USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1045 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 CYS SG : rot 108:sc= -4.71! USER MOD Set 1.2: A 127 CYS SG : rot 42:sc= -8.39! USER MOD Set 2.1: A 83 THR OG1 : rot -162:sc= 1.11 USER MOD Set 2.2: A 85 THR OG1 : rot 76:sc= 1.25 USER MOD Set 2.3: A 96 GLN : amide:sc= 0.412 K(o=3.7,f=-4.2!) USER MOD Set 2.4: A 98 GLN : amide:sc= 0.972 K(o=3.7,f=0.69) USER MOD Set 3.1: A 22 TYR OH : rot 33:sc= 1.02 USER MOD Set 3.2: A 105 SER OG : rot 29:sc= 1.16 USER MOD Set 4.1: A 17 LYS NZ :NH3+ 163:sc= 0.428 (180deg=-0.0358) USER MOD Set 4.2: A 128 THR OG1 : rot -150:sc= 0.65 USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 16 SER OG : rot 43:sc= 0.59 USER MOD Single : A 23 MET CE :methyl -127:sc= -0.121 (180deg=-3.93!) USER MOD Single : A 24 LYS NZ :NH3+ -159:sc= 1.17 (180deg=0.497) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl -171:sc= 0 (180deg=-0.0721) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ -162:sc= 0.921 (180deg=0.708) USER MOD Single : A 43 CYS SG : rot 170:sc= 0 USER MOD Single : A 46 THR OG1 : rot -43:sc= 1.12 USER MOD Single : A 47 CYS SG : rot -52:sc= 0.824 USER MOD Single : A 50 LYS NZ :NH3+ 157:sc= 1.1 (180deg=1.07) USER MOD Single : A 51 ASN : amide:sc= 0.0998 X(o=0.1,f=-0.044) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -152:sc= 1.12 (180deg=0.993) USER MOD Single : A 56 THR OG1 : rot 90:sc= 1.25 USER MOD Single : A 58 SER OG : rot -130:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 175:sc= 0.865 (180deg=0.85) USER MOD Single : A 62 THR OG1 : rot 44:sc= 0.573 USER MOD Single : A 63 THR OG1 : rot -160:sc= 0 USER MOD Single : A 64 GLN : amide:sc=-0.00302 X(o=-0.003,f=-0.003) USER MOD Single : A 66 SER OG : rot 31:sc= 0.171 USER MOD Single : A 67 CYS SG : rot -40:sc= -1.52 USER MOD Single : A 68 THR OG1 : rot -164:sc= 1.12 USER MOD Single : A 72 LYS NZ :NH3+ 156:sc= 1.17 (180deg=0.988) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot -93:sc= 1.14 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0.418 K(o=0.42,f=-0.4) USER MOD Single : A 87 CYS SG : rot -160:sc= -1.5 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 HIS : no HD1:sc= 0.701 K(o=0.7,f=-4.1!) USER MOD Single : A 103 LYS NZ :NH3+ 162:sc= 1.13 (180deg=1) USER MOD Single : A 106 THR OG1 : rot 17:sc= 0.167 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 170:sc= 1.11 (180deg=0.91) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -161:sc= 1.43 (180deg=1.19) USER MOD Single : A 122 MET CE :methyl 175:sc= 0 (180deg=-0.0242) USER MOD Single : A 123 ASN : amide:sc= -0.0314 X(o=-0.031,f=-0.34) USER MOD Single : A 124 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 126 THR OG1 : rot 37:sc= 0.683 USER MOD Single : A 131 TYR OH : rot 150:sc= 0.811 USER MOD Single : A 133 LYS NZ :NH3+ 146:sc= 0.954 (180deg=-0.203!) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 0.308 -1.895 -2.752 1.00 0.00 N ATOM 15 CA VAL A 4 1.469 -1.928 -3.701 1.00 0.00 C ATOM 16 C VAL A 4 2.714 -2.740 -3.175 1.00 0.00 C ATOM 17 O VAL A 4 3.398 -3.395 -3.964 1.00 0.00 O ATOM 18 CB VAL A 4 1.765 -0.476 -4.214 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.479 0.453 -3.203 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.556 -0.467 -5.540 1.00 0.00 C ATOM 0 HA VAL A 4 1.190 -2.519 -4.573 1.00 0.00 H new ATOM 0 HB VAL A 4 0.766 -0.069 -4.369 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.636 1.432 -3.656 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.863 0.561 -2.310 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.442 0.021 -2.929 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.734 0.563 -5.850 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.511 -0.973 -5.398 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.982 -0.984 -6.309 1.00 0.00 H new ATOM 30 N GLN A 5 2.945 -2.769 -1.845 1.00 0.00 N ATOM 31 CA GLN A 5 3.815 -3.779 -1.182 1.00 0.00 C ATOM 32 C GLN A 5 3.354 -5.278 -1.299 1.00 0.00 C ATOM 33 O GLN A 5 4.210 -6.157 -1.404 1.00 0.00 O ATOM 34 CB GLN A 5 3.975 -3.348 0.301 1.00 0.00 C ATOM 35 CG GLN A 5 4.908 -2.129 0.539 1.00 0.00 C ATOM 36 CD GLN A 5 5.167 -1.803 2.013 1.00 0.00 C ATOM 37 OE1 GLN A 5 6.221 -2.085 2.571 1.00 0.00 O ATOM 38 NE2 GLN A 5 4.222 -1.202 2.693 1.00 0.00 N ATOM 0 H GLN A 5 2.537 -2.096 -1.196 1.00 0.00 H new ATOM 0 HA GLN A 5 4.765 -3.782 -1.716 1.00 0.00 H new ATOM 0 HB2 GLN A 5 2.989 -3.115 0.703 1.00 0.00 H new ATOM 0 HB3 GLN A 5 4.359 -4.195 0.869 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.863 -2.318 0.049 1.00 0.00 H new ATOM 0 HG3 GLN A 5 4.471 -1.254 0.058 1.00 0.00 H new ATOM 0 HE21 GLN A 5 3.341 -0.962 2.239 1.00 0.00 H new ATOM 0 HE22 GLN A 5 4.368 -0.974 3.676 1.00 0.00 H new ATOM 47 N GLN A 6 2.042 -5.596 -1.313 1.00 0.00 N ATOM 48 CA GLN A 6 1.540 -6.952 -1.689 1.00 0.00 C ATOM 49 C GLN A 6 1.767 -7.389 -3.187 1.00 0.00 C ATOM 50 O GLN A 6 1.915 -8.586 -3.453 1.00 0.00 O ATOM 51 CB GLN A 6 0.049 -6.994 -1.259 1.00 0.00 C ATOM 52 CG GLN A 6 -0.538 -8.418 -1.131 1.00 0.00 C ATOM 53 CD GLN A 6 -2.047 -8.455 -0.880 1.00 0.00 C ATOM 54 OE1 GLN A 6 -2.856 -8.560 -1.794 1.00 0.00 O ATOM 55 NE2 GLN A 6 -2.481 -8.373 0.355 1.00 0.00 N ATOM 0 H GLN A 6 1.303 -4.936 -1.069 1.00 0.00 H new ATOM 0 HA GLN A 6 2.136 -7.700 -1.167 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.055 -6.484 -0.301 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.542 -6.434 -1.984 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -0.319 -8.972 -2.044 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -0.033 -8.935 -0.315 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -1.817 -8.285 1.124 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -3.483 -8.397 0.546 1.00 0.00 H new ATOM 64 N LEU A 7 1.853 -6.444 -4.147 1.00 0.00 N ATOM 65 CA LEU A 7 2.376 -6.716 -5.520 1.00 0.00 C ATOM 66 C LEU A 7 3.924 -7.002 -5.663 1.00 0.00 C ATOM 67 O LEU A 7 4.366 -7.291 -6.778 1.00 0.00 O ATOM 68 CB LEU A 7 1.979 -5.533 -6.460 1.00 0.00 C ATOM 69 CG LEU A 7 0.496 -5.078 -6.576 1.00 0.00 C ATOM 70 CD1 LEU A 7 0.381 -3.964 -7.628 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.476 -6.210 -6.941 1.00 0.00 C ATOM 0 H LEU A 7 1.567 -5.476 -4.003 1.00 0.00 H new ATOM 0 HA LEU A 7 1.909 -7.660 -5.802 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.558 -4.665 -6.146 1.00 0.00 H new ATOM 0 HB3 LEU A 7 2.315 -5.794 -7.464 1.00 0.00 H new ATOM 0 HG LEU A 7 0.209 -4.723 -5.586 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.658 -3.646 -7.709 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.998 -3.116 -7.329 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.722 -4.339 -8.593 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.489 -5.814 -7.003 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.193 -6.636 -7.904 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.436 -6.985 -6.176 1.00 0.00 H new ATOM 83 N GLU A 8 4.742 -6.952 -4.593 1.00 0.00 N ATOM 84 CA GLU A 8 6.214 -7.187 -4.654 1.00 0.00 C ATOM 85 C GLU A 8 6.623 -8.659 -4.978 1.00 0.00 C ATOM 86 O GLU A 8 6.073 -9.613 -4.418 1.00 0.00 O ATOM 87 CB GLU A 8 6.830 -6.782 -3.283 1.00 0.00 C ATOM 88 CG GLU A 8 6.967 -5.260 -3.025 1.00 0.00 C ATOM 89 CD GLU A 8 8.049 -4.533 -3.814 1.00 0.00 C ATOM 90 OE1 GLU A 8 9.107 -5.122 -4.136 1.00 0.00 O ATOM 91 OE2 GLU A 8 7.839 -3.345 -4.126 1.00 0.00 O ATOM 0 H GLU A 8 4.406 -6.747 -3.652 1.00 0.00 H new ATOM 0 HA GLU A 8 6.593 -6.582 -5.477 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.217 -7.211 -2.490 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.818 -7.235 -3.203 1.00 0.00 H new ATOM 0 HG2 GLU A 8 6.009 -4.789 -3.245 1.00 0.00 H new ATOM 0 HG3 GLU A 8 7.160 -5.110 -1.963 1.00 0.00 H new ATOM 98 N GLY A 9 7.643 -8.824 -5.835 1.00 0.00 N ATOM 99 CA GLY A 9 8.301 -10.138 -6.058 1.00 0.00 C ATOM 100 C GLY A 9 8.554 -10.521 -7.530 1.00 0.00 C ATOM 101 O GLY A 9 8.241 -9.786 -8.470 1.00 0.00 O ATOM 0 H GLY A 9 8.037 -8.065 -6.391 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.256 -10.138 -5.533 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.686 -10.913 -5.601 1.00 0.00 H new ATOM 105 N ARG A 10 9.122 -11.722 -7.706 1.00 0.00 N ATOM 106 CA ARG A 10 9.235 -12.381 -9.037 1.00 0.00 C ATOM 107 C ARG A 10 7.966 -13.257 -9.306 1.00 0.00 C ATOM 108 O ARG A 10 7.590 -14.102 -8.491 1.00 0.00 O ATOM 109 CB ARG A 10 10.587 -13.144 -9.062 1.00 0.00 C ATOM 110 CG ARG A 10 10.911 -13.858 -10.398 1.00 0.00 C ATOM 111 CD ARG A 10 12.290 -14.548 -10.428 1.00 0.00 C ATOM 112 NE ARG A 10 13.383 -13.655 -10.914 1.00 0.00 N ATOM 113 CZ ARG A 10 14.472 -13.319 -10.232 1.00 0.00 C ATOM 114 NH1 ARG A 10 14.600 -13.472 -8.939 1.00 0.00 N ATOM 115 NH2 ARG A 10 15.458 -12.804 -10.902 1.00 0.00 N ATOM 0 H ARG A 10 9.517 -12.270 -6.942 1.00 0.00 H new ATOM 0 HA ARG A 10 9.253 -11.669 -9.862 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.389 -12.440 -8.840 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.584 -13.885 -8.263 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.140 -14.603 -10.595 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.864 -13.129 -11.207 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.535 -14.900 -9.426 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.235 -15.427 -11.070 1.00 0.00 H new ATOM 0 HE ARG A 10 13.285 -13.269 -11.853 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.835 -13.870 -8.394 1.00 0.00 H new ATOM 0 HH12 ARG A 10 15.465 -13.193 -8.476 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.376 -12.673 -11.910 1.00 0.00 H new ATOM 0 HH22 ARG A 10 16.314 -12.531 -10.420 1.00 0.00 H new ATOM 129 N TRP A 11 7.292 -13.025 -10.440 1.00 0.00 N ATOM 130 CA TRP A 11 5.940 -13.588 -10.712 1.00 0.00 C ATOM 131 C TRP A 11 5.986 -14.456 -12.003 1.00 0.00 C ATOM 132 O TRP A 11 6.119 -13.910 -13.101 1.00 0.00 O ATOM 133 CB TRP A 11 4.937 -12.407 -10.858 1.00 0.00 C ATOM 134 CG TRP A 11 4.669 -11.589 -9.592 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.187 -10.310 -9.309 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.850 -11.906 -8.528 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.707 -9.818 -8.082 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.883 -10.823 -7.616 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.027 -13.032 -8.277 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.094 -10.856 -6.446 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.246 -13.034 -7.123 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.284 -11.971 -6.214 1.00 0.00 C ATOM 0 H TRP A 11 7.656 -12.447 -11.198 1.00 0.00 H new ATOM 0 HA TRP A 11 5.616 -14.229 -9.892 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.311 -11.733 -11.629 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.988 -12.806 -11.216 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.868 -9.774 -9.954 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.919 -8.924 -7.638 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.006 -13.867 -8.962 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 3.116 -10.036 -5.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.597 -13.875 -6.926 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.679 -12.013 -5.320 1.00 0.00 H new ATOM 153 N ARG A 12 5.871 -15.791 -11.911 1.00 0.00 N ATOM 154 CA ARG A 12 5.991 -16.685 -13.094 1.00 0.00 C ATOM 155 C ARG A 12 4.627 -16.980 -13.780 1.00 0.00 C ATOM 156 O ARG A 12 3.703 -17.483 -13.137 1.00 0.00 O ATOM 157 CB ARG A 12 6.688 -17.980 -12.644 1.00 0.00 C ATOM 158 CG ARG A 12 7.079 -18.930 -13.807 1.00 0.00 C ATOM 159 CD ARG A 12 7.752 -20.223 -13.330 1.00 0.00 C ATOM 160 NE ARG A 12 9.078 -19.898 -12.741 1.00 0.00 N ATOM 161 CZ ARG A 12 9.445 -20.108 -11.480 1.00 0.00 C ATOM 162 NH1 ARG A 12 8.736 -20.766 -10.590 1.00 0.00 N ATOM 163 NH2 ARG A 12 10.566 -19.581 -11.097 1.00 0.00 N ATOM 0 H ARG A 12 5.695 -16.283 -11.035 1.00 0.00 H new ATOM 0 HA ARG A 12 6.585 -16.178 -13.855 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.587 -17.720 -12.085 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.030 -18.514 -11.959 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.185 -19.182 -14.378 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.753 -18.406 -14.485 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.125 -20.722 -12.591 1.00 0.00 H new ATOM 0 HD3 ARG A 12 7.871 -20.914 -14.165 1.00 0.00 H new ATOM 0 HE ARG A 12 9.769 -19.475 -13.361 1.00 0.00 H new ATOM 0 HH11 ARG A 12 7.831 -21.160 -10.849 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.091 -20.883 -9.641 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.123 -19.034 -11.753 1.00 0.00 H new ATOM 0 HH22 ARG A 12 10.891 -19.713 -10.139 1.00 0.00 H new ATOM 177 N LEU A 13 4.534 -16.759 -15.104 1.00 0.00 N ATOM 178 CA LEU A 13 3.300 -17.063 -15.885 1.00 0.00 C ATOM 179 C LEU A 13 2.937 -18.585 -15.896 1.00 0.00 C ATOM 180 O LEU A 13 3.749 -19.426 -16.289 1.00 0.00 O ATOM 181 CB LEU A 13 3.489 -16.518 -17.330 1.00 0.00 C ATOM 182 CG LEU A 13 2.239 -16.573 -18.257 1.00 0.00 C ATOM 183 CD1 LEU A 13 1.173 -15.543 -17.851 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.632 -16.361 -19.729 1.00 0.00 C ATOM 0 H LEU A 13 5.293 -16.371 -15.664 1.00 0.00 H new ATOM 0 HA LEU A 13 2.457 -16.571 -15.400 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.821 -15.482 -17.264 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.293 -17.080 -17.805 1.00 0.00 H new ATOM 0 HG LEU A 13 1.809 -17.568 -18.142 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.320 -15.618 -18.525 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.847 -15.740 -16.830 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.595 -14.540 -17.910 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.740 -16.404 -20.354 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.107 -15.387 -19.842 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.328 -17.142 -20.036 1.00 0.00 H new ATOM 196 N VAL A 14 1.698 -18.919 -15.512 1.00 0.00 N ATOM 197 CA VAL A 14 1.157 -20.309 -15.592 1.00 0.00 C ATOM 198 C VAL A 14 0.052 -20.367 -16.698 1.00 0.00 C ATOM 199 O VAL A 14 0.325 -20.892 -17.785 1.00 0.00 O ATOM 200 CB VAL A 14 0.817 -20.923 -14.183 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.095 -21.290 -13.393 1.00 0.00 C ATOM 202 CG2 VAL A 14 -0.083 -20.080 -13.247 1.00 0.00 C ATOM 0 H VAL A 14 1.032 -18.244 -15.136 1.00 0.00 H new ATOM 0 HA VAL A 14 1.929 -21.003 -15.925 1.00 0.00 H new ATOM 0 HB VAL A 14 0.236 -21.802 -14.461 1.00 0.00 H new ATOM 0 HG11 VAL A 14 1.817 -21.710 -12.427 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.672 -22.024 -13.955 1.00 0.00 H new ATOM 0 HG13 VAL A 14 2.698 -20.395 -13.239 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -0.239 -20.617 -12.311 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.400 -19.125 -13.041 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -1.045 -19.904 -13.729 1.00 0.00 H new ATOM 212 N ASP A 15 -1.139 -19.783 -16.465 1.00 0.00 N ATOM 213 CA ASP A 15 -2.209 -19.651 -17.495 1.00 0.00 C ATOM 214 C ASP A 15 -2.033 -18.350 -18.354 1.00 0.00 C ATOM 215 O ASP A 15 -1.674 -17.279 -17.851 1.00 0.00 O ATOM 216 CB ASP A 15 -3.578 -19.718 -16.754 1.00 0.00 C ATOM 217 CG ASP A 15 -4.852 -19.502 -17.583 1.00 0.00 C ATOM 218 OD1 ASP A 15 -4.892 -19.938 -18.753 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.803 -18.866 -17.078 1.00 0.00 O ATOM 0 H ASP A 15 -1.395 -19.387 -15.561 1.00 0.00 H new ATOM 0 HA ASP A 15 -2.152 -20.465 -18.217 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -3.652 -20.694 -16.275 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.565 -18.972 -15.959 1.00 0.00 H new ATOM 224 N SER A 16 -2.358 -18.460 -19.653 1.00 0.00 N ATOM 225 CA SER A 16 -2.618 -17.274 -20.519 1.00 0.00 C ATOM 226 C SER A 16 -3.835 -17.521 -21.473 1.00 0.00 C ATOM 227 O SER A 16 -3.686 -17.564 -22.701 1.00 0.00 O ATOM 228 CB SER A 16 -1.316 -16.851 -21.247 1.00 0.00 C ATOM 229 OG SER A 16 -0.963 -17.765 -22.286 1.00 0.00 O ATOM 0 H SER A 16 -2.450 -19.354 -20.136 1.00 0.00 H new ATOM 0 HA SER A 16 -2.913 -16.427 -19.899 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.444 -15.854 -21.669 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.501 -16.789 -20.526 1.00 0.00 H new ATOM 0 HG SER A 16 -1.766 -18.016 -22.788 1.00 0.00 H new ATOM 235 N LYS A 17 -5.044 -17.672 -20.901 1.00 0.00 N ATOM 236 CA LYS A 17 -6.286 -17.972 -21.666 1.00 0.00 C ATOM 237 C LYS A 17 -6.809 -16.759 -22.503 1.00 0.00 C ATOM 238 O LYS A 17 -6.941 -15.646 -21.984 1.00 0.00 O ATOM 239 CB LYS A 17 -7.359 -18.561 -20.705 1.00 0.00 C ATOM 240 CG LYS A 17 -7.863 -17.664 -19.545 1.00 0.00 C ATOM 241 CD LYS A 17 -8.929 -18.377 -18.684 1.00 0.00 C ATOM 242 CE LYS A 17 -9.362 -17.630 -17.407 1.00 0.00 C ATOM 243 NZ LYS A 17 -10.163 -16.410 -17.717 1.00 0.00 N ATOM 0 H LYS A 17 -5.196 -17.591 -19.896 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.047 -18.726 -22.416 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.223 -18.850 -21.304 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.953 -19.474 -20.270 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -7.020 -17.378 -18.915 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.282 -16.745 -19.953 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.812 -18.549 -19.300 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -8.544 -19.356 -18.398 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.949 -18.299 -16.777 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.478 -17.348 -16.