USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1021 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 73 ASN :FLIP amide:sc= -3.55 F(o=-3.7!,f=-2.9) USER MOD Set 1.2: A 112 TYR OH : rot 153:sc= 0.62 USER MOD Set 2.1: A 32 SER OG : rot 180:sc= -0.6 USER MOD Set 2.2: A 33 SER OG : rot 85:sc= -0.472 USER MOD Set 3.1: A 18 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 22 HIS : no HE2:sc= -3.89! C(o=-3.9!,f=-4.6!) USER MOD Set 4.1: A 19 ASN :FLIP amide:sc= -7.44! C(o=-9.3!,f=-8.3!) USER MOD Set 4.2: A 85 THR OG1 : rot 44:sc= 0.0128 USER MOD Set 4.3: A 92 TYR OH : rot 30:sc= -0.83 USER MOD Single : A 1 ALA N :NH3+ -148:sc= 0.148 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc=-0.000121 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.879 USER MOD Single : A 11 TYR OH : rot 180:sc= -0.76 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN : amide:sc= -7.72! C(o=-7.7!,f=-8.2!) USER MOD Single : A 14 ASN : amide:sc= -0.121 K(o=-0.12,f=-1.9!) USER MOD Single : A 15 LYS NZ :NH3+ -168:sc= 0.425 (180deg=0.293) USER MOD Single : A 20 SER OG : rot -65:sc= 1.24 USER MOD Single : A 21 HIS :FLIP no HD1:sc= -0.31 F(o=-1.2,f=-0.31) USER MOD Single : A 26 SER OG : rot 59:sc= 0.0855 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot -157:sc= 1.18 USER MOD Single : A 34 TYR OH : rot 3:sc= 0 USER MOD Single : A 36 HIS : no HE2:sc= -9.02 K(o=-9,f=-11!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -1.15 K(o=-1.1,f=-4.2!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc=-0.00152 USER MOD Single : A 56 LYS NZ :NH3+ 160:sc= -0.0242 (180deg=-0.17) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot -17:sc= 0.177 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HD1:sc= -3.23 X(o=-3.2,f=-2.8) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HE2:sc= -4.81! C(o=-4.8!,f=-4.7!) USER MOD Single : A 79 TYR OH : rot 100:sc= -1.12 USER MOD Single : A 90 HIS :FLIP no HD1:sc= -0.424 F(o=-1.7,f=-0.42) USER MOD Single : A 93 LYS NZ :NH3+ -160:sc= -0.0511 (180deg=-0.307) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ -159:sc= -0.226 (180deg=-1.03) USER MOD Single : A 102 ASN : amide:sc= -0.506 X(o=-0.51,f=-0.54) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.512 USER MOD Single : A 114 ASN : amide:sc= -0.0536 X(o=-0.054,f=-0.47) USER MOD Single : A 115 LYS NZ :NH3+ -137:sc= -0.25 (180deg=-1.03) USER MOD Single : A 123 HIS :FLIP no HE2:sc= -4.8! C(o=-6!,f=-4.8!) USER MOD Single : A 124 THR OG1 : rot -55:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 128 GLN : amide:sc= -0.0298 X(o=-0.03,f=-0.37) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 HIS : no HD1:sc= -10.8! C(o=-11!,f=-11!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 1.325 -0.005 0.025 1.00 0.00 N ATOM 2 CA ALA A 1 2.067 -0.039 -1.247 1.00 0.00 C ATOM 3 C ALA A 1 2.394 1.395 -1.612 1.00 0.00 C ATOM 4 O ALA A 1 2.569 2.203 -0.708 1.00 0.00 O ATOM 5 CB ALA A 1 1.246 -0.739 -2.338 1.00 0.00 C ATOM 0 H1 ALA A 1 1.539 -0.862 0.575 1.00 0.00 H new ATOM 0 H2 ALA A 1 1.607 0.835 0.569 1.00 0.00 H new ATOM 0 H3 ALA A 1 0.304 0.035 -0.170 1.00 0.00 H new ATOM 0 HA ALA A 1 2.988 -0.613 -1.148 1.00 0.00 H new ATOM 0 HB1 ALA A 1 1.814 -0.752 -3.268 1.00 0.00 H new ATOM 0 HB2 ALA A 1 1.029 -1.762 -2.030 1.00 0.00 H new ATOM 0 HB3 ALA A 1 0.311 -0.201 -2.491 1.00 0.00 H new ATOM 13 N VAL A 2 2.448 1.712 -2.904 1.00 0.00 N ATOM 14 CA VAL A 2 2.731 3.050 -3.402 1.00 0.00 C ATOM 15 C VAL A 2 2.454 3.053 -4.904 1.00 0.00 C ATOM 16 O VAL A 2 2.835 2.133 -5.632 1.00 0.00 O ATOM 17 CB VAL A 2 4.181 3.431 -3.044 1.00 0.00 C ATOM 18 CG1 VAL A 2 5.199 2.737 -3.945 1.00 0.00 C ATOM 19 CG2 VAL A 2 4.336 4.951 -3.021 1.00 0.00 C ATOM 0 H VAL A 2 2.293 1.030 -3.646 1.00 0.00 H new ATOM 0 HA VAL A 2 2.094 3.805 -2.941 1.00 0.00 H new ATOM 0 HB VAL A 2 4.395 3.067 -2.039 1.00 0.00 H new ATOM 0 HG11 VAL A 2 6.206 3.037 -3.654 1.00 0.00 H new ATOM 0 HG12 VAL A 2 5.098 1.656 -3.843 1.00 0.00 H new ATOM 0 HG13 VAL A 2 5.021 3.022 -4.982 1.00 0.00 H new ATOM 0 HG21 VAL A 2 5.364 5.208 -2.767 1.00 0.00 H new ATOM 0 HG22 VAL A 2 4.093 5.356 -4.003 1.00 0.00 H new ATOM 0 HG23 VAL A 2 3.662 5.374 -2.277 1.00 0.00 H new ATOM 29 N THR A 3 1.706 4.047 -5.354 1.00 0.00 N ATOM 30 CA THR A 3 1.412 4.198 -6.772 1.00 0.00 C ATOM 31 C THR A 3 2.533 4.969 -7.448 1.00 0.00 C ATOM 32 O THR A 3 2.795 6.121 -7.117 1.00 0.00 O ATOM 33 CB THR A 3 0.040 4.847 -6.899 1.00 0.00 C ATOM 34 OG1 THR A 3 -0.832 3.749 -7.067 1.00 0.00 O ATOM 35 CG2 THR A 3 -0.068 5.792 -8.081 1.00 0.00 C ATOM 0 H THR A 3 1.290 4.763 -4.758 1.00 0.00 H new ATOM 0 HA THR A 3 1.367 3.238 -7.287 1.00 0.00 H new ATOM 0 HB THR A 3 -0.186 5.466 -6.031 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.752 4.073 -7.157 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.070 6.220 -8.114 1.00 0.00 H new ATOM 0 HG22 THR A 3 0.665 6.592 -7.976 1.00 0.00 H new ATOM 0 HG23 THR A 3 0.123 5.244 -9.004 1.00 0.00 H new ATOM 43 N TRP A 4 3.208 4.326 -8.392 1.00 0.00 N ATOM 44 CA TRP A 4 4.284 4.963 -9.121 1.00 0.00 C ATOM 45 C TRP A 4 3.712 5.747 -10.289 1.00 0.00 C ATOM 46 O TRP A 4 2.788 5.267 -10.950 1.00 0.00 O ATOM 47 CB TRP A 4 5.234 3.896 -9.611 1.00 0.00 C ATOM 48 CG TRP A 4 5.899 3.112 -8.514 1.00 0.00 C ATOM 49 CD1 TRP A 4 5.275 2.336 -7.604 1.00 0.00 C ATOM 50 CD2 TRP A 4 7.322 3.014 -8.210 1.00 0.00 C ATOM 51 NE1 TRP A 4 6.210 1.808 -6.731 1.00 0.00 N ATOM 52 CE2 TRP A 4 7.479 2.197 -7.076 1.00 0.00 C ATOM 53 CE3 TRP A 4 8.471 3.573 -8.795 1.00 0.00 C ATOM 54 CZ2 TRP A 4 8.734 1.909 -6.531 1.00 0.00 C ATOM 55 CZ3 TRP A 4 9.736 3.254 -8.285 1.00 0.00 C ATOM 56 CH2 TRP A 4 9.879 2.410 -7.175 1.00 0.00 C ATOM 0 H TRP A 4 3.025 3.361 -8.667 1.00 0.00 H new ATOM 0 HA TRP A 4 4.823 5.655 -8.474 1.00 0.00 H new ATOM 0 HB2 TRP A 4 4.688 3.207 -10.255 1.00 0.00 H new ATOM 0 HB3 TRP A 4 6.003 4.364 -10.225 1.00 0.00 H new ATOM 0 HD1 TRP A 4 4.211 2.155 -7.563 1.00 0.00 H new ATOM 0 HE1 TRP A 4 5.985 1.209 -5.937 1.00 0.00 H new ATOM 0 HE3 TRP A 4 8.379 4.246 -9.635 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 8.822 1.314 -5.634 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 10.617 3.666 -8.755 1.00 0.00 H new ATOM 0 HH2 TRP A 4 10.863 2.146 -6.817 1.00 0.00 H new ATOM 67 N THR A 5 4.255 6.914 -10.563 1.00 0.00 N ATOM 68 CA THR A 5 3.723 7.768 -11.630 1.00 0.00 C ATOM 69 C THR A 5 4.883 8.313 -12.425 1.00 0.00 C ATOM 70 O THR A 5 5.869 8.801 -11.859 1.00 0.00 O ATOM 71 CB THR A 5 2.836 8.871 -11.038 1.00 0.00 C ATOM 72 OG1 THR A 5 1.532 8.388 -11.095 1.00 0.00 O ATOM 73 CG2 THR A 5 2.810 10.171 -11.844 1.00 0.00 C ATOM 0 H THR A 5 5.060 7.301 -10.071 1.00 0.00 H new ATOM 0 HA THR A 5 3.086 7.195 -12.304 1.00 0.00 H new ATOM 0 HB THR A 5 3.227 9.096 -10.046 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.919 9.057 -10.725 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.158 10.892 -11.351 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.819 10.579 -11.909 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.435 9.970 -12.847 1.00 0.00 H new ATOM 81 N CYS A 6 4.770 8.231 -13.747 1.00 0.00 N ATOM 82 CA CYS A 6 5.799 8.743 -14.634 1.00 0.00 C ATOM 83 C CYS A 6 5.205 9.838 -15.516 1.00 0.00 C ATOM 84 O CYS A 6 5.039 9.654 -16.716 1.00 0.00 O ATOM 85 CB CYS A 6 6.393 7.593 -15.445 1.00 0.00 C ATOM 86 