USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1065 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 87 TYR OH : rot 15:sc= 0.0385 USER MOD Set 1.2: A 91 GLN : amide:sc= -1.19 X(o=-3.4,f=-3.2) USER MOD Set 1.3: A 110 ASN : amide:sc= -2.25! C(o=-3.4!,f=-7.7!) USER MOD Set 2.1: A 30 TYR OH : rot 170:sc= -4.18! USER MOD Set 2.2: A 81 ASN : amide:sc= -3.96 K(o=-7.4,f=-10!) USER MOD Set 2.3: A 82 THR OG1 : rot -123:sc= -0.607 USER MOD Set 2.4: A 98 THR OG1 : rot -90:sc= 1.34 USER MOD Set 3.1: A 66 GLN : amide:sc= -0.833 K(o=-1.2,f=-0.47) USER MOD Set 3.2: A 80 TYR OH : rot 180:sc= -0.33 USER MOD Single : A 1 HIS : no HD1:sc= -0.0945 X(o=-0.095,f=-0.095) USER MOD Single : A 1 HIS N :NH3+ -144:sc= 0.0821 (180deg=-0.148) USER MOD Single : A 2 MET CE :methyl 159:sc= -0.962 (180deg=-2.6!) USER MOD Single : A 7 SER OG : rot 180:sc= 0.134 USER MOD Single : A 10 SER OG : rot 170:sc= -2.84! USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -132:sc= -2.3 (180deg=-5.12!) USER MOD Single : A 29 GLN : amide:sc= -1.33 K(o=-1.3,f=-2.3) USER MOD Single : A 31 LYS NZ :NH3+ -157:sc= -0.0167 (180deg=-0.293) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 HIS : no HD1:sc= -2.01! C(o=-2!,f=-5.5!) USER MOD Single : A 39 SER OG : rot 180:sc= -1.84! USER MOD Single : A 48 ASN : amide:sc= -3.77! C(o=-3.8!,f=-12!) USER MOD Single : A 54 THR OG1 : rot -65:sc= 2.09 USER MOD Single : A 55 SER OG : rot 180:sc= 0.0947 USER MOD Single : A 58 CYS SG : rot 140:sc= -0.0466 USER MOD Single : A 60 GLN : amide:sc=-0.00663 X(o=-0.0066,f=0) USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 107:sc= 0.0501 USER MOD Single : A 70 GLN : amide:sc= -0.157 X(o=-0.16,f=-0.12) USER MOD Single : A 71 THR OG1 : rot -17:sc= 1.22 USER MOD Single : A 73 SER OG : rot -150:sc= -0.892 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 88 CYS SG : rot 58:sc= -3.59! USER MOD Single : A 90 HIS : no HE2:sc= -9.36! C(o=-9.4!,f=-12!) USER MOD Single : A 96 LYS NZ :NH3+ 147:sc= -0.377 (180deg=-1.15) USER MOD Single : A 99 LYS NZ :NH3+ 147:sc= -1.1 (180deg=-2.11!) USER MOD Single : A 104 LYS NZ :NH3+ 151:sc= -0.223 (180deg=-1.18!) USER MOD Single : A 109 GLN : amide:sc= -2.88 K(o=-2.9,f=-2.3) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0312) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN : amide:sc= -1.11 K(o=-1.1,f=-4!) USER MOD Single : A 118 GLN : amide:sc= -0.294 K(o=-0.29,f=-2.6!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -0.0141 K(o=-0.014,f=-0.98) USER MOD Single : A 126 ASN : amide:sc=-0.00519 X(o=-0.0052,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0.00372 USER MOD Single : A 131 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.7!) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 5.559 23.671 13.887 1.00 0.00 N ATOM 2 CA HIS A 1 5.715 23.330 12.462 1.00 0.00 C ATOM 3 C HIS A 1 5.431 21.849 12.254 1.00 0.00 C ATOM 4 O HIS A 1 4.961 21.163 13.165 1.00 0.00 O ATOM 5 CB HIS A 1 7.121 23.667 11.911 1.00 0.00 C ATOM 6 CG HIS A 1 7.619 25.002 12.376 1.00 0.00 C ATOM 7 ND1 HIS A 1 7.188 26.203 11.872 1.00 0.00 N ATOM 8 CD2 HIS A 1 8.629 25.296 13.232 1.00 0.00 C ATOM 9 CE1 HIS A 1 7.906 27.180 12.403 1.00 0.00 C ATOM 10 NE2 HIS A 1 8.789 26.656 13.224 1.00 0.00 N ATOM 0 H1 HIS A 1 5.153 24.625 13.973 1.00 0.00 H new ATOM 0 H2 HIS A 1 4.926 22.982 14.341 1.00 0.00 H new ATOM 0 H3 HIS A 1 6.488 23.647 14.353 1.00 0.00 H new ATOM 0 HA HIS A 1 4.999 23.939 11.911 1.00 0.00 H new ATOM 0 HB2 HIS A 1 7.823 22.893 12.221 1.00 0.00 H new ATOM 0 HB3 HIS A 1 7.093 23.654 10.821 1.00 0.00 H new ATOM 0 HD2 HIS A 1 9.202 24.588 13.813 1.00 0.00 H new ATOM 0 HE1 HIS A 1 7.786 28.233 12.196 1.00 0.00 H new ATOM 0 HE2 HIS A 1 9.479 27.176 13.766 1.00 0.00 H new ATOM 21 N MET A 2 5.442 21.436 10.988 1.00 0.00 N ATOM 22 CA MET A 2 5.365 20.029 10.636 1.00 0.00 C ATOM 23 C MET A 2 4.107 19.378 11.191 1.00 0.00 C ATOM 24 O MET A 2 4.102 18.200 11.542 1.00 0.00 O ATOM 25 CB MET A 2 6.635 19.278 11.014 1.00 0.00 C ATOM 26 CG MET A 2 6.792 19.156 12.505 1.00 0.00 C ATOM 27 SD MET A 2 8.217 18.052 12.819 1.00 0.00 S ATOM 28 CE MET A 2 7.346 16.530 13.226 1.00 0.00 C ATOM 0 H MET A 2 5.504 22.065 10.187 1.00 0.00 H new ATOM 0 HA MET A 2 5.289 19.968 9.550 1.00 0.00 H new ATOM 0 HB2 MET A 2 6.615 18.283 10.569 1.00 0.00 H new ATOM 0 HB3 MET A 2 7.500 19.796 10.599 1.00 0.00 H new ATOM 0 HG2 MET A 2 6.959 20.135 12.954 1.00 0.00 H new ATOM 0 HG3 MET A 2 5.886 18.750 12.954 1.00 0.00 H new ATOM 0 HE1 MET A 2 8.013 15.680 13.082 1.00 0.00 H new ATOM 0 HE2 MET A 2 7.020 16.564 14.266 1.00 0.00 H new ATOM 0 HE3 MET A 2 6.477 16.423 12.577 1.00 0.00 H new ATOM 38 N GLY A 3 3.065 20.190 11.350 1.00 0.00 N ATOM 39 CA GLY A 3 1.753 19.686 11.732 1.00 0.00 C ATOM 40 C GLY A 3 0.677 20.251 10.813 1.00 0.00 C ATOM 41 O GLY A 3 0.132 19.544 9.968 1.00 0.00 O ATOM 0 H GLY A 3 3.106 21.201 11.220 1.00 0.00 H new ATOM 0 HA2 GLY A 3 1.747 18.597 11.683 1.00 0.00 H new ATOM 0 HA3 GLY A 3 1.538 19.960 12.765 1.00 0.00 H new ATOM 45 N ALA A 4 0.448 21.554 10.938 1.00 0.00 N ATOM 46 CA ALA A 4 -0.440 22.271 10.034 1.00 0.00 C ATOM 47 C ALA A 4 -1.856 21.702 10.122 1.00 0.00 C ATOM 48 O ALA A 4 -2.221 20.810 9.356 1.00 0.00 O ATOM 49 CB ALA A 4 0.089 22.202 8.606 1.00 0.00 C ATOM 0 H ALA A 4 0.869 22.137 11.662 1.00 0.00 H new ATOM 0 HA ALA A 4 -0.475 23.319 10.331 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.585 22.742 7.942 1.00 0.00 H new ATOM 0 HB2 ALA A 4 1.080 22.654 8.563 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.151 21.160 8.291 1.00 0.00 H new ATOM 55 N ARG A 5 -2.542 22.061 11.202 1.00 0.00 N ATOM 56 CA ARG A 5 -3.792 21.411 11.577 1.00 0.00 C ATOM 57 C ARG A 5 -3.552 19.939 11.888 1.00 0.00 C ATOM 58 O ARG A 5 -3.241 19.578 13.026 1.00 0.00 O ATOM 59 CB ARG A 5 -4.857 21.557 10.484 1.00 0.00 C ATOM 60 CG ARG A 5 -6.181 20.873 10.790 1.00 0.00 C ATOM 61 CD ARG A 5 -7.314 21.842 10.794 1.00 0.00 C ATOM 62 NE ARG A 5 -7.551 22.402 12.118 1.00 0.00 N ATOM 63 CZ ARG A 5 -8.354 21.832 13.018 1.00 0.00 C ATOM 64 NH1 ARG A 5 -9.166 20.831 12.691 1.00 0.00 N ATOM 65 NH2 ARG A 5 -8.388 22.317 14.261 1.00 0.00 N ATOM 0 H ARG A 5 -2.250 22.804 11.837 1.00 0.00 H new ATOM 0 HA ARG A 5 -4.166 21.908 12.472 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -5.042 22.618 10.316 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -4.461 21.151 9.553 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -6.369 20.096 10.049 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -6.120 20.380 11.760 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -7.103 22.649 10.092 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -8.218 21.344 10.444 1.00 0.00 H new ATOM 0 HE ARG A 5 -7.080 23.272 12.369 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -9.185 20.482 11.733 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -9.770 20.413 13.398 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -7.804 23.114 14.513 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -8.998 21.890 14.958 1.00 0.00 H new ATOM 79 N ALA A 6 -3.528 19.123 10.840 1.00 0.00 N ATOM 80 CA ALA A 6 -3.026 17.759 10.924 1.00 0.00 C ATOM 81 C ALA A 6 -3.081 17.096 9.546 1.00 0.00 C ATOM 82 O ALA A 6 -4.095 17.184 8.854 1.00 0.00 O ATOM 83 CB ALA A 6 -3.827 16.954 11.943 1.00 0.00 C ATOM 0 H ALA A 6 -3.855 19.389 9.911 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.988 17.786 11.257 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -3.437 15.937 11.991 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -3.743 17.422 12.924 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -4.874 16.927 11.643 1.00 0.00 H new ATOM 89 N SER A 7 -1.894 16.742 9.056 1.00 0.00 N ATOM 90 CA SER A 7 -1.744 16.231 7.702 1.00 0.00 C ATOM 91 C SER A 7 -1.808 14.701 7.707 1.00 0.00 C ATOM 92 O SER A 7 -1.896 14.091 8.775 1.00 0.00 O ATOM 93 CB SER A 7 -0.457 16.722 7.054 1.00 0.00 C ATOM 94 OG SER A 7 -0.470 16.516 5.653 1.00 0.00 O ATOM 0 H SER A 7 -1.022 16.801 9.582 1.00 0.00 H new ATOM 0 HA SER A 7 -2.570 16.615 7.103 1.00 0.00 H new ATOM 0 HB2 SER A 7 -0.324 17.783 7.266 1.00 0.00 H new ATOM 0 HB3 SER A 7 0.394 16.200 7.492 1.00 0.00 H new ATOM 0 HG SER A 7 0.369 16.843 5.266 1.00 0.00 H new ATOM 100 N VAL A 8 -1.440 14.118 6.571 1.00 0.00 N ATOM 101 CA VAL A 8 -1.111 12.700 6.493 1.00 0.00 C ATOM 102 C VAL A 8 0.075 12.387 7.411 1.00 0.00 C ATOM 103 O VAL A 8 0.019 11.433 8.190 1.00 0.00 O ATOM 104 CB VAL A 8 -0.870 12.295 5.024 1.00 0.00 C ATOM 105 CG1 VAL A 8 -0.384 10.859 4.878 1.00 0.00 C ATOM 106 CG2 VAL A 8 -2.100 12.540 4.166 1.00 0.00 C ATOM 0 H VAL A 8 -1.362 14.613 5.682 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.948 12.099 6.849 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.068 12.939 4.662 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.232 10.632 3.823 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.557 10.737 5.415 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -1.129 10.179 5.292 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -1.892 12.243 3.138 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.935 11.954 4.551 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.357 13.599 4.192 1.00 0.00 H new ATOM 116 N LEU A 9 1.211 13.002 7.099 1.00 0.00 N ATOM 117 CA LEU A 9 2.510 12.504 7.546 1.00 0.00 C ATOM 118 C LEU A 9 3.107 13.445 8.588 1.00 0.00 C ATOM 119 O LEU A 9 2.389 14.209 9.231 1.00 0.00 O ATOM 120 CB LEU A 9 3.390 12.317 6.299 1.00 0.00 C ATOM 121 CG LEU A 9 3.124 11.086 5.450 1.00 0.00 C ATOM 122 CD1 LEU A 9 3.941 11.118 4.167 1.00 0.00 C ATOM 123 CD2 LEU A 9 3.474 9.846 6.265 1.00 0.00 C ATOM 0 H LEU A 9 1.260 13.851 6.535 1.00 0.00 H new ATOM 0 HA LEU A 9 2.424 11.540 8.047 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.274 13.197 5.667 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.431 12.290 6.619 1.00 0.00 H new ATOM 0 HG LEU A 9 2.071 11.066 5.170 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.730 10.225 3.579 1.00 0.00 H new ATOM 0 HD12 LEU A 9 3.676 12.003 3.589 1.00 0.00 H new ATOM 0 HD13 LEU A 9 5.003 11.149 4.412 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.288 8.953 5.668 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.526 9.881 6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.858 9.816 7.164 1.00 0.00 H new ATOM 135 N SER A 10 4.382 13.219 8.889 1.00 0.00 N ATOM 136 CA SER A 10 5.055 13.905 9.980 1.00 0.00 C ATOM 137 C SER A 10 6.359 14.533 9.489 1.00 0.00 C ATOM 138 O SER A 10 6.739 14.352 8.331 1.00 0.00 O ATOM 139 CB SER A 10 5.304 12.977 11.161 1.00 0.00 C ATOM 140 OG SER A 10 6.420 12.135 10.935 1.00 0.00 O ATOM 0 H SER A 10 4.973 12.558 8.385 1.00 0.00 H new ATOM 0 HA SER A 10 4.398 14.701 10.331 1.00 0.00 H new ATOM 0 HB2 SER A 10 5.470 13.569 12.061 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.418 12.368 11.339 1.00 0.00 H new ATOM 0 HG SER A 10 6.652 11.669 11.765 1.00 0.00 H new ATOM 146 N GLY A 11 7.172 14.953 10.457 1.00 0.00 N ATOM 147 CA GLY A 11 8.477 15.527 10.164 1.00 0.00 C ATOM 148 C GLY A 11 9.358 14.511 9.443 1.00 0.00 C ATOM 149 O GLY A 11 9.518 14.568 8.224 1.00 0.00 O ATOM 0 H GLY A 11 6.946 14.905 11.451 1.00 0.00 H new ATOM 0 HA2 GLY A 11 8.359 16.418 9.547 1.00 0.00 H new ATOM 0 HA3 GLY A 11 8.958 15.842 11.090 1.00 0.00 H new ATOM 153 N GLY A 12 9.720 13.458 10.174 1.00 0.00 N ATOM 154 CA GLY A 12 10.613 12.437 9.647 1.00 0.00 C ATOM 155 C GLY A 12 9.891 11.581 8.611 1.00 0.00 C ATOM 156 O GLY A 12 10.520 10.995 7.731 1.00 0.00 O ATOM 0 H GLY A 12 9.407 13.293 11.131 1.00 0.00 H new ATOM 0 HA2 GLY A 12 11.486 12.907 9.195 1.00 0.00 H new ATOM 0 HA3 GLY A 12 10.975 11.807 10.460 1.00 0.00 H new ATOM 160 N GLU A 13 8.591 11.406 8.822 1.00 0.00 N ATOM 161 CA GLU A 13 7.810 10.439 8.061 1.00 0.00 C ATOM 162 C GLU A 13 7.665 10.892 6.614 1.00 0.00 C ATOM 163 O GLU A 13 7.813 10.101 5.684 1.00 0.00 O ATOM 164 CB GLU A 13 6.441 10.321 8.747 1.00 0.00 C ATOM 165 CG GLU A 13 6.163 9.469 9.847 1.00 0.00 C ATOM 166 CD GLU A 13 4.741 9.396 10.316 1.00 0.00 C ATOM 167 OE1 GLU A 13 3.775 9.393 9.572 1.00 0.00 O ATOM 168 OE2 GLU A 13 4.659 9.249 11.555 1.00 0.00 O ATOM 0 H GLU A 13 8.054 11.924 9.517 1.00 0.00 H new ATOM 0 HA GLU A 13 8.305 9.468 8.040 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.178 11.328 9.071 1.00 0.00 H new ATOM 0 HB3 GLU A 13 5.734 10.044 7.965 1.00 0.00 H new ATOM 0 HG2 GLU A 13 6.484 8.461 9.583 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.779 9.790 10.687 1.00 0.00 H new ATOM 175 N LEU A 14 7.413 12.185 6.440 1.00 0.00 N ATOM 176 CA LEU A 14 7.475 12.811 5.126 1.00 0.00 C ATOM 177 C LEU A 14 8.892 12.731 4.566 1.00 0.00 C ATOM 178 O LEU A 14 9.088 12.422 3.390 1.00 0.00 O ATOM 179 CB LEU A 14 6.958 14.254 5.271 1.00 0.00 C ATOM 180 CG LEU A 14 6.150 14.823 4.122 1.00 0.00 C ATOM 181 CD1 LEU A 14 5.079 13.846 3.659 1.00 0.00 C ATOM 182 CD2 LEU A 14 5.506 16.129 4.576 1.00 0.00 C ATOM 0 H LEU A 14 7.163 12.822 7.197 1.00 0.00 H new ATOM 0 HA LEU A 14 6.845 12.290 4.405 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.345 14.304 6.171 1.00 0.00 H new ATOM 0 HB3 LEU A 14 7.817 14.905 5.434 1.00 0.00 H new ATOM 0 HG LEU A 14 6.816 15.004 3.278 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.518 14.285 2.834 1.00 0.00 H new ATOM 0 HD12 LEU A 14 5.550 12.921 3.326 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.401 13.631 4.485 1.00 0.00 H new ATOM 0 HD21 LEU A 14 4.921 16.550 3.758 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.853 15.936 5.427 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.283 16.836 4.867 1.00 0.00 H new ATOM 194 N ASP A 15 9.840 13.220 5.360 1.00 0.00 N ATOM 195 CA ASP A 15 11.239 13.238 4.966 1.00 0.00 C ATOM 196 C ASP A 15 11.739 11.810 4.719 1.00 0.00 C ATOM 197 O ASP A 15 12.659 11.607 3.925 1.00 0.00 O ATOM 198 CB ASP A 15 12.097 14.033 5.945 1.00 0.00 C ATOM 199 CG ASP A 15 13.488 14.333 5.419 1.00 0.00 C ATOM 200 OD1 ASP A 15 13.599 15.344 4.693 1.00 0.00 O ATOM 201 OD2 ASP A 15 14.435 13.569 5.659 1.00 0.00 O ATOM 0 H ASP A 15 9.660 13.611 6.285 1.00 0.00 H new ATOM 0 HA ASP A 15 11.332 13.770 4.019 1.00 0.00 H new ATOM 0 HB2 ASP A 15 11.594 14.972 6.178 1.00 0.00 H new ATOM 0 HB3 ASP A 15 12.181 13.476 6.878 1.00 0.00 H new ATOM 206 N LYS A 16 10.899 10.856 5.112 1.00 0.00 N ATOM 207 CA LYS A 16 11.027 9.475 4.673 1.00 0.00 C ATOM 208 C LYS A 16 10.231 9.243 3.394 1.00 0.00 C ATOM 209 O LYS A 16 10.669 8.528 2.496 1.00 0.00 O ATOM 210 CB LYS A 16 10.548 8.490 5.743 1.00 0.00 C ATOM 211 CG LYS A 16 11.536 7.360 6.033 1.00 0.00 C ATOM 212 CD LYS A 16 12.002 6.639 4.781 1.00 0.00 C ATOM 213 CE LYS A 16 13.415 6.226 4.794 1.00 0.00 C ATOM 214 NZ LYS A 16 14.309 7.335 4.373 1.00 0.00 N ATOM 0 H LYS A 16 10.114 11.021 5.742 1.00 0.00 H new ATOM 0 HA LYS A 16 12.087 9.298 4.488 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.356 9.037 6.666 1.00 0.00 H new ATOM 0 HB3 LYS A 16 9.599 8.057 5.426 1.00 0.00 H new ATOM 0 HG2 LYS A 16 12.402 7.768 6.554 1.00 0.00 H new ATOM 0 HG3 LYS A 16 11.069 6.641 6.706 1.00 0.00 H new ATOM 0 HD2 LYS A 16 11.381 5.755 4.636 1.00 0.00 H new ATOM 0 HD3 LYS A 16 11.836 7.289 3.922 1.00 0.00 H new ATOM 0 HE2 LYS A 16 13.690 5.896 5.796 1.00 0.00 H new ATOM 0 HE3 LYS A 16 13.552 5.374 4.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 15.297 7.011 4.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 14.062 7.633 3.