USER MOD reduce.3.24.130724 H: found=0, std=0, add=1291, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1284 hydrogens (24 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 153 HIS : no HD1:sc= -6.4! C(o=-6.4!,f=-8.5!) USER MOD Set 1.2: A 155 TYR OH : rot 141:sc= 0.00738 USER MOD Set 2.1: A 39 MET CE :methyl 144:sc= -2.57! (180deg=-6.32!) USER MOD Set 2.2: A 59 ASN : amide:sc= -3.43! X(o=-6!,f=-6.4) USER MOD Set 3.1: A 58 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 92 GLN : amide:sc= -0.141 X(o=-0.14,f=-0.015) USER MOD Single : A 1 THR N :NH3+ 149:sc= 0.164 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 123:sc= 1.34 USER MOD Single : A 7 GLN : amide:sc= 0.797 K(o=0.8,f=-5.7!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -0.333 K(o=-0.33,f=-2.4) USER MOD Single : A 22 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.22) USER MOD Single : A 28 HIS : no HD1:sc= -0.187 X(o=-0.19,f=-0.46) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -5.59 K(o=-5.6,f=-9.6!) USER MOD Single : A 34 THR OG1 : rot -75:sc= 0.598 USER MOD Single : A 37 LYS NZ :NH3+ -149:sc= 0.39 (180deg=0.0731) USER MOD Single : A 45 THR OG1 : rot -160:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.759 USER MOD Single : A 48 SER OG : rot -179:sc= 0.00725 USER MOD Single : A 51 LYS NZ :NH3+ -127:sc= -0.599 (180deg=-3.39!) USER MOD Single : A 63 THR OG1 : rot -160:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 65 GLN : amide:sc= -0.0198 X(o=-0.02,f=0) USER MOD Single : A 68 TYR OH : rot 90:sc= -0.123 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -5.06! C(o=-5.1!,f=-8.5!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 HIS : no HD1:sc= -0.556 K(o=-0.56,f=0) USER MOD Single : A 101 GLN : amide:sc=-0.00452 X(o=-0.0045,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= -1.88! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -100:sc= 1.47 USER MOD Single : A 121 SER OG : rot -85:sc= 1.2 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000824) USER MOD Single : A 128 MET CE :methyl 179:sc= -1.57 (180deg=-1.63) USER MOD Single : A 132 ASN : amide:sc= -0.85 X(o=-0.85,f=-0.73) USER MOD Single : A 137 THR OG1 : rot 180:sc= -0.0025 USER MOD Single : A 138 LYS NZ :NH3+ -125:sc=-0.00999 (180deg=-0.287) USER MOD Single : A 140 SER OG : rot 180:sc= -0.0538 USER MOD Single : A 141 SER OG : rot 30:sc= 0.8 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0122 USER MOD Single : A 148 ASN : amide:sc= -1.6 K(o=-1.6,f=-5.4!) USER MOD Single : A 152 THR OG1 : rot 120:sc= 0.153 USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 159 GLN : amide:sc= -0.0292 K(o=-0.029,f=-3.1!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -3.372 6.483 3.971 1.00 0.00 N ATOM 2 CA THR A 1 -3.377 5.221 3.177 1.00 0.00 C ATOM 3 C THR A 1 -1.976 4.608 3.188 1.00 0.00 C ATOM 4 O THR A 1 -1.005 5.265 3.513 1.00 0.00 O ATOM 5 CB THR A 1 -3.789 5.528 1.735 1.00 0.00 C ATOM 6 OG1 THR A 1 -4.954 6.342 1.739 1.00 0.00 O ATOM 7 CG2 THR A 1 -4.079 4.221 0.997 1.00 0.00 C ATOM 0 H1 THR A 1 -4.071 7.144 3.576 1.00 0.00 H new ATOM 0 H2 THR A 1 -3.616 6.272 4.960 1.00 0.00 H new ATOM 0 H3 THR A 1 -2.426 6.914 3.932 1.00 0.00 H new ATOM 0 HA THR A 1 -4.085 4.518 3.615 1.00 0.00 H new ATOM 0 HB THR A 1 -2.980 6.056 1.230 1.00 0.00 H new ATOM 0 HG1 THR A 1 -4.774 7.173 1.252 1.00 0.00 H new ATOM 0 HG21 THR A 1 -4.372 4.440 -0.030 1.00 0.00 H new ATOM 0 HG22 THR A 1 -3.184 3.599 0.994 1.00 0.00 H new ATOM 0 HG23 THR A 1 -4.888 3.691 1.500 1.00 0.00 H new ATOM 17 N ALA A 2 -1.867 3.352 2.835 1.00 0.00 N ATOM 18 CA ALA A 2 -0.532 2.685 2.821 1.00 0.00 C ATOM 19 C ALA A 2 -0.383 1.862 1.541 1.00 0.00 C ATOM 20 O ALA A 2 -1.167 0.970 1.273 1.00 0.00 O ATOM 21 CB ALA A 2 -0.409 1.764 4.037 1.00 0.00 C ATOM 0 H ALA A 2 -2.648 2.759 2.555 1.00 0.00 H new ATOM 0 HA ALA A 2 0.251 3.442 2.857 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.566 1.277 4.027 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.512 2.351 4.950 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.193 1.008 4.001 1.00 0.00 H new ATOM 27 N PHE A 3 0.617 2.157 0.749 1.00 0.00 N ATOM 28 CA PHE A 3 0.827 1.396 -0.517 1.00 0.00 C ATOM 29 C PHE A 3 1.767 0.218 -0.252 1.00 0.00 C ATOM 30 O PHE A 3 2.632 0.285 0.600 1.00 0.00 O ATOM 31 CB PHE A 3 1.448 2.318 -1.569 1.00 0.00 C ATOM 32 CG PHE A 3 0.363 3.120 -2.246 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.521 3.893 -1.481 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.241 3.094 -3.640 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.526 4.638 -2.110 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.765 3.838 -4.269 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.647 4.610 -3.504 1.00 0.00 C ATOM 0 H PHE A 3 1.298 2.895 0.927 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.130 1.023 -0.881 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.169 2.987 -1.100 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.993 1.729 -2.307 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -0.427 3.914 -0.405 1.00 0.00 H new ATOM 0 HD2 PHE A 3 0.923 2.500 -4.231 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.207 5.234 -1.520 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -0.860 3.816 -5.345 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.422 5.185 -3.990 1.00 0.00 H new ATOM 47 N LEU A 4 1.602 -0.858 -0.978 1.00 0.00 N ATOM 48 CA LEU A 4 2.481 -2.047 -0.778 1.00 0.00 C ATOM 49 C LEU A 4 2.433 -2.930 -2.026 1.00 0.00 C ATOM 50 O LEU A 4 1.427 -3.551 -2.316 1.00 0.00 O ATOM 51 CB LEU A 4 1.990 -2.845 0.433 1.00 0.00 C ATOM 52 CG LEU A 4 2.964 -3.988 0.723 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.129 -3.466 1.565 1.00 0.00 C ATOM 54 CD2 LEU A 4 2.237 -5.095 1.492 1.00 0.00 C ATOM 0 H LEU A 4 0.893 -0.964 -1.704 1.00 0.00 H new ATOM 0 HA LEU A 4 3.506 -1.719 -0.605 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.909 -2.193 1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.994 -3.243 0.240 1.00 0.00 H new ATOM 0 HG LEU A 4 3.345 -4.387 -0.217 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.823 -4.281 1.771 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.647 -2.677 1.020 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.748 -3.067 2.505 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.931 -5.910 1.699 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.856 -4.695 2.432 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.406 -5.469 0.893 1.00 0.00 H new ATOM 66 N TRP A 5 3.513 -2.988 -2.767 1.00 0.00 N ATOM 67 CA TRP A 5 3.532 -3.828 -3.998 1.00 0.00 C ATOM 68 C TRP A 5 4.918 -4.463 -4.171 1.00 0.00 C ATOM 69 O TRP A 5 5.925 -3.886 -3.801 1.00 0.00 O ATOM 70 CB TRP A 5 3.191 -2.955 -5.218 1.00 0.00 C ATOM 71 CG TRP A 5 4.224 -1.882 -5.402 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.130 -1.848 -6.407 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.475 -0.699 -4.586 1.00 0.00 C ATOM 74 NE1 TRP A 5 5.920 -0.723 -6.261 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.556 0.017 -5.154 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.879 -0.182 -3.421 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.028 1.202 -4.588 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.352 1.011 -2.848 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.425 1.700 -3.431 1.00 0.00 C ATOM 0 H TRP A 5 4.380 -2.489 -2.570 1.00 0.00 H new ATOM 0 HA TRP A 5 2.791 -4.622 -3.910 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.139 -3.575 -6.113 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.208 -2.503 -5.086 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.221 -2.581 -7.195 1.00 0.00 H new ATOM 0 HE1 TRP A 5 6.679 -0.471 -6.894 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.052 -0.706 -2.964 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.854 1.730 -5.041 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.887 1.399 -1.954 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.785 2.616 -2.985 1.00 0.00 H new ATOM 90 N ALA A 6 4.973 -5.643 -4.734 1.00 0.00 N ATOM 91 CA ALA A 6 6.286 -6.321 -4.939 1.00 0.00 C ATOM 92 C ALA A 6 6.788 -6.031 -6.355 1.00 0.00 C ATOM 93 O ALA A 6 6.217 -6.486 -7.329 1.00 0.00 O ATOM 94 CB ALA A 6 6.116 -7.830 -4.756 1.00 0.00 C ATOM 0 H ALA A 6 4.161 -6.167 -5.061 1.00 0.00 H new ATOM 0 HA ALA A 6 7.007 -5.948 -4.212 1.00 0.00 H new ATOM 0 HB1 ALA A 6 7.075 -8.325 -4.906 1.00 0.00 H new ATOM 0 HB2 ALA A 6 5.755 -8.036 -3.748 1.00 0.00 H new ATOM 0 HB3 ALA A 6 5.396 -8.206 -5.483 1.00 0.00 H new ATOM 100 N GLN A 7 7.850 -5.275 -6.475 1.00 0.00 N ATOM 101 CA GLN A 7 8.394 -4.949 -7.826 1.00 0.00 C ATOM 102 C GLN A 7 9.906 -5.174 -7.839 1.00 0.00 C ATOM 103 O GLN A 7 10.574 -5.018 -6.834 1.00 0.00 O ATOM 104 CB GLN A 7 8.094 -3.485 -8.156 1.00 0.00 C ATOM 105 CG GLN A 7 8.616 -2.589 -7.031 1.00 0.00 C ATOM 106 CD GLN A 7 8.809 -1.166 -7.557 1.00 0.00 C ATOM 107 OE1 GLN A 7 7.868 -0.537 -8.001 1.00 0.00 O ATOM 108 NE2 GLN A 7 9.996 -0.627 -7.527 1.00 0.00 N ATOM 0 H GLN A 7 8.364 -4.869 -5.693 1.00 0.00 H new ATOM 0 HA GLN A 7 7.926 -5.594 -8.570 1.00 0.00 H new ATOM 0 HB2 GLN A 7 8.564 -3.211 -9.101 1.00 0.00 H new ATOM 0 HB3 GLN A 7 7.021 -3.342 -8.280 1.00 0.00 H new ATOM 0 HG2 GLN A 7 7.913 -2.587 -6.198 1.00 0.00 H new ATOM 0 HG3 GLN A 7 9.560 -2.978 -6.651 1.00 0.00 H new ATOM 0 HE21 GLN A 7 10.786 -1.154 -7.155 1.00 0.00 H new ATOM 0 HE22 GLN A 7 10.134 0.321 -7.876 1.00 0.00 H new ATOM 117 N ASP A 8 10.448 -5.537 -8.973 1.00 0.00 N ATOM 118 CA ASP A 8 11.919 -5.773 -9.066 1.00 0.00 C ATOM 119 C ASP A 8 12.593 -4.550 -9.693 1.00 0.00 C ATOM 120 O ASP A 8 11.933 -3.656 -10.189 1.00 0.00 O ATOM 121 CB ASP A 8 12.192 -7.009 -9.931 1.00 0.00 C ATOM 122 CG ASP A 8 11.440 -6.892 -11.259 1.00 0.00 C ATOM 123 OD1 ASP A 8 11.448 -5.816 -11.832 1.00 0.00 O ATOM 124 OD2 ASP A 8 10.867 -7.884 -11.681 1.00 0.00 O ATOM 0 H ASP A 8 9.933 -5.680 -9.841 1.00 0.00 H new ATOM 0 HA ASP A 8 12.321 -5.938 -8.067 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.262 -7.105 -10.116 1.00 0.00 H new ATOM 0 HB3 ASP A 8 11.878 -7.910 -9.403 1.00 0.00 H new ATOM 129 N ARG A 9 13.900 -4.508 -9.674 1.00 0.00 N ATOM 130 CA ARG A 9 14.629 -3.345 -10.267 1.00 0.00 C ATOM 131 C ARG A 9 14.312 -3.242 -11.762 1.00 0.00 C ATOM 132 O ARG A 9 14.533 -2.216 -12.379 1.00 0.00 O ATOM 133 CB ARG A 9 16.135 -3.540 -10.078 1.00 0.00 C ATOM 134 CG ARG A 9 16.548 -4.901 -10.643 1.00 0.00 C ATOM 135 CD ARG A 9 18.074 -5.018 -10.628 1.00 0.00 C ATOM 136 NE ARG A 9 18.647 -4.196 -11.739 1.00 0.00 N ATOM 137 CZ ARG A 9 19.939 -4.204 -11.990 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.760 -4.931 -11.274 1.00 0.00 N ATOM 139 NH2 ARG A 9 20.410 -3.475 -12.966 1.00 0.00 N ATOM 0 H ARG A 9 14.497 -5.231 -9.272 1.00 0.00 H new ATOM 0 HA ARG A 9 14.312 -2.429 -9.769 1.00 0.00 H new ATOM 0 HB2 ARG A 9 16.682 -2.744 -10.583 1.00 0.00 H new ATOM 0 HB3 ARG A 9 16.390 -3.481 -9.020 1.00 0.00 H new ATOM 0 HG2 ARG A 9 16.105 -5.702 -10.051 1.00 0.00 H new ATOM 0 HG3 ARG A 9 16.174 -5.013 -11.661 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.466 -4.678 -9.670 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.371 -6.061 -10.742 1.00 0.00 H new ATOM 0 HE ARG A 9 18.028 -3.621 -12.310 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.401 -5.502 -10.509 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.759 -4.926 -11.481 1.00 0.00 H new ATOM 0 HH21 ARG A 9 19.778 -2.905 -13.528 1.00 0.00 H new ATOM 0 HH22 ARG A 9 21.410 -3.476 -13.167 1.00 0.00 H new ATOM 153 N ASP A 10 13.799 -4.294 -12.348 1.00 0.00 N ATOM 154 CA ASP A 10 13.467 -4.261 -13.804 1.00 0.00 C ATOM 155 C ASP A 10 12.168 -3.477 -14.024 1.00 0.00 C ATOM 156 O ASP A 10 11.571 -3.539 -15.082 1.00 0.00 O ATOM 157 CB ASP A 10 13.291 -5.691 -14.318 1.00 0.00 C ATOM 158 CG ASP A 10 14.663 -6.295 -14.627 1.00 0.00 C ATOM 159 OD1 ASP A 10 15.447 -6.439 -13.704 1.00 0.00 O ATOM 160 OD2 ASP A 10 14.906 -6.603 -15.783 1.00 0.00 O ATOM 0 H ASP A 10 13.595 -5.177 -11.879 1.00 0.00 H new ATOM 0 HA ASP A 10 14.277 -3.773 -14.346 1.00 0.00 H new ATOM 0 HB2 ASP A 10 12.775 -6.296 -13.572 1.00 0.00 H new ATOM 0 HB3 ASP A 10 12.671 -5.693 -15.214 1.00 0.00 H new ATOM 165 N GLY A 11 11.728 -2.742 -13.033 1.00 0.00 N ATOM 166 CA GLY A 11 10.470 -1.952 -13.179 1.00 0.00 C ATOM 167 C GLY A 11 9.293 -2.900 -13.416 1.00 0.00 C ATOM 168 O GLY A 11 8.386 -2.599 -14.170 1.00 0.00 O ATOM 0 H GLY A 11 12.188 -2.656 -12.127 1.00 0.00 H new ATOM 0 HA2 GLY A 11 10.296 -1.357 -12.282 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.561 -1.254 -14.011 1.00 0.00 H new ATOM 172 N LEU A 12 9.301 -4.041 -12.776 1.00 0.00 N ATOM 173 CA LEU A 12 8.186 -5.016 -12.957 1.00 0.00 C ATOM 174 C LEU A 12 7.389 -5.128 -11.657 1.00 0.00 C ATOM 175 O LEU A 12 7.824 -4.678 -10.613 1.00 0.00 O ATOM 176 CB LEU A 12 8.760 -6.386 -13.322 1.00 0.00 C ATOM 177 CG LEU A 12 7.746 -7.155 -14.169 1.00 0.00 C ATOM 178 CD1 LEU A 12 7.821 -6.674 -15.619 1.00 0.00 C ATOM 179 CD2 LEU A 12 8.066 -8.651 -14.112 1.00 0.00 C ATOM 0 H LEU A 12 10.035 -4.340 -12.134 1.00 0.00 H new ATOM 0 HA LEU A 12 7.530 -4.672 -13.757 1.00 0.00 H new ATOM 0 HB2 LEU A 12 9.693 -6.266 -13.873 1.00 0.00 H new ATOM 0 HB3 LEU A 12 8.994 -6.947 -12.417 1.00 0.00 H new ATOM 0 HG LEU A 12 6.743 -6.981 -13.781 1.00 0.00 H new ATOM 0 HD11 LEU A 12 7.098 -7.223 -16.222 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.595 -5.609 -15.661 1.00 0.00 H new ATOM 0 HD13 LEU A 12 8.824 -6.847 -16.008 1.00 0.00 H new ATOM 0 HD21 LEU A 12 7.344 -9.201 -14.715 1.00 0.00 H new ATOM 0 HD22 LEU A 12 9.070 -8.823 -14.501 1.00 0.00 H new ATOM 0 HD23 LEU A 12 8.013 -8.995 -13.079 1.00 0.00 H new ATOM 191 N ILE A 13 6.226 -5.726 -11.713 1.00 0.00 N ATOM 192 CA ILE A 13 5.392 -5.872 -10.484 1.00 0.00 C ATOM 193 C ILE A 13 4.743 -7.258 -10.468 1.00 0.00 C ATOM 194 O ILE A 13 4.486 -7.819 -9.418 1.00 0.00 O ATOM 195 CB ILE A 13 4.302 -4.798 -10.475 1.00 0.00 C ATOM 196 CG1 ILE A 13 3.513 -4.862 -11.786 1.00 0.00 C ATOM 197 CG2 ILE A 13 4.945 -3.418 -10.336 1.00 0.00 C ATOM 198 CD1 ILE A 13 2.305 -3.928 -11.700 1.00 0.00 C ATOM 0 H ILE A 13 5.818 -6.120 -12.560 1.00 0.00 H new ATOM 0 HA ILE A 13 6.023 -5.756 -9.603 1.00 0.00 H new ATOM 0 HB ILE A 13 3.629 -4.971 -9.635 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.151 -4.573 -12.621 1.00 0.00 H new ATOM 0 HG13 ILE A 13 3.184 -5.884 -11.975 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.168 -2.654 -10.330 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.508 -3.371 -9.404 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.618 -3.244 -11.175 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.743 -3.973 -12.633 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.664 -4.238 -10.875 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.646 -2.907 -11.531 1.00 0.00 H new ATOM 210 N GLY A 14 4.477 -7.813 -11.624 1.00 0.00 N ATOM 211 CA GLY A 14 3.845 -9.163 -11.684 1.00 0.00 C ATOM 212 C GLY A 14 3.833 -9.661 -13.131 1.00 0.00 C ATOM 213 O GLY A 14 4.474 -9.095 -13.995 1.00 0.00 O ATOM 0 H GLY A 14 4.671 -7.387 -12.530 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.395 -9.861 -11.053 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.827 -9.117 -11.296 1.00 0.00 H new ATOM 217 N LYS A 15 3.106 -10.717 -13.396 1.00 0.00 N ATOM 218 CA LYS A 15 3.044 -11.262 -14.783 1.00 0.00 C ATOM 219 C LYS A 15 1.950 -12.329 -14.863 1.00 0.00 C ATOM 220 O LYS A 15 1.997 -13.329 -14.173 1.00 0.00 O ATOM 221 CB LYS A 15 4.393 -11.886 -15.147 1.00 0.00 C ATOM 222 CG LYS A 15 4.507 -12.008 -16.668 1.00 0.00 C ATOM 223 CD LYS A 15 3.777 -13.269 -17.135 1.00 0.00 C ATOM 224 CE LYS A 15 4.301 -13.682 -18.512 1.00 0.00 C ATOM 225 NZ LYS A 15 3.982 -15.117 -18.754 1.00 0.00 N ATOM 0 H LYS A 15 2.551 -11.226 -12.708 1.00 0.00 H new ATOM 0 HA LYS A 15 2.817 -10.456 -15.480 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.206 -11.272 -14.759 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.487 -12.869 -14.685 1.00 0.00 H new ATOM 0 HG2 LYS A 15 4.078 -11.128 -17.147 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.556 -12.052 -16.962 1.00 0.00 H new ATOM 0 HD2 LYS A 15 3.930 -14.077 -16.419 1.00 0.00 H new ATOM 0 HD3 LYS A 15 2.704 -13.084 -17.183 1.00 0.00 H new ATOM 0 HE2 LYS A 15 3.849 -13.062 -19.286 1.00 0.00 H new ATOM 0 HE3 LYS A 15 5.378 -13.524 -18.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 4.338 -15.399 -19.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 4.434 -15.701 -18.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 2.952 -15.254 -18.720 1.00 0.00 H new ATOM 239 N ASP A 16 0.965 -12.120 -15.702 1.00 0.00 N ATOM 240 CA ASP A 16 -0.143 -13.116 -15.838 1.00 0.00 C ATOM 241 C ASP A 16 -0.851 -13.290 -14.490 1.00 0.00 C ATOM 242 O ASP A 16 -1.376 -14.345 -14.189 1.00 0.00 O ATOM 243 CB ASP A 16 0.426 -14.462 -16.293 1.00 0.00 C ATOM 244 CG ASP A 16 0.341 -14.566 -17.817 1.00 0.00 C ATOM 245 OD1 ASP A 16 0.709 -13.608 -18.477 1.00 0.00 O ATOM 246 OD2 ASP A 16 -0.091 -15.600 -18.298 1.00 0.00 O ATOM 0 H ASP A 16 0.881 -11.299 -16.301 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.858 -12.756 -16.578 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.462 -14.558 -15.969 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.130 -15.278 -15.831 1.00 0.00 H new ATOM 251 N GLY A 17 -0.868 -12.260 -13.683 1.00 0.00 N ATOM 252 CA GLY A 17 -1.539 -12.354 -12.353 1.00 0.00 C ATOM 253 C GLY A 17 -0.521 -12.785 -11.295 1.00 0.00 C ATOM 254 O GLY A 17 -0.255 -12.065 -10.351 1.00 0.00 O ATOM 0 H GLY A 17 -0.444 -11.355 -13.889 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -1.973 -11.391 -12.084 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -2.359 -13.071 -12.397 1.00 0.00 H new ATOM 258 N HIS A 18 0.047 -13.954 -11.448 1.00 0.00 N ATOM 259 CA HIS A 18 1.050 -14.439 -10.455 1.00 0.00 C ATOM 260 C HIS A 18 2.363 -13.676 -10.642 1.00 0.00 C ATOM 261 O HIS A 18 2.538 -12.957 -11.607 1.00 0.00 O ATOM 262 CB HIS A 18 1.293 -15.938 -10.662 1.00 0.00 C ATOM 263 CG HIS A 18 1.667 -16.198 -12.097 1.00 0.00 C ATOM 264 ND1 HIS A 18 2.972 -16.089 -12.552 1.00 0.00 N ATOM 265 CD2 HIS A 18 0.919 -16.563 -13.188 1.00 0.00 C ATOM 266 CE1 HIS A 18 2.969 -16.384 -13.864 1.00 0.00 C ATOM 267 NE2 HIS A 18 1.743 -16.679 -14.303 1.00 0.00 N ATOM 0 H HIS A 18 -0.142 -14.594 -12.220 1.00 0.00 H new ATOM 0 HA HIS A 18 0.673 -14.270 -9.446 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.088 -16.282 -10.001 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.397 -16.501 -10.402 1.00 0.00 H new ATOM 0 HD1 HIS A 18 3.786 -15.832 -11.994 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -0.147 -16.734 -13.182 1.00 0.00 H new ATOM 0 HE1 HIS A 18 3.851 -16.382 -14.487 1.00 0.00 H new ATOM 275 N LEU A 19 3.284 -13.829 -9.724 1.00 0.00 N ATOM 276 CA LEU A 19 4.589 -13.115 -9.840 1.00 0.00 C ATOM 277 C LEU A 19 5.542 -13.933 -10.725 1.00 0.00 C ATOM 278 O LEU A 19 5.384 -15.132 -10.846 1.00 0.00 O ATOM 279 CB LEU A 19 5.204 -12.947 -8.449 1.00 0.00 C ATOM 280 CG LEU A 19 4.488 -11.816 -7.709 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.834 -11.883 -6.220 1.00 0.00 C ATOM 282 CD2 LEU A 19 4.942 -10.470 -8.277 1.00 0.00 C ATOM 0 H LEU A 19 3.187 -14.419 -8.898 1.00 0.00 H new ATOM 0 HA LEU A 19 4.428 -12.134 -10.287 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.117 -13.877 -7.886 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.268 -12.724 -8.534 1.00 0.00 H new ATOM 0 HG LEU A 19 3.411 -11.921 -7.837 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.324 -11.077 -5.691 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.513 -12.843 -5.815 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.911 -11.777 -6.092 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.433 -9.663 -7.751 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.019 -10.365 -8.147 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.698 -10.422 -9.338 1.00 0.00 H new ATOM 294 N PRO A 20 6.509 -13.267 -11.324 1.00 0.00 N ATOM 295 CA PRO A 20 7.544 -13.875 -12.228 1.00 0.00 C ATOM 296 C PRO A 20 8.639 -14.544 -11.393 1.00 0.00 C ATOM 297 O PRO A 20 9.271 -15.489 -11.826 1.00 0.00 O ATOM 298 CB PRO A 20 8.129 -12.732 -13.052 1.00 0.00 C ATOM 299 CG PRO A 20 7.690 -11.434 -12.407 1.00 0.00 C ATOM 300 CD PRO A 20 6.780 -11.785 -11.233 1.00 0.00 C ATOM 0 HA PRO A 20 7.108 -14.637 -12.874 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.217 -12.797 -13.080 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.780 -12.785 -14.083 1.00 0.00 H new ATOM 0 HG2 PRO A 20 8.555 -10.865 -12.064 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.162 -10.808 -13.127 1.00 0.00 H new ATOM 0 HD2 PRO A 20 7.257 -11.536 -10.285 1.00 0.00 H new ATOM 0 HD3 PRO A 20 5.850 -11.218 -11.280 1.00 0.00 H new ATOM 308 N TRP A 21 8.866 -14.059 -10.198 1.00 0.00 N ATOM 309 CA TRP A 21 9.920 -14.659 -9.327 1.00 0.00 C ATOM 310 C TRP A 21 9.259 -15.457 -8.201 1.00 0.00 C ATOM 311 O TRP A 21 8.068 -15.357 -7.974 1.00 0.00 O ATOM 312 CB TRP A 21 10.787 -13.546 -8.728 1.00 0.00 C ATOM 313 CG TRP A 21 9.918 -12.546 -8.033 1.00 0.00 C ATOM 314 CD1 TRP A 21 9.457 -12.667 -6.767 1.00 0.00 C ATOM 315 CD2 TRP A 21 9.399 -11.283 -8.539 1.00 0.00 C ATOM 316 NE1 TRP A 21 8.689 -11.557 -6.463 1.00 0.00 N ATOM 317 CE2 TRP A 21 8.623 -10.676 -7.523 1.00 0.00 C ATOM 318 CE3 TRP A 21 9.525 -10.610 -9.768 1.00 0.00 C ATOM 319 CZ2 TRP A 21 7.994 -9.445 -7.721 1.00 0.00 C ATOM 320 CZ3 TRP A 21 8.894 -9.372 -9.970 1.00 0.00 C ATOM 321 CH2 TRP A 21 8.129 -8.791 -8.948 1.00 0.00 C ATOM 0 H TRP A 21 8.365 -13.271 -9.788 1.00 0.00 H new ATOM 0 HA TRP A 21 10.547 -15.323 -9.922 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.504 -13.970 -8.025 1.00 0.00 H new ATOM 0 HB3 TRP A 21 11.362 -13.057 -9.514 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.656 -13.495 -6.102 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.228 -11.408 -5.565 1.00 0.00 H new ATOM 0 HE3 TRP A 21 10.111 -11.049 -10.