SG CYS A 6 8.067 7.223 -14.900 1.00 0.00 S ATOM 0 H CYS A 6 3.972 7.813 -14.225 1.00 0.00 H new ATOM 0 HA CYS A 6 6.613 9.189 -14.062 1.00 0.00 H new ATOM 0 HB2 CYS A 6 5.767 6.707 -15.339 1.00 0.00 H new ATOM 0 HB3 CYS A 6 6.400 7.854 -16.503 1.00 0.00 H new ATOM 91 N GLY A 7 4.879 10.979 -14.906 1.00 0.00 N ATOM 92 CA GLY A 7 4.287 12.136 -15.589 1.00 0.00 C ATOM 93 C GLY A 7 3.334 11.757 -16.724 1.00 0.00 C ATOM 94 O GLY A 7 3.735 11.683 -17.878 1.00 0.00 O ATOM 0 H GLY A 7 5.020 11.130 -13.907 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.748 12.741 -14.860 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.087 12.759 -15.990 1.00 0.00 H new ATOM 98 N GLY A 8 2.067 11.530 -16.387 1.00 0.00 N ATOM 99 CA GLY A 8 1.080 11.095 -17.374 1.00 0.00 C ATOM 100 C GLY A 8 0.051 10.197 -16.731 1.00 0.00 C ATOM 101 O GLY A 8 -1.066 10.628 -16.464 1.00 0.00 O ATOM 0 H GLY A 8 1.700 11.639 -15.442 1.00 0.00 H new ATOM 0 HA2 GLY A 8 0.590 11.963 -17.814 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.578 10.565 -18.186 1.00 0.00 H new ATOM 105 N LEU A 9 0.445 8.963 -16.434 1.00 0.00 N ATOM 106 CA LEU A 9 -0.425 8.001 -15.779 1.00 0.00 C ATOM 107 C LEU A 9 0.317 7.369 -14.607 1.00 0.00 C ATOM 108 O LEU A 9 1.551 7.413 -14.531 1.00 0.00 O ATOM 109 CB LEU A 9 -0.888 6.979 -16.817 1.00 0.00 C ATOM 110 CG LEU A 9 -1.903 7.523 -17.845 1.00 0.00 C ATOM 111 CD1 LEU A 9 -1.685 6.903 -19.230 1.00 0.00 C ATOM 112 CD2 LEU A 9 -3.355 7.310 -17.374 1.00 0.00 C ATOM 0 H LEU A 9 1.377 8.605 -16.642 1.00 0.00 H new ATOM 0 HA LEU A 9 -1.314 8.480 -15.369 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -0.016 6.602 -17.351 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -1.335 6.131 -16.298 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.732 8.596 -17.927 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -2.417 7.308 -19.929 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.680 7.138 -19.580 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -1.804 5.821 -19.167 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -4.042 7.705 -18.122 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -3.541 6.245 -17.238 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -3.511 7.829 -16.428 1.00 0.00 H new ATOM 124 N LEU A 10 -0.462 6.801 -13.694 1.00 0.00 N ATOM 125 CA LEU A 10 0.061 6.114 -12.528 1.00 0.00 C ATOM 126 C LEU A 10 0.000 4.603 -12.728 1.00 0.00 C ATOM 127 O LEU A 10 -0.848 4.095 -13.439 1.00 0.00 O ATOM 128 CB LEU A 10 -0.696 6.616 -11.284 1.00 0.00 C ATOM 129 CG LEU A 10 -1.977 5.880 -10.853 1.00 0.00 C ATOM 130 CD1 LEU A 10 -3.022 5.931 -11.967 1.00 0.00 C ATOM 131 CD2 LEU A 10 -1.709 4.439 -10.373 1.00 0.00 C ATOM 0 H LEU A 10 -1.481 6.806 -13.746 1.00 0.00 H new ATOM 0 HA LEU A 10 1.117 6.340 -12.378 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -0.003 6.593 -10.443 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.956 7.661 -11.454 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.378 6.405 -9.986 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.922 5.406 -11.646 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.267 6.970 -12.188 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.623 5.454 -12.862 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.650 3.971 -10.083 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.253 3.866 -11.180 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.035 4.460 -9.517 1.00 0.00 H new ATOM 143 N TYR A 11 0.868 3.877 -12.037 1.00 0.00 N ATOM 144 CA TYR A 11 0.971 2.433 -12.135 1.00 0.00 C ATOM 145 C TYR A 11 1.068 1.861 -10.731 1.00 0.00 C ATOM 146 O TYR A 11 2.059 2.053 -10.013 1.00 0.00 O ATOM 147 CB TYR A 11 2.221 2.110 -12.949 1.00 0.00 C ATOM 148 CG TYR A 11 2.306 2.883 -14.255 1.00 0.00 C ATOM 149 CD1 TYR A 11 2.871 4.169 -14.278 1.00 0.00 C ATOM 150 CD2 TYR A 11 1.771 2.319 -15.414 1.00 0.00 C ATOM 151 CE1 TYR A 11 2.892 4.900 -15.484 1.00 0.00 C ATOM 152 CE2 TYR A 11 1.799 3.049 -16.625 1.00 0.00 C ATOM 153 CZ TYR A 11 2.352 4.327 -16.630 1.00 0.00 C ATOM 154 OH TYR A 11 2.483 4.974 -17.825 1.00 0.00 O ATOM 0 H TYR A 11 1.532 4.286 -11.380 1.00 0.00 H new ATOM 0 HA TYR A 11 0.101 1.997 -12.626 1.00 0.00 H new ATOM 0 HB2 TYR A 11 3.104 2.328 -12.348 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.239 1.042 -13.166 1.00 0.00 H new ATOM 0 HD1 TYR A 11 3.287 4.596 -13.377 1.00 0.00 H new ATOM 0 HD2 TYR A 11 1.338 1.330 -15.386 1.00 0.00 H new ATOM 0 HE1 TYR A 11 3.321 5.890 -15.517 1.00 0.00 H new ATOM 0 HE2 TYR A 11 1.398 2.622 -17.532 1.00 0.00 H new ATOM 0 HH TYR A 11 2.054 4.447 -18.531 1.00 0.00 H new ATOM 164 N ASN A 12 -0.007 1.201 -10.299 1.00 0.00 N ATOM 165 CA ASN A 12 -0.025 0.562 -8.994 1.00 0.00 C ATOM 166 C ASN A 12 1.143 -0.407 -8.899 1.00 0.00 C ATOM 167 O ASN A 12 1.212 -1.364 -9.668 1.00 0.00 O ATOM 168 CB ASN A 12 -1.349 -0.191 -8.771 1.00 0.00 C ATOM 169 CG ASN A 12 -1.923 0.157 -7.419 1.00 0.00 C ATOM 170 OD1 ASN A 12 -2.965 0.761 -7.282 1.00 0.00 O ATOM 171 ND2 ASN A 12 -1.232 -0.227 -6.370 1.00 0.00 N ATOM 0 H ASN A 12 -0.869 1.098 -10.834 1.00 0.00 H new ATOM 0 HA ASN A 12 0.064 1.328 -8.224 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -2.061 0.069 -9.555 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -1.181 -1.266 -8.837 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -1.571 -0.017 -5.431 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -0.356 -0.735 -6.494 1.00 0.00 H new ATOM 178 N GLN A 13 2.032 -0.188 -7.931 1.00 0.00 N ATOM 179 CA GLN A 13 3.163 -1.091 -7.764 1.00 0.00 C ATOM 180 C GLN A 13 2.734 -2.523 -7.608 1.00 0.00 C ATOM 181 O GLN A 13 3.304 -3.407 -8.239 1.00 0.00 O ATOM 182 CB GLN A 13 4.006 -0.714 -6.556 1.00 0.00 C ATOM 183 CG GLN A 13 5.243 -1.617 -6.392 1.00 0.00 C ATOM 184 CD GLN A 13 5.976 -1.783 -7.716 1.00 0.00 C ATOM 185 OE1 GLN A 13 6.410 -2.853 -8.106 1.00 0.00 O ATOM 186 NE2 GLN A 13 6.091 -0.706 -8.472 1.00 0.00 N ATOM 0 H GLN A 13 1.992 0.586 -7.268 1.00 0.00 H new ATOM 0 HA GLN A 13 3.753 -0.992 -8.675 1.00 0.00 H new ATOM 0 HB2 GLN A 13 4.328 0.323 -6.652 1.00 0.00 H new ATOM 0 HB3 GLN A 13 3.394 -0.776 -5.656 1.00 0.00 H new ATOM 0 HG2 GLN A 13 5.916 -1.186 -5.651 1.00 0.00 H new ATOM 0 HG3 GLN A 13 4.938 -2.594 -6.016 1.00 0.00 H new ATOM 0 HE21 GLN A 13 5.727 0.189 -8.144 1.00 0.00 H new ATOM 0 HE22 GLN A 13 6.544 -0.769 -9.384 1.00 0.00 H new ATOM 195 N ASN A 14 1.680 -2.729 -6.827 1.00 0.00 N ATOM 196 CA ASN A 14 1.121 -4.059 -6.631 1.00 0.00 C ATOM 197 C ASN A 14 0.866 -4.779 -7.949 1.00 0.00 C ATOM 198 O ASN A 14 0.862 -6.002 -8.013 1.00 0.00 O ATOM 199 CB ASN A 14 -0.229 -3.944 -5.925 1.00 0.00 C ATOM 200 CG ASN A 14 -0.413 -5.016 -4.876 1.00 0.00 C ATOM 201 OD1 ASN A 14 0.437 -5.832 -4.591 1.00 0.00 O ATOM 202 ND2 ASN A 14 -1.560 -5.009 -4.249 1.00 0.00 N ATOM 0 H ASN A 14 1.195 -1.989 -6.319 1.00 0.00 H new ATOM 0 HA ASN A 14 1.848 -4.621 -6.045 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.312 -2.962 -5.458 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -1.030 -4.016 -6.661 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.744 -5.693 -3.515 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.271 -4.320 -4.494 1.00 0.00 H new ATOM 209 N LYS A 15 0.653 -4.007 -9.021 1.00 0.00 N ATOM 210 CA LYS A 15 0.579 -4.497 -10.391 1.00 0.00 C ATOM 211 C LYS A 15 1.898 -4.363 -11.127 1.00 0.00 C ATOM 212 O LYS A 15 2.215 -5.246 -11.906 1.00 0.00 O ATOM 213 CB LYS A 15 -0.536 -3.748 -11.101 1.00 0.00 C ATOM 214 CG LYS A 15 -1.781 -4.639 -11.124 1.00 0.00 C ATOM 215 CD LYS A 15 -2.389 -4.675 -12.514 1.00 0.00 C ATOM 216 CE LYS A 15 -2.846 -6.083 -12.891 1.00 0.00 C ATOM 217 NZ LYS A 15 -4.098 -6.436 -12.182 1.00 0.00 N ATOM 0 H LYS A 15 0.525 -2.998 -8.951 1.00 0.00 H new ATOM 0 HA LYS A 15 0.362 -5.565 -10.377 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -0.750 -2.811 -10.587 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -0.234 -3.493 -12.117 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -1.517 -5.649 -10.811 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.515 -4.265 -10.410 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.237 -3.992 -12.558 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -1.658 -4.322 -13.241 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -3.003 -6.143 -13.968 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -2.066 -6.803 -12.