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -10.670 -16.102 -16.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.529 -15.650 -18.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -10.849 -16.627 -18.468 1.00 0.00 H new ATOM 257 N GLY A 18 -7.058 -16.973 -23.809 1.00 0.00 N ATOM 258 CA GLY A 18 -7.341 -15.856 -24.761 1.00 0.00 C ATOM 259 C GLY A 18 -6.159 -15.018 -25.323 1.00 0.00 C ATOM 260 O GLY A 18 -6.414 -14.064 -26.061 1.00 0.00 O ATOM 0 H GLY A 18 -7.071 -17.899 -24.237 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -7.877 -16.278 -25.611 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.024 -15.167 -24.264 1.00 0.00 H new ATOM 264 N PHE A 19 -4.892 -15.327 -24.986 1.00 0.00 N ATOM 265 CA PHE A 19 -3.736 -14.440 -25.292 1.00 0.00 C ATOM 266 C PHE A 19 -3.338 -14.316 -26.802 1.00 0.00 C ATOM 267 O PHE A 19 -3.191 -13.181 -27.260 1.00 0.00 O ATOM 268 CB PHE A 19 -2.568 -14.819 -24.335 1.00 0.00 C ATOM 269 CG PHE A 19 -1.335 -13.893 -24.387 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.451 -12.529 -24.091 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.103 -14.398 -24.815 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.363 -11.677 -24.267 1.00 0.00 C ATOM 273 CE2 PHE A 19 0.988 -13.547 -24.975 1.00 0.00 C ATOM 274 CZ PHE A 19 0.854 -12.185 -24.715 1.00 0.00 C ATOM 0 H PHE A 19 -4.635 -16.186 -24.500 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.044 -13.413 -25.098 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.948 -14.830 -23.314 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.247 -15.835 -24.567 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.388 -12.136 -23.725 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.003 -15.453 -25.022 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.463 -10.623 -24.056 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.938 -13.943 -25.301 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.694 -11.523 -24.861 1.00 0.00 H new ATOM 284 N ASP A 20 -3.189 -15.421 -27.563 1.00 0.00 N ATOM 285 CA ASP A 20 -2.922 -15.381 -29.040 1.00 0.00 C ATOM 286 C ASP A 20 -3.961 -14.569 -29.903 1.00 0.00 C ATOM 287 O ASP A 20 -3.553 -13.745 -30.729 1.00 0.00 O ATOM 288 CB ASP A 20 -2.701 -16.840 -29.523 1.00 0.00 C ATOM 289 CG ASP A 20 -1.798 -16.939 -30.751 1.00 0.00 C ATOM 290 OD1 ASP A 20 -2.266 -16.656 -31.874 1.00 0.00 O ATOM 291 OD2 ASP A 20 -0.605 -17.271 -30.595 1.00 0.00 O ATOM 0 H ASP A 20 -3.248 -16.367 -27.186 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.018 -14.794 -29.203 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.264 -17.422 -28.711 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.667 -17.289 -29.754 1.00 0.00 H new ATOM 296 N GLU A 21 -5.281 -14.709 -29.654 1.00 0.00 N ATOM 297 CA GLU A 21 -6.307 -13.763 -30.174 1.00 0.00 C ATOM 298 C GLU A 21 -6.242 -12.280 -29.657 1.00 0.00 C ATOM 299 O GLU A 21 -6.502 -11.369 -30.445 1.00 0.00 O ATOM 300 CB GLU A 21 -7.701 -14.415 -29.994 1.00 0.00 C ATOM 301 CG GLU A 21 -7.999 -15.552 -31.004 1.00 0.00 C ATOM 302 CD GLU A 21 -8.283 -15.087 -32.430 1.00 0.00 C ATOM 303 OE1 GLU A 21 -9.389 -14.570 -32.701 1.00 0.00 O ATOM 304 OE2 GLU A 21 -7.388 -15.190 -33.301 1.00 0.00 O ATOM 0 H GLU A 21 -5.668 -15.469 -29.095 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.082 -13.613 -31.230 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.777 -14.813 -28.982 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.466 -13.645 -30.093 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.149 -16.234 -31.022 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.857 -16.121 -30.645 1.00 0.00 H new ATOM 311 N TYR A 22 -5.879 -12.004 -28.384 1.00 0.00 N ATOM 312 CA TYR A 22 -5.589 -10.615 -27.901 1.00 0.00 C ATOM 313 C TYR A 22 -4.393 -9.908 -28.632 1.00 0.00 C ATOM 314 O TYR A 22 -4.549 -8.776 -29.089 1.00 0.00 O ATOM 315 CB TYR A 22 -5.475 -10.649 -26.345 1.00 0.00 C ATOM 316 CG TYR A 22 -4.900 -9.386 -25.669 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.673 -8.236 -25.488 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.549 -9.374 -25.295 1.00 0.00 C ATOM 319 CE1 TYR A 22 -5.095 -7.080 -24.960 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.981 -8.223 -24.757 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.748 -7.075 -24.606 1.00 0.00 C ATOM 322 OH TYR A 22 -3.158 -5.922 -24.164 1.00 0.00 O ATOM 0 H TYR A 22 -5.777 -12.719 -27.664 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.423 -9.968 -28.173 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.467 -10.834 -25.934 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.851 -11.499 -26.067 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.719 -8.241 -25.757 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.947 -10.261 -25.425 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.692 -6.190 -24.826 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.944 -8.222 -24.457 1.00 0.00 H new ATOM 0 HH TYR A 22 -3.814 -5.388 -23.669 1.00 0.00 H new ATOM 332 N MET A 23 -3.220 -10.548 -28.740 1.00 0.00 N ATOM 333 CA MET A 23 -2.105 -10.069 -29.609 1.00 0.00 C ATOM 334 C MET A 23 -2.405 -9.991 -31.149 1.00 0.00 C ATOM 335 O MET A 23 -2.027 -9.010 -31.789 1.00 0.00 O ATOM 336 CB MET A 23 -0.812 -10.826 -29.198 1.00 0.00 C ATOM 337 CG MET A 23 -0.832 -12.360 -29.299 1.00 0.00 C ATOM 338 SD MET A 23 0.114 -13.144 -27.984 1.00 0.00 S ATOM 339 CE MET A 23 1.814 -12.862 -28.497 1.00 0.00 C ATOM 0 H MET A 23 -3.006 -11.408 -28.236 1.00 0.00 H new ATOM 0 HA MET A 23 -1.957 -9.006 -29.422 1.00 0.00 H new ATOM 0 HB2 MET A 23 0.006 -10.458 -29.817 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.577 -10.559 -28.168 1.00 0.00 H new ATOM 0 HG2 MET A 23 -1.863 -12.711 -29.260 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.428 -12.664 -30.265 1.00 0.00 H new ATOM 0 HE1 MET A 23 2.351 -13.810 -28.514 1.00 0.00 H new ATOM 0 HE2 MET A 23 1.825 -12.421 -29.494 1.00 0.00 H new ATOM 0 HE3 MET A 23 2.298 -12.183 -27.795 1.00 0.00 H new ATOM 349 N LYS A 24 -3.169 -10.928 -31.738 1.00 0.00 N ATOM 350 CA LYS A 24 -3.890 -10.706 -33.034 1.00 0.00 C ATOM 351 C LYS A 24 -4.761 -9.399 -33.112 1.00 0.00 C ATOM 352 O LYS A 24 -4.616 -8.641 -34.074 1.00 0.00 O ATOM 353 CB LYS A 24 -4.666 -12.028 -33.287 1.00 0.00 C ATOM 354 CG LYS A 24 -5.607 -12.178 -34.506 1.00 0.00 C ATOM 355 CD LYS A 24 -7.041 -11.634 -34.260 1.00 0.00 C ATOM 356 CE LYS A 24 -8.086 -12.068 -35.305 1.00 0.00 C ATOM 357 NZ LYS A 24 -8.554 -13.455 -35.040 1.00 0.00 N ATOM 0 H LYS A 24 -3.313 -11.858 -31.344 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.184 -10.499 -33.838 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.926 -12.825 -33.355 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.263 -12.223 -32.396 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.171 -11.655 -35.357 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.670 -13.232 -34.778 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.375 -11.962 -33.276 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.002 -10.545 -34.237 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -8.934 -11.383 -35.284 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.654 -12.010 -36.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.961 -13.856 -35.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.751 -14.040 -34.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -9.278 -13.440 -34.293 1.00 0.00 H new ATOM 371 N GLU A 25 -5.611 -9.122 -32.104 1.00 0.00 N ATOM 372 CA GLU A 25 -6.341 -7.827 -31.962 1.00 0.00 C ATOM 373 C GLU A 25 -5.436 -6.552 -31.743 1.00 0.00 C ATOM 374 O GLU A 25 -5.695 -5.515 -32.359 1.00 0.00 O ATOM 375 CB GLU A 25 -7.423 -8.057 -30.863 1.00 0.00 C ATOM 376 CG GLU A 25 -8.574 -7.020 -30.810 1.00 0.00 C ATOM 377 CD GLU A 25 -9.616 -7.141 -31.918 1.00 0.00 C ATOM 378 OE1 GLU A 25 -10.321 -8.172 -31.981 1.00 0.00 O ATOM 379 OE2 GLU A 25 -9.765 -6.180 -32.698 1.00 0.00 O ATOM 0 H GLU A 25 -5.818 -9.786 -31.358 1.00 0.00 H new ATOM 0 HA GLU A 25 -6.808 -7.564 -32.911 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -7.858 -9.045 -31.012 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -6.928 -8.070 -29.892 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.079 -7.112 -29.848 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.142 -6.020 -30.849 1.00 0.00 H new ATOM 386 N LEU A 26 -4.348 -6.616 -30.941 1.00 0.00 N ATOM 387 CA LEU A 26 -3.252 -5.588 -30.945 1.00 0.00 C ATOM 388 C LEU A 26 -2.540 -5.316 -32.323 1.00 0.00 C ATOM 389 O LEU A 26 -2.215 -4.164 -32.626 1.00 0.00 O ATOM 390 CB LEU A 26 -2.152 -5.958 -29.901 1.00 0.00 C ATOM 391 CG LEU A 26 -2.498 -5.970 -28.390 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.300 -6.510 -27.585 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.847 -4.570 -27.865 1.00 0.00 C ATOM 0 H LEU A 26 -4.195 -7.372 -30.273 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.778 -4.667 -30.694 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.781 -6.950 -30.158 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.325 -5.262 -30.040 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.370 -6.612 -28.265 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.548 -6.516 -26.524 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.071 -7.525 -27.910 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.433 -5.871 -27.751 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.082 -4.628 -26.802 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.997 -3.904 -28.013 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.710 -4.183 -28.407 1.00 0.00 H new ATOM 405 N GLY A 27 -2.242 -6.372 -33.098 1.00 0.00 N ATOM 406 CA GLY A 27 -1.498 -6.284 -34.382 1.00 0.00 C ATOM 407 C GLY A 27 -0.141 -7.011 -34.343 1.00 0.00 C ATOM 408 O GLY A 27 0.905 -6.359 -34.349 1.00 0.00 O ATOM 0 H GLY A 27 -2.511 -7.325 -32.855 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.108 -6.709 -35.179 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.335 -5.235 -34.630 1.00 0.00 H new ATOM 412 N VAL A 28 -0.177 -8.353 -34.288 1.00 0.00 N ATOM 413 CA VAL A 28 1.040 -9.196 -34.068 1.00 0.00 C ATOM 414 C VAL A 28 1.022 -10.369 -35.108 1.00 0.00 C ATOM 415 O VAL A 28 0.063 -11.150 -35.195 1.00 0.00 O ATOM 416 CB VAL A 28 1.142 -9.701 -32.582 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.430 -10.512 -32.303 1.00 0.00 C ATOM 418 CG2 VAL A 28 1.130 -8.553 -31.543 1.00 0.00 C ATOM 0 H VAL A 28 -1.036 -8.893 -34.392 1.00 0.00 H new ATOM 0 HA VAL A 28 1.937 -8.598 -34.227 1.00 0.00 H new ATOM 0 HB VAL A 28 0.257 -10.328 -32.473 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.440 -10.832 -31.261 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.456 -11.388 -32.951 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.302 -9.889 -32.500 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.203 -8.970 -30.539 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.977 -7.890 -31.723 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.202 -7.989 -31.635 1.00 0.00 H new ATOM 428 N GLY A 29 2.123 -10.510 -35.871 1.00 0.00 N ATOM 429 CA GLY A 29 2.291 -11.620 -36.849 1.00 0.00 C ATOM 430 C GLY A 29 2.669 -13.003 -36.264 1.00 0.00 C ATOM 431 O GLY A 29 3.110 -13.129 -35.120 1.00 0.00 O ATOM 0 H GLY A 29 2.916 -9.870 -35.834 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.360 -11.728 -37.406 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.060 -11.331 -37.565 1.00 0.00 H new ATOM 435 N ILE A 30 2.505 -14.052 -37.084 1.00 0.00 N ATOM 436 CA ILE A 30 2.610 -15.484 -36.638 1.00 0.00 C ATOM 437 C ILE A 30 3.912 -15.936 -35.883 1.00 0.00 C ATOM 438 O ILE A 30 3.806 -16.577 -34.834 1.00 0.00 O ATOM 439 CB ILE A 30 2.236 -16.483 -37.791 1.00 0.00 C ATOM 440 CG1 ILE A 30 3.069 -16.345 -39.101 1.00 0.00 C ATOM 441 CG2 ILE A 30 0.719 -16.481 -38.107 1.00 0.00 C ATOM 442 CD1 ILE A 30 3.277 -17.666 -39.856 1.00 0.00 C ATOM 0 H ILE A 30 2.296 -13.951 -38.077 1.00 0.00 H new ATOM 0 HA ILE A 30 1.861 -15.525 -35.847 1.00 0.00 H new ATOM 0 HB ILE A 30 2.512 -17.453 -37.376 1.00 0.00 H new ATOM 0 HG12 ILE A 30 2.571 -15.636 -39.762 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.043 -15.922 -38.856 1.00 0.00 H new ATOM 0 HG21 ILE A 30 0.514 -17.188 -38.911 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.161 -16.772 -37.217 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.413 -15.482 -38.416 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.866 -17.483 -40.755 1.00 0.00 H new ATOM 0 HD12 ILE A 30 3.804 -18.372 -39.215 1.00 0.00 H new ATOM 0 HD13 ILE A 30 2.309 -18.082 -40.135 1.00 0.00 H new ATOM 454 N ALA A 31 5.115 -15.599 -36.380 1.00 0.00 N ATOM 455 CA ALA A 31 6.394 -15.837 -35.650 1.00 0.00 C ATOM 456 C ALA A 31 6.546 -15.115 -34.266 1.00 0.00 C ATOM 457 O ALA A 31 6.955 -15.748 -33.288 1.00 0.00 O ATOM 458 CB ALA A 31 7.536 -15.493 -36.626 1.00 0.00 C ATOM 0 H ALA A 31 5.239 -15.157 -37.291 1.00 0.00 H new ATOM 0 HA ALA A 31 6.418 -16.885 -35.351 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.495 -15.652 -36.134 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.468 -16.133 -37.505 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.453 -14.449 -36.930 1.00 0.00 H new ATOM 464 N LEU A 32 6.162 -13.826 -34.172 1.00 0.00 N ATOM 465 CA LEU A 32 6.004 -13.116 -32.866 1.00 0.00 C ATOM 466 C LEU A 32 4.865 -13.668 -31.937 1.00 0.00 C ATOM 467 O LEU A 32 5.091 -13.782 -30.729 1.00 0.00 O ATOM 468 CB LEU A 32 5.859 -11.586 -33.112 1.00 0.00 C ATOM 469 CG LEU A 32 7.095 -10.833 -33.681 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.712 -9.393 -34.061 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.274 -10.783 -32.689 1.00 0.00 C ATOM 0 H LEU A 32 5.952 -13.245 -34.983 1.00 0.00 H new ATOM 0 HA LEU A 32 6.916 -13.316 -32.303 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.026 -11.432 -33.798 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.585 -11.117 -32.167 1.00 0.00 H new ATOM 0 HG LEU A 32 7.417 -11.392 -34.560 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.586 -8.877 -34.458 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.928 -9.413 -34.818 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.351 -8.867 -33.177 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.107 -10.245 -33.141 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.962 -10.270 -31.779 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.587 -11.798 -32.444 1.00 0.00 H new ATOM 483 N ARG A 33 3.687 -14.057 -32.472 1.00 0.00 N ATOM 484 CA ARG A 33 2.652 -14.816 -31.706 1.00 0.00 C ATOM 485 C ARG A 33 3.117 -16.200 -31.154 1.00 0.00 C ATOM 486 O ARG A 33 2.988 -16.430 -29.950 1.00 0.00 O ATOM 487 CB ARG A 33 1.317 -14.919 -32.492 1.00 0.00 C ATOM 488 CG ARG A 33 0.606 -13.565 -32.727 1.00 0.00 C ATOM 489 CD ARG A 33 -0.923 -13.652 -32.888 1.00 0.00 C ATOM 490 NE ARG A 33 -1.303 -13.703 -34.319 1.00 0.00 N ATOM 491 CZ ARG A 33 -2.152 -14.561 -34.881 1.00 0.00 C ATOM 492 NH1 ARG A 33 -2.682 -15.602 -34.281 1.00 0.00 N ATOM 493 NH2 ARG A 33 -2.483 -14.349 -36.121 1.00 0.00 N ATOM 0 H ARG A 33 3.420 -13.860 -33.437 1.00 0.00 H new ATOM 0 HA ARG A 33 2.477 -14.218 -30.812 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.513 -15.385 -33.458 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.641 -15.581 -31.951 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.831 -12.904 -31.890 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.025 -13.102 -33.621 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.296 -14.539 -32.377 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.392 -12.790 -32.414 1.00 0.00 H new ATOM 0 HE ARG A 33 -0.872 -13.013 -34.934 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -2.450 -15.803 -33.308 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -3.326 -16.210 -34.788 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.095 -13.550 -36.623 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -3.131 -14.981 -36.591 1.00 0.00 H new ATOM 507 N LYS A 34 3.726 -17.073 -31.982 1.00 0.00 N ATOM 508 CA LYS A 34 4.443 -18.288 -31.505 1.00 0.00 C ATOM 509 C LYS A 34 5.517 -18.037 -30.387 1.00 0.00 C ATOM 510 O LYS A 34 5.428 -18.674 -29.336 1.00 0.00 O ATOM 511 CB LYS A 34 4.978 -19.014 -32.767 1.00 0.00 C ATOM 512 CG LYS A 34 5.594 -20.403 -32.492 1.00 0.00 C ATOM 513 CD LYS A 34 6.042 -21.114 -33.783 1.00 0.00 C ATOM 514 CE LYS A 34 6.726 -22.463 -33.492 1.00 0.00 C ATOM 515 NZ LYS A 34 7.136 -23.111 -34.768 1.00 0.00 N ATOM 0 H LYS A 34 3.739 -16.963 -32.996 1.00 0.00 H new ATOM 0 HA LYS A 34 3.747 -18.933 -30.969 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.161 -19.127 -33.480 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.730 -18.384 -33.242 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.450 -20.292 -31.826 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.864 -21.024 -31.973 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.177 -21.278 -34.426 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.729 -20.470 -34.332 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.598 -22.308 -32.856 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.045 -23.115 -32.