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 7.407 -9.001 -6.930 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 8.998 -8.864 -10.918 1.00 0.00 H new ATOM 0 HH2 TRP A 21 7.645 -7.839 -9.109 1.00 0.00 H new ATOM 332 N HIS A 22 10.027 -16.248 -7.495 1.00 0.00 N ATOM 333 CA HIS A 22 9.454 -17.059 -6.380 1.00 0.00 C ATOM 334 C HIS A 22 10.116 -16.651 -5.062 1.00 0.00 C ATOM 335 O HIS A 22 11.159 -17.163 -4.699 1.00 0.00 O ATOM 336 CB HIS A 22 9.712 -18.543 -6.643 1.00 0.00 C ATOM 337 CG HIS A 22 8.805 -19.372 -5.776 1.00 0.00 C ATOM 338 ND1 HIS A 22 7.425 -19.252 -5.822 1.00 0.00 N ATOM 339 CD2 HIS A 22 9.066 -20.337 -4.835 1.00 0.00 C ATOM 340 CE1 HIS A 22 6.912 -20.123 -4.933 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.869 -20.810 -4.304 1.00 0.00 N ATOM 0 H HIS A 22 11.029 -16.367 -7.644 1.00 0.00 H new ATOM 0 HA HIS A 22 8.380 -16.884 -6.317 1.00 0.00 H new ATOM 0 HB2 HIS A 22 9.537 -18.773 -7.694 1.00 0.00 H new ATOM 0 HB3 HIS A 22 10.754 -18.785 -6.433 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.050 -20.678 -4.550 1.00 0.00 H new ATOM 0 HE1 HIS A 22 5.855 -20.251 -4.751 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.749 -21.527 -3.589 1.00 0.00 H new ATOM 349 N LEU A 23 9.517 -15.735 -4.345 1.00 0.00 N ATOM 350 CA LEU A 23 10.105 -15.286 -3.048 1.00 0.00 C ATOM 351 C LEU A 23 9.163 -15.679 -1.897 1.00 0.00 C ATOM 352 O LEU A 23 8.405 -14.858 -1.420 1.00 0.00 O ATOM 353 CB LEU A 23 10.288 -13.766 -3.073 1.00 0.00 C ATOM 354 CG LEU A 23 11.225 -13.343 -1.940 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.623 -13.914 -2.189 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.302 -11.815 -1.886 1.00 0.00 C ATOM 0 H LEU A 23 8.643 -15.277 -4.603 1.00 0.00 H new ATOM 0 HA LEU A 23 11.074 -15.763 -2.899 1.00 0.00 H new ATOM 0 HB2 LEU A 23 10.699 -13.455 -4.033 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.323 -13.272 -2.964 1.00 0.00 H new ATOM 0 HG LEU A 23 10.842 -13.723 -0.993 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.289 -13.611 -1.381 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.570 -15.002 -2.228 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.007 -13.536 -3.136 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.969 -11.513 -1.079 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.684 -11.436 -2.834 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.307 -11.407 -1.707 1.00 0.00 H new ATOM 368 N PRO A 24 9.236 -16.929 -1.480 1.00 0.00 N ATOM 369 CA PRO A 24 8.407 -17.523 -0.371 1.00 0.00 C ATOM 370 C PRO A 24 8.370 -16.572 0.832 1.00 0.00 C ATOM 371 O PRO A 24 7.355 -16.427 1.486 1.00 0.00 O ATOM 372 CB PRO A 24 9.072 -18.843 0.022 1.00 0.00 C ATOM 373 CG PRO A 24 10.157 -19.133 -0.993 1.00 0.00 C ATOM 374 CD PRO A 24 10.144 -18.006 -2.020 1.00 0.00 C ATOM 0 HA PRO A 24 7.380 -17.685 -0.697 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.495 -18.775 1.024 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.339 -19.650 0.039 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.130 -19.195 -0.506 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.981 -20.094 -1.477 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.150 -17.618 -2.180 1.00 0.00 H new ATOM 0 HD3 PRO A 24 9.784 -18.366 -2.984 1.00 0.00 H new ATOM 382 N ASP A 25 9.473 -15.930 1.126 1.00 0.00 N ATOM 383 CA ASP A 25 9.513 -14.989 2.283 1.00 0.00 C ATOM 384 C ASP A 25 8.537 -13.835 2.040 1.00 0.00 C ATOM 385 O ASP A 25 7.798 -13.439 2.922 1.00 0.00 O ATOM 386 CB ASP A 25 10.929 -14.433 2.440 1.00 0.00 C ATOM 387 CG ASP A 25 11.170 -14.051 3.901 1.00 0.00 C ATOM 388 OD1 ASP A 25 11.399 -14.946 4.697 1.00 0.00 O ATOM 389 OD2 ASP A 25 11.119 -12.868 4.200 1.00 0.00 O ATOM 0 H ASP A 25 10.349 -16.019 0.612 1.00 0.00 H new ATOM 0 HA ASP A 25 9.227 -15.520 3.191 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.660 -15.177 2.123 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.062 -13.562 1.799 1.00 0.00 H new ATOM 394 N ASP A 26 8.531 -13.294 0.848 1.00 0.00 N ATOM 395 CA ASP A 26 7.606 -12.165 0.536 1.00 0.00 C ATOM 396 C ASP A 26 6.158 -12.651 0.634 1.00 0.00 C ATOM 397 O ASP A 26 5.298 -11.958 1.145 1.00 0.00 O ATOM 398 CB ASP A 26 7.883 -11.660 -0.883 1.00 0.00 C ATOM 399 CG ASP A 26 7.026 -10.426 -1.167 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.053 -9.510 -0.360 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.353 -10.418 -2.185 1.00 0.00 O ATOM 0 H ASP A 26 9.129 -13.587 0.076 1.00 0.00 H new ATOM 0 HA ASP A 26 7.764 -11.355 1.248 1.00 0.00 H new ATOM 0 HB2 ASP A 26 8.939 -11.414 -0.992 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.661 -12.443 -1.608 1.00 0.00 H new ATOM 406 N LEU A 27 5.886 -13.835 0.148 1.00 0.00 N ATOM 407 CA LEU A 27 4.494 -14.373 0.210 1.00 0.00 C ATOM 408 C LEU A 27 4.072 -14.538 1.672 1.00 0.00 C ATOM 409 O LEU A 27 2.898 -14.543 1.989 1.00 0.00 O ATOM 410 CB LEU A 27 4.444 -15.731 -0.493 1.00 0.00 C ATOM 411 CG LEU A 27 4.806 -15.557 -1.969 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.897 -16.931 -2.638 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.728 -14.723 -2.665 1.00 0.00 C ATOM 0 H LEU A 27 6.569 -14.453 -0.290 1.00 0.00 H new ATOM 0 HA LEU A 27 3.814 -13.680 -0.285 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.138 -16.424 -0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.448 -16.163 -0.401 1.00 0.00 H new ATOM 0 HG LEU A 27 5.767 -15.049 -2.049 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.155 -16.807 -3.690 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.665 -17.526 -2.144 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.936 -17.439 -2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.986 -14.599 -3.717 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.767 -15.231 -2.585 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.662 -13.744 -2.190 1.00 0.00 H new ATOM 425 N HIS A 28 5.024 -14.673 2.561 1.00 0.00 N ATOM 426 CA HIS A 28 4.688 -14.838 4.005 1.00 0.00 C ATOM 427 C HIS A 28 4.492 -13.462 4.643 1.00 0.00 C ATOM 428 O HIS A 28 3.737 -13.307 5.584 1.00 0.00 O ATOM 429 CB HIS A 28 5.831 -15.570 4.714 1.00 0.00 C ATOM 430 CG HIS A 28 5.694 -17.050 4.489 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.483 -17.710 4.630 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.607 -18.013 4.135 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.697 -19.012 4.363 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.975 -19.251 4.055 1.00 0.00 N ATOM 0 H HIS A 28 6.021 -14.676 2.347 1.00 0.00 H new ATOM 0 HA HIS A 28 3.770 -15.417 4.101 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.791 -15.221 4.335 1.00 0.00 H new ATOM 0 HB3 HIS A 28 5.811 -15.350 5.781 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.656 -17.837 3.947 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.929 -19.771 4.394 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.397 -20.148 3.813 1.00 0.00 H new ATOM 442 N TYR A 29 5.168 -12.462 4.135 1.00 0.00 N ATOM 443 CA TYR A 29 5.028 -11.089 4.703 1.00 0.00 C ATOM 444 C TYR A 29 3.647 -10.531 4.353 1.00 0.00 C ATOM 445 O TYR A 29 3.119 -9.682 5.045 1.00 0.00 O ATOM 446 CB TYR A 29 6.109 -10.182 4.113 1.00 0.00 C ATOM 447 CG TYR A 29 6.148 -8.881 4.879 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.432 -8.884 6.249 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.900 -7.672 4.217 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.468 -7.677 6.959 1.00 0.00 C ATOM 451 CE2 TYR A 29 5.936 -6.466 4.927 1.00 0.00 C ATOM 452 CZ TYR A 29 6.220 -6.468 6.298 1.00 0.00 C ATOM 453 OH TYR A 29 6.255 -5.279 6.997 1.00 0.00 O ATOM 0 H TYR A 29 5.813 -12.539 3.348 1.00 0.00 H new ATOM 0 HA TYR A 29 5.139 -11.130 5.787 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.080 -10.675 4.163 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.903 -9.990 3.060 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.623 -9.817 6.759 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.681 -7.670 3.159 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.687 -7.679 8.017 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.745 -5.534 4.417 1.00 0.00 H new ATOM 0 HH TYR A 29 6.062 -4.536 6.388 1.00 0.00 H new ATOM 463 N PHE A 30 3.061 -11.003 3.281 1.00 0.00 N ATOM 464 CA PHE A 30 1.713 -10.505 2.876 1.00 0.00 C ATOM 465 C PHE A 30 0.687 -10.883 3.947 1.00 0.00 C ATOM 466 O PHE A 30 -0.048 -10.045 4.435 1.00 0.00 O ATOM 467 CB PHE A 30 1.315 -11.141 1.543 1.00 0.00 C ATOM 468 CG PHE A 30 0.083 -10.452 1.006 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.123 -9.087 0.696 1.00 0.00 C ATOM 470 CD2 PHE A 30 -1.099 -11.178 0.817 1.00 0.00 C ATOM 471 CE1 PHE A 30 -1.019 -8.449 0.198 1.00 0.00 C ATOM 472 CE2 PHE A 30 -2.242 -10.540 0.318 1.00 0.00 C ATOM 473 CZ PHE A 30 -2.202 -9.175 0.009 1.00 0.00 C ATOM 0 H PHE A 30 3.460 -11.714 2.668 1.00 0.00 H new ATOM 0 HA PHE A 30 1.743 -9.421 2.768 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.133 -11.056 0.828 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.120 -12.205 1.679 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.035 -8.527 0.841 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -1.130 -12.231 1.056 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.988 -7.396 -0.041 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -3.153 -11.101 0.172 1.00 0.00 H new ATOM 0 HZ PHE A 30 -3.083 -8.682 -0.375 1.00 0.00 H new ATOM 483 N ARG A 31 0.635 -12.138 4.314 1.00 0.00 N ATOM 484 CA ARG A 31 -0.342 -12.581 5.354 1.00 0.00 C ATOM 485 C ARG A 31 0.042 -11.996 6.718 1.00 0.00 C ATOM 486 O ARG A 31 -0.601 -12.262 7.716 1.00 0.00 O ATOM 487 CB ARG A 31 -0.336 -14.109 5.438 1.00 0.00 C ATOM 488 CG ARG A 31 -1.621 -14.587 6.116 1.00 0.00 C ATOM 489 CD ARG A 31 -1.629 -16.116 6.175 1.00 0.00 C ATOM 490 NE ARG A 31 -2.210 -16.661 4.910 1.00 0.00 N ATOM 491 CZ ARG A 31 -2.867 -17.801 4.901 1.00 0.00 C ATOM 492 NH1 ARG A 31 -3.031 -18.491 6.002 1.00 0.00 N ATOM 493 NH2 ARG A 31 -3.363 -18.249 3.781 1.00 0.00 N ATOM 0 H ARG A 31 1.229 -12.877 3.937 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.337 -12.230 5.082 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.258 -14.539 4.439 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.533 -14.450 6.001 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.689 -14.173 7.122 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.490 -14.229 5.565 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.615 -16.490 6.313 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.213 -16.454 7.031 1.00 0.00 H new ATOM 0 HE ARG A 31 -2.095 -16.141 4.040 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.647 -18.146 6.882 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -3.543 -19.373 5.980 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -3.240 -17.716 2.920 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -3.873 -19.132 3.766 1.00 0.00 H new ATOM 507 N ALA A 32 1.084 -11.202 6.769 1.00 0.00 N ATOM 508 CA ALA A 32 1.512 -10.600 8.067 1.00 0.00 C ATOM 509 C ALA A 32 1.007 -9.158 8.151 1.00 0.00 C ATOM 510 O ALA A 32 0.753 -8.643 9.224 1.00 0.00 O ATOM 511 CB ALA A 32 3.039 -10.612 8.156 1.00 0.00 C ATOM 0 H ALA A 32 1.657 -10.945 5.965 1.00 0.00 H new ATOM 0 HA ALA A 32 1.096 -11.179 8.891 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.352 -10.173 9.103 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.399 -11.639 8.096 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.456 -10.033 7.332 1.00 0.00 H new ATOM 517 N GLN A 33 0.860 -8.505 7.025 1.00 0.00 N ATOM 518 CA GLN A 33 0.372 -7.095 7.029 1.00 0.00 C ATOM 519 C GLN A 33 -0.990 -7.026 6.338 1.00 0.00 C ATOM 520 O GLN A 33 -1.306 -6.060 5.667 1.00 0.00 O ATOM 521 CB GLN A 33 1.370 -6.208 6.281 1.00 0.00 C ATOM 522 CG GLN A 33 2.505 -5.807 7.225 1.00 0.00 C ATOM 523 CD GLN A 33 3.387 -7.024 7.510 1.00 0.00 C ATOM 524 OE1 GLN A 33 3.743 -7.755 6.607 1.00 0.00 O ATOM 525 NE2 GLN A 33 3.756 -7.274 8.736 1.00 0.00 N ATOM 0 H GLN A 33 1.058 -8.890 6.102 1.00 0.00 H new ATOM 0 HA GLN A 33 0.276 -6.746 8.057 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.771 -6.741 5.419 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.868 -5.318 5.901 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.100 -5.011 6.778 1.00 0.00 H new ATOM 0 HG3 GLN A 33 2.096 -5.415 8.156 1.00 0.00 H new ATOM 0 HE21 GLN A 33 3.457 -6.660 9.494 1.00 0.00 H new ATOM 0 HE22 GLN A 33 4.344 -8.083 8.937 1.00 0.00 H new ATOM 534 N THR A 34 -1.799 -8.043 6.497 1.00 0.00 N ATOM 535 CA THR A 34 -3.144 -8.047 5.852 1.00 0.00 C ATOM 536 C THR A 34 -4.199 -8.470 6.876 1.00 0.00 C ATOM 537 O THR A 34 -5.354 -8.096 6.780 1.00 0.00 O ATOM 538 CB THR A 34 -3.145 -9.031 4.680 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.615 -10.277 5.110 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.288 -8.475 3.542 1.00 0.00 C ATOM 0 H THR A 34 -1.583 -8.873 7.049 1.00 0.00 H new ATOM 0 HA THR A 34 -3.375 -7.047 5.486 1.00 0.00 H new ATOM 0 HB THR A 34 -4.166 -9.173 4.325 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.641 -10.206 5.196 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.290 -9.177 2.708 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.696 -7.520 3.213 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.266 -8.331 3.893 1.00 0.00 H new ATOM 548 N VAL A 35 -3.809 -9.248 7.854 1.00 0.00 N ATOM 549 CA VAL A 35 -4.783 -9.702 8.891 1.00 0.00 C ATOM 550 C VAL A 35 -5.078 -8.550 9.853 1.00 0.00 C ATOM 551 O VAL A 35 -4.178 -7.950 10.410 1.00 0.00 O ATOM 552 CB VAL A 35 -4.187 -10.877 9.669 1.00 0.00 C ATOM 553 CG1 VAL A 35 -4.034 -12.082 8.738 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.815 -10.482 10.220 1.00 0.00 C ATOM 0 H VAL A 35 -2.856 -9.589 7.979 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.708 -10.017 8.408 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.849 -11.137 10.495 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.609 -12.919 9.293 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.011 -12.365 8.346 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.373 -11.822 7.912 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.391 -11.319 10.774 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.153 -10.220 9.395 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.923 -9.625 10.884 1.00 0.00 H new ATOM 564 N GLY A 36 -6.334 -8.240 10.051 1.00 0.00 N ATOM 565 CA GLY A 36 -6.700 -7.127 10.977 1.00 0.00 C ATOM 566 C GLY A 36 -6.621 -5.793 10.232 1.00 0.00 C ATOM 567 O GLY A 36 -6.456 -4.747 10.832 1.00 0.00 O ATOM 0 H GLY A 36 -7.124 -8.711 9.610 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.707 -7.279 11.365 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.027 -7.117 11.834 1.00 0.00 H new ATOM 571 N LYS A 37 -6.740 -5.823 8.929 1.00 0.00 N ATOM 572 CA LYS A 37 -6.673 -4.561 8.135 1.00 0.00 C ATOM 573 C LYS A 37 -7.620 -4.660 6.938 1.00 0.00 C ATOM 574 O LYS A 37 -8.078 -5.730 6.585 1.00 0.00 O ATOM 575 CB LYS A 37 -5.242 -4.346 7.637 1.00 0.00 C ATOM 576 CG LYS A 37 -4.417 -3.660 8.729 1.00 0.00 C ATOM 577 CD LYS A 37 -3.671 -4.716 9.546 1.00 0.00 C ATOM 578 CE LYS A 37 -3.519 -4.235 10.990 1.00 0.00 C ATOM 579 NZ LYS A 37 -2.486 -3.163 11.051 1.00 0.00 N ATOM 0 H LYS A 37 -6.881 -6.671 8.380 1.00 0.00 H new ATOM 0 HA LYS A 37 -6.969 -3.721 8.764 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.791 -5.302 7.372 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.248 -3.736 6.734 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -3.708 -2.964 8.280 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.069 -3.076 9.379 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -4.215 -5.660 9.522 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -2.690 -4.902 9.109 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -4.472 -3.858 11.361 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.233 -5.067 11.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.006 -3.195 11.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.789 -3.309 10.