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.282 -7.454 -12.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -4.002 -6.205 -11.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -4.890 -5.897 -12.587 1.00 0.00 H new ATOM 231 N ALA A 16 2.697 -3.345 -10.883 1.00 0.00 N ATOM 232 CA ALA A 16 4.006 -3.237 -11.520 1.00 0.00 C ATOM 233 C ALA A 16 4.866 -4.489 -11.277 1.00 0.00 C ATOM 234 O ALA A 16 5.532 -4.965 -12.185 1.00 0.00 O ATOM 235 CB ALA A 16 4.696 -2.009 -10.972 1.00 0.00 C ATOM 0 H ALA A 16 2.469 -2.578 -10.250 1.00 0.00 H new ATOM 0 HA ALA A 16 3.872 -3.152 -12.598 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.678 -1.907 -11.434 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.097 -1.126 -11.194 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.811 -2.108 -9.893 1.00 0.00 H new ATOM 241 N GLU A 17 4.811 -5.046 -10.069 1.00 0.00 N ATOM 242 CA GLU A 17 5.495 -6.294 -9.737 1.00 0.00 C ATOM 243 C GLU A 17 4.607 -7.486 -10.072 1.00 0.00 C ATOM 244 O GLU A 17 5.081 -8.444 -10.680 1.00 0.00 O ATOM 245 CB GLU A 17 5.921 -6.326 -8.270 1.00 0.00 C ATOM 246 CG GLU A 17 4.839 -5.755 -7.337 1.00 0.00 C ATOM 247 CD GLU A 17 4.899 -6.299 -5.921 1.00 0.00 C ATOM 248 OE1 GLU A 17 5.141 -7.517 -5.791 1.00 0.00 O ATOM 249 OE2 GLU A 17 4.647 -5.471 -5.006 1.00 0.00 O ATOM 0 H GLU A 17 4.289 -4.643 -9.291 1.00 0.00 H new ATOM 0 HA GLU A 17 6.401 -6.354 -10.339 1.00 0.00 H new ATOM 0 HB2 GLU A 17 6.143 -7.353 -7.980 1.00 0.00 H new ATOM 0 HB3 GLU A 17 6.841 -5.755 -8.148 1.00 0.00 H new ATOM 0 HG2 GLU A 17 4.938 -4.670 -7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 17 3.858 -5.973 -7.758 1.00 0.00 H new ATOM 256 N SER A 18 3.312 -7.448 -9.727 1.00 0.00 N ATOM 257 CA SER A 18 2.398 -8.579 -9.977 1.00 0.00 C ATOM 258 C SER A 18 2.118 -8.776 -11.452 1.00 0.00 C ATOM 259 O SER A 18 2.379 -9.843 -11.982 1.00 0.00 O ATOM 260 CB SER A 18 1.057 -8.384 -9.314 1.00 0.00 C ATOM 261 OG SER A 18 0.207 -9.474 -9.613 1.00 0.00 O ATOM 0 H SER A 18 2.871 -6.648 -9.274 1.00 0.00 H new ATOM 0 HA SER A 18 2.913 -9.446 -9.563 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.185 -8.297 -8.235 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.604 -7.454 -9.657 1.00 0.00 H new ATOM 0 HG SER A 18 -0.661 -9.341 -9.178 1.00 0.00 H new ATOM 267 N ASN A 19 1.595 -7.754 -12.140 1.00 0.00 N ATOM 268 CA ASN A 19 1.466 -7.770 -13.602 1.00 0.00 C ATOM 269 C ASN A 19 2.731 -8.284 -14.298 1.00 0.00 C ATOM 270 O ASN A 19 2.664 -8.961 -15.319 1.00 0.00 O ATOM 271 CB ASN A 19 1.118 -6.381 -14.124 1.00 0.00 C ATOM 272 CG ASN A 19 0.336 -6.560 -15.395 1.00 0.00 C ATOM 273 OD1 ASN A 19 -0.899 -6.128 -15.359 1.00 0.00 O flip ATOM 274 ND2 ASN A 19 0.778 -7.098 -16.387 1.00 0.00 N flip ATOM 0 H ASN A 19 1.252 -6.899 -11.703 1.00 0.00 H new ATOM 0 HA ASN A 19 0.658 -8.462 -13.837 1.00 0.00 H new ATOM 0 HB2 ASN A 19 0.533 -5.830 -13.388 1.00 0.00 H new ATOM 0 HB3 ASN A 19 2.023 -5.803 -14.309 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.742 -7.430 -16.400 1.00 0.00 H new ATOM 0 HD22 ASN A 19 0.186 -7.219 -17.208 1.00 0.00 H new ATOM 281 N SER A 20 3.891 -8.042 -13.685 1.00 0.00 N ATOM 282 CA SER A 20 5.172 -8.553 -14.180 1.00 0.00 C ATOM 283 C SER A 20 5.455 -9.973 -13.738 1.00 0.00 C ATOM 284 O SER A 20 6.081 -10.728 -14.473 1.00 0.00 O ATOM 285 CB SER A 20 6.325 -7.683 -13.707 1.00 0.00 C ATOM 286 OG SER A 20 6.944 -8.127 -12.502 1.00 0.00 O ATOM 0 H SER A 20 3.970 -7.487 -12.833 1.00 0.00 H new ATOM 0 HA SER A 20 5.090 -8.534 -15.267 1.00 0.00 H new ATOM 0 HB2 SER A 20 7.078 -7.641 -14.494 1.00 0.00 H new ATOM 0 HB3 SER A 20 5.960 -6.666 -13.560 1.00 0.00 H new ATOM 0 HG SER A 20 6.303 -8.067 -11.763 1.00 0.00 H new ATOM 292 N HIS A 21 5.007 -10.362 -12.530 1.00 0.00 N ATOM 293 CA HIS A 21 5.200 -11.712 -11.975 1.00 0.00 C ATOM 294 C HIS A 21 4.825 -12.758 -13.014 1.00 0.00 C ATOM 295 O HIS A 21 5.451 -13.811 -13.059 1.00 0.00 O ATOM 296 CB HIS A 21 4.391 -11.912 -10.677 1.00 0.00 C ATOM 297 CG HIS A 21 5.070 -11.447 -9.408 1.00 0.00 C ATOM 298 ND1 HIS A 21 6.143 -10.606 -9.302 1.00 0.00 N flip ATOM 299 CD2 HIS A 21 4.653 -11.781 -8.138 1.00 0.00 C flip ATOM 300 CE1 HIS A 21 6.386 -10.447 -7.949 1.00 0.00 C flip ATOM 301 NE2 HIS A 21 5.473 -11.165 -7.268 1.00 0.00 N flip ATOM 0 H HIS A 21 4.495 -9.739 -11.905 1.00 0.00 H new ATOM 0 HA HIS A 21 6.253 -11.828 -11.720 1.00 0.00 H new ATOM 0 HB2 HIS A 21 3.443 -11.384 -10.776 1.00 0.00 H new ATOM 0 HB3 HIS A 21 4.156 -12.972 -10.575 1.00 0.00 H new ATOM 0 HD2 HIS A 21 3.820 -12.421 -7.887 1.00 0.00 H new ATOM 0 HE1 HIS A 21 7.173 -9.849 -7.514 1.00 0.00 H new ATOM 0 HE2 HIS A 21 5.413 -11.231 -6.252 1.00 0.00 H new ATOM 310 N HIS A 22 3.785 -12.467 -13.799 1.00 0.00 N ATOM 311 CA HIS A 22 3.302 -13.315 -14.877 1.00 0.00 C ATOM 312 C HIS A 22 4.290 -13.327 -16.030 1.00 0.00 C ATOM 313 O HIS A 22 4.634 -14.403 -16.504 1.00 0.00 O ATOM 314 CB HIS A 22 1.922 -12.876 -15.363 1.00 0.00 C ATOM 315 CG HIS A 22 1.078 -12.072 -14.400 1.00 0.00 C ATOM 316 ND1 HIS A 22 0.207 -11.080 -14.784 1.00 0.00 N ATOM 317 CD2 HIS A 22 1.029 -12.200 -13.038 1.00 0.00 C ATOM 318 CE1 HIS A 22 -0.354 -10.606 -13.663 1.00 0.00 C ATOM 319 NE2 HIS A 22 0.116 -11.269 -12.587 1.00 0.00 N ATOM 0 H HIS A 22 3.244 -11.609 -13.694 1.00 0.00 H new ATOM 0 HA HIS A 22 3.209 -14.327 -14.483 1.00 0.00 H new ATOM 0 HB2 HIS A 22 2.054 -12.287 -16.271 1.00 0.00 H new ATOM 0 HB3 HIS A 22 1.361 -13.768 -15.641 1.00 0.00 H new ATOM 0 HD1 HIS A 22 0.023 -10.766 -15.737 1.00 0.00 H new ATOM 0 HD2 HIS A 22 1.595 -12.894 -12.434 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -1.079 -9.807 -13.627 1.00 0.00 H new ATOM 328 N ALA A 23 4.744 -12.135 -16.440 1.00 0.00 N ATOM 329 CA ALA A 23 5.751 -11.950 -17.478 1.00 0.00 C ATOM 330 C ALA A 23 6.854 -13.013 -17.357 1.00 0.00 C ATOM 331 O ALA A 23 7.437 -13.185 -16.288 1.00 0.00 O ATOM 332 CB ALA A 23 6.343 -10.536 -17.417 1.00 0.00 C ATOM 0 H ALA A 23 4.409 -11.256 -16.046 1.00 0.00 H new ATOM 0 HA ALA A 23 5.269 -12.070 -18.448 1.00 0.00 H new ATOM 0 HB1 ALA A 23 7.092 -10.421 -18.201 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.550 -9.803 -17.563 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.809 -10.378 -16.444 1.00 0.00 H new ATOM 338 N