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 7.597 -24.021 -34.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.297 -23.274 -35.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.802 -22.492 -35.274 1.00 0.00 H new ATOM 529 N MET A 35 6.468 -17.098 -30.581 1.00 0.00 N ATOM 530 CA MET A 35 7.399 -16.627 -29.510 1.00 0.00 C ATOM 531 C MET A 35 6.709 -16.120 -28.194 1.00 0.00 C ATOM 532 O MET A 35 7.013 -16.650 -27.123 1.00 0.00 O ATOM 533 CB MET A 35 8.351 -15.598 -30.185 1.00 0.00 C ATOM 534 CG MET A 35 9.535 -15.069 -29.349 1.00 0.00 C ATOM 535 SD MET A 35 9.014 -13.980 -28.000 1.00 0.00 S ATOM 536 CE MET A 35 8.601 -12.469 -28.897 1.00 0.00 C ATOM 0 H MET A 35 6.619 -16.640 -31.480 1.00 0.00 H new ATOM 0 HA MET A 35 7.966 -17.471 -29.117 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.755 -16.055 -31.088 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.753 -14.743 -30.500 1.00 0.00 H new ATOM 0 HG2 MET A 35 10.087 -15.913 -28.935 1.00 0.00 H new ATOM 0 HG3 MET A 35 10.221 -14.528 -30.001 1.00 0.00 H new ATOM 0 HE1 MET A 35 8.418 -11.663 -28.187 1.00 0.00 H new ATOM 0 HE2 MET A 35 9.429 -12.196 -29.551 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.706 -12.635 -29.496 1.00 0.00 H new ATOM 546 N GLY A 36 5.781 -15.145 -28.260 1.00 0.00 N ATOM 547 CA GLY A 36 5.014 -14.673 -27.070 1.00 0.00 C ATOM 548 C GLY A 36 4.068 -15.667 -26.349 1.00 0.00 C ATOM 549 O GLY A 36 4.026 -15.666 -25.117 1.00 0.00 O ATOM 0 H GLY A 36 5.537 -14.662 -29.125 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.734 -14.311 -26.336 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.417 -13.816 -27.381 1.00 0.00 H new ATOM 553 N ALA A 37 3.315 -16.499 -27.089 1.00 0.00 N ATOM 554 CA ALA A 37 2.514 -17.609 -26.507 1.00 0.00 C ATOM 555 C ALA A 37 3.326 -18.780 -25.852 1.00 0.00 C ATOM 556 O ALA A 37 2.966 -19.203 -24.750 1.00 0.00 O ATOM 557 CB ALA A 37 1.561 -18.100 -27.615 1.00 0.00 C ATOM 0 H ALA A 37 3.239 -16.428 -28.104 1.00 0.00 H new ATOM 0 HA ALA A 37 1.971 -17.214 -25.649 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.950 -18.918 -27.233 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.915 -17.280 -27.929 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.144 -18.449 -28.467 1.00 0.00 H new ATOM 563 N MET A 38 4.412 -19.289 -26.479 1.00 0.00 N ATOM 564 CA MET A 38 5.338 -20.263 -25.817 1.00 0.00 C ATOM 565 C MET A 38 6.264 -19.706 -24.675 1.00 0.00 C ATOM 566 O MET A 38 6.648 -20.476 -23.789 1.00 0.00 O ATOM 567 CB MET A 38 6.093 -21.090 -26.896 1.00 0.00 C ATOM 568 CG MET A 38 7.361 -20.466 -27.518 1.00 0.00 C ATOM 569 SD MET A 38 7.894 -21.410 -28.961 1.00 0.00 S ATOM 570 CE MET A 38 8.877 -22.702 -28.178 1.00 0.00 C ATOM 0 H MET A 38 4.675 -19.049 -27.435 1.00 0.00 H new ATOM 0 HA MET A 38 4.695 -20.928 -25.241 1.00 0.00 H new ATOM 0 HB2 MET A 38 6.372 -22.046 -26.452 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.394 -21.306 -27.704 1.00 0.00 H new ATOM 0 HG2 MET A 38 7.161 -19.434 -27.806 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.161 -20.441 -26.778 1.00 0.00 H new ATOM 0 HE1 MET A 38 9.277 -23.369 -28.942 1.00 0.00 H new ATOM 0 HE2 MET A 38 9.700 -22.249 -27.625 1.00 0.00 H new ATOM 0 HE3 MET A 38 8.250 -23.271 -27.492 1.00 0.00 H new ATOM 580 N ALA A 39 6.608 -18.400 -24.668 1.00 0.00 N ATOM 581 CA ALA A 39 7.353 -17.750 -23.561 1.00 0.00 C ATOM 582 C ALA A 39 6.645 -17.833 -22.172 1.00 0.00 C ATOM 583 O ALA A 39 5.476 -17.458 -22.014 1.00 0.00 O ATOM 584 CB ALA A 39 7.584 -16.283 -23.972 1.00 0.00 C ATOM 0 H ALA A 39 6.378 -17.763 -25.430 1.00 0.00 H new ATOM 0 HA ALA A 39 8.291 -18.287 -23.418 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.131 -15.766 -23.183 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.162 -16.251 -24.896 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.623 -15.793 -24.128 1.00 0.00 H new ATOM 590 N LYS A 40 7.380 -18.322 -21.161 1.00 0.00 N ATOM 591 CA LYS A 40 6.848 -18.494 -19.784 1.00 0.00 C ATOM 592 C LYS A 40 7.613 -17.531 -18.800 1.00 0.00 C ATOM 593 O LYS A 40 8.499 -18.010 -18.085 1.00 0.00 O ATOM 594 CB LYS A 40 6.934 -20.023 -19.477 1.00 0.00 C ATOM 595 CG LYS A 40 5.966 -20.546 -18.387 1.00 0.00 C ATOM 596 CD LYS A 40 4.604 -21.100 -18.885 1.00 0.00 C ATOM 597 CE LYS A 40 3.678 -20.072 -19.563 1.00 0.00 C ATOM 598 NZ LYS A 40 2.326 -20.646 -19.816 1.00 0.00 N ATOM 0 H LYS A 40 8.353 -18.610 -21.265 1.00 0.00 H new ATOM 0 HA LYS A 40 5.805 -18.202 -19.662 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.743 -20.571 -20.400 1.00 0.00 H new ATOM 0 HB3 LYS A 40 7.954 -20.257 -19.173 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.472 -21.334 -17.829 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.770 -19.735 -17.686 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.796 -21.910 -19.589 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.076 -21.534 -18.036 1.00 0.00 H new ATOM 0 HE2 LYS A 40 3.588 -19.188 -18.931 1.00 0.00 H new ATOM 0 HE3 LYS A 40 4.120 -19.747 -20.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 1.831 -20.069 -20.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 2.423 -21.620 -20.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 1.780 -20.650 -18.931 1.00 0.00 H new ATOM 612 N PRO A 41 7.347 -16.185 -18.734 1.00 0.00 N ATOM 613 CA PRO A 41 8.238 -15.233 -18.017 1.00 0.00 C ATOM 614 C PRO A 41 8.140 -15.221 -16.467 1.00 0.00 C ATOM 615 O PRO A 41 7.046 -15.201 -15.893 1.00 0.00 O ATOM 616 CB PRO A 41 7.812 -13.867 -18.596 1.00 0.00 C ATOM 617 CG PRO A 41 6.375 -14.061 -19.074 1.00 0.00 C ATOM 618 CD PRO A 41 6.391 -15.487 -19.615 1.00 0.00 C ATOM 0 HA PRO A 41 9.279 -15.514 -18.174 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.873 -13.084 -17.840 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.463 -13.568 -19.418 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.659 -13.944 -18.261 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.103 -13.339 -19.844 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.402 -15.942 -19.573 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.711 -15.517 -20.656 1.00 0.00 H new ATOM 626 N ASP A 42 9.314 -15.091 -15.838 1.00 0.00 N ATOM 627 CA ASP A 42 9.452 -14.692 -14.414 1.00 0.00 C ATOM 628 C ASP A 42 9.484 -13.120 -14.326 1.00 0.00 C ATOM 629 O ASP A 42 10.526 -12.471 -14.457 1.00 0.00 O ATOM 630 CB ASP A 42 10.724 -15.398 -13.861 1.00 0.00 C ATOM 631 CG ASP A 42 10.536 -16.819 -13.300 1.00 0.00 C ATOM 632 OD1 ASP A 42 10.216 -17.762 -14.053 1.00 0.00 O ATOM 633 OD2 ASP A 42 10.745 -17.024 -12.087 1.00 0.00 O ATOM 0 H ASP A 42 10.208 -15.259 -16.299 1.00 0.00 H new ATOM 0 HA ASP A 42 8.611 -15.004 -13.795 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.463 -15.443 -14.661 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.144 -14.774 -13.073 1.00 0.00 H new ATOM 638 N CYS A 43 8.304 -12.500 -14.154 1.00 0.00 N ATOM 639 CA CYS A 43 8.124 -11.028 -14.211 1.00 0.00 C ATOM 640 C CYS A 43 8.302 -10.352 -12.817 1.00 0.00 C ATOM 641 O CYS A 43 7.512 -10.569 -11.895 1.00 0.00 O ATOM 642 CB CYS A 43 6.724 -10.780 -14.816 1.00 0.00 C ATOM 643 SG CYS A 43 6.442 -8.993 -15.069 1.00 0.00 S ATOM 0 H CYS A 43 7.437 -13.005 -13.970 1.00 0.00 H new ATOM 0 HA CYS A 43 8.894 -10.571 -14.832 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.634 -11.306 -15.766 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.959 -11.185 -14.154 1.00 0.00 H new ATOM 0 HG CYS A 43 5.360 -8.819 -15.769 1.00 0.00 H new ATOM 649 N ILE A 44 9.334 -9.512 -12.663 1.00 0.00 N ATOM 650 CA ILE A 44 9.707 -8.911 -11.347 1.00 0.00 C ATOM 651 C ILE A 44 8.991 -7.536 -11.184 1.00 0.00 C ATOM 652 O ILE A 44 9.264 -6.614 -11.957 1.00 0.00 O ATOM 653 CB ILE A 44 11.262 -8.786 -11.201 1.00 0.00 C ATOM 654 CG1 ILE A 44 12.057 -10.110 -11.421 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.691 -8.210 -9.825 1.00 0.00 C ATOM 656 CD1 ILE A 44 13.381 -9.866 -12.152 1.00 0.00 C ATOM 0 H ILE A 44 9.938 -9.223 -13.432 1.00 0.00 H new ATOM 0 HA ILE A 44 9.374 -9.569 -10.544 1.00 0.00 H new ATOM 0 HB ILE A 44 11.517 -8.098 -12.007 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.255 -10.579 -10.457 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.448 -10.808 -11.996 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.778 -8.146 -9.780 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.263 -7.216 -9.698 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.333 -8.864 -9.029 1.00 0.00 H new ATOM 0 HD11 ILE A 44 13.903 -10.813 -12.285 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.182 -9.422 -13.127 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.001 -9.189 -11.565 1.00 0.00 H new ATOM 668 N ILE A 45 8.135 -7.393 -10.160 1.00 0.00 N ATOM 669 CA ILE A 45 7.551 -6.073 -9.761 1.00 0.00 C ATOM 670 C ILE A 45 8.265 -5.618 -8.444 1.00 0.00 C ATOM 671 O ILE A 45 8.156 -6.308 -7.425 1.00 0.00 O ATOM 672 CB ILE A 45 5.987 -6.141 -9.585 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.234 -6.606 -10.866 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.398 -4.784 -9.093 1.00 0.00 C ATOM 675 CD1 ILE A 45 3.744 -6.931 -10.664 1.00 0.00 C ATOM 0 H ILE A 45 7.821 -8.172 -9.581 1.00 0.00 H new ATOM 0 HA ILE A 45 7.720 -5.342 -10.552 1.00 0.00 H new ATOM 0 HB ILE A 45 5.825 -6.901 -8.820 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.321 -5.827 -11.623 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.733 -7.491 -11.261 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.317 -4.874 -8.985 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.839 -4.524 -8.131 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.626 -4.004 -9.819 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.308 -7.245 -11.612 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.642 -7.734 -9.934 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.224 -6.044 -10.302 1.00 0.00 H new ATOM 687 N THR A 46 8.905 -4.429 -8.441 1.00 0.00 N ATOM 688 CA THR A 46 9.306 -3.741 -7.169 1.00 0.00 C ATOM 689 C THR A 46 9.082 -2.192 -7.258 1.00 0.00 C ATOM 690 O THR A 46 9.447 -1.544 -8.246 1.00 0.00 O ATOM 691 CB THR A 46 10.720 -4.203 -6.677 1.00 0.00 C ATOM 692 OG1 THR A 46 10.583 -5.472 -6.040 1.00 0.00 O ATOM 693 CG2 THR A 46 11.420 -3.338 -5.614 1.00 0.00 C ATOM 0 H THR A 46 9.158 -3.921 -9.288 1.00 0.00 H new ATOM 0 HA THR A 46 8.638 -4.059 -6.368 1.00 0.00 H new ATOM 0 HB THR A 46 11.320 -4.167 -7.586 1.00 0.00 H new ATOM 0 HG1 THR A 46 9.787 -5.467 -5.469 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.388 -3.776 -5.368 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.566 -2.330 -6.003 1.00 0.00 H new ATOM 0 HG23 THR A 46 10.803 -3.294 -4.716 1.00 0.00 H new ATOM 701 N CYS A 47 8.480 -1.609 -6.200 1.00 0.00 N ATOM 702 CA CYS A 47 8.129 -0.166 -6.135 1.00 0.00 C ATOM 703 C CYS A 47 9.020 0.694 -5.178 1.00 0.00 C ATOM 704 O CYS A 47 9.361 0.278 -4.066 1.00 0.00 O ATOM 705 CB CYS A 47 6.638 -0.086 -5.738 1.00 0.00 C ATOM 706 SG CYS A 47 6.346 -0.583 -4.002 1.00 0.00 S ATOM 0 H CYS A 47 8.220 -2.125 -5.360 1.00 0.00 H new ATOM 0 HA CYS A 47 8.319 0.273 -7.115 1.00 0.00 H new ATOM 0 HB2 CYS A 47 6.281 0.933 -5.886 1.00 0.00 H new ATOM 0 HB3 CYS A 47 6.055 -0.727 -6.399 1.00 0.00 H new ATOM 0 HG CYS A 47 6.887 -1.745 -3.787 1.00 0.00 H new ATOM 712 N ASP A 48 9.330 1.935 -5.600 1.00 0.00 N ATOM 713 CA ASP A 48 9.906 2.991 -4.717 1.00 0.00 C ATOM 714 C ASP A 48 8.757 3.991 -4.304 1.00 0.00 C ATOM 715 O ASP A 48 7.804 3.572 -3.637 1.00 0.00 O ATOM 716 CB ASP A 48 11.159 3.502 -5.488 1.00 0.00 C ATOM 717 CG ASP A 48 11.919 4.658 -4.850 1.00 0.00 C ATOM 718 OD1 ASP A 48 12.809 4.428 -4.008 1.00 0.00 O ATOM 719 OD2 ASP A 48 11.599 5.818 -5.199 1.00 0.00 O ATOM 0 H ASP A 48 9.191 2.243 -6.562 1.00 0.00 H new ATOM 0 HA ASP A 48 10.274 2.689 -3.736 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.848 2.667 -5.613 1.00 0.00 H new ATOM 0 HB3 ASP A 48 10.845 3.808 -6.486 1.00 0.00 H new ATOM 724 N GLY A 49 8.809 5.287 -4.678 1.00 0.00 N ATOM 725 CA GLY A 49 7.704 6.252 -4.408 1.00 0.00 C ATOM 726 C GLY A 49 6.652 6.290 -5.536 1.00 0.00 C ATOM 727 O GLY A 49 5.640 5.590 -5.468 1.00 0.00 O ATOM 0 H GLY A 49 9.603 5.697 -5.169 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.215 5.984 -3.471 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.123 7.249 -4.275 1.00 0.00 H new ATOM 731 N LYS A 50 6.914 7.076 -6.593 1.00 0.00 N ATOM 732 CA LYS A 50 6.225 6.880 -7.906 1.00 0.00 C ATOM 733 C LYS A 50 6.897 5.821 -8.846 1.00 0.00 C ATOM 734 O LYS A 50 6.179 5.144 -9.581 1.00 0.00 O ATOM 735 CB LYS A 50 6.066 8.216 -8.682 1.00 0.00 C ATOM 736 CG LYS A 50 5.065 9.261 -8.133 1.00 0.00 C ATOM 737 CD LYS A 50 5.136 10.631 -8.857 1.00 0.00 C ATOM 738 CE LYS A 50 4.739 10.616 -10.352 1.00 0.00 C ATOM 739 NZ LYS A 50 4.966 11.953 -10.969 1.00 0.00 N ATOM 0 H LYS A 50 7.584 7.845 -6.579 1.00 0.00 H new ATOM 0 HA LYS A 50 5.246 6.488 -7.631 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.046 8.689 -8.736 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.771 7.976 -9.703 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.054 8.865 -8.222 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.256 9.411 -7.070 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.487 11.333 -8.334 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.153 11.014 -8.773 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.322 9.862 -10.881 1.00 0.00 H new ATOM 0 HE3 LYS A 50 3.690 10.337 -10.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.076 11.846 -11.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.153 12.570 -10.