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.941 -2.236 10.930 1.00 0.00 H new ATOM 593 N ILE A 38 -7.915 -3.548 6.311 1.00 0.00 N ATOM 594 CA ILE A 38 -8.832 -3.567 5.134 1.00 0.00 C ATOM 595 C ILE A 38 -8.012 -3.734 3.854 1.00 0.00 C ATOM 596 O ILE A 38 -7.381 -2.805 3.385 1.00 0.00 O ATOM 597 CB ILE A 38 -9.610 -2.251 5.073 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.308 -2.009 6.413 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.658 -2.328 3.961 1.00 0.00 C ATOM 600 CD1 ILE A 38 -10.910 -0.603 6.429 1.00 0.00 C ATOM 0 H ILE A 38 -7.558 -2.627 6.566 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.531 -4.398 5.230 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.921 -1.432 4.867 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.090 -2.753 6.567 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.596 -2.121 7.231 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.212 -1.390 3.918 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.163 -2.501 3.006 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.347 -3.147 4.166 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -11.407 -0.431 7.384 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.118 0.134 6.294 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -11.635 -0.508 5.620 1.00 0.00 H new ATOM 612 N MET A 39 -8.017 -4.914 3.287 1.00 0.00 N ATOM 613 CA MET A 39 -7.240 -5.154 2.036 1.00 0.00 C ATOM 614 C MET A 39 -8.056 -4.688 0.829 1.00 0.00 C ATOM 615 O MET A 39 -9.036 -5.306 0.457 1.00 0.00 O ATOM 616 CB MET A 39 -6.937 -6.647 1.901 1.00 0.00 C ATOM 617 CG MET A 39 -5.897 -6.861 0.801 1.00 0.00 C ATOM 618 SD MET A 39 -5.771 -8.627 0.424 1.00 0.00 S ATOM 619 CE MET A 39 -7.436 -8.835 -0.252 1.00 0.00 C ATOM 0 H MET A 39 -8.528 -5.723 3.639 1.00 0.00 H new ATOM 0 HA MET A 39 -6.305 -4.596 2.079 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.566 -7.040 2.848 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.850 -7.194 1.664 1.00 0.00 H new ATOM 0 HG2 MET A 39 -6.179 -6.307 -0.094 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.929 -6.477 1.122 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.408 -9.550 -1.075 1.00 0.00 H new ATOM 0 HE2 MET A 39 -8.102 -9.205 0.528 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.803 -7.876 -0.617 1.00 0.00 H new ATOM 629 N VAL A 40 -7.659 -3.602 0.216 1.00 0.00 N ATOM 630 CA VAL A 40 -8.405 -3.088 -0.970 1.00 0.00 C ATOM 631 C VAL A 40 -7.724 -3.577 -2.249 1.00 0.00 C ATOM 632 O VAL A 40 -6.578 -3.264 -2.511 1.00 0.00 O ATOM 633 CB VAL A 40 -8.408 -1.557 -0.947 1.00 0.00 C ATOM 634 CG1 VAL A 40 -9.300 -1.031 -2.073 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.949 -1.070 0.399 1.00 0.00 C ATOM 0 H VAL A 40 -6.847 -3.048 0.488 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.432 -3.453 -0.941 1.00 0.00 H new ATOM 0 HB VAL A 40 -7.391 -1.190 -1.087 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -9.302 0.059 -2.057 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.918 -1.379 -3.033 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.317 -1.398 -1.933 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.952 0.020 0.417 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.966 -1.438 0.537 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -8.315 -1.445 1.203 1.00 0.00 H new ATOM 645 N VAL A 41 -8.424 -4.344 -3.046 1.00 0.00 N ATOM 646 CA VAL A 41 -7.827 -4.861 -4.312 1.00 0.00 C ATOM 647 C VAL A 41 -8.798 -4.619 -5.471 1.00 0.00 C ATOM 648 O VAL A 41 -9.954 -4.302 -5.266 1.00 0.00 O ATOM 649 CB VAL A 41 -7.560 -6.361 -4.175 1.00 0.00 C ATOM 650 CG1 VAL A 41 -6.481 -6.592 -3.116 1.00 0.00 C ATOM 651 CG2 VAL A 41 -8.848 -7.073 -3.751 1.00 0.00 C ATOM 0 H VAL A 41 -9.386 -4.635 -2.873 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.889 -4.342 -4.510 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.223 -6.758 -5.132 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.290 -7.661 -3.018 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -5.563 -6.086 -3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.819 -6.195 -2.159 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.658 -8.142 -3.653 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.185 -6.676 -2.794 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.619 -6.909 -4.504 1.00 0.00 H new ATOM 661 N GLY A 42 -8.333 -4.769 -6.686 1.00 0.00 N ATOM 662 CA GLY A 42 -9.220 -4.552 -7.866 1.00 0.00 C ATOM 663 C GLY A 42 -9.874 -5.876 -8.265 1.00 0.00 C ATOM 664 O GLY A 42 -9.935 -6.806 -7.484 1.00 0.00 O ATOM 0 H GLY A 42 -7.374 -5.033 -6.910 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -9.986 -3.814 -7.628 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -8.642 -4.154 -8.700 1.00 0.00 H new ATOM 668 N ARG A 43 -10.362 -5.964 -9.476 1.00 0.00 N ATOM 669 CA ARG A 43 -11.015 -7.224 -9.936 1.00 0.00 C ATOM 670 C ARG A 43 -9.948 -8.194 -10.450 1.00 0.00 C ATOM 671 O ARG A 43 -10.058 -9.394 -10.282 1.00 0.00 O ATOM 672 CB ARG A 43 -11.999 -6.906 -11.064 1.00 0.00 C ATOM 673 CG ARG A 43 -13.319 -6.416 -10.465 1.00 0.00 C ATOM 674 CD ARG A 43 -14.369 -6.295 -11.572 1.00 0.00 C ATOM 675 NE ARG A 43 -14.576 -7.632 -12.210 1.00 0.00 N ATOM 676 CZ ARG A 43 -15.071 -7.733 -13.425 1.00 0.00 C ATOM 677 NH1 ARG A 43 -15.394 -6.666 -14.111 1.00 0.00 N ATOM 678 NH2 ARG A 43 -15.241 -8.914 -13.953 1.00 0.00 N ATOM 0 H ARG A 43 -10.336 -5.214 -10.167 1.00 0.00 H new ATOM 0 HA ARG A 43 -11.550 -7.680 -9.103 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.581 -6.144 -11.722 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -12.171 -7.794 -11.673 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -13.662 -7.110 -9.698 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -13.174 -5.451 -9.980 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.308 -5.928 -11.159 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -14.044 -5.570 -12.318 1.00 0.00 H new ATOM 0 HE ARG A 43 -14.330 -8.478 -11.696 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -15.263 -5.740 -13.705 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -15.777 -6.761 -15.052 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -14.991 -9.750 -13.424 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -15.624 -9.001 -14.894 1.00 0.00 H new ATOM 692 N ARG A 44 -8.919 -7.680 -11.076 1.00 0.00 N ATOM 693 CA ARG A 44 -7.839 -8.564 -11.605 1.00 0.00 C ATOM 694 C ARG A 44 -7.054 -9.166 -10.437 1.00 0.00 C ATOM 695 O ARG A 44 -6.649 -10.313 -10.478 1.00 0.00 O ATOM 696 CB ARG A 44 -6.894 -7.743 -12.485 1.00 0.00 C ATOM 697 CG ARG A 44 -7.579 -7.433 -13.818 1.00 0.00 C ATOM 698 CD ARG A 44 -7.444 -8.634 -14.754 1.00 0.00 C ATOM 699 NE ARG A 44 -8.014 -8.290 -16.094 1.00 0.00 N ATOM 700 CZ ARG A 44 -8.149 -9.206 -17.028 1.00 0.00 C ATOM 701 NH1 ARG A 44 -7.789 -10.447 -16.812 1.00 0.00 N ATOM 702 NH2 ARG A 44 -8.650 -8.874 -18.187 1.00 0.00 N ATOM 0 H ARG A 44 -8.781 -6.683 -11.243 1.00 0.00 H new ATOM 0 HA ARG A 44 -8.282 -9.365 -12.196 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -6.622 -6.816 -11.979 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -5.970 -8.295 -12.658 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -8.632 -7.204 -13.653 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -7.129 -6.551 -14.274 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.395 -8.914 -14.854 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -7.965 -9.495 -14.336 1.00 0.00 H new ATOM 0 HE ARG A 44 -8.302 -7.331 -16.286 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.398 -10.715 -15.909 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.900 -11.146 -17.547 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -8.933 -7.910 -18.363 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -8.758 -9.579 -18.917 1.00 0.00 H new ATOM 716 N THR A 45 -6.837 -8.399 -9.399 1.00 0.00 N ATOM 717 CA THR A 45 -6.079 -8.918 -8.222 1.00 0.00 C ATOM 718 C THR A 45 -6.990 -9.817 -7.384 1.00 0.00 C ATOM 719 O THR A 45 -6.531 -10.713 -6.699 1.00 0.00 O ATOM 720 CB THR A 45 -5.595 -7.744 -7.369 1.00 0.00 C ATOM 721 OG1 THR A 45 -4.936 -6.797 -8.199 1.00 0.00 O ATOM 722 CG2 THR A 45 -4.626 -8.252 -6.301 1.00 0.00 C ATOM 0 H THR A 45 -7.153 -7.433 -9.316 1.00 0.00 H new ATOM 0 HA THR A 45 -5.220 -9.494 -8.568 1.00 0.00 H new ATOM 0 HB THR A 45 -6.449 -7.270 -6.885 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.362 -6.224 -7.649 1.00 0.00 H new ATOM 0 HG21 THR A 45 -4.282 -7.415 -5.694 1.00 0.00 H new ATOM 0 HG22 THR A 45 -5.133 -8.977 -5.665 1.00 0.00 H new ATOM 0 HG23 THR A 45 -3.771 -8.727 -6.782 1.00 0.00 H new ATOM 730 N TYR A 46 -8.277 -9.583 -7.433 1.00 0.00 N ATOM 731 CA TYR A 46 -9.226 -10.418 -6.642 1.00 0.00 C ATOM 732 C TYR A 46 -9.205 -11.854 -7.170 1.00 0.00 C ATOM 733 O TYR A 46 -9.346 -12.801 -6.420 1.00 0.00 O ATOM 734 CB TYR A 46 -10.640 -9.847 -6.775 1.00 0.00 C ATOM 735 CG TYR A 46 -11.555 -10.532 -5.789 1.00 0.00 C ATOM 736 CD1 TYR A 46 -11.279 -10.470 -4.418 1.00 0.00 C ATOM 737 CD2 TYR A 46 -12.681 -11.229 -6.246 1.00 0.00 C ATOM 738 CE1 TYR A 46 -12.128 -11.105 -3.504 1.00 0.00 C ATOM 739 CE2 TYR A 46 -13.530 -11.864 -5.331 1.00 0.00 C ATOM 740 CZ TYR A 46 -13.253 -11.802 -3.960 1.00 0.00 C ATOM 741 OH TYR A 46 -14.090 -12.427 -3.059 1.00 0.00 O ATOM 0 H TYR A 46 -8.711 -8.846 -7.989 1.00 0.00 H new ATOM 0 HA TYR A 46 -8.928 -10.412 -5.594 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -10.629 -8.773 -6.591 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -11.008 -9.992 -7.791 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.411 -9.932 -4.066 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -12.894 -11.277 -7.304 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.915 -11.057 -2.446 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -14.398 -12.401 -5.683 1.00 0.00 H new ATOM 0 HH TYR A 46 -14.823 -12.864 -3.542 1.00 0.00 H new ATOM 751 N GLU A 47 -9.029 -12.018 -8.456 1.00 0.00 N ATOM 752 CA GLU A 47 -8.996 -13.390 -9.044 1.00 0.00 C ATOM 753 C GLU A 47 -7.560 -13.917 -9.035 1.00 0.00 C ATOM 754 O GLU A 47 -7.329 -15.112 -9.045 1.00 0.00 O ATOM 755 CB GLU A 47 -9.512 -13.339 -10.484 1.00 0.00 C ATOM 756 CG GLU A 47 -11.020 -13.080 -10.478 1.00 0.00 C ATOM 757 CD GLU A 47 -11.448 -12.526 -11.837 1.00 0.00 C ATOM 758 OE1 GLU A 47 -10.864 -11.544 -12.265 1.00 0.00 O ATOM 759 OE2 GLU A 47 -12.355 -13.090 -12.427 1.00 0.00 O ATOM 0 H GLU A 47 -8.906 -11.258 -9.126 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.628 -14.053 -8.454 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.000 -12.552 -11.037 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.296 -14.279 -10.992 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.557 -14.004 -10.264 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.275 -12.373 -9.689 1.00 0.00 H new ATOM 766 N SER A 48 -6.594 -13.033 -9.015 1.00 0.00 N ATOM 767 CA SER A 48 -5.168 -13.472 -9.006 1.00 0.00 C ATOM 768 C SER A 48 -4.883 -14.266 -7.728 1.00 0.00 C ATOM 769 O SER A 48 -3.951 -15.046 -7.668 1.00 0.00 O ATOM 770 CB SER A 48 -4.256 -12.246 -9.057 1.00 0.00 C ATOM 771 OG SER A 48 -2.908 -12.669 -9.214 1.00 0.00 O ATOM 0 H SER A 48 -6.734 -12.023 -9.005 1.00 0.00 H new ATOM 0 HA SER A 48 -4.979 -14.103 -9.875 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.545 -11.598 -9.885 1.00 0.00 H new ATOM 0 HB3 SER A 48 -4.362 -11.662 -8.143 1.00 0.00 H new ATOM 0 HG SER A 48 -2.319 -11.886 -9.233 1.00 0.00 H new ATOM 777 N PHE A 49 -5.679 -14.070 -6.706 1.00 0.00 N ATOM 778 CA PHE A 49 -5.461 -14.810 -5.428 1.00 0.00 C ATOM 779 C PHE A 49 -5.630 -16.318 -5.672 1.00 0.00 C ATOM 780 O PHE A 49 -6.242 -16.713 -6.645 1.00 0.00 O ATOM 781 CB PHE A 49 -6.482 -14.345 -4.388 1.00 0.00 C ATOM 782 CG PHE A 49 -6.235 -12.893 -4.052 1.00 0.00 C ATOM 783 CD1 PHE A 49 -4.973 -12.484 -3.600 1.00 0.00 C ATOM 784 CD2 PHE A 49 -7.266 -11.957 -4.193 1.00 0.00 C ATOM 785 CE1 PHE A 49 -4.745 -11.138 -3.290 1.00 0.00 C ATOM 786 CE2 PHE A 49 -7.037 -10.611 -3.881 1.00 0.00 C ATOM 787 CZ PHE A 49 -5.776 -10.202 -3.430 1.00 0.00 C ATOM 0 H PHE A 49 -6.471 -13.428 -6.703 1.00 0.00 H new ATOM 0 HA PHE A 49 -4.453 -14.612 -5.062 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.493 -14.473 -4.774 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.404 -14.956 -3.488 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.177 -13.206 -3.491 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -8.238 -12.273 -4.542 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.773 -10.822 -2.942 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.833 -9.889 -3.988 1.00 0.00 H new ATOM 0 HZ PHE A 49 -5.599 -9.164 -3.190 1.00 0.00 H new ATOM 797 N PRO A 50 -5.083 -17.123 -4.783 1.00 0.00 N ATOM 798 CA PRO A 50 -5.129 -18.623 -4.833 1.00 0.00 C ATOM 799 C PRO A 50 -6.476 -19.121 -4.301 1.00 0.00 C ATOM 800 O PRO A 50 -7.321 -19.572 -5.052 1.00 0.00 O ATOM 801 CB PRO A 50 -3.991 -19.123 -3.947 1.00 0.00 C ATOM 802 CG PRO A 50 -3.499 -17.944 -3.131 1.00 0.00 C ATOM 803 CD PRO A 50 -4.309 -16.722 -3.553 1.00 0.00 C ATOM 0 HA PRO A 50 -5.019 -18.991 -5.853 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -4.337 -19.924 -3.294 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -3.184 -19.533 -4.554 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.624 -18.137 -2.065 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -2.436 -17.777 -3.302 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -4.983 -16.410 -2.756 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -3.654 -15.877 -3.766 1.00 0.00 H new ATOM 811 N LYS A 51 -6.680 -19.042 -3.011 1.00 0.00 N ATOM 812 CA LYS A 51 -7.969 -19.510 -2.420 1.00 0.00 C ATOM 813 C LYS A 51 -8.793 -18.299 -1.971 1.00 0.00 C ATOM 814 O LYS A 51 -8.912 -18.016 -0.793 1.00 0.00 O ATOM 815 CB LYS A 51 -7.683 -20.416 -1.218 1.00 0.00 C ATOM 816 CG LYS A 51 -6.732 -19.707 -0.249 1.00 0.00 C ATOM 817 CD LYS A 51 -7.119 -20.046 1.193 1.00 0.00 C ATOM 818 CE LYS A 51 -6.042 -19.527 2.146 1.00 0.00 C ATOM 819 NZ LYS A 51 -4.742 -20.184 1.831 1.00 0.00 N ATOM 0 H LYS A 51 -6.007 -18.672 -2.340 1.00 0.00 H new ATOM 0 HA LYS A 51 -8.530 -20.072 -3.167 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -8.614 -20.667 -0.710 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.241 -21.354 -1.555 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -5.704 -20.015 -0.442 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -6.776 -18.629 -0.404 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.082 -19.598 1.437 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.231 -21.124 1.307 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.948 -18.445 2.051 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.325 -19.733 3.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -4.349 -20.608 2.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.892 -20.927 1.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.077 -19.477 1.459 1.00 0.00 H new ATOM 833 N ARG A 52 -9.364 -17.584 -2.907 1.00 0.00 N ATOM 834 CA ARG A 52 -10.185 -16.390 -2.548 1.00 0.00 C ATOM 835 C ARG A 52 -11.571 -16.845 -2.071 1.00 0.00 C ATOM 836 O ARG A 52 -12.014 -17.920 -2.421 1.00 0.00 O ATOM 837 CB ARG A 52 -10.338 -15.489 -3.777 1.00 0.00 C ATOM 838 CG ARG A 52 -10.906 -16.302 -4.942 1.00 0.00 C ATOM 839 CD ARG A 52 -10.653 -15.557 -6.256 1.00 0.00 C ATOM 840 NE ARG A 52 -11.783 -14.613 -6.519 1.00 0.00 N ATOM 841 CZ ARG A 52 -12.871 -15.014 -7.142 1.00 0.00 C ATOM 842 NH1 ARG A 52 -12.995 -16.252 -7.550 1.00 0.00 N ATOM 843 NH2 ARG A 52 -13.838 -14.165 -7.358 1.00 0.00 N ATOM 0 H ARG A 52 -9.296 -17.777 -3.906 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.691 -15.836 -1.750 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -10.999 -14.653 -3.548 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.372 -15.066 -4.053 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -10.439 -17.286 -4.974 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -11.975 -16.461 -4.802 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -9.712 -15.009 -6.200 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -10.560 -16.268 -7.077 1.00 0.00 H new ATOM 0 HE ARG A 52 -11.709 -13.643 -6.211 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.242 -16.921 -7.386 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -13.844 -16.548 -8.031 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -13.748 -13.198 -7.045 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -14.684 -14.468 -7.840 1.00 0.00 H new ATOM 857 N PRO A 53 -12.222 -16.014 -1.282 1.00 0.00 N ATOM 858 CA PRO A 53 -11.750 -14.666 -0.800 1.00 0.00 C ATOM 859 C PRO A 53 -10.785 -14.840 0.376 1.00 0.00 C ATOM 860 O PRO A 53 -10.620 -15.926 0.899 1.00 0.00 O ATOM 861 CB PRO A 53 -12.997 -13.905 -0.356 1.00 0.00 C ATOM 862 CG PRO A 53 -14.137 -14.902 -0.287 1.00 0.00 C ATOM 863 CD PRO A 53 -13.586 -16.262 -0.705 1.00 0.00 C ATOM 0 HA PRO A 53 -11.220 -14.125 -1.584 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.836 -13.438 0.616 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.229 -13.105 -1.059 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -14.545 -14.948 0.723 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -14.951 -14.599 -0.946 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -13.528 -16.936 0.150 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.237 -16.735 -1.440 1.00 0.00 H new ATOM 871 N LEU A 54 -10.148 -13.775 0.793 1.00 0.00 N ATOM 872 CA LEU A 54 -9.191 -13.865 1.934 1.00 0.00 C ATOM 873 C LEU A 54 -9.920 -13.500 3.241 1.00 0.00 C ATOM 874 O LEU A 54 -10.353 -12.375 3.395 1.00 0.00 O ATOM 875 CB LEU A 54 -8.038 -12.885 1.706 1.00 0.00 C ATOM 876 CG LEU A 54 -7.348 -13.207 0.381 1.00 0.00 C ATOM 877 CD1 LEU A 54 -6.336 -12.108 0.052 1.00 0.00 C ATOM 878 CD2 LEU A 54 -6.622 -14.549 0.498 1.00 0.00 C ATOM 0 H LEU A 54 -10.251 -12.844 0.390 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.800 -14.880 2.005 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.414 -11.862 1.693 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.323 -12.952 2.526 1.00 0.00 H new ATOM 0 HG LEU A 54 -8.093 -13.264 -0.412 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.844 -12.338 -0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.852 -11.151 -0.031 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.590 -12.051 0.845 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.129 -14.780 -0.447 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.877 -14.492 1.291 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -7.342 -15.333 0.733 1.00 0.00 H new ATOM 890 N PRO A 55 -10.042 -14.448 4.151 1.00 0.00 N ATOM 891 CA PRO A 55 -10.721 -14.278 5.482 1.00 0.00 C ATOM 892 C PRO A 55 -9.784 -13.562 6.459 1.00 0.00 C ATOM 893 O PRO A 55 -8.680 -13.188 6.111 1.00 0.00 O ATOM 894 CB PRO A 55 -11.048 -15.682 5.989 1.00 0.00 C ATOM 895 CG PRO A 55 -10.312 -16.669 5.108 1.00 0.00 C ATOM 896 CD PRO A 55 -9.544 -15.869 4.062 1.00 0.00 C ATOM 0 HA PRO A 55 -11.626 -13.677 5.392 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -10.742 -15.795 7.029 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -12.122 -15.862 5.952 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -9.630 -17.278 5.702 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -11.014 -17.352 4.629 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -8.471 -15.916 4.250 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -9.711 -16.276 3.065 1.00 0.00 H new ATOM 904 N GLU A 56 -10.220 -13.369 7.679 1.00 0.00 N ATOM 905 CA GLU A 56 -9.367 -12.677 8.693 1.00 0.00 C ATOM 906 C GLU A 56 -9.044 -11.259 8.214 1.00 0.00 C ATOM 907 O GLU A 56 -8.022 -10.696 8.558 1.00 0.00 O ATOM 908 CB GLU A 56 -8.063 -13.457 8.894 1.00 0.00 C ATOM 909 CG GLU A 56 -8.387 -14.916 9.223 1.00 0.00 C ATOM 910 CD GLU A 56 -7.104 -15.646 9.625 1.00 0.00 C ATOM 911 OE1 GLU A 56 -6.296 -15.908 8.751 1.00 0.00 O ATOM 912 OE2 GLU A 56 -6.953 -15.930 10.802 1.00 0.00 O ATOM 0 H GLU A 56 -11.136 -13.663 8.018 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.907 -12.627 9.639 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.452 -13.403 7.993 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.481 -13.012 9.701 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.114 -14.964 10.033 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.839 -15.403 8.359 1.00 0.00 H new ATOM 919 N ARG A 57 -9.913 -10.679 7.424 1.00 0.00 N ATOM 920 CA ARG A 57 -9.668 -9.297 6.918 1.00 0.00 C ATOM 921 C ARG A 57 -10.870 -8.834 6.090 1.00 0.00 C ATOM 922 O ARG A 57 -11.831 -9.561 5.918 1.00 0.00 O ATOM 923 CB ARG A 57 -8.407 -9.283 6.047 1.00 0.00 C ATOM 924 CG ARG A 57 -8.547 -10.308 4.919 1.00 0.00 C ATOM 925 CD ARG A 57 -7.158 -10.770 4.474 1.00 0.00 C ATOM 926 NE ARG A 57 -6.617 -11.749 5.468 1.00 0.00 N ATOM 927 CZ ARG A 57 -5.450 -12.327 5.283 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.728 -12.062 4.223 1.00 0.00 N ATOM 929 NH2 ARG A 57 -5.005 -13.177 6.168 1.00 0.00 N ATOM 0 H ARG A 57 -10.784 -11.106 7.108 1.00 0.00 H new ATOM 0 HA ARG A 57 -9.529 -8.622 7.763 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.253 -8.288 5.630 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.532 -9.513 6.654 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -9.134 -11.161 5.259 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.082 -9.868 4.078 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.215 -11.230 3.488 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -6.488 -9.914 4.388 1.00 0.00 H new ATOM 0 HE ARG A 57 -7.161 -11.971 6.301 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.069 -11.399 3.527 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.825 -12.518 4.094 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.561 -13.389 6.996 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.101 -13.629 6.031 1.00 0.00 H new ATOM 943 N THR A 58 -10.819 -7.631 5.576 1.00 0.00 N ATOM 944 CA THR A 58 -11.953 -7.113 4.756 1.00 0.00 C ATOM 945 C THR A 58 -11.502 -6.956 3.303 1.00 0.00 C ATOM 946 O THR A 58 -10.693 -6.104 2.984 1.00 0.00 O ATOM 947 CB THR A 58 -12.398 -5.755 5.302 1.00 0.00 C ATOM 948 OG1 THR A 58 -12.473 -5.817 6.720 1.00 0.00 O ATOM 949 CG2 THR A 58 -13.771 -5.398 4.732 1.00 0.00 C ATOM 0 H THR A 58 -10.038 -6.985 5.690 1.00 0.00 H new ATOM 0 HA THR A 58 -12.786 -7.814 4.804 1.00 0.00 H new ATOM 0 HB THR A 58 -11.677 -4.992 5.009 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.756 -4.947 7.071 1.00 0.00 H new ATOM 0 HG21 THR A 58 -14.086 -4.430 5.122 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.712 -5.349 3.645 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.495 -6.160 5.022 1.00 0.00 H new ATOM 957 N ASN A 59 -12.021 -7.771 2.421 1.00 0.00 N ATOM 958 CA ASN A 59 -11.630 -7.677 0.983 1.00 0.00 C