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 14.195 8.139 5.023 1.00 0.00 H new ATOM 228 N TRP A 17 9.035 9.823 3.350 1.00 0.00 N ATOM 229 CA TRP A 17 8.064 9.499 2.315 1.00 0.00 C ATOM 230 C TRP A 17 8.571 9.945 0.948 1.00 0.00 C ATOM 231 O TRP A 17 8.313 9.288 -0.062 1.00 0.00 O ATOM 232 CB TRP A 17 6.682 10.064 2.637 1.00 0.00 C ATOM 233 CG TRP A 17 5.649 9.804 1.577 1.00 0.00 C ATOM 234 CD1 TRP A 17 5.619 10.388 0.331 1.00 0.00 C ATOM 235 CD2 TRP A 17 4.895 8.583 1.443 1.00 0.00 C ATOM 236 NE1 TRP A 17 4.713 9.736 -0.473 1.00 0.00 N ATOM 237 CE2 TRP A 17 4.329 8.577 0.145 1.00 0.00 C ATOM 238 CE3 TRP A 17 4.633 7.524 2.306 1.00 0.00 C ATOM 239 CZ2 TRP A 17 3.347 7.661 -0.220 1.00 0.00 C ATOM 240 CZ3 TRP A 17 3.631 6.637 1.959 1.00 0.00 C ATOM 241 CH2 TRP A 17 3.086 6.633 0.672 1.00 0.00 C ATOM 0 H TRP A 17 8.716 10.521 4.022 1.00 0.00 H new ATOM 0 HA TRP A 17 7.948 8.416 2.284 1.00 0.00 H new ATOM 0 HB2 TRP A 17 6.337 9.636 3.578 1.00 0.00 H new ATOM 0 HB3 TRP A 17 6.768 11.140 2.789 1.00 0.00 H new ATOM 0 HD1 TRP A 17 6.219 11.234 0.029 1.00 0.00 H new ATOM 0 HE1 TRP A 17 4.382 10.063 -1.381 1.00 0.00 H new ATOM 0 HE3 TRP A 17 5.195 7.399 3.219 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 2.813 7.747 -1.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.264 5.936 2.694 1.00 0.00 H new ATOM 0 HH2 TRP A 17 2.450 5.815 0.367 1.00 0.00 H new ATOM 252 N GLU A 18 9.516 10.892 0.968 1.00 0.00 N ATOM 253 CA GLU A 18 9.910 11.561 -0.271 1.00 0.00 C ATOM 254 C GLU A 18 11.095 10.855 -0.919 1.00 0.00 C ATOM 255 O GLU A 18 11.902 11.494 -1.607 1.00 0.00 O ATOM 256 CB GLU A 18 10.261 13.011 0.089 1.00 0.00 C ATOM 257 CG GLU A 18 10.069 14.125 -0.769 1.00 0.00 C ATOM 258 CD GLU A 18 11.298 14.827 -1.264 1.00 0.00 C ATOM 259 OE1 GLU A 18 12.412 14.334 -1.272 1.00 0.00 O ATOM 260 OE2 GLU A 18 11.060 16.002 -1.618 1.00 0.00 O ATOM 0 H GLU A 18 10.009 11.204 1.805 1.00 0.00 H new ATOM 0 HA GLU A 18 9.097 11.534 -0.996 1.00 0.00 H new ATOM 0 HB2 GLU A 18 9.710 13.236 1.002 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.320 13.009 0.347 1.00 0.00 H new ATOM 0 HG2 GLU A 18 9.499 13.790 -1.636 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.452 14.854 -0.244 1.00 0.00 H new ATOM 267 N LYS A 19 11.065 9.528 -0.906 1.00 0.00 N ATOM 268 CA LYS A 19 11.802 8.720 -1.878 1.00 0.00 C ATOM 269 C LYS A 19 11.630 7.239 -1.558 1.00 0.00 C ATOM 270 O LYS A 19 12.422 6.649 -0.818 1.00 0.00 O ATOM 271 CB LYS A 19 13.287 9.070 -1.910 1.00 0.00 C ATOM 272 CG LYS A 19 13.735 9.769 -3.195 1.00 0.00 C ATOM 273 CD LYS A 19 15.032 10.540 -3.032 1.00 0.00 C ATOM 274 CE LYS A 19 14.958 11.687 -2.113 1.00 0.00 C ATOM 275 NZ LYS A 19 16.187 11.801 -1.286 1.00 0.00 N ATOM 0 H LYS A 19 10.534 8.982 -0.228 1.00 0.00 H new ATOM 0 HA LYS A 19 11.390 8.939 -2.863 1.00 0.00 H new ATOM 0 HB2 LYS A 19 13.516 9.713 -1.060 1.00 0.00 H new ATOM 0 HB3 LYS A 19 13.868 8.156 -1.784 1.00 0.00 H new ATOM 0 HG2 LYS A 19 13.858 9.025 -3.982 1.00 0.00 H new ATOM 0 HG3 LYS A 19 12.951 10.453 -3.522 1.00 0.00 H new ATOM 0 HD2 LYS A 19 15.802 9.856 -2.675 1.00 0.00 H new ATOM 0 HD3 LYS A 19 15.351 10.897 -4.011 1.00 0.00 H new ATOM 0 HE2 LYS A 19 14.816 12.604 -2.685 1.00 0.00 H new ATOM 0 HE3 LYS A 19 14.089 11.579 -1.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 16.102 12.619 -0.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 16.308 10.935 -0.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 17.012 11.929 -1.906 1.00 0.00 H new ATOM 289 N ILE A 20 10.413 6.732 -1.815 1.00 0.00 N ATOM 290 CA ILE A 20 10.271 5.265 -1.933 1.00 0.00 C ATOM 291 C ILE A 20 10.493 4.873 -3.392 1.00 0.00 C ATOM 292 O ILE A 20 9.509 4.743 -4.140 1.00 0.00 O ATOM 293 CB ILE A 20 8.936 4.788 -1.304 1.00 0.00 C ATOM 294 CG1 ILE A 20 9.138 4.587 0.240 1.00 0.00 C ATOM 295 CG2 ILE A 20 8.309 3.511 -1.914 1.00 0.00 C ATOM 296 CD1 ILE A 20 8.252 5.494 1.118 1.00 0.00 C ATOM 0 H ILE A 20 9.558 7.274 -1.939 1.00 0.00 H new ATOM 0 HA ILE A 20 11.032 4.739 -1.356 1.00 0.00 H new ATOM 0 HB ILE A 20 8.220 5.579 -1.529 1.00 0.00 H new ATOM 0 HG12 ILE A 20 8.932 3.546 0.489 1.00 0.00 H new ATOM 0 HG13 ILE A 20 10.184 4.773 0.485 1.00 0.00 H new ATOM 0 HG21 ILE A 20 7.381 3.277 -1.393 1.00 0.00 H new ATOM 0 HG22 ILE A 20 8.100 3.677 -2.971 1.00 0.00 H new ATOM 0 HG23 ILE A 20 9.004 2.678 -1.809 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.454 5.292 2.170 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.473 6.539 0.901 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.202 5.293 0.905 1.00 0.00 H new ATOM 308 N ARG A 21 11.637 4.227 -3.627 1.00 0.00 N ATOM 309 CA ARG A 21 11.957 3.680 -4.936 1.00 0.00 C ATOM 310 C ARG A 21 10.916 2.643 -5.351 1.00 0.00 C ATOM 311 O ARG A 21 10.081 2.238 -4.540 1.00 0.00 O ATOM 312 CB ARG A 21 13.355 3.047 -4.963 1.00 0.00 C ATOM 313 CG ARG A 21 14.392 3.836 -5.750 1.00 0.00 C ATOM 314 CD ARG A 21 15.018 4.904 -4.920 1.00 0.00 C ATOM 315 NE ARG A 21 16.453 4.715 -4.772 1.00 0.00 N ATOM 316 CZ ARG A 21 17.289 4.613 -5.808 1.00 0.00 C ATOM 317 NH1 ARG A 21 16.889 4.861 -7.052 1.00 0.00 N ATOM 318 NH2 ARG A 21 18.566 4.297 -5.586 1.00 0.00 N ATOM 0 H ARG A 21 12.357 4.072 -2.921 1.00 0.00 H new ATOM 0 HA ARG A 21 11.947 4.509 -5.644 1.00 0.00 H new ATOM 0 HB2 ARG A 21 13.707 2.931 -3.938 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.279 2.047 -5.389 1.00 0.00 H new ATOM 0 HG2 ARG A 21 15.164 3.159 -6.115 1.00 0.00 H new ATOM 0 HG3 ARG A 21 13.921 4.284 -6.625 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.826 5.875 -5.376 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.551 4.917 -3.935 1.00 0.00 H new ATOM 0 HE ARG A 21 16.840 4.658 -3.830 1.00 0.00 H new ATOM 0 HH11 ARG A 21 15.924 5.136 -7.232 1.00 0.00 H new ATOM 0 HH12 ARG A 21 17.548 4.776 -7.826 1.00 0.00 H new ATOM 0 HH21 ARG A 21 18.893 4.136 -4.633 1.00 0.00 H new ATOM 0 HH22 ARG A 21 19.215 4.216 -6.369 1.00 0.00 H new ATOM 332 N LEU A 22 10.836 2.408 -6.659 1.00 0.00 N ATOM 333 CA LEU A 22 9.728 1.658 -7.237 1.00 0.00 C ATOM 334 C LEU A 22 10.179 0.907 -8.485 1.00 0.00 C ATOM 335 O LEU A 22 9.843 -0.265 -8.668 1.00 0.00 O ATOM 336 CB LEU A 22 8.564 2.630 -7.468 1.00 0.00 C ATOM 337 CG LEU A 22 8.812 3.814 -8.387 1.00 0.00 C ATOM 338 CD1 LEU A 22 8.337 3.519 -9.802 1.00 0.00 C ATOM 339 CD2 LEU A 22 8.069 5.023 -7.825 1.00 0.00 C ATOM 0 H LEU A 22 11.527 2.727 -7.338 1.00 0.00 H new ATOM 0 HA LEU A 22 9.376 0.881 -6.559 1.00 0.00 H new ATOM 0 HB2 LEU A 22 7.726 2.061 -7.870 1.00 0.00 H new ATOM 0 HB3 LEU A 22 8.251 3.017 -6.498 1.00 0.00 H new ATOM 0 HG LEU A 22 9.882 4.015 -8.435 1.00 0.00 H new ATOM 0 HD11 LEU A 22 8.527 4.384 -10.437 1.00 0.00 H new ATOM 0 HD12 LEU A 22 8.875 2.656 -10.194 1.00 0.00 H new ATOM 0 HD13 LEU A 22 7.268 3.306 -9.790 1.00 0.00 H new ATOM 0 HD21 LEU A 22 8.235 5.885 -8.472 1.00 0.00 H new ATOM 0 HD22 LEU A 22 7.002 4.805 -7.778 1.00 0.00 H new ATOM 0 HD23 LEU A 22 8.439 5.244 -6.824 1.00 0.00 H new ATOM 351 N ARG A 23 11.097 1.520 -9.226 1.00 0.00 N ATOM 352 CA ARG A 23 11.892 0.814 -10.218 1.00 0.00 C ATOM 353 C ARG A 23 13.369 1.241 -10.104 1.00 0.00 C ATOM 354 O ARG A 23 13.790 2.272 -10.647 1.00 0.00 O ATOM 355 CB ARG A 23 11.400 1.063 -11.644 1.00 0.00 C ATOM 356 CG ARG A 23 11.286 2.530 -12.038 1.00 0.00 C ATOM 357 CD ARG A 23 10.607 2.692 -13.356 1.00 0.00 C ATOM 358 NE ARG A 23 10.465 4.092 -13.730 1.00 0.00 N ATOM 359 CZ ARG A 23 9.302 4.745 -13.692 1.00 0.00 C ATOM 360 NH1 ARG A 23 8.221 4.209 -13.133 1.00 0.00 N ATOM 361 NH2 ARG A 23 9.234 5.983 -14.183 1.00 0.00 N ATOM 0 H ARG A 23 11.308 2.515 -9.154 1.00 0.00 H new ATOM 0 HA ARG A 23 11.789 -0.252 -10.015 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.079 0.567 -12.338 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.424 0.593 -11.763 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.730 3.071 -11.272 1.00 0.00 H new ATOM 0 HG3 ARG A 23 12.281 2.974 -12.083 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.176 2.168 -14.124 1.00 0.00 H new ATOM 0 HD3 ARG A 23 9.622 2.226 -13.316 1.00 0.00 H new ATOM 0 HE ARG A 23 11.296 4.599 -14.036 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.269 3.278 -12.720 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.344 4.729 -13.117 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.065 6.420 -14.582 1.00 0.00 H new ATOM 0 HH22 ARG A 23 8.351 6.493 -14.160 1.00 0.00 H new ATOM 375 N PRO A 24 14.139 0.439 -9.342 1.00 0.00 N ATOM 376 CA PRO A 24 15.591 0.679 -9.149 1.00 0.00 C ATOM 377 C PRO A 24 16.370 0.797 -10.457 1.00 0.00 C ATOM 378 O PRO A 24 17.524 1.224 -10.464 1.00 0.00 O ATOM 379 CB PRO A 24 16.099 -0.448 -8.257 1.00 0.00 C ATOM 380 CG PRO A 24 14.916 -1.182 -7.698 1.00 0.00 C ATOM 381 CD PRO A 24 13.726 -0.750 -8.542 1.00 0.00 C ATOM 0 HA PRO A 24 15.750 1.648 -8.677 1.00 0.00 H new ATOM 0 HB2 PRO A 24 16.731 -1.128 -8.828 1.00 0.00 H new ATOM 0 HB3 PRO A 24 16.711 -0.046 -7.450 1.00 0.00 H new ATOM 0 HG2 PRO A 24 15.063 -2.261 -7.752 1.00 0.00 H new ATOM 0 HG3 PRO A 24 14.762 -0.934 -6.648 1.00 0.00 H new ATOM 0 HD2 PRO A 24 13.410 -1.560 -9.199 1.00 0.00 H new ATOM 0 HD3 PRO A 24 12.876 -0.505 -7.906 1.00 0.00 H new ATOM 389 N GLY A 25 15.822 0.171 -11.496 1.00 0.00 N ATOM 390 CA GLY A 25 16.435 0.202 -12.816 1.00 0.00 C ATOM 391 C GLY A 25 15.963 1.427 -13.593 1.00 0.00 C ATOM 392 O GLY A 25 16.563 1.804 -14.599 1.00 0.00 O ATOM 0 H GLY A 25 14.954 -0.363 -11.446 1.00 0.00 H new ATOM 0 HA2 GLY A 25 17.521 0.221 -12.719 1.00 0.00 H new ATOM 0 HA3 GLY A 25 16.179 -0.705 -13.364 1.00 0.00 H new ATOM 396 N GLY A 26 14.767 1.891 -13.243 1.00 0.00 N ATOM 397 CA GLY A 26 14.174 3.051 -13.890 1.00 0.00 C ATOM 398 C GLY A 26 14.558 4.329 -13.151 1.00 0.00 C ATOM 399 O GLY A 26 14.599 5.408 -13.740 1.00 0.00 O ATOM 0 H GLY A 26 14.189 1.477 -12.511 1.00 0.00 H new ATOM 0 HA2 GLY A 26 14.509 3.108 -14.926 1.00 0.00 H new ATOM 0 HA3 GLY A 26 13.089 2.948 -13.911 1.00 0.00 H new ATOM 403 N LYS A 27 15.056 4.146 -11.932 1.00 0.00 N ATOM 404 CA LYS A 27 15.479 5.263 -11.101 1.00 0.00 C ATOM 405 C LYS A 27 14.285 6.156 -10.765 1.00 0.00 C ATOM 406 O LYS A 27 14.457 7.308 -10.369 1.00 0.00 O ATOM 407 CB LYS A 27 16.554 6.109 -11.785 1.00 0.00 C ATOM 408 CG LYS A 27 17.737 5.298 -12.312 1.00 0.00 C ATOM 409 CD LYS A 27 18.597 6.068 -13.296 1.00 0.00 C ATOM 410 CE LYS A 27 19.314 5.236 -14.276 1.00 0.00 C ATOM 411 NZ LYS A 27 20.734 5.647 -14.404 1.00 0.00 N ATOM 0 H LYS A 27 15.176 3.231 -11.498 1.00 0.00 H new ATOM 0 HA LYS A 27 15.901 4.841 -10.189 1.00 0.00 H new ATOM 0 HB2 LYS A 27 16.101 6.654 -12.614 1.00 0.00 H new ATOM 0 HB3 LYS A 27 16.922 6.853 -11.078 1.00 0.00 H new ATOM 0 HG2 LYS A 27 18.354 4.979 -11.472 1.00 0.00 H new ATOM 0 HG3 LYS A 27 17.364 4.395 -12.794 1.00 0.00 H new ATOM 0 HD2 LYS A 27 17.964 6.774 -13.834 1.00 0.00 H new ATOM 0 HD3 LYS A 27 19.326 6.655 -12.737 1.00 0.00 H new ATOM 0 HE2 LYS A 27 19.263 4.190 -13.973 1.00 0.00 H new ATOM 0 HE3 LYS A 27 18.824 5.311 -15.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 21.209 5.040 -15.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 20.782 6.638 -14.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 21.207 5.551 -13.483 1.00 0.00 H new ATOM 425 N LYS A 28 13.111 5.536 -10.720 1.00 0.00 N ATOM 426 CA LYS A 28 11.904 6.200 -10.251 1.00 0.00 C ATOM 427 C LYS A 28 11.698 5.940 -8.761 1.00 0.00 C ATOM 428 O LYS A 28 11.893 4.821 -8.287 1.00 0.00 O ATOM 429 CB LYS A 28 10.663 5.730 -11.012 1.00 0.00 C ATOM 430 CG LYS A 28 9.769 6.869 -11.502 1.00 0.00 C ATOM 431 CD LYS A 28 10.476 7.815 -12.455 1.00 0.00 C ATOM 432 CE LYS A 28 9.589 8.735 -13.185 1.00 0.00 C ATOM 433 NZ LYS A 28 9.768 8.611 -14.653 1.00 0.00 N ATOM 0 H LYS A 28 12.971 4.567 -11.005 1.00 0.00 H new ATOM 0 HA LYS A 28 12.037 7.267 -10.430 1.00 0.00 H new ATOM 0 HB2 LYS A 28 10.978 5.134 -11.869 1.00 0.00 H new ATOM 0 HB3 LYS A 28 10.079 5.075 -10.366 1.00 0.00 H new ATOM 0 HG2 LYS A 28 8.895 6.448 -11.999 1.00 0.00 H new ATOM 0 HG3 LYS A 28 9.406 7.433 -10.643 1.00 0.00 H new ATOM 0 HD2 LYS A 28 11.200 8.403 -11.890 1.00 0.00 H new ATOM 0 HD3 LYS A 28 11.039 7.225 -13.179 1.00 0.00 H new ATOM 0 HE2 LYS A 28 8.552 8.525 -12.925 1.00 0.00 H new ATOM 0 HE3 LYS A 28 9.794 9.760 -12.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 9.871 9.558 -15.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 10.621 8.050 -14.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.938 8.138 -15.065 1.00 0.00 H new ATOM 447 N GLN A 29 11.041 6.897 -8.110 1.00 0.00 N ATOM 448 CA GLN A 29 10.794 6.813 -6.678 1.00 0.00 C ATOM 449 C GLN A 29 9.495 7.533 -6.320 1.00 0.00 C ATOM 450 O GLN A 29 9.223 8.621 -6.830 1.00 0.00 O ATOM 451 CB GLN A 29 11.962 7.344 -5.844 1.00 0.00 C ATOM 452 CG GLN A 29 12.559 8.632 -6.379 1.00 0.00 C ATOM 453 CD GLN A 29 14.055 8.560 -6.563 1.00 0.00 C ATOM 454 OE1 GLN A 29 14.610 7.552 -6.993 1.00 0.00 O ATOM 455 NE2 GLN A 29 14.712 9.687 -6.303 1.00 0.00 N ATOM 0 H GLN A 29 10.671 7.738 -8.553 1.00 0.00 H new ATOM 0 HA GLN A 29 10.694 5.756 -6.431 1.00 0.00 H new ATOM 0 HB2 GLN A 29 11.621 7.509 -4.822 1.00 0.00 H new ATOM 0 HB3 GLN A 29 12.741 6.583 -5.801 1.00 0.00 H new ATOM 0 HG2 GLN A 29 12.093 8.872 -7.335 1.00 0.00 H new ATOM 0 HG3 GLN A 29 12.322 9.447 -5.695 1.00 0.00 H new ATOM 0 HE21 GLN A 29 14.209 10.500 -5.947 1.00 0.00 H new ATOM 0 HE22 GLN A 29 15.719 9.738 -6.460 1.00 0.00 H new ATOM 464 N TYR A 30 8.869 7.063 -5.241 1.00 0.00 N ATOM 465 CA TYR A 30 7.748 7.744 -4.633 1.00 0.00 C ATOM 466 C TYR A 30 8.207 9.157 -4.153 1.00 0.00 C ATOM 467 O TYR A 30 8.951 9.180 -3.151 1.00 0.00 O ATOM 468 CB TYR A 30 7.177 6.992 -3.427 1.00 0.00 C ATOM 469 CG TYR A 30 6.454 5.692 -3.718 1.00 0.00 C ATOM 470 CD1 TYR A 30 6.801 4.912 -4.822 1.00 0.00 C ATOM 471 CD2 TYR A 30 5.573 5.136 -2.779 1.00 0.00 C ATOM 472 CE1 TYR A 30 6.381 3.589 -4.940 1.00 0.00 C ATOM 473 CE2 TYR A 30 5.102 3.830 -2.909 1.00 0.00 C ATOM 474 CZ TYR A 30 5.546 3.045 -3.972 1.00 0.00 C ATOM 475 OH TYR A 30 5.271 1.704 -4.044 1.00 0.00 O ATOM 0 H TYR A 30 9.133 6.197 -4.770 1.00 0.00 H new ATOM 0 HA TYR A 30 6.966 7.808 -5.390 1.00 0.00 H new ATOM 0 HB2 TYR A 30 7.995 6.780 -2.739 1.00 0.00 H new ATOM 0 HB3 TYR A 30 6.487 7.656 -2.907 1.00 0.00 H new ATOM 0 HD1 TYR A 30 7.409 5.344 -5.603 1.00 0.00 H new ATOM 0 HD2 TYR A 30 5.253 5.732 -1.937 1.00 0.00 H new ATOM 0 HE1 TYR A 30 6.703 2.990 -5.779 1.00 0.00 H new ATOM 0 HE2 TYR A 30 4.400 3.430 -2.193 1.00 0.00 H new ATOM 0 HH TYR A 30 4.814 1.419 -3.225 1.00 0.00 H new ATOM 485 N LYS A 31 7.286 10.097 -4.350 1.00 0.00 N ATOM 486 CA LYS A 31 7.181 11.304 -3.550 1.00 0.00 C ATOM 487 C LYS A 31 5.719 11.606 -3.228 1.00 0.00 C ATOM 488 O LYS A 31 4.863 10.722 -3.292 1.00 0.00 O ATOM 489 CB LYS A 31 7.792 12.516 -4.259 1.00 0.00 C ATOM 490 CG LYS A 31 9.206 12.278 -4.786 1.00 0.00 C ATOM 491 CD LYS A 31 9.399 12.755 -6.214 1.00 0.00 C ATOM 492 CE LYS A 31 10.351 13.865 -6.373 1.00 0.00 C ATOM 493 NZ LYS A 31 9.981 15.026 -5.523 1.00 0.00 N ATOM 0 H LYS A 31 6.581 10.036 -5.085 1.00 0.00 H new ATOM 0 HA LYS A 31 7.737 11.123 -2.630 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.148 12.800 -5.091 1.00 0.00 H new ATOM 0 HB3 LYS A 31 7.810 13.358 -3.567 1.00 0.00 H new ATOM 0 HG2 LYS A 31 9.919 12.789 -4.139 1.00 0.00 H new ATOM 0 HG3 LYS A 31 9.433 11.213 -4.731 1.00 0.00 H new ATOM 0 HD2 LYS A 31 9.739 11.915 -6.820 1.00 0.00 H new ATOM 0 HD3 LYS A 31 8.433 13.065 -6.612 1.00 0.00 H new ATOM 0 HE2 LYS A 31 11.353 13.526 -6.111 1.00 0.00 H new ATOM 0 HE3 LYS A 31 10.381 14.173 -7.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 10.398 15.893 -5.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 8.946 15.121 -5.