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.828 12.377 -10.571 1.00 0.00 H new ATOM 753 N ASN A 51 8.238 5.716 -8.909 1.00 0.00 N ATOM 754 CA ASN A 51 8.933 4.821 -9.877 1.00 0.00 C ATOM 755 C ASN A 51 8.798 3.301 -9.509 1.00 0.00 C ATOM 756 O ASN A 51 9.230 2.853 -8.443 1.00 0.00 O ATOM 757 CB ASN A 51 10.392 5.311 -10.112 1.00 0.00 C ATOM 758 CG ASN A 51 11.386 5.234 -8.943 1.00 0.00 C ATOM 759 OD1 ASN A 51 12.104 4.255 -8.776 1.00 0.00 O ATOM 760 ND2 ASN A 51 11.459 6.250 -8.113 1.00 0.00 N ATOM 0 H ASN A 51 8.870 6.238 -8.303 1.00 0.00 H new ATOM 0 HA ASN A 51 8.427 4.891 -10.840 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.807 4.734 -10.939 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.345 6.350 -10.440 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.113 6.223 -7.331 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.862 7.065 -8.251 1.00 0.00 H new ATOM 767 N LEU A 52 8.151 2.530 -10.395 1.00 0.00 N ATOM 768 CA LEU A 52 7.833 1.095 -10.170 1.00 0.00 C ATOM 769 C LEU A 52 8.443 0.258 -11.337 1.00 0.00 C ATOM 770 O LEU A 52 8.109 0.446 -12.513 1.00 0.00 O ATOM 771 CB LEU A 52 6.293 1.010 -9.951 1.00 0.00 C ATOM 772 CG LEU A 52 5.670 -0.400 -9.750 1.00 0.00 C ATOM 773 CD1 LEU A 52 4.432 -0.330 -8.837 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.235 -1.019 -11.085 1.00 0.00 C ATOM 0 H LEU A 52 7.827 2.879 -11.297 1.00 0.00 H new ATOM 0 HA LEU A 52 8.283 0.656 -9.280 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.044 1.614 -9.079 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.806 1.473 -10.809 1.00 0.00 H new ATOM 0 HG LEU A 52 6.443 -1.018 -9.293 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.015 -1.329 -8.712 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.720 0.067 -7.864 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.684 0.322 -9.288 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.804 -2.004 -10.906 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.491 -0.378 -11.558 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.100 -1.115 -11.741 1.00 0.00 H new ATOM 786 N THR A 53 9.370 -0.654 -11.004 1.00 0.00 N ATOM 787 CA THR A 53 10.189 -1.390 -12.010 1.00 0.00 C ATOM 788 C THR A 53 9.530 -2.760 -12.348 1.00 0.00 C ATOM 789 O THR A 53 9.299 -3.596 -11.467 1.00 0.00 O ATOM 790 CB THR A 53 11.664 -1.525 -11.520 1.00 0.00 C ATOM 791 OG1 THR A 53 12.218 -0.234 -11.282 1.00 0.00 O ATOM 792 CG2 THR A 53 12.614 -2.185 -12.537 1.00 0.00 C ATOM 0 H THR A 53 9.580 -0.909 -10.039 1.00 0.00 H new ATOM 0 HA THR A 53 10.221 -0.821 -12.939 1.00 0.00 H new ATOM 0 HB THR A 53 11.598 -2.148 -10.628 1.00 0.00 H new ATOM 0 HG1 THR A 53 13.143 -0.327 -10.973 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.618 -2.239 -12.115 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.261 -3.191 -12.765 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.636 -1.593 -13.452 1.00 0.00 H new ATOM 800 N ILE A 54 9.258 -2.974 -13.645 1.00 0.00 N ATOM 801 CA ILE A 54 8.665 -4.234 -14.174 1.00 0.00 C ATOM 802 C ILE A 54 9.734 -4.859 -15.133 1.00 0.00 C ATOM 803 O ILE A 54 9.934 -4.361 -16.246 1.00 0.00 O ATOM 804 CB ILE A 54 7.254 -3.948 -14.808 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.215 -3.498 -13.729 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.690 -5.170 -15.580 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.908 -2.872 -14.244 1.00 0.00 C ATOM 0 H ILE A 54 9.441 -2.279 -14.369 1.00 0.00 H new ATOM 0 HA ILE A 54 8.450 -4.971 -13.400 1.00 0.00 H new ATOM 0 HB ILE A 54 7.410 -3.135 -15.518 1.00 0.00 H new ATOM 0 HG12 ILE A 54 5.960 -4.366 -13.121 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.700 -2.778 -13.070 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.715 -4.918 -15.997 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.372 -5.437 -16.387 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.586 -6.014 -14.899 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.275 -2.604 -13.398 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.137 -1.978 -14.824 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.385 -3.590 -14.875 1.00 0.00 H new ATOM 819 N LYS A 55 10.410 -5.946 -14.708 1.00 0.00 N ATOM 820 CA LYS A 55 11.398 -6.677 -15.559 1.00 0.00 C ATOM 821 C LYS A 55 10.847 -8.076 -15.982 1.00 0.00 C ATOM 822 O LYS A 55 10.668 -8.959 -15.141 1.00 0.00 O ATOM 823 CB LYS A 55 12.762 -6.792 -14.814 1.00 0.00 C ATOM 824 CG LYS A 55 13.906 -7.419 -15.660 1.00 0.00 C ATOM 825 CD LYS A 55 15.166 -7.800 -14.859 1.00 0.00 C ATOM 826 CE LYS A 55 16.203 -8.535 -15.734 1.00 0.00 C ATOM 827 NZ LYS A 55 17.179 -9.259 -14.877 1.00 0.00 N ATOM 0 H LYS A 55 10.295 -6.346 -13.777 1.00 0.00 H new ATOM 0 HA LYS A 55 11.561 -6.110 -16.475 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.070 -5.798 -14.490 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.621 -7.392 -13.915 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.525 -8.311 -16.157 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.189 -6.715 -16.442 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.616 -6.900 -14.441 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.884 -8.435 -14.019 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.698 -9.238 -16.396 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.726 -7.820 -16.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.087 -9.339 -15.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.317 -8.735 -13.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.816 -10.210 -14.664 1.00 0.00 H new ATOM 841 N THR A 56 10.671 -8.304 -17.294 1.00 0.00 N ATOM 842 CA THR A 56 10.226 -9.623 -17.838 1.00 0.00 C ATOM 843 C THR A 56 11.457 -10.568 -18.054 1.00 0.00 C ATOM 844 O THR A 56 12.240 -10.334 -18.980 1.00 0.00 O ATOM 845 CB THR A 56 9.447 -9.387 -19.175 1.00 0.00 C ATOM 846 OG1 THR A 56 8.478 -8.345 -19.064 1.00 0.00 O ATOM 847 CG2 THR A 56 8.692 -10.612 -19.700 1.00 0.00 C ATOM 0 H THR A 56 10.828 -7.596 -18.011 1.00 0.00 H new ATOM 0 HA THR A 56 9.561 -10.111 -17.125 1.00 0.00 H new ATOM 0 HB THR A 56 10.244 -9.126 -19.871 1.00 0.00 H new ATOM 0 HG1 THR A 56 8.889 -7.489 -19.304 1.00 0.00 H new ATOM 0 HG21 THR A 56 8.183 -10.355 -20.629 1.00 0.00 H new ATOM 0 HG22 THR A 56 9.397 -11.422 -19.885 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.958 -10.932 -18.960 1.00 0.00 H new ATOM 855 N GLU A 57 11.631 -11.638 -17.250 1.00 0.00 N ATOM 856 CA GLU A 57 12.717 -12.640 -17.483 1.00 0.00 C ATOM 857 C GLU A 57 12.163 -13.902 -18.226 1.00 0.00 C ATOM 858 O GLU A 57 11.695 -14.869 -17.618 1.00 0.00 O ATOM 859 CB GLU A 57 13.452 -12.973 -16.155 1.00 0.00 C ATOM 860 CG GLU A 57 14.358 -11.842 -15.600 1.00 0.00 C ATOM 861 CD GLU A 57 15.066 -12.104 -14.276 1.00 0.00 C ATOM 862 OE1 GLU A 57 14.564 -12.868 -13.422 1.00 0.00 O ATOM 863 OE2 GLU A 57 16.114 -11.468 -14.039 1.00 0.00 O ATOM 0 H GLU A 57 11.045 -11.838 -16.439 1.00 0.00 H new ATOM 0 HA GLU A 57 13.467 -12.207 -18.145 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.708 -13.224 -15.399 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.062 -13.863 -16.309 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.116 -11.618 -16.350 1.00 0.00 H new ATOM 0 HG3 GLU A 57 13.748 -10.946 -15.486 1.00 0.00 H new ATOM 870 N SER A 58 12.244 -13.878 -19.568 1.00 0.00 N ATOM 871 CA SER A 58 12.057 -15.077 -20.434 1.00 0.00 C ATOM 872 C SER A 58 13.270 -15.241 -21.394 1.00 0.00 C ATOM 873 O SER A 58 13.697 -14.274 -22.037 1.00 0.00 O ATOM 874 CB SER A 58 10.745 -14.948 -21.244 1.00 0.00 C ATOM 875 OG SER A 58 10.486 -16.126 -22.014 1.00 0.00 O ATOM 0 H SER A 58 12.442 -13.027 -20.094 1.00 0.00 H new ATOM 0 HA SER A 58 11.992 -15.962 -19.801 1.00 0.00 H new ATOM 0 HB2 SER A 58 9.913 -14.766 -20.564 1.00 0.00 H new ATOM 0 HB3 SER A 58 10.809 -14.085 -21.907 1.00 0.00 H new ATOM 0 HG SER A 58 10.288 -15.874 -22.940 1.00 0.00 H new ATOM 881 N THR A 59 13.745 -16.485 -21.610 1.00 0.00 N ATOM 882 CA THR A 59 14.805 -16.784 -22.639 1.00 0.00 C ATOM 883 C THR A 59 14.282 -16.810 -24.129 1.00 0.00 C ATOM 884 O THR A 59 14.548 -17.734 -24.901 1.00 0.00 O ATOM 885 CB THR A 59 15.578 -18.090 -22.263 1.00 0.00 C ATOM 886 OG1 THR A 59 14.714 -19.222 -22.321 1.00 0.00 O ATOM 887 CG2 THR A 59 16.277 -18.097 -20.892 1.00 0.00 C ATOM 0 H THR A 59 13.424 -17.306 -21.097 1.00 0.00 H new ATOM 0 HA THR A 59 15.499 -15.944 -22.613 1.00 0.00 H new ATOM 0 HB THR A 59 16.370 -18.135 -23.010 1.00 0.00 H new ATOM 0 HG1 THR A 59 15.216 -20.029 -22.084 1.00 0.00 H new ATOM 0 HG21 THR A 59 16.778 -19.053 -20.744 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.012 -17.293 -20.854 1.00 0.00 H new ATOM 0 HG23 THR A 59 15.537 -17.950 -20.105 1.00 0.00 H new ATOM 895 N LEU A 60 13.547 -15.755 -24.510 1.00 0.00 N ATOM 896 CA LEU A 60 13.000 -15.510 -25.872 1.00 0.00 C ATOM 897 C LEU A 60 12.890 -13.965 -26.116 1.00 0.00 C ATOM 898 O LEU A 60 13.377 -13.479 -27.144 1.00 0.00 O ATOM 899 CB LEU A 60 11.625 -16.213 -26.099 1.00 0.00 C ATOM 900 CG LEU A 60 11.629 -17.741 -26.365 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.198 -18.296 -26.332 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.271 -18.116 -27.714 1.00 0.00 C ATOM 0 H LEU A 60 13.301 -15.011 -23.856 1.00 0.00 H new ATOM 0 HA LEU A 60 13.688 -15.947 -26.596 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.005 -16.027 -25.222 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.136 -15.727 -26.943 1.00 0.00 H new ATOM 0 HG LEU A 60 12.231 -18.183 -25.571 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.220 -19.369 -26.521 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.757 -18.108 -25.353 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.599 -17.805 -27.099 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.244 -19.198 -27.842 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.718 -17.641 -28.525 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.306 -17.775 -27.732 1.00 0.00 H new ATOM 914 N LYS A 61 12.247 -13.177 -25.217 1.00 0.00 N ATOM 915 CA LYS A 61 12.222 -11.691 -25.324 1.00 0.00 C ATOM 916 C LYS A 61 12.025 -11.035 -23.923 1.00 0.00 C ATOM 917 O LYS A 61 10.971 -11.176 -23.295 1.00 0.00 O ATOM 918 CB LYS A 61 11.138 -11.253 -26.348 1.00 0.00 C ATOM 919 CG LYS A 61 11.195 -9.781 -26.824 1.00 0.00 C ATOM 920 CD LYS A 61 12.455 -9.330 -27.605 1.00 0.00 C ATOM 921 CE LYS A 61 12.718 -10.031 -28.958 1.00 0.00 C ATOM 922 NZ LYS A 61 13.617 -11.214 -28.816 1.00 0.00 N ATOM 0 H LYS A 61 11.740 -13.542 -24.411 1.00 0.00 H new ATOM 0 HA LYS A 61 13.185 -11.339 -25.695 1.00 0.00 H new ATOM 0 HB2 LYS A 61 11.214 -11.898 -27.223 1.00 0.00 H new ATOM 0 HB3 LYS A 61 10.158 -11.431 -25.905 1.00 0.00 H new ATOM 0 HG2 LYS A 61 10.325 -9.597 -27.454 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.095 -9.140 -25.948 1.00 0.00 H new ATOM 0 HD2 LYS A 61 12.378 -8.258 -27.786 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.325 -9.484 -26.967 1.00 0.00 H new ATOM 0 HE2 LYS A 61 11.769 -10.348 -29.391 1.00 0.00 H new ATOM 0 HE3 LYS A 61 13.164 -9.320 -29.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 13.697 -11.701 -29.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 14.559 -10.899 -28.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 13.222 -11.867 -28.110 1.00 0.00 H new ATOM 936 N THR A 62 13.035 -10.280 -23.462 1.00 0.00 N ATOM 937 CA THR A 62 12.996 -9.576 -22.154 1.00 0.00 C ATOM 938 C THR A 62 12.580 -8.086 -22.338 1.00 0.00 C ATOM 939 O THR A 62 13.432 -7.211 -22.540 1.00 0.00 O ATOM 940 CB THR A 62 14.381 -9.686 -21.451 1.00 0.00 C ATOM 941 OG1 THR A 62 15.415 -9.114 -22.250 1.00 0.00 O ATOM 942 CG2 THR A 62 14.799 -11.100 -21.037 1.00 0.00 C ATOM 0 H THR A 62 13.903 -10.136 -23.978 1.00 0.00 H new ATOM 0 HA THR A 62 12.246 -10.052 -21.522 1.00 0.00 H new ATOM 0 HB THR A 62 14.246 -9.123 -20.527 1.00 0.00 H new ATOM 0 HG1 THR A 62 15.109 -8.259 -22.618 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.777 -11.064 -20.557 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.067 -11.506 -20.339 1.00 0.00 H new ATOM 0 HG23 THR A 62 14.851 -11.737 -21.920 1.00 0.00 H new ATOM 950 N THR A 63 11.273 -7.805 -22.234 1.00 0.00 N ATOM 951 CA THR A 63 10.748 -6.404 -22.213 1.00 0.00 C ATOM 952 C THR A 63 10.714 -5.898 -20.734 1.00 0.00 C ATOM 953 O THR A 63 10.019 -6.446 -19.868 1.00 0.00 O ATOM 954 CB THR A 63 9.357 -6.274 -22.898 1.00 0.00 C ATOM 955 OG1 THR A 63 9.369 -6.830 -24.207 1.00 0.00 O ATOM 956 CG2 THR A 63 8.866 -4.826 -23.087 1.00 0.00 C ATOM 0 H THR A 63 10.549 -8.519 -22.162 1.00 0.00 H new ATOM 0 HA THR A 63 11.419 -5.775 -22.797 1.00 0.00 H new ATOM 0 HB THR A 63 8.694 -6.803 -22.213 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.619 -6.468 -24.723 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.890 -4.833 -23.572 1.00 0.00 H new ATOM 0 HG22 THR A 63 8.785 -4.339 -22.115 1.00 0.00 H new ATOM 0 HG23 THR A 63 9.575 -4.279 -23.708 1.00 0.00 H new ATOM 964 N GLN A 64 11.493 -4.846 -20.467 1.00 0.00 N ATOM 965 CA GLN A 64 11.668 -4.269 -19.105 1.00 0.00 C ATOM 966 C GLN A 64 11.464 -2.723 -19.097 1.00 0.00 C ATOM 967 O GLN A 64 11.862 -2.022 -20.033 1.00 0.00 O ATOM 968 CB GLN A 64 13.017 -4.750 -18.491 1.00 0.00 C ATOM 969 CG GLN A 64 14.366 -4.344 -19.156 1.00 0.00 C ATOM 970 CD GLN A 64 14.844 -2.893 -19.005 1.00 0.00 C ATOM 971 OE1 GLN A 64 15.071 -2.181 -19.976 1.00 0.00 O ATOM 972 NE2 GLN A 64 15.055 -2.414 -17.801 1.00 0.00 N ATOM 0 H GLN A 64 12.029 -4.358 -21.185 1.00 0.00 H new ATOM 0 HA GLN A 64 10.882 -4.645 -18.449 1.00 0.00 H new ATOM 0 HB2 GLN A 64 13.046 -4.400 -17.459 1.00 0.00 H new ATOM 0 HB3 GLN A 64 12.987 -5.839 -18.457 1.00 0.00 H new ATOM 0 HG2 GLN A 64 15.144 -4.994 -18.754 1.00 0.00 H new ATOM 0 HG3 GLN A 64 14.290 -4.560 -20.222 1.00 0.00 H new ATOM 0 HE21 GLN A 64 14.871 -2.994 -16.982 1.00 0.00 H new ATOM 0 HE22 GLN A 64 15.403 -1.462 -17.685 1.00 0.00 H new ATOM 981 N PHE A 65 10.830 -2.189 -18.037 1.00 0.00 N ATOM 982 CA PHE A 65 10.469 -0.743 -17.962 1.00 0.00 C ATOM 983 C PHE A 65 10.301 -0.238 -16.493 1.00 0.00 C ATOM 984 O PHE A 65 9.791 -0.947 -15.620 1.00 0.00 O ATOM 985 CB PHE A 65 9.229 -0.418 -18.854 1.00 0.00 C ATOM 986 CG PHE A 65 7.889 -1.101 -18.513 1.00 0.00 C ATOM 987 CD1 PHE A 65 6.992 -0.486 -17.635 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.536 -2.313 -19.117 1.00 0.00 C ATOM 989 CE1 PHE A 65 5.750 -1.063 -17.382 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.297 -2.894 -18.855 1.00 0.00 C ATOM 991 CZ PHE A 65 5.404 -2.267 -17.989 1.00 0.00 C ATOM 0 H PHE A 65 10.553 -2.728 -17.217 1.00 0.00 H new ATOM 0 HA PHE A 65 11.312 -0.184 -18.369 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.071 0.660 -18.825 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.482 -0.675 -19.883 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.263 0.440 -17.151 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.227 -2.800 -19.789 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.055 -0.576 -16.714 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.029 -3.830 -19.323 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.442 -2.715 -17.788 1.00 0.00 H new ATOM 1001 N SER A 66 10.685 1.025 -16.243 1.00 0.00 N ATOM 1002 CA SER A 66 10.359 1.745 -14.981 1.00 0.00 C ATOM 1003 C SER A 66 9.166 2.724 -15.215 1.00 0.00 C ATOM 1004 O SER A 66 9.299 3.747 -15.895 1.00 0.00 O ATOM 1005 CB SER A 66 11.630 2.428 -14.421 1.00 0.00 C ATOM 1006 OG SER A 66 12.190 3.384 -15.327 1.00 0.00 O ATOM 0 H SER A 66 11.229 1.582 -16.902 1.00 0.00 H new ATOM 0 HA SER A 66 10.027 1.042 -14.217 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.387 2.924 -13.481 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.377 1.667 -14.196 1.00 0.00 H new ATOM 0 HG SER A 66 11.475 3.782 -15.866 1.00 0.00 H new ATOM 1012 N CYS A 67 7.985 2.389 -14.669 1.00 0.00 N ATOM 1013 CA CYS A 67 6.769 3.224 -14.811 1.00 0.00 C ATOM 1014 C CYS A 67 6.602 4.230 -13.638 1.00 0.00 C ATOM 1015 O CYS A 67 6.649 3.839 -12.467 1.00 0.00 O ATOM 1016 CB CYS A 67 5.565 2.265 -14.911 1.00 0.00 C ATOM 1017 SG CYS A 67 5.305 1.274 -13.408 1.00 0.00 S ATOM 0 H CYS A 67 7.841 1.541 -14.121 1.00 0.00 H new ATOM 0 HA CYS A 67 6.846 3.838 -15.708 1.00 0.00 H new ATOM 0 HB2 CYS A 67 4.665 2.844 -15.116 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.713 1.595 -15.758 1.00 0.00 H new ATOM 0 HG CYS A 67 6.454 0.889 -12.938 1.00 0.00 H new ATOM 1023 N THR A 68 6.346 5.518 -13.926 1.00 0.00 N ATOM 1024 CA THR A 68 5.922 6.490 -12.883 1.00 0.00 C ATOM 1025 C THR A 68 4.411 6.304 -12.538 1.00 0.00 C ATOM 1026 O THR A 68 3.524 6.408 -13.390 1.00 0.00 O ATOM 1027 CB THR A 68 6.234 7.978 -13.246 1.00 0.00 C ATOM 1028 OG1 THR A 68 6.322 8.242 -14.648 1.00 0.00 O ATOM 1029 CG2 THR A 68 7.506 8.518 -12.599 1.00 0.00 C ATOM 0 H THR A 68 6.422 5.915 -14.862 1.00 0.00 H new ATOM 0 HA THR A 68 6.521 6.268 -12.000 1.00 0.00 H new ATOM 0 HB THR A 68 5.364 8.495 -12.840 1.00 0.00 H new ATOM 0 HG1 THR A 68 6.754 9.110 -14.791 1.00 0.00 H new ATOM 0 HG21 THR A 68 7.654 9.555 -12.899 1.00 0.00 H new ATOM 0 HG22 THR A 68 7.414 8.463 -11.514 1.00 0.00 H new ATOM 0 HG23 THR A 68 8.360 7.922 -12.921 1.00 0.00 H new ATOM 1037 N LEU A 69 4.132 6.057 -11.252 1.00 0.00 N ATOM 1038 CA LEU A 69 2.768 5.784 -10.749 1.00 0.00 C ATOM 1039 C LEU A 69 1.893 7.078 -10.649 1.00 0.00 C ATOM 1040 O LEU A 69 2.330 8.113 -10.133 1.00 0.00 O ATOM 1041 CB LEU A 69 2.959 5.068 -9.389 1.00 0.00 C ATOM 1042 CG LEU A 69 1.732 4.296 -8.859 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.525 2.976 -9.618 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.918 4.030 -7.359 1.00 0.00 C ATOM 0 H LEU A 69 4.845 6.039 -10.523 1.00 0.00 H new ATOM 0 HA LEU A 69 2.209 5.153 -11.440 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.792 4.371 -9.481 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.246 5.811 -8.645 1.00 0.00 H new ATOM 0 HG LEU A 69 0.841 4.903 -9.019 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.653 2.459 -9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.369 3.185 -10.676 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.406 2.346 -9.499 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.055 3.485 -6.976 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.820 3.438 -7.204 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.011 4.979 -6.830 1.00 0.00 H new ATOM 1056 N GLY A 70 0.676 7.021 -11.213 1.00 0.00 N ATOM 1057 CA GLY A 70 -0.078 8.248 -11.594 1.00 0.00 C ATOM 1058 C GLY A 70 0.183 8.844 -13.003 1.00 0.00 C ATOM 1059 O GLY A 70 -0.703 9.516 -13.533 1.00 0.00 O ATOM 0 H GLY A 70 0.187 6.149 -11.418 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.142 8.026 -11.515 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.142 9.020 -10.857 1.00 0.00 H new ATOM 1063 N GLU A 71 1.380 8.659 -13.587 1.00 0.00 N ATOM 1064 CA GLU A 71 1.843 9.411 -14.776 1.00 0.00 C ATOM 1065 C GLU A 71 1.806 8.557 -16.091 1.00 0.00 C ATOM 1066 O GLU A 71 1.804 7.314 -16.083 1.00 0.00 O ATOM 1067 CB GLU A 71 3.268 9.845 -14.353 1.00 0.00 C ATOM 1068 CG GLU A 71 3.965 10.976 -15.141 1.00 0.00 C ATOM 1069 CD GLU A 71 5.305 11.285 -14.499 1.00 0.00 C ATOM 1070 OE1 GLU A 71 6.307 10.644 -14.881 1.00 0.00 O ATOM 1071 OE2 GLU A 71 5.341 12.082 -13.537 1.00 0.00 O ATOM 0 H GLU A 71 2.061 7.980 -13.248 1.00 0.00 H new ATOM 0 HA GLU A 71 1.204 10.255 -15.036 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.224 10.150 -13.307 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.909 8.965 -14.402 1.00 0.00 H new ATOM 0 HG2 GLU A 71 4.107 10.677 -16.179 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.339 11.868 -15.149 1.00 0.00 H new ATOM 1078 N LYS A 72 1.767 9.286 -17.223 1.00 0.00 N ATOM 1079 CA LYS A 72 1.794 8.701 -18.592 1.00 0.00 C ATOM 1080 C LYS A 72 3.253 8.687 -19.166 1.00 0.00 C ATOM 1081 O LYS A 72 3.856 9.745 -19.368 1.00 0.00 O ATOM 1082 CB LYS A 72 0.799 9.500 -19.490 1.00 0.00 C ATOM 1083 CG LYS A 72 0.273 8.718 -20.720 1.00 0.00 C ATOM 1084 CD LYS A 72 -0.499 9.599 -21.734 1.00 0.00 C ATOM 1085 CE LYS A 72 -1.466 8.801 -22.637 1.00 0.00 C ATOM 1086 NZ LYS A 72 -1.935 9.632 -23.778 1.00 0.00 N ATOM 0 H LYS A 72 1.715 10.305 -17.221 1.00 0.00 H new ATOM 0 HA LYS A 72 1.475 7.659 -18.566 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.051 9.810 -18.882 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.291 10.409 -19.836 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.115 8.248 -21.228 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.381 7.916 -20.377 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.065 10.355 -21.189 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.218 10.128 -22.362 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.966 7.909 -23.013 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -2.322 8.464 -22.