ATOM 959 C ASN A 59 -12.506 -6.637 0.283 1.00 0.00 C ATOM 960 O ASN A 59 -13.677 -6.861 0.045 1.00 0.00 O ATOM 961 CB ASN A 59 -11.822 -9.039 0.312 1.00 0.00 C ATOM 962 CG ASN A 59 -10.738 -10.004 0.798 1.00 0.00 C ATOM 963 OD1 ASN A 59 -10.110 -10.678 0.006 1.00 0.00 O ATOM 964 ND2 ASN A 59 -10.492 -10.102 2.076 1.00 0.00 N ATOM 0 H ASN A 59 -12.701 -8.500 2.636 1.00 0.00 H new ATOM 0 HA ASN A 59 -10.584 -7.380 0.910 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -12.809 -9.436 0.547 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -11.771 -8.933 -0.772 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.773 -10.744 2.409 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -11.019 -9.536 2.742 1.00 0.00 H new ATOM 971 N VAL A 60 -11.944 -5.501 -0.047 1.00 0.00 N ATOM 972 CA VAL A 60 -12.737 -4.439 -0.732 1.00 0.00 C ATOM 973 C VAL A 60 -12.401 -4.437 -2.225 1.00 0.00 C ATOM 974 O VAL A 60 -11.298 -4.109 -2.621 1.00 0.00 O ATOM 975 CB VAL A 60 -12.391 -3.076 -0.130 1.00 0.00 C ATOM 976 CG1 VAL A 60 -13.310 -2.007 -0.723 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.583 -3.126 1.388 1.00 0.00 C ATOM 0 H VAL A 60 -10.968 -5.264 0.130 1.00 0.00 H new ATOM 0 HA VAL A 60 -13.801 -4.636 -0.598 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.354 -2.831 -0.359 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.063 -1.036 -0.294 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -13.176 -1.971 -1.804 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -14.347 -2.251 -0.494 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.337 -2.155 1.818 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.620 -3.371 1.616 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.929 -3.887 1.813 1.00 0.00 H new ATOM 987 N VAL A 61 -13.346 -4.803 -3.054 1.00 0.00 N ATOM 988 CA VAL A 61 -13.092 -4.827 -4.524 1.00 0.00 C ATOM 989 C VAL A 61 -13.581 -3.518 -5.147 1.00 0.00 C ATOM 990 O VAL A 61 -14.724 -3.134 -4.988 1.00 0.00 O ATOM 991 CB VAL A 61 -13.843 -6.002 -5.153 1.00 0.00 C ATOM 992 CG1 VAL A 61 -13.461 -6.121 -6.629 1.00 0.00 C ATOM 993 CG2 VAL A 61 -13.468 -7.295 -4.425 1.00 0.00 C ATOM 0 H VAL A 61 -14.285 -5.087 -2.774 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.023 -4.940 -4.706 1.00 0.00 H new ATOM 0 HB VAL A 61 -14.917 -5.834 -5.068 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -13.996 -6.958 -7.077 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.727 -5.201 -7.149 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -12.387 -6.289 -6.715 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -14.003 -8.133 -4.873 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -12.394 -7.462 -4.511 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -13.740 -7.212 -3.373 1.00 0.00 H new ATOM 1003 N LEU A 62 -12.719 -2.830 -5.854 1.00 0.00 N ATOM 1004 CA LEU A 62 -13.124 -1.543 -6.491 1.00 0.00 C ATOM 1005 C LEU A 62 -13.319 -1.756 -7.994 1.00 0.00 C ATOM 1006 O LEU A 62 -12.383 -2.051 -8.714 1.00 0.00 O ATOM 1007 CB LEU A 62 -12.032 -0.495 -6.262 1.00 0.00 C ATOM 1008 CG LEU A 62 -12.554 0.883 -6.667 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -13.474 1.423 -5.571 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -11.373 1.840 -6.855 1.00 0.00 C ATOM 0 H LEU A 62 -11.751 -3.106 -6.017 1.00 0.00 H new ATOM 0 HA LEU A 62 -14.059 -1.197 -6.049 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.733 -0.489 -5.214 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -11.145 -0.745 -6.844 1.00 0.00 H new ATOM 0 HG LEU A 62 -13.110 0.800 -7.601 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -13.846 2.406 -5.860 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -14.314 0.743 -5.434 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -12.918 1.506 -4.637 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -11.744 2.823 -7.144 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -10.818 1.922 -5.920 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.715 1.457 -7.635 1.00 0.00 H new ATOM 1022 N THR A 63 -14.530 -1.607 -8.470 1.00 0.00 N ATOM 1023 CA THR A 63 -14.797 -1.798 -9.925 1.00 0.00 C ATOM 1024 C THR A 63 -15.814 -0.758 -10.398 1.00 0.00 C ATOM 1025 O THR A 63 -16.759 -0.440 -9.699 1.00 0.00 O ATOM 1026 CB THR A 63 -15.355 -3.203 -10.162 1.00 0.00 C ATOM 1027 OG1 THR A 63 -15.738 -3.336 -11.524 1.00 0.00 O ATOM 1028 CG2 THR A 63 -16.572 -3.429 -9.264 1.00 0.00 C ATOM 0 H THR A 63 -15.346 -1.361 -7.910 1.00 0.00 H new ATOM 0 HA THR A 63 -13.869 -1.678 -10.483 1.00 0.00 H new ATOM 0 HB THR A 63 -14.590 -3.942 -9.926 1.00 0.00 H new ATOM 0 HG1 THR A 63 -16.368 -4.081 -11.615 1.00 0.00 H new ATOM 0 HG21 THR A 63 -16.969 -4.430 -9.434 1.00 0.00 H new ATOM 0 HG22 THR A 63 -16.277 -3.328 -8.219 1.00 0.00 H new ATOM 0 HG23 THR A 63 -17.339 -2.691 -9.498 1.00 0.00 H new ATOM 1036 N HIS A 64 -15.628 -0.226 -11.579 1.00 0.00 N ATOM 1037 CA HIS A 64 -16.580 0.795 -12.107 1.00 0.00 C ATOM 1038 C HIS A 64 -17.709 0.096 -12.866 1.00 0.00 C ATOM 1039 O HIS A 64 -18.263 0.636 -13.805 1.00 0.00 O ATOM 1040 CB HIS A 64 -15.838 1.742 -13.052 1.00 0.00 C ATOM 1041 CG HIS A 64 -14.830 2.541 -12.274 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -13.535 2.093 -12.064 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -14.911 3.761 -11.649 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -12.895 3.029 -11.340 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -13.687 4.067 -11.059 1.00 0.00 N ATOM 0 H HIS A 64 -14.854 -0.456 -12.202 1.00 0.00 H new ATOM 0 HA HIS A 64 -17.000 1.365 -11.278 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -15.339 1.173 -13.836 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -16.545 2.410 -13.544 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -15.790 4.388 -11.619 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -11.865 2.951 -11.024 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -13.447 4.904 -10.527 1.00 0.00 H new ATOM 1053 N GLN A 65 -18.052 -1.101 -12.464 1.00 0.00 N ATOM 1054 CA GLN A 65 -19.146 -1.845 -13.156 1.00 0.00 C ATOM 1055 C GLN A 65 -20.036 -2.528 -12.115 1.00 0.00 C ATOM 1056 O GLN A 65 -19.566 -3.282 -11.284 1.00 0.00 O ATOM 1057 CB GLN A 65 -18.538 -2.903 -14.080 1.00 0.00 C ATOM 1058 CG GLN A 65 -17.999 -2.229 -15.342 1.00 0.00 C ATOM 1059 CD GLN A 65 -17.679 -3.294 -16.393 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -16.536 -3.476 -16.762 1.00 0.00 O ATOM 1061 NE2 GLN A 65 -18.648 -4.010 -16.893 1.00 0.00 N ATOM 0 H GLN A 65 -17.620 -1.596 -11.684 1.00 0.00 H new ATOM 0 HA GLN A 65 -19.743 -1.149 -13.744 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -17.735 -3.432 -13.566 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -19.291 -3.646 -14.345 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -18.734 -1.526 -15.734 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.103 -1.655 -15.106 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -19.608 -3.857 -16.583 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -18.446 -4.723 -17.594 1.00 0.00 H new ATOM 1070 N GLU A 66 -21.318 -2.268 -12.158 1.00 0.00 N ATOM 1071 CA GLU A 66 -22.249 -2.897 -11.176 1.00 0.00 C ATOM 1072 C GLU A 66 -22.640 -4.293 -11.665 1.00 0.00 C ATOM 1073 O GLU A 66 -23.721 -4.776 -11.387 1.00 0.00 O ATOM 1074 CB GLU A 66 -23.505 -2.034 -11.037 1.00 0.00 C ATOM 1075 CG GLU A 66 -23.205 -0.837 -10.133 1.00 0.00 C ATOM 1076 CD GLU A 66 -22.444 0.226 -10.928 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -23.094 1.057 -11.541 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -21.225 0.191 -10.910 1.00 0.00 O ATOM 0 H GLU A 66 -21.760 -1.645 -12.834 1.00 0.00 H new ATOM 0 HA GLU A 66 -21.755 -2.977 -10.208 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -23.832 -1.689 -12.018 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -24.320 -2.624 -10.618 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -24.134 -0.420 -9.744 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.615 -1.156 -9.274 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.766 -4.941 -12.392 1.00 0.00 N ATOM 1086 CA ASP A 67 -22.076 -6.307 -12.905 1.00 0.00 C ATOM 1087 C ASP A 67 -21.301 -7.347 -12.093 1.00 0.00 C ATOM 1088 O ASP A 67 -21.796 -8.421 -11.812 1.00 0.00 O ATOM 1089 CB ASP A 67 -21.671 -6.403 -14.378 1.00 0.00 C ATOM 1090 CG ASP A 67 -22.341 -7.622 -15.014 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -23.542 -7.573 -15.220 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -21.641 -8.585 -15.284 1.00 0.00 O ATOM 0 H ASP A 67 -20.848 -4.580 -12.653 1.00 0.00 H new ATOM 0 HA ASP A 67 -23.145 -6.496 -12.809 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.965 -5.496 -14.907 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -20.587 -6.485 -14.463 1.00 0.00 H new ATOM 1097 N TYR A 68 -20.087 -7.032 -11.718 1.00 0.00 N ATOM 1098 CA TYR A 68 -19.270 -7.994 -10.923 1.00 0.00 C ATOM 1099 C TYR A 68 -19.841 -8.102 -9.508 1.00 0.00 C ATOM 1100 O TYR A 68 -20.310 -7.131 -8.944 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.824 -7.499 -10.852 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.938 -8.605 -10.332 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -16.768 -9.777 -11.079 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -16.285 -8.459 -9.103 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -15.946 -10.803 -10.597 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -15.462 -9.485 -8.620 1.00 0.00 C ATOM 1107 CZ TYR A 68 -15.294 -10.656 -9.367 1.00 0.00 C ATOM 1108 OH TYR A 68 -14.483 -11.666 -8.891 1.00 0.00 O ATOM 0 H TYR A 68 -19.627 -6.147 -11.930 1.00 0.00 H new ATOM 0 HA TYR A 68 -19.296 -8.973 -11.401 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.488 -7.183 -11.840 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.758 -6.629 -10.199 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -17.271 -9.890 -12.028 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.415 -7.555 -8.527 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -15.815 -11.707 -11.174 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.958 -9.372 -7.672 1.00 0.00 H new ATOM 0 HH TYR A 68 -13.566 -11.527 -9.208 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.805 -9.278 -8.933 1.00 0.00 N ATOM 1119 CA GLN A 69 -20.344 -9.460 -7.553 1.00 0.00 C ATOM 1120 C GLN A 69 -19.507 -10.505 -6.812 1.00 0.00 C ATOM 1121 O GLN A 69 -19.664 -11.695 -7.016 1.00 0.00 O ATOM 1122 CB GLN A 69 -21.797 -9.933 -7.631 1.00 0.00 C ATOM 1123 CG GLN A 69 -22.676 -8.799 -8.165 1.00 0.00 C ATOM 1124 CD GLN A 69 -24.140 -9.086 -7.828 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -24.789 -9.861 -8.501 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -24.691 -8.488 -6.806 1.00 0.00 N ATOM 0 H GLN A 69 -19.424 -10.121 -9.362 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.299 -8.512 -7.018 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -21.873 -10.803 -8.283 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -22.143 -10.242 -6.645 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -22.370 -7.850 -7.725 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.552 -8.706 -9.244 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -24.145 -7.837 -6.241 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -25.667 -8.672 -6.573 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.620 -10.067 -5.956 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.766 -11.028 -5.196 1.00 0.00 C ATOM 1137 C ALA A 70 -18.479 -11.431 -3.904 1.00 0.00 C ATOM 1138 O ALA A 70 -18.760 -10.604 -3.056 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.431 -10.363 -4.854 1.00 0.00 C ATOM 0 H ALA A 70 -18.450 -9.083 -5.750 1.00 0.00 H new ATOM 0 HA ALA A 70 -17.586 -11.914 -5.804 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.807 -11.064 -4.299 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.922 -10.074 -5.774 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.611 -9.477 -4.245 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.774 -12.698 -3.750 1.00 0.00 N ATOM 1146 CA GLN A 71 -19.469 -13.166 -2.516 1.00 0.00 C ATOM 1147 C GLN A 71 -18.486 -13.161 -1.343 1.00 0.00 C ATOM 1148 O GLN A 71 -17.352 -13.584 -1.471 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.993 -14.587 -2.734 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.299 -14.533 -3.530 1.00 0.00 C ATOM 1151 CD GLN A 71 -21.645 -15.932 -4.042 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -21.011 -16.433 -4.951 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -22.628 -16.590 -3.494 1.00 0.00 N ATOM 0 H GLN A 71 -18.562 -13.429 -4.429 1.00 0.00 H new ATOM 0 HA GLN A 71 -20.303 -12.500 -2.295 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.252 -15.181 -3.270 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.160 -15.076 -1.774 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -22.105 -14.155 -2.901 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -21.198 -13.843 -4.368 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -23.160 -16.171 -2.732 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -22.865 -17.524 -3.828 1.00 0.00 H new ATOM 1162 N GLY A 72 -18.915 -12.684 -0.202 1.00 0.00 N ATOM 1163 CA GLY A 72 -18.013 -12.646 0.986 1.00 0.00 C ATOM 1164 C GLY A 72 -16.963 -11.550 0.797 1.00 0.00 C ATOM 1165 O GLY A 72 -15.817 -11.706 1.175 1.00 0.00 O ATOM 0 H GLY A 72 -19.854 -12.319 -0.043 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -18.593 -12.457 1.890 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -17.526 -13.612 1.116 1.00 0.00 H new ATOM 1169 N ALA A 73 -17.347 -10.443 0.214 1.00 0.00 N ATOM 1170 CA ALA A 73 -16.379 -9.330 -0.005 1.00 0.00 C ATOM 1171 C ALA A 73 -17.142 -8.015 -0.174 1.00 0.00 C ATOM 1172 O ALA A 73 -18.229 -7.986 -0.718 1.00 0.00 O ATOM 1173 CB ALA A 73 -15.558 -9.609 -1.266 1.00 0.00 C ATOM 0 H ALA A 73 -18.294 -10.263 -0.121 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.712 -9.255 0.854 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.850 -8.796 -1.427 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -15.013 -10.546 -1.146 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -16.225 -9.685 -2.125 1.00 0.00 H new ATOM 1179 N VAL A 74 -16.578 -6.929 0.290 1.00 0.00 N ATOM 1180 CA VAL A 74 -17.263 -5.610 0.162 1.00 0.00 C ATOM 1181 C VAL A 74 -17.125 -5.100 -1.274 1.00 0.00 C ATOM 1182 O VAL A 74 -16.108 -4.545 -1.648 1.00 0.00 O ATOM 1183 CB VAL A 74 -16.624 -4.606 1.123 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -17.420 -3.300 1.104 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -16.629 -5.184 2.540 1.00 0.00 C ATOM 0 H VAL A 74 -15.670 -6.900 0.753 1.00 0.00 H new ATOM 0 HA VAL A 74 -18.319 -5.725 0.407 1.00 0.00 H new ATOM 0 HB VAL A 74 -15.598 -4.410 0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.964 -2.586 1.789 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -17.418 -2.887 0.095 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -18.447 -3.495 1.414 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -16.174 -4.470 3.226 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -17.656 -5.381 2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -16.061 -6.114 2.556 1.00 0.00 H new ATOM 1195 N VAL A 75 -18.140 -5.286 -2.079 1.00 0.00 N ATOM 1196 CA VAL A 75 -18.077 -4.817 -3.494 1.00 0.00 C ATOM 1197 C VAL A 75 -18.375 -3.317 -3.547 1.00 0.00 C ATOM 1198 O VAL A 75 -19.518 -2.902 -3.511 1.00 0.00 O ATOM 1199 CB VAL A 75 -19.112 -5.573 -4.330 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -18.945 -5.206 -5.805 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -18.908 -7.079 -4.154 1.00 0.00 C ATOM 0 H VAL A 75 -19.012 -5.744 -1.815 1.00 0.00 H new ATOM 0 HA VAL A 75 -17.081 -5.004 -3.895 1.00 0.00 H new ATOM 0 HB VAL A 75 -20.114 -5.300 -3.999 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -19.683 -5.745 -6.400 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -19.090 -4.133 -5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -17.943 -5.478 -6.136 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -19.645 -7.618 -4.749 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -17.906 -7.351 -4.484 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -19.028 -7.342 -3.103 1.00 0.00 H new ATOM 1211 N VAL A 76 -17.352 -2.504 -3.632 1.00 0.00 N ATOM 1212 CA VAL A 76 -17.566 -1.027 -3.687 1.00 0.00 C ATOM 1213 C VAL A 76 -17.460 -0.551 -5.137 1.00 0.00 C ATOM 1214 O VAL A 76 -16.872 -1.210 -5.974 1.00 0.00 O ATOM 1215 CB VAL A 76 -16.502 -0.326 -2.840 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.702 -0.686 -1.367 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -15.111 -0.781 -3.290 1.00 0.00 C ATOM 0 H VAL A 76 -16.377 -2.801 -3.666 1.00 0.00 H new ATOM 0 HA VAL A 76 -18.555 -0.788 -3.298 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.592 0.753 -2.966 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.944 -0.186 -0.764 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.692 -0.364 -1.045 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.613 -1.765 -1.241 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.352 -0.282 -2.687 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -15.023 -1.860 -3.164 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -14.966 -0.525 -4.340 1.00 0.00 H new ATOM 1227 N HIS A 77 -18.027 0.591 -5.438 1.00 0.00 N ATOM 1228 CA HIS A 77 -17.966 1.119 -6.832 1.00 0.00 C ATOM 1229 C HIS A 77 -17.708 2.627 -6.795 1.00 0.00 C ATOM 1230 O HIS A 77 -18.129 3.358 -7.672 1.00 0.00 O ATOM 1231 CB HIS A 77 -19.295 0.846 -7.540 1.00 0.00 C ATOM 1232 CG HIS A 77 -19.569 -0.633 -7.542 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -19.190 -1.453 -8.592 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -20.183 -1.454 -6.628 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -19.576 -2.706 -8.288 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -20.186 -2.762 -7.101 1.00 0.00 N ATOM 0 H HIS A 77 -18.530 1.180 -4.775 1.00 0.00 H new ATOM 0 HA HIS A 77 -17.159 0.625 -7.373 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -20.103 1.375 -7.036 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -19.258 1.221 -8.563 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -18.706 -1.160 -9.441 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -20.600 -1.133 -5.685 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -19.412 -3.562 -8.926 1.00 0.00 H new ATOM 1244 N ASP A 78 -17.021 3.095 -5.785 1.00 0.00 N ATOM 1245 CA ASP A 78 -16.730 4.555 -5.682 1.00 0.00 C ATOM 1246 C ASP A 78 -15.676 4.790 -4.598 1.00 0.00 C ATOM 1247 O ASP A 78 -15.600 4.062 -3.627 1.00 0.00 O ATOM 1248 CB ASP A 78 -18.013 5.306 -5.316 1.00 0.00 C ATOM 1249 CG ASP A 78 -17.856 6.786 -5.670 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -17.889 7.099 -6.849 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.707 7.580 -4.757 1.00 0.00 O ATOM 0 H ASP A 78 -16.648 2.526 -5.025 1.00 0.00 H new ATOM 0 HA ASP A 78 -16.355 4.919 -6.639 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -18.861 4.881 -5.852 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -18.221 5.196 -4.252 1.00 0.00 H new ATOM 1256 N VAL A 79 -14.862 5.803 -4.762 1.00 0.00 N ATOM 1257 CA VAL A 79 -13.807 6.094 -3.746 1.00 0.00 C ATOM 1258 C VAL A 79 -14.465 6.564 -2.448 1.00 0.00 C ATOM 1259 O VAL A 79 -13.962 6.328 -1.366 1.00 0.00 O ATOM 1260 CB VAL A 79 -12.879 7.189 -4.276 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -11.712 7.384 -3.307 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -12.338 6.779 -5.647 1.00 0.00 C ATOM 0 H VAL A 79 -14.884 6.441 -5.557 1.00 0.00 H new ATOM 0 HA VAL A 79 -13.229 5.191 -3.552 1.00 0.00 H new ATOM 0 HB VAL A 79 -13.435 8.122 -4.367 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -11.051 8.164 -3.685 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.096 7.676 -2.329 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -11.156 6.451 -3.215 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -11.677 7.559 -6.025 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.783 5.846 -5.555 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.168 6.640 -6.339 1.00 0.00 H new ATOM 1272 N ALA A 80 -15.589 7.231 -2.550 1.00 0.00 N ATOM 1273 CA ALA A 80 -16.289 7.721 -1.328 