ATOM 1578 CB ASP A 94 -18.801 -15.847 1.100 1.00 0.00 C ATOM 1579 CG ASP A 94 -20.114 -16.577 1.437 1.00 0.00 C ATOM 1580 OD1 ASP A 94 -20.768 -16.230 2.455 1.00 0.00 O ATOM 1581 OD2 ASP A 94 -20.457 -17.519 0.673 1.00 0.00 O ATOM 0 H ASP A 94 -18.424 -15.343 3.709 1.00 0.00 H new ATOM 0 HA ASP A 94 -17.601 -14.045 1.379 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -18.774 -15.694 0.021 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -17.976 -16.515 1.348 1.00 0.00 H new ATOM 1586 N ARG A 95 -19.572 -12.248 2.033 1.00 0.00 N ATOM 1587 CA ARG A 95 -20.352 -11.020 1.898 1.00 0.00 C ATOM 1588 C ARG A 95 -21.732 -11.177 1.247 1.00 0.00 C ATOM 1589 O ARG A 95 -22.668 -11.708 1.840 1.00 0.00 O ATOM 1590 CB ARG A 95 -19.400 -10.014 1.235 1.00 0.00 C ATOM 1591 CG ARG A 95 -18.356 -9.508 2.258 1.00 0.00 C ATOM 1592 CD ARG A 95 -18.868 -8.271 2.990 1.00 0.00 C ATOM 1593 NE ARG A 95 -18.732 -7.085 2.072 1.00 0.00 N ATOM 1594 CZ ARG A 95 -19.147 -5.824 2.405 1.00 0.00 C ATOM 1595 NH1 ARG A 95 -19.704 -5.569 3.624 1.00 0.00 N ATOM 1596 NH2 ARG A 95 -18.992 -4.808 1.505 1.00 0.00 N ATOM 0 H ARG A 95 -18.894 -12.121 2.784 1.00 0.00 H new ATOM 0 HA ARG A 95 -20.676 -10.653 2.872 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -18.894 -10.483 0.391 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -19.968 -9.172 0.838 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -18.134 -10.296 2.978 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -17.423 -9.273 1.746 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -19.909 -8.407 3.282 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -18.299 -8.109 3.905 1.00 0.00 H new ATOM 0 HE ARG A 95 -18.309 -7.229 1.155 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -19.816 -6.323 4.301 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -20.009 -4.624 3.858 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -18.570 -4.993 0.595 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -19.298 -3.865 1.743 1.00 0.00 H new ATOM 1610 N ASP A 96 -21.830 -10.817 -0.047 1.00 0.00 N ATOM 1611 CA ASP A 96 -22.890 -11.291 -0.937 1.00 0.00 C ATOM 1612 C ASP A 96 -22.263 -12.357 -1.806 1.00 0.00 C ATOM 1613 O ASP A 96 -21.449 -11.968 -2.642 1.00 0.00 O ATOM 1614 CB ASP A 96 -23.616 -10.174 -1.725 1.00 0.00 C ATOM 1615 CG ASP A 96 -24.695 -10.653 -2.714 1.00 0.00 C ATOM 1616 OD1 ASP A 96 -25.660 -11.321 -2.259 1.00 0.00 O ATOM 1617 OD2 ASP A 96 -24.557 -10.352 -3.929 1.00 0.00 O ATOM 0 H ASP A 96 -21.169 -10.186 -0.500 1.00 0.00 H new ATOM 0 HA ASP A 96 -23.711 -11.708 -0.354 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -24.079 -9.492 -1.011 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -22.871 -9.600 -2.277 1.00 0.00 H new ATOM 1622 N PRO A 97 -22.613 -13.669 -1.753 1.00 0.00 N ATOM 1623 CA PRO A 97 -21.930 -14.754 -2.462 1.00 0.00 C ATOM 1624 C PRO A 97 -22.006 -14.673 -3.965 1.00 0.00 C ATOM 1625 O PRO A 97 -21.040 -15.018 -4.630 1.00 0.00 O ATOM 1626 CB PRO A 97 -22.504 -16.056 -1.933 1.00 0.00 C ATOM 1627 CG PRO A 97 -23.298 -15.667 -0.682 1.00 0.00 C ATOM 1628 CD PRO A 97 -23.616 -14.179 -0.833 1.00 0.00 C ATOM 0 HA PRO A 97 -20.861 -14.678 -2.265 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -23.146 -16.533 -2.674 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -21.713 -16.766 -1.692 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -24.212 -16.255 -0.601 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -22.718 -15.853 0.222 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -24.622 -14.029 -1.224 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -23.567 -13.666 0.127 1.00 0.00 H new ATOM 1636 N GLU A 98 -23.094 -14.088 -4.527 1.00 0.00 N ATOM 1637 CA GLU A 98 -23.257 -13.750 -5.936 1.00 0.00 C ATOM 1638 C GLU A 98 -22.236 -12.696 -6.375 1.00 0.00 C ATOM 1639 O GLU A 98 -21.823 -12.655 -7.518 1.00 0.00 O ATOM 1640 CB GLU A 98 -24.692 -13.276 -6.264 1.00 0.00 C ATOM 1641 CG GLU A 98 -25.783 -14.364 -6.136 1.00 0.00 C ATOM 1642 CD GLU A 98 -26.081 -14.723 -4.679 1.00 0.00 C ATOM 1643 OE1 GLU A 98 -25.879 -15.909 -4.306 1.00 0.00 O ATOM 1644 OE2 GLU A 98 -26.516 -13.814 -3.922 1.00 0.00 O ATOM 0 H GLU A 98 -23.911 -13.833 -3.972 1.00 0.00 H new ATOM 0 HA GLU A 98 -23.077 -14.667 -6.498 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -24.946 -12.448 -5.602 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -24.706 -12.886 -7.282 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -26.698 -14.016 -6.616 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -25.464 -15.259 -6.670 1.00 0.00 H new ATOM 1651 N THR A 99 -21.693 -11.878 -5.425 1.00 0.00 N ATOM 1652 CA THR A 99 -20.555 -10.990 -5.671 1.00 0.00 C ATOM 1653 C THR A 99 -19.238 -11.774 -5.702 1.00 0.00 C ATOM 1654 O THR A 99 -18.390 -11.519 -6.541 1.00 0.00 O ATOM 1655 CB THR A 99 -20.536 -9.766 -4.726 1.00 0.00 C ATOM 1656 OG1 THR A 99 -20.404 -8.570 -5.479 1.00 0.00 O ATOM 1657 CG2 THR A 99 -19.428 -9.733 -3.651 1.00 0.00 C ATOM 0 H THR A 99 -22.046 -11.829 -4.469 1.00 0.00 H new ATOM 0 HA THR A 99 -20.679 -10.562 -6.666 1.00 0.00 H new ATOM 0 HB THR A 99 -21.485 -9.852 -4.197 1.00 0.00 H new ATOM 0 HG1 THR A 99 -20.395 -7.801 -4.872 1.00 0.00 H new ATOM 0 HG21 THR A 99 -19.525 -8.825 -3.056 1.00 0.00 H new ATOM 0 HG22 THR A 99 -19.524 -10.604 -3.003 1.00 0.00 H new ATOM 0 HG23 THR A 99 -18.451 -9.747 -4.135 1.00 0.00 H new ATOM 1665 N ILE A 100 -19.054 -12.780 -4.795 1.00 0.00 N ATOM 1666 CA ILE A 100 -17.912 -13.700 -4.568 1.00 0.00 C ATOM 1667 C ILE A 100 -17.739 -14.631 -5.747 1.00 0.00 C ATOM 1668 O ILE A 100 -16.657 -14.690 -6.312 1.00 0.00 O ATOM 1669 CB ILE A 100 -18.116 -14.478 -3.264 1.00 0.00 C ATOM 1670 CG1 ILE A 100 -18.454 -13.506 -2.116 1.00 0.00 C ATOM 1671 CG2 ILE A 100 -16.844 -15.286 -2.905 1.00 0.00 C ATOM 1672 CD1 ILE A 100 -17.397 -12.457 -1.817 1.00 0.00 C ATOM 0 H ILE A 100 -19.798 -12.984 -4.128 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.997 -13.115 -4.473 1.00 0.00 H new ATOM 0 HB ILE A 100 -18.944 -15.173 -3.405 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -19.388 -12.998 -2.356 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -18.631 -14.087 -1.211 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -17.010 -15.831 -1.976 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -16.623 -15.992 -3.706 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -16.003 -14.604 -2.781 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -17.733 -11.826 -0.994 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -16.465 -12.949 -1.539 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -17.234 -11.843 -2.702 1.00 0.00 H new ATOM 1684 N ARG A 101 -18.832 -15.294 -6.209 1.00 0.00 N ATOM 1685 CA ARG A 101 -18.911 -16.196 -7.353 1.00 0.00 C ATOM 1686 C ARG A 101 -18.826 -15.467 -8.722 1.00 0.00 C ATOM 1687 O ARG A 101 -18.275 -15.987 -9.692 1.00 0.00 O ATOM 1688 CB ARG A 101 -20.148 -17.114 -7.219 1.00 0.00 C ATOM 1689 CG ARG A 101 -20.226 -17.860 -5.858 1.00 0.00 C ATOM 1690 CD ARG A 101 -19.003 -18.731 -5.508 1.00 0.00 C ATOM 1691 NE ARG A 101 -19.314 -19.599 -4.312 1.00 0.00 N ATOM 1692 CZ ARG A 101 -19.305 -19.167 -3.011 1.00 0.00 C ATOM 1693 NH1 ARG A 101 -18.993 -17.879 -2.690 1.00 0.00 N ATOM 1694 NH2 ARG A 101 -19.618 -20.047 -2.014 1.00 0.00 N ATOM 0 H ARG A 101 -19.737 -15.194 -5.748 1.00 0.00 H new ATOM 0 HA ARG A 101 -18.024 -16.830 -7.339 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -21.050 -16.515 -7.348 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -20.135 -17.847 -8.025 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -20.364 -17.123 -5.067 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -21.113 -18.494 -5.861 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -18.734 -19.355 -6.361 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -18.143 -18.096 -5.294 1.00 0.00 H new ATOM 0 HE ARG A 101 -19.547 -20.577 -4.485 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -18.759 -17.212 -3.426 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -18.993 -17.582 -1.714 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -19.855 -21.013 -2.242 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -19.615 -19.738 -1.042 1.00 0.00 H new ATOM 1708 N ARG A 102 -19.303 -14.178 -8.809 1.00 0.00 N ATOM 1709 CA ARG A 102 -19.198 -13.299 -9.996 1.00 0.00 C ATOM 1710 C ARG A 102 -17.802 -12.689 -10.113 1.00 0.00 C ATOM 1711 O ARG A 102 -17.307 -12.470 -11.215 1.00 0.00 O ATOM 1712 CB ARG A 102 -20.258 -12.164 -10.056 1.00 0.00 C ATOM 1713 CG ARG A 102 -21.678 -12.564 -10.542 1.00 0.00 C ATOM 1714 CD ARG A 102 -22.095 -14.035 -10.352 1.00 0.00 C ATOM 1715 NE ARG A 102 -23.560 -14.172 -10.671 1.00 0.00 N ATOM 1716 CZ ARG A 102 -24.350 -15.173 -10.168 1.00 0.00 C ATOM 1717 NH1 ARG A 102 -23.833 -16.129 -9.342 1.00 0.00 N ATOM 1718 NH2 ARG A 102 -25.674 -15.210 -10.496 1.00 0.00 N ATOM 0 H ARG A 102 -19.780 -13.726 -8.029 1.00 0.00 H new ATOM 0 HA ARG A 102 -19.396 -13.959 -10.841 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -20.348 -11.729 -9.061 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -19.881 -11.380 -10.713 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -22.403 -11.937 -10.023 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -21.752 -12.325 -11.603 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -21.506 -14.681 -11.003 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -21.901 -14.352 -9.327 1.00 0.00 H new ATOM 0 HE ARG A 102 -23.986 -13.485 -11.293 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -22.845 -16.105 -9.090 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -24.435 -16.867 -8.976 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -26.067 -14.497 -11.110 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -26.270 -15.951 -10.127 1.00 0.00 H new ATOM 1732 N GLN A 103 -17.110 -12.489 -8.960 1.00 0.00 N ATOM 1733 CA GLN A 103 -15.694 -12.120 -8.827 1.00 0.00 C ATOM 1734 C GLN A 103 -14.762 -13.189 -9.395 1.00 0.00 C ATOM 1735 O GLN A 103 -14.032 -12.973 -10.358 1.00 0.00 O ATOM 1736 CB GLN A 103 -15.472 -11.710 -7.362 1.00 0.00 C ATOM 1737 CG GLN A 103 -15.747 -10.197 -7.257 1.00 0.00 C ATOM 1738 CD GLN A 103 -15.712 -9.678 -5.829 1.00 0.00 C ATOM 1739 OE1 GLN A 103 -15.039 -8.704 -5.486 1.00 0.00 O ATOM 1740 NE2 GLN A 103 -16.475 -10.384 -4.965 1.00 0.00 N ATOM 0 H GLN A 103 -17.561 -12.589 -8.051 1.00 0.00 H new ATOM 0 HA GLN A 103 -15.431 -11.260 -9.443 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -16.138 -12.267 -6.703 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.452 -11.937 -7.051 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -15.008 -9.658 -7.850 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -16.723 -9.981 -7.691 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -17.015 -11.183 -5.297 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -16.511 -10.117 -3.981 1.00 0.00 H new ATOM 1749 N LEU A 104 -14.886 -14.385 -8.816 1.00 0.00 N ATOM 1750 CA LEU A 104 -14.328 -15.708 -9.090 1.00 0.00 C ATOM 1751 C LEU A 104 -14.418 -16.206 -10.540 1.00 0.00 C ATOM 1752 O LEU A 104 -13.415 -16.568 -11.147 1.00 0.00 O ATOM 1753 CB LEU A 104 -15.264 -16.627 -8.257 1.00 0.00 C ATOM 1754 CG LEU A 104 -14.866 -17.092 -6.846 1.00 0.00 C ATOM 1755 CD1 LEU A 104 -14.346 -18.540 -6.878 1.00 0.00 C ATOM 1756 CD2 LEU A 104 -13.951 -16.110 -6.113 1.00 0.00 C ATOM 0 H LEU A 104 -15.491 -14.452 -7.997 1.00 0.00 H new ATOM 0 HA LEU A 104 -13.262 -15.697 -8.864 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -16.220 -16.111 -8.165 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -15.442 -17.524 -8.850 1.00 0.00 H new ATOM 0 HG LEU A 104 -15.768 -17.097 -6.235 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -14.070 -18.850 -5.870 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -15.127 -19.199 -7.259 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -13.473 -18.599 -7.528 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -13.712 -16.504 -5.125 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -13.031 -15.975 -6.682 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -14.457 -15.150 -6.008 1.00 0.00 H new ATOM 1768 N GLU A 105 -15.658 -16.297 -11.102 1.00 0.00 N ATOM 1769 CA GLU A 105 -15.966 -16.713 -12.470 1.00 0.00 C ATOM 1770 C GLU A 105 -15.925 -15.663 -13.594 1.00 0.00 C ATOM 1771 O GLU A 105 -15.243 -15.824 -14.602 1.00 0.00 O ATOM 1772 CB GLU A 105 -17.334 -17.454 -12.515 1.00 0.00 C ATOM 1773 CG GLU A 105 -17.403 -18.656 -11.550 1.00 0.00 C ATOM 1774 CD GLU A 105 -18.793 -19.288 -11.616 1.00 0.00 C ATOM 1775 OE1 GLU A 105 -18.890 -20.471 -12.038 1.00 0.00 O ATOM 1776 OE2 GLU A 105 -19.776 -18.595 -11.239 1.00 0.00 O ATOM 0 H GLU A 105 -16.499 -16.067 -10.573 1.00 0.00 H new ATOM 0 HA GLU A 105 -15.120 -17.360 -12.702 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -18.130 -16.751 -12.268 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -17.519 -17.801 -13.532 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -16.645 -19.393 -11.816 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -17.188 -18.331 -10.532 1.00 0.00 H new ATOM 1783 N LEU A 106 -16.754 -14.587 -13.466 1.00 0.00 N ATOM 1784 CA LEU A 106 -17.063 -13.599 -14.508 1.00 0.00 C ATOM 1785 C LEU A 106 -16.088 -12.464 -14.698 1.00 0.00 C ATOM 1786 O LEU A 106 -15.712 -12.122 -15.816 1.00 0.00 O ATOM 1787 CB LEU A 106 -18.404 -12.910 -14.230 1.00 0.00 C ATOM 1788 CG LEU A 106 -19.617 -13.839 -13.992 1.00 0.00 C ATOM 1789 CD1 LEU A 106 -20.878 -13.056 -14.363 1.00 0.00 C ATOM 1790 CD2 LEU A 106 -19.626 -15.147 -14.803 1.00 0.00 C ATOM 0 H LEU A 106 -17.239 -14.388 -12.591 1.00 0.00 H new ATOM 0 HA LEU A 106 -17.042 -14.219 -15.404 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -18.285 -12.272 -13.354 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -18.634 -12.257 -15.072 1.00 0.00 H new ATOM 0 HG LEU A 106 -19.565 -14.137 -12.945 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -21.755 -13.684 -14.207 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -20.952 -12.167 -13.737 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -20.827 -12.759 -15.410 