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.228 9.013 -24.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.742 10.213 -23.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.163 10.251 -24.097 1.00 0.00 H new ATOM 1100 N PHE A 73 3.807 7.490 -19.420 1.00 0.00 N ATOM 1101 CA PHE A 73 5.211 7.303 -19.915 1.00 0.00 C ATOM 1102 C PHE A 73 5.237 6.418 -21.210 1.00 0.00 C ATOM 1103 O PHE A 73 4.435 5.488 -21.348 1.00 0.00 O ATOM 1104 CB PHE A 73 6.105 6.733 -18.760 1.00 0.00 C ATOM 1105 CG PHE A 73 5.913 5.237 -18.425 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.741 4.830 -17.785 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.763 4.272 -18.983 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.363 3.494 -17.808 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.403 2.926 -18.960 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.188 2.542 -18.396 1.00 0.00 C ATOM 0 H PHE A 73 3.304 6.612 -19.292 1.00 0.00 H new ATOM 0 HA PHE A 73 5.630 8.267 -20.204 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.150 6.894 -19.024 1.00 0.00 H new ATOM 0 HB3 PHE A 73 5.911 7.314 -17.858 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.127 5.555 -17.271 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.698 4.572 -19.431 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.424 3.193 -17.367 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.064 2.182 -19.379 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.887 1.505 -18.416 1.00 0.00 H new ATOM 1120 N GLU A 74 6.184 6.638 -22.139 1.00 0.00 N ATOM 1121 CA GLU A 74 6.234 5.864 -23.414 1.00 0.00 C ATOM 1122 C GLU A 74 6.930 4.466 -23.270 1.00 0.00 C ATOM 1123 O GLU A 74 8.161 4.355 -23.249 1.00 0.00 O ATOM 1124 CB GLU A 74 6.852 6.770 -24.509 1.00 0.00 C ATOM 1125 CG GLU A 74 6.575 6.263 -25.946 1.00 0.00 C ATOM 1126 CD GLU A 74 6.781 7.285 -27.051 1.00 0.00 C ATOM 1127 OE1 GLU A 74 5.911 8.169 -27.211 1.00 0.00 O ATOM 1128 OE2 GLU A 74 7.788 7.187 -27.782 1.00 0.00 O ATOM 0 H GLU A 74 6.922 7.335 -22.043 1.00 0.00 H new ATOM 0 HA GLU A 74 5.220 5.599 -23.714 1.00 0.00 H new ATOM 0 HB2 GLU A 74 6.455 7.779 -24.404 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.929 6.834 -24.354 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.221 5.407 -26.141 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.547 5.904 -25.994 1.00 0.00 H new ATOM 1135 N GLU A 75 6.122 3.394 -23.194 1.00 0.00 N ATOM 1136 CA GLU A 75 6.610 2.000 -23.066 1.00 0.00 C ATOM 1137 C GLU A 75 6.852 1.369 -24.473 1.00 0.00 C ATOM 1138 O GLU A 75 5.953 1.286 -25.316 1.00 0.00 O ATOM 1139 CB GLU A 75 5.570 1.232 -22.206 1.00 0.00 C ATOM 1140 CG GLU A 75 6.077 -0.105 -21.607 1.00 0.00 C ATOM 1141 CD GLU A 75 5.885 -1.352 -22.456 1.00 0.00 C ATOM 1142 OE1 GLU A 75 4.726 -1.801 -22.583 1.00 0.00 O ATOM 1143 OE2 GLU A 75 6.882 -1.904 -22.962 1.00 0.00 O ATOM 0 H GLU A 75 5.105 3.466 -23.219 1.00 0.00 H new ATOM 0 HA GLU A 75 7.578 1.952 -22.568 1.00 0.00 H new ATOM 0 HB2 GLU A 75 5.246 1.879 -21.391 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.692 1.029 -22.819 1.00 0.00 H new ATOM 0 HG2 GLU A 75 7.141 0.000 -21.393 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.574 -0.263 -20.653 1.00 0.00 H new ATOM 1150 N THR A 76 8.098 0.951 -24.739 1.00 0.00 N ATOM 1151 CA THR A 76 8.482 0.376 -26.065 1.00 0.00 C ATOM 1152 C THR A 76 8.259 -1.168 -26.064 1.00 0.00 C ATOM 1153 O THR A 76 9.111 -1.948 -25.625 1.00 0.00 O ATOM 1154 CB THR A 76 9.918 0.843 -26.446 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.966 2.267 -26.476 1.00 0.00 O ATOM 1156 CG2 THR A 76 10.405 0.364 -27.825 1.00 0.00 C ATOM 0 H THR A 76 8.864 0.994 -24.066 1.00 0.00 H new ATOM 0 HA THR A 76 7.837 0.753 -26.859 1.00 0.00 H new ATOM 0 HB THR A 76 10.564 0.404 -25.686 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.871 2.559 -26.714 1.00 0.00 H new ATOM 0 HG21 THR A 76 11.413 0.737 -28.004 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.411 -0.726 -27.850 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.736 0.741 -28.598 1.00 0.00 H new ATOM 1164 N THR A 77 7.095 -1.584 -26.589 1.00 0.00 N ATOM 1165 CA THR A 77 6.655 -3.012 -26.578 1.00 0.00 C ATOM 1166 C THR A 77 7.499 -3.940 -27.520 1.00 0.00 C ATOM 1167 O THR A 77 8.120 -3.484 -28.486 1.00 0.00 O ATOM 1168 CB THR A 77 5.128 -3.113 -26.909 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.841 -2.612 -28.211 1.00 0.00 O ATOM 1170 CG2 THR A 77 4.186 -2.402 -25.923 1.00 0.00 C ATOM 0 H THR A 77 6.427 -0.954 -27.033 1.00 0.00 H new ATOM 0 HA THR A 77 6.831 -3.381 -25.568 1.00 0.00 H new ATOM 0 HB THR A 77 4.932 -4.183 -26.834 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.601 -1.664 -28.151 1.00 0.00 H new ATOM 0 HG21 THR A 77 3.154 -2.535 -26.246 1.00 0.00 H new ATOM 0 HG22 THR A 77 4.312 -2.828 -24.928 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.424 -1.339 -25.895 1.00 0.00 H new ATOM 1178 N ALA A 78 7.490 -5.263 -27.249 1.00 0.00 N ATOM 1179 CA ALA A 78 8.233 -6.281 -28.054 1.00 0.00 C ATOM 1180 C ALA A 78 8.120 -6.262 -29.620 1.00 0.00 C ATOM 1181 O ALA A 78 9.118 -6.506 -30.302 1.00 0.00 O ATOM 1182 CB ALA A 78 7.823 -7.651 -27.479 1.00 0.00 C ATOM 0 H ALA A 78 6.970 -5.664 -26.468 1.00 0.00 H new ATOM 0 HA ALA A 78 9.289 -6.033 -27.945 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.334 -8.443 -28.026 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.100 -7.701 -26.426 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.745 -7.779 -27.578 1.00 0.00 H new ATOM 1188 N ASP A 79 6.939 -5.945 -30.175 1.00 0.00 N ATOM 1189 CA ASP A 79 6.748 -5.692 -31.634 1.00 0.00 C ATOM 1190 C ASP A 79 7.429 -4.413 -32.234 1.00 0.00 C ATOM 1191 O ASP A 79 7.813 -4.421 -33.407 1.00 0.00 O ATOM 1192 CB ASP A 79 5.224 -5.574 -31.911 1.00 0.00 C ATOM 1193 CG ASP A 79 4.378 -6.798 -31.613 1.00 0.00 C ATOM 1194 OD1 ASP A 79 4.248 -7.661 -32.499 1.00 0.00 O ATOM 1195 OD2 ASP A 79 3.768 -6.855 -30.521 1.00 0.00 O ATOM 0 H ASP A 79 6.080 -5.854 -29.633 1.00 0.00 H new ATOM 0 HA ASP A 79 7.237 -6.536 -32.120 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.836 -4.741 -31.324 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.089 -5.315 -32.961 1.00 0.00 H new ATOM 1200 N GLY A 80 7.469 -3.297 -31.484 1.00 0.00 N ATOM 1201 CA GLY A 80 7.660 -1.937 -32.060 1.00 0.00 C ATOM 1202 C GLY A 80 6.577 -0.864 -31.771 1.00 0.00 C ATOM 1203 O GLY A 80 6.839 0.305 -32.061 1.00 0.00 O ATOM 0 H GLY A 80 7.372 -3.303 -30.469 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.615 -1.553 -31.700 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.746 -2.042 -33.142 1.00 0.00 H new ATOM 1207 N ARG A 81 5.396 -1.199 -31.202 1.00 0.00 N ATOM 1208 CA ARG A 81 4.399 -0.178 -30.761 1.00 0.00 C ATOM 1209 C ARG A 81 4.915 0.565 -29.486 1.00 0.00 C ATOM 1210 O ARG A 81 5.071 -0.042 -28.417 1.00 0.00 O ATOM 1211 CB ARG A 81 3.006 -0.799 -30.451 1.00 0.00 C ATOM 1212 CG ARG A 81 2.215 -1.461 -31.610 1.00 0.00 C ATOM 1213 CD ARG A 81 0.877 -2.111 -31.156 1.00 0.00 C ATOM 1214 NE ARG A 81 1.057 -3.210 -30.163 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.610 -4.393 -30.434 1.00 0.00 C ATOM 1216 NH1 ARG A 81 1.684 -4.902 -31.636 1.00 0.00 N ATOM 1217 NH2 ARG A 81 2.128 -5.077 -29.459 1.00 0.00 N ATOM 0 H ARG A 81 5.105 -2.162 -31.035 1.00 0.00 H new ATOM 0 HA ARG A 81 4.281 0.521 -31.589 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.144 -1.550 -29.673 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.380 -0.013 -30.029 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.005 -0.710 -32.371 1.00 0.00 H new ATOM 0 HG3 ARG A 81 2.840 -2.222 -32.077 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.237 -1.342 -30.723 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.358 -2.503 -32.030 1.00 0.00 H new ATOM 0 HE ARG A 81 0.734 -3.045 -29.210 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.306 -4.388 -32.432 1.00 0.00 H new ATOM 0 HH12 ARG A 81 2.120 -5.813 -31.778 1.00 0.00 H new ATOM 0 HH21 ARG A 81 2.107 -4.707 -28.509 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.556 -5.984 -29.644 1.00 0.00 H new ATOM 1231 N LYS A 82 5.162 1.877 -29.615 1.00 0.00 N ATOM 1232 CA LYS A 82 5.507 2.743 -28.458 1.00 0.00 C ATOM 1233 C LYS A 82 4.200 3.294 -27.810 1.00 0.00 C ATOM 1234 O LYS A 82 3.479 4.107 -28.396 1.00 0.00 O ATOM 1235 CB LYS A 82 6.487 3.854 -28.910 1.00 0.00 C ATOM 1236 CG LYS A 82 7.927 3.364 -29.199 1.00 0.00 C ATOM 1237 CD LYS A 82 8.958 4.510 -29.114 1.00 0.00 C ATOM 1238 CE LYS A 82 10.413 4.115 -29.422 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.602 3.875 -30.878 1.00 0.00 N ATOM 0 H LYS A 82 5.131 2.370 -30.507 1.00 0.00 H new ATOM 0 HA LYS A 82 6.022 2.169 -27.687 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.091 4.326 -29.809 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.527 4.622 -28.137 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.194 2.583 -28.487 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.965 2.916 -30.192 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.659 5.297 -29.807 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.920 4.936 -28.112 1.00 0.00 H new ATOM 0 HE2 LYS A 82 11.086 4.905 -29.089 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.676 3.216 -28.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.591 3.610 -31.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.975 3.105 -31.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.373 4.742 -31.405 1.00 0.00 H new ATOM 1253 N THR A 83 3.881 2.781 -26.615 1.00 0.00 N ATOM 1254 CA THR A 83 2.549 2.950 -25.979 1.00 0.00 C ATOM 1255 C THR A 83 2.658 3.956 -24.800 1.00 0.00 C ATOM 1256 O THR A 83 3.254 3.669 -23.753 1.00 0.00 O ATOM 1257 CB THR A 83 1.954 1.572 -25.551 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.823 0.883 -24.658 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.667 0.606 -26.712 1.00 0.00 C ATOM 0 H THR A 83 4.534 2.235 -26.053 1.00 0.00 H new ATOM 0 HA THR A 83 1.849 3.368 -26.703 1.00 0.00 H new ATOM 0 HB THR A 83 1.009 1.841 -25.079 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.582 -0.067 -24.634 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.256 -0.324 -26.319 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.948 1.060 -27.394 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.593 0.396 -27.248 1.00 0.00 H new ATOM 1267 N GLN A 84 2.039 5.139 -24.957 1.00 0.00 N ATOM 1268 CA GLN A 84 1.960 6.167 -23.885 1.00 0.00 C ATOM 1269 C GLN A 84 1.028 5.664 -22.737 1.00 0.00 C ATOM 1270 O GLN A 84 -0.199 5.608 -22.856 1.00 0.00 O ATOM 1271 CB GLN A 84 1.479 7.498 -24.521 1.00 0.00 C ATOM 1272 CG GLN A 84 2.533 8.300 -25.331 1.00 0.00 C ATOM 1273 CD GLN A 84 3.567 9.084 -24.506 1.00 0.00 C ATOM 1274 OE1 GLN A 84 3.442 9.297 -23.303 1.00 0.00 O ATOM 1275 NE2 GLN A 84 4.603 9.587 -25.131 1.00 0.00 N ATOM 0 H GLN A 84 1.579 5.416 -25.824 1.00 0.00 H new ATOM 0 HA GLN A 84 2.936 6.345 -23.433 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.639 7.277 -25.179 1.00 0.00 H new ATOM 0 HB3 GLN A 84 1.101 8.139 -23.725 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.067 7.606 -25.980 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.007 9.002 -25.978 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.725 9.422 -26.130 1.00 0.00 H new ATOM 0 HE22 GLN A 84 5.287 10.144 -24.618 1.00 0.00 H new ATOM 1284 N THR A 85 1.651 5.199 -21.652 1.00 0.00 N ATOM 1285 CA THR A 85 1.025 4.249 -20.704 1.00 0.00 C ATOM 1286 C THR A 85 0.809 4.973 -19.350 1.00 0.00 C ATOM 1287 O THR A 85 1.788 5.283 -18.666 1.00 0.00 O ATOM 1288 CB THR A 85 1.920 2.972 -20.614 1.00 0.00 C ATOM 1289 OG1 THR A 85 1.997 2.325 -21.885 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.407 1.904 -19.633 1.00 0.00 C ATOM 0 H THR A 85 2.603 5.464 -21.398 1.00 0.00 H new ATOM 0 HA THR A 85 0.042 3.915 -21.038 1.00 0.00 H new ATOM 0 HB THR A 85 2.883 3.344 -20.264 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.599 2.828 -22.472 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.088 1.053 -19.633 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.355 2.327 -18.630 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.414 1.575 -19.940 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.452 5.225 -18.936 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.733 5.686 -17.539 1.00 0.00 C ATOM 1300 C VAL A 86 -0.753 4.463 -16.566 1.00 0.00 C ATOM 1301 O VAL A 86 -1.619 3.586 -16.679 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.906 6.719 -17.407 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.324 6.208 -17.718 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.951 7.381 -16.009 1.00 0.00 C ATOM 0 H VAL A 86 -1.279 5.124 -19.524 1.00 0.00 H new ATOM 0 HA VAL A 86 0.097 6.312 -17.211 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.649 7.433 -18.190 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.040 7.020 -17.589 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.364 5.849 -18.746 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.574 5.393 -17.039 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.780 8.088 -15.968 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.090 6.614 -15.247 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.015 7.909 -15.826 1.00 0.00 H new ATOM 1314 N CYS A 87 0.228 4.396 -15.640 1.00 0.00 N ATOM 1315 CA CYS A 87 0.256 3.318 -14.606 1.00 0.00 C ATOM 1316 C CYS A 87 -0.370 3.821 -13.275 1.00 0.00 C ATOM 1317 O CYS A 87 0.205 4.671 -12.594 1.00 0.00 O ATOM 1318 CB CYS A 87 1.691 2.791 -14.414 1.00 0.00 C ATOM 1319 SG CYS A 87 2.189 1.767 -15.841 1.00 0.00 S ATOM 0 H CYS A 87 1.001 5.058 -15.580 1.00 0.00 H new ATOM 0 HA CYS A 87 -0.351 2.481 -14.950 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.380 3.628 -14.300 1.00 0.00 H new ATOM 0 HB3 CYS A 87 1.750 2.203 -13.498 1.00 0.00 H new ATOM 0 HG CYS A 87 3.185 1.004 -15.501 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.556 3.312 -12.908 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.371 3.887 -11.798 1.00 0.00 C ATOM 1327 C ASN A 88 -2.903 2.783 -10.830 1.00 0.00 C ATOM 1328 O ASN A 88 -3.615 1.860 -11.238 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.465 4.834 -12.377 1.00 0.00 C ATOM 1330 CG ASN A 88 -4.476 4.271 -13.395 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -4.140 3.841 -14.493 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -5.751 4.306 -13.103 1.00 0.00 N ATOM 0 H ASN A 88 -1.983 2.502 -13.357 