PRO A 24 7.138 -13.723 -18.460 1.00 0.00 N ATOM 339 CA PRO A 24 8.127 -14.783 -18.446 1.00 0.00 C ATOM 340 C PRO A 24 9.509 -14.170 -18.361 1.00 0.00 C ATOM 341 O PRO A 24 9.875 -13.323 -19.173 1.00 0.00 O ATOM 342 CB PRO A 24 7.900 -15.571 -19.739 1.00 0.00 C ATOM 343 CG PRO A 24 7.095 -14.657 -20.629 1.00 0.00 C ATOM 344 CD PRO A 24 6.564 -13.524 -19.769 1.00 0.00 C ATOM 0 HA PRO A 24 8.039 -15.450 -17.589 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.847 -15.840 -20.206 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.365 -16.501 -19.544 1.00 0.00 H new ATOM 0 HG2 PRO A 24 7.715 -14.266 -21.436 1.00 0.00 H new ATOM 0 HG3 PRO A 24 6.273 -15.202 -21.093 1.00 0.00 H new ATOM 0 HD2 PRO A 24 6.850 -12.555 -20.178 1.00 0.00 H new ATOM 0 HD3 PRO A 24 5.475 -13.543 -19.726 1.00 0.00 H new ATOM 352 N LEU A 25 10.271 -14.584 -17.356 1.00 0.00 N ATOM 353 CA LEU A 25 11.634 -14.128 -17.141 1.00 0.00 C ATOM 354 C LEU A 25 12.525 -14.479 -18.319 1.00 0.00 C ATOM 355 O LEU A 25 13.039 -15.587 -18.407 1.00 0.00 O ATOM 356 CB LEU A 25 12.174 -14.695 -15.815 1.00 0.00 C ATOM 357 CG LEU A 25 12.969 -13.707 -14.972 1.00 0.00 C ATOM 358 CD1 LEU A 25 12.309 -12.332 -14.946 1.00 0.00 C ATOM 359 CD2 LEU A 25 13.144 -14.279 -13.567 1.00 0.00 C ATOM 0 H LEU A 25 9.952 -15.256 -16.658 1.00 0.00 H new ATOM 0 HA LEU A 25 11.634 -13.041 -17.066 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.334 -15.061 -15.224 1.00 0.00 H new ATOM 0 HB3 LEU A 25 12.807 -15.554 -16.035 1.00 0.00 H new ATOM 0 HG LEU A 25 13.952 -13.564 -15.421 1.00 0.00 H new ATOM 0 HD11 LEU A 25 12.905 -11.654 -14.335 1.00 0.00 H new ATOM 0 HD12 LEU A 25 12.242 -11.941 -15.961 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.308 -12.417 -14.523 1.00 0.00 H new ATOM 0 HD21 LEU A 25 13.713 -13.577 -12.957 1.00 0.00 H new ATOM 0 HD22 LEU A 25 12.165 -14.442 -13.116 1.00 0.00 H new ATOM 0 HD23 LEU A 25 13.679 -15.227 -13.624 1.00 0.00 H new ATOM 371 N SER A 26 12.666 -13.530 -19.238 1.00 0.00 N ATOM 372 CA SER A 26 13.397 -13.729 -20.488 1.00 0.00 C ATOM 373 C SER A 26 13.359 -12.439 -21.308 1.00 0.00 C ATOM 374 O SER A 26 12.504 -11.575 -21.106 1.00 0.00 O ATOM 375 CB SER A 26 12.834 -14.887 -21.319 1.00 0.00 C ATOM 376 OG SER A 26 13.678 -16.026 -21.303 1.00 0.00 O ATOM 0 H SER A 26 12.274 -12.594 -19.137 1.00 0.00 H new ATOM 0 HA SER A 26 14.424 -13.987 -20.231 1.00 0.00 H new ATOM 0 HB2 SER A 26 11.851 -15.161 -20.935 1.00 0.00 H new ATOM 0 HB3 SER A 26 12.694 -14.557 -22.348 1.00 0.00 H new ATOM 0 HG SER A 26 13.804 -16.327 -20.379 1.00 0.00 H new ATOM 382 N ASP A 27 14.290 -12.320 -22.251 1.00 0.00 N ATOM 383 CA ASP A 27 14.385 -11.184 -23.158 1.00 0.00 C ATOM 384 C ASP A 27 13.770 -11.564 -24.484 1.00 0.00 C ATOM 385 O ASP A 27 14.279 -12.480 -25.124 1.00 0.00 O ATOM 386 CB ASP A 27 15.845 -10.755 -23.335 1.00 0.00 C ATOM 387 CG ASP A 27 16.349 -10.552 -24.769 1.00 0.00 C ATOM 388 OD1 ASP A 27 16.109 -9.445 -25.282 1.00 0.00 O ATOM 389 OD2 ASP A 27 17.155 -11.387 -25.249 1.00 0.00 O ATOM 0 H ASP A 27 15.011 -13.024 -22.407 1.00 0.00 H new ATOM 0 HA ASP A 27 13.843 -10.336 -22.739 1.00 0.00 H new ATOM 0 HB2 ASP A 27 15.991 -9.822 -22.791 1.00 0.00 H new ATOM 0 HB3 ASP A 27 16.477 -11.504 -22.858 1.00 0.00 H new ATOM 394 N GLY A 28 12.682 -10.889 -24.867 1.00 0.00 N ATOM 395 CA GLY A 28 12.072 -11.142 -26.169 1.00 0.00 C ATOM 396 C GLY A 28 11.823 -12.629 -26.417 1.00 0.00 C ATOM 397 O GLY A 28 12.484 -13.267 -27.234 1.00 0.00 O ATOM 0 H GLY A 28 12.215 -10.177 -24.304 1.00 0.00 H new ATOM 0 HA2 GLY A 28 11.127 -10.602 -26.236 1.00 0.00 H new ATOM 0 HA3 GLY A 28 12.719 -10.749 -26.953 1.00 0.00 H new ATOM 401 N LYS A 29 10.827 -13.177 -25.718 1.00 0.00 N ATOM 402 CA LYS A 29 10.462 -14.599 -25.840 1.00 0.00 C ATOM 403 C LYS A 29 8.975 -14.816 -25.699 1.00 0.00 C ATOM 404 O LYS A 29 8.523 -15.913 -25.385 1.00 0.00 O ATOM 405 CB LYS A 29 11.303 -15.431 -24.859 1.00 0.00 C ATOM 406 CG LYS A 29 12.520 -16.053 -25.559 1.00 0.00 C ATOM 407 CD LYS A 29 12.396 -17.575 -25.588 1.00 0.00 C ATOM 408 CE LYS A 29 13.523 -18.184 -26.425 1.00 0.00 C ATOM 409 NZ LYS A 29 14.414 -19.021 -25.586 1.00 0.00 N ATOM 0 H LYS A 29 10.252 -12.657 -25.055 1.00 0.00 H new ATOM 0 HA LYS A 29 10.697 -14.945 -26.847 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.637 -14.799 -24.036 1.00 0.00 H new ATOM 0 HB3 LYS A 29 10.687 -16.219 -24.426 1.00 0.00 H new ATOM 0 HG2 LYS A 29 12.599 -15.669 -26.576 1.00 0.00 H new ATOM 0 HG3 LYS A 29 13.433 -15.766 -25.038 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.434 -17.969 -24.572 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.430 -17.860 -26.004 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.099 -18.788 -27.227 1.00 0.00 H new ATOM 0 HE3 LYS A 29 14.102 -17.389 -26.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 15.170 -19.423 -26.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 14.834 -18.436 -24.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.863 -19.792 -25.157 1.00 0.00 H new ATOM 423 N THR A 30 8.222 -13.761 -25.947 1.00 0.00 N ATOM 424 CA THR A 30 6.783 -13.776 -25.786 1.00 0.00 C ATOM 425 C THR A 30 6.154 -13.418 -27.113 1.00 0.00 C ATOM 426 O THR A 30 6.777 -12.773 -27.963 1.00 0.00 O ATOM 427 CB THR A 30 6.410 -12.769 -24.712 1.00 0.00 C ATOM 428 OG1 THR A 30 6.669 -11.485 -25.237 1.00 0.00 O ATOM 429 CG2 THR A 30 7.223 -12.960 -23.434 1.00 0.00 C ATOM 0 H THR A 30 8.594 -12.867 -26.267 1.00 0.00 H new ATOM 0 HA THR A 30 6.424 -14.759 -25.481 1.00 0.00 H new ATOM 0 HB THR A 30 5.361 -12.902 -24.448 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.795 -10.850 -24.501 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.921 -12.217 -22.696 1.00 0.00 H new ATOM 0 HG22 THR A 30 7.046 -13.959 -23.036 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.283 -12.840 -23.656 1.00 0.00 H new ATOM 437 N GLY A 31 4.902 -13.834 -27.297 1.00 0.00 N ATOM 438 CA GLY A 31 4.192 -13.578 -28.539 1.00 0.00 C ATOM 439 C GLY A 31 4.384 -12.164 -29.050 1.00 0.00 C ATOM 440 O GLY A 31 4.674 -11.959 -30.226 1.00 0.00 O ATOM 0 H GLY A 31 4.363 -14.349 -26.600 1.00 0.00 H new ATOM 0 HA2 GLY A 31 4.533 -14.282 -29.298 1.00 0.00 H new ATOM 0 HA3 GLY A 31 3.128 -13.763 -28.388 1.00 0.00 H new ATOM 444 N SER A 32 4.133 -11.186 -28.180 1.00 0.00 N ATOM 445 CA SER A 32 4.399 -9.781 -28.478 1.00 0.00 C ATOM 446 C SER A 32 5.890 -9.513 -28.579 1.00 0.00 C ATOM 447 O SER A 32 6.402 -9.375 -29.686 1.00 0.00 O ATOM 448 CB SER A 32 3.732 -8.873 -27.444 1.00 0.00 C ATOM 449 OG SER A 32 4.209 -7.539 -27.493 1.00 0.00 O ATOM 0 H SER A 32 3.741 -11.346 -27.252 1.00 0.00 H new ATOM 0 HA SER A 32 3.964 -9.552 -29.451 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.654 -8.875 -27.608 1.00 0.00 H new ATOM 0 HB3 SER A 32 3.904 -9.279 -26.447 1.00 0.00 H new ATOM 0 HG SER A 32 3.749 -7.002 -26.814 1.00 0.00 H new ATOM 455 N SER A 33 6.550 -9.381 -27.430 1.00 0.00 N ATOM 456 CA SER A 33 7.977 -9.098 -27.317 1.00 0.00 C ATOM 457 C SER A 33 8.379 -9.057 -25.856 1.00 0.00 C ATOM 458 O SER A 33 9.234 -9.812 -25.406 1.00 0.00 O ATOM 459 CB SER A 33 8.342 -7.780 -28.019 1.00 0.00 C ATOM 460 OG SER A 33 7.700 -6.647 -27.454 1.00 0.00 O ATOM 0 H SER A 33 6.090 -9.471 -26.524 1.00 0.00 H new ATOM 0 HA SER A 33 8.527 -9.897 -27.814 1.00 0.00 H new ATOM 