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 10.340 14.878 -4.558 1.00 0.00 H new ATOM 507 N LEU A 32 5.492 12.800 -2.690 1.00 0.00 N ATOM 508 CA LEU A 32 4.195 13.162 -2.140 1.00 0.00 C ATOM 509 C LEU A 32 3.201 13.467 -3.260 1.00 0.00 C ATOM 510 O LEU A 32 1.988 13.377 -3.054 1.00 0.00 O ATOM 511 CB LEU A 32 4.396 14.317 -1.151 1.00 0.00 C ATOM 512 CG LEU A 32 5.022 13.971 0.192 1.00 0.00 C ATOM 513 CD1 LEU A 32 5.151 15.252 1.010 1.00 0.00 C ATOM 514 CD2 LEU A 32 4.182 12.949 0.942 1.00 0.00 C ATOM 0 H LEU A 32 6.195 13.536 -2.624 1.00 0.00 H new ATOM 0 HA LEU A 32 3.755 12.331 -1.589 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.019 15.071 -1.632 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.426 14.777 -0.965 1.00 0.00 H new ATOM 0 HG LEU A 32 6.005 13.529 0.028 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.598 15.023 1.977 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.783 15.962 0.477 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.164 15.688 1.161 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.654 12.721 1.898 1.00 0.00 H new ATOM 0 HD22 LEU A 32 3.186 13.355 1.117 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.104 12.037 0.350 1.00 0.00 H new ATOM 526 N LYS A 33 3.725 13.463 -4.485 1.00 0.00 N ATOM 527 CA LYS A 33 2.900 13.472 -5.682 1.00 0.00 C ATOM 528 C LYS A 33 2.330 12.079 -5.946 1.00 0.00 C ATOM 529 O LYS A 33 1.168 11.954 -6.343 1.00 0.00 O ATOM 530 CB LYS A 33 3.679 13.933 -6.914 1.00 0.00 C ATOM 531 CG LYS A 33 2.792 14.404 -8.068 1.00 0.00 C ATOM 532 CD LYS A 33 3.503 15.356 -9.014 1.00 0.00 C ATOM 533 CE LYS A 33 2.883 15.488 -10.341 1.00 0.00 C ATOM 534 NZ LYS A 33 3.899 15.755 -11.390 1.00 0.00 N ATOM 0 H LYS A 33 4.728 13.453 -4.670 1.00 0.00 H new ATOM 0 HA LYS A 33 2.091 14.180 -5.504 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.346 14.746 -6.627 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.307 13.113 -7.263 1.00 0.00 H new ATOM 0 HG2 LYS A 33 2.444 13.536 -8.629 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.909 14.897 -7.662 1.00 0.00 H new ATOM 0 HD2 LYS A 33 3.547 16.341 -8.550 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.531 15.018 -9.141 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.340 14.575 -10.583 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.154 16.298 -10.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 3.429 15.843 -12.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.400 16.640 -11.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.580 14.970 -11.421 1.00 0.00 H new ATOM 548 N HIS A 34 3.037 11.072 -5.439 1.00 0.00 N ATOM 549 CA HIS A 34 2.524 9.712 -5.408 1.00 0.00 C ATOM 550 C HIS A 34 1.466 9.566 -4.318 1.00 0.00 C ATOM 551 O HIS A 34 0.492 8.832 -4.491 1.00 0.00 O ATOM 552 CB HIS A 34 3.597 8.621 -5.211 1.00 0.00 C ATOM 553 CG HIS A 34 4.392 8.351 -6.466 1.00 0.00 C ATOM 554 ND1 HIS A 34 5.572 8.975 -6.783 1.00 0.00 N ATOM 555 CD2 HIS A 34 4.289 7.301 -7.322 1.00 0.00 C ATOM 556 CE1 HIS A 34 6.209 8.265 -7.705 1.00 0.00 C ATOM 557 NE2 HIS A 34 5.415 7.295 -8.102 1.00 0.00 N ATOM 0 H HIS A 34 3.971 11.177 -5.043 1.00 0.00 H new ATOM 0 HA HIS A 34 2.096 9.552 -6.398 1.00 0.00 H new ATOM 0 HB2 HIS A 34 4.276 8.925 -4.414 1.00 0.00 H new ATOM 0 HB3 HIS A 34 3.116 7.699 -4.885 1.00 0.00 H new ATOM 0 HD2 HIS A 34 3.470 6.600 -7.377 1.00 0.00 H new ATOM 0 HE1 HIS A 34 7.209 8.452 -8.068 1.00 0.00 H new ATOM 0 HE2 HIS A 34 5.606 6.645 -8.865 1.00 0.00 H new ATOM 565 N ILE A 35 1.775 10.114 -3.144 1.00 0.00 N ATOM 566 CA ILE A 35 0.881 10.011 -2.003 1.00 0.00 C ATOM 567 C ILE A 35 -0.458 10.703 -2.329 1.00 0.00 C ATOM 568 O ILE A 35 -1.460 10.393 -1.671 1.00 0.00 O ATOM 569 CB ILE A 35 1.529 10.532 -0.683 1.00 0.00 C ATOM 570 CG1 ILE A 35 0.960 9.700 0.512 1.00 0.00 C ATOM 571 CG2 ILE A 35 1.382 12.046 -0.425 1.00 0.00 C ATOM 572 CD1 ILE A 35 1.947 9.535 1.690 1.00 0.00 C ATOM 0 H ILE A 35 2.635 10.631 -2.963 1.00 0.00 H new ATOM 0 HA ILE A 35 0.680 8.956 -1.817 1.00 0.00 H new ATOM 0 HB ILE A 35 2.605 10.390 -0.788 1.00 0.00 H new ATOM 0 HG12 ILE A 35 0.052 10.181 0.877 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.674 8.712 0.150 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.867 12.303 0.517 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.851 12.601 -1.238 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.325 12.305 -0.372 1.00 0.00 H new ATOM 0 HD11 ILE A 35 1.478 8.946 2.478 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.846 9.025 1.343 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.215 10.517 2.081 1.00 0.00 H new ATOM 584 N VAL A 36 -0.287 11.956 -2.787 1.00 0.00 N ATOM 585 CA VAL A 36 -1.433 12.831 -3.016 1.00 0.00 C ATOM 586 C VAL A 36 -2.311 12.221 -4.124 1.00 0.00 C ATOM 587 O VAL A 36 -3.476 11.888 -3.833 1.00 0.00 O ATOM 588 CB VAL A 36 -0.969 14.263 -3.318 1.00 0.00 C ATOM 589 CG1 VAL A 36 -2.110 15.183 -3.743 1.00 0.00 C ATOM 590 CG2 VAL A 36 -0.201 14.867 -2.149 1.00 0.00 C ATOM 0 H VAL A 36 0.619 12.373 -3.000 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.045 12.905 -2.117 1.00 0.00 H new ATOM 0 HB VAL A 36 -0.292 14.180 -4.168 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -1.718 16.180 -3.942 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.578 14.790 -4.646 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.850 15.237 -2.945 1.00 0.00 H new ATOM 0 HG21 VAL A 36 0.110 15.880 -2.403 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.842 14.894 -1.268 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.679 14.259 -1.939 1.00 0.00 H new ATOM 600 N TRP A 37 -1.618 11.566 -5.057 1.00 0.00 N ATOM 601 CA TRP A 37 -2.235 10.634 -5.990 1.00 0.00 C ATOM 602 C TRP A 37 -2.945 9.511 -5.235 1.00 0.00 C ATOM 603 O TRP A 37 -4.083 9.165 -5.536 1.00 0.00 O ATOM 604 CB TRP A 37 -1.197 10.092 -6.979 1.00 0.00 C ATOM 605 CG TRP A 37 -1.740 9.156 -8.002 1.00 0.00 C ATOM 606 CD1 TRP A 37 -2.040 9.433 -9.308 1.00 0.00 C ATOM 607 CD2 TRP A 37 -1.935 7.741 -7.844 1.00 0.00 C ATOM 608 NE1 TRP A 37 -2.435 8.289 -9.961 1.00 0.00 N ATOM 609 CE2 TRP A 37 -2.375 7.239 -9.089 1.00 0.00 C ATOM 610 CE3 TRP A 37 -1.785 6.870 -6.770 1.00 0.00 C ATOM 611 CZ2 TRP A 37 -2.659 5.895 -9.287 1.00 0.00 C ATOM 612 CZ3 TRP A 37 -2.054 5.532 -6.969 1.00 0.00 C ATOM 613 CH2 TRP A 37 -2.462 5.045 -8.209 1.00 0.00 C ATOM 0 H TRP A 37 -0.611 11.670 -5.184 1.00 0.00 H new ATOM 0 HA TRP A 37 -2.989 11.165 -6.570 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -0.728 10.933 -7.489 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -0.414 9.581 -6.419 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -1.976 10.411 -9.762 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -2.725 8.233 -10.937 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -1.466 7.232 -5.804 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -3.017 5.528 -10.237 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.946 4.845 -6.143 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.628 3.985 -8.333 1.00 0.00 H new ATOM 624 N ALA A 38 -2.157 8.819 -4.415 1.00 0.00 N ATOM 625 CA ALA A 38 -2.617 7.616 -3.734 1.00 0.00 C ATOM 626 C ALA A 38 -3.787 7.953 -2.811 1.00 0.00 C ATOM 627 O ALA A 38 -4.934 7.611 -3.074 1.00 0.00 O ATOM 628 CB ALA A 38 -1.463 7.021 -2.922 1.00 0.00 C ATOM 0 H ALA A 38 -1.192 9.075 -4.207 1.00 0.00 H new ATOM 0 HA ALA A 38 -2.953 6.888 -4.472 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.804 6.121 -2.411 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.640 6.769 -3.590 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -1.123 7.749 -2.186 1.00 0.00 H new ATOM 634 N SER A 39 -3.468 8.669 -1.735 1.00 0.00 N ATOM 635 CA SER A 39 -4.410 8.927 -0.665 1.00 0.00 C ATOM 636 C SER A 39 -5.659 9.636 -1.197 1.00 0.00 C ATOM 637 O SER A 39 -6.767 9.350 -0.731 1.00 0.00 O ATOM 638 CB SER A 39 -3.773 9.736 0.462 1.00 0.00 C ATOM 639 OG SER A 39 -4.736 10.133 1.420 1.00 0.00 O ATOM 0 H SER A 39 -2.548 9.084 -1.587 1.00 0.00 H new ATOM 0 HA SER A 39 -4.708 7.963 -0.254 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.999 9.141 0.947 1.00 0.00 H new ATOM 0 HB3 SER A 39 -3.284 10.618 0.048 1.00 0.00 H new ATOM 0 HG SER A 39 -4.298 10.648 2.130 1.00 0.00 H new ATOM 645 N ARG A 40 -5.506 10.219 -2.383 1.00 0.00 N ATOM 646 CA ARG A 40 -6.638 10.662 -3.183 1.00 0.00 C ATOM 647 C ARG A 40 -7.424 9.458 -3.702 1.00 0.00 C ATOM 648 O ARG A 40 -8.638 9.377 -3.514 1.00 0.00 O ATOM 649 CB ARG A 40 -6.201 11.539 -4.362 1.00 0.00 C ATOM 650 CG ARG A 40 -7.344 12.070 -5.216 1.00 0.00 C ATOM 651 CD ARG A 40 -6.881 12.451 -6.581 1.00 0.00 C ATOM 652 NE ARG A 40 -7.148 13.851 -6.879 1.00 0.00 N ATOM 653 CZ ARG A 40 -7.168 14.344 -8.119 1.00 0.00 C ATOM 654 NH1 ARG A 40 -7.135 13.549 -9.184 1.00 0.00 N ATOM 655 NH2 ARG A 40 -7.275 15.662 -8.294 1.00 0.00 N ATOM 0 H ARG A 40 -4.598 10.396 -2.812 1.00 0.00 H new ATOM 0 HA ARG A 40 -7.274 11.265 -2.535 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -5.630 12.384 -3.977 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -5.528 10.962 -4.997 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -8.123 11.311 -5.294 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -7.791 12.936 -4.728 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -5.811 12.260 -6.667 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -7.377 11.822 -7.320 1.00 0.00 H new ATOM 0 HE ARG A 40 -7.329 14.486 -6.102 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -7.093 12.537 -9.064 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.151 13.951 -10.121 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -7.340 16.280 -7.485 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -7.291 16.052 -9.236 1.00 0.00 H new ATOM 669 N GLU A 41 -6.770 8.695 -4.573 1.00 0.00 N ATOM 670 CA GLU A 41 -7.430 7.650 -5.335 1.00 0.00 C ATOM 671 C GLU A 41 -8.024 6.600 -4.398 1.00 0.00 C ATOM 672 O GLU A 41 -9.143 6.127 -4.628 1.00 0.00 O ATOM 673 CB GLU A 41 -6.391 7.022 -6.275 1.00 0.00 C ATOM 674 CG GLU A 41 -6.689 6.456 -7.541 1.00 0.00 C ATOM 675 CD GLU A 41 -7.857 7.024 -8.289 1.00 0.00 C ATOM 676 OE1 GLU A 41 -8.927 6.441 -8.008 1.00 0.00 O ATOM 677 OE2 GLU A 41 -7.781 7.946 -9.082 1.00 0.00 O ATOM 0 H GLU A 41 -5.773 8.786 -4.767 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.252 8.067 -5.917 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.644 7.795 -6.458 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -5.901 6.235 -5.701 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.805 6.554 -8.171 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.864 5.389 -7.401 1.00 0.00 H new ATOM 684 N LEU A 42 -7.407 6.473 -3.224 1.00 0.00 N ATOM 685 CA LEU A 42 -7.963 5.672 -2.148 1.00 0.00 C ATOM 686 C LEU A 42 -9.328 6.235 -1.725 1.00 0.00 C ATOM 687 O LEU A 42 -10.304 5.489 -1.629 1.00 0.00 O ATOM 688 CB LEU A 42 -6.960 5.681 -0.971 1.00 0.00 C ATOM 689 CG LEU A 42 -7.482 5.031 0.306 1.00 0.00 C ATOM 690 CD1 LEU A 42 -6.723 3.757 0.619 1.00 0.00 C ATOM 691 CD2 LEU A 42 -7.393 6.020 1.455 1.00 0.00 C ATOM 0 H LEU A 42 -6.518 6.919 -2.999 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.122 4.645 -2.476 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -6.050 5.166 -1.281 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -6.684 6.713 -0.753 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.527 4.757 0.160 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -7.116 3.315 1.534 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -6.840 3.052 -0.204 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -5.666 3.987 0.752 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -7.767 5.553 2.366 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.354 6.318 1.599 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.994 6.900 1.225 1.00 0.00 H new ATOM 703 N GLU A 43 -9.268 7.432 -1.149 1.00 0.00 N ATOM 704 CA GLU A 43 -10.418 8.030 -0.485 1.00 0.00 C ATOM 705 C GLU A 43 -11.566 8.200 -1.487 1.00 0.00 C ATOM 706 O GLU A 43 -12.716 7.883 -1.161 1.00 0.00 O ATOM 707 CB GLU A 43 -9.970 9.398 0.056 1.00 0.00 C ATOM 708 CG GLU A 43 -10.864 10.412 0.489 1.00 0.00 C ATOM 709 CD GLU A 43 -10.364 11.824 0.463 1.00 0.00 C ATOM 710 OE1 GLU A 43 -9.247 12.151 0.101 1.00 0.00 O ATOM 711 OE2 GLU A 43 -11.212 12.634 0.900 1.00 0.00 O ATOM 0 H GLU A 43 -8.427 8.009 -1.130 1.00 0.00 H new ATOM 0 HA GLU A 43 -10.774 7.397 0.328 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -9.313 9.191 0.900 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -9.355 9.847 -0.724 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.759 10.360 -0.130 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.168 10.180 1.510 1.00 0.00 H new ATOM 718 N ARG A 44 -11.172 8.182 -2.767 1.00 0.00 N ATOM 719 CA ARG A 44 -12.127 8.329 -3.853 1.00 0.00 C ATOM 720 C ARG A 44 -12.530 6.970 -4.416 1.00 0.00 C ATOM 721 O ARG A 44 -13.570 6.843 -5.066 1.00 0.00 O ATOM 722 CB ARG A 44 -11.573 9.211 -4.981 1.00 0.00 C ATOM 723 CG ARG A 44 -12.610 9.652 -6.005 1.00 0.00 C ATOM 724 CD ARG A 44 -12.928 11.104 -5.876 1.00 0.00 C ATOM 725 NE ARG A 44 -13.942 11.530 -6.830 1.00 0.00 N ATOM 726 CZ ARG A 44 -15.220 11.153 -6.756 1.00 0.00 C ATOM 727 NH1 ARG A 44 -15.698 10.521 -5.690 1.00 0.00 N ATOM 728 NH2 ARG A 44 -16.049 11.467 -7.753 1.00 0.00 N ATOM 0 H ARG A 44 -10.204 8.067 -3.066 1.00 0.00 H new ATOM 0 HA ARG A 44 -13.008 8.817 -3.436 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -11.116 10.097 -4.541 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -10.782 8.666 -5.496 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -12.239 9.448 -7.010 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -13.521 9.067 -5.876 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -13.274 11.310 -4.863 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -12.020 11.688 -6.027 1.00 0.00 H new ATOM 0 HE ARG A 44 -13.662 12.147 -7.592 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -15.084 10.313 -4.903 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -16.679 10.244 -5.659 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -15.703 11.989 -8.558 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -17.028 11.185 -7.710 1.00 0.00 H new ATOM 742 N PHE A 45 -11.779 5.938 -4.043 1.00 0.00 N ATOM 743 CA PHE A 45 -12.267 4.561 -4.136 1.00 0.00 C ATOM 744 C PHE A 45 -13.490 4.384 -3.243 1.00 0.00 C ATOM 745 O PHE A 45 -14.614 4.270 -3.723 1.00 0.00 O ATOM 746 CB PHE A 45 -11.205 3.501 -3.751 1.00 0.00 C ATOM 747 CG PHE A 45 -10.665 2.771 -4.948 1.00 0.00 C ATOM 748 CD1 PHE A 45 -11.477 2.147 -5.894 1.00 0.00 C ATOM 749 CD2 PHE A 45 -9.283 2.819 -5.153 1.00 0.00 C ATOM 750 CE1 PHE A 45 -10.917 1.549 -7.028 1.00 0.00 C ATOM 751 CE2 PHE A 45 -8.711 2.256 -6.284 1.00 0.00 C ATOM 752 CZ PHE A 45 -9.530 1.642 -7.234 1.00 0.00 C ATOM 0 H PHE A 45 -10.832 6.026 -3.674 1.00 0.00 H new ATOM 0 HA PHE A 45 -12.520 4.397 -5.184 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -10.384 3.988 -3.225 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -11.646 2.783 -3.059 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -12.547 2.125 -5.750 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -8.652 3.301 -4.421 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -11.542 1.023 -7.735 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -7.641 2.292 -6.429 1.00 0.00 H new ATOM 0 HZ PHE A 45 -9.094 1.235 -8.134 1.00 0.00 H new ATOM 762 N ALA A 46 -13.276 4.572 -1.937 1.00 0.00 N ATOM 763 CA ALA A 46 -14.282 4.156 -0.959 1.00 0.00 C ATOM 764 C ALA A 46 -13.895 4.615 0.443 1.00 0.00 C ATOM 765 O ALA A 46 -14.389 4.073 1.436 1.00 0.00 O ATOM 766 CB ALA A 46 -14.444 2.637 -1.003 1.00 0.00 C ATOM 0 H ALA A 46 -12.438 4.998 -1.541 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.234 4.622 -1.212 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -15.194 2.330 -0.274 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -14.762 2.334 -2.000 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -13.492 2.163 -0.766 1.00 0.00 H new ATOM 772 N VAL A 47 -12.875 5.467 0.521 1.00 0.00 N ATOM 773 CA VAL A 47 -12.067 5.587 1.732 1.00 0.00 C ATOM 774 C VAL A 47 -12.116 7.010 2.273 1.00 0.00 C ATOM 775 O VAL A 47 -12.490 7.946 1.570 1.00 0.00 O ATOM 776 CB VAL A 47 -10.640 5.062 1.482 1.00 0.00 C ATOM 777 CG1 VAL A 47 -9.845 4.905 2.774 1.00 0.00 C ATOM 