1.00 0.00 C ATOM 1274 C ALA A 80 -16.795 6.528 -0.515 1.00 0.00 C ATOM 1275 O ALA A 80 -16.836 6.568 0.700 1.00 0.00 O ATOM 1276 CB ALA A 80 -17.473 8.600 -1.737 1.00 0.00 C ATOM 0 H ALA A 80 -16.051 7.456 -3.431 1.00 0.00 H new ATOM 0 HA ALA A 80 -15.596 8.304 -0.722 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -17.985 8.959 -0.844 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -17.112 9.451 -2.315 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -18.166 8.017 -2.344 1.00 0.00 H new ATOM 1282 N ALA A 81 -17.182 5.469 -1.180 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.688 4.266 -0.456 1.00 0.00 C ATOM 1284 C ALA A 81 -16.533 3.596 0.292 1.00 0.00 C ATOM 1285 O ALA A 81 -16.707 3.068 1.374 1.00 0.00 O ATOM 1286 CB ALA A 81 -18.285 3.279 -1.461 1.00 0.00 C ATOM 0 H ALA A 81 -17.169 5.387 -2.197 1.00 0.00 H new ATOM 0 HA ALA A 81 -18.455 4.568 0.257 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.655 2.400 -0.932 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -19.108 3.755 -1.993 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -17.518 2.977 -2.174 1.00 0.00 H new ATOM 1292 N VAL A 82 -15.356 3.617 -0.280 1.00 0.00 N ATOM 1293 CA VAL A 82 -14.181 2.984 0.389 1.00 0.00 C ATOM 1294 C VAL A 82 -13.821 3.779 1.646 1.00 0.00 C ATOM 1295 O VAL A 82 -13.554 3.215 2.690 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.990 2.979 -0.571 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.832 2.197 0.054 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -13.398 2.315 -1.888 1.00 0.00 C ATOM 0 H VAL A 82 -15.158 4.047 -1.184 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.428 1.959 0.666 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.675 4.005 -0.762 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.984 2.194 -0.631 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.539 2.668 0.992 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.147 1.171 0.246 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.549 2.312 -2.572 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.714 1.289 -1.696 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -14.222 2.870 -2.335 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.812 5.084 1.550 1.00 0.00 N ATOM 1309 CA PHE A 83 -13.470 5.925 2.734 1.00 0.00 C ATOM 1310 C PHE A 83 -14.633 5.904 3.728 1.00 0.00 C ATOM 1311 O PHE A 83 -14.440 6.022 4.923 1.00 0.00 O ATOM 1312 CB PHE A 83 -13.213 7.364 2.279 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.840 7.457 1.657 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.704 7.162 2.420 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.703 7.840 0.318 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -9.432 7.249 1.843 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -10.431 7.927 -0.259 1.00 0.00 C ATOM 1318 CZ PHE A 83 -9.295 7.631 0.504 1.00 0.00 C ATOM 0 H PHE A 83 -14.028 5.604 0.699 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.575 5.530 3.215 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.972 7.670 1.559 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.286 8.044 3.128 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.809 6.867 3.454 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.579 8.069 -0.270 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.556 7.021 2.432 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -10.326 8.222 -1.292 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.313 7.698 0.059 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.839 5.755 3.239 1.00 0.00 N ATOM 1329 CA ALA A 84 -17.022 5.725 4.148 1.00 0.00 C ATOM 1330 C ALA A 84 -16.963 4.471 5.022 1.00 0.00 C ATOM 1331 O ALA A 84 -17.331 4.494 6.181 1.00 0.00 O ATOM 1332 CB ALA A 84 -18.304 5.706 3.314 1.00 0.00 C ATOM 0 H ALA A 84 -16.054 5.653 2.247 1.00 0.00 H new ATOM 0 HA ALA A 84 -17.015 6.610 4.784 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.169 5.684 3.977 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.346 6.600 2.692 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.311 4.821 2.678 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.502 3.376 4.471 1.00 0.00 N ATOM 1339 CA TYR A 85 -16.414 2.113 5.261 1.00 0.00 C ATOM 1340 C TYR A 85 -15.288 2.232 6.291 1.00 0.00 C ATOM 1341 O TYR A 85 -15.376 1.700 7.382 1.00 0.00 O ATOM 1342 CB TYR A 85 -16.122 0.942 4.320 1.00 0.00 C ATOM 1343 CG TYR A 85 -16.365 -0.360 5.046 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.649 -0.917 5.074 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.304 -1.008 5.690 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -17.873 -2.124 5.747 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.529 -2.216 6.363 1.00 0.00 C ATOM 1348 CZ TYR A 85 -16.813 -2.773 6.392 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.034 -3.963 7.054 1.00 0.00 O ATOM 0 H TYR A 85 -16.182 3.304 3.505 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.360 1.940 5.775 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.759 1.003 3.438 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -15.090 0.990 3.972 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.466 -0.416 4.577 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.314 -0.577 5.668 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.863 -2.555 5.769 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.712 -2.718 6.860 1.00 0.00 H new ATOM 0 HH TYR A 85 -16.194 -4.280 7.446 1.00 0.00 H new ATOM 1359 N ALA A 86 -14.234 2.929 5.951 1.00 0.00 N ATOM 1360 CA ALA A 86 -13.095 3.089 6.902 1.00 0.00 C ATOM 1361 C ALA A 86 -13.532 3.968 8.075 1.00 0.00 C ATOM 1362 O ALA A 86 -13.057 3.817 9.185 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.917 3.747 6.182 1.00 0.00 C ATOM 0 H ALA A 86 -14.114 3.396 5.052 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.791 2.110 7.274 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.085 3.864 6.877 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.606 3.121 5.346 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.219 4.726 5.810 1.00 0.00 H new ATOM 1369 N LYS A 87 -14.433 4.887 7.835 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.908 5.783 8.931 1.00 0.00 C ATOM 1371 C LYS A 87 -15.692 4.963 9.957 1.00 0.00 C ATOM 1372 O LYS A 87 -15.649 5.234 11.143 1.00 0.00 O ATOM 1373 CB LYS A 87 -15.813 6.869 8.345 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.954 7.954 7.693 1.00 0.00 C ATOM 1375 CD LYS A 87 -15.861 9.002 7.044 1.00 0.00 C ATOM 1376 CE LYS A 87 -16.468 9.893 8.127 1.00 0.00 C ATOM 1377 NZ LYS A 87 -17.059 11.108 7.497 1.00 0.00 N ATOM 0 H LYS A 87 -14.861 5.055 6.924 1.00 0.00 H new ATOM 0 HA LYS A 87 -14.051 6.248 9.418 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -16.490 6.435 7.609 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -16.432 7.303 9.130 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -14.314 8.424 8.440 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -14.298 7.512 6.944 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.290 9.606 6.339 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -16.652 8.512 6.476 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -17.234 9.346 8.676 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.703 10.180 8.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -17.472 11.715 8.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -16.317 11.633 6.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -17.801 10.825 6.825 1.00 0.00 H new ATOM 1391 N GLN A 88 -16.409 3.964 9.508 1.00 0.00 N ATOM 1392 CA GLN A 88 -17.200 3.119 10.449 1.00 0.00 C ATOM 1393 C GLN A 88 -16.249 2.284 11.308 1.00 0.00 C ATOM 1394 O GLN A 88 -16.495 2.054 12.477 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.118 2.190 9.653 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.357 2.963 9.197 1.00 0.00 C ATOM 1397 CD GLN A 88 -20.451 1.977 8.784 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -21.570 2.063 9.249 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -20.174 1.035 7.924 1.00 0.00 N ATOM 0 H GLN A 88 -16.480 3.698 8.526 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.803 3.760 11.093 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.587 1.790 8.789 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.413 1.339 10.267 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -19.716 3.604 10.003 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.105 3.614 8.360 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -19.235 0.962 7.533 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -20.897 0.372 7.643 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.164 1.830 10.733 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.188 1.007 11.507 1.00 0.00 C ATOM 1410 C HIS A 89 -12.816 1.698 11.499 1.00 0.00 C ATOM 1411 O HIS A 89 -11.996 1.416 10.648 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.066 -0.376 10.866 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.261 -1.210 11.242 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -15.135 -2.471 11.804 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.609 -0.976 11.143 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.376 -2.944 12.018 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -17.312 -2.073 11.633 1.00 0.00 N ATOM 0 H HIS A 89 -14.912 1.995 9.758 1.00 0.00 H new ATOM 0 HA HIS A 89 -14.536 0.902 12.535 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.001 -0.282 9.782 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.150 -0.863 11.199 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -17.057 -0.077 10.745 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.589 -3.911 12.449 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -18.324 -2.187 11.686 1.00 0.00 H new ATOM 1425 N PRO A 90 -12.600 2.586 12.446 1.00 0.00 N ATOM 1426 CA PRO A 90 -11.333 3.375 12.620 1.00 0.00 C ATOM 1427 C PRO A 90 -10.278 2.520 13.328 1.00 0.00 C ATOM 1428 O PRO A 90 -9.330 3.032 13.892 1.00 0.00 O ATOM 1429 CB PRO A 90 -11.692 4.590 13.475 1.00 0.00 C ATOM 1430 CG PRO A 90 -13.070 4.345 14.059 1.00 0.00 C ATOM 1431 CD PRO A 90 -13.557 2.996 13.538 1.00 0.00 C ATOM 0 HA PRO A 90 -10.920 3.681 11.659 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -10.958 4.730 14.269 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -11.687 5.498 12.872 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -13.030 4.343 15.148 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -13.757 5.139 13.767 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -13.574 2.255 14.337 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -14.574 3.073 13.153 1.00 0.00 H new ATOM 1439 N ASP A 91 -10.438 1.221 13.299 1.00 0.00 N ATOM 1440 CA ASP A 91 -9.449 0.323 13.966 1.00 0.00 C ATOM 1441 C ASP A 91 -8.507 -0.268 12.915 1.00 0.00 C ATOM 1442 O ASP A 91 -7.357 -0.556 13.193 1.00 0.00 O ATOM 1443 CB ASP A 91 -10.190 -0.810 14.681 1.00 0.00 C ATOM 1444 CG ASP A 91 -9.260 -1.461 15.706 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -9.131 -0.915 16.790 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -8.695 -2.495 15.391 1.00 0.00 O ATOM 0 H ASP A 91 -11.214 0.743 12.840 1.00 0.00 H new ATOM 0 HA ASP A 91 -8.871 0.895 14.692 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.079 -0.421 15.177 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -10.527 -1.552 13.957 1.00 0.00 H new ATOM 1451 N GLN A 92 -8.986 -0.448 11.711 1.00 0.00 N ATOM 1452 CA GLN A 92 -8.127 -1.019 10.634 1.00 0.00 C ATOM 1453 C GLN A 92 -7.498 0.119 9.827 1.00 0.00 C ATOM 1454 O GLN A 92 -7.752 1.282 10.078 1.00 0.00 O ATOM 1455 CB GLN A 92 -8.979 -1.891 9.710 1.00 0.00 C ATOM 1456 CG GLN A 92 -9.383 -3.171 10.444 1.00 0.00 C ATOM 1457 CD GLN A 92 -10.610 -3.783 9.766 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -10.593 -4.936 9.380 1.00 0.00 O ATOM 1459 NE2 GLN A 92 -11.681 -3.056 9.603 1.00 0.00 N ATOM 0 H GLN A 92 -9.940 -0.223 11.428 1.00 0.00 H new ATOM 0 HA GLN A 92 -7.339 -1.626 11.080 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -9.868 -1.344 9.394 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -8.419 -2.138 8.808 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -8.558 -3.883 10.437 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.604 -2.950 11.488 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -11.695 -2.089 9.927 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -12.504 -3.455 9.152 1.00 0.00 H new ATOM 1468 N GLU A 93 -6.681 -0.212 8.858 1.00 0.00 N ATOM 1469 CA GLU A 93 -6.030 0.844 8.029 1.00 0.00 C ATOM 1470 C GLU A 93 -6.269 0.548 6.546 1.00 0.00 C ATOM 1471 O GLU A 93 -6.425 -0.593 6.152 1.00 0.00 O ATOM 1472 CB GLU A 93 -4.526 0.859 8.311 1.00 0.00 C ATOM 1473 CG GLU A 93 -4.269 1.501 9.675 1.00 0.00 C ATOM 1474 CD GLU A 93 -4.610 0.502 10.782 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -4.228 -0.650 10.651 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -5.246 0.905 11.741 1.00 0.00 O ATOM 0 H GLU A 93 -6.438 -1.170 8.606 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.456 1.816 8.278 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.132 -0.157 8.296 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.005 1.415 7.532 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -3.225 1.806 9.754 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -4.873 2.402 9.785 1.00 0.00 H new ATOM 1483 N LEU A 94 -6.298 1.567 5.726 1.00 0.00 N ATOM 1484 CA LEU A 94 -6.528 1.355 4.267 1.00 0.00 C ATOM 1485 C LEU A 94 -5.206 0.989 3.590 1.00 0.00 C ATOM 1486 O LEU A 94 -4.330 1.818 3.432 1.00 0.00 O ATOM 1487 CB LEU A 94 -7.080 2.640 3.646 1.00 0.00 C ATOM 1488 CG LEU A 94 -7.693 2.324 2.281 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -9.046 1.637 2.475 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -7.892 3.625 1.498 1.00 0.00 C ATOM 0 H LEU A 94 -6.172 2.540 6.006 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.245 0.546 4.126 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.832 3.079 4.301 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.283 3.376 3.537 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.025 1.663 1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -9.483 1.412 1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -8.907 0.711 3.033 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.714 2.298 3.028 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.329 3.401 0.525 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.560 4.285 2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.929 4.117 1.359 1.00 0.00 H new ATOM 1502 N VAL A 95 -5.058 -0.249 3.190 1.00 0.00 N ATOM 1503 CA VAL A 95 -3.795 -0.680 2.522 1.00 0.00 C ATOM 1504 C VAL A 95 -4.090 -1.051 1.067 1.00 0.00 C ATOM 1505 O VAL A 95 -5.014 -1.789 0.782 1.00 0.00 O ATOM 1506 CB VAL A 95 -3.219 -1.896 3.251 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -1.850 -2.242 2.665 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -3.068 -1.572 4.740 1.00 0.00 C ATOM 0 H VAL A 95 -5.760 -0.981 3.298 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.073 0.136 2.551 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.891 -2.745 3.128 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.440 -3.108 3.185 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.956 -2.471 1.605 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.177 -1.393 2.787 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.658 -2.437 5.261 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.395 -0.723 4.861 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.043 -1.325 5.159 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.310 -0.543 0.147 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.536 -0.860 -1.293 1.00 0.00 C ATOM 1520 C ILE A 96 -2.584 -1.977 -1.724 1.00 0.00 C ATOM 1521 O ILE A 96 -1.383 -1.877 -1.556 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.275 0.389 -2.140 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -4.087 1.574 -1.590 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.676 0.117 -3.594 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.588 1.261 -1.631 1.00 0.00 C ATOM 0 H ILE A 96 -2.524 0.080 0.333 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.567 -1.185 -1.435 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.214 0.635 -2.098 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.782 1.788 -0.566 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.880 2.468 -2.177 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.490 1.007 -4.195 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -3.089 -0.714 -3.984 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.735 -0.135 -3.638 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.148 2.110 -1.238 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.892 1.071 -2.660 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.793 0.379 -1.024 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.112 -3.039 -2.277 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.244 -4.168 -2.722 1.00 0.00 C ATOM 1539 C ALA A 97 -2.186 -4.196 -4.252 1.00 0.00 C ATOM 1540 O ALA A 97 -1.220 -4.653 -4.834 1.00 0.00 O ATOM 1541 CB ALA A 97 -2.824 -5.489 -2.211 1.00 0.00 C ATOM 0 H ALA A 97 -4.110 -3.172 -2.439 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.239 -4.032 -2.322 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.190 -6.314 -2.536 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -2.866 -5.471 -1.122 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.829 -5.624 -2.611 1.00 0.00 H new ATOM 1547 N GLY A 98 -3.213 -3.711 -4.901 1.00 0.00 N ATOM 1548 CA GLY A 98 -3.227 -3.705 -6.395 1.00 0.00 C ATOM 1549 C GLY A 98 -4.673 -3.548 -6.896 1.00 0.00 C ATOM 1550 O GLY A 98 -5.590 -3.449 -6.105 1.00 0.00 O ATOM 0 H GLY A 98 -4.044 -3.318 -4.460 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.610 -2.889 -6.771 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -2.798 -4.631 -6.777 1.00 0.00 H new ATOM 1554 N GLY A 99 -4.908 -3.520 -8.198 1.00 0.00 N ATOM 1555 CA GLY A 99 -3.801 -3.639 -9.203 1.00 0.00 C ATOM 1556 C GLY A 99 -3.188 -2.261 -9.456 1.00 0.00 C ATOM 1557 O GLY A 99 -3.210 -1.396 -8.599 1.00 0.00 O ATOM 0 H GLY A 99 -5.837 -3.418 -8.606 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -3.038 -4.326 -8.839 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -4.185 -4.054 -10.135 1.00 0.00 H new ATOM 1561 N ALA A 100 -2.642 -2.052 -10.627 1.00 0.00 N ATOM 1562 CA ALA A 100 -2.024 -0.731 -10.947 1.00 0.00 C ATOM 1563 C ALA A 100 -3.113 0.341 -11.008 1.00 0.00 C ATOM 1564 O ALA A 100 -2.884 1.490 -10.678 1.00 0.00 O ATOM 1565 CB ALA A 100 -1.314 -0.814 -12.300 1.00 0.00 C ATOM 0 H ALA A 100 -2.598 -2.742 -11.377 1.00 0.00 H new ATOM 0 HA ALA A 100 -1.302 -0.471 -10.173 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.863 0.150 -12.534 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.537 -1.577 -12.257 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -2.036 -1.074 -13.074 1.00 0.00 H new ATOM 1571 N GLN A 101 -4.296 -0.028 -11.431 1.00 0.00 N ATOM 1572 CA GLN A 101 -5.408 0.964 -11.518 1.00 0.00 C ATOM 1573 C GLN A 101 -5.864 1.345 -10.109 1.00 0.00 C ATOM 1574 O GLN A 101 -6.316 2.449 -9.872 1.00 0.00 O ATOM 1575 CB GLN A 101 -6.581 0.347 -12.284 1.00 0.00 C ATOM 1576 CG GLN A 101 -7.544 1.451 -12.722 1.00 0.00 C ATOM 1577 CD GLN A 101 -8.583 0.872 -13.683 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -9.758 0.833 -13.375 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -8.198 0.415 -14.843 1.00 0.00 N ATOM 0 H GLN A 101 -4.539 -0.976 -11.720 1.00 0.00 H new ATOM 0 HA GLN A 101 -5.060 1.855 -12.040 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -6.214 -0.196 -13.155 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -7.101 -0.374 -11.654 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -8.039 1.882 -11.852 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -6.993 2.257 -13.208 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -7.212 0.447 -15.102 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -8.883 0.025 -15.491 1.00 0.00 H new ATOM 1588 N ILE A 102 -5.749 0.437 -9.174 1.00 0.00 N ATOM 1589 CA ILE A 102 -6.173 0.735 -7.775 1.00 0.00 C ATOM 1590 C ILE A 102 -5.128 1.627 -7.102 1.00 