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.736 4.507 -11.165 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.032 5.235 -11.537 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.957 5.675 -12.848 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -6.439 3.980 -13.782 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -6.057 4.659 -12.196 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.551 2.880 -9.533 1.00 0.00 N ATOM 1340 CA PHE A 89 -2.986 1.903 -8.497 1.00 0.00 C ATOM 1341 C PHE A 89 -4.369 2.267 -7.854 1.00 0.00 C ATOM 1342 O PHE A 89 -4.613 3.418 -7.477 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.837 1.792 -7.452 1.00 0.00 C ATOM 1344 CG PHE A 89 -2.037 0.693 -6.397 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -1.706 -0.637 -6.679 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.651 1.007 -5.180 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.009 -1.641 -5.763 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.961 0.000 -4.273 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.643 -1.321 -4.568 1.00 0.00 C ATOM 0 H PHE A 89 -1.962 3.629 -9.169 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.162 0.930 -8.956 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.901 1.606 -7.979 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.732 2.751 -6.944 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.215 -0.885 -7.608 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.885 2.035 -4.944 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.752 -2.667 -5.981 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.448 0.244 -3.340 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.890 -2.103 -3.865 1.00 0.00 H new ATOM 1359 N THR A 90 -5.233 1.253 -7.667 1.00 0.00 N ATOM 1360 CA THR A 90 -6.515 1.394 -6.914 1.00 0.00 C ATOM 1361 C THR A 90 -6.755 0.164 -5.978 1.00 0.00 C ATOM 1362 O THR A 90 -6.996 -0.948 -6.457 1.00 0.00 O ATOM 1363 CB THR A 90 -7.701 1.721 -7.877 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.881 1.952 -7.120 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.059 0.678 -8.951 1.00 0.00 C ATOM 0 H THR A 90 -5.073 0.312 -8.028 1.00 0.00 H new ATOM 0 HA THR A 90 -6.446 2.253 -6.246 1.00 0.00 H new ATOM 0 HB THR A 90 -7.335 2.592 -8.420 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.623 2.159 -7.726 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.899 1.040 -9.544 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.199 0.515 -9.601 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.332 -0.261 -8.470 1.00 0.00 H new ATOM 1373 N ASP A 91 -6.722 0.374 -4.641 1.00 0.00 N ATOM 1374 CA ASP A 91 -7.105 -0.642 -3.606 1.00 0.00 C ATOM 1375 C ASP A 91 -6.152 -1.890 -3.515 1.00 0.00 C ATOM 1376 O ASP A 91 -5.231 -1.918 -2.693 1.00 0.00 O ATOM 1377 CB ASP A 91 -8.643 -0.900 -3.662 1.00 0.00 C ATOM 1378 CG ASP A 91 -9.204 -1.688 -2.484 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -9.265 -1.134 -1.367 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -9.584 -2.862 -2.676 1.00 0.00 O ATOM 0 H ASP A 91 -6.426 1.262 -4.235 1.00 0.00 H new ATOM 0 HA ASP A 91 -6.921 -0.225 -2.616 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.156 0.060 -3.716 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -8.874 -1.437 -4.582 1.00 0.00 H new ATOM 1385 N GLY A 92 -6.360 -2.887 -4.386 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.380 -3.984 -4.630 1.00 0.00 C ATOM 1387 C GLY A 92 -5.122 -4.313 -6.121 1.00 0.00 C ATOM 1388 O GLY A 92 -5.060 -5.490 -6.488 1.00 0.00 O ATOM 0 H GLY A 92 -7.208 -2.967 -4.947 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.432 -3.714 -4.164 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.735 -4.886 -4.131 1.00 0.00 H new ATOM 1392 N ALA A 93 -4.973 -3.279 -6.970 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.954 -3.426 -8.444 1.00 0.00 C ATOM 1394 C ALA A 93 -4.068 -2.331 -9.104 1.00 0.00 C ATOM 1395 O ALA A 93 -4.378 -1.138 -9.019 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.410 -3.323 -8.951 1.00 0.00 C ATOM 0 H ALA A 93 -4.862 -2.315 -6.656 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.526 -4.392 -8.713 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.426 -3.428 -10.036 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -7.009 -4.115 -8.501 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.824 -2.353 -8.674 1.00 0.00 H new ATOM 1402 N LEU A 94 -2.994 -2.731 -9.806 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.215 -1.808 -10.677 1.00 0.00 C ATOM 1404 C LEU A 94 -2.797 -1.818 -12.124 1.00 0.00 C ATOM 1405 O LEU A 94 -2.652 -2.799 -12.862 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.714 -2.202 -10.585 1.00 0.00 C ATOM 1407 CG LEU A 94 0.290 -1.437 -11.486 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.353 0.063 -11.155 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.694 -2.044 -11.342 1.00 0.00 C ATOM 0 H LEU A 94 -2.638 -3.687 -9.793 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.296 -0.773 -10.343 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.398 -2.077 -9.549 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.631 -3.264 -10.818 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.064 -1.538 -12.512 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.071 0.551 -11.814 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.632 0.509 -11.297 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.665 0.194 -10.119 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.392 -1.500 -11.978 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.017 -1.971 -10.304 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.670 -3.092 -11.642 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.440 -0.712 -12.537 1.00 0.00 N ATOM 1422 CA VAL A 95 -3.998 -0.567 -13.911 1.00 0.00 C ATOM 1423 C VAL A 95 -2.866 -0.034 -14.851 1.00 0.00 C ATOM 1424 O VAL A 95 -2.479 1.138 -14.804 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.295 0.316 -13.924 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -5.900 0.474 -15.341 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.428 -0.221 -13.014 1.00 0.00 C ATOM 0 H VAL A 95 -3.591 0.103 -11.943 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.324 -1.536 -14.288 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.944 1.276 -13.545 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.795 1.094 -15.288 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.170 0.946 -15.998 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.162 -0.507 -15.736 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.290 0.443 -13.077 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.715 -1.220 -13.341 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.077 -0.264 -11.983 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.371 -0.915 -15.732 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.494 -0.537 -16.868 1.00 0.00 C ATOM 1439 C GLN A 96 -2.392 -0.145 -18.089 1.00 0.00 C ATOM 1440 O GLN A 96 -2.838 -0.999 -18.863 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.547 -1.753 -17.077 1.00 0.00 C ATOM 1442 CG GLN A 96 0.418 -1.684 -18.290 1.00 0.00 C ATOM 1443 CD GLN A 96 1.282 -2.936 -18.510 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.302 -3.893 -17.738 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.033 -2.982 -19.584 1.00 0.00 N ATOM 0 H GLN A 96 -2.564 -1.915 -15.683 1.00 0.00 H new ATOM 0 HA GLN A 96 -0.872 0.343 -16.701 1.00 0.00 H new ATOM 0 HB2 GLN A 96 0.050 -1.878 -16.174 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.160 -2.648 -17.181 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -0.169 -1.504 -19.191 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.077 -0.825 -18.162 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.034 -2.201 -20.240 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.616 -3.799 -19.764 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.678 1.160 -18.239 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.507 1.680 -19.359 1.00 0.00 C ATOM 1456 C HIS A 97 -2.591 2.081 -20.557 1.00 0.00 C ATOM 1457 O HIS A 97 -2.055 3.191 -20.590 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.324 2.862 -18.778 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.275 3.541 -19.763 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -4.899 4.499 -20.695 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.584 3.123 -20.006 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.038 4.562 -21.460 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.119 3.818 -21.075 1.00 0.00 N ATOM 0 H HIS A 97 -2.349 1.883 -17.599 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.194 0.935 -19.760 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.904 2.500 -17.929 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.629 3.609 -18.394 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.105 2.365 -19.440 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.079 5.183 -22.343 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -8.060 3.785 -21.468 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.463 1.189 -21.542 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.569 1.394 -22.723 1.00 0.00 C ATOM 1474 C GLN A 98 -2.328 2.163 -23.846 1.00 0.00 C ATOM 1475 O GLN A 98 -3.310 1.632 -24.364 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.111 -0.001 -23.244 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.177 -0.837 -22.324 1.00 0.00 C ATOM 1478 CD GLN A 98 1.283 -0.978 -22.775 1.00 0.00 C ATOM 1479 OE1 GLN A 98 1.589 -1.352 -23.904 1.00 0.00 O ATOM 1480 NE2 GLN A 98 2.235 -0.709 -21.919 1.00 0.00 N ATOM 0 H GLN A 98 -2.967 0.302 -21.560 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.701 1.986 -22.432 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.003 -0.594 -23.447 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.602 0.146 -24.197 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.185 -0.387 -21.331 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.601 -1.836 -22.225 1.00 0.00 H new ATOM 0 HE21 GLN A 98 2.000 -0.397 -20.977 1.00 0.00 H new ATOM 0 HE22 GLN A 98 3.212 -0.811 -22.194 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.897 3.381 -24.225 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.603 4.220 -25.234 1.00 0.00 C ATOM 1491 C GLU A 99 -1.641 4.594 -26.410 1.00 0.00 C ATOM 1492 O GLU A 99 -0.543 5.122 -26.201 1.00 0.00 O ATOM 1493 CB GLU A 99 -3.173 5.441 -24.456 1.00 0.00 C ATOM 1494 CG GLU A 99 -4.224 6.292 -25.207 1.00 0.00 C ATOM 1495 CD GLU A 99 -3.676 7.356 -26.147 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -3.229 8.409 -25.640 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -3.691 7.156 -27.379 1.00 0.00 O ATOM 0 H GLU A 99 -1.055 3.817 -23.848 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.426 3.695 -25.719 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -3.621 5.080 -23.530 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.342 6.089 -24.177 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.861 5.621 -25.783 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -4.860 6.781 -24.469 1.00 0.00 H new ATOM 1504 N TRP A 100 -2.045 4.298 -27.657 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.244 4.602 -28.877 1.00 0.00 C ATOM 1506 C TRP A 100 -2.203 4.993 -30.049 1.00 0.00 C ATOM 1507 O TRP A 100 -3.069 4.208 -30.440 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.270 3.425 -29.199 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.873 2.105 -29.711 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -1.011 1.761 -31.071 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.498 1.089 -29.004 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.701 0.542 -31.235 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -2.016 0.161 -29.941 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.741 0.916 -27.615 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.802 -0.928 -29.501 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.512 -0.171 -27.205 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -3.054 -1.065 -28.134 1.00 0.00 C ATOM 0 H TRP A 100 -2.935 3.841 -27.858 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.601 5.466 -28.709 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.443 3.777 -29.944 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.297 3.204 -28.294 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.634 2.358 -31.888 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.918 0.054 -32.104 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.338 1.611 -26.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.200 -1.641 -30.208 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.694 -0.325 -26.152 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.678 -1.876 -27.788 1.00 0.00 H new ATOM 1528 N ASP A 101 -2.074 6.208 -30.609 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.982 6.729 -31.692 1.00 0.00 C ATOM 1530 C ASP A 101 -4.517 6.927 -31.343 1.00 0.00 C ATOM 1531 O ASP A 101 -5.351 7.031 -32.250 1.00 0.00 O ATOM 1532 CB ASP A 101 -2.842 5.933 -33.030 1.00 0.00 C ATOM 1533 CG ASP A 101 -1.465 5.539 -33.564 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -0.564 6.396 -33.644 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -1.301 4.354 -33.942 1.00 0.00 O ATOM 0 H ASP A 101 -1.346 6.869 -30.338 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.600 7.743 -31.807 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -3.417 5.014 -32.918 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -3.330 6.522 -33.806 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.929 6.928 -30.062 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.336 6.592 -29.674 1.00 0.00 C ATOM 1542 C GLY A 102 -6.753 5.093 -29.571 1.00 0.00 C ATOM 1543 O GLY A 102 -7.801 4.795 -28.997 1.00 0.00 O ATOM 0 H GLY A 102 -4.322 7.154 -29.274 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.530 7.055 -28.707 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.999 7.070 -30.395 1.00 0.00 H new ATOM 1547 N LYS A 103 -5.957 4.153 -30.108 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.109 2.688 -29.876 1.00 0.00 C ATOM 1549 C LYS A 103 -5.540 2.333 -28.463 1.00 0.00 C ATOM 1550 O LYS A 103 -4.410 2.724 -28.143 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.292 1.897 -30.945 1.00 0.00 C ATOM 1552 CG LYS A 103 -5.493 2.223 -32.452 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.172 2.067 -33.240 1.00 0.00 C ATOM 1554 CE LYS A 103 -4.230 2.622 -34.672 1.00 0.00 C ATOM 1555 NZ LYS A 103 -2.851 2.719 -35.223 1.00 0.00 N ATOM 0 H LYS A 103 -5.177 4.382 -30.725 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.164 2.423 -29.943 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.235 2.036 -30.718 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.511 0.838 -30.807 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.250 1.561 -32.872 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.865 3.242 -32.560 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.375 2.574 -32.697 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -3.908 1.010 -33.281 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.839 1.973 -35.301 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -4.704 3.604 -34.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -2.896 2.795 -36.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.380 3.561 -34.