778 CG2 VAL A 47 -10.649 3.764 0.690 1.00 0.00 C ATOM 0 H VAL A 47 -12.589 6.084 -0.239 1.00 0.00 H new ATOM 0 HA VAL A 47 -12.487 4.957 2.516 1.00 0.00 H new ATOM 0 HB VAL A 47 -10.135 5.819 0.882 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -8.847 4.533 2.544 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.766 5.871 3.272 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -10.353 4.199 3.431 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.625 3.426 0.534 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -11.202 3.004 1.243 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.127 3.930 -0.275 1.00 0.00 H new ATOM 788 N ASN A 48 -11.601 7.173 3.488 1.00 0.00 N ATOM 789 CA ASN A 48 -11.436 8.480 4.094 1.00 0.00 C ATOM 790 C ASN A 48 -9.929 8.735 4.353 1.00 0.00 C ATOM 791 O ASN A 48 -9.140 7.781 4.482 1.00 0.00 O ATOM 792 CB ASN A 48 -12.304 8.652 5.332 1.00 0.00 C ATOM 793 CG ASN A 48 -12.050 9.938 6.093 1.00 0.00 C ATOM 794 OD1 ASN A 48 -10.931 10.184 6.568 1.00 0.00 O ATOM 795 ND2 ASN A 48 -13.070 10.794 6.166 1.00 0.00 N ATOM 0 H ASN A 48 -11.288 6.400 4.076 1.00 0.00 H new ATOM 0 HA ASN A 48 -11.789 9.246 3.403 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -13.352 8.619 5.035 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -12.136 7.808 6.001 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -12.947 11.695 6.628 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -13.973 10.547 5.760 1.00 0.00 H new ATOM 802 N PRO A 49 -9.511 9.974 4.011 1.00 0.00 N ATOM 803 CA PRO A 49 -8.078 10.343 3.896 1.00 0.00 C ATOM 804 C PRO A 49 -7.341 10.348 5.237 1.00 0.00 C ATOM 805 O PRO A 49 -6.479 9.499 5.477 1.00 0.00 O ATOM 806 CB PRO A 49 -8.060 11.719 3.226 1.00 0.00 C ATOM 807 CG PRO A 49 -9.412 12.342 3.435 1.00 0.00 C ATOM 808 CD PRO A 49 -10.343 11.196 3.813 1.00 0.00 C ATOM 0 HA PRO A 49 -7.540 9.599 3.308 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.279 12.345 3.657 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -7.842 11.624 2.162 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -9.378 13.095 4.223 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -9.756 12.843 2.530 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -10.892 11.435 4.724 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.082 11.031 3.029 1.00 0.00 H new ATOM 816 N GLY A 50 -7.981 11.014 6.199 1.00 0.00 N ATOM 817 CA GLY A 50 -7.527 10.986 7.591 1.00 0.00 C ATOM 818 C GLY A 50 -7.583 9.552 8.110 1.00 0.00 C ATOM 819 O GLY A 50 -6.788 9.115 8.932 1.00 0.00 O ATOM 0 H GLY A 50 -8.815 11.579 6.040 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -6.510 11.371 7.662 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -8.156 11.632 8.204 1.00 0.00 H new ATOM 823 N LEU A 51 -8.559 8.823 7.569 1.00 0.00 N ATOM 824 CA LEU A 51 -8.761 7.421 7.915 1.00 0.00 C ATOM 825 C LEU A 51 -7.520 6.608 7.541 1.00 0.00 C ATOM 826 O LEU A 51 -6.787 6.180 8.449 1.00 0.00 O ATOM 827 CB LEU A 51 -10.043 6.974 7.191 1.00 0.00 C ATOM 828 CG LEU A 51 -10.929 5.965 7.885 1.00 0.00 C ATOM 829 CD1 LEU A 51 -12.168 5.650 7.054 1.00 0.00 C ATOM 830 CD2 LEU A 51 -10.134 4.688 8.135 1.00 0.00 C ATOM 0 H LEU A 51 -9.224 9.185 6.886 1.00 0.00 H new ATOM 0 HA LEU A 51 -8.892 7.264 8.986 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -10.641 7.863 6.990 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.755 6.559 6.225 1.00 0.00 H new ATOM 0 HG LEU A 51 -11.262 6.389 8.832 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -12.784 4.921 7.581 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -12.742 6.563 6.896 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -11.865 5.240 6.091 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -10.768 3.957 8.636 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.791 4.281 7.184 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -9.273 4.913 8.765 1.00 0.00 H new ATOM 842 N LEU A 52 -7.011 6.923 6.339 1.00 0.00 N ATOM 843 CA LEU A 52 -5.818 6.238 5.839 1.00 0.00 C ATOM 844 C LEU A 52 -4.562 6.915 6.361 1.00 0.00 C ATOM 845 O LEU A 52 -3.504 6.284 6.456 1.00 0.00 O ATOM 846 CB LEU A 52 -5.944 6.097 4.329 1.00 0.00 C ATOM 847 CG LEU A 52 -4.933 6.716 3.398 1.00 0.00 C ATOM 848 CD1 LEU A 52 -4.895 8.231 3.513 1.00 0.00 C ATOM 849 CD2 LEU A 52 -3.552 6.126 3.662 1.00 0.00 C ATOM 0 H LEU A 52 -7.398 7.629 5.713 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.730 5.220 6.220 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.966 5.029 4.110 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.919 6.499 4.052 1.00 0.00 H new ATOM 0 HG LEU A 52 -5.239 6.482 2.378 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.152 8.630 2.823 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.875 8.639 3.266 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.631 8.512 4.533 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.827 6.579 2.985 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -3.261 6.328 4.693 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.579 5.049 3.497 1.00 0.00 H new ATOM 861 N GLU A 53 -4.743 8.108 6.916 1.00 0.00 N ATOM 862 CA GLU A 53 -3.648 8.850 7.526 1.00 0.00 C ATOM 863 C GLU A 53 -3.158 8.138 8.781 1.00 0.00 C ATOM 864 O GLU A 53 -1.971 8.173 9.110 1.00 0.00 O ATOM 865 CB GLU A 53 -4.166 10.259 7.839 1.00 0.00 C ATOM 866 CG GLU A 53 -3.726 11.077 8.910 1.00 0.00 C ATOM 867 CD GLU A 53 -4.195 12.501 8.922 1.00 0.00 C ATOM 868 OE1 GLU A 53 -4.202 13.227 7.944 1.00 0.00 O ATOM 869 OE2 GLU A 53 -4.670 12.831 10.031 1.00 0.00 O ATOM 0 H GLU A 53 -5.644 8.584 6.956 1.00 0.00 H new ATOM 0 HA GLU A 53 -2.795 8.914 6.850 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -4.005 10.843 6.933 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -5.244 10.158 7.965 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -4.041 10.610 9.843 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.636 11.080 8.907 1.00 0.00 H new ATOM 876 N THR A 54 -4.110 7.658 9.580 1.00 0.00 N ATOM 877 CA THR A 54 -3.787 6.694 10.628 1.00 0.00 C ATOM 878 C THR A 54 -3.304 5.387 10.001 1.00 0.00 C ATOM 879 O THR A 54 -3.820 4.967 8.961 1.00 0.00 O ATOM 880 CB THR A 54 -5.010 6.446 11.598 1.00 0.00 C ATOM 881 OG1 THR A 54 -5.950 5.588 10.891 1.00 0.00 O ATOM 882 CG2 THR A 54 -5.659 7.730 12.118 1.00 0.00 C ATOM 0 H THR A 54 -5.095 7.916 9.523 1.00 0.00 H new ATOM 0 HA THR A 54 -2.984 7.110 11.236 1.00 0.00 H new ATOM 0 HB THR A 54 -4.656 5.959 12.507 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.312 6.067 10.117 1.00 0.00 H new ATOM 0 HG21 THR A 54 -6.490 7.477 12.777 1.00 0.00 H new ATOM 0 HG22 THR A 54 -4.922 8.312 12.671 1.00 0.00 H new ATOM 0 HG23 THR A 54 -6.028 8.317 11.277 1.00 0.00 H new ATOM 890 N SER A 55 -2.555 4.618 10.787 1.00 0.00 N ATOM 891 CA SER A 55 -2.329 3.206 10.528 1.00 0.00 C ATOM 892 C SER A 55 -3.649 2.448 10.441 1.00 0.00 C ATOM 893 O SER A 55 -3.953 1.815 9.425 1.00 0.00 O ATOM 894 CB SER A 55 -1.416 2.588 11.587 1.00 0.00 C ATOM 895 OG SER A 55 -1.353 3.396 12.746 1.00 0.00 O ATOM 0 H SER A 55 -2.087 4.963 11.625 1.00 0.00 H new ATOM 0 HA SER A 55 -1.827 3.123 9.564 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.782 1.596 11.852 1.00 0.00 H new ATOM 0 HB3 SER A 55 -0.415 2.459 11.176 1.00 0.00 H new ATOM 0 HG SER A 55 -0.764 2.975 13.406 1.00 0.00 H new ATOM 901 N GLU A 56 -4.549 2.768 11.372 1.00 0.00 N ATOM 902 CA GLU A 56 -5.713 1.922 11.603 1.00 0.00 C ATOM 903 C GLU A 56 -6.592 1.874 10.355 1.00 0.00 C ATOM 904 O GLU A 56 -6.816 0.798 9.791 1.00 0.00 O ATOM 905 CB GLU A 56 -6.475 2.499 12.800 1.00 0.00 C ATOM 906 CG GLU A 56 -7.116 1.720 13.800 1.00 0.00 C ATOM 907 CD GLU A 56 -8.403 2.250 14.357 1.00 0.00 C ATOM 908 OE1 GLU A 56 -9.504 1.997 13.900 1.00 0.00 O ATOM 909 OE2 GLU A 56 -8.224 2.946 15.380 1.00 0.00 O ATOM 0 H GLU A 56 -4.494 3.594 11.968 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.409 0.897 11.818 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.769 3.142 13.325 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.246 3.147 12.383 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.309 0.730 13.386 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.418 1.590 14.627 1.00 0.00 H new ATOM 916 N GLY A 57 -6.845 3.054 9.799 1.00 0.00 N ATOM 917 CA GLY A 57 -7.582 3.170 8.550 1.00 0.00 C ATOM 918 C GLY A 57 -6.774 2.578 7.399 1.00 0.00 C ATOM 919 O GLY A 57 -7.302 1.824 6.582 1.00 0.00 O ATOM 0 H GLY A 57 -6.549 3.945 10.197 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -8.538 2.653 8.635 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -7.803 4.218 8.347 1.00 0.00 H new ATOM 923 N CYS A 58 -5.456 2.722 7.510 1.00 0.00 N ATOM 924 CA CYS A 58 -4.542 2.210 6.497 1.00 0.00 C ATOM 925 C CYS A 58 -4.549 0.683 6.501 1.00 0.00 C ATOM 926 O CYS A 58 -4.412 0.052 5.455 1.00 0.00 O ATOM 927 CB CYS A 58 -3.134 2.764 6.701 1.00 0.00 C ATOM 928 SG CYS A 58 -2.218 3.071 5.174 1.00 0.00 S ATOM 0 H CYS A 58 -4.998 3.190 8.292 1.00 0.00 H new ATOM 0 HA CYS A 58 -4.884 2.546 5.518 1.00 0.00 H new ATOM 0 HB2 CYS A 58 -3.202 3.696 7.262 1.00 0.00 H new ATOM 0 HB3 CYS A 58 -2.567 2.063 7.315 1.00 0.00 H new ATOM 0 HG CYS A 58 -1.551 4.181 5.284 1.00 0.00 H new ATOM 933 N ARG A 59 -4.937 0.125 7.645 1.00 0.00 N ATOM 934 CA ARG A 59 -5.157 -1.304 7.773 1.00 0.00 C ATOM 935 C ARG A 59 -6.575 -1.662 7.320 1.00 0.00 C ATOM 936 O ARG A 59 -6.880 -2.834 7.099 1.00 0.00 O ATOM 937 CB ARG A 59 -4.949 -1.800 9.209 1.00 0.00 C ATOM 938 CG ARG A 59 -4.617 -3.281 9.327 1.00 0.00 C ATOM 939 CD ARG A 59 -3.542 -3.526 10.330 1.00 0.00 C ATOM 940 NE ARG A 59 -3.238 -4.943 10.474 1.00 0.00 N ATOM 941 CZ ARG A 59 -2.976 -5.519 11.650 1.00 0.00 C ATOM 942 NH1 ARG A 59 -2.776 -4.797 12.748 1.00 0.00 N ATOM 943 NH2 ARG A 59 -2.857 -6.845 11.711 1.00 0.00 N ATOM 0 H ARG A 59 -5.106 0.652 8.502 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.421 -1.796 7.137 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.144 -1.223 9.665 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.853 -1.597 9.784 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -5.513 -3.833 9.611 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.302 -3.662 8.356 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -2.640 -2.991 10.032 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.848 -3.122 11.295 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.225 -5.524 9.636 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.821 -3.779 12.704 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -2.577 -5.261 13.634 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.966 -7.406 10.866 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.657 -7.299 12.602 1.00 0.00 H new ATOM 957 N GLN A 60 -7.491 -0.723 7.596 1.00 0.00 N ATOM 958 CA GLN A 60 -8.875 -0.890 7.157 1.00 0.00 C ATOM 959 C GLN A 60 -8.919 -0.900 5.619 1.00 0.00 C ATOM 960 O GLN A 60 -9.483 -1.852 5.053 1.00 0.00 O ATOM 961 CB GLN A 60 -9.810 0.174 7.721 1.00 0.00 C ATOM 962 CG GLN A 60 -10.809 -0.356 8.733 1.00 0.00 C ATOM 963 CD GLN A 60 -10.724 0.340 10.068 1.00 0.00 C ATOM 964 OE1 GLN A 60 -9.757 0.206 10.813 1.00 0.00 O ATOM 965 NE2 GLN A 60 -11.735 1.162 10.343 1.00 0.00 N ATOM 0 H GLN A 60 -7.302 0.138 8.109 1.00 0.00 H new ATOM 0 HA GLN A 60 -9.236 -1.842 7.546 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -9.213 0.956 8.190 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -10.353 0.639 6.898 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -11.817 -0.242 8.334 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -10.642 -1.424 8.875 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -12.518 1.242 9.695 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -11.726 1.712 11.202 1.00 0.00 H new ATOM 974 N ILE A 61 -7.882 -0.266 5.053 1.00 0.00 N ATOM 975 CA ILE A 61 -7.648 -0.330 3.622 1.00 0.00 C ATOM 976 C ILE A 61 -6.825 -1.555 3.255 1.00 0.00 C ATOM 977 O ILE A 61 -7.380 -2.551 2.779 1.00 0.00 O ATOM 978 CB ILE A 61 -7.056 1.007 3.066 1.00 0.00 C ATOM 979 CG1 ILE A 61 -7.989 2.200 3.378 1.00 0.00 C ATOM 980 CG2 ILE A 61 -6.694 0.914 1.563 1.00 0.00 C ATOM 981 CD1 ILE A 61 -9.504 1.960 3.207 1.00 0.00 C ATOM 0 H ILE A 61 -7.201 0.291 5.569 1.00 0.00 H new ATOM 0 HA ILE A 61 -8.612 -0.449 3.127 1.00 0.00 H new ATOM 0 HB ILE A 61 -6.115 1.187 3.586 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.808 2.513 4.406 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -7.702 3.033 2.736 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -6.288 1.868 1.227 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.951 0.131 1.416 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -7.589 0.678 0.987 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -10.047 2.872 3.456 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -9.714 1.683 2.174 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -9.822 1.155 3.870 1.00 0.00 H new ATOM 993 N LEU A 62 -5.597 -1.609 3.769 1.00 0.00 N ATOM 994 CA LEU A 62 -4.632 -2.596 3.304 1.00 0.00 C ATOM 995 C LEU A 62 -5.148 -4.015 3.598 1.00 0.00 C ATOM 996 O LEU A 62 -5.040 -4.878 2.711 1.00 0.00 O ATOM 997 CB LEU A 62 -3.281 -2.297 3.965 1.00 0.00 C ATOM 998 CG LEU A 62 -2.029 -2.739 3.230 1.00 0.00 C ATOM 999 CD1 LEU A 62 -1.943 -2.112 1.847 1.00 0.00 C ATOM 1000 CD2 LEU A 62 -0.809 -2.342 4.059 1.00 0.00 C ATOM 0 H LEU A 62 -5.252 -0.987 4.500 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.498 -2.539 2.224 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.215 -1.221 4.124 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.277 -2.766 4.949 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.063 -3.820 3.098 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.034 -2.451 1.350 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.811 -2.409 1.258 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -1.922 -1.026 1.940 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.099 -2.654 3.543 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.797 -1.260 4.194 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.857 -2.828 5.033 1.00 0.00 H new ATOM 1012 N GLY A 63 -6.136 -4.055 4.494 1.00 0.00 N ATOM 1013 CA GLY A 63 -6.899 -5.265 4.749 1.00 0.00 C ATOM 1014 C GLY A 63 -7.936 -5.494 3.657 1.00 0.00 C ATOM 1015 O GLY A 63 -7.947 -6.532 2.999 1.00 0.00 O ATOM 0 H GLY A 63 -6.423 -3.254 5.056 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -6.225 -6.120 4.801 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -7.395 -5.190 5.717 1.00 0.00 H new ATOM 1019 N GLN A 64 -8.858 -4.546 3.534 1.00 0.00 N ATOM 1020 CA GLN A 64 -9.928 -4.621 2.558 1.00 0.00 C ATOM 1021 C GLN A 64 -9.371 -4.724 1.138 1.00 0.00 C ATOM 1022 O GLN A 64 -10.136 -4.925 0.188 1.00 0.00 O ATOM 1023 CB GLN A 64 -10.905 -3.443 2.668 1.00 0.00 C ATOM 1024 CG GLN A 64 -12.361 -3.847 2.559 1.00 0.00 C ATOM 1025 CD GLN A 64 -13.087 -3.153 1.432 1.00 0.00 C ATOM 1026 OE1 GLN A 64 -13.396 -3.740 0.398 1.00 0.00 O ATOM 1027 NE2 GLN A 64 -13.449 -1.896 1.682 1.00 0.00 N ATOM 0 H GLN A 64 -8.881 -3.705 4.111 1.00 0.00 H new ATOM 0 HA GLN A 64 -10.490 -5.528 2.780 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -10.747 -2.940 3.622 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -10.678 -2.720 1.885 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -12.422 -4.925 2.413 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -12.865 -3.624 3.499 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -13.169 -1.449 2.555 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -14.006 -1.381 1.001 1.00 0.00 H new ATOM 1036 N LEU A 65 -8.114 -4.330 0.973 1.00 0.00 N ATOM 1037 CA LEU A 65 -7.610 -3.853 -0.317 1.00 0.00 C ATOM 1038 C LEU A 65 -6.792 -4.949 -0.992 1.00 0.00 C ATOM 1039 O LEU A 65 -7.036 -5.279 -2.156 1.00 0.00 O ATOM 1040 CB LEU A 65 -6.823 -2.560 -0.062 