0 HB2 SER A 33 9.422 -7.638 -27.972 1.00 0.00 H new ATOM 0 HB3 SER A 33 8.075 -7.852 -29.073 1.00 0.00 H new ATOM 0 HG SER A 33 8.218 -6.326 -26.687 1.00 0.00 H new ATOM 466 N TYR A 34 7.751 -8.157 -25.106 1.00 0.00 N ATOM 467 CA TYR A 34 8.061 -7.930 -23.707 1.00 0.00 C ATOM 468 C TYR A 34 7.770 -9.175 -22.828 1.00 0.00 C ATOM 469 O TYR A 34 6.803 -9.889 -23.089 1.00 0.00 O ATOM 470 CB TYR A 34 7.180 -6.792 -23.211 1.00 0.00 C ATOM 471 CG TYR A 34 7.354 -5.493 -23.989 1.00 0.00 C ATOM 472 CD1 TYR A 34 6.581 -5.253 -25.127 1.00 0.00 C ATOM 473 CD2 TYR A 34 8.249 -4.515 -23.537 1.00 0.00 C ATOM 474 CE1 TYR A 34 6.743 -4.059 -25.858 1.00 0.00 C ATOM 475 CE2 TYR A 34 8.397 -3.314 -24.266 1.00 0.00 C ATOM 476 CZ TYR A 34 7.647 -3.102 -25.419 1.00 0.00 C ATOM 477 OH TYR A 34 7.780 -1.903 -26.081 1.00 0.00 O ATOM 0 H TYR A 34 7.004 -7.560 -25.461 1.00 0.00 H new ATOM 0 HA TYR A 34 9.124 -7.701 -23.629 1.00 0.00 H new ATOM 0 HB2 TYR A 34 6.136 -7.102 -23.269 1.00 0.00 H new ATOM 0 HB3 TYR A 34 7.400 -6.607 -22.160 1.00 0.00 H new ATOM 0 HD1 TYR A 34 5.856 -5.986 -25.448 1.00 0.00 H new ATOM 0 HD2 TYR A 34 8.823 -4.678 -22.637 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.166 -3.890 -26.755 1.00 0.00 H new ATOM 0 HE2 TYR A 34 9.093 -2.560 -23.928 1.00 0.00 H new ATOM 0 HH TYR A 34 7.131 -1.860 -26.814 1.00 0.00 H new ATOM 487 N PRO A 35 8.548 -9.348 -21.752 1.00 0.00 N ATOM 488 CA PRO A 35 9.609 -8.432 -21.360 1.00 0.00 C ATOM 489 C PRO A 35 10.836 -8.563 -22.249 1.00 0.00 C ATOM 490 O PRO A 35 10.930 -9.450 -23.085 1.00 0.00 O ATOM 491 CB PRO A 35 9.910 -8.724 -19.890 1.00 0.00 C ATOM 492 CG PRO A 35 9.366 -10.119 -19.653 1.00 0.00 C ATOM 493 CD PRO A 35 8.457 -10.468 -20.836 1.00 0.00 C ATOM 0 HA PRO A 35 9.295 -7.396 -21.483 1.00 0.00 H new ATOM 0 HB2 PRO A 35 10.980 -8.677 -19.689 1.00 0.00 H new ATOM 0 HB3 PRO A 35 9.430 -7.996 -19.236 1.00 0.00 H new ATOM 0 HG2 PRO A 35 10.180 -10.839 -19.570 1.00 0.00 H new ATOM 0 HG3 PRO A 35 8.809 -10.159 -18.717 1.00 0.00 H new ATOM 0 HD2 PRO A 35 8.779 -11.392 -21.316 1.00 0.00 H new ATOM 0 HD3 PRO A 35 7.429 -10.621 -20.507 1.00 0.00 H new ATOM 501 N HIS A 36 11.763 -7.634 -22.103 1.00 0.00 N ATOM 502 CA HIS A 36 12.963 -7.598 -22.925 1.00 0.00 C ATOM 503 C HIS A 36 14.135 -7.165 -22.086 1.00 0.00 C ATOM 504 O HIS A 36 13.942 -6.791 -20.935 1.00 0.00 O ATOM 505 CB HIS A 36 12.774 -6.760 -24.187 1.00 0.00 C ATOM 506 CG HIS A 36 12.269 -5.350 -24.007 1.00 0.00 C ATOM 507 ND1 HIS A 36 12.816 -4.240 -24.609 1.00 0.00 N ATOM 508 CD2 HIS A 36 11.268 -4.939 -23.186 1.00 0.00 C ATOM 509 CE1 HIS A 36 12.136 -3.167 -24.184 1.00 0.00 C ATOM 510 NE2 HIS A 36 11.196 -3.580 -23.325 1.00 0.00 N ATOM 0 H HIS A 36 11.708 -6.884 -21.414 1.00 0.00 H new ATOM 0 HA HIS A 36 13.173 -8.603 -23.291 1.00 0.00 H new ATOM 0 HB2 HIS A 36 13.730 -6.713 -24.708 1.00 0.00 H new ATOM 0 HB3 HIS A 36 12.080 -7.287 -24.842 1.00 0.00 H new ATOM 0 HD1 HIS A 36 13.599 -4.235 -25.262 1.00 0.00 H new ATOM 0 HD2 HIS A 36 10.653 -5.560 -22.551 1.00 0.00 H new ATOM 0 HE1 HIS A 36 12.315 -2.145 -24.483 1.00 0.00 H new ATOM 519 N TRP A 37 15.345 -7.286 -22.614 1.00 0.00 N ATOM 520 CA TRP A 37 16.517 -6.852 -21.866 1.00 0.00 C ATOM 521 C TRP A 37 16.530 -5.328 -21.817 1.00 0.00 C ATOM 522 O TRP A 37 16.405 -4.643 -22.839 1.00 0.00 O ATOM 523 CB TRP A 37 17.760 -7.420 -22.510 1.00 0.00 C ATOM 524 CG TRP A 37 19.046 -6.843 -21.989 1.00 0.00 C ATOM 525 CD1 TRP A 37 19.446 -6.718 -20.700 1.00 0.00 C ATOM 526 CD2 TRP A 37 20.144 -6.320 -22.781 1.00 0.00 C ATOM 527 NE1 TRP A 37 20.701 -6.146 -20.635 1.00 0.00 N ATOM 528 CE2 TRP A 37 21.159 -5.882 -21.901 1.00 0.00 C ATOM 529 CE3 TRP A 37 20.325 -6.167 -24.163 1.00 0.00 C ATOM 530 CZ2 TRP A 37 22.336 -5.296 -22.358 1.00 0.00 C ATOM 531 CZ3 TRP A 37 21.502 -5.568 -24.635 1.00 0.00 C ATOM 532 CH2 TRP A 37 22.481 -5.131 -23.739 1.00 0.00 C ATOM 0 H TRP A 37 15.540 -7.673 -23.538 1.00 0.00 H new ATOM 0 HA TRP A 37 16.487 -7.220 -20.840 1.00 0.00 H new ATOM 0 HB2 TRP A 37 17.772 -8.499 -22.359 1.00 0.00 H new ATOM 0 HB3 TRP A 37 17.708 -7.249 -23.585 1.00 0.00 H new ATOM 0 HD1 TRP A 37 18.864 -7.023 -19.843 1.00 0.00 H new ATOM 0 HE1 TRP A 37 21.211 -5.949 -19.774 1.00 0.00 H new ATOM 0 HE3 TRP A 37 19.568 -6.506 -24.855 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 23.108 -4.981 -21.672 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.653 -5.444 -25.697 1.00 0.00 H new ATOM 0 HH2 TRP A 37 23.371 -4.654 -24.122 1.00 0.00 H new ATOM 543 N PHE A 38 16.685 -4.831 -20.590 1.00 0.00 N ATOM 544 CA PHE A 38 16.743 -3.423 -20.288 1.00 0.00 C ATOM 545 C PHE A 38 18.220 -3.090 -20.139 1.00 0.00 C ATOM 546 O PHE A 38 18.775 -3.025 -19.037 1.00 0.00 O ATOM 547 CB PHE A 38 16.008 -3.178 -18.973 1.00 0.00 C ATOM 548 CG PHE A 38 16.088 -1.736 -18.497 1.00 0.00 C ATOM 549 CD1 PHE A 38 15.669 -0.702 -19.332 1.00 0.00 C ATOM 550 CD2 PHE A 38 16.648 -1.425 -17.257 1.00 0.00 C ATOM 551 CE1 PHE A 38 15.792 0.621 -18.920 1.00 0.00 C ATOM 552 CE2 PHE A 38 16.724 -0.099 -16.814 1.00 0.00 C ATOM 553 CZ PHE A 38 16.309 0.920 -17.659 1.00 0.00 C ATOM 0 H PHE A 38 16.775 -5.423 -19.764 1.00 0.00 H new ATOM 0 HA PHE A 38 16.281 -2.808 -21.060 1.00 0.00 H new ATOM 0 HB2 PHE A 38 14.961 -3.456 -19.093 1.00 0.00 H new ATOM 0 HB3 PHE A 38 16.425 -3.830 -18.205 1.00 0.00 H new ATOM 0 HD1 PHE A 38 15.248 -0.928 -20.301 1.00 0.00 H new ATOM 0 HD2 PHE A 38 17.028 -2.218 -16.630 1.00 0.00 H new ATOM 0 HE1 PHE A 38 15.486 1.420 -19.579 1.00 0.00 H new ATOM 0 HE2 PHE A 38 17.101 0.128 -15.828 1.00 0.00 H new ATOM 0 HZ PHE A 38 16.386 1.949 -17.340 1.00 0.00 H new ATOM 563 N THR A 39 18.852 -2.866 -21.292 1.00 0.00 N ATOM 564 CA THR A 39 20.214 -2.346 -21.377 1.00 0.00 C ATOM 565 C THR A 39 20.446 -1.284 -20.339 1.00 0.00 C ATOM 566 O THR A 39 21.554 -1.176 -19.829 1.00 0.00 O ATOM 567 CB THR A 39 20.467 -1.763 -22.774 1.00 0.00 C ATOM 568 OG1 THR A 39 19.488 -0.800 -23.096 1.00 0.00 O ATOM 569 CG2 THR A 39 20.402 -2.849 -23.848 1.00 0.00 C ATOM 0 H THR A 39 18.426 -3.043 -22.202 1.00 0.00 H new ATOM 0 HA THR A 39 20.905 -3.169 -21.195 1.00 0.00 H new ATOM 0 HB THR A 39 21.460 -1.314 -22.751 1.00 0.00 H new ATOM 0 HG1 THR A 39 19.666 -0.438 -23.989 1.00 0.00 H new ATOM 0 HG21 THR A 39 20.585 -2.405 -24.826 1.00 0.00 H new ATOM 0 HG22 THR A 39 21.159 -3.606 -23.646 1.00 0.00 H new ATOM 0 HG23 THR A 39 19.415 -3.311 -23.839 1.00 0.00 H new ATOM 577 N ASN A 40 19.424 -0.486 -19.996 1.00 0.00 N ATOM 578 CA ASN A 40 19.554 0.583 -18.990 1.00 0.00 C ATOM 579 C ASN A 40 20.685 1.565 -19.332 1.00 0.00 C ATOM 580 O ASN A 40 21.273 2.251 -18.488 1.00 0.00 O ATOM 581 CB ASN A 40 19.761 -0.040 -17.599 1.00 0.00 C ATOM 582 CG ASN A 40 19.755 1.018 -16.503 1.00 0.00 C ATOM 583 OD1 ASN A 40 19.125 2.060 -16.570 1.00 0.00 O ATOM 584 ND2 ASN A 40 20.454 0.742 -15.423 1.00 0.00 N ATOM 0 H ASN A 40 18.492 -0.561 -20.403 1.00 0.00 H new ATOM 0 HA ASN A 40 18.631 1.163 -18.989 1.00 0.00 H new ATOM 0 HB2 ASN A 40 18.974 -0.769 -17.406 1.00 0.00 H new ATOM 0 HB3 ASN A 40 20.708 -0.580 -17.579 1.00 0.00 H new ATOM 0 HD21 ASN A 40 20.468 1.399 -14.643 1.00 0.00 H new ATOM 0 HD22 ASN A 40 20.981 -0.129 -15.366 1.00 0.00 H new ATOM 591 N GLY A 41 21.056 1.560 -20.608 1.00 0.00 N ATOM 592 CA GLY A 41 22.220 2.273 -21.054 1.00 0.00 C ATOM 593 C GLY A 41 23.362 