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -2.312 1.869 -34.962 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.290 1.609 -27.616 1.00 0.00 N ATOM 1570 CA GLU A 104 -5.859 1.373 -26.210 1.00 0.00 C ATOM 1571 C GLU A 104 -6.144 -0.053 -25.651 1.00 0.00 C ATOM 1572 O GLU A 104 -7.137 -0.703 -25.990 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.364 2.507 -25.275 1.00 0.00 C ATOM 1574 CG GLU A 104 -7.896 2.694 -25.131 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.263 3.633 -24.000 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -7.916 4.831 -24.055 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -8.825 3.157 -22.989 1.00 0.00 O ATOM 0 H GLU A 104 -7.182 1.181 -27.864 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.770 1.410 -26.232 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -5.953 2.330 -24.281 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -5.943 3.447 -25.631 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.301 3.081 -26.066 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.362 1.724 -24.959 1.00 0.00 H new ATOM 1584 N SER A 105 -5.249 -0.505 -24.752 1.00 0.00 N ATOM 1585 CA SER A 105 -5.455 -1.723 -23.929 1.00 0.00 C ATOM 1586 C SER A 105 -5.470 -1.395 -22.405 1.00 0.00 C ATOM 1587 O SER A 105 -4.665 -0.609 -21.890 1.00 0.00 O ATOM 1588 CB SER A 105 -4.402 -2.793 -24.287 1.00 0.00 C ATOM 1589 OG SER A 105 -4.702 -4.007 -23.594 1.00 0.00 O ATOM 0 H SER A 105 -4.360 -0.039 -24.572 1.00 0.00 H new ATOM 0 HA SER A 105 -6.438 -2.132 -24.161 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.397 -2.968 -25.363 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.406 -2.443 -24.016 1.00 0.00 H new ATOM 0 HG SER A 105 -5.669 -4.068 -23.444 1.00 0.00 H new ATOM 1595 N THR A 106 -6.405 -2.036 -21.689 1.00 0.00 N ATOM 1596 CA THR A 106 -6.597 -1.847 -20.224 1.00 0.00 C ATOM 1597 C THR A 106 -6.156 -3.156 -19.503 1.00 0.00 C ATOM 1598 O THR A 106 -6.757 -4.221 -19.688 1.00 0.00 O ATOM 1599 CB THR A 106 -8.055 -1.410 -19.871 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.997 -2.443 -20.119 1.00 0.00 O ATOM 1601 CG2 THR A 106 -8.564 -0.173 -20.629 1.00 0.00 C ATOM 0 H THR A 106 -7.057 -2.704 -22.101 1.00 0.00 H new ATOM 0 HA THR A 106 -5.974 -1.025 -19.871 1.00 0.00 H new ATOM 0 HB THR A 106 -7.982 -1.169 -18.810 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.529 -3.301 -20.197 1.00 0.00 H new ATOM 0 HG21 THR A 106 -9.584 0.051 -20.316 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.921 0.679 -20.408 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.549 -0.371 -21.701 1.00 0.00 H new ATOM 1609 N ILE A 107 -5.057 -3.085 -18.732 1.00 0.00 N ATOM 1610 CA ILE A 107 -4.367 -4.299 -18.201 1.00 0.00 C ATOM 1611 C ILE A 107 -4.380 -4.183 -16.643 1.00 0.00 C ATOM 1612 O ILE A 107 -3.558 -3.481 -16.046 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.963 -4.464 -18.894 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -3.087 -4.636 -20.442 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -2.135 -5.618 -18.271 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.781 -4.730 -21.239 1.00 0.00 C ATOM 0 H ILE A 107 -4.619 -2.206 -18.457 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.871 -5.235 -18.442 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.422 -3.536 -18.710 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.668 -5.537 -20.637 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.662 -3.795 -20.831 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -1.175 -5.694 -18.781 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.969 -5.416 -17.213 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.679 -6.556 -18.380 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -2.009 -4.847 -22.298 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.199 -3.821 -21.092 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.206 -5.589 -20.895 1.00 0.00 H new ATOM 1628 N THR A 108 -5.340 -4.861 -15.988 1.00 0.00 N ATOM 1629 CA THR A 108 -5.569 -4.731 -14.519 1.00 0.00 C ATOM 1630 C THR A 108 -4.794 -5.850 -13.756 1.00 0.00 C ATOM 1631 O THR A 108 -5.236 -7.003 -13.695 1.00 0.00 O ATOM 1632 CB THR A 108 -7.103 -4.727 -14.240 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.743 -3.699 -14.992 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.473 -4.448 -12.774 1.00 0.00 C ATOM 0 H THR A 108 -5.978 -5.511 -16.447 1.00 0.00 H new ATOM 0 HA THR A 108 -5.175 -3.786 -14.146 1.00 0.00 H new ATOM 0 HB THR A 108 -7.431 -5.730 -14.515 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.705 -3.710 -14.808 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.557 -4.462 -12.663 1.00 0.00 H new ATOM 0 HG22 THR A 108 -7.033 -5.214 -12.136 1.00 0.00 H new ATOM 0 HG23 THR A 108 -7.091 -3.469 -12.482 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.641 -5.494 -13.164 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.787 -6.441 -12.400 1.00 0.00 C ATOM 1644 C ARG A 109 -3.248 -6.499 -10.906 1.00 0.00 C ATOM 1645 O ARG A 109 -2.870 -5.632 -10.109 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.302 -5.982 -12.503 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.639 -5.857 -13.898 1.00 0.00 C ATOM 1648 CD ARG A 109 0.855 -5.502 -13.768 1.00 0.00 C ATOM 1649 NE ARG A 109 1.492 -5.403 -15.112 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.617 -6.005 -15.500 1.00 0.00 C ATOM 1651 NH1 ARG A 109 3.335 -6.792 -14.741 1.00 0.00 N ATOM 1652 NH2 ARG A 109 3.025 -5.791 -16.714 1.00 0.00 N ATOM 0 H ARG A 109 -3.269 -4.545 -13.197 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.881 -7.443 -12.820 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.226 -5.010 -12.016 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.703 -6.679 -11.917 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.748 -6.795 -14.442 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -1.150 -5.090 -14.480 1.00 0.00 H new ATOM 0 HD2 ARG A 109 0.964 -4.556 -13.238 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.364 -6.261 -13.174 1.00 0.00 H new ATOM 0 HE ARG A 109 1.022 -4.818 -15.802 1.00 0.00 H new ATOM 0 HH11 ARG A 109 3.044 -6.980 -13.782 1.00 0.00 H new ATOM 0 HH12 ARG A 109 4.186 -7.218 -15.109 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.490 -5.181 -17.332 1.00 0.00 H new ATOM 0 HH22 ARG A 109 3.881 -6.233 -17.050 1.00 0.00 H new ATOM 1666 N LYS A 110 -4.080 -7.489 -10.529 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.706 -7.544 -9.172 1.00 0.00 C ATOM 1668 C LYS A 110 -4.504 -8.903 -8.427 1.00 0.00 C ATOM 1669 O LYS A 110 -4.358 -9.970 -9.028 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.176 -7.043 -9.238 1.00 0.00 C ATOM 1671 CG LYS A 110 -7.206 -7.817 -10.093 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.625 -7.227 -9.894 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.722 -7.843 -10.781 1.00 0.00 C ATOM 1674 NZ LYS A 110 -9.671 -7.294 -12.160 1.00 0.00 N ATOM 0 H LYS A 110 -4.341 -8.266 -11.137 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.165 -6.850 -8.529 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.557 -7.012 -8.217 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.155 -6.016 -9.602 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.928 -7.764 -11.146 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -7.201 -8.871 -9.814 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.911 -7.354 -8.850 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.585 -6.155 -10.085 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -9.601 -8.926 -10.813 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -10.701 -7.644 -10.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.303 -7.844 -12.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -9.976 -6.300 -12.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -8.698 -7.354 -12.522 1.00 0.00 H new ATOM 1688 N LEU A 111 -4.447 -8.845 -7.086 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.817 -9.909 -6.255 1.00 0.00 C ATOM 1690 C LEU A 111 -4.875 -10.836 -5.575 1.00 0.00 C ATOM 1691 O LEU A 111 -5.737 -10.365 -4.826 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.886 -9.185 -5.229 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.518 -9.825 -4.886 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.617 -11.155 -4.121 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.604 -9.974 -6.112 1.00 0.00 C ATOM 0 H LEU A 111 -4.830 -8.071 -6.543 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.231 -10.587 -6.875 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.696 -8.181 -5.607 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.442 -9.075 -4.298 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.058 -9.109 -4.205 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.615 -11.535 -3.921 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.139 -10.994 -3.178 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.167 -11.880 -4.721 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.340 -10.428 -5.809 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -1.090 -10.608 -6.854 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.412 -8.992 -6.544 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.797 -12.155 -5.822 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.615 -13.170 -5.091 1.00 0.00 C ATOM 1709 C LYS A 112 -4.686 -14.310 -4.570 1.00 0.00 C ATOM 1710 O LYS A 112 -4.020 -14.973 -5.367 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.740 -13.775 -5.980 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.884 -12.825 -6.423 1.00 0.00 C ATOM 1713 CD LYS A 112 -7.679 -12.242 -7.841 1.00 0.00 C ATOM 1714 CE LYS A 112 -8.838 -11.393 -8.398 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.998 -12.238 -8.797 1.00 0.00 N ATOM 0 H LYS A 112 -4.176 -12.557 -6.524 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.098 -12.663 -4.255 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.277 -14.187 -6.877 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.185 -14.610 -5.439 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.829 -13.367 -6.393 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.964 -12.006 -5.709 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -6.778 -11.629 -7.833 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.497 -13.068 -8.529 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.155 -10.672 -7.645 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -8.490 -10.823 -9.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.758 -11.632 -9.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -9.701 -12.910 -9.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -10.346 -12.763 -7.969 1.00 0.00 H new ATOM 1729 N ASP A 113 -4.656 -14.568 -3.247 1.00 0.00 N ATOM 1730 CA ASP A 113 -4.050 -15.819 -2.660 1.00 0.00 C ATOM 1731 C ASP A 113 -2.524 -16.077 -2.970 1.00 0.00 C ATOM 1732 O ASP A 113 -2.100 -17.179 -3.349 1.00 0.00 O ATOM 1733 CB ASP A 113 -4.961 -17.051 -2.955 1.00 0.00 C ATOM 1734 CG ASP A 113 -6.406 -16.942 -2.466 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -6.674 -17.302 -1.301 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -7.267 -16.469 -3.241 1.00 0.00 O ATOM 0 H ASP A 113 -5.042 -13.934 -2.547 1.00 0.00 H new ATOM 0 HA ASP A 113 -4.024 -15.647 -1.584 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -4.973 -17.220 -4.032 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -4.508 -17.931 -2.499 1.00 0.00 H new ATOM 1741 N GLY A 114 -1.689 -15.026 -2.855 1.00 0.00 N ATOM 1742 CA GLY A 114 -0.315 -15.014 -3.442 1.00 0.00 C ATOM 1743 C GLY A 114 -0.163 -15.243 -4.973 1.00 0.00 C ATOM 1744 O GLY A 114 0.796 -15.900 -5.387 1.00 0.00 O ATOM 0 H GLY A 114 -1.934 -14.168 -2.361 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.140 -14.053 -3.203 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.271 -15.779 -2.932 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.108 -14.740 -5.786 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.147 -14.953 -7.260 1.00 0.00 C ATOM 1750 C LYS A 115 -1.521 -13.595 -7.929 1.00 0.00 C ATOM 1751 O LYS A 115 -2.531 -12.963 -7.591 1.00 0.00 O ATOM 1752 CB LYS A 115 -2.162 -16.057 -7.703 1.00 0.00 C ATOM 1753 CG LYS A 115 -2.128 -17.426 -6.981 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.811 -18.218 -7.158 1.00 0.00 C ATOM 1755 CE LYS A 115 -0.559 -19.306 -6.095 1.00 0.00 C ATOM 1756 NZ LYS A 115 -0.234 -18.689 -4.776 1.00 0.00 N ATOM 0 H LYS A 115 -1.879 -14.167 -5.443 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.164 -15.304 -7.576 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -3.166 -15.648 -7.591 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -2.009 -16.240 -8.767 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.298 -17.264 -5.917 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.954 -18.035 -7.347 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.815 -18.687 -8.142 1.00 0.00 H new ATOM 0 HD3 LYS A 115 0.023 -17.516 -7.143 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.441 -19.939 -5.999 1.00 0.00 H new ATOM 0 HE3 LYS A 115 0.261 -19.949 -6.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.238 -19.391 -4.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 0.398 -17.876 -4.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -1.111 -18.369 -4.317 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.712 -13.161 -8.905 1.00 0.00 N ATOM 1771 CA LEU A 116 -0.970 -11.917 -9.674 1.00 0.00 C ATOM 1772 C LEU A 116 -1.875 -12.248 -10.901 1.00 0.00 C ATOM 1773 O LEU A 116 -1.451 -12.879 -11.877 1.00 0.00 O ATOM 1774 CB LEU A 116 0.415 -11.320 -10.024 1.00 0.00 C ATOM 1775 CG LEU A 116 0.430 -9.970 -10.782 1.00 0.00 C ATOM 1776 CD1 LEU A 116 0.267 -8.788 -9.812 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.738 -9.832 -11.576 1.00 0.00 C ATOM 0 H LEU A 116 0.136 -13.652 -9.189 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.524 -11.164 -9.113 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.973 -11.193 -9.096 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.957 -12.051 -10.624 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.413 -9.955 -11.473 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.281 -7.853 -10.372 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.682 -8.880 -9.283 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.086 -8.792 -9.092 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.743 -8.880 -12.107 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.585 -9.869 -10.891 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.816 -10.648 -12.294 1.00 0.00 H new ATOM 1789 N VAL A 117 -3.145 -11.834 -10.811 1.00 0.00 N ATOM 1790 CA VAL A 117 -4.191 -12.138 -11.826 1.00 0.00 C ATOM 1791 C VAL A 117 -4.301 -10.888 -12.752 1.00 0.00 C ATOM 1792 O VAL A 117 -4.796 -9.826 -12.354 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.515 -12.560 -11.097 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.725 -12.722 -12.044 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -5.348 -13.879 -10.296 1.00 0.00 C ATOM 0 H VAL A 117 -3.489 -11.274 -10.031 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.947 -12.988 -12.463 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.718 -11.731 -10.419 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.602 -13.015 -11.467 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.922 -11.776 -12.548 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.506 -13.490 -12.786 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.290 -14.131 -9.809 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.064 -14.683 -10.975 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.572 -13.751 -9.541 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.787 -11.026 -13.983 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.609 -9.887 -14.925 1.00 0.00 C ATOM 1807 C VAL A 118 -4.732 -9.984 -16.007 1.00 0.00 C ATOM 1808 O VAL A 118 -4.631 -10.739 -16.982 1.00 0.00 O ATOM 1809 CB VAL A 118 -2.138 -9.876 -15.468 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.886 -8.771 -16.516 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -1.063 -9.734 -14.362 1.00 0.00 C ATOM 0 H VAL A 118 -3.481 -11.922 -14.362 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.727 -8.916 -14.444 1.00 0.00 H new ATOM 0 HB VAL A 118 -2.039 -10.856 -15.935 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.850 -8.817 -16.852 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.550 -8.919 -17.367 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -2.080 -7.795 -16.070 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -0.072 -9.734 -14.816 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.216 -8.798 -13.824 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.144 -10.569 -13.666 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.806 -9.206 -15.804 1.00 0.00 N ATOM 1822 CA GLU A 119 -7.000 -9.200 -16.690 1.00 0.00 C ATOM 1823 C GLU A 119 -6.825 -8.104 -17.789 1.00 0.00 C ATOM 1824 O GLU A 119 -6.743 -6.904 -17.496 1.00 0.00 O ATOM 1825 CB GLU A 119 -8.247 -8.992 -15.788 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.617 -10.223 -14.908 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.586 -9.980 -13.762 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -10.470 -9.100 -13.868 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -9.422 -10.611 -12.697 1.00 0.00 O ATOM 0 H GLU A 119 -5.880 -8.558 -15.020 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.127 -10.141 -17.225 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.071 -8.135 -15.137 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.100 -8.743 -16.420 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.043 -10.988 -15.557 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.696 -10.633 -14.493 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.692 -8.543 -19.051 1.00 0.00 N ATOM 1837 CA CYS A 120 -6.150 -7.715 -20.157 1.00 0.00 C ATOM 1838 C CYS A 