0.00 C ATOM 1591 O ILE A 102 -5.455 2.483 -6.300 1.00 0.00 O ATOM 1592 CB ILE A 102 -6.305 -0.575 -6.992 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -7.226 -1.545 -7.753 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -6.887 -0.288 -5.604 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -8.624 -0.935 -7.922 1.00 0.00 C ATOM 0 H ILE A 102 -5.378 -0.502 -9.321 1.00 0.00 H new ATOM 0 HA ILE A 102 -7.134 1.250 -7.790 1.00 0.00 H new ATOM 0 HB ILE A 102 -5.321 -1.030 -6.882 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.800 -1.769 -8.731 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -7.297 -2.489 -7.212 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.980 -1.221 -5.048 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.226 0.391 -5.065 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -7.870 0.171 -5.709 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -9.263 -1.634 -8.462 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -9.054 -0.734 -6.941 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -8.549 -0.004 -8.483 1.00 0.00 H new ATOM 1607 N PHE A 103 -3.874 1.433 -7.424 1.00 0.00 N ATOM 1608 CA PHE A 103 -2.799 2.265 -6.808 1.00 0.00 C ATOM 1609 C PHE A 103 -2.975 3.725 -7.235 1.00 0.00 C ATOM 1610 O PHE A 103 -3.096 4.611 -6.410 1.00 0.00 O ATOM 1611 CB PHE A 103 -1.431 1.759 -7.272 1.00 0.00 C ATOM 1612 CG PHE A 103 -1.068 0.506 -6.510 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -1.077 0.509 -5.109 1.00 0.00 C ATOM 1614 CD2 PHE A 103 -0.719 -0.659 -7.204 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.738 -0.651 -4.404 1.00 0.00 C ATOM 1616 CE2 PHE A 103 -0.380 -1.819 -6.498 1.00 0.00 C ATOM 1617 CZ PHE A 103 -0.389 -1.816 -5.098 1.00 0.00 C ATOM 0 H PHE A 103 -3.549 0.732 -8.089 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.863 2.194 -5.722 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -1.452 1.552 -8.342 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -0.674 2.527 -7.111 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -1.346 1.407 -4.573 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -0.711 -0.662 -8.284 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.746 -0.648 -3.324 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -0.111 -2.717 -7.034 1.00 0.00 H new ATOM 0 HZ PHE A 103 -0.127 -2.711 -4.554 1.00 0.00 H new ATOM 1627 N THR A 104 -2.990 3.977 -8.519 1.00 0.00 N ATOM 1628 CA THR A 104 -3.156 5.376 -9.012 1.00 0.00 C ATOM 1629 C THR A 104 -4.518 5.920 -8.570 1.00 0.00 C ATOM 1630 O THR A 104 -4.728 7.117 -8.516 1.00 0.00 O ATOM 1631 CB THR A 104 -3.071 5.392 -10.540 1.00 0.00 C ATOM 1632 OG1 THR A 104 -2.068 4.480 -10.966 1.00 0.00 O ATOM 1633 CG2 THR A 104 -2.719 6.800 -11.020 1.00 0.00 C ATOM 0 H THR A 104 -2.894 3.271 -9.249 1.00 0.00 H new ATOM 0 HA THR A 104 -2.366 6.001 -8.597 1.00 0.00 H new ATOM 0 HB THR A 104 -4.033 5.098 -10.960 1.00 0.00 H new ATOM 0 HG1 THR A 104 -2.013 4.488 -11.944 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.659 6.809 -12.108 1.00 0.00 H new ATOM 0 HG22 THR A 104 -3.489 7.499 -10.693 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.758 7.097 -10.601 1.00 0.00 H new ATOM 1641 N ALA A 105 -5.444 5.047 -8.258 1.00 0.00 N ATOM 1642 CA ALA A 105 -6.794 5.504 -7.820 1.00 0.00 C ATOM 1643 C ALA A 105 -6.694 6.136 -6.430 1.00 0.00 C ATOM 1644 O ALA A 105 -7.395 7.081 -6.117 1.00 0.00 O ATOM 1645 CB ALA A 105 -7.746 4.307 -7.767 1.00 0.00 C ATOM 0 H ALA A 105 -5.320 4.035 -8.289 1.00 0.00 H new ATOM 0 HA ALA A 105 -7.174 6.241 -8.528 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -8.733 4.641 -7.447 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.819 3.856 -8.757 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.365 3.570 -7.060 1.00 0.00 H new ATOM 1651 N PHE A 106 -5.828 5.620 -5.595 1.00 0.00 N ATOM 1652 CA PHE A 106 -5.675 6.184 -4.220 1.00 0.00 C ATOM 1653 C PHE A 106 -4.294 6.832 -4.075 1.00 0.00 C ATOM 1654 O PHE A 106 -3.830 7.076 -2.977 1.00 0.00 O ATOM 1655 CB PHE A 106 -5.817 5.059 -3.192 1.00 0.00 C ATOM 1656 CG PHE A 106 -7.267 4.655 -3.083 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -8.126 5.349 -2.222 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.753 3.582 -3.842 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -9.470 4.973 -2.120 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -9.098 3.206 -3.740 1.00 0.00 C ATOM 1661 CZ PHE A 106 -9.957 3.902 -2.879 1.00 0.00 C ATOM 0 H PHE A 106 -5.219 4.830 -5.807 1.00 0.00 H new ATOM 0 HA PHE A 106 -6.445 6.937 -4.052 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -5.211 4.203 -3.489 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -5.447 5.390 -2.222 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.751 6.175 -1.636 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.091 3.045 -4.505 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -10.132 5.509 -1.456 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.473 2.379 -4.325 1.00 0.00 H new ATOM 0 HZ PHE A 106 -10.994 3.612 -2.801 1.00 0.00 H new ATOM 1671 N LYS A 107 -3.638 7.112 -5.173 1.00 0.00 N ATOM 1672 CA LYS A 107 -2.286 7.744 -5.104 1.00 0.00 C ATOM 1673 C LYS A 107 -2.412 9.165 -4.547 1.00 0.00 C ATOM 1674 O LYS A 107 -1.466 9.717 -4.016 1.00 0.00 O ATOM 1675 CB LYS A 107 -1.670 7.795 -6.505 1.00 0.00 C ATOM 1676 CG LYS A 107 -2.619 8.524 -7.462 1.00 0.00 C ATOM 1677 CD LYS A 107 -2.213 9.996 -7.563 1.00 0.00 C ATOM 1678 CE LYS A 107 -2.612 10.543 -8.934 1.00 0.00 C ATOM 1679 NZ LYS A 107 -4.078 10.808 -8.957 1.00 0.00 N ATOM 0 H LYS A 107 -3.982 6.930 -6.116 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.645 7.154 -4.449 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -0.708 8.307 -6.471 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -1.480 6.784 -6.866 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.587 8.059 -8.447 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -3.646 8.443 -7.105 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.697 10.573 -6.775 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -1.138 10.098 -7.418 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -2.063 11.461 -9.145 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -2.349 9.828 -9.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.349 11.180 -9.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -4.594 9.924 -8.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -4.316 11.506 -8.223 1.00 0.00 H new ATOM 1693 N ASP A 108 -3.572 9.759 -4.666 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.767 11.145 -4.147 1.00 0.00 C ATOM 1695 C ASP A 108 -3.665 11.139 -2.620 1.00 0.00 C ATOM 1696 O ASP A 108 -3.013 11.980 -2.031 1.00 0.00 O ATOM 1697 CB ASP A 108 -5.148 11.657 -4.564 1.00 0.00 C ATOM 1698 CG ASP A 108 -5.194 13.178 -4.418 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -4.212 13.817 -4.758 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -6.212 13.679 -3.968 1.00 0.00 O ATOM 0 H ASP A 108 -4.395 9.342 -5.102 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.998 11.798 -4.559 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -5.356 11.374 -5.596 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.920 11.198 -3.946 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.308 10.197 -1.978 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.256 10.128 -0.488 1.00 0.00 C ATOM 1707 C ASP A 109 -3.243 9.061 -0.060 1.00 0.00 C ATOM 1708 O ASP A 109 -3.503 8.259 0.818 1.00 0.00 O ATOM 1709 CB ASP A 109 -5.642 9.770 0.053 1.00 0.00 C ATOM 1710 CG ASP A 109 -6.657 10.817 -0.409 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -6.954 10.844 -1.592 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.119 11.574 0.428 1.00 0.00 O ATOM 0 H ASP A 109 -4.868 9.471 -2.424 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.950 11.095 -0.088 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.937 8.782 -0.299 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -5.619 9.726 1.142 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.088 9.048 -0.678 1.00 0.00 N ATOM 1718 CA VAL A 110 -1.051 8.039 -0.315 1.00 0.00 C ATOM 1719 C VAL A 110 -0.097 8.639 0.726 1.00 0.00 C ATOM 1720 O VAL A 110 0.164 9.828 0.727 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.277 7.632 -1.579 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.408 8.859 -2.191 1.00 0.00 C ATOM 1723 CG2 VAL A 110 0.782 6.582 -1.225 1.00 0.00 C ATOM 0 H VAL A 110 -1.820 9.695 -1.420 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.525 7.155 0.111 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.977 7.212 -2.301 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.954 8.562 -3.086 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.345 9.602 -2.455 1.00 0.00 H new ATOM 0 HG13 VAL A 110 1.102 9.287 -1.468 1.00 0.00 H new ATOM 0 HG21 VAL A 110 1.327 6.297 -2.125 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.477 6.998 -0.496 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.296 5.703 -0.802 1.00 0.00 H new ATOM 1733 N ASP A 111 0.423 7.823 1.607 1.00 0.00 N ATOM 1734 CA ASP A 111 1.360 8.333 2.650 1.00 0.00 C ATOM 1735 C ASP A 111 2.537 7.366 2.792 1.00 0.00 C ATOM 1736 O ASP A 111 3.656 7.682 2.435 1.00 0.00 O ATOM 1737 CB ASP A 111 0.625 8.444 3.987 1.00 0.00 C ATOM 1738 CG ASP A 111 1.292 9.516 4.850 1.00 0.00 C ATOM 1739 OD1 ASP A 111 1.101 10.686 4.557 1.00 0.00 O ATOM 1740 OD2 ASP A 111 1.981 9.151 5.787 1.00 0.00 O ATOM 0 H ASP A 111 0.237 6.821 1.648 1.00 0.00 H new ATOM 0 HA ASP A 111 1.730 9.316 2.358 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.422 8.697 3.818 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.641 7.484 4.504 1.00 0.00 H new ATOM 1745 N THR A 112 2.288 6.190 3.311 1.00 0.00 N ATOM 1746 CA THR A 112 3.385 5.193 3.481 1.00 0.00 C ATOM 1747 C THR A 112 3.574 4.420 2.173 1.00 0.00 C ATOM 1748 O THR A 112 2.666 3.767 1.694 1.00 0.00 O ATOM 1749 CB THR A 112 3.019 4.218 4.602 1.00 0.00 C ATOM 1750 OG1 THR A 112 2.489 4.944 5.703 1.00 0.00 O ATOM 1751 CG2 THR A 112 4.267 3.454 5.045 1.00 0.00 C ATOM 0 H THR A 112 1.369 5.878 3.625 1.00 0.00 H new ATOM 0 HA THR A 112 4.311 5.708 3.737 1.00 0.00 H new ATOM 0 HB THR A 112 2.274 3.510 4.240 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.252 4.321 6.422 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.004 2.760 5.843 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.672 2.898 4.200 1.00 0.00 H new ATOM 0 HG23 THR A 112 5.015 4.159 5.408 1.00 0.00 H new ATOM 1759 N LEU A 113 4.746 4.492 1.596 1.00 0.00 N ATOM 1760 CA LEU A 113 5.002 3.766 0.318 1.00 0.00 C ATOM 1761 C LEU A 113 5.917 2.569 0.582 1.00 0.00 C ATOM 1762 O LEU A 113 7.127 2.697 0.603 1.00 0.00 O ATOM 1763 CB LEU A 113 5.674 4.712 -0.680 1.00 0.00 C ATOM 1764 CG LEU A 113 4.628 5.657 -1.273 1.00 0.00 C ATOM 1765 CD1 LEU A 113 5.317 6.914 -1.807 1.00 0.00 C ATOM 1766 CD2 LEU A 113 3.898 4.952 -2.419 1.00 0.00 C ATOM 0 H LEU A 113 5.538 5.024 1.957 1.00 0.00 H new ATOM 0 HA LEU A 113 4.056 3.414 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.457 5.285 -0.183 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.153 4.139 -1.474 1.00 0.00 H new ATOM 0 HG LEU A 113 3.912 5.937 -0.500 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.570 7.587 -2.229 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.839 7.417 -0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.033 6.636 -2.580 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.152 5.624 -2.843 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.616 4.673 -3.191 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.406 4.056 -2.040 1.00 0.00 H new ATOM 1778 N LEU A 114 5.346 1.409 0.781 1.00 0.00 N ATOM 1779 CA LEU A 114 6.174 0.196 1.041 1.00 0.00 C ATOM 1780 C LEU A 114 6.479 -0.503 -0.285 1.00 0.00 C ATOM 1781 O LEU A 114 5.590 -0.987 -0.959 1.00 0.00 O ATOM 1782 CB LEU A 114 5.404 -0.759 1.957 1.00 0.00 C ATOM 1783 CG LEU A 114 5.190 -0.098 3.319 1.00 0.00 C ATOM 1784 CD1 LEU A 114 4.076 -0.827 4.071 1.00 0.00 C ATOM 1785 CD2 LEU A 114 6.485 -0.173 4.131 1.00 0.00 C ATOM 0 H LEU A 114 4.338 1.250 0.774 1.00 0.00 H new ATOM 0 HA LEU A 114 7.108 0.487 1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 114 4.443 -1.013 1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.957 -1.691 2.076 1.00 0.00 H new ATOM 0 HG LEU A 114 4.909 0.945 3.176 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.924 -0.356 5.042 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.153 -0.775 3.494 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.356 -1.871 4.214 1.00 0.00 H new ATOM 0 HD21 LEU A 114 6.333 0.298 5.102 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.765 -1.217 4.274 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.280 0.346 3.596 1.00 0.00 H new ATOM 1797 N VAL A 115 7.732 -0.555 -0.663 1.00 0.00 N ATOM 1798 CA VAL A 115 8.103 -1.217 -1.948 1.00 0.00 C ATOM 1799 C VAL A 115 9.144 -2.310 -1.679 1.00 0.00 C ATOM 1800 O VAL A 115 10.060 -2.129 -0.899 1.00 0.00 O ATOM 1801 CB VAL A 115 8.671 -0.164 -2.913 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.924 0.481 -2.310 1.00 0.00 C ATOM 1803 CG2 VAL A 115 9.030 -0.824 -4.248 1.00 0.00 C ATOM 0 H VAL A 115 8.514 -0.167 -0.135 1.00 0.00 H new ATOM 0 HA VAL A 115 7.222 -1.675 -2.398 1.00 0.00 H new ATOM 0 HB VAL A 115 7.916 0.605 -3.079 1.00 0.00 H new ATOM 0 HG11 VAL A 115 10.319 1.225 -3.001 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.667 0.962 -1.366 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.678 -0.286 -2.133 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.432 -0.073 -4.928 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.777 -1.600 -4.081 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.136 -1.269 -4.686 1.00 0.00 H new ATOM 1813 N THR A 116 9.008 -3.440 -2.326 1.00 0.00 N ATOM 1814 CA THR A 116 9.983 -4.549 -2.122 1.00 0.00 C ATOM 1815 C THR A 116 10.830 -4.714 -3.385 1.00 0.00 C ATOM 1816 O THR A 116 10.392 -5.291 -4.363 1.00 0.00 O ATOM 1817 CB THR A 116 9.227 -5.850 -1.839 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.320 -5.643 -0.765 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.223 -6.949 -1.465 1.00 0.00 C ATOM 0 H THR A 116 8.260 -3.641 -2.989 1.00 0.00 H new ATOM 0 HA THR A 116 10.629 -4.317 -1.276 1.00 0.00 H new ATOM 0 HB THR A 116 8.674 -6.152 -2.729 1.00 0.00 H new ATOM 0 HG1 THR A 116 8.706 -5.998 0.063 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.684 -7.875 -1.264 1.00 0.00 H new ATOM 0 HG22 THR A 116 10.918 -7.106 -2.290 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.777 -6.651 -0.575 1.00 0.00 H new ATOM 1827 N ARG A 117 12.037 -4.208 -3.370 1.00 0.00 N ATOM 1828 CA ARG A 117 12.920 -4.326 -4.568 1.00 0.00 C ATOM 1829 C ARG A 117 13.698 -5.642 -4.505 1.00 0.00 C ATOM 1830 O ARG A 117 14.159 -6.050 -3.455 1.00 0.00 O ATOM 1831 CB ARG A 117 13.903 -3.154 -4.594 1.00 0.00 C ATOM 1832 CG ARG A 117 13.127 -1.837 -4.647 1.00 0.00 C ATOM 1833 CD ARG A 117 14.069 -0.676 -4.323 1.00 0.00 C ATOM 1834 NE ARG A 117 13.311 0.613 -4.380 1.00 0.00 N ATOM 1835 CZ ARG A 117 13.044 1.193 -5.530 1.00 0.00 C ATOM 1836 NH1 ARG A 117 13.432 0.657 -6.660 1.00 0.00 N ATOM 1837 NH2 ARG A 117 12.383 2.317 -5.546 1.00 0.00 N ATOM 0 H ARG A 117 12.449 -3.717 -2.577 1.00 0.00 H new ATOM 0 HA ARG A 117 12.309 -4.310 -5.471 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.538 -3.179 -3.708 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.560 -3.236 -5.460 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.690 -1.700 -5.636 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.302 -1.860 -3.935 1.00 0.00 H new ATOM 0 HD2 ARG A 117 14.503 -0.811 -3.332 1.00 0.00 H new ATOM 0 HD3 ARG A 117 14.896 -0.656 -5.033 1.00 0.00 H new ATOM 0 HE ARG A 117 12.996 1.049 -3.513 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.949 -0.222 -6.656 1.00 0.00 H new ATOM 0 HH12 ARG A 117 13.217 1.119 -7.544 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.077 2.741 -4.670 1.00 0.00 H new ATOM 0 HH22 ARG A 117 12.173 2.772 -6.434 1.00 0.00 H new ATOM 1851 N LEU A 118 13.848 -6.306 -5.624 1.00 0.00 N ATOM 1852 CA LEU A 118 14.597 -7.596 -5.643 1.00 0.00 C ATOM 1853 C LEU A 118 15.893 -7.418 -6.439 1.00 0.00 C ATOM 1854 O LEU A 118 15.916 -6.755 -7.460 1.00 0.00 O ATOM 1855 CB LEU A 118 13.733 -8.678 -6.301 1.00 0.00 C ATOM 1856 CG LEU A 118 13.080 -9.543 -5.220 1.00 0.00 C ATOM 1857 CD1 LEU A 118 12.034 -8.720 -4.468 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.402 -10.749 -5.876 1.00 0.00 C ATOM 0 H LEU A 118 13.482 -6.007 -6.528 1.00 0.00 H new ATOM 0 HA LEU A 118 14.836 -7.896 -4.623 1.00 0.00 H new ATOM 0 HB2 LEU A 118 12.967 -8.217 -6.924 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.345 -9.298 -6.956 1.00 0.00 H new ATOM 0 HG LEU A 118 13.842 -9.887 -4.521 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.570 -9.337 -3.699 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.514 -7.859 -4.002 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.271 -8.376 -5.166 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.936 -11.367 -5.108 1.00 0.00 H new ATOM 0 HD22 LEU A 118 11.640 -10.403 -6.575 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.146 -11.337 -6.413 1.00 0.00 H new ATOM 1870 N ALA A 119 16.967 -8.004 -5.978 1.00 0.00 N ATOM 1871 CA ALA A 119 18.267 -7.876 -6.701 1.00 0.00 C ATOM 1872 C ALA A 119 18.207 -8.675 -8.004 1.00 0.00 C ATOM 1873 O ALA A 119 18.801 -8.303 -8.997 1.00 0.00 O ATOM 1874 CB ALA A 119 19.396 -8.418 -5.822 1.00 0.00 C ATOM 0 H ALA A 119 17.000 -8.568 -5.129 1.00 0.00 H new ATOM 0 HA ALA A 119 18.455 -6.826 -6.927 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.345 -8.325 -6.350 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.440 -7.849 -4.894 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.209 -9.468 -5.595 1.00 0.00 H new ATOM 1880 N GLY A 120 17.492 -9.772 -8.003 1.00 0.00 N ATOM 1881 CA GLY A 120 17.386 -10.604 -9.238 1.00 0.00 C ATOM 1882 C GLY A 120 16.470 -9.907 -10.245 1.00 0.00 C ATOM 1883 O GLY A 120 15.448 -9.352 -9.887 1.00 0.00 O ATOM 0 H GLY A 120 16.976 -10.127 -7.198 1.00 0.00 H new ATOM 0 HA2 GLY A 120 18.374 -10.756 -9.673 1.00 0.00 H new ATOM 0 HA3 GLY A 120 16.991 -11.590 -8.992 1.00 0.00 H new ATOM 1887 N SER A 121 16.831 -9.931 -11.503 1.00 0.00 N ATOM 1888 CA SER A 121 15.988 -9.272 -12.543 1.00 0.00 C ATOM 1889 C SER A 121 14.919 -10.252 -13.030 1.00 0.00 C ATOM 1890 O SER A 121 15.162 -11.438 -13.151 1.00 0.00 O ATOM 1891 CB SER A 121 16.869 -8.852 -13.721 1.00 0.00 C ATOM 1892 OG SER A 121 17.664 -7.738 -13.339 1.00 0.00 O ATOM 0 H SER A 121 17.676 -10.381 -11.854 1.00 0.00 H new ATOM 0 HA SER A 121 15.506 -8.392 -12.117 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.507 -9.681 -14.026 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.249 -8.594 -14.580 1.00 0.00 H new ATOM 0 HG SER A 121 17.155 -6.911 -13.474 1.00 0.00 H new ATOM 1898 N PHE A 122 13.737 -9.762 -13.308 1.00 0.00 N ATOM 1899 CA PHE A 122 12.644 -10.657 -13.789 1.00 0.00 C ATOM 1900 C PHE A 122 11.729 -9.879 -14.737 1.00 0.00 C ATOM 1901 O PHE A 122 10.981 -9.014 -14.320 1.00 0.00 O ATOM 1902 CB PHE A 122 11.832 -11.157 -12.592 1.00 0.00 C ATOM 1903 CG PHE A 122 12.716 -11.990 -11.696 1.00 0.00 C ATOM 1904 CD1 PHE A 122 13.009 -13.316 -12.038 1.00 0.00 C ATOM 1905 CD2 PHE A 122 13.241 -11.438 -10.521 1.00 0.00 C ATOM 1906 CE1 PHE A 122 13.828 -14.089 -11.206 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.061 -12.211 -9.690 1.00 0.00 C ATOM 1908 CZ PHE A 122 14.354 -13.536 -10.033 1.00 0.00 C ATOM 0 H PHE A 122 13.483 -8.778 -13.222 1.00 0.00 H new ATOM 0 HA PHE A 122 13.075 -11.508 -14.317 1.00 0.00 H new ATOM 0 HB2 PHE A 122 11.426 -10.312 -12.036 1.00 0.00 H new ATOM 0 HB3 PHE A 122 10.984 -11.749 -12.936 1.00 0.00 H new ATOM 0 HD1 PHE A 122 12.603 -13.742 -12.944 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.013 -10.416 -10.256 1.00 0.00 H new ATOM 0 HE1 PHE A 122 14.054 -15.112 -11.469 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.467 -11.785 -8.785 1.00 0.00 H new ATOM 0 HZ PHE A 122 14.987 -14.132 -9.392 1.00 0.00 H new ATOM 1918 N GLU A 123 11.784 -10.183 -16.009 1.00 0.00 N ATOM 1919 CA GLU A 123 10.920 -9.468 -16.994 1.00 0.00 C ATOM 1920 C GLU A 