1.00 0.00 C ATOM 1041 CG LEU A 65 -6.557 -1.662 -1.262 1.00 0.00 C ATOM 1042 CD1 LEU A 65 -7.831 -0.962 -1.708 1.00 0.00 C ATOM 1043 CD2 LEU A 65 -5.498 -0.637 -0.868 1.00 0.00 C ATOM 0 H LEU A 65 -7.418 -4.330 1.719 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.419 -3.621 -1.010 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -7.363 -1.977 0.684 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -5.863 -2.830 0.378 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.203 -2.264 -2.099 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -7.615 -0.326 -2.567 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -8.577 -1.707 -1.986 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.215 -0.351 -0.891 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.292 0.018 -1.715 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -5.861 -0.042 -0.030 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -4.583 -1.153 -0.577 1.00 0.00 H new ATOM 1055 N GLN A 66 -6.123 -5.748 -0.154 1.00 0.00 N ATOM 1056 CA GLN A 66 -5.261 -6.808 -0.643 1.00 0.00 C ATOM 1057 C GLN A 66 -6.094 -7.821 -1.474 1.00 0.00 C ATOM 1058 O GLN A 66 -5.965 -7.852 -2.715 1.00 0.00 O ATOM 1059 CB GLN A 66 -4.511 -7.539 0.468 1.00 0.00 C ATOM 1060 CG GLN A 66 -3.002 -7.413 0.379 1.00 0.00 C ATOM 1061 CD GLN A 66 -2.296 -8.745 0.362 1.00 0.00 C ATOM 1062 OE1 GLN A 66 -1.267 -8.929 -0.283 1.00 0.00 O ATOM 1063 NE2 GLN A 66 -2.838 -9.684 1.135 1.00 0.00 N ATOM 0 H GLN A 66 -6.167 -5.674 0.862 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.505 -6.334 -1.269 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.842 -7.151 1.432 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.780 -8.595 0.440 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -2.742 -6.860 -0.524 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -2.642 -6.829 1.226 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -3.694 -9.487 1.653 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -2.397 -10.601 1.209 1.00 0.00 H new ATOM 1072 N PRO A 67 -7.192 -8.293 -0.848 1.00 0.00 N ATOM 1073 CA PRO A 67 -8.309 -8.952 -1.578 1.00 0.00 C ATOM 1074 C PRO A 67 -8.821 -8.138 -2.762 1.00 0.00 C ATOM 1075 O PRO A 67 -8.818 -8.596 -3.905 1.00 0.00 O ATOM 1076 CB PRO A 67 -9.386 -9.247 -0.545 1.00 0.00 C ATOM 1077 CG PRO A 67 -9.029 -8.547 0.734 1.00 0.00 C ATOM 1078 CD PRO A 67 -7.573 -8.134 0.586 1.00 0.00 C ATOM 0 HA PRO A 67 -7.963 -9.876 -2.042 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -10.357 -8.907 -0.904 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -9.466 -10.321 -0.378 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -9.668 -7.679 0.896 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -9.164 -9.206 1.592 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -7.436 -7.101 0.904 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -6.936 -8.750 1.220 1.00 0.00 H new ATOM 1086 N SER A 68 -9.127 -6.872 -2.486 1.00 0.00 N ATOM 1087 CA SER A 68 -9.842 -6.039 -3.437 1.00 0.00 C ATOM 1088 C SER A 68 -9.009 -5.807 -4.694 1.00 0.00 C ATOM 1089 O SER A 68 -9.490 -5.198 -5.652 1.00 0.00 O ATOM 1090 CB SER A 68 -10.275 -4.717 -2.815 1.00 0.00 C ATOM 1091 OG SER A 68 -11.640 -4.748 -2.434 1.00 0.00 O ATOM 0 H SER A 68 -8.889 -6.405 -1.611 1.00 0.00 H new ATOM 0 HA SER A 68 -10.747 -6.574 -3.724 1.00 0.00 H new ATOM 0 HB2 SER A 68 -9.657 -4.504 -1.943 1.00 0.00 H new ATOM 0 HB3 SER A 68 -10.112 -3.908 -3.527 1.00 0.00 H new ATOM 0 HG SER A 68 -11.706 -4.802 -1.458 1.00 0.00 H new ATOM 1097 N LEU A 69 -7.704 -6.021 -4.555 1.00 0.00 N ATOM 1098 CA LEU A 69 -6.758 -5.735 -5.621 1.00 0.00 C ATOM 1099 C LEU A 69 -7.022 -6.643 -6.822 1.00 0.00 C ATOM 1100 O LEU A 69 -7.249 -6.139 -7.931 1.00 0.00 O ATOM 1101 CB LEU A 69 -5.339 -5.878 -5.044 1.00 0.00 C ATOM 1102 CG LEU A 69 -4.904 -4.820 -4.045 1.00 0.00 C ATOM 1103 CD1 LEU A 69 -3.506 -5.101 -3.517 1.00 0.00 C ATOM 1104 CD2 LEU A 69 -4.943 -3.459 -4.735 1.00 0.00 C ATOM 0 H LEU A 69 -7.278 -6.394 -3.707 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.872 -4.717 -5.993 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.263 -6.853 -4.563 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.632 -5.876 -5.873 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.583 -4.831 -3.192 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.224 -4.326 -2.804 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -3.492 -6.072 -3.022 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -2.798 -5.107 -4.346 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.633 -2.686 -4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -4.266 -3.465 -5.589 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.957 -3.253 -5.077 1.00 0.00 H new ATOM 1116 N GLN A 70 -7.441 -7.870 -6.508 1.00 0.00 N ATOM 1117 CA GLN A 70 -7.798 -8.841 -7.530 1.00 0.00 C ATOM 1118 C GLN A 70 -8.945 -8.317 -8.393 1.00 0.00 C ATOM 1119 O GLN A 70 -9.268 -8.893 -9.428 1.00 0.00 O ATOM 1120 CB GLN A 70 -8.112 -10.225 -6.963 1.00 0.00 C ATOM 1121 CG GLN A 70 -9.430 -10.318 -6.221 1.00 0.00 C ATOM 1122 CD GLN A 70 -10.242 -11.531 -6.608 1.00 0.00 C ATOM 1123 OE1 GLN A 70 -9.725 -12.632 -6.778 1.00 0.00 O ATOM 1124 NE2 GLN A 70 -11.534 -11.300 -6.824 1.00 0.00 N ATOM 0 H GLN A 70 -7.540 -8.210 -5.551 1.00 0.00 H new ATOM 0 HA GLN A 70 -6.918 -8.971 -8.160 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -8.119 -10.945 -7.781 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -7.308 -10.517 -6.287 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -9.236 -10.345 -5.149 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -10.015 -9.419 -6.416 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -11.918 -10.368 -6.669 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -12.140 -12.055 -7.145 1.00 0.00 H new ATOM 1133 N THR A 71 -9.615 -7.288 -7.883 1.00 0.00 N ATOM 1134 CA THR A 71 -10.925 -6.899 -8.408 1.00 0.00 C ATOM 1135 C THR A 71 -11.142 -5.401 -8.242 1.00 0.00 C ATOM 1136 O THR A 71 -12.236 -4.893 -8.514 1.00 0.00 O ATOM 1137 CB THR A 71 -12.080 -7.738 -7.723 1.00 0.00 C ATOM 1138 OG1 THR A 71 -13.343 -7.226 -8.213 1.00 0.00 O ATOM 1139 CG2 THR A 71 -11.984 -7.803 -6.198 1.00 0.00 C ATOM 0 H THR A 71 -9.278 -6.711 -7.113 1.00 0.00 H new ATOM 0 HA THR A 71 -10.952 -7.122 -9.475 1.00 0.00 H new ATOM 0 HB THR A 71 -11.980 -8.786 -8.005 1.00 0.00 H new ATOM 0 HG1 THR A 71 -13.205 -6.341 -8.611 1.00 0.00 H new ATOM 0 HG21 THR A 71 -12.811 -8.395 -5.806 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.039 -8.265 -5.912 1.00 0.00 H new ATOM 0 HG23 THR A 71 -12.033 -6.795 -5.787 1.00 0.00 H new ATOM 1147 N GLY A 72 -10.023 -4.685 -8.140 1.00 0.00 N ATOM 1148 CA GLY A 72 -10.018 -3.232 -8.219 1.00 0.00 C ATOM 1149 C GLY A 72 -9.380 -2.777 -9.528 1.00 0.00 C ATOM 1150 O GLY A 72 -10.071 -2.493 -10.504 1.00 0.00 O ATOM 0 H GLY A 72 -9.100 -5.097 -8.001 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.038 -2.854 -8.152 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -9.468 -2.817 -7.374 1.00 0.00 H new ATOM 1154 N SER A 73 -8.053 -2.843 -9.563 1.00 0.00 N ATOM 1155 CA SER A 73 -7.300 -2.606 -10.787 1.00 0.00 C ATOM 1156 C SER A 73 -5.801 -2.765 -10.515 1.00 0.00 C ATOM 1157 O SER A 73 -5.369 -2.681 -9.364 1.00 0.00 O ATOM 1158 CB SER A 73 -7.600 -1.237 -11.380 1.00 0.00 C ATOM 1159 OG SER A 73 -7.535 -0.222 -10.393 1.00 0.00 O ATOM 0 H SER A 73 -7.475 -3.060 -8.751 1.00 0.00 H new ATOM 0 HA SER A 73 -7.610 -3.348 -11.523 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.888 -1.019 -12.176 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.592 -1.244 -11.833 1.00 0.00 H new ATOM 0 HG SER A 73 -8.151 0.503 -10.628 1.00 0.00 H new ATOM 1165 N GLU A 74 -5.019 -2.749 -11.588 1.00 0.00 N ATOM 1166 CA GLU A 74 -3.592 -2.442 -11.496 1.00 0.00 C ATOM 1167 C GLU A 74 -3.404 -1.018 -10.970 1.00 0.00 C ATOM 1168 O GLU A 74 -2.454 -0.748 -10.233 1.00 0.00 O ATOM 1169 CB GLU A 74 -2.996 -2.600 -12.898 1.00 0.00 C ATOM 1170 CG GLU A 74 -3.262 -1.736 -13.992 1.00 0.00 C ATOM 1171 CD GLU A 74 -2.133 -0.876 -14.473 1.00 0.00 C ATOM 1172 OE1 GLU A 74 -1.554 -0.287 -13.535 1.00 0.00 O ATOM 1173 OE2 GLU A 74 -1.789 -0.786 -15.640 1.00 0.00 O ATOM 0 H GLU A 74 -5.347 -2.945 -12.534 1.00 0.00 H new ATOM 0 HA GLU A 74 -3.086 -3.116 -10.804 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -1.914 -2.595 -12.767 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -3.272 -3.601 -13.231 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -3.603 -2.345 -14.829 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -4.090 -1.083 -13.714 1.00 0.00 H new ATOM 1180 N GLU A 75 -4.500 -0.258 -11.040 1.00 0.00 N ATOM 1181 CA GLU A 75 -4.517 1.101 -10.522 1.00 0.00 C ATOM 1182 C GLU A 75 -4.787 1.095 -9.019 1.00 0.00 C ATOM 1183 O GLU A 75 -4.257 1.936 -8.290 1.00 0.00 O ATOM 1184 CB GLU A 75 -5.588 1.879 -11.292 1.00 0.00 C ATOM 1185 CG GLU A 75 -6.375 2.936 -10.767 1.00 0.00 C ATOM 1186 CD GLU A 75 -6.204 4.291 -11.386 1.00 0.00 C ATOM 1187 OE1 GLU A 75 -5.419 4.540 -12.286 1.00 0.00 O ATOM 1188 OE2 GLU A 75 -6.927 5.153 -10.842 1.00 0.00 O ATOM 0 H GLU A 75 -5.382 -0.565 -11.450 1.00 0.00 H new ATOM 0 HA GLU A 75 -3.549 1.583 -10.662 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -5.085 2.290 -12.167 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -6.296 1.132 -11.652 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.424 2.653 -10.858 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.159 3.021 -9.702 1.00 0.00 H new ATOM 1195 N LEU A 76 -5.372 -0.007 -8.549 1.00 0.00 N ATOM 1196 CA LEU A 76 -5.416 -0.310 -7.130 1.00 0.00 C ATOM 1197 C LEU A 76 -4.077 -0.867 -6.653 1.00 0.00 C ATOM 1198 O LEU A 76 -3.850 -0.978 -5.443 1.00 0.00 O ATOM 1199 CB LEU A 76 -6.604 -1.236 -6.841 1.00 0.00 C ATOM 1200 CG LEU A 76 -7.498 -0.913 -5.661 1.00 0.00 C ATOM 1201 CD1 LEU A 76 -8.426 -2.081 -5.336 1.00 0.00 C ATOM 1202 CD2 LEU A 76 -6.652 -0.587 -4.434 1.00 0.00 C ATOM 0 H LEU A 76 -5.823 -0.705 -9.140 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.576 0.603 -6.557 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -7.229 -1.263 -7.734 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.213 -2.243 -6.695 1.00 0.00 H new ATOM 0 HG LEU A 76 -8.105 -0.049 -5.931 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -9.055 -1.820 -4.485 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -9.055 -2.297 -6.200 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -7.831 -2.961 -5.091 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -7.305 -0.357 -3.592 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -6.027 -1.445 -4.184 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -6.018 0.274 -4.647 1.00 0.00 H new ATOM 1214 N ARG A 77 -3.389 -1.544 -7.571 1.00 0.00 N ATOM 1215 CA ARG A 77 -2.080 -2.106 -7.276 1.00 0.00 C ATOM 1216 C ARG A 77 -1.094 -0.982 -6.927 1.00 0.00 C ATOM 1217 O ARG A 77 -0.433 -1.058 -5.885 1.00 0.00 O ATOM 1218 CB ARG A 77 -1.529 -2.929 -8.444 1.00 0.00 C ATOM 1219 CG ARG A 77 -1.514 -4.434 -8.212 1.00 0.00 C ATOM 1220 CD ARG A 77 -0.704 -4.798 -7.015 1.00 0.00 C ATOM 1221 NE ARG A 77 0.139 -5.959 -7.255 1.00 0.00 N ATOM 1222 CZ ARG A 77 1.448 -5.874 -7.508 1.00 0.00 C ATOM 1223 NH1 ARG A 77 2.037 -4.705 -7.741 1.00 0.00 N ATOM 1224 NH2 ARG A 77 2.170 -6.993 -7.578 1.00 0.00 N ATOM 0 H ARG A 77 -3.718 -1.714 -8.521 1.00 0.00 H new ATOM 0 HA ARG A 77 -2.198 -2.776 -6.424 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -2.125 -2.718 -9.332 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -0.512 -2.598 -8.656 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -2.535 -4.793 -8.083 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -1.109 -4.934 -9.092 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -0.080 -3.951 -6.729 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -1.370 -5.001 -6.176 1.00 0.00 H new ATOM 0 HE ARG A 77 -0.291 -6.884 -7.229 1.00 0.00 H new ATOM 0 HH11 ARG A 77 1.488 -3.846 -7.729 1.00 0.00 H new ATOM 0 HH12 ARG A 77 3.038 -4.667 -7.932 1.00 0.00 H new ATOM 0 HH21 ARG A 77 1.722 -7.899 -7.439 1.00 0.00 H new ATOM 0 HH22 ARG A 77 3.170 -6.943 -7.770 1.00 0.00 H new ATOM 1238 N SER A 78 -1.373 0.185 -7.508 1.00 0.00 N ATOM 1239 CA SER A 78 -0.708 1.419 -7.125 1.00 0.00 C ATOM 1240 C SER A 78 -1.206 1.898 -5.766 1.00 0.00 C ATOM 1241 O SER A 78 -0.433 2.010 -4.815 1.00 0.00 O ATOM 1242 CB SER A 78 -0.875 2.501 -8.186 1.00 0.00 C ATOM 1243 OG SER A 78 0.062 2.344 -9.236 1.00 0.00 O ATOM 0 H SER A 78 -2.062 0.296 -8.252 1.00 0.00 H new ATOM 0 HA SER A 78 0.359 1.210 -7.044 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.887 2.463 -8.590 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.751 3.483 -7.729 1.00 0.00 H new ATOM 0 HG SER A 78 -0.071 3.051 -9.901 1.00 0.00 H new ATOM 1249 N LEU A 79 -2.529 1.960 -5.635 1.00 0.00 N ATOM 1250 CA LEU A 79 -3.152 2.471 -4.424 1.00 0.00 C ATOM 1251 C LEU A 79 -2.773 1.603 -3.225 1.00 0.00 C ATOM 1252 O LEU A 79 -2.472 2.116 -2.149 1.00 0.00 O ATOM 1253 CB LEU A 79 -4.667 2.559 -4.667 1.00 0.00 C ATOM 1254 CG LEU A 79 -5.227 3.932 -5.004 1.00 0.00 C ATOM 1255 CD1 LEU A 79 -4.788 4.967 -3.980 1.00 0.00 C ATOM 1256 CD2 LEU A 79 -4.740 4.325 -6.394 1.00 0.00 C ATOM 0 H LEU A 79 -3.188 1.662 -6.355 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.793 3.472 -4.185 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.921 1.879 -5.480 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -5.176 2.194 -3.775 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.316 3.892 -4.985 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -5.202 5.940 -4.245 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.147 4.677 -2.992 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.700 5.028 -3.967 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -5.133 5.308 -6.653 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.650 4.355 -6.403 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -5.088 3.592 -7.122 1.00 0.00 H new ATOM 1268 N TYR A 80 -2.604 0.313 -3.494 1.00 0.00 N ATOM 1269 CA TYR A 80 -2.084 -0.619 -2.506 1.00 0.00 C ATOM 1270 C TYR A 80 -0.670 -0.224 -2.092 1.00 0.00 C ATOM 1271 O TYR A 80 -0.313 -0.288 -0.919 1.00 0.00 O ATOM 1272 CB TYR A 80 -2.114 -2.067 -3.041 1.00 0.00 C ATOM 1273 CG TYR A 80 -1.700 -3.112 -2.030 1.00 0.00 C ATOM 1274 CD1 TYR A 80 -2.570 -3.535 -1.022 1.00 0.00 C ATOM 1275 CD2 TYR A 80 -0.423 -3.670 -2.073 1.00 0.00 C ATOM 1276 CE1 TYR A 80 -2.216 -4.566 -0.150 1.00 0.00 C ATOM 1277 CE2 TYR A 80 -0.021 -4.630 -1.150 1.00 0.00 C ATOM 1278 CZ TYR A 80 -0.915 -5.066 -0.181 1.00 0.00 C ATOM 1279 OH TYR A 80 -0.450 -5.928 0.776 1.00 0.00 O ATOM 0 H TYR A 80 -2.822 -0.111 -4.396 1.00 0.00 H new ATOM 0 HA TYR A 80 -2.726 -0.575 -1.626 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.122 -2.293 -3.388 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -1.456 -2.136 -3.907 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.532 -3.056 -0.916 1.00 0.00 H new ATOM 0 HD2 TYR A 80 0.268 -3.350 -2.839 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -2.941 -4.971 0.540 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.980 -5.034 -1.187 1.00 0.00 H new ATOM 0 HH TYR A 80 0.481 -6.164 0.579 1.00 0.00 H new ATOM 1289 N ASN A 81 0.130 0.155 -3.085 1.00 0.00 N ATOM 1290 CA ASN A 81 1.579 0.265 -2.888 1.00 0.00 C ATOM 1291 C ASN A 81 1.891 1.478 -2.018 1.00 0.00 C ATOM 1292 O ASN A 81 2.601 1.361 -1.014 1.00 0.00 O ATOM 1293 CB ASN A 81 2.340 0.143 -4.182 1.00 0.00 C ATOM 1294 CG ASN A 81 2.629 1.433 -4.922 1.00 0.00 C ATOM 1295 OD1 ASN A 81 2.105 2.509 -4.602 1.00 0.00 O ATOM 1296 ND2 ASN A 81 3.516 1.334 -5.923 1.00 0.00 N ATOM 0 H ASN A 81 -0.192 0.389 -4.024 1.00 0.00 H new ATOM 0 HA ASN A 81 1.951 -0.590 -2.323 1.00 0.00 H new ATOM 0 HB2 ASN A 81 3.289 -0.351 -3.974 1.00 0.00 H new ATOM 0 HB3 ASN A 81 1.779 -0.513 -4.847 1.00 0.00 H new ATOM 0 HD21 ASN A 81 3.782 2.164 -6.453 1.00 0.00 H new ATOM 0 HD22 ASN A 81 3.925 0.429 -6.155 1.00 0.00 H new ATOM 1303 N THR A 82 1.090 2.525 -2.211 1.00 0.00 N ATOM 1304 CA THR A 82 1.245 3.755 -1.453 1.00 0.00 C ATOM 1305 C THR A 82 0.572 3.616 -0.084 1.00 0.00 C ATOM 1306 O THR A 82 1.138 4.053 0.920 1.00 0.00 O ATOM 1307 CB THR A 82 0.667 5.011 -2.227 1.00 0.00 C ATOM 1308 OG1 THR A 82 -0.017 4.546 -3.409 1.00 0.00 O ATOM 1309 CG2 THR A 82 1.710 6.094 -2.508 1.00 0.00 C ATOM 0 H THR A 82 0.327 2.541 -2.888 1.00 0.00 H new ATOM 0 HA THR A 82 2.313 3.924 -1.317 1.00 0.00 H new ATOM 0 HB THR A 82 -0.050 5.520 -1.583 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.373 4.972 -4.201 1.00 0.00 H new ATOM 0 HG21 THR A 82 1.241 6.922 -3.040 1.00 0.00 H new ATOM 0 HG22 THR A 82 2.122 6.455 -1.566 1.00 0.00 H new ATOM 0 HG23 THR A 82 2.511 5.678 -3.119 1.00 0.00 H new ATOM 1317 N ILE A 83 -0.336 2.643 -0.029 1.00 0.00 N ATOM 1318 CA ILE A 83 -1.034 2.334 1.225 1.00 0.00 C ATOM 1319 C ILE A 83 -0.112 1.547 2.139 1.00 0.00 C ATOM 1320 O ILE A 83 0.020 1.856 3.323 1.00 0.00 O ATOM 1321 CB ILE A 83 -2.406 1.660 0.911 1.00 0.00 C ATOM 1322 CG1 ILE A 83 -3.444 2.799 0.600 1.00 0.00 C ATOM 1323 CG2 ILE A 83 -2.963 0.704 1.979 1.00 0.00 C ATOM 1324 CD1 ILE A 83 -3.589 3.806 1.767 1.00 0.00 C ATOM 0 H ILE A 83 -0.605 2.061 -0.823 1.00 0.00 H new ATOM 0 HA ILE A 83 -1.283 3.239 1.779 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.231 1.006 0.057 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -3.135 3.332 -0.299 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -4.415 2.352 0.387 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.919 0.301 1.644 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.260 -0.114 2.138 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -3.106 1.246 2.914 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.318 4.571 1.499 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.926 3.281 2.661 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.625 4.276 1.964 1.00 0.00 H new ATOM 1336 N ALA A 84 0.599 0.585 1.551 1.00 0.00 N ATOM 1337 CA ALA A 84 1.422 -0.330 2.329 1.00 0.00 C ATOM 1338 C ALA A 84 2.662 0.400 2.857 1.00 0.00 C ATOM 1339 O ALA A 84 2.894 0.358 4.078 1.00 0.00 O ATOM 1340 CB ALA A 84 1.799 -1.553 1.510 1.00 0.00 C ATOM 0 H ALA A 84 0.620 0.423 0.544 1.00 0.00 H new ATOM 0 HA ALA A 84 0.845 -0.682 3.184 1.00 0.00 H new ATOM 0 HB1 ALA A 84 2.414 -2.220 2.114 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.894 -2.075 1.199 1.00 0.00 H new ATOM 0 HB3 ALA A 84 2.360 -1.242 0.629 1.00 0.00 H new ATOM 1346 N VAL A 85 3.085 1.407 2.091 1.00 0.00 N ATOM 1347 CA VAL A 85 4.051 2.388 2.570 1.00 0.00 C ATOM 1348 C VAL A 85 3.424 3.265 3.648 1.00 0.00 C ATOM 1349 O VAL A 85 4.080 3.558 4.659 1.00 0.00 O ATOM 1350 CB VAL A 85 4.699 3.153 1.406 1.00 0.00 C ATOM 1351 CG1 VAL A 85 5.550 4.338 1.861 1.00 0.00 C ATOM 1352 CG2 VAL A 85 5.526 2.226 0.519 1.00 0.00 C ATOM 0 H VAL A 85 2.770 1.562 1.133 1.00 0.00 H new ATOM 0 HA VAL A 85 4.883 1.877 3.054 1.00 0.00 H new ATOM 0 HB VAL A 85 3.870 3.557 0.825 1.00 0.00 H new ATOM 0 HG11 VAL A 85 5.978 4.834 0.990 1.00 0.00 H new ATOM 0 HG12 VAL A 85 4.927 5.044 2.411 1.00 0.00 H new ATOM 0 HG13 VAL A 85 6.353 3.983 2.507 1.00 0.00 H new ATOM 0 HG21 VAL A 85 5.970 2.801 -0.294 1.00 0.00 H new ATOM 0 HG22 VAL A 85 6.317 1.765 1.111 1.00 0.00 H new ATOM 0 HG23 VAL A 85 4.883 1.449 0.105 1.00 0.00 H new ATOM 1362 N LEU A 86 2.352 3.961 3.271 1.00 0.00 N ATOM 1363 CA LEU A 86 1.732 4.945 4.141 1.00 0.00 C ATOM 1364 C LEU A 86 1.260 4.280 5.448 1.00 0.00 C ATOM 1365 O LEU A 86 1.446 4.885 6.516 1.00 0.00 O ATOM 1366 CB LEU A 86 0.632 5.680 3.382 1.00 0.00 C ATOM 1367 CG LEU A 86 0.252 7.080 3.817 1.00 0.00 C ATOM 1368 CD1 LEU A 86 1.448 7.911 4.254 1.00 0.00 C ATOM 1369 CD2 LEU A 86 -0.448 7.776 2.646 1.00 0.00 C ATOM 0 H LEU A 86 1.897 3.857 2.364 1.00 0.00 H new ATOM 0 HA LEU A 86 2.457 5.702 4.441 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.931 5.730 2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -0.267 5.065 3.428 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.405 6.993 4.682 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.111 8.903 4.554 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.941 7.425 5.096 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.151 8.001 3.426 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.730 8.787 2.940 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.229 7.821 1.793 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.342 7.216 2.371 1.00 0.00 H new ATOM 1381 N TYR A 87 1.265 2.938 5.394 1.00 0.00 N ATOM 1382 CA TYR A 87 1.206 2.113 6.580 1.00 0.00 C ATOM 1383 C TYR A 87 2.550 1.998 7.268 1.00 0.00 C ATOM 1384 O TYR A 87 2.652 2.145 8.492 1.00 0.00 O ATOM 1385 CB TYR A 87 0.600 0.721 6.303 1.00 0.00 C ATOM 1386 CG TYR A 87 0.090 0.050 7.586 1.00 0.00 C ATOM 1387 CD1 TYR A 87 0.968 -0.139 8.662 1.00 0.00 C ATOM 1388 CD2 TYR A 87 -1.278 0.106 7.874 1.00 0.00 C ATOM 1389 CE1 TYR A 87 0.495 -0.507 9.920 1.00 0.00 C ATOM 1390 CE2 TYR A 87 -1.768 -0.192 9.143 1.00 0.00 C ATOM 1391 CZ TYR A 87 -0.880 -0.539 10.152 1.00 0.00 C ATOM 1392 OH TYR A 87 -1.398 -0.869 11.373 1.00 0.00 O ATOM 0 H TYR A 87 1.310 2.410 4.523 1.00 0.00 H new ATOM 0 HA TYR A 87 0.532 2.626 7.266 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -0.222 0.818 5.593 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.352 0.085 5.835 1.00 0.00 H new ATOM 0 HD1 TYR A 87 2.028 0.003 8.514 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -1.970 0.387 7.094 1.00 0.00 H new ATOM 0 HE1 TYR A 87 1.187 -0.765 10.708 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -2.829 -0.153 9.340 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.691 -0.829 12.050 1.00 0.00 H new ATOM 1402 N CYS A 88 3.606 1.772 6.487 1.00 0.00 N ATOM 1403 CA CYS A 88 4.961 1.708 6.993 1.00 0.00 C ATOM 1404 C CYS A 88 5.300 3.007 7.765 1.00 0.00 C ATOM 1405 O CYS A 88 5.397 2.999 8.985 1.00 0.00 O ATOM 1406 CB CYS A 88 5.993 1.563 5.868 1.00 0.00 C ATOM 1407 SG CYS A 88 5.918 0.067 4.895 1.00 0.00 S ATOM 0 H CYS A 88 3.536 1.628 5.480 1.00 0.00 H new ATOM 0 HA CYS A 88 5.010 0.833 7.642 1.00 0.00 H new ATOM 0 HB2 CYS A 88 5.883 2.413 5.194 1.00 0.00 H new ATOM 0 HB3 CYS A 88 6.988 1.633 6.308 1.00 0.00 H new ATOM 0 HG CYS A 88 4.739 -0.043 4.359 1.00 0.00 H new ATOM 1412 N VAL A 89 5.037 4.107 7.065 1.00 0.00 N ATOM 1413 CA VAL A 89 5.281 5.435 7.608 1.00 0.00 C ATOM 1414 C VAL A 89 4.412 5.651 8.852 1.00 0.00 C ATOM 1415 O VAL A 89 4.947 5.601 9.980 1.00 0.00 O ATOM 1416 CB VAL A 89 5.061 6.507 6.521 1.00 0.00 C ATOM 1417 CG1 VAL A 89 5.630 7.865 6.916 1.00 0.00 C ATOM 1418 CG2 VAL A 89 5.599 6.071 5.167 1.00 0.00 C ATOM 0 H VAL A 89 4.654 4.102 6.119 1.00 0.00 H new ATOM 0 HA VAL A 89 6.320 5.526 7.923 1.00 0.00 H new ATOM 0 HB VAL A 89 3.981 6.620 6.430 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.448 8.582 6.116 1.00 0.00 H new ATOM 0 HG12 VAL A 89 5.146 8.210 7.830 1.00 0.00 H new ATOM 0 HG13 VAL A 89 6.703 7.775 7.085 1.00 0.00 H new ATOM 0 HG21 VAL A 89 5.421 6.858 4.434 1.00 0.00 H new ATOM 0 HG22 VAL A 89 6.670 5.883 5.244 1.00 0.00 H new ATOM 0 HG23 VAL A 89 5.092 5.159 4.851 1.00 0.00 H new ATOM 1428 N HIS A 90 3.130 5.299 8.694 1.00 0.00 N ATOM 1429 CA HIS A 90 2.151 5.625 9.719 1.00 0.00 C ATOM 1430 C HIS A 90 2.460 4.861 11.011 1.00 0.00 C ATOM 1431 O HIS A 90 2.127 5.324 12.101 1.00 0.00 O ATOM 1432 CB HIS A 90 0.689 5.331 9.324 1.00 0.00 C ATOM 1433 CG HIS A 90 0.088 6.395 8.440 1.00 0.00 C ATOM 1434 ND1 HIS A 90 0.662 7.625 8.235 1.00 0.00 N ATOM 1435 CD2 HIS A 90 -0.823 6.239 7.441 1.00 0.00 C ATOM 1436 CE1 HIS A 90 0.076 8.213 7.201 1.00 0.00 C ATOM 1437 NE2 HIS A 90 -0.891 7.430 6.769 1.00 0.00 N ATOM 0 H HIS A 90 2.760 4.801 7.885 1.00 0.00 H new ATOM 0 HA HIS A 90 2.237 6.703 9.858 1.00 0.00 H new ATOM 0 HB2 HIS A 90 0.644 4.372 8.809 1.00 0.00 H new ATOM 0 HB3 HIS A 90 0.087 5.236 10.228 1.00 0.00 H new ATOM 0 HD1 HIS A 90 1.419 8.023 8.790 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -1.386 5.344 7.220 1.00 0.00 H new ATOM 0 HE1 HIS A 90 0.346 9.172 6.784 1.00 0.00 H new ATOM 1446 N GLN A 91 2.763 3.577 10.831 1.00 0.00 N ATOM 1447 CA GLN A 91 3.073 2.706 11.955 1.00 0.00 C ATOM 1448 C GLN A 91 4.324 3.207 12.681 1.00 0.00 C ATOM 1449 O GLN A 91 4.403 3.175 13.908 1.00 0.00 O ATOM 1450 CB GLN A 91 3.231 1.243 11.538 1.00 0.00 C ATOM 1451 CG GLN A 91 3.558 0.308 12.685 1.00 0.00 C ATOM 1452 CD GLN A 91 2.552 -0.805 12.849 1.00 0.00 C ATOM 1453 OE1 GLN A 91 1.357 -0.583 13.020 1.00 0.00 O ATOM 1454 NE2 GLN A 91 3.059 -2.035 12.818 1.00 0.00 N ATOM 0 H GLN A 91 2.800 3.121 9.919 1.00 0.00 H new ATOM 0 HA GLN A 91 2.225 2.743 12.639 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.309 0.910 11.062 1.00 0.00 H new ATOM 0 HB3 GLN A 91 4.020 1.172 10.789 1.00 0.00 H new ATOM 0 HG2 GLN A 91 4.545 -0.124 12.523 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.609 0.882 13.610 1.00 0.00 H new ATOM 0 HE21 GLN A 91 4.059 -2.171 12.673 1.00 0.00 H new ATOM 0 HE22 GLN A 91 2.447 -2.842 12.939 1.00 0.00 H new ATOM 1463 N ARG A 92 5.392 3.335 11.894 1.00 0.00 N ATOM 1464 CA ARG A 92 6.754 3.384 12.383 1.00 0.00 C ATOM 1465 C ARG A 92 7.708 3.156 11.176 1.00 0.00 C ATOM 1466 O ARG A 92 8.868 3.569 11.257 1.00 0.00 O ATOM 1467 CB ARG A 92 7.080 2.346 13.453 1.00 0.00 C ATOM 1468 CG ARG A 92 8.531 2.332 13.930 1.00 0.00 C ATOM 1469 CD ARG A 92 8.620 2.089 15.397 1.00 0.00 C ATOM 1470 NE ARG A 92 8.455 3.315 16.168 1.00 0.00 N ATOM 1471 CZ ARG A 92 7.341 3.610 16.842 1.00 0.00 C ATOM 1472 NH1 ARG A 92 6.228 2.899 16.692 1.00 0.00 N ATOM 1473 NH2 ARG A 92 7.329 4.677 17.642 1.00 0.00 N ATOM 0 H ARG A 92 5.324 3.408 10.879 1.00 0.00 H new ATOM 0 HA ARG A 92 6.883 4.360 12.851 1.00 0.00 H new ATOM 0 HB2 ARG A 92 6.434 2.520 14.313 1.00 0.00 H new ATOM 0 HB3 ARG A 92 6.833 1.358 13.064 1.00 0.00 H new ATOM 0 HG2 ARG A 92 9.083 1.557 13.398 1.00 0.00 H new ATOM 0 HG3 ARG A 92 9.004 3.284 13.688 1.00 0.00 H new ATOM 0 HD2 ARG A 92 7.855 1.370 15.692 1.00 0.00 H new ATOM 0 HD3 ARG A 92 9.586 1.641 15.632 1.00 0.00 H new ATOM 0 HE ARG A 92 9.228 3.980 16.194 1.00 0.00 H new ATOM 0 HH11 ARG A 92 6.212 2.107 16.050 1.00 0.00 H new ATOM 0 HH12 ARG A 92 5.390 3.146 17.219 1.00 0.00 H new ATOM 0 HH21 ARG A 92 8.164 5.256 17.733 1.00 0.00 H new ATOM 0 HH22 ARG A 92 6.485 4.914 18.163 1.00 0.00 H new ATOM 1487 N ILE A 93 7.388 2.072 10.467 1.00 0.00 N ATOM 1488 CA ILE A 93 8.317 1.437 9.543 1.00 0.00 C ATOM 1489 C ILE A 93 8.749 2.426 8.464 1.00 0.00 C ATOM 1490 O ILE A 93 8.034 3.403 8.196 1.00 0.00 O ATOM 1491 CB ILE A 93 7.654 0.148 8.921 1.00 0.00 C ATOM 1492 CG1 ILE A 93 7.214 -0.795 10.072 1.00 0.00 C ATOM 1493 CG2 ILE A 93 8.553 -0.566 7.894 1.00 0.00 C ATOM 1494 CD1 ILE A 93 5.683 -0.851 10.302 1.00 0.00 C ATOM 0 H ILE A 93 6.478 1.614 10.520 1.00 0.00 H new ATOM 0 HA ILE A 93 9.213 1.129 10.082 1.00 0.00 H new ATOM 0 HB ILE A 93 6.778 0.457 8.350 1.00 0.00 H new ATOM 0 HG12 ILE A 93 7.574 -1.801 9.859 1.00 0.00 H new ATOM 0 HG13 ILE A 93 7.696 -0.472 10.995 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.036 -1.444 7.506 1.00 0.00 H new ATOM 0 HG22 ILE A 93 8.779 0.115 7.073 1.00 0.00 H new ATOM 0 HG23 ILE A 93 9.481 -0.875 8.375 1.00 0.00 H new ATOM 0 HD11 ILE A 93 5.463 -1.533 11.124 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.315 0.145 10.549 1.00 0.00 H new ATOM 0 HD13 ILE A 93 5.192 -1.205 9.396 1.00 0.00 H new ATOM 1506 N ASP A 94 10.064 2.440 8.195 1.00 0.00 N ATOM 1507 CA ASP A 94 10.548 3.147 7.015 1.00 0.00 C ATOM 1508 C ASP A 94 11.105 2.164 5.989 1.00 0.00 C ATOM 1509 O ASP A 94 11.759 1.184 6.340 1.00 0.00 O ATOM 1510 CB ASP A 94 11.491 4.290 7.362 1.00 0.00 C ATOM 1511 CG ASP A 94 12.815 3.833 7.938 1.00 0.00 C ATOM 1512 OD1 ASP A 94 13.574 3.099 7.286 1.00 0.00 O ATOM 1513 OD2 ASP A 94 13.077 4.218 9.099 1.00 0.00 O ATOM 0 H ASP A 94 10.782 1.986 8.759 1.00 0.00 H new ATOM 0 HA ASP A 94 9.699 3.639 6.540 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.679 4.879 6.465 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.001 4.949 8.079 1.00 0.00 H new ATOM 1518 N VAL A 95 11.095 2.612 4.727 1.00 0.00 N ATOM 1519 CA VAL A 95 11.380 1.687 3.623 1.00 0.00 C ATOM 1520 C VAL A 95 12.233 2.378 2.571 1.00 0.00 C ATOM 1521 O VAL A 95 12.777 3.458 2.812 1.00 0.00 O ATOM 1522 CB VAL A 95 10.080 1.040 3.132 1.00 0.00 C ATOM 1523 CG1 VAL A 95 9.164 0.633 4.291 1.00 0.00 C ATOM 1524 CG2 VAL A 95 9.320 1.905 2.140 1.00 0.00 C ATOM 0 H VAL A 95 10.900 3.574 4.450 1.00 0.00 H new ATOM 0 HA VAL A 95 11.991 0.847 3.953 1.00 0.00 H new ATOM 0 HB VAL A 95 10.391 0.138 2.605 1.00 0.00 H new ATOM 0 HG11 VAL A 95 8.256 0.179 3.895 1.00 0.00 H new ATOM 0 HG12 VAL A 95 9.680 -0.085 4.928 1.00 0.00 H new ATOM 0 HG13 VAL A 95 8.904 1.515 4.876 1.00 0.00 H new ATOM 0 HG21 VAL A 95 8.410 1.391 1.831 1.00 0.00 H new ATOM 0 HG22 VAL A 95 9.059 2.853 2.609 1.00 0.00 H new ATOM 0 HG23 VAL A 95 9.945 2.092 1.267 1.00 0.00 H new ATOM 1534 N LYS A 96 12.618 1.585 1.565 1.00 0.00 N ATOM 1535 CA LYS A 96 13.513 2.061 0.518 1.00 0.00 C ATOM 1536 C LYS A 96 12.780 2.047 -0.829 1.00 0.00 C ATOM 1537 O LYS A 96 12.486 3.110 -1.380 1.00 0.00 O ATOM 1538 CB LYS A 96 14.770 1.202 0.404 1.00 0.00 C ATOM 1539 CG LYS A 96 15.763 1.688 -0.652 1.00 0.00 C ATOM 1540 CD LYS A 96 17.188 1.240 -0.379 1.00 0.00 C ATOM 1541 CE LYS A 96 17.354 -0.207 -0.174 1.00 0.00 C ATOM 1542 NZ LYS A 96 16.539 -0.989 -1.138 1.00 0.00 N ATOM 0 H LYS A 96 12.322 0.615 1.458 1.00 0.00 H new ATOM 0 HA LYS A 96 13.816 3.074 0.783 1.00 0.00 H new ATOM 0 HB2 LYS A 96 15.269 1.177 1.373 1.00 0.00 H new ATOM 0 HB3 LYS A 96 14.478 0.178 0.169 1.00 0.00 H new ATOM 0 HG2 LYS A 96 15.454 1.320 -1.630 1.00 0.00 H new ATOM 0 HG3 LYS A 96 15.733 2.777 -0.697 1.00 0.00 H new ATOM 0 HD2 LYS A 96 17.817 1.548 -1.214 1.00 0.00 H new ATOM 0 HD3 LYS A 96 17.554 1.762 0.505 1.00 0.00 H new ATOM 0 HE2 LYS A 96 18.405 -0.473 -0.284 1.00 0.00 H new ATOM 0 HE3 LYS A 96 17.065 -0.467 0.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 17.034 -1.873 -1.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 15.617 -1.212 -0.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 16.395 -0.431 -2.004 1.00 0.00 H new ATOM 1556 N ASP A 97 12.086 0.918 -1.038 1.00 0.00 N ATOM 1557 CA ASP A 97 11.273 0.755 -2.243 1.00 0.00 C ATOM 1558 C ASP A 97 9.876 0.257 -1.866 1.00 0.00 C ATOM 1559 O ASP A 97 9.696 -0.269 -0.758 1.00 0.00 O ATOM 1560 CB ASP A 97 11.997 -0.087 -3.285 1.00 0.00 C ATOM 1561 CG ASP A 97 11.926 -1.581 -3.037 1.00 0.00 C ATOM 1562 OD1 ASP A 97 11.741 -2.028 -1.896 1.00 0.00 O ATOM 1563 OD2 ASP A 97 12.064 -2.316 -4.040 1.00 0.00 O ATOM 0 H ASP A 97 12.073 0.122 -0.400 1.00 0.00 H new ATOM 0 HA ASP A 97 11.124 1.720 -2.728 1.00 0.00 H new ATOM 0 HB2 ASP A 97 11.574 0.127 -4.266 1.00 0.00 H new ATOM 0 HB3 ASP A 97 13.044 0.215 -3.316 1.00 0.00 H new ATOM 1568 N THR A 98 9.082 0.003 -2.905 1.00 0.00 N ATOM 1569 CA THR A 98 7.842 -0.746 -2.781 1.00 0.00 C ATOM 1570 C THR A 98 8.109 -2.138 -2.209 1.00 0.00 C ATOM 1571 O THR A 98 7.476 -2.551 -1.242 1.00 0.00 O ATOM 1572 CB THR A 98 7.094 -0.863 -4.176 1.00 0.00 C ATOM 1573 OG1 THR A 98 7.443 0.327 -4.938 1.00 0.00 O ATOM 1574 CG2 THR A 98 5.588 -1.077 -4.056 1.00 0.00 C ATOM 0 H THR A 98 9.284 0.313 -3.855 1.00 0.00 H new ATOM 0 HA THR A 98 7.195 -0.200 -2.095 1.00 0.00 H new ATOM 0 HB THR A 98 7.424 -1.762 -4.696 1.00 0.00 H new ATOM 0 HG1 THR A 98 6.789 1.034 -4.757 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.150 -1.147 -5.052 1.00 0.00 H new ATOM 0 HG22 THR A 98 5.394 -1.999 -3.509 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.143 -0.238 -3.522 1.00 0.00 H new ATOM 1582 N LYS A 99 8.923 -2.904 -2.930 1.00 0.00 N ATOM 1583 CA LYS A 99 8.985 -4.349 -2.749 1.00 0.00 C ATOM 1584 C LYS A 99 9.413 -4.686 -1.322 1.00 0.00 C ATOM 1585 O LYS A 99 8.833 -5.581 -0.697 1.00 0.00 O ATOM 1586 CB LYS A 99 9.958 -5.004 -3.728 1.00 0.00 C ATOM 1587 CG LYS A 99 9.331 -5.373 -5.073 1.00 0.00 C ATOM 1588 CD LYS A 99 8.418 -6.582 -4.993 1.00 0.00 C ATOM 1589 CE LYS A 99 7.015 -6.277 -4.666 1.00 0.00 C ATOM 1590 NZ LYS A 99 6.683 -6.680 -3.276 1.00 0.00 N ATOM 0 H LYS A 99 9.551 -2.544 -3.648 1.00 0.00 H new ATOM 0 HA LYS A 99 7.986 -4.740 -2.942 1.00 0.00 H new ATOM 0 HB2 LYS A 99 10.794 -4.326 -3.902 1.00 0.00 H new ATOM 0 HB3 LYS A 99 10.367 -5.904 -3.270 1.00 0.00 H new ATOM 0 HG2 LYS A 99 8.764 -4.521 -5.448 1.00 0.00 H new ATOM 0 HG3 LYS A 99 10.124 -5.571 -5.794 1.00 0.00 H new ATOM 0 HD2 LYS A 99 8.448 -7.106 -5.948 1.00 0.00 H new ATOM 0 HD3 LYS A 99 8.811 -7.267 -4.242 1.00 0.00 H new ATOM 0 HE2 LYS A 99 6.835 -5.209 -4.790 1.00 0.00 H new ATOM 0 HE3 LYS A 99 6.356 -6.794 -5.