120 -7.119 -7.679 -21.381 1.00 0.00 C ATOM 1839 O CYS A 120 -7.481 -8.715 -21.946 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.727 -8.246 -20.469 1.00 0.00 C ATOM 1841 SG CYS A 120 -4.587 -10.050 -20.388 1.00 0.00 S ATOM 0 H CYS A 120 -6.956 -9.485 -19.341 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.069 -6.667 -19.870 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -4.435 -7.912 -21.465 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -4.022 -7.804 -19.765 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.466 -10.530 -21.590 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.550 -6.471 -21.785 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.553 -6.276 -22.884 1.00 0.00 C ATOM 1848 C VAL A 121 -8.152 -5.050 -23.761 1.00 0.00 C ATOM 1849 O VAL A 121 -7.822 -3.982 -23.235 1.00 0.00 O ATOM 1850 CB VAL A 121 -10.028 -6.187 -22.356 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -10.349 -5.003 -21.419 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.083 -6.180 -23.495 1.00 0.00 C ATOM 0 H VAL A 121 -7.224 -5.598 -21.371 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.535 -7.164 -23.515 1.00 0.00 H new ATOM 0 HB VAL A 121 -10.095 -7.100 -21.764 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -11.396 -5.049 -21.121 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.717 -5.058 -20.533 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -10.161 -4.065 -21.941 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.083 -6.117 -23.065 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.912 -5.321 -24.144 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.996 -7.097 -24.077 1.00 0.00 H new ATOM 1862 N MET A 122 -8.264 -5.195 -25.095 1.00 0.00 N ATOM 1863 CA MET A 122 -8.167 -4.034 -26.029 1.00 0.00 C ATOM 1864 C MET A 122 -9.576 -3.399 -26.265 1.00 0.00 C ATOM 1865 O MET A 122 -9.901 -2.360 -25.688 1.00 0.00 O ATOM 1866 CB MET A 122 -7.349 -4.450 -27.288 1.00 0.00 C ATOM 1867 CG MET A 122 -7.039 -3.274 -28.236 1.00 0.00 C ATOM 1868 SD MET A 122 -6.202 -3.852 -29.720 1.00 0.00 S ATOM 1869 CE MET A 122 -6.110 -2.298 -30.631 1.00 0.00 C ATOM 0 H MET A 122 -8.420 -6.091 -25.556 1.00 0.00 H new ATOM 0 HA MET A 122 -7.598 -3.210 -25.599 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.412 -4.906 -26.968 1.00 0.00 H new ATOM 0 HB3 MET A 122 -7.903 -5.212 -27.836 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.965 -2.768 -28.509 1.00 0.00 H new ATOM 0 HG3 MET A 122 -6.415 -2.542 -27.723 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.538 -2.447 -31.547 1.00 0.00 H new ATOM 0 HE2 MET A 122 -7.117 -1.963 -30.882 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.620 -1.544 -30.015 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.410 -4.044 -27.090 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.821 -3.632 -27.343 1.00 0.00 C ATOM 1881 C ASN A 123 -12.746 -4.892 -27.430 1.00 0.00 C ATOM 1882 O ASN A 123 -13.624 -5.091 -26.589 1.00 0.00 O ATOM 1883 CB ASN A 123 -11.904 -2.614 -28.525 1.00 0.00 C ATOM 1884 CG ASN A 123 -11.432 -3.071 -29.918 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -12.140 -3.760 -30.642 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -10.233 -2.743 -30.330 1.00 0.00 N ATOM 0 H ASN A 123 -10.134 -4.876 -27.612 1.00 0.00 H new ATOM 0 HA ASN A 123 -12.218 -3.068 -26.499 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -12.942 -2.293 -28.615 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.321 -1.735 -28.248 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -9.902 -3.061 -31.241 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -9.630 -2.170 -29.740 1.00 0.00 H new ATOM 1893 N ASN A 124 -12.500 -5.754 -28.426 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.195 -7.051 -28.621 1.00 0.00 C ATOM 1895 C ASN A 124 -12.665 -8.200 -27.693 1.00 0.00 C ATOM 1896 O ASN A 124 -13.469 -8.832 -27.004 1.00 0.00 O ATOM 1897 CB ASN A 124 -13.072 -7.308 -30.153 1.00 0.00 C ATOM 1898 CG ASN A 124 -13.636 -8.624 -30.699 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -14.730 -9.062 -30.363 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -12.913 -9.284 -31.574 1.00 0.00 N ATOM 0 H ASN A 124 -11.796 -5.572 -29.141 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.240 -7.023 -28.313 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -13.569 -6.488 -30.672 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -12.016 -7.259 -30.418 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -13.263 -10.156 -31.970 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -12.002 -8.924 -31.858 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.350 -8.508 -27.691 1.00 0.00 N ATOM 1908 CA VAL A 125 -10.825 -9.773 -27.103 1.00 0.00 C ATOM 1909 C VAL A 125 -10.314 -9.542 -25.640 1.00 0.00 C ATOM 1910 O VAL A 125 -9.407 -8.738 -25.391 1.00 0.00 O ATOM 1911 CB VAL A 125 -9.728 -10.394 -28.032 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.214 -11.745 -27.480 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -10.177 -10.668 -29.488 1.00 0.00 C ATOM 0 H VAL A 125 -10.630 -7.904 -28.087 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.638 -10.496 -27.038 1.00 0.00 H new ATOM 0 HB VAL A 125 -8.954 -9.626 -28.043 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -8.454 -12.146 -28.150 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.782 -11.593 -26.491 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.044 -12.448 -27.409 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -9.347 -11.097 -30.050 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.014 -11.367 -29.485 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -10.487 -9.733 -29.955 1.00 0.00 H new ATOM 1923 N THR A 126 -10.867 -10.322 -24.696 1.00 0.00 N ATOM 1924 CA THR A 126 -10.441 -10.325 -23.264 1.00 0.00 C ATOM 1925 C THR A 126 -9.541 -11.565 -22.964 1.00 0.00 C ATOM 1926 O THR A 126 -10.028 -12.703 -22.972 1.00 0.00 O ATOM 1927 CB THR A 126 -11.676 -10.347 -22.310 1.00 0.00 C ATOM 1928 OG1 THR A 126 -12.486 -11.497 -22.552 1.00 0.00 O ATOM 1929 CG2 THR A 126 -12.568 -9.101 -22.384 1.00 0.00 C ATOM 0 H THR A 126 -11.626 -10.975 -24.893 1.00 0.00 H new ATOM 0 HA THR A 126 -9.874 -9.411 -23.088 1.00 0.00 H new ATOM 0 HB THR A 126 -11.244 -10.372 -21.309 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.912 -12.261 -22.770 1.00 0.00 H new ATOM 0 HG21 THR A 126 -13.399 -9.207 -21.687 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.984 -8.219 -22.121 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.956 -8.991 -23.397 1.00 0.00 H new ATOM 1937 N CYS A 127 -8.261 -11.334 -22.645 1.00 0.00 N ATOM 1938 CA CYS A 127 -7.344 -12.383 -22.130 1.00 0.00 C ATOM 1939 C CYS A 127 -7.158 -12.330 -20.578 1.00 0.00 C ATOM 1940 O CYS A 127 -7.363 -11.299 -19.926 1.00 0.00 O ATOM 1941 CB CYS A 127 -6.015 -12.242 -22.901 1.00 0.00 C ATOM 1942 SG CYS A 127 -5.353 -10.576 -22.846 1.00 0.00 S ATOM 0 H CYS A 127 -7.823 -10.417 -22.733 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.775 -13.369 -22.303 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.283 -12.933 -22.483 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -6.170 -12.532 -23.940 1.00 0.00 H new ATOM 0 HG CYS A 127 -5.482 -10.097 -21.644 1.00 0.00 H new ATOM 1947 N THR A 128 -6.758 -13.463 -19.970 1.00 0.00 N ATOM 1948 CA THR A 128 -6.433 -13.528 -18.512 1.00 0.00 C ATOM 1949 C THR A 128 -5.052 -14.223 -18.325 1.00 0.00 C ATOM 1950 O THR A 128 -4.885 -15.397 -18.668 1.00 0.00 O ATOM 1951 CB THR A 128 -7.545 -14.252 -17.692 1.00 0.00 C ATOM 1952 OG1 THR A 128 -8.855 -13.862 -18.100 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.462 -13.973 -16.184 1.00 0.00 C ATOM 0 H THR A 128 -6.649 -14.352 -20.457 1.00 0.00 H new ATOM 0 HA THR A 128 -6.382 -12.510 -18.125 1.00 0.00 H new ATOM 0 HB THR A 128 -7.371 -15.310 -17.888 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.467 -13.922 -17.337 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.263 -14.505 -15.671 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.499 -14.313 -15.804 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.566 -12.903 -16.006 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.073 -13.500 -17.761 1.00 0.00 N ATOM 1962 CA ARG A 129 -2.715 -14.043 -17.487 1.00 0.00 C ATOM 1963 C ARG A 129 -2.533 -14.266 -15.952 1.00 0.00 C ATOM 1964 O ARG A 129 -2.480 -13.310 -15.171 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.670 -13.067 -18.090 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.550 -13.074 -19.636 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.657 -11.952 -20.208 1.00 0.00 C ATOM 1968 NE ARG A 129 0.782 -12.088 -19.835 1.00 0.00 N ATOM 1969 CZ ARG A 129 1.715 -12.732 -20.533 1.00 0.00 C ATOM 1970 NH1 ARG A 129 1.477 -13.408 -21.625 1.00 0.00 N ATOM 1971 NH2 ARG A 129 2.935 -12.686 -20.095 1.00 0.00 N ATOM 0 H ARG A 129 -4.189 -12.527 -17.480 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.575 -15.017 -17.956 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -1.918 -12.055 -17.769 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.694 -13.305 -17.668 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.151 -14.037 -19.954 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.547 -12.984 -20.067 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.744 -11.948 -21.295 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -1.026 -10.989 -19.855 1.00 0.00 H new ATOM 0 HE ARG A 129 1.078 -11.646 -18.964 1.00 0.00 H new ATOM 0 HH11 ARG A 129 0.527 -13.466 -21.992 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.241 -13.878 -22.110 1.00 0.00 H new ATOM 0 HH21 ARG A 129 3.152 -12.169 -19.243 1.00 0.00 H new ATOM 0 HH22 ARG A 129 3.678 -13.167 -20.603 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.442 -15.534 -15.518 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.292 -15.895 -14.072 1.00 0.00 C ATOM 1987 C ILE A 130 -0.772 -16.116 -13.782 1.00 0.00 C ATOM 1988 O ILE A 130 -0.134 -16.958 -14.425 1.00 0.00 O ATOM 1989 CB ILE A 130 -3.156 -17.153 -13.687 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.652 -17.130 -14.136 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -3.078 -17.508 -12.178 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.537 -16.020 -13.552 1.00 0.00 C ATOM 0 H ILE A 130 -2.469 -16.341 -16.142 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.668 -15.082 -13.450 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.677 -17.935 -14.275 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.679 -17.048 -15.223 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -5.098 -18.090 -13.878 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.695 -18.384 -11.978 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -2.044 -17.723 -11.908 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.440 -16.667 -11.587 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.549 -16.118 -13.944 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.558 -16.106 -12.466 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.132 -15.047 -13.831 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.203 -15.384 -12.807 1.00 0.00 N ATOM 2005 CA TYR A 131 1.240 -15.499 -12.455 1.00 0.00 C ATOM 2006 C TYR A 131 1.434 -15.932 -10.955 1.00 0.00 C ATOM 2007 O TYR A 131 0.910 -15.290 -10.037 1.00 0.00 O ATOM 2008 CB TYR A 131 1.983 -14.162 -12.727 1.00 0.00 C ATOM 2009 CG TYR A 131 2.074 -13.557 -14.145 1.00 0.00 C ATOM 2010 CD1 TYR A 131 0.996 -12.854 -14.695 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.308 -13.521 -14.802 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.160 -12.118 -15.869 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.477 -12.772 -15.962 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.404 -12.064 -16.490 1.00 0.00 C ATOM 2015 OH TYR A 131 2.600 -11.254 -17.577 1.00 0.00 O ATOM 0 H TYR A 131 -0.714 -14.704 -12.244 1.00 0.00 H new ATOM 0 HA TYR A 131 1.670 -16.274 -13.089 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.519 -13.408 -12.091 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.006 -14.292 -12.373 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.032 -12.881 -14.208 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.141 -14.082 -14.404 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.320 -11.590 -16.296 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.439 -12.741 -16.451 1.00 0.00 H new ATOM 0 HH TYR A 131 3.533 -10.955 -17.598 1.00 0.00 H new ATOM 2025 N GLU A 132 2.229 -16.991 -10.706 1.00 0.00 N ATOM 2026 CA GLU A 132 2.572 -17.473 -9.331 1.00 0.00 C ATOM 2027 C GLU A 132 3.787 -16.742 -8.665 1.00 0.00 C ATOM 2028 O GLU A 132 4.773 -16.409 -9.330 1.00 0.00 O ATOM 2029 CB GLU A 132 2.713 -19.027 -9.346 1.00 0.00 C ATOM 2030 CG GLU A 132 3.802 -19.700 -10.239 1.00 0.00 C ATOM 2031 CD GLU A 132 5.205 -19.952 -9.688 1.00 0.00 C ATOM 2032 OE1 GLU A 132 5.534 -19.552 -8.554 1.00 0.00 O ATOM 2033 OE2 GLU A 132 6.003 -20.575 -10.426 1.00 0.00 O ATOM 0 H GLU A 132 2.658 -17.545 -11.447 1.00 0.00 H new ATOM 0 HA GLU A 132 1.743 -17.203 -8.676 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.892 -19.347 -8.319 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.749 -19.438 -9.645 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.405 -20.662 -10.562 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.912 -19.085 -11.132 1.00 0.00 H new ATOM 2040 N LYS A 133 3.709 -16.474 -7.342 1.00 0.00 N ATOM 2041 CA LYS A 133 4.792 -15.771 -6.591 1.00 0.00 C ATOM 2042 C LYS A 133 6.023 -16.686 -6.292 1.00 0.00 C ATOM 2043 O LYS A 133 5.911 -17.702 -5.598 1.00 0.00 O ATOM 2044 CB LYS A 133 4.219 -15.185 -5.266 1.00 0.00 C ATOM 2045 CG LYS A 133 5.009 -13.960 -4.743 1.00 0.00 C ATOM 2046 CD LYS A 133 4.493 -13.429 -3.389 1.00 0.00 C ATOM 2047 CE LYS A 133 5.237 -12.147 -2.945 1.00 0.00 C ATOM 2048 NZ LYS A 133 5.501 -12.162 -1.485 1.00 0.00 N ATOM 0 H LYS A 133 2.908 -16.732 -6.765 1.00 0.00 H new ATOM 0 HA LYS A 133 5.154 -14.965 -7.230 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.180 -14.897 -5.424 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.222 -15.963 -4.502 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.060 -14.231 -4.642 1.00 0.00 H new ATOM 0 HG3 LYS A 133 4.956 -13.161 -5.482 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.426 -13.220 -3.465 1.00 0.00 H new ATOM 0 HD3 LYS A 133 4.614 -14.200 -2.628 1.00 0.00 H new ATOM 0 HE2 LYS A 133 6.179 -12.063 -3.487 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.642 -11.270 -3.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.407 -11.689 -1.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 4.736 -11.662 -0.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 5.546 -13.146 -1.150 1.00 0.00 H new ATOM 2062 N VAL A 134 7.202 -16.278 -6.778 1.00 0.00 N ATOM 2063 CA VAL A 134 8.457 -17.074 -6.662 1.00 0.00 C ATOM 2064 C VAL A 134 9.223 -16.584 -5.388 1.00 0.00 C ATOM 2065 O VAL A 134 9.904 -15.552 -5.419 1.00 0.00 O ATOM 2066 CB VAL A 134 9.279 -16.952 -7.995 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.597 -17.759 -7.972 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.490 -17.369 -9.260 1.00 0.00 C ATOM 0 H VAL A 134 7.326 -15.390 -7.264 1.00 0.00 H new ATOM 0 HA VAL A 134 8.260 -18.138 -6.533 1.00 0.00 H new ATOM 0 HB VAL A 134 9.500 -15.886 -8.052 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.117 -17.633 -8.921 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.230 -17.399 -7.161 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.375 -18.815 -7.818 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.125 -17.257 -10.139 1.00 0.00 H new ATOM 0 HG22 VAL A 134 8.178 -18.409 -9.168 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.610 -16.735 -9.365 1.00 0.00 H new ATOM 2078 N GLU A 135 9.079 -17.334 -4.284 1.00 0.00 N ATOM 2079 CA GLU A 135 9.610 -16.944 -2.949 1.00 0.00 C ATOM 2080 C GLU A 135 10.853 -17.806 -2.591 1.00 0.00 C ATOM 2081 O GLU A 135 11.949 -17.227 -2.408 1.00 0.00 O ATOM 2082 CB GLU A 135 8.502 -17.097 -1.870 1.00 0.00 C ATOM 2083 CG GLU A 135 7.200 -16.267 -2.028 1.00 0.00 C ATOM 2084 CD GLU A 135 7.288 -14.778 -1.706 1.00 0.00 C ATOM 2085 OE1 GLU A 135 7.823 -13.999 -2.519 1.00 0.00 O ATOM 2086 OE2 GLU A 135 6.715 -14.346 -0.681 1.00 0.00 O ATOM 2087 OXT GLU A 135 10.744 -19.053 -2.479 1.00 0.00 O ATOM 0 H GLU A 135 8.592 -18.230 -4.282 1.00 0.00 H new ATOM 0 HA GLU A 135 9.918 -15.899 -2.981 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.222 -18.150 -1.828 1.00 0.00 H new ATOM 0 HB3 GLU A 135 8.941 -16.845 -0.905 1.00 0.00 H new ATOM 0 HG2 GLU A 135 6.853 -16.372 -3.056 1.00 0.00 H new ATOM 0 HG3 GLU A 135 6.436 -16.708 -1.387 1.00 0.00 H new