123 9.510 -10.058 -16.960 1.00 0.00 C ATOM 1921 O GLU A 123 9.328 -11.239 -16.726 1.00 0.00 O ATOM 1922 CB GLU A 123 11.506 -9.629 -18.398 1.00 0.00 C ATOM 1923 CG GLU A 123 10.909 -8.571 -19.327 1.00 0.00 C ATOM 1924 CD GLU A 123 11.141 -8.979 -20.783 1.00 0.00 C ATOM 1925 OE1 GLU A 123 12.273 -8.894 -21.228 1.00 0.00 O ATOM 1926 OE2 GLU A 123 10.181 -9.370 -21.427 1.00 0.00 O ATOM 0 H GLU A 123 12.392 -10.898 -16.408 1.00 0.00 H new ATOM 0 HA GLU A 123 10.877 -8.410 -16.737 1.00 0.00 H new ATOM 0 HB2 GLU A 123 12.591 -9.528 -18.364 1.00 0.00 H new ATOM 0 HB3 GLU A 123 11.291 -10.627 -18.781 1.00 0.00 H new ATOM 0 HG2 GLU A 123 9.842 -8.464 -19.134 1.00 0.00 H new ATOM 0 HG3 GLU A 123 11.367 -7.601 -19.133 1.00 0.00 H new ATOM 1933 N GLY A 124 8.511 -9.244 -17.191 1.00 0.00 N ATOM 1934 CA GLY A 124 7.106 -9.749 -17.175 1.00 0.00 C ATOM 1935 C GLY A 124 6.286 -9.014 -18.235 1.00 0.00 C ATOM 1936 O GLY A 124 6.656 -8.964 -19.393 1.00 0.00 O ATOM 0 H GLY A 124 8.609 -8.249 -17.391 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.092 -10.822 -17.369 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.665 -9.597 -16.190 1.00 0.00 H new ATOM 1940 N ASP A 125 5.174 -8.443 -17.845 1.00 0.00 N ATOM 1941 CA ASP A 125 4.321 -7.706 -18.824 1.00 0.00 C ATOM 1942 C ASP A 125 3.741 -6.458 -18.157 1.00 0.00 C ATOM 1943 O ASP A 125 3.691 -5.395 -18.748 1.00 0.00 O ATOM 1944 CB ASP A 125 3.179 -8.613 -19.289 1.00 0.00 C ATOM 1945 CG ASP A 125 3.723 -9.664 -20.259 1.00 0.00 C ATOM 1946 OD1 ASP A 125 4.517 -9.299 -21.111 1.00 0.00 O ATOM 1947 OD2 ASP A 125 3.337 -10.814 -20.133 1.00 0.00 O ATOM 0 H ASP A 125 4.820 -8.456 -16.888 1.00 0.00 H new ATOM 0 HA ASP A 125 4.925 -7.412 -19.683 1.00 0.00 H new ATOM 0 HB2 ASP A 125 2.715 -9.100 -18.431 1.00 0.00 H new ATOM 0 HB3 ASP A 125 2.405 -8.020 -19.776 1.00 0.00 H new ATOM 1952 N THR A 126 3.305 -6.579 -16.929 1.00 0.00 N ATOM 1953 CA THR A 126 2.726 -5.405 -16.214 1.00 0.00 C ATOM 1954 C THR A 126 3.837 -4.669 -15.460 1.00 0.00 C ATOM 1955 O THR A 126 4.574 -5.260 -14.693 1.00 0.00 O ATOM 1956 CB THR A 126 1.667 -5.884 -15.219 1.00 0.00 C ATOM 1957 OG1 THR A 126 0.836 -6.852 -15.843 1.00 0.00 O ATOM 1958 CG2 THR A 126 0.817 -4.696 -14.764 1.00 0.00 C ATOM 0 H THR A 126 3.326 -7.445 -16.390 1.00 0.00 H new ATOM 0 HA THR A 126 2.267 -4.730 -16.937 1.00 0.00 H new ATOM 0 HB THR A 126 2.157 -6.330 -14.353 1.00 0.00 H new ATOM 0 HG1 THR A 126 0.158 -7.161 -15.206 1.00 0.00 H new ATOM 0 HG21 THR A 126 0.063 -5.038 -14.055 1.00 0.00 H new ATOM 0 HG22 THR A 126 1.456 -3.954 -14.284 1.00 0.00 H new ATOM 0 HG23 THR A 126 0.326 -4.248 -15.628 1.00 0.00 H new ATOM 1966 N LYS A 127 3.960 -3.384 -15.677 1.00 0.00 N ATOM 1967 CA LYS A 127 5.021 -2.600 -14.978 1.00 0.00 C ATOM 1968 C LYS A 127 4.387 -1.771 -13.860 1.00 0.00 C ATOM 1969 O LYS A 127 3.179 -1.699 -13.737 1.00 0.00 O ATOM 1970 CB LYS A 127 5.707 -1.668 -15.980 1.00 0.00 C ATOM 1971 CG LYS A 127 6.498 -2.499 -16.992 1.00 0.00 C ATOM 1972 CD LYS A 127 7.227 -1.566 -17.961 1.00 0.00 C ATOM 1973 CE LYS A 127 8.349 -2.333 -18.662 1.00 0.00 C ATOM 1974 NZ LYS A 127 7.760 -3.302 -19.631 1.00 0.00 N ATOM 0 H LYS A 127 3.370 -2.844 -16.310 1.00 0.00 H new ATOM 0 HA LYS A 127 5.758 -3.281 -14.552 1.00 0.00 H new ATOM 0 HB2 LYS A 127 4.963 -1.060 -16.495 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.373 -0.982 -15.457 1.00 0.00 H new ATOM 0 HG2 LYS A 127 7.216 -3.135 -16.474 1.00 0.00 H new ATOM 0 HG3 LYS A 127 5.826 -3.158 -17.542 1.00 0.00 H new ATOM 0 HD2 LYS A 127 6.527 -1.171 -18.697 1.00 0.00 H new ATOM 0 HD3 LYS A 127 7.638 -0.713 -17.421 1.00 0.00 H new ATOM 0 HE2 LYS A 127 9.009 -1.638 -19.182 1.00 0.00 H new ATOM 0 HE3 LYS A 127 8.957 -2.861 -17.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 8.523 -3.812 -20.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 7.161 -3.982 -19.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 7.184 -2.789 -20.329 1.00 0.00 H new ATOM 1988 N MET A 128 5.197 -1.143 -13.045 1.00 0.00 N ATOM 1989 CA MET A 128 4.651 -0.315 -11.929 1.00 0.00 C ATOM 1990 C MET A 128 4.485 1.131 -12.401 1.00 0.00 C ATOM 1991 O MET A 128 5.270 1.631 -13.185 1.00 0.00 O ATOM 1992 CB MET A 128 5.617 -0.357 -10.743 1.00 0.00 C ATOM 1993 CG MET A 128 4.826 -0.276 -9.437 1.00 0.00 C ATOM 1994 SD MET A 128 4.446 1.456 -9.069 1.00 0.00 S ATOM 1995 CE MET A 128 2.867 1.167 -8.231 1.00 0.00 C ATOM 0 H MET A 128 6.215 -1.169 -13.105 1.00 0.00 H new ATOM 0 HA MET A 128 3.683 -0.711 -11.623 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.202 -1.276 -10.770 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.322 0.472 -10.805 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.904 -0.852 -9.521 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.402 -0.714 -8.622 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.453 2.118 -7.896 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.170 0.691 -8.921 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.025 0.517 -7.370 1.00 0.00 H new ATOM 2005 N ILE A 129 3.467 1.805 -11.928 1.00 0.00 N ATOM 2006 CA ILE A 129 3.240 3.220 -12.342 1.00 0.00 C ATOM 2007 C ILE A 129 4.375 4.101 -11.799 1.00 0.00 C ATOM 2008 O ILE A 129 5.115 3.678 -10.933 1.00 0.00 O ATOM 2009 CB ILE A 129 1.902 3.708 -11.784 1.00 0.00 C ATOM 2010 CG1 ILE A 129 1.871 3.482 -10.270 1.00 0.00 C ATOM 2011 CG2 ILE A 129 0.761 2.928 -12.438 1.00 0.00 C ATOM 2012 CD1 ILE A 129 0.725 4.290 -9.657 1.00 0.00 C ATOM 0 H ILE A 129 2.782 1.433 -11.270 1.00 0.00 H new ATOM 0 HA ILE A 129 3.222 3.281 -13.430 1.00 0.00 H new ATOM 0 HB ILE A 129 1.784 4.770 -11.998 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.740 2.422 -10.052 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.820 3.783 -9.827 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.192 3.276 -12.040 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.784 3.086 -13.516 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.877 1.865 -12.224 1.00 0.00 H new ATOM 0 HD11 ILE A 129 0.702 4.129 -8.579 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.876 5.350 -9.863 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.221 3.967 -10.092 1.00 0.00 H new ATOM 2024 N PRO A 130 4.483 5.307 -12.319 1.00 0.00 N ATOM 2025 CA PRO A 130 5.516 6.326 -11.933 1.00 0.00 C ATOM 2026 C PRO A 130 5.093 7.037 -10.644 1.00 0.00 C ATOM 2027 O PRO A 130 4.166 7.825 -10.638 1.00 0.00 O ATOM 2028 CB PRO A 130 5.596 7.322 -13.088 1.00 0.00 C ATOM 2029 CG PRO A 130 4.400 7.074 -13.986 1.00 0.00 C ATOM 2030 CD PRO A 130 3.612 5.911 -13.391 1.00 0.00 C ATOM 0 HA PRO A 130 6.485 5.861 -11.750 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.588 8.345 -12.713 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.525 7.192 -13.643 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.777 7.966 -14.050 1.00 0.00 H new ATOM 0 HG3 PRO A 130 4.724 6.839 -15.000 1.00 0.00 H new ATOM 0 HD2 PRO A 130 2.666 6.257 -12.973 1.00 0.00 H new ATOM 0 HD3 PRO A 130 3.372 5.173 -14.157 1.00 0.00 H new ATOM 2038 N LEU A 131 5.768 6.763 -9.557 1.00 0.00 N ATOM 2039 CA LEU A 131 5.413 7.418 -8.264 1.00 0.00 C ATOM 2040 C LEU A 131 6.354 8.598 -8.015 1.00 0.00 C ATOM 2041 O LEU A 131 7.519 8.556 -8.363 1.00 0.00 O ATOM 2042 CB LEU A 131 5.552 6.407 -7.125 1.00 0.00 C ATOM 2043 CG LEU A 131 4.548 5.270 -7.325 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.888 4.115 -6.382 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.136 5.778 -7.019 1.00 0.00 C ATOM 0 H LEU A 131 6.552 6.112 -9.510 1.00 0.00 H new ATOM 0 HA LEU A 131 4.384 7.776 -8.309 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.567 6.010 -7.099 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.377 6.896 -6.167 1.00 0.00 H new ATOM 0 HG LEU A 131 4.595 4.922 -8.357 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.172 3.306 -6.525 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.893 3.753 -6.598 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.841 4.462 -5.350 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.420 4.969 -7.161 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.090 6.126 -5.987 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.892 6.601 -7.691 1.00 0.00 H new ATOM 2057 N ASN A 132 5.855 9.649 -7.413 1.00 0.00 N ATOM 2058 CA ASN A 132 6.714 10.837 -7.137 1.00 0.00 C ATOM 2059 C ASN A 132 7.446 10.637 -5.808 1.00 0.00 C ATOM 2060 O ASN A 132 6.981 11.055 -4.765 1.00 0.00 O ATOM 2061 CB ASN A 132 5.840 12.090 -7.054 1.00 0.00 C ATOM 2062 CG ASN A 132 6.716 13.335 -7.203 1.00 0.00 C ATOM 2063 OD1 ASN A 132 7.576 13.389 -8.061 1.00 0.00 O ATOM 2064 ND2 ASN A 132 6.534 14.347 -6.399 1.00 0.00 N ATOM 0 H ASN A 132 4.888 9.734 -7.101 1.00 0.00 H new ATOM 0 HA ASN A 132 7.442 10.955 -7.940 1.00 0.00 H new ATOM 0 HB2 ASN A 132 5.082 12.070 -7.837 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.312 12.116 -6.100 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.113 15.182 -6.491 1.00 0.00 H new ATOM 0 HD22 ASN A 132 5.813 14.303 -5.679 1.00 0.00 H new ATOM 2071 N TRP A 133 8.589 10.000 -5.843 1.00 0.00 N ATOM 2072 CA TRP A 133 9.362 9.766 -4.587 1.00 0.00 C ATOM 2073 C TRP A 133 9.928 11.092 -4.071 1.00 0.00 C ATOM 2074 O TRP A 133 10.319 11.203 -2.924 1.00 0.00 O ATOM 2075 CB TRP A 133 10.512 8.796 -4.870 1.00 0.00 C ATOM 2076 CG TRP A 133 9.955 7.475 -5.294 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.807 7.069 -6.576 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.473 6.381 -4.460 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.264 5.797 -6.582 1.00 0.00 N ATOM 2080 CE2 TRP A 133 9.040 5.330 -5.302 1.00 0.00 C ATOM 2081 CE3 TRP A 133 9.370 6.202 -3.068 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.523 4.143 -4.783 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.850 5.009 -2.543 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.427 3.981 -3.398 1.00 0.00 C ATOM 0 H TRP A 133 9.021 9.631 -6.690 1.00 0.00 H new ATOM 0 HA TRP A 133 8.701 9.340 -3.832 1.00 0.00 H new ATOM 0 HB2 TRP A 133 11.158 9.198 -5.651 1.00 0.00 H new ATOM 0 HB3 TRP A 133 11.127 8.674 -3.979 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.070 7.644 -7.452 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.055 5.268 -7.429 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.693 6.987 -2.400 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.199 3.355 -5.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.775 4.882 -1.473 1.00 0.00 H new ATOM 0 HH2 TRP A 133 8.028 3.066 -2.987 1.00 0.00 H new ATOM 2095 N ASP A 134 9.975 12.097 -4.910 1.00 0.00 N ATOM 2096 CA ASP A 134 10.516 13.419 -4.474 1.00 0.00 C ATOM 2097 C ASP A 134 9.638 13.989 -3.358 1.00 0.00 C ATOM 2098 O ASP A 134 10.094 14.751 -2.526 1.00 0.00 O ATOM 2099 CB ASP A 134 10.519 14.384 -5.663 1.00 0.00 C ATOM 2100 CG ASP A 134 11.887 14.351 -6.345 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.877 14.262 -5.637 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.922 14.416 -7.563 1.00 0.00 O ATOM 0 H ASP A 134 9.661 12.058 -5.880 1.00 0.00 H new ATOM 0 HA ASP A 134 11.534 13.291 -4.105 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.740 14.105 -6.373 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.294 15.395 -5.324 1.00 0.00 H new ATOM 2107 N ASP A 135 8.381 13.621 -3.335 1.00 0.00 N ATOM 2108 CA ASP A 135 7.465 14.134 -2.276 1.00 0.00 C ATOM 2109 C ASP A 135 7.432 13.147 -1.108 1.00 0.00 C ATOM 2110 O ASP A 135 6.434 13.015 -0.425 1.00 0.00 O ATOM 2111 CB ASP A 135 6.055 14.289 -2.852 1.00 0.00 C ATOM 2112 CG ASP A 135 5.252 15.261 -1.985 1.00 0.00 C ATOM 2113 OD1 ASP A 135 5.736 16.357 -1.756 1.00 0.00 O ATOM 2114 OD2 ASP A 135 4.168 14.892 -1.565 1.00 0.00 O ATOM 0 H ASP A 135 7.951 12.986 -4.007 1.00 0.00 H new ATOM 0 HA ASP A 135 7.823 15.102 -1.924 1.00 0.00 H new ATOM 0 HB2 ASP A 135 6.108 14.658 -3.876 1.00 0.00 H new ATOM 0 HB3 ASP A 135 5.557 13.320 -2.887 1.00 0.00 H new ATOM 2119 N PHE A 136 8.519 12.455 -0.876 1.00 0.00 N ATOM 2120 CA PHE A 136 8.564 11.472 0.245 1.00 0.00 C ATOM 2121 C PHE A 136 9.993 11.372 0.780 1.00 0.00 C ATOM 2122 O PHE A 136 10.934 11.801 0.139 1.00 0.00 O ATOM 2123 CB PHE A 136 8.111 10.100 -0.260 1.00 0.00 C ATOM 2124 CG PHE A 136 6.659 10.168 -0.668 1.00 0.00 C ATOM 2125 CD1 PHE A 136 5.664 10.295 0.308 1.00 0.00 C ATOM 2126 CD2 PHE A 136 6.309 10.102 -2.022 1.00 0.00 C ATOM 2127 CE1 PHE A 136 4.317 10.357 -0.072 1.00 0.00 C ATOM 2128 CE2 PHE A 136 4.963 10.165 -2.401 1.00 0.00 C ATOM 2129 CZ PHE A 136 3.967 10.293 -1.425 1.00 0.00 C ATOM 0 H PHE A 136 9.380 12.530 -1.418 1.00 0.00 H new ATOM 0 HA PHE A 136 7.900 11.803 1.044 1.00 0.00 H new ATOM 0 HB2 PHE A 136 8.724 9.792 -1.107 1.00 0.00 H new ATOM 0 HB3 PHE A 136 8.246 9.351 0.520 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.934 10.345 1.352 1.00 0.00 H new ATOM 0 HD2 PHE A 136 7.078 10.002 -2.774 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.548 10.454 0.680 1.00 0.00 H new ATOM 0 HE2 PHE A 136 4.693 10.115 -3.445 1.00 0.00 H new ATOM 0 HZ PHE A 136 2.928 10.342 -1.717 1.00 0.00 H new ATOM 2139 N THR A 137 10.160 10.810 1.950 1.00 0.00 N ATOM 2140 CA THR A 137 11.526 10.677 2.535 1.00 0.00 C ATOM 2141 C THR A 137 11.667 9.304 3.196 1.00 0.00 C ATOM 2142 O THR A 137 10.779 8.847 3.891 1.00 0.00 O ATOM 2143 CB THR A 137 11.741 11.772 3.584 1.00 0.00 C ATOM 2144 OG1 THR A 137 11.249 13.007 3.083 1.00 0.00 O ATOM 2145 CG2 THR A 137 13.233 11.901 3.891 1.00 0.00 C ATOM 0 H THR A 137 9.406 10.437 2.526 1.00 0.00 H new ATOM 0 HA THR A 137 12.270 10.778 1.745 1.00 0.00 H new ATOM 0 HB THR A 137 11.207 11.511 4.498 1.00 0.00 H new ATOM 0 HG1 THR A 137 11.384 13.709 3.753 1.00 0.00 H new ATOM 0 HG21 THR A 137 13.385 12.681 4.638 1.00 0.00 H new ATOM 0 HG22 THR A 137 13.609 10.953 4.275 1.00 0.00 H new ATOM 0 HG23 THR A 137 13.771 12.162 2.980 1.00 0.00 H new ATOM 2153 N LYS A 138 12.778 8.646 2.981 1.00 0.00 N ATOM 2154 CA LYS A 138 12.987 7.300 3.592 1.00 0.00 C ATOM 2155 C LYS A 138 13.172 7.449 5.102 1.00 0.00 C ATOM 2156 O LYS A 138 13.681 8.447 5.577 1.00 0.00 O ATOM 2157 CB LYS A 138 14.236 6.654 2.986 1.00 0.00 C ATOM 2158 CG LYS A 138 14.230 5.154 3.282 1.00 0.00 C ATOM 2159 CD LYS A 138 15.183 4.439 2.321 1.00 0.00 C ATOM 2160 CE LYS A 138 16.628 4.768 2.697 1.00 0.00 C ATOM 2161 NZ LYS A 138 16.996 4.040 3.943 1.00 0.00 N ATOM 0 H LYS A 138 13.550 8.984 2.407 1.00 0.00 H new ATOM 0 HA LYS A 138 12.119 6.671 3.393 1.00 0.00 H new ATOM 0 HB2 LYS A 138 14.260 6.823 1.909 1.00 0.00 H new ATOM 0 HB3 LYS A 138 15.133 7.114 3.400 1.00 0.00 H new ATOM 0 HG2 LYS A 138 14.535 4.975 4.313 1.00 0.00 H new ATOM 0 HG3 LYS A 138 13.221 4.755 3.174 1.00 0.00 H new ATOM 0 HD2 LYS A 138 15.021 3.362 2.365 1.00 0.00 H new ATOM 0 HD3 LYS A 138 14.983 4.750 1.296 1.00 0.00 H new ATOM 0 HE2 LYS A 138 17.299 4.485 1.886 1.00 0.00 H new ATOM 0 HE3 LYS A 138 16.741 5.842 2.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 17.340 4.718 4.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 16.161 3.544 4.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 17.744 3.349 3.733 1.00 0.00 H new ATOM 2175 N VAL A 139 12.762 6.462 5.859 1.00 0.00 N ATOM 2176 CA VAL A 139 12.910 6.537 7.342 1.00 0.00 C ATOM 2177 C VAL A 139 13.317 5.165 7.884 1.00 0.00 C ATOM 2178 O VAL A 139 14.015 5.063 8.875 1.00 0.00 O ATOM 2179 CB VAL A 139 11.579 6.959 7.967 1.00 0.00 C ATOM 2180 CG1 VAL A 139 11.247 8.391 7.543 1.00 0.00 C ATOM 2181 CG2 VAL A 139 10.470 6.017 7.490 1.00 0.00 C ATOM 0 H VAL A 139 12.330 5.606 5.511 1.00 0.00 H new ATOM 0 HA VAL A 139 13.677 7.269 7.594 1.00 0.00 H new ATOM 0 HB VAL A 139 11.657 6.910 9.053 1.00 0.00 H new ATOM 0 HG11 VAL A 139 10.299 8.692 7.988 1.00 0.00 H new ATOM 0 HG12 VAL A 139 12.036 9.063 7.881 1.00 0.00 H new ATOM 0 HG13 VAL A 139 11.170 8.440 6.457 1.00 0.00 H new ATOM 0 HG21 VAL A 139 9.521 6.317 7.935 1.00 0.00 H new ATOM 0 HG22 VAL A 139 10.393 6.066 6.404 1.00 0.00 H new ATOM 0 HG23 VAL A 139 10.705 4.996 7.791 1.00 0.00 H new ATOM 2191 N SER A 140 12.884 4.111 7.239 1.00 0.00 N ATOM 2192 CA SER A 140 13.241 2.741 7.708 1.00 0.00 C ATOM 2193 C SER A 140 13.449 1.825 6.500 1.00 0.00 C ATOM 2194 O SER A 140 12.890 2.044 5.442 1.00 0.00 O ATOM 2195 CB SER A 140 12.108 2.188 8.576 1.00 0.00 C ATOM 2196 OG SER A 140 11.611 3.225 9.412 1.00 0.00 O ATOM 0 H SER A 140 12.297 4.142 6.405 1.00 0.00 H new ATOM 0 HA SER A 140 14.160 2.786 8.293 1.00 0.00 H new ATOM 0 HB2 SER A 140 11.309 1.798 7.946 1.00 0.00 H new ATOM 0 HB3 SER A 140 12.470 1.358 9.182 1.00 0.00 H new ATOM 0 HG SER A 140 10.884 2.876 9.969 1.00 0.00 H new ATOM 2202 N SER A 141 14.251 0.801 6.652 1.00 0.00 N ATOM 2203 CA SER A 141 14.502 -0.135 5.518 1.00 0.00 C ATOM 2204 C SER A 141 14.927 -1.499 6.066 1.00 0.00 C ATOM 2205 O SER A 141 15.983 -1.639 6.653 1.00 0.00 O ATOM 2206 CB SER A 141 15.616 0.426 4.631 1.00 0.00 C ATOM 2207 OG SER A 141 16.791 0.605 5.410 1.00 0.00 O ATOM 0 H SER A 141 14.743 0.574 7.516 1.00 0.00 H new ATOM 0 HA SER A 141 13.590 -0.247 4.931 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.815 -0.254 3.803 1.00 0.00 H new ATOM 0 HB3 SER A 141 15.306 1.376 4.195 1.00 0.00 H new ATOM 0 HG SER A 141 16.810 -0.058 6.131 1.00 0.00 H new ATOM 2213 N ARG A 142 14.108 -2.502 5.879 1.00 0.00 N ATOM 2214 CA ARG A 142 14.454 -3.863 6.386 1.00 0.00 C ATOM 2215 C ARG A 142 15.198 -4.639 5.298 1.00 0.00 C ATOM 2216 O ARG A 142 14.604 -5.124 4.354 1.00 0.00 O ATOM 2217 CB ARG A 142 13.172 -4.610 6.758 1.00 0.00 C ATOM 2218 CG ARG A 142 13.518 -5.806 7.648 1.00 0.00 C ATOM 2219 CD ARG A 142 13.775 -5.323 9.076 1.00 0.00 C ATOM 2220 NE ARG A 142 13.831 -6.500 9.998 1.00 0.00 N ATOM 2221 CZ ARG A 142 14.918 -7.234 10.094 1.00 0.00 C ATOM 2222 NH1 ARG A 142 15.983 -6.958 9.385 1.00 0.00 N ATOM 2223 NH2 ARG A 142 14.934 -8.254 10.908 1.00 0.00 N ATOM 0 H ARG A 142 13.212 -2.436 5.396 1.00 0.00 H new ATOM 0 HA ARG A 142 15.090 -3.771 7.266 1.00 0.00 H new ATOM 0 HB2 ARG A 142 12.487 -3.941 7.279 1.00 0.00 H new ATOM 0 HB3 ARG A 142 12.662 -4.949 5.857 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.701 -6.528 7.639 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.400 -6.317 7.262 1.00 0.00 H new ATOM 0 HD2 ARG A 142 14.712 -4.768 9.120 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.985 -4.640 9.388 1.00 0.00 H new ATOM 0 HE ARG A 142 13.014 -6.737 10.561 1.00 0.00 H new ATOM 0 HH11 ARG A 142 15.978 -6.163 8.746 1.00 0.00 H new ATOM 0 HH12 ARG A 142 16.818 -7.538 9.472 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.108 -8.476 11.463 1.00 0.00 H new ATOM 0 HH22 ARG A 142 15.773 -8.829 10.989 1.00 0.00 H new ATOM 2237 N THR A 143 16.496 -4.759 5.425 1.00 0.00 N ATOM 2238 CA THR A 143 17.289 -5.502 4.404 1.00 0.00 C ATOM 2239 C THR A 143 17.281 -6.995 4.740 1.00 0.00 C ATOM 2240 O THR A 143 17.351 -7.380 5.891 1.00 0.00 O ATOM 2241 CB THR A 143 18.730 -4.988 4.403 1.00 0.00 C ATOM 2242 OG1 THR A 143 18.725 -3.568 4.447 1.00 0.00 O ATOM 2243 CG2 THR A 143 19.443 -5.457 3.133 1.00 0.00 C ATOM 0 H THR A 143 17.041 -4.372 6.196 1.00 0.00 H new ATOM 0 HA THR A 143 16.848 -5.348 3.419 1.00 0.00 H new ATOM 0 HB THR A 143 19.254 -5.378 5.276 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.648 -3.238 4.448 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.469 -5.089 3.135 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.448 -6.546 3.100 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.921 -5.070 2.258 1.00 0.00 H new ATOM 2251 N VAL A 144 17.194 -7.835 3.740 1.00 0.00 N ATOM 2252 CA VAL A 144 17.181 -9.307 3.991 1.00 0.00 C ATOM 2253 C VAL A 144 17.882 -10.026 2.831 1.00 0.00 C ATOM 2254 O VAL A 144 17.581 -9.795 1.675 1.00 0.00 O ATOM 2255 CB VAL A 144 15.724 -9.784 4.116 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.962 -9.486 2.821 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.695 -11.293 4.389 1.00 0.00 C ATOM 0 H VAL A 144 17.131 -7.564 2.759 1.00 0.00 H new ATOM 0 HA VAL A 144 17.710 -9.534 4.917 1.00 0.00 H new ATOM 0 HB VAL A 144 15.249 -9.255 4.942 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.931 -9.827 2.919 1.00 0.00 H new ATOM 0 HG12 VAL A 144 14.973 -8.413 2.631 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.439 -10.006 1.990 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.661 -11.627 4.477 1.00 0.00 H new ATOM 0 HG22 