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 5.982 -6.021 -2.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 6.290 -7.643 -3.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 7.544 -6.659 -2.693 1.00 0.00 H new ATOM 1604 N GLU A 100 10.088 -3.717 -0.697 1.00 0.00 N ATOM 1605 CA GLU A 100 10.673 -3.951 0.619 1.00 0.00 C ATOM 1606 C GLU A 100 9.702 -3.533 1.718 1.00 0.00 C ATOM 1607 O GLU A 100 9.494 -4.264 2.685 1.00 0.00 O ATOM 1608 CB GLU A 100 11.980 -3.151 0.692 1.00 0.00 C ATOM 1609 CG GLU A 100 12.082 -1.805 1.128 1.00 0.00 C ATOM 1610 CD GLU A 100 12.587 -1.575 2.522 1.00 0.00 C ATOM 1611 OE1 GLU A 100 13.765 -1.596 2.834 1.00 0.00 O ATOM 1612 OE2 GLU A 100 11.655 -1.494 3.352 1.00 0.00 O ATOM 0 H GLU A 100 10.239 -2.782 -1.075 1.00 0.00 H new ATOM 0 HA GLU A 100 10.879 -5.011 0.767 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.649 -3.726 1.333 1.00 0.00 H new ATOM 0 HB3 GLU A 100 12.403 -3.174 -0.312 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.739 -1.275 0.438 1.00 0.00 H new ATOM 0 HG3 GLU A 100 11.096 -1.347 1.045 1.00 0.00 H new ATOM 1619 N ALA A 101 8.999 -2.433 1.470 1.00 0.00 N ATOM 1620 CA ALA A 101 7.849 -2.052 2.279 1.00 0.00 C ATOM 1621 C ALA A 101 6.771 -3.134 2.209 1.00 0.00 C ATOM 1622 O ALA A 101 6.212 -3.530 3.229 1.00 0.00 O ATOM 1623 CB ALA A 101 7.299 -0.706 1.819 1.00 0.00 C ATOM 0 H ALA A 101 9.208 -1.786 0.710 1.00 0.00 H new ATOM 0 HA ALA A 101 8.167 -1.952 3.317 1.00 0.00 H new ATOM 0 HB1 ALA A 101 6.440 -0.435 2.433 1.00 0.00 H new ATOM 0 HB2 ALA A 101 8.072 0.056 1.919 1.00 0.00 H new ATOM 0 HB3 ALA A 101 6.992 -0.776 0.776 1.00 0.00 H new ATOM 1629 N LEU A 102 6.356 -3.436 0.985 1.00 0.00 N ATOM 1630 CA LEU A 102 5.203 -4.289 0.743 1.00 0.00 C ATOM 1631 C LEU A 102 5.427 -5.673 1.344 1.00 0.00 C ATOM 1632 O LEU A 102 4.473 -6.419 1.567 1.00 0.00 O ATOM 1633 CB LEU A 102 4.934 -4.310 -0.770 1.00 0.00 C ATOM 1634 CG LEU A 102 3.483 -4.200 -1.210 1.00 0.00 C ATOM 1635 CD1 LEU A 102 2.989 -2.763 -1.112 1.00 0.00 C ATOM 1636 CD2 LEU A 102 3.370 -4.697 -2.647 1.00 0.00 C ATOM 0 H LEU A 102 6.808 -3.097 0.136 1.00 0.00 H new ATOM 0 HA LEU A 102 4.313 -3.899 1.237 1.00 0.00 H new ATOM 0 HB2 LEU A 102 5.490 -3.490 -1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 102 5.342 -5.236 -1.175 1.00 0.00 H new ATOM 0 HG LEU A 102 2.862 -4.809 -0.553 1.00 0.00 H new ATOM 0 HD11 LEU A 102 1.948 -2.713 -1.433 1.00 0.00 H new ATOM 0 HD12 LEU A 102 3.067 -2.421 -0.080 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.597 -2.125 -1.753 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.334 -4.624 -2.977 1.00 0.00 H new ATOM 0 HD22 LEU A 102 4.000 -4.087 -3.294 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.695 -5.736 -2.699 1.00 0.00 H new ATOM 1648 N ASP A 103 6.689 -6.097 1.336 1.00 0.00 N ATOM 1649 CA ASP A 103 7.070 -7.357 1.955 1.00 0.00 C ATOM 1650 C ASP A 103 6.906 -7.275 3.471 1.00 0.00 C ATOM 1651 O ASP A 103 6.105 -8.003 4.056 1.00 0.00 O ATOM 1652 CB ASP A 103 8.452 -7.818 1.502 1.00 0.00 C ATOM 1653 CG ASP A 103 8.594 -9.327 1.446 1.00 0.00 C ATOM 1654 OD1 ASP A 103 8.312 -10.028 2.429 1.00 0.00 O ATOM 1655 OD2 ASP A 103 9.006 -9.804 0.366 1.00 0.00 O ATOM 0 H ASP A 103 7.461 -5.585 0.908 1.00 0.00 H new ATOM 0 HA ASP A 103 6.391 -8.138 1.613 1.00 0.00 H new ATOM 0 HB2 ASP A 103 8.660 -7.404 0.515 1.00 0.00 H new ATOM 0 HB3 ASP A 103 9.203 -7.415 2.182 1.00 0.00 H new ATOM 1660 N LYS A 104 7.468 -6.210 4.037 1.00 0.00 N ATOM 1661 CA LYS A 104 7.395 -5.983 5.476 1.00 0.00 C ATOM 1662 C LYS A 104 5.945 -5.825 5.914 1.00 0.00 C ATOM 1663 O LYS A 104 5.571 -6.209 7.023 1.00 0.00 O ATOM 1664 CB LYS A 104 8.198 -4.755 5.899 1.00 0.00 C ATOM 1665 CG LYS A 104 8.874 -4.895 7.265 1.00 0.00 C ATOM 1666 CD LYS A 104 7.886 -5.083 8.401 1.00 0.00 C ATOM 1667 CE LYS A 104 7.765 -6.463 8.895 1.00 0.00 C ATOM 1668 NZ LYS A 104 9.091 -7.034 9.242 1.00 0.00 N ATOM 0 H LYS A 104 7.978 -5.492 3.522 1.00 0.00 H new ATOM 0 HA LYS A 104 7.831 -6.854 5.965 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.961 -4.555 5.146 1.00 0.00 H new ATOM 0 HB3 LYS A 104 7.536 -3.890 5.920 1.00 0.00 H new ATOM 0 HG2 LYS A 104 9.557 -5.744 7.241 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.476 -4.007 7.458 1.00 0.00 H new ATOM 0 HD2 LYS A 104 8.182 -4.440 9.230 1.00 0.00 H new ATOM 0 HD3 LYS A 104 6.905 -4.744 8.069 1.00 0.00 H new ATOM 0 HE2 LYS A 104 7.119 -6.481 9.773 1.00 0.00 H new ATOM 0 HE3 LYS A 104 7.288 -7.082 8.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.978 -7.739 9.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 9.503 -7.489 8.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 9.721 -6.274 9.569 1.00 0.00 H new ATOM 1682 N ILE A 105 5.088 -5.549 4.930 1.00 0.00 N ATOM 1683 CA ILE A 105 3.702 -5.158 5.237 1.00 0.00 C ATOM 1684 C ILE A 105 2.753 -6.228 4.706 1.00 0.00 C ATOM 1685 O ILE A 105 1.711 -6.485 5.327 1.00 0.00 O ATOM 1686 CB ILE A 105 3.442 -3.709 4.725 1.00 0.00 C ATOM 1687 CG1 ILE A 105 3.924 -2.693 5.816 1.00 0.00 C ATOM 1688 CG2 ILE A 105 2.007 -3.381 4.275 1.00 0.00 C ATOM 1689 CD1 ILE A 105 5.376 -2.910 6.290 1.00 0.00 C ATOM 0 H ILE A 105 5.316 -5.586 3.936 1.00 0.00 H new ATOM 0 HA ILE A 105 3.517 -5.113 6.310 1.00 0.00 H new ATOM 0 HB ILE A 105 4.018 -3.623 3.804 1.00 0.00 H new ATOM 0 HG12 ILE A 105 3.831 -1.682 5.420 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.259 -2.760 6.677 1.00 0.00 H new ATOM 0 HG21 ILE A 105 1.958 -2.344 3.942 1.00 0.00 H new ATOM 0 HG22 ILE A 105 1.724 -4.040 3.454 1.00 0.00 H new ATOM 0 HG23 ILE A 105 1.322 -3.527 5.110 1.00 0.00 H new ATOM 0 HD11 ILE A 105 5.628 -2.164 7.044 1.00 0.00 H new ATOM 0 HD12 ILE A 105 5.474 -3.907 6.719 1.00 0.00 H new ATOM 0 HD13 ILE A 105 6.054 -2.812 5.442 1.00 0.00 H new ATOM 1701 N GLU A 106 3.290 -7.085 3.841 1.00 0.00 N ATOM 1702 CA GLU A 106 2.693 -8.378 3.539 1.00 0.00 C ATOM 1703 C GLU A 106 2.972 -9.367 4.670 1.00 0.00 C ATOM 1704 O GLU A 106 2.199 -10.297 4.894 1.00 0.00 O ATOM 1705 CB GLU A 106 3.297 -8.874 2.218 1.00 0.00 C ATOM 1706 CG GLU A 106 3.159 -10.194 1.713 1.00 0.00 C ATOM 1707 CD GLU A 106 3.491 -10.412 0.268 1.00 0.00 C ATOM 1708 OE1 GLU A 106 3.648 -9.515 -0.542 1.00 0.00 O ATOM 1709 OE2 GLU A 106 3.639 -11.622 -0.005 1.00 0.00 O ATOM 0 H GLU A 106 4.153 -6.900 3.330 1.00 0.00 H new ATOM 0 HA GLU A 106 1.611 -8.288 3.444 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.910 -8.213 1.443 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.369 -8.689 2.289 1.00 0.00 H new ATOM 0 HG2 GLU A 106 3.793 -10.851 2.308 1.00 0.00 H new ATOM 0 HG3 GLU A 106 2.129 -10.512 1.875 1.00 0.00 H new ATOM 1716 N GLU A 107 3.950 -9.015 5.497 1.00 0.00 N ATOM 1717 CA GLU A 107 4.223 -9.744 6.726 1.00 0.00 C ATOM 1718 C GLU A 107 3.487 -9.106 7.901 1.00 0.00 C ATOM 1719 O GLU A 107 3.769 -9.408 9.061 1.00 0.00 O ATOM 1720 CB GLU A 107 5.742 -9.724 6.947 1.00 0.00 C ATOM 1721 CG GLU A 107 6.434 -10.557 7.864 1.00 0.00 C ATOM 1722 CD GLU A 107 6.828 -11.923 7.385 1.00 0.00 C ATOM 1723 OE1 GLU A 107 7.002 -12.215 6.215 1.00 0.00 O ATOM 1724 OE2 GLU A 107 7.024 -12.716 8.333 1.00 0.00 O ATOM 0 H GLU A 107 4.571 -8.222 5.335 1.00 0.00 H new ATOM 0 HA GLU A 107 3.870 -10.773 6.650 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.191 -9.912 5.972 1.00 0.00 H new ATOM 0 HB3 GLU A 107 5.993 -8.700 7.222 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.338 -10.035 8.179 1.00 0.00 H new ATOM 0 HG3 GLU A 107 5.810 -10.676 8.750 1.00 0.00 H new ATOM 1731 N GLU A 108 2.350 -8.488 7.577 1.00 0.00 N ATOM 1732 CA GLU A 108 1.481 -7.889 8.576 1.00 0.00 C ATOM 1733 C GLU A 108 2.225 -6.825 9.377 1.00 0.00 C ATOM 1734 O GLU A 108 1.772 -6.396 10.436 1.00 0.00 O ATOM 1735 CB GLU A 108 0.949 -9.003 9.483 1.00 0.00 C ATOM 1736 CG GLU A 108 -0.363 -9.047 10.024 1.00 0.00 C ATOM 1737 CD GLU A 108 -1.429 -9.681 9.184 1.00 0.00 C ATOM 1738 OE1 GLU A 108 -1.663 -9.373 8.028 1.00 0.00 O ATOM 1739 OE2 GLU A 108 -1.995 -10.627 9.774 1.00 0.00 O ATOM 0 H GLU A 108 2.012 -8.392 6.619 1.00 0.00 H new ATOM 0 HA GLU A 108 0.644 -7.388 8.089 1.00 0.00 H new ATOM 0 HB2 GLU A 108 1.076 -9.931 8.926 1.00 0.00 H new ATOM 0 HB3 GLU A 108 1.627 -9.047 10.335 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -0.319 -9.581 10.973 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.671 -8.025 10.246 1.00 0.00 H new ATOM 1746 N GLN A 109 3.336 -6.349 8.821 1.00 0.00 N ATOM 1747 CA GLN A 109 3.885 -5.045 9.206 1.00 0.00 C ATOM 1748 C GLN A 109 4.237 -5.029 10.683 1.00 0.00 C ATOM 1749 O GLN A 109 3.968 -4.066 11.405 1.00 0.00 O ATOM 1750 CB GLN A 109 2.977 -3.891 8.799 1.00 0.00 C ATOM 1751 CG GLN A 109 1.751 -3.704 9.669 1.00 0.00 C ATOM 1752 CD GLN A 109 0.493 -4.259 9.045 1.00 0.00 C ATOM 1753 OE1 GLN A 109 0.279 -4.185 7.839 1.00 0.00 O ATOM 1754 NE2 GLN A 109 -0.317 -4.902 9.883 1.00 0.00 N ATOM 0 H GLN A 109 3.873 -6.840 8.107 1.00 0.00 H new ATOM 0 HA GLN A 109 4.811 -4.893 8.651 1.00 0.00 H new ATOM 0 HB2 GLN A 109 3.558 -2.969 8.813 1.00 0.00 H new ATOM 0 HB3 GLN A 109 2.653 -4.048 7.770 1.00 0.00 H new ATOM 0 HG2 GLN A 109 1.917 -4.190 10.631 1.00 0.00 H new ATOM 0 HG3 GLN A 109 1.613 -2.641 9.868 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -0.098 -4.937 10.879 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -1.157 -5.360 9.530 1.00 0.00 H new ATOM 1763 N ASN A 110 5.010 -6.034 11.098 1.00 0.00 N ATOM 1764 CA ASN A 110 5.237 -6.286 12.514 1.00 0.00 C ATOM 1765 C ASN A 110 3.967 -6.825 13.168 1.00 0.00 C ATOM 1766 O ASN A 110 2.857 -6.446 12.797 1.00 0.00 O ATOM 1767 CB ASN A 110 5.842 -5.077 13.220 1.00 0.00 C ATOM 1768 CG ASN A 110 6.821 -4.304 12.356 1.00 0.00 C ATOM 1769 OD1 ASN A 110 6.494 -3.228 11.834 1.00 0.00 O ATOM 1770 ND2 ASN A 110 8.035 -4.837 12.219 1.00 0.00 N ATOM 0 H ASN A 110 5.487 -6.683 10.472 1.00 0.00 H new ATOM 0 HA ASN A 110 5.990 -7.067 12.618 1.00 0.00 H new ATOM 0 HB2 ASN A 110 5.040 -4.409 13.534 1.00 0.00 H new ATOM 0 HB3 ASN A 110 6.351 -5.410 14.124 1.00 0.00 H new ATOM 0 HD21 ASN A 110 8.743 -4.356 11.665 1.00 0.00 H new ATOM 0 HD22 ASN A 110 8.256 -5.726 12.669 1.00 0.00 H new ATOM 1777 N LYS A 111 4.145 -7.823 14.029 1.00 0.00 N ATOM 1778 CA LYS A 111 3.043 -8.682 14.452 1.00 0.00 C ATOM 1779 C LYS A 111 2.518 -9.486 13.265 1.00 0.00 C ATOM 1780 O LYS A 111 1.676 -9.004 12.506 1.00 0.00 O ATOM 1781 CB LYS A 111 1.895 -7.881 15.062 1.00 0.00 C ATOM 1782 CG LYS A 111 0.937 -8.717 15.912 1.00 0.00 C ATOM 1783 CD LYS A 111 1.163 -8.546 17.404 1.00 0.00 C ATOM 1784 CE LYS A 111 0.797 -9.713 18.222 1.00 0.00 C ATOM 1785 NZ LYS A 111 0.034 -9.311 19.431 1.00 0.00 N ATOM 0 H LYS A 111 5.045 -8.057 14.449 1.00 0.00 H new ATOM 0 HA LYS A 111 3.433 -9.354 15.217 1.00 0.00 H new ATOM 0 HB2 LYS A 111 2.309 -7.083 15.678 1.00 0.00 H new ATOM 0 HB3 LYS A 111 1.331 -7.404 14.260 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -0.089 -8.440 15.672 1.00 0.00 H new ATOM 0 HG3 LYS A 111 1.052 -9.769 15.651 1.00 0.00 H new ATOM 0 HD2 LYS A 111 2.215 -8.317 17.574 1.00 0.00 H new ATOM 0 HD3 LYS A 111 0.590 -7.685 17.748 1.00 0.00 H new ATOM 0 HE2 LYS A 111 0.200 -10.404 17.626 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.699 -10.247 18.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -0.208 -10.157 19.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.614 -8.671 20.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -0.839 -8.823 19.144 1.00 0.00 H new ATOM 1799 N SER A 112 3.179 -10.607 13.000 1.00 0.00 N ATOM 1800 CA SER A 112 3.001 -11.335 11.752 1.00 0.00 C ATOM 1801 C SER A 112 2.448 -12.733 12.026 1.00 0.00 C ATOM 1802 O SER A 112 2.678 -13.294 13.099 1.00 0.00 O ATOM 1803 CB SER A 112 4.296 -11.404 10.953 1.00 0.00 C ATOM 1804 OG SER A 112 5.272 -12.190 11.614 1.00 0.00 O ATOM 0 H SER A 112 3.849 -11.034 13.640 1.00 0.00 H new ATOM 0 HA SER A 112 2.278 -10.790 11.145 1.00 0.00 H new ATOM 0 HB2 SER A 112 4.095 -11.824 9.968 1.00 0.00 H new ATOM 0 HB3 SER A 112 4.683 -10.397 10.797 1.00 0.00 H new ATOM 0 HG SER A 112 6.090 -12.216 11.076 1.00 0.00 H new ATOM 1810 N LYS A 113 1.975 -13.371 10.961 1.00 0.00 N ATOM 1811 CA LYS A 113 1.606 -14.777 10.998 1.00 0.00 C ATOM 1812 C LYS A 113 0.413 -14.993 11.924 1.00 0.00 C ATOM 1813 O LYS A 113 0.327 -14.397 12.994 1.00 0.00 O ATOM 1814 CB LYS A 113 2.764 -15.662 11.464 1.00 0.00 C ATOM 1815 CG LYS A 113 4.022 -15.541 10.604 1.00 0.00 C ATOM 1816 CD LYS A 113 4.156 -16.657 9.585 1.00 0.00 C ATOM 1817 CE LYS A 113 3.275 -16.535 8.413 1.00 0.00 C ATOM 1818 NZ LYS A 113 3.991 -16.874 7.157 1.00 0.00 N ATOM 0 H LYS A 113 1.838 -12.928 10.052 1.00 0.00 H new ATOM 0 HA LYS A 113 1.343 -15.061 9.979 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.013 -15.405 12.493 1.00 0.00 H new ATOM 0 HB3 LYS A 113 2.436 -16.701 11.466 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.009 -14.583 10.085 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.899 -15.541 11.251 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.190 -16.694 9.242 1.00 0.00 H new ATOM 0 HD3 LYS A 113 3.950 -17.607 10.079 1.00 0.00 H new ATOM 0 HE2 LYS A 113 2.415 -17.194 8.532 1.00 0.00 H new ATOM 0 HE3 LYS A 113 2.890 -15.517 8.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 3.342 -16.778 6.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.797 -16.228 7.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 4.337 -17.853 7.208 1.00 0.00 H new ATOM 1832 N LYS A 114 -0.457 -15.917 11.527 1.00 0.00 N ATOM 1833 CA LYS A 114 -1.509 -16.410 12.406 1.00 0.00 C ATOM 1834 C LYS A 114 -1.631 -17.924 12.292 1.00 0.00 C ATOM 1835 O LYS A 114 -2.653 -18.508 12.647 1.00 0.00 O ATOM 1836 CB LYS A 114 -2.863 -15.773 12.081 1.00 0.00 C ATOM 1837 CG LYS A 114 -3.104 -14.437 12.783 1.00 0.00 C ATOM 1838 CD LYS A 114 -4.431 -14.381 13.517 1.00 0.00 C ATOM 1839 CE LYS A 114 -4.607 -13.208 14.388 1.00 0.00 C ATOM 1840 NZ LYS A 114 -3.768 -13.308 15.610 1.00 0.00 N ATOM 0 H LYS A 114 -0.453 -16.340 10.599 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.232 -16.136 13.424 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.934 -15.624 11.004 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.656 -16.467 12.360 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.296 -14.255 13.491 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.069 -13.635 12.046 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.237 -14.395 12.783 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.534 -15.283 14.121 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.346 -12.303 13.839 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.656 -13.118 14.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.014 -12.538 16.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.938 -14.223 16.