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -20.520 -15.721 -14.558 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -19.624 -14.915 -15.868 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -18.740 -15.733 -14.558 1.00 0.00 H new ATOM 1802 N GLU A 107 -15.635 -11.812 -13.577 1.00 0.00 N ATOM 1803 CA GLU A 107 -14.736 -10.648 -13.528 1.00 0.00 C ATOM 1804 C GLU A 107 -13.354 -10.920 -14.100 1.00 0.00 C ATOM 1805 O GLU A 107 -12.618 -10.028 -14.507 1.00 0.00 O ATOM 1806 CB GLU A 107 -14.661 -10.100 -12.079 1.00 0.00 C ATOM 1807 CG GLU A 107 -13.934 -8.756 -11.896 1.00 0.00 C ATOM 1808 CD GLU A 107 -14.110 -8.251 -10.463 1.00 0.00 C ATOM 1809 OE1 GLU A 107 -13.081 -8.100 -9.752 1.00 0.00 O ATOM 1810 OE2 GLU A 107 -15.279 -8.001 -10.065 1.00 0.00 O ATOM 0 H GLU A 107 -15.913 -12.115 -12.643 1.00 0.00 H new ATOM 0 HA GLU A 107 -15.165 -9.885 -14.177 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -15.678 -9.994 -11.700 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -14.165 -10.845 -11.457 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -12.874 -8.874 -12.120 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -14.328 -8.022 -12.599 1.00 0.00 H new ATOM 1817 N LYS A 108 -13.066 -12.236 -14.231 1.00 0.00 N ATOM 1818 CA LYS A 108 -11.902 -12.864 -14.837 1.00 0.00 C ATOM 1819 C LYS A 108 -11.853 -12.763 -16.374 1.00 0.00 C ATOM 1820 O LYS A 108 -10.796 -12.848 -16.990 1.00 0.00 O ATOM 1821 CB LYS A 108 -11.915 -14.353 -14.427 1.00 0.00 C ATOM 1822 CG LYS A 108 -11.752 -14.597 -12.917 1.00 0.00 C ATOM 1823 CD LYS A 108 -10.367 -14.239 -12.359 1.00 0.00 C ATOM 1824 CE LYS A 108 -10.222 -14.611 -10.877 1.00 0.00 C ATOM 1825 NZ LYS A 108 -8.839 -14.370 -10.415 1.00 0.00 N ATOM 0 H LYS A 108 -13.714 -12.939 -13.876 1.00 0.00 H new ATOM 0 HA LYS A 108 -11.020 -12.334 -14.479 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -12.853 -14.800 -14.756 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -11.114 -14.870 -14.955 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -12.505 -14.016 -12.385 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -11.953 -15.648 -12.708 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -9.600 -14.755 -12.937 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -10.194 -13.170 -12.482 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -10.919 -14.024 -10.279 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -10.482 -15.659 -10.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -8.692 -14.839 -9.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -8.169 -14.754 -11.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -8.681 -13.347 -10.310 1.00 0.00 H new ATOM 1839 N LYS A 109 -13.036 -12.558 -17.015 1.00 0.00 N ATOM 1840 CA LYS A 109 -13.275 -12.441 -18.443 1.00 0.00 C ATOM 1841 C LYS A 109 -13.041 -11.029 -18.981 1.00 0.00 C ATOM 1842 O LYS A 109 -12.934 -10.816 -20.185 1.00 0.00 O ATOM 1843 CB LYS A 109 -14.718 -12.890 -18.739 1.00 0.00 C ATOM 1844 CG LYS A 109 -14.993 -14.316 -18.240 1.00 0.00 C ATOM 1845 CD LYS A 109 -16.408 -14.740 -18.623 1.00 0.00 C ATOM 1846 CE LYS A 109 -16.804 -16.116 -18.073 1.00 0.00 C ATOM 1847 NZ LYS A 109 -18.193 -16.457 -18.457 1.00 0.00 N ATOM 0 H LYS A 109 -13.903 -12.466 -16.486 1.00 0.00 H new ATOM 0 HA LYS A 109 -12.555 -13.081 -18.953 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -15.416 -12.200 -18.266 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.900 -12.841 -19.813 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -14.268 -15.007 -18.671 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -14.872 -14.361 -17.158 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -17.114 -13.994 -18.257 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -16.493 -14.753 -19.710 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -16.120 -16.875 -18.453 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -16.711 -16.119 -16.