VAL A 144 16.178 -11.821 3.567 1.00 0.00 H new ATOM 0 HG23 VAL A 144 16.225 -11.505 5.318 1.00 0.00 H new ATOM 2267 N GLU A 145 18.810 -10.895 3.137 1.00 0.00 N ATOM 2268 CA GLU A 145 19.537 -11.635 2.064 1.00 0.00 C ATOM 2269 C GLU A 145 19.085 -13.096 2.057 1.00 0.00 C ATOM 2270 O GLU A 145 19.222 -13.799 3.041 1.00 0.00 O ATOM 2271 CB GLU A 145 21.043 -11.566 2.324 1.00 0.00 C ATOM 2272 CG GLU A 145 21.521 -10.120 2.179 1.00 0.00 C ATOM 2273 CD GLU A 145 23.012 -10.038 2.513 1.00 0.00 C ATOM 2274 OE1 GLU A 145 23.808 -10.445 1.682 1.00 0.00 O ATOM 2275 OE2 GLU A 145 23.332 -9.571 3.593 1.00 0.00 O ATOM 0 H GLU A 145 19.097 -11.125 4.089 1.00 0.00 H new ATOM 0 HA GLU A 145 19.316 -11.182 1.097 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.267 -11.936 3.325 1.00 0.00 H new ATOM 0 HB3 GLU A 145 21.574 -12.208 1.621 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.346 -9.768 1.162 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.952 -9.470 2.844 1.00 0.00 H new ATOM 2282 N ASP A 146 18.550 -13.556 0.955 1.00 0.00 N ATOM 2283 CA ASP A 146 18.087 -14.973 0.875 1.00 0.00 C ATOM 2284 C ASP A 146 19.286 -15.887 0.615 1.00 0.00 C ATOM 2285 O ASP A 146 20.426 -15.484 0.755 1.00 0.00 O ATOM 2286 CB ASP A 146 17.077 -15.115 -0.267 1.00 0.00 C ATOM 2287 CG ASP A 146 16.192 -16.337 -0.015 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.600 -16.407 1.050 1.00 0.00 O ATOM 2289 OD2 ASP A 146 16.119 -17.182 -0.893 1.00 0.00 O ATOM 0 H ASP A 146 18.414 -13.009 0.105 1.00 0.00 H new ATOM 0 HA ASP A 146 17.613 -15.255 1.815 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.464 -14.217 -0.338 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.599 -15.221 -1.218 1.00 0.00 H new ATOM 2294 N THR A 147 19.035 -17.116 0.240 1.00 0.00 N ATOM 2295 CA THR A 147 20.153 -18.067 -0.029 1.00 0.00 C ATOM 2296 C THR A 147 20.867 -17.667 -1.323 1.00 0.00 C ATOM 2297 O THR A 147 22.081 -17.683 -1.400 1.00 0.00 O ATOM 2298 CB THR A 147 19.594 -19.484 -0.174 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.486 -19.465 -1.064 1.00 0.00 O ATOM 2300 CG2 THR A 147 19.142 -19.999 1.195 1.00 0.00 C ATOM 0 H THR A 147 18.100 -17.502 0.108 1.00 0.00 H new ATOM 0 HA THR A 147 20.860 -18.037 0.800 1.00 0.00 H new ATOM 0 HB THR A 147 20.368 -20.142 -0.570 1.00 0.00 H new ATOM 0 HG1 THR A 147 18.127 -20.372 -1.159 1.00 0.00 H new ATOM 0 HG21 THR A 147 18.744 -21.008 1.091 1.00 0.00 H new ATOM 0 HG22 THR A 147 19.992 -20.013 1.877 1.00 0.00 H new ATOM 0 HG23 THR A 147 18.368 -19.343 1.593 1.00 0.00 H new ATOM 2308 N ASN A 148 20.120 -17.313 -2.339 1.00 0.00 N ATOM 2309 CA ASN A 148 20.749 -16.913 -3.633 1.00 0.00 C ATOM 2310 C ASN A 148 20.708 -15.381 -3.770 1.00 0.00 C ATOM 2311 O ASN A 148 19.707 -14.771 -3.452 1.00 0.00 O ATOM 2312 CB ASN A 148 19.973 -17.549 -4.790 1.00 0.00 C ATOM 2313 CG ASN A 148 20.849 -17.570 -6.043 1.00 0.00 C ATOM 2314 OD1 ASN A 148 21.093 -16.543 -6.646 1.00 0.00 O ATOM 2315 ND2 ASN A 148 21.336 -18.704 -6.465 1.00 0.00 N ATOM 0 H ASN A 148 19.100 -17.284 -2.327 1.00 0.00 H new ATOM 0 HA ASN A 148 21.785 -17.252 -3.657 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.673 -18.563 -4.526 1.00 0.00 H new ATOM 0 HB3 ASN A 148 19.059 -16.986 -4.982 1.00 0.00 H new ATOM 0 HD21 ASN A 148 21.921 -18.729 -7.300 1.00 0.00 H new ATOM 0 HD22 ASN A 148 21.132 -19.566 -5.960 1.00 0.00 H new ATOM 2322 N PRO A 149 21.794 -14.791 -4.239 1.00 0.00 N ATOM 2323 CA PRO A 149 21.945 -13.305 -4.444 1.00 0.00 C ATOM 2324 C PRO A 149 20.724 -12.748 -5.184 1.00 0.00 C ATOM 2325 O PRO A 149 20.205 -11.703 -4.842 1.00 0.00 O ATOM 2326 CB PRO A 149 23.209 -13.093 -5.278 1.00 0.00 C ATOM 2327 CG PRO A 149 23.889 -14.434 -5.438 1.00 0.00 C ATOM 2328 CD PRO A 149 23.081 -15.461 -4.655 1.00 0.00 C ATOM 0 HA PRO A 149 22.020 -12.787 -3.488 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.958 -12.674 -6.252 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.875 -12.383 -4.788 1.00 0.00 H new ATOM 0 HG2 PRO A 149 23.943 -14.712 -6.491 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.913 -14.390 -5.067 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.877 -16.339 -5.268 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.636 -15.804 -3.782 1.00 0.00 H new ATOM 2336 N ALA A 150 20.267 -13.441 -6.198 1.00 0.00 N ATOM 2337 CA ALA A 150 19.083 -12.959 -6.970 1.00 0.00 C ATOM 2338 C ALA A 150 17.861 -12.899 -6.050 1.00 0.00 C ATOM 2339 O ALA A 150 16.997 -12.057 -6.210 1.00 0.00 O ATOM 2340 CB ALA A 150 18.804 -13.922 -8.126 1.00 0.00 C ATOM 0 H ALA A 150 20.665 -14.322 -6.524 1.00 0.00 H new ATOM 0 HA ALA A 150 19.288 -11.964 -7.365 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.940 -13.572 -8.691 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.673 -13.964 -8.782 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.600 -14.917 -7.730 1.00 0.00 H new ATOM 2346 N LEU A 151 17.786 -13.787 -5.091 1.00 0.00 N ATOM 2347 CA LEU A 151 16.622 -13.788 -4.156 1.00 0.00 C ATOM 2348 C LEU A 151 16.832 -12.727 -3.072 1.00 0.00 C ATOM 2349 O LEU A 151 16.231 -12.781 -2.016 1.00 0.00 O ATOM 2350 CB LEU A 151 16.495 -15.166 -3.503 1.00 0.00 C ATOM 2351 CG LEU A 151 15.881 -16.148 -4.501 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.979 -17.570 -3.945 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.410 -15.789 -4.727 1.00 0.00 C ATOM 0 H LEU A 151 18.482 -14.512 -4.916 1.00 0.00 H new ATOM 0 HA LEU A 151 15.712 -13.562 -4.711 1.00 0.00 H new ATOM 0 HB2 LEU A 151 17.475 -15.521 -3.184 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.873 -15.101 -2.610 1.00 0.00 H new ATOM 0 HG LEU A 151 16.420 -16.091 -5.447 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.541 -18.270 -4.657 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.026 -17.826 -3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.440 -17.629 -3.000 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.970 -16.488 -5.438 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.872 -15.847 -3.781 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.339 -14.776 -5.123 1.00 0.00 H new ATOM 2365 N THR A 152 17.682 -11.763 -3.328 1.00 0.00 N ATOM 2366 CA THR A 152 17.935 -10.693 -2.319 1.00 0.00 C ATOM 2367 C THR A 152 16.971 -9.531 -2.556 1.00 0.00 C ATOM 2368 O THR A 152 16.671 -9.183 -3.683 1.00 0.00 O ATOM 2369 CB THR A 152 19.378 -10.196 -2.456 1.00 0.00 C ATOM 2370 OG1 THR A 152 20.267 -11.302 -2.378 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.688 -9.209 -1.329 1.00 0.00 C ATOM 0 H THR A 152 18.212 -11.673 -4.195 1.00 0.00 H new ATOM 0 HA THR A 152 17.781 -11.093 -1.317 1.00 0.00 H new ATOM 0 HB THR A 152 19.502 -9.697 -3.417 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.782 -11.367 -3.209 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.715 -8.856 -1.427 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.005 -8.361 -1.390 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.565 -9.706 -0.366 1.00 0.00 H new ATOM 2379 N HIS A 153 16.484 -8.927 -1.501 1.00 0.00 N ATOM 2380 CA HIS A 153 15.536 -7.785 -1.657 1.00 0.00 C ATOM 2381 C HIS A 153 15.545 -6.934 -0.385 1.00 0.00 C ATOM 2382 O HIS A 153 16.067 -7.336 0.637 1.00 0.00 O ATOM 2383 CB HIS A 153 14.123 -8.320 -1.904 1.00 0.00 C ATOM 2384 CG HIS A 153 13.751 -9.292 -0.818 1.00 0.00 C ATOM 2385 ND1 HIS A 153 14.361 -10.530 -0.692 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.832 -9.223 0.200 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.808 -11.151 0.366 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.869 -10.398 0.946 1.00 0.00 N ATOM 0 H HIS A 153 16.704 -9.177 -0.537 1.00 0.00 H new ATOM 0 HA HIS A 153 15.845 -7.173 -2.505 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.411 -7.495 -1.927 1.00 0.00 H new ATOM 0 HB3 HIS A 153 14.074 -8.810 -2.876 1.00 0.00 H new ATOM 0 HD2 HIS A 153 12.179 -8.384 0.393 1.00 0.00 H new ATOM 0 HE1 HIS A 153 14.089 -12.137 0.705 1.00 0.00 H new ATOM 0 HE2 HIS A 153 12.301 -10.633 1.760 1.00 0.00 H new ATOM 2396 N THR A 154 14.969 -5.760 -0.447 1.00 0.00 N ATOM 2397 CA THR A 154 14.936 -4.872 0.751 1.00 0.00 C ATOM 2398 C THR A 154 13.559 -4.213 0.858 1.00 0.00 C ATOM 2399 O THR A 154 12.967 -3.832 -0.134 1.00 0.00 O ATOM 2400 CB THR A 154 16.010 -3.789 0.615 1.00 0.00 C ATOM 2401 OG1 THR A 154 17.258 -4.399 0.311 1.00 0.00 O ATOM 2402 CG2 THR A 154 16.126 -3.012 1.927 1.00 0.00 C ATOM 0 H THR A 154 14.519 -5.379 -1.279 1.00 0.00 H new ATOM 0 HA THR A 154 15.128 -5.463 1.647 1.00 0.00 H new ATOM 0 HB THR A 154 15.735 -3.103 -0.186 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.947 -3.708 0.222 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.891 -2.242 1.827 1.00 0.00 H new ATOM 0 HG22 THR A 154 15.169 -2.545 2.159 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.401 -3.695 2.731 1.00 0.00 H new ATOM 2410 N TYR A 155 13.048 -4.080 2.056 1.00 0.00 N ATOM 2411 CA TYR A 155 11.708 -3.449 2.238 1.00 0.00 C ATOM 2412 C TYR A 155 11.884 -1.968 2.581 1.00 0.00 C ATOM 2413 O TYR A 155 12.121 -1.610 3.719 1.00 0.00 O ATOM 2414 CB TYR A 155 10.964 -4.151 3.377 1.00 0.00 C ATOM 2415 CG TYR A 155 10.618 -5.560 2.959 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.424 -5.814 2.275 1.00 0.00 C ATOM 2417 CD2 TYR A 155 11.494 -6.612 3.256 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.103 -7.121 1.889 1.00 0.00 C ATOM 2419 CE2 TYR A 155 11.173 -7.919 2.869 1.00 0.00 C ATOM 2420 CZ TYR A 155 9.979 -8.173 2.186 1.00 0.00 C ATOM 2421 OH TYR A 155 9.663 -9.462 1.804 1.00 0.00 O ATOM 0 H TYR A 155 13.503 -4.382 2.917 1.00 0.00 H new ATOM 0 HA TYR A 155 11.134 -3.543 1.316 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.583 -4.168 4.274 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.057 -3.601 3.626 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.750 -5.002 2.045 1.00 0.00 H new ATOM 0 HD2 TYR A 155 12.416 -6.415 3.783 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.181 -7.318 1.363 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.847 -8.731 3.098 1.00 0.00 H new ATOM 0 HH TYR A 155 10.473 -9.919 1.494 1.00 0.00 H new ATOM 2431 N GLU A 156 11.769 -1.107 1.602 1.00 0.00 N ATOM 2432 CA GLU A 156 11.927 0.354 1.859 1.00 0.00 C ATOM 2433 C GLU A 156 10.618 0.918 2.414 1.00 0.00 C ATOM 2434 O GLU A 156 9.543 0.563 1.970 1.00 0.00 O ATOM 2435 CB GLU A 156 12.275 1.068 0.550 1.00 0.00 C ATOM 2436 CG GLU A 156 13.710 0.726 0.148 1.00 0.00 C ATOM 2437 CD GLU A 156 14.252 1.812 -0.784 1.00 0.00 C ATOM 2438 OE1 GLU A 156 14.268 2.960 -0.374 1.00 0.00 O ATOM 2439 OE2 GLU A 156 14.641 1.475 -1.890 1.00 0.00 O ATOM 0 H GLU A 156 11.572 -1.355 0.633 1.00 0.00 H new ATOM 0 HA GLU A 156 12.727 0.511 2.583 1.00 0.00 H new ATOM 0 HB2 GLU A 156 11.584 0.765 -0.237 1.00 0.00 H new ATOM 0 HB3 GLU A 156 12.167 2.146 0.672 1.00 0.00 H new ATOM 0 HG2 GLU A 156 14.338 0.647 1.035 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.738 -0.243 -0.350 1.00 0.00 H new ATOM 2446 N VAL A 157 10.704 1.794 3.384 1.00 0.00 N ATOM 2447 CA VAL A 157 9.469 2.387 3.975 1.00 0.00 C ATOM 2448 C VAL A 157 9.550 3.913 3.901 1.00 0.00 C ATOM 2449 O VAL A 157 10.300 4.538 4.628 1.00 0.00 O ATOM 2450 CB VAL A 157 9.344 1.953 5.437 1.00 0.00 C ATOM 2451 CG1 VAL A 157 8.004 2.431 5.999 1.00 0.00 C ATOM 2452 CG2 VAL A 157 9.417 0.427 5.524 1.00 0.00 C ATOM 0 H VAL A 157 11.579 2.124 3.792 1.00 0.00 H new ATOM 0 HA VAL A 157 8.598 2.042 3.418 1.00 0.00 H new ATOM 0 HB VAL A 157 10.158 2.390 6.016 1.00 0.00 H new ATOM 0 HG11 VAL A 157 7.915 2.122 7.040 1.00 0.00 H new ATOM 0 HG12 VAL A 157 7.951 3.518 5.937 1.00 0.00 H new ATOM 0 HG13 VAL A 157 7.190 1.994 5.420 1.00 0.00 H new ATOM 0 HG21 VAL A 157 9.328 0.117 6.565 1.00 0.00 H new ATOM 0 HG22 VAL A 157 8.604 -0.010 4.945 1.00 0.00 H new ATOM 0 HG23 VAL A 157 10.372 0.085 5.124 1.00 0.00 H new ATOM 2462 N TRP A 158 8.784 4.514 3.026 1.00 0.00 N ATOM 2463 CA TRP A 158 8.809 6.001 2.897 1.00 0.00 C ATOM 2464 C TRP A 158 7.562 6.591 3.559 1.00 0.00 C ATOM 2465 O TRP A 158 6.611 5.889 3.845 1.00 0.00 O ATOM 2466 CB TRP A 158 8.829 6.383 1.415 1.00 0.00 C ATOM 2467 CG TRP A 158 10.096 5.893 0.792 1.00 0.00 C ATOM 2468 CD1 TRP A 158 10.451 4.594 0.670 1.00 0.00 C ATOM 2469 CD2 TRP A 158 11.180 6.670 0.204 1.00 0.00 C ATOM 2470 NE1 TRP A 158 11.683 4.523 0.044 1.00 0.00 N ATOM 2471 CE2 TRP A 158 12.173 5.777 -0.261 1.00 0.00 C ATOM 2472 CE3 TRP A 158 11.395 8.049 0.031 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 13.338 6.236 -0.877 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 12.568 8.514 -0.587 1.00 0.00 C ATOM 2475 CH2 TRP A 158 13.537 7.609 -1.040 1.00 0.00 C ATOM 0 H TRP A 158 8.141 4.037 2.394 1.00 0.00 H new ATOM 0 HA TRP A 158 9.700 6.394 3.386 1.00 0.00 H new ATOM 0 HB2 TRP A 158 7.969 5.949 0.905 1.00 0.00 H new ATOM 0 HB3 TRP A 158 8.752 7.465 1.306 1.00 0.00 H new ATOM 0 HD1 TRP A 158 9.868 3.749 1.006 1.00 0.00 H new ATOM 0 HE1 TRP A 158 12.169 3.651 -0.166 1.00 0.00 H new ATOM 0 HE3 TRP A 158 10.654 8.755 0.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 14.081 5.534 -1.226 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 12.724 9.575 -0.714 1.00 0.00 H new ATOM 0 HH2 TRP A 158 14.437 7.972 -1.515 1.00 0.00 H new ATOM 2486 N GLN A 159 7.563 7.877 3.803 1.00 0.00 N ATOM 2487 CA GLN A 159 6.382 8.523 4.448 1.00 0.00 C ATOM 2488 C GLN A 159 6.254 9.964 3.951 1.00 0.00 C ATOM 2489 O GLN A 159 7.240 10.641 3.723 1.00 0.00 O ATOM 2490 CB GLN A 159 6.566 8.522 5.967 1.00 0.00 C ATOM 2491 CG GLN A 159 6.280 7.122 6.516 1.00 0.00 C ATOM 2492 CD GLN A 159 6.222 7.174 8.043 1.00 0.00 C ATOM 2493 OE1 GLN A 159 7.208 6.926 8.709 1.00 0.00 O ATOM 2494 NE2 GLN A 159 5.100 7.488 8.631 1.00 0.00 N ATOM 0 H GLN A 159 8.333 8.508 3.582 1.00 0.00 H new ATOM 0 HA GLN A 159 5.479 7.968 4.191 1.00 0.00 H new ATOM 0 HB2 GLN A 159 7.582 8.823 6.221 1.00 0.00 H new ATOM 0 HB3 GLN A 159 5.895 9.248 6.426 1.00 0.00 H new ATOM 0 HG2 GLN A 159 5.336 6.750 6.118 1.00 0.00 H new ATOM 0 HG3 GLN A 159 7.057 6.428 6.195 1.00 0.00 H new ATOM 0 HE21 GLN A 159 4.272 7.696 8.072 1.00 0.00 H new ATOM 0 HE22 GLN A 159 5.051 7.525 9.649 1.00 0.00 H new ATOM 2503 N LYS A 160 5.045 10.438 3.784 1.00 0.00 N ATOM 2504 CA LYS A 160 4.841 11.835 3.303 1.00 0.00 C ATOM 2505 C LYS A 160 5.279 12.818 4.391 1.00 0.00 C ATOM 2506 O LYS A 160 4.680 12.894 5.447 1.00 0.00 O ATOM 2507 CB LYS A 160 3.360 12.053 2.985 1.00 0.00 C ATOM 2508 CG LYS A 160 3.206 13.286 2.091 1.00 0.00 C ATOM 2509 CD LYS A 160 1.730 13.684 2.023 1.00 0.00 C ATOM 2510 CE LYS A 160 1.294 14.266 3.369 1.00 0.00 C ATOM 2511 NZ LYS A 160 0.042 15.053 3.189 1.00 0.00 N ATOM 0 H LYS A 160 4.188 9.914 3.961 1.00 0.00 H new ATOM 0 HA LYS A 160 5.434 12.000 2.404 1.00 0.00 H new ATOM 0 HB2 LYS A 160 2.951 11.175 2.485 1.00 0.00 H new ATOM 0 HB3 LYS A 160 2.795 12.187 3.907 1.00 0.00 H new ATOM 0 HG2 LYS A 160 3.799 14.111 2.486 1.00 0.00 H new ATOM 0 HG3 LYS A 160 3.583 13.073 1.091 1.00 0.00 H new ATOM 0 HD2 LYS A 160 1.577 14.417 1.231 1.00 0.00 H new ATOM 0 HD3 LYS A 160 1.120 12.815 1.776 1.00 0.00 H new ATOM 0 HE2 LYS A 160 1.131 13.463 4.088 1.00 0.00 H new ATOM 0 HE3 LYS A 160 2.081 14.902 3.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -0.254 15.448 4.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 0.212 15.827 2.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -0.708 14.433 2.821 1.00 0.00 H new ATOM 2525 N LYS A 161 6.321 13.569 4.137 1.00 0.00 N ATOM 2526 CA LYS A 161 6.806 14.552 5.150 1.00 0.00 C ATOM 2527 C LYS A 161 7.384 15.776 4.438 1.00 0.00 C ATOM 2528 O LYS A 161 8.068 15.656 3.439 1.00 0.00 O ATOM 2529 CB LYS A 161 7.891 13.903 6.012 1.00 0.00 C ATOM 2530 CG LYS A 161 8.136 14.758 7.257 1.00 0.00 C ATOM 2531 CD LYS A 161 9.085 14.021 8.204 1.00 0.00 C ATOM 2532 CE LYS A 161 9.163 14.771 9.534 1.00 0.00 C ATOM 2533 NZ LYS A 161 10.123 15.904 9.412 1.00 0.00 N ATOM 0 H LYS A 161 6.857 13.543 3.270 1.00 0.00 H new ATOM 0 HA LYS A 161 5.975 14.860 5.784 1.00 0.00 H new ATOM 0 HB2 LYS A 161 7.586 12.898 6.303 1.00 0.00 H new ATOM 0 HB3 LYS A 161 8.813 13.803 5.440 1.00 0.00 H new ATOM 0 HG2 LYS A 161 8.563 15.719 6.972 1.00 0.00 H new ATOM 0 HG3 LYS A 161 7.192 14.965 7.760 1.00 0.00 H new ATOM 0 HD2 LYS A 161 8.733 13.003 8.369 1.00 0.00 H new ATOM 0 HD3 LYS A 161 10.077 13.947 7.757 1.00 0.00 H new ATOM 0 HE2 LYS A 161 8.177 15.144 9.811 1.00 0.00 H new ATOM 0 HE3 LYS A 161 9.482 14.094 10.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 10.175 16.414 10.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 11.064 15.536 9.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 9.800 16.554 8.667 1.00 0.00 H new ATOM 2547 N ALA A 162 7.113 16.951 4.946 1.00 0.00 N ATOM 2548 CA ALA A 162 7.643 18.190 4.305 1.00 0.00 C ATOM 2549 C ALA A 162 7.655 19.329 5.327 1.00 0.00 C ATOM 2550 O ALA A 162 6.975 19.203 6.333 1.00 0.00 O ATOM 2551 CB ALA A 162 6.750 18.576 3.123 1.00 0.00 C ATOM 2552 OXT ALA A 162 8.343 20.307 5.088 1.00 0.00 O ATOM 0 H ALA A 162 6.546 17.105 5.780 1.00 0.00 H new ATOM 0 HA ALA A 162 8.658 18.009 3.950 1.00 0.00 H new ATOM 0 HB1 ALA A 162 7.137 19.481 2.655 1.00 0.00 H new ATOM 0 HB2 ALA A 162 6.741 17.766 2.394 1.00 0.00 H new ATOM 0 HB3 ALA A 162 5.735 18.757 3.477 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 N1 TMQ A 170 3.618 -8.732 -2.031 1.00 0.00 N HETATM 2560 C2 TMQ A 170 3.440 -7.682 -1.216 1.00 0.00 C HETATM 2561 N3 TMQ A 170 2.306 -6.940 -1.233 1.00 0.00 N HETATM 2562 C4 TMQ A 170 1.285 -7.237 -2.094 1.00 0.00 C HETATM 2563 C3A TMQ A 170 2.659 -9.120 -2.935 1.00 0.00 C HETATM 2564 C4A TMQ A 170 1.396 -8.368 -3.018 1.00 0.00 C HETATM 2565 C5 TMQ A 170 0.397 -8.823 -4.004 1.00 0.00 C HETATM 2566 C6 TMQ A 170 0.695 -9.971 -4.835 1.00 0.00 C HETATM 2567 C7 TMQ A 170 1.919 -10.649 -4.708 1.00 0.00 C HETATM 2568 C8 TMQ A 170 2.880 -10.240 -3.785 1.00 0.00 C HETATM 2569 C9 TMQ A 170 -0.310 -10.469 -5.863 1.00 0.00 C HETATM 2570 N10 TMQ A 170 0.015 -11.791 -6.409 1.00 0.00 N HETATM 2571 C11 TMQ A 170 -0.049 -12.923 -5.627 1.00 0.00 C HETATM 2572 C12 TMQ A 170 -0.822 -12.947 -4.431 1.00 0.00 C HETATM 2573 C13 TMQ A 170 -0.880 -14.141 -3.626 1.00 0.00 C HETATM 2574 C14 TMQ A 170 -0.159 -15.291 -4.038 1.00 0.00 C HETATM 2575 C15 TMQ A 170 0.614 -15.277 -5.227 1.00 0.00 C HETATM 2576 C16 TMQ A 170 0.664 -14.076 -6.024 1.00 0.00 C HETATM 2577 C17 TMQ A 170 -0.943 -8.135 -4.193 1.00 0.00 C HETATM 2578 O18 TMQ A 170 -1.639 -14.215 -2.419 1.00 0.00 O HETATM 2579 O19 TMQ A 170 -0.211 -16.438 -3.272 1.00 0.00 O HETATM 2580 O20 TMQ A 170 1.318 -16.466 -5.589 1.00 0.00 O HETATM 2581 C21 TMQ A 170 -1.890 -12.927 -1.858 1.00 0.00 C HETATM 2582 C22 TMQ A 170 0.953 -16.487 -2.482 1.00 0.00 C HETATM 2583 C23 TMQ A 170 2.411 -16.201 -6.470 1.00 0.00 C HETATM 2584 N24 TMQ A 170 4.427 -7.353 -0.348 1.00 0.00 N HETATM 2585 N25 TMQ A 170 0.201 -6.411 -2.007 1.00 0.00 N HETATM 0 HN52 TMQ A 170 -0.605 -6.562 -2.613 1.00 0.00 H new HETATM 0 HN51 TMQ A 170 0.197 -5.643 -1.336 1.00 0.00 H new HETATM 0 HN22 TMQ A 170 4.310 -6.558 0.280 1.00 0.00 H new HETATM 0 HN21 TMQ A 170 5.287 -7.901 -0.322 1.00 0.00 H new HETATM 0 H233 TMQ A 170 2.038 -15.738 -7.384 1.00 0.00 H new HETATM 0 H232 TMQ A 170 3.115 -15.527 -5.983 1.00 0.00 H new HETATM 0 H231 TMQ A 170 2.915 -17.136 -6.716 1.00 0.00 H new HETATM 0 H223 TMQ A 170 1.831 -16.506 -3.128 1.00 0.00 H new HETATM 0 H222 TMQ A 170 0.994 -15.607 -1.840 1.00 0.00 H new HETATM 0 H221 TMQ A 170 0.937 -17.386 -1.866 1.00 0.00 H new HETATM 0 H213 TMQ A 170 -0.943 -12.438 -1.632 1.00 0.00 H new HETATM 0 H212 TMQ A 170 -2.449 -12.322 -2.572 1.00 0.00 H new HETATM 0 H211 TMQ A 170 -2.470 -13.036 -0.942 1.00 0.00 H new HETATM 0 H173 TMQ A 170 -1.503 -8.167 -3.259 1.00 0.00 H new HETATM 0 H172 TMQ A 170 -0.781 -7.097 -4.484 1.00 0.00 H new HETATM 0 H171 TMQ A 170 -1.508 -8.646 -4.972 1.00 0.00 H new HETATM 0 HN1 TMQ A 170 0.294 -11.874 -7.387 1.00 0.00 H new HETATM 0 HN TMQ A 170 4.491 -9.258 -1.978 1.00 0.00 H new HETATM 0 H92 TMQ A 170 -1.298 -10.508 -5.404 1.00 0.00 H new HETATM 0 H91 TMQ A 170 -0.366 -9.751 -6.681 1.00 0.00 H new HETATM 0 H8 TMQ A 170 3.819 -10.789 -3.713 1.00 0.00 H new HETATM 0 H7 TMQ A 170 2.121 -11.511 -5.343 1.00 0.00 H new HETATM 0 H16 TMQ A 170 1.256 -14.058 -6.939 1.00 0.00 H new HETATM 0 H12 TMQ A 170 -1.372 -12.058 -4.123 1.00 0.00 H new