1.371 -21.472 1.00 0.00 C ATOM 594 O GLY A 41 23.958 1.695 -22.496 1.00 0.00 O ATOM 0 H GLY A 41 20.556 1.064 -21.346 1.00 0.00 H new ATOM 0 HA2 GLY A 41 21.945 2.910 -21.895 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.561 2.930 -20.254 1.00 0.00 H new ATOM 598 N TYR A 42 23.670 0.323 -20.691 1.00 0.00 N ATOM 599 CA TYR A 42 24.755 -0.632 -20.928 1.00 0.00 C ATOM 600 C TYR A 42 24.764 -1.086 -22.384 1.00 0.00 C ATOM 601 O TYR A 42 23.723 -1.146 -23.036 1.00 0.00 O ATOM 602 CB TYR A 42 24.570 -1.846 -19.995 1.00 0.00 C ATOM 603 CG TYR A 42 24.754 -1.520 -18.508 1.00 0.00 C ATOM 604 CD1 TYR A 42 26.040 -1.264 -18.039 1.00 0.00 C ATOM 605 CD2 TYR A 42 23.679 -1.497 -17.610 1.00 0.00 C ATOM 606 CE1 TYR A 42 26.278 -1.020 -16.666 1.00 0.00 C ATOM 607 CE2 TYR A 42 23.898 -1.216 -16.242 1.00 0.00 C ATOM 608 CZ TYR A 42 25.196 -0.992 -15.791 1.00 0.00 C ATOM 609 OH TYR A 42 25.431 -0.743 -14.463 1.00 0.00 O ATOM 0 H TYR A 42 23.145 0.113 -19.842 1.00 0.00 H new ATOM 0 HA TYR A 42 25.709 -0.149 -20.718 1.00 0.00 H new ATOM 0 HB2 TYR A 42 23.573 -2.259 -20.146 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.282 -2.621 -20.278 1.00 0.00 H new ATOM 0 HD1 TYR A 42 26.867 -1.252 -18.733 1.00 0.00 H new ATOM 0 HD2 TYR A 42 22.678 -1.695 -17.965 1.00 0.00 H new ATOM 0 HE1 TYR A 42 27.282 -0.858 -16.303 1.00 0.00 H new ATOM 0 HE2 TYR A 42 23.067 -1.175 -15.554 1.00 0.00 H new ATOM 0 HH TYR A 42 24.582 -0.753 -13.973 1.00 0.00 H new ATOM 619 N ASP A 43 25.944 -1.431 -22.875 1.00 0.00 N ATOM 620 CA ASP A 43 26.068 -1.925 -24.253 1.00 0.00 C ATOM 621 C ASP A 43 25.708 -3.406 -24.339 1.00 0.00 C ATOM 622 O ASP A 43 25.090 -3.857 -25.303 1.00 0.00 O ATOM 623 CB ASP A 43 27.504 -1.745 -24.741 1.00 0.00 C ATOM 624 CG ASP A 43 27.638 -0.686 -25.832 1.00 0.00 C ATOM 625 OD1 ASP A 43 27.251 -0.994 -26.988 1.00 0.00 O ATOM 626 OD2 ASP A 43 28.114 0.415 -25.500 1.00 0.00 O ATOM 0 H ASP A 43 26.821 -1.382 -22.356 1.00 0.00 H new ATOM 0 HA ASP A 43 25.381 -1.353 -24.876 1.00 0.00 H new ATOM 0 HB2 ASP A 43 28.136 -1.470 -23.897 1.00 0.00 H new ATOM 0 HB3 ASP A 43 27.875 -2.697 -25.120 1.00 0.00 H new ATOM 631 N GLY A 44 26.098 -4.166 -23.313 1.00 0.00 N ATOM 632 CA GLY A 44 25.870 -5.607 -23.243 1.00 0.00 C ATOM 633 C GLY A 44 26.067 -6.126 -21.829 1.00 0.00 C ATOM 634 O GLY A 44 25.105 -6.371 -21.101 1.00 0.00 O ATOM 0 H GLY A 44 26.586 -3.792 -22.499 1.00 0.00 H new ATOM 0 HA2 GLY A 44 24.858 -5.835 -23.579 1.00 0.00 H new ATOM 0 HA3 GLY A 44 26.554 -6.119 -23.920 1.00 0.00 H new ATOM 638 N ASP A 45 27.330 -6.275 -21.444 1.00 0.00 N ATOM 639 CA ASP A 45 27.713 -6.796 -20.133 1.00 0.00 C ATOM 640 C ASP A 45 28.394 -5.727 -19.288 1.00 0.00 C ATOM 641 O ASP A 45 27.924 -5.368 -18.206 1.00 0.00 O ATOM 642 CB ASP A 45 28.710 -7.943 -20.307 1.00 0.00 C ATOM 643 CG ASP A 45 28.176 -9.294 -19.917 1.00 0.00 C ATOM 644 OD1 ASP A 45 27.139 -9.699 -20.471 1.00 0.00 O ATOM 645 OD2 ASP A 45 28.826 -9.902 -19.034 1.00 0.00 O ATOM 0 H ASP A 45 28.125 -6.036 -22.037 1.00 0.00 H new ATOM 0 HA ASP A 45 26.802 -7.132 -19.637 1.00 0.00 H new ATOM 0 HB2 ASP A 45 29.027 -7.978 -21.349 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.598 -7.731 -19.711 1.00 0.00 H new ATOM 650 N GLY A 46 29.550 -5.253 -19.778 1.00 0.00 N ATOM 651 CA GLY A 46 30.334 -4.203 -19.157 1.00 0.00 C ATOM 652 C GLY A 46 29.509 -2.942 -18.969 1.00 0.00 C ATOM 653 O GLY A 46 28.294 -2.937 -19.145 1.00 0.00 O ATOM 0 H GLY A 46 29.966 -5.606 -20.640 1.00 0.00 H new ATOM 0 HA2 GLY A 46 30.706 -4.545 -18.191 1.00 0.00 H new ATOM 0 HA3 GLY A 46 31.205 -3.983 -19.774 1.00 0.00 H new ATOM 657 N LYS A 47 30.178 -1.852 -18.603 1.00 0.00 N ATOM 658 CA LYS A 47 29.500 -0.568 -18.462 1.00 0.00 C ATOM 659 C LYS A 47 28.843 -0.124 -19.780 1.00 0.00 C ATOM 660 O LYS A 47 28.689 -0.873 -20.743 1.00 0.00 O ATOM 661 CB LYS A 47 30.461 0.473 -17.890 1.00 0.00 C ATOM 662 CG LYS A 47 31.195 -0.054 -16.650 1.00 0.00 C ATOM 663 CD LYS A 47 31.695 1.101 -15.777 1.00 0.00 C ATOM 664 CE LYS A 47 30.886 1.182 -14.476 1.00 0.00 C ATOM 665 NZ LYS A 47 30.669 2.590 -14.066 1.00 0.00 N ATOM 0 H LYS A 47 31.178 -1.832 -18.401 1.00 0.00 H new ATOM 0 HA LYS A 47 28.681 -0.678 -17.751 1.00 0.00 H new ATOM 0 HB2 LYS A 47 31.188 0.754 -18.652 1.00 0.00 H new ATOM 0 HB3 LYS A 47 29.907 1.375 -17.629 1.00 0.00 H new ATOM 0 HG2 LYS A 47 30.526 -0.690 -16.070 1.00 0.00 H new ATOM 0 HG3 LYS A 47 32.037 -0.674 -16.957 1.00 0.00 H new ATOM 0 HD2 LYS A 47 32.751 0.960 -15.547 1.00 0.00 H new ATOM 0 HD3 LYS A 47 31.611 2.040 -16.323 1.00 0.00 H new ATOM 0 HE2 LYS A 47 29.924 0.688 -14.612 1.00 0.00 H new ATOM 0 HE3 LYS A 47 31.411 0.647 -13.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 30.119 2.614 -13.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 31.588 3.053 -13.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 30.147 3.092 -14.812 1.00 0.00 H new ATOM 679 N LEU A 48 28.402 1.118 -19.787 1.00 0.00 N ATOM 680 CA LEU A 48 27.721 1.663 -20.951 1.00 0.00 C ATOM 681 C LEU A 48 28.719 2.374 -21.865 1.00 0.00 C ATOM 682 O LEU A 48 29.896 2.482 -21.513 1.00 0.00 O ATOM 683 CB LEU A 48 26.567 2.542 -20.476 1.00 0.00 C ATOM 684 CG LEU A 48 26.146 2.436 -19.004 1.00 0.00 C ATOM 685 CD1 LEU A 48 27.042 3.356 -18.166 1.00 0.00 C ATOM 686 CD2 LEU A 48 24.685 2.806 -18.831 1.00 0.00 C ATOM 0 H LEU A 48 28.500 1.768 -19.007 1.00 0.00 H new ATOM 0 HA LEU A 48 27.287 0.871 -21.561 1.00 0.00 H new ATOM 0 HB2 LEU A 48 26.833 3.580 -20.674 1.00 0.00 H new ATOM 0 HB3 LEU A 48 25.696 2.313 -21.091 1.00 0.00 H new ATOM 0 HG LEU A 48 26.264 1.406 -18.667 1.00 0.00 H new ATOM 0 HD11 LEU A 48 26.752 3.289 -17.117 1.00 0.00 H new ATOM 0 HD12 LEU A 48 28.082 3.049 -18.275 1.00 0.00 H new ATOM 0 HD13 LEU A 48 26.929 4.385 -18.509 1.00 0.00 H new ATOM 0 HD21 LEU A 48 24.411 2.723 -17.779 1.00 0.00 H new ATOM 0 HD22 LEU A 48 24.527 3.831 -19.168 1.00 0.00 H new ATOM 0 HD23 LEU A 48 24.066 2.131 -19.422 1.00 0.00 H new ATOM 698 N PRO A 49 28.236 2.865 -23.017 1.00 0.00 N ATOM 699 CA PRO A 49 29.090 3.586 -23.932 1.00 0.00 C ATOM 700 C PRO A 49 29.465 4.948 -23.368 1.00 0.00 C ATOM 701 O PRO A 49 28.783 5.520 -22.513 1.00 0.00 O ATOM 702 CB PRO A 49 28.281 3.670 -25.234 1.00 0.00 C ATOM 703 CG PRO A 49 26.832 3.395 -24.868 1.00 0.00 C ATOM 704 CD PRO A 49 26.859 2.817 -23.463 1.00 0.00 C ATOM 0 HA PRO A 49 30.046 3.091 -24.103 1.00 0.00 H new ATOM 0 HB2 PRO A 49 28.384 4.654 -25.691 1.00 0.00 H new ATOM 0 HB3 PRO A 49 28.641 2.942 -25.961 1.00 0.00 H new ATOM 0 HG2 PRO A 49 26.240 4.310 -24.903 1.00 0.00 H new ATOM 0 HG3 PRO A 49 26.378 2.695 -25.570 1.00 0.00 H new ATOM 0 HD2 PRO A 49 26.216 3.392 -22.796 1.00 0.00 H new ATOM 0 HD3 PRO A 49 26.487 1.792 -23.459 1.00 0.00 H new ATOM 712 N LYS A 50 30.558 5.505 -23.883 1.00 0.00 N ATOM 713 CA LYS A 50 31.018 6.837 -23.515 1.00 0.00 C ATOM 714 C LYS A 50 30.000 7.889 -23.955 1.00 0.00 C ATOM 715 O LYS A 50 29.996 8.324 -25.101 1.00 0.00 O ATOM 716 CB LYS A 50 32.428 7.079 -24.052 1.00 0.00 C ATOM 717 CG LYS A 50 32.741 8.578 -24.197 1.00 0.00 C ATOM 718 CD LYS A 50 34.197 8.920 -23.886 1.00 0.00 C ATOM 719 CE LYS A 50 34.970 9.175 -25.177 1.00 0.00 C ATOM 720 NZ LYS A 50 34.905 10.611 -25.549 1.00 0.00 N ATOM 0 H LYS A 50 31.151 5.041 -24.571 1.00 0.00 H new ATOM 0 HA LYS A 50 31.090 6.920 -22.431 1.00 0.00 H new ATOM 0 HB2 LYS A 50 33.155 6.620 -23.382 1.00 0.00 H new ATOM 0 HB3 LYS A 50 32.536 6.591 -25.021 1.00 0.00 H new ATOM 0 HG2 LYS A 50 32.509 8.895 -25.214 1.00 0.00 H new ATOM 0 HG3 LYS A 50 32.091 9.145 -23.531 1.00 0.00 H new ATOM 0 HD2 LYS A 50 34.242 9.802 -23.247 1.00 0.00 H new ATOM 0 HD3 LYS A 50 34.659 8.102 -23.333 1.00 0.00 H new ATOM 0 HE2 LYS A 50 36.010 8.873 -25.051 1.00 0.00 H new ATOM 0 HE3 LYS A 50 34.557 8.566 -25.