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -2.764 -13.233 15.349 1.00 0.00 H new ATOM 1854 N LYS A 115 -0.580 -18.544 11.767 1.00 0.00 N ATOM 1855 CA LYS A 115 -0.621 -19.954 11.404 1.00 0.00 C ATOM 1856 C LYS A 115 -0.031 -20.808 12.522 1.00 0.00 C ATOM 1857 O LYS A 115 1.174 -20.791 12.759 1.00 0.00 O ATOM 1858 CB LYS A 115 0.147 -20.231 10.109 1.00 0.00 C ATOM 1859 CG LYS A 115 -0.698 -20.885 9.016 1.00 0.00 C ATOM 1860 CD LYS A 115 0.061 -21.933 8.224 1.00 0.00 C ATOM 1861 CE LYS A 115 0.760 -21.424 7.032 1.00 0.00 C ATOM 1862 NZ LYS A 115 0.787 -22.435 5.945 1.00 0.00 N ATOM 0 H LYS A 115 0.314 -18.089 11.583 1.00 0.00 H new ATOM 0 HA LYS A 115 -1.668 -20.214 11.248 1.00 0.00 H new ATOM 0 HB2 LYS A 115 0.551 -19.292 9.730 1.00 0.00 H new ATOM 0 HB3 LYS A 115 0.997 -20.876 10.333 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -1.575 -21.346 9.470 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -1.060 -20.115 8.335 1.00 0.00 H new ATOM 0 HD2 LYS A 115 0.791 -22.406 8.881 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.638 -22.709 7.913 1.00 0.00 H new ATOM 0 HE2 LYS A 115 0.266 -20.520 6.677 1.00 0.00 H new ATOM 0 HE3 LYS A 115 1.780 -21.146 7.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 1.286 -22.045 5.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 1.280 -23.288 6.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.187 -22.681 5.675 1.00 0.00 H new ATOM 1876 N ALA A 116 -0.918 -21.442 13.282 1.00 0.00 N ATOM 1877 CA ALA A 116 -0.535 -22.113 14.516 1.00 0.00 C ATOM 1878 C ALA A 116 0.467 -23.227 14.225 1.00 0.00 C ATOM 1879 O ALA A 116 0.396 -23.881 13.187 1.00 0.00 O ATOM 1880 CB ALA A 116 -1.769 -22.659 15.227 1.00 0.00 C ATOM 0 H ALA A 116 -1.912 -21.504 13.062 1.00 0.00 H new ATOM 0 HA ALA A 116 -0.056 -21.390 15.176 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -1.467 -23.158 16.148 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -2.445 -21.838 15.464 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -2.277 -23.372 14.578 1.00 0.00 H new ATOM 1886 N GLN A 117 1.292 -23.525 15.223 1.00 0.00 N ATOM 1887 CA GLN A 117 2.156 -24.696 15.187 1.00 0.00 C ATOM 1888 C GLN A 117 3.249 -24.518 14.136 1.00 0.00 C ATOM 1889 O GLN A 117 4.396 -24.225 14.465 1.00 0.00 O ATOM 1890 CB GLN A 117 1.381 -25.996 14.958 1.00 0.00 C ATOM 1891 CG GLN A 117 0.821 -26.604 16.229 1.00 0.00 C ATOM 1892 CD GLN A 117 -0.215 -25.733 16.896 1.00 0.00 C ATOM 1893 OE1 GLN A 117 0.053 -24.613 17.322 1.00 0.00 O ATOM 1894 NE2 GLN A 117 -1.443 -26.246 16.939 1.00 0.00 N ATOM 0 H GLN A 117 1.379 -22.966 16.072 1.00 0.00 H new ATOM 0 HA GLN A 117 2.620 -24.783 16.170 1.00 0.00 H new ATOM 0 HB2 GLN A 117 0.561 -25.803 14.266 1.00 0.00 H new ATOM 0 HB3 GLN A 117 2.039 -26.721 14.478 1.00 0.00 H new ATOM 0 HG2 GLN A 117 0.378 -27.572 15.997 1.00 0.00 H new ATOM 0 HG3 GLN A 117 1.638 -26.787 16.928 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -1.618 -27.182 16.573 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -2.209 -25.703 17.338 1.00 0.00 H new ATOM 1903 N GLN A 118 2.903 -24.843 12.895 1.00 0.00 N ATOM 1904 CA GLN A 118 3.881 -24.938 11.822 1.00 0.00 C ATOM 1905 C GLN A 118 3.182 -24.946 10.465 1.00 0.00 C ATOM 1906 O GLN A 118 3.273 -23.985 9.704 1.00 0.00 O ATOM 1907 CB GLN A 118 4.807 -26.147 11.970 1.00 0.00 C ATOM 1908 CG GLN A 118 6.140 -25.821 12.617 1.00 0.00 C ATOM 1909 CD GLN A 118 7.304 -25.939 11.664 1.00 0.00 C ATOM 1910 OE1 GLN A 118 7.218 -26.548 10.602 1.00 0.00 O ATOM 1911 NE2 GLN A 118 8.440 -25.393 12.091 1.00 0.00 N ATOM 0 H GLN A 118 1.945 -25.046 12.608 1.00 0.00 H new ATOM 0 HA GLN A 118 4.516 -24.055 11.888 1.00 0.00 H new ATOM 0 HB2 GLN A 118 4.302 -26.909 12.564 1.00 0.00 H new ATOM 0 HB3 GLN A 118 4.987 -26.578 10.985 1.00 0.00 H new ATOM 0 HG2 GLN A 118 6.106 -24.807 13.016 1.00 0.00 H new ATOM 0 HG3 GLN A 118 6.301 -26.490 13.462 1.00 0.00 H new ATOM 0 HE21 GLN A 118 8.464 -24.896 12.981 1.00 0.00 H new ATOM 0 HE22 GLN A 118 9.287 -25.472 11.528 1.00 0.00 H new ATOM 1920 N ALA A 119 2.609 -26.096 10.128 1.00 0.00 N ATOM 1921 CA ALA A 119 2.110 -26.343 8.781 1.00 0.00 C ATOM 1922 C ALA A 119 1.306 -27.639 8.743 1.00 0.00 C ATOM 1923 O ALA A 119 1.231 -28.304 7.710 1.00 0.00 O ATOM 1924 CB ALA A 119 3.269 -26.386 7.789 1.00 0.00 C ATOM 0 H ALA A 119 2.478 -26.875 10.773 1.00 0.00 H new ATOM 0 HA ALA A 119 1.447 -25.527 8.494 1.00 0.00 H new ATOM 0 HB1 ALA A 119 2.883 -26.571 6.787 1.00 0.00 H new ATOM 0 HB2 ALA A 119 3.797 -25.432 7.804 1.00 0.00 H new ATOM 0 HB3 ALA A 119 3.956 -27.185 8.067 1.00 0.00 H new ATOM 1930 N ALA A 120 0.509 -27.838 9.791 1.00 0.00 N ATOM 1931 CA ALA A 120 -0.284 -29.052 9.927 1.00 0.00 C ATOM 1932 C ALA A 120 0.626 -30.274 10.006 1.00 0.00 C ATOM 1933 O ALA A 120 1.623 -30.366 9.292 1.00 0.00 O ATOM 1934 CB ALA A 120 -1.270 -29.175 8.770 1.00 0.00 C ATOM 0 H ALA A 120 0.397 -27.173 10.556 1.00 0.00 H new ATOM 0 HA ALA A 120 -0.856 -28.996 10.853 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -1.855 -30.087 8.886 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -1.938 -28.313 8.768 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -0.723 -29.212 7.828 1.00 0.00 H new ATOM 1940 N ALA A 121 0.319 -31.153 10.953 1.00 0.00 N ATOM 1941 CA ALA A 121 1.218 -32.243 11.313 1.00 0.00 C ATOM 1942 C ALA A 121 1.447 -33.157 10.112 1.00 0.00 C ATOM 1943 O ALA A 121 0.520 -33.804 9.629 1.00 0.00 O ATOM 1944 CB ALA A 121 0.657 -33.022 12.497 1.00 0.00 C ATOM 0 H ALA A 121 -0.550 -31.132 11.487 1.00 0.00 H new ATOM 0 HA ALA A 121 2.180 -31.825 11.609 1.00 0.00 H new ATOM 0 HB1 ALA A 121 1.338 -33.833 12.755 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.547 -32.355 13.352 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.316 -33.436 12.232 1.00 0.00 H new ATOM 1950 N ASP A 122 2.646 -33.065 9.547 1.00 0.00 N ATOM 1951 CA ASP A 122 2.952 -33.703 8.274 1.00 0.00 C ATOM 1952 C ASP A 122 3.073 -35.213 8.455 1.00 0.00 C ATOM 1953 O ASP A 122 2.498 -35.986 7.689 1.00 0.00 O ATOM 1954 CB ASP A 122 4.155 -33.056 7.595 1.00 0.00 C ATOM 1955 CG ASP A 122 5.391 -33.014 8.474 1.00 0.00 C ATOM 1956 OD1 ASP A 122 5.296 -32.795 9.691 1.00 0.00 O ATOM 1957 OD2 ASP A 122 6.485 -33.210 7.903 1.00 0.00 O ATOM 0 H ASP A 122 3.426 -32.550 9.955 1.00 0.00 H new ATOM 0 HA ASP A 122 2.123 -33.542 7.584 1.00 0.00 H new ATOM 0 HB2 ASP A 122 4.386 -33.604 6.682 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.893 -32.040 7.299 1.00 0.00 H new ATOM 1962 N THR A 123 3.619 -35.601 9.606 1.00 0.00 N ATOM 1963 CA THR A 123 3.794 -37.008 9.934 1.00 0.00 C ATOM 1964 C THR A 123 3.135 -37.328 11.273 1.00 0.00 C ATOM 1965 O THR A 123 3.801 -37.392 12.304 1.00 0.00 O ATOM 1966 CB THR A 123 5.327 -37.414 9.956 1.00 0.00 C ATOM 1967 OG1 THR A 123 6.047 -36.242 10.453 1.00 0.00 O ATOM 1968 CG2 THR A 123 5.860 -37.886 8.604 1.00 0.00 C ATOM 0 H THR A 123 3.947 -34.957 10.326 1.00 0.00 H new ATOM 0 HA THR A 123 3.308 -37.595 9.154 1.00 0.00 H new ATOM 0 HB THR A 123 5.472 -38.280 10.602 1.00 0.00 H new ATOM 0 HG1 THR A 123 7.006 -36.439 10.489 1.00 0.00 H new ATOM 0 HG21 THR A 123 6.914 -38.146 8.699 1.00 0.00 H new ATOM 0 HG22 THR A 123 5.299 -38.761 8.277 1.00 0.00 H new ATOM 0 HG23 THR A 123 5.748 -37.088 7.870 1.00 0.00 H new ATOM 1976 N GLY A 124 1.851 -37.663 11.208 1.00 0.00 N ATOM 1977 CA GLY A 124 1.134 -38.194 12.359 1.00 0.00 C ATOM 1978 C GLY A 124 0.713 -39.637 12.104 1.00 0.00 C ATOM 1979 O GLY A 124 1.548 -40.540 12.068 1.00 0.00 O ATOM 0 H GLY A 124 1.284 -37.575 10.365 1.00 0.00 H new ATOM 0 HA2 GLY A 124 1.768 -38.145 13.245 1.00 0.00 H new ATOM 0 HA3 GLY A 124 0.255 -37.582 12.562 1.00 0.00 H new ATOM 1983 N ASN A 125 -0.566 -39.811 11.791 1.00 0.00 N ATOM 1984 CA ASN A 125 -1.078 -41.089 11.315 1.00 0.00 C ATOM 1985 C ASN A 125 -1.645 -40.943 9.907 1.00 0.00 C ATOM 1986 O ASN A 125 -1.008 -41.330 8.928 1.00 0.00 O ATOM 1987 CB ASN A 125 -2.044 -41.717 12.317 1.00 0.00 C ATOM 1988 CG ASN A 125 -1.382 -42.109 13.624 1.00 0.00 C ATOM 1989 OD1 ASN A 125 -0.187 -42.438 13.656 1.00 0.00 O ATOM 1990 ND2 ASN A 125 -2.153 -42.072 14.710 1.00 0.00 N ATOM 0 H ASN A 125 -1.271 -39.077 11.859 1.00 0.00 H new ATOM 0 HA ASN A 125 -0.254 -41.798 11.240 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -2.851 -41.014 12.523 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -2.498 -42.601 11.868 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -1.765 -42.321 15.620 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -3.131 -41.794 14.632 1.00 0.00 H new ATOM 1997 N ASN A 126 -2.930 -40.601 9.849 1.00 0.00 N ATOM 1998 CA ASN A 126 -3.611 -40.399 8.579 1.00 0.00 C ATOM 1999 C ASN A 126 -3.606 -41.689 7.763 1.00 0.00 C ATOM 2000 O ASN A 126 -3.915 -41.680 6.573 1.00 0.00 O ATOM 2001 CB ASN A 126 -3.062 -39.185 7.831 1.00 0.00 C ATOM 2002 CG ASN A 126 -4.130 -38.410 7.082 1.00 0.00 C ATOM 2003 OD1 ASN A 126 -4.187 -38.445 5.844 1.00 0.00 O ATOM 2004 ND2 ASN A 126 -4.980 -37.706 7.827 1.00 0.00 N ATOM 0 H ASN A 126 -3.519 -40.459 10.670 1.00 0.00 H new ATOM 0 HA ASN A 126 -4.657 -40.160 8.770 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -2.571 -38.520 8.542 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -2.300 -39.516 7.125 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -5.720 -37.163 7.382 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -4.891 -37.710 8.843 1.00 0.00 H new ATOM 2011 N SER A 127 -3.408 -42.801 8.459 1.00 0.00 N ATOM 2012 CA SER A 127 -3.587 -44.122 7.872 1.00 0.00 C ATOM 2013 C SER A 127 -3.830 -45.160 8.964 1.00 0.00 C ATOM 2014 O SER A 127 -4.042 -44.815 10.125 1.00 0.00 O ATOM 2015 CB SER A 127 -2.403 -44.510 6.997 1.00 0.00 C ATOM 2016 OG SER A 127 -1.251 -44.784 7.774 1.00 0.00 O ATOM 0 H SER A 127 -3.121 -42.813 9.438 1.00 0.00 H new ATOM 0 HA SER A 127 -4.465 -44.089 7.228 1.00 0.00 H new ATOM 0 HB2 SER A 127 -2.660 -45.387 6.404 1.00 0.00 H new ATOM 0 HB3 SER A 127 -2.187 -43.703 6.296 1.00 0.00 H new ATOM 0 HG SER A 127 -0.509 -45.032 7.183 1.00 0.00 H new ATOM 2022 N GLN A 128 -3.945 -46.414 8.541 1.00 0.00 N ATOM 2023 CA GLN A 128 -4.388 -47.487 9.419 1.00 0.00 C ATOM 2024 C GLN A 128 -3.272 -48.509 9.613 1.00 0.00 C ATOM 2025 O GLN A 128 -3.183 -49.154 10.657 1.00 0.00 O ATOM 2026 CB GLN A 128 -5.672 -48.162 8.929 1.00 0.00 C ATOM 2027 CG GLN A 128 -6.585 -48.623 10.047 1.00 0.00 C ATOM 2028 CD GLN A 128 -8.034 -48.273 9.811 1.00 0.00 C ATOM 2029 OE1 GLN A 128 -8.843 -49.096 9.392 1.00 0.00 O ATOM 2030 NE2 GLN A 128 -8.375 -47.028 10.136 1.00 0.00 N ATOM 0 H GLN A 128 -3.736 -46.712 7.588 1.00 0.00 H new ATOM 0 HA GLN A 128 -4.627 -47.035 10.382 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -6.217 -47.466 8.291 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.407 -49.020 8.311 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -6.492 -49.703 10.162 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -6.257 -48.174 10.984 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -7.668 -46.379 10.480 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -9.344 -46.723 10.041 1.00 0.00 H new ATOM 2039 N VAL A 129 -2.526 -48.747 8.540 1.00 0.00 N ATOM 2040 CA VAL A 129 -1.564 -49.840 8.495 1.00 0.00 C ATOM 2041 C VAL A 129 -0.139 -49.297 8.568 1.00 0.00 C ATOM 2042 O VAL A 129 0.562 -49.235 7.560 1.00 0.00 O ATOM 2043 CB VAL A 129 -1.817 -50.729 7.260 1.00 0.00 C ATOM 2044 CG1 VAL A 129 -0.791 -51.848 7.126 1.00 0.00 C ATOM 2045 CG2 VAL A 129 -3.231 -51.285 7.248 1.00 0.00 C ATOM 0 H VAL A 129 -2.570 -48.193 7.685 1.00 0.00 H new ATOM 0 HA VAL A 129 -1.696 -50.480 9.367 1.00 0.00 H new ATOM 0 HB VAL A 129 -1.702 -50.082 6.390 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -1.015 -52.443 6.241 1.00 0.00 H new ATOM 0 HG12 VAL A 129 0.206 -51.418 7.031 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -0.829 -52.484 8.010 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.370 -51.906 6.363 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -3.393 -51.887 8.142 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.945 -50.462 7.230 1.00 0.00 H new ATOM 2055 N SER A 130 0.316 -49.059 9.794 1.00 0.00 N ATOM 2056 CA SER A 130 1.715 -48.745 10.050 1.00 0.00 C ATOM 2057 C SER A 130 2.028 -48.893 11.535 1.00 0.00 C ATOM 2058 O SER A 130 2.544 -49.921 11.970 1.00 0.00 O ATOM 2059 CB SER A 130 2.078 -47.355 9.545 1.00 0.00 C ATOM 2060 OG SER A 130 0.991 -46.456 9.674 1.00 0.00 O ATOM 0 H SER A 130 -0.269 -49.078 10.630 1.00 0.00 H new ATOM 0 HA SER A 130 2.328 -49.457 9.497 1.00 0.00 H new ATOM 0 HB2 SER A 130 2.934 -46.976 10.104 1.00 0.00 H new ATOM 0 HB3 SER A 130 2.381 -47.414 8.500 1.00 0.00 H new ATOM 0 HG SER A 130 1.256 -45.573 9.343 1.00 0.00 H new ATOM 2066 N GLN A 131 1.573 -47.917 12.313 1.00 0.00 N ATOM 2067 CA GLN A 131 1.601 -48.011 13.766 1.00 0.00 C ATOM 2068 C GLN A 131 0.616 -47.022 14.382 1.00 0.00 C ATOM 2069 O GLN A 131 0.776 -45.810 14.248 1.00 0.00 O ATOM 2070 CB GLN A 131 3.005 -47.820 14.344 1.00 0.00 C ATOM 2071 CG GLN A 131 3.661 -46.516 13.938 1.00 0.00 C ATOM 2072 CD GLN A 131 4.665 -46.680 12.822 1.00 0.00 C ATOM 2073 OE1 GLN A 131 4.397 -46.400 11.657 1.00 0.00 O ATOM 2074 NE2 GLN A 131 5.869 -47.101 13.204 1.00 0.00 N ATOM 0 H GLN A 131 1.178 -47.046 11.957 1.00 0.00 H new ATOM 0 HA GLN A 131 1.295 -49.024 14.028 1.00 0.00 H new ATOM 0 HB2 GLN A 131 2.949 -47.865 15.432 1.00 0.00 H new ATOM 0 HB3 GLN A 131 3.636 -48.649 14.023 1.00 0.00 H new ATOM 0 HG2 GLN A 131 2.891 -45.811 13.625 1.00 0.00 H new ATOM 0 HG3 GLN A 131 4.158 -46.081 14.805 1.00 0.00 H new ATOM 0 HE21 GLN A 131 6.045 -47.322 14.184 1.00 0.00 H new ATOM 0 HE22 GLN A 131 6.616 -47.203 12.516 1.00 0.00 H new ATOM 2083 N ASN A 132 -0.472 -47.561 14.919 1.00 0.00 N ATOM 2084 CA ASN A 132 -1.601 -46.751 15.355 1.00 0.00 C ATOM 2085 C ASN A 132 -1.434 -46.351 16.818 1.00 0.00 C ATOM 2086 O ASN A 132 -1.459 -45.169 17.153 1.00 0.00 O ATOM 2087 CB ASN A 132 -2.934 -47.426 15.039 1.00 0.00 C ATOM 2088 CG ASN A 132 -3.984 -46.465 14.514 1.00 0.00 C ATOM 2089 OD1 ASN A 132 -4.039 -46.184 13.307 1.00 0.00 O ATOM 2090 ND2 ASN A 132 -4.821 -45.956 15.415 1.00 0.00 N ATOM 0 H ASN A 132 -0.596 -48.563 15.063 1.00 0.00 H new ATOM 0 HA ASN A 132 -1.616 -45.823 14.784 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -2.770 -48.212 14.302 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -3.312 -47.909 15.940 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -5.549 -45.303 15.124 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -4.735 -46.219 16.397 1.00 0.00 H new ATOM 2097 N TYR A 133 -1.113 -47.340 17.645 1.00 0.00 N ATOM 2098 CA TYR A 133 -0.712 -47.095 19.022 1.00 0.00 C ATOM 2099 C TYR A 133 -1.874 -46.503 19.816 1.00 0.00 C ATOM 2100 O TYR A 133 -2.867 -46.069 19.214 1.00 0.00 O ATOM 2101 CB TYR A 133 0.522 -46.170 19.085 1.00 0.00 C ATOM 2102 CG TYR A 133 1.471 -46.475 20.220 1.00 0.00 C ATOM 2103 CD1 TYR A 133 2.406 -47.505 20.102 1.00 0.00 C ATOM 2104 CD2 TYR A 133 1.451 -45.739 21.407 1.00 0.00 C ATOM 2105 CE1 TYR A 133 3.268 -47.824 21.147 1.00 0.00 C ATOM 2106 CE2 TYR A 133 2.314 -46.039 22.460 1.00 0.00 C ATOM 2107 CZ TYR A 133 3.208 -47.100 22.329 1.00 0.00 C ATOM 2108 OH TYR A 133 4.034 -47.475 23.352 1.00 0.00 O ATOM 2109 OXT TYR A 133 -1.910 -46.648 21.047 1.00 0.00 O ATOM 0 H TYR A 133 -1.124 -48.325 17.381 1.00 0.00 H new ATOM 0 HA TYR A 133 -0.436 -48.049 19.471 1.00 0.00 H new ATOM 0 HB2 TYR A 133 1.065 -46.244 18.143 1.00 0.00 H new ATOM 0 HB3 TYR A 133 0.183 -45.138 19.177 1.00 0.00 H new ATOM 0 HD1 TYR A 133 2.462 -48.066 19.181 1.00 0.00 H new ATOM 0 HD2 TYR A 133 0.753 -44.921 21.511 1.00 0.00 H new ATOM 0 HE1 TYR A 133 3.979 -48.630 21.039 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.290 -45.455 23.368 1.00 0.00 H new ATOM 0 HH TYR A 133 3.891 -46.884 24.121 1.00 0.00 H new TER 2119 TYR A 133