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -18.439 -17.392 -18.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -18.845 -15.743 -18.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -18.272 -16.476 -19.494 1.00 0.00 H new ATOM 1861 N LYS A 110 -12.975 -10.034 -18.064 1.00 0.00 N ATOM 1862 CA LYS A 110 -12.777 -8.621 -18.338 1.00 0.00 C ATOM 1863 C LYS A 110 -11.516 -8.115 -17.650 1.00 0.00 C ATOM 1864 O LYS A 110 -10.700 -7.439 -18.273 1.00 0.00 O ATOM 1865 CB LYS A 110 -14.055 -7.798 -18.012 1.00 0.00 C ATOM 1866 CG LYS A 110 -14.782 -8.144 -16.700 1.00 0.00 C ATOM 1867 CD LYS A 110 -16.139 -7.428 -16.619 1.00 0.00 C ATOM 1868 CE LYS A 110 -16.998 -7.820 -15.406 1.00 0.00 C ATOM 1869 NZ LYS A 110 -16.409 -7.316 -14.145 1.00 0.00 N ATOM 0 H LYS A 110 -13.065 -10.223 -17.066 1.00 0.00 H new ATOM 0 HA LYS A 110 -12.613 -8.482 -19.407 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -13.782 -6.743 -17.982 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -14.759 -7.922 -18.835 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -14.931 -9.222 -16.636 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -14.163 -7.856 -15.850 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -15.966 -6.352 -16.593 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -16.701 -7.639 -17.529 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -18.005 -7.419 -15.526 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -17.091 -8.905 -15.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -16.479 -8.050 -13.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -15.409 -7.076 -14.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -16.925 -6.468 -13.836 1.00 0.00 H new ATOM 1883 N LYS A 111 -11.302 -8.441 -16.346 1.00 0.00 N ATOM 1884 CA LYS A 111 -10.098 -8.102 -15.596 1.00 0.00 C ATOM 1885 C LYS A 111 -9.461 -9.422 -15.177 1.00 0.00 C ATOM 1886 O LYS A 111 -8.541 -9.471 -14.360 1.00 0.00 O ATOM 1887 CB LYS A 111 -10.366 -7.195 -14.354 1.00 0.00 C ATOM 1888 CG LYS A 111 -10.633 -5.703 -14.662 1.00 0.00 C ATOM 1889 CD LYS A 111 -12.048 -5.327 -15.148 1.00 0.00 C ATOM 1890 CE LYS A 111 -13.180 -5.637 -14.153 1.00 0.00 C ATOM 1891 NZ LYS A 111 -12.988 -4.935 -12.862 1.00 0.00 N ATOM 0 H LYS A 111 -11.985 -8.957 -15.792 1.00 0.00 H new ATOM 0 HA LYS A 111 -9.437 -7.512 -16.231 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -11.223 -7.595 -13.813 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -9.508 -7.262 -13.686 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -10.422 -5.129 -13.760 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -9.919 -5.381 -15.420 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -12.066 -4.261 -15.376 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -12.248 -5.856 -16.080 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -14.136 -5.344 -14.587 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -13.226 -6.712 -13.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -13.797 -5.129 -12.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -12.113 -5.271 -12.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -12.919 -3.911 -13.031 1.00 0.00 H new TER 1905 LYS A 111