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 35.436 10.766 -26.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 33.913 10.889 -25.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 35.321 11.186 -24.788 1.00 0.00 H new ATOM 734 N GLY A 51 29.152 8.295 -23.018 1.00 0.00 N ATOM 735 CA GLY A 51 28.078 9.252 -23.288 1.00 0.00 C ATOM 736 C GLY A 51 26.705 8.654 -23.017 1.00 0.00 C ATOM 737 O GLY A 51 25.762 8.902 -23.765 1.00 0.00 O ATOM 0 H GLY A 51 29.186 7.973 -22.051 1.00 0.00 H new ATOM 0 HA2 GLY A 51 28.217 10.138 -22.669 1.00 0.00 H new ATOM 0 HA3 GLY A 51 28.134 9.577 -24.327 1.00 0.00 H new ATOM 741 N ARG A 52 26.583 7.878 -21.940 1.00 0.00 N ATOM 742 CA ARG A 52 25.309 7.315 -21.512 1.00 0.00 C ATOM 743 C ARG A 52 24.982 7.745 -20.099 1.00 0.00 C ATOM 744 O ARG A 52 25.872 8.089 -19.327 1.00 0.00 O ATOM 745 CB ARG A 52 25.389 5.796 -21.597 1.00 0.00 C ATOM 746 CG ARG A 52 24.014 5.138 -21.526 1.00 0.00 C ATOM 747 CD ARG A 52 23.094 5.645 -22.640 1.00 0.00 C ATOM 748 NE ARG A 52 22.504 4.527 -23.379 1.00 0.00 N ATOM 749 CZ ARG A 52 21.364 4.569 -24.044 1.00 0.00 C ATOM 750 NH1 ARG A 52 20.672 5.682 -24.128 1.00 0.00 N ATOM 751 NH2 ARG A 52 20.895 3.494 -24.628 1.00 0.00 N ATOM 0 H ARG A 52 27.368 7.624 -21.341 1.00 0.00 H new ATOM 0 HA ARG A 52 24.516 7.679 -22.165 1.00 0.00 H new ATOM 0 HB2 ARG A 52 25.877 5.512 -22.529 1.00 0.00 H new ATOM 0 HB3 ARG A 52 26.011 5.421 -20.784 1.00 0.00 H new ATOM 0 HG2 ARG A 52 24.122 4.056 -21.605 1.00 0.00 H new ATOM 0 HG3 ARG A 52 23.561 5.343 -20.556 1.00 0.00 H new ATOM 0 HD2 ARG A 52 22.303 6.261 -22.212 1.00 0.00 H new ATOM 0 HD3 ARG A 52 23.659 6.280 -23.323 1.00 0.00 H new ATOM 0 HE ARG A 52 23.015 3.644 -23.380 1.00 0.00 H new ATOM 0 HH11 ARG A 52 21.013 6.530 -23.676 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.793 5.698 -24.645 1.00 0.00 H new ATOM 0 HH21 ARG A 52 21.411 2.616 -24.571 1.00 0.00 H new ATOM 0 HH22 ARG A 52 20.014 3.535 -25.140 1.00 0.00 H new ATOM 765 N THR A 53 23.697 7.649 -19.772 1.00 0.00 N ATOM 766 CA THR A 53 23.188 8.014 -18.459 1.00 0.00 C ATOM 767 C THR A 53 22.199 6.948 -17.976 1.00 0.00 C ATOM 768 O THR A 53 21.061 6.925 -18.449 1.00 0.00 O ATOM 769 CB THR A 53 22.617 9.427 -18.532 1.00 0.00 C ATOM 770 OG1 THR A 53 23.733 10.249 -18.809 1.00 0.00 O ATOM 771 CG2 THR A 53 22.046 9.887 -17.195 1.00 0.00 C ATOM 0 H THR A 53 22.979 7.314 -20.414 1.00 0.00 H new ATOM 0 HA THR A 53 23.979 8.038 -17.709 1.00 0.00 H new ATOM 0 HB THR A 53 21.817 9.470 -19.271 1.00 0.00 H new ATOM 0 HG1 THR A 53 23.443 11.183 -18.873 1.00 0.00 H new ATOM 0 HG21 THR A 53 21.651 10.898 -17.296 1.00 0.00 H new ATOM 0 HG22 THR A 53 21.245 9.214 -16.891 1.00 0.00 H new ATOM 0 HG23 THR A 53 22.833 9.879 -16.441 1.00 0.00 H new ATOM 779 N PRO A 54 22.669 6.019 -17.112 1.00 0.00 N ATOM 780 CA PRO A 54 21.821 4.986 -16.529 1.00 0.00 C ATOM 781 C PRO A 54 20.879 5.568 -15.490 1.00 0.00 C ATOM 782 O PRO A 54 20.916 6.757 -15.181 1.00 0.00 O ATOM 783 CB PRO A 54 22.787 3.959 -15.906 1.00 0.00 C ATOM 784 CG PRO A 54 24.116 4.681 -15.734 1.00 0.00 C ATOM 785 CD PRO A 54 24.018 5.958 -16.571 1.00 0.00 C ATOM 0 HA PRO A 54 21.180 4.522 -17.279 1.00 0.00 H new ATOM 0 HB2 PRO A 54 22.411 3.601 -14.948 1.00 0.00 H new ATOM 0 HB3 PRO A 54 22.898 3.087 -16.550 1.00 0.00 H new ATOM 0 HG2 PRO A 54 24.299 4.916 -14.685 1.00 0.00 H new ATOM 0 HG3 PRO A 54 24.944 4.057 -16.070 1.00 0.00 H new ATOM 0 HD2 PRO A 54 24.226 6.835 -15.959 1.00 0.00 H new ATOM 0 HD3 PRO A 54 24.754 5.948 -17.375 1.00 0.00 H new ATOM 793 N ILE A 55 20.057 4.702 -14.918 1.00 0.00 N ATOM 794 CA ILE A 55 19.090 5.099 -13.917 1.00 0.00 C ATOM 795 C ILE A 55 19.565 4.599 -12.562 1.00 0.00 C ATOM 796 O ILE A 55 20.097 3.495 -12.436 1.00 0.00 O ATOM 797 CB ILE A 55 17.700 4.588 -14.291 1.00 0.00 C ATOM 798 CG1 ILE A 55 17.402 4.828 -15.785 1.00 0.00 C ATOM 799 CG2 ILE A 55 16.660 5.312 -13.430 1.00 0.00 C ATOM 800 CD1 ILE A 55 15.959 4.532 -16.174 1.00 0.00 C ATOM 0 H ILE A 55 20.045 3.706 -15.137 1.00 0.00 H new ATOM 0 HA ILE A 55 19.008 6.185 -13.865 1.00 0.00 H new ATOM 0 HB ILE A 55 17.658 3.514 -14.110 1.00 0.00 H new ATOM 0 HG12 ILE A 55 17.630 5.865 -16.030 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.066 4.205 -16.384 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.663 4.956 -13.688 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.856 5.111 -12.377 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.720 6.385 -13.612 1.00 0.00 H new ATOM 0 HD11 ILE A 55 15.823 4.723 -17.238 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.732 3.488 -15.961 1.00 0.00 H new ATOM 0 HD13 ILE A 55 15.289 5.173 -15.602 1.00 0.00 H new ATOM 812 N LYS A 56 19.378 5.430 -11.537 1.00 0.00 N ATOM 813 CA LYS A 56 19.713 5.070 -10.168 1.00 0.00 C ATOM 814 C LYS A 56 18.469 4.552 -9.456 1.00 0.00 C ATOM 815 O LYS A 56 17.361 5.039 -9.663 1.00 0.00 O ATOM 816 CB LYS A 56 20.336 6.290 -9.486 1.00 0.00 C ATOM 817 CG LYS A 56 20.832 5.956 -8.071 1.00 0.00 C ATOM 818 CD LYS A 56 22.358 6.020 -7.944 1.00 0.00 C ATOM 819 CE LYS A 56 22.772 7.299 -7.222 1.00 0.00 C ATOM 820 NZ LYS A 56 22.435 7.217 -5.777 1.00 0.00 N ATOM 0 H LYS A 56 18.991 6.368 -11.636 1.00 0.00 H new ATOM 0 HA LYS A 56 20.445 4.263 -10.136 1.00 0.00 H new ATOM 0 HB2 LYS A 56 21.168 6.658 -10.086 1.00 0.00 H new ATOM 0 HB3 LYS A 56 19.601 7.093 -9.434 1.00 0.00 H new ATOM 0 HG2 LYS A 56 20.384 6.651 -7.361 1.00 0.00 H new ATOM 0 HG3 LYS A 56 20.491 4.957 -7.798 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.722 5.150 -7.397 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.815 5.988 -8.933 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.843 7.460 -7.342 1.00 0.00 H new ATOM 0 HE3 LYS A 56 22.268 8.155 -7.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 23.003 7.909 -5.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 21.425 7.425 -5.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 22.641 6.260 -5.426 1.00 0.00 H new ATOM 834 N PHE A 57 18.693 3.601 -8.557 1.00 0.00 N ATOM 835 CA PHE A 57 17.652 2.968 -7.754 1.00 0.00 C ATOM 836 C PHE A 57 18.015 3.002 -6.275 1.00 0.00 C ATOM 837 O PHE A 57 17.223 3.421 -5.436 1.00 0.00 O ATOM 838 CB PHE A 57 17.491 1.525 -8.241 1.00 0.00 C ATOM 839 CG PHE A 57 17.428 1.406 -9.761 1.00 0.00 C ATOM 840 CD1 PHE A 57 16.226 1.651 -10.428 1.00 0.00 C ATOM 841 CD2 PHE A 57 18.574 1.063 -10.491 1.00 0.00 C ATOM 842 CE1 PHE A 57 16.157 1.498 -11.821 1.00 0.00 C ATOM 843 CE2 PHE A 57 18.508 0.941 -11.883 1.00 0.00 C ATOM 844 CZ PHE A 57 17.299 1.158 -12.542 1.00 0.00 C ATOM 0 H PHE A 57 19.626 3.239 -8.361 1.00 0.00 H new ATOM 0 HA PHE A 57 16.712 3.508 -7.868 1.00 0.00 H new ATOM 0 HB2 PHE A 57 18.325 0.928 -7.871 1.00 0.00 H new ATOM 0 HB3 PHE A 57 16.582 1.103 -7.812 1.00 0.00 H new ATOM 0 HD1 PHE A 57 15.352 1.957 -9.873 1.00 0.00 H new ATOM 0 HD2 PHE A 57 19.509 0.893 -9.978 1.00 0.00 H new ATOM 0 HE1 PHE A 57 15.218 1.644 -12.334 1.00 0.00 H new ATOM 0 HE2 PHE A 57 19.392 0.679 -12.446 1.00 0.00 H new ATOM 0 HZ PHE A 57 17.248 1.062 -13.617 1.00 0.00 H new ATOM 854 N GLY A 58 19.240 2.566 -5.962 1.00 0.00 N ATOM 855 CA GLY A 58 19.728 2.428 -4.588 1.00 0.00 C ATOM 856 C GLY A 58 20.063 0.989 -4.227 1.00 0.00 C ATOM 857 O GLY A 58 20.544 0.722 -3.129 1.00 0.00 O ATOM 0 H GLY A 58 19.928 2.296 -6.665 1.00 0.00 H new ATOM 0 HA2 GLY A 58 20.616 3.047 -4.458 1.00 0.00 H new ATOM 0 HA3 GLY A 58 18.973 2.805 -3.899 1.00 0.00 H new ATOM 861 N LYS A 59 19.821 0.046 -5.141 1.00 0.00 N ATOM 862 CA LYS A 59 20.151 -1.362 -4.934 1.00 0.00 C ATOM 863 C LYS A 59 21.466 -1.682 -5.599 1.00 0.00 C ATOM 864 O LYS A 59 21.631 -1.354 -6.767 1.00 0.00 O ATOM 865 CB LYS A 59 18.994 -2.224 -5.465 1.00 0.00 C ATOM 866 CG LYS A 59 18.278 -2.884 -4.283 1.00 0.00 C ATOM 867 CD LYS A 59 18.770 -4.317 -4.043 1.00 0.00 C ATOM 868 CE LYS A 59 19.480 -4.454 -2.697 1.00 0.00 C ATOM 869 NZ LYS A 59 19.402 -5.853 -2.219 1.00 0.00 N ATOM 0 H LYS A 59 19.390 0.240 -6.045 1.00 0.00 H new ATOM 0 HA LYS A 59 20.273 -1.580 -3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 59 18.295 -1.608 -6.032 1.00 0.00 H new ATOM 0 HB3 LYS A 59 19.374 -2.985 -6.147 1.00 0.00 H new ATOM 0 HG2 LYS A 59 18.439 -2.290 -3.384 1.00 0.00 H new ATOM 0 HG3 LYS A 59 17.204 -2.895 -4.470 1.00 0.00 H new ATOM 0 HD2 LYS A 59 17.924 -5.003 -4.079 1.00 0.00 H new ATOM 0 HD3 LYS A 59 19.450 -4.607 -4.844 1.00 0.00 H new ATOM 0 HE2 LYS A 59 20.523 -4.153 -2.795 1.00 0.00 H new ATOM 0 HE3 LYS A 59 19.023 -3.786 -1.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 19.888 -5.935 -1.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 18.405 -6.127 -2.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 19.858 -6.482 -2.910 1.00 0.00 H new ATOM 883 N SER A 60 22.341 -2.378 -4.875 1.00 0.00 N ATOM 884 CA SER A 60 23.638 -2.823 -5.417 1.00 0.00 C ATOM 885 C SER A 60 23.460 -3.917 -6.478 1.00 0.00 C ATOM 886 O SER A 60 24.403 -4.347 -7.140 1.00 0.00 O ATOM 887 CB SER A 60 24.544 -3.291 -4.268 1.00 0.00 C ATOM 888 OG SER A 60 25.806 -3.760 -4.692 1.00 0.00 O ATOM 0 H SER A 60 22.180 -2.651 -3.905 1.00 0.00 H new ATOM 0 HA SER A 60 24.116 -1.980 -5.916 1.00 0.00 H new ATOM 0 HB2 SER A 60 24.689 -2.464 -3.572 1.00 0.00 H new ATOM 0 HB3 SER A 60 24.038 -4.085 -3.719 1.00 0.00 H new ATOM 0 HG SER A 60 25.775 -3.960 -5.651 1.00 0.00 H new ATOM 894 N ASP A 61 22.223 -4.390 -6.666 1.00 0.00 N ATOM 895 CA ASP A 61 21.892 -5.445 -7.609 1.00 0.00 C ATOM 896 C ASP A 61 21.570 -4.831 -8.958 1.00 0.00 C ATOM 897 O ASP A 61 22.229 -5.157 -9.945 1.00 0.00 O ATOM 898 CB ASP A 61 20.685 -6.249 -7.132 1.00 0.00 C ATOM 899 CG ASP A 61 20.854 -6.973 -5.789 1.00 0.00 C ATOM 900 OD1 ASP A 61 21.418 -6.389 -4.838 1.00 0.00 O ATOM 901 OD2 ASP A 61 20.339 -8.111 -5.701 1.00 0.00 O ATOM 0 H ASP A 61 21.414 -4.039 -6.154 1.00 0.00 H new ATOM 0 HA ASP A 61 22.749 -6.113 -7.689 1.00 0.00 H new ATOM 0 HB2 ASP A 61 19.831 -5.576 -7.056 1.00 0.00 H new ATOM 0 HB3 ASP A 61 20.441 -6.989 -7.894 1.00 0.00 H new ATOM 906 N CYS A 62 20.584 -3.932 -8.971 1.00 0.00 N ATOM 907 CA CYS A 62 20.197 -3.194 -10.166 1.00 0.00 C ATOM 908 C CYS A 62 21.285 -2.206 -10.568 1.00 0.00 C ATOM 909 O CYS A 62 21.394 -1.860 -11.742 1.00 0.00 O ATOM 910 CB CYS A 62 18.862 -2.475 -9.925 1.00 0.00 C ATOM 911 SG CYS A 62 17.888 -2.227 -11.416 1.00 0.00 S ATOM 0 H CYS A 62 20.031 -3.697 -8.147 1.00 0.00 H new ATOM 0 HA CYS A 62 20.070 -3.898 -10.989 1.00 0.00 H new ATOM 0 HB2 CYS A 62 18.274 -3.051 -9.211 1.00 0.00 H new ATOM 0 HB3 CYS A 62 19.060 -1.506 -9.467 1.00 0.00 H new ATOM 916 N ASP A 63 22.089 -1.766 -9.599 1.00 0.00 N ATOM 917 CA ASP A 63 23.248 -0.906 -9.855 1.00 0.00 C ATOM 918 C ASP A 63 24.352 -1.688 -10.555 1.00 0.00 C ATOM 919 O ASP A 63 25.030 -1.179 -11.454 1.00 0.00 O ATOM 920 CB ASP A 63 23.786 -0.363 -8.532 1.00 0.00 C ATOM 921 CG ASP A 63 25.110 0.400 -8.620 1.00 0.00 C ATOM 922 OD1 ASP A 63 25.310 1.125 -9.634 1.00 0.00 O ATOM 923 OD2 ASP A 63 25.875 0.295 -7.646 1.00 0.00 O ATOM 0 H ASP A 63 21.956 -1.995 -8.614 1.00 0.00 H new ATOM 0 HA ASP A 63 22.932 -0.084 -10.497 1.00 0.00 H new ATOM 0 HB2 ASP A 63 23.035 0.297 -8.099 1.00 0.00 H new ATOM 0 HB3 ASP A 63 23.913 -1.197 -7.842 1.00 0.00 H new ATOM 928 N ARG A 64 24.541 -2.952 -10.162 1.00 0.00 N ATOM 929 CA ARG A 64 25.566 -3.783 -10.771 1.00 0.00 C ATOM 930 C ARG A 64 25.404 -3.860 -12.297 1.00 0.00 C ATOM 931 O ARG A 64 24.315 -3.717 -12.847 1.00 0.00 O ATOM 932 CB ARG A 64 25.551 -5.178 -10.140 1.00 0.00 C ATOM 933 CG ARG A 64 25.122 -6.280 -11.113 1.00 0.00 C ATOM 934 CD ARG A 64 25.134 -7.664 -10.502 1.00 0.00 C ATOM 935 NE ARG A 64 24.551 -7.656 -9.166 1.00 0.00 N ATOM 936 CZ ARG A 64 24.861 -8.495 -8.195 1.00 0.00 C ATOM 937 NH1 ARG A 64 25.722 -9.464 -8.406 1.00 0.00 N ATOM 938 NH2 ARG A 64 24.326 -8.353 -7.009 1.00 0.00 N ATOM 0 H ARG A 64 23.999 -3.412 -9.431 1.00 0.00 H new ATOM 0 HA ARG A 64 26.535 -3.323 -10.580 1.00 0.00 H new ATOM 0 HB2 ARG A 64 26.546 -5.407 -9.759 1.00 0.00 H new ATOM 0 HB3 ARG A 64 24.875 -5.175 -9.285 1.00 0.00 H new ATOM 0 HG2 ARG A 64 24.118 -6.061 -11.477 1.00 0.00 H new ATOM 0 HG3 ARG A 64 25.785 -6.268 -11.978 1.00 0.00 H new ATOM 0 HD2 ARG A 64 24.578 -8.351 -11.140 1.00 0.00 H new ATOM 0 HD3 ARG A 64 26.158 -8.034 -10.452 1.00 0.00 H new ATOM 0 HE ARG A 64 23.847 -6.945 -8.965 1.00 0.00 H new ATOM 0 HH11 ARG A 64 26.155 -9.571 -9.323 1.00 0.00 H new ATOM 0 HH12 ARG A 64 25.958 -10.110 -7.652 1.00 0.00 H new ATOM 0 HH21 ARG A 64 23.668 -7.593 -6.834 1.00 0.00 H new ATOM 0 HH22 ARG A 64 24.567 -9.002 -6.260 1.00 0.00 H new ATOM 952 N PRO A 65 26.495 -4.195 -12.995 1.00 0.00 N ATOM 953 CA PRO A 65 26.416 -4.383 -14.435 1.00 0.00 C ATOM 954 C PRO A 65 25.650 -5.653 -14.834 1.00 0.00 C ATOM 955 O PRO A 65 25.801 -6.693 -14.194 1.00 0.00 O ATOM 956 CB PRO A 65 27.873 -4.404 -14.889 1.00 0.00 C ATOM 957 CG PRO A 65 28.707 -4.707 -13.651 1.00 0.00 C ATOM 958 CD PRO A 65 27.797 -4.512 -12.450 1.00 0.00 C ATOM 0 HA PRO A 65 25.847 -3.589 -14.918 1.00 0.00 H new ATOM 0 HB2 PRO A 65 28.029 -5.162 -15.657 1.00 0.00 H new ATOM 0 HB3 PRO A 65 28.158 -3.446 -15.324 1.00 0.00 H new ATOM 0 HG2 PRO A 65 29.091 -5.727 -13.684 1.00 0.00 H new ATOM 0 HG3 PRO A 65 29.570 -4.043 -13.594 1.00 0.00 H new ATOM 0 HD2 PRO A 65 27.757 -5.413 -11.838 1.00 0.00 H new ATOM 0 HD3 PRO A 65 28.160 -3.708 -11.810 1.00 0.00 H new ATOM 966 N PRO A 66 24.838 -5.592 -15.900 1.00 0.00 N ATOM 967 CA PRO A 66 24.103 -6.739 -16.391 1.00 0.00 C ATOM 968 C PRO A 66 25.021 -7.743 -17.059 1.00 0.00 C ATOM 969 O PRO A 66 26.209 -7.512 -17.241 1.00 0.00 O ATOM 970 CB PRO A 66 23.059 -6.151 -17.353 1.00 0.00 C ATOM 971 CG PRO A 66 23.542 -4.767 -17.727 1.00 0.00 C ATOM 972 CD PRO A 66 24.653 -4.433 -16.737 1.00 0.00 C ATOM 0 HA PRO A 66 23.625 -7.303 -15.590 1.00 0.00 H new ATOM 0 HB2 PRO A 66 22.954 -6.777 -18.239 1.00 0.00 H new ATOM 0 HB3 PRO A 66 22.079 -6.104 -16.878 1.00 0.00 H new ATOM 0 HG2 PRO A 66 23.912 -4.746 -18.752 1.00 0.00 H new ATOM 0 HG3 PRO A 66 22.732 -4.040 -17.666 1.00 0.00 H new ATOM 0 HD2 PRO A 66 25.576 -4.186 -17.262 1.00 0.00 H new ATOM 0 HD3 PRO A 66 24.385 -3.563 -16.137 1.00 0.00 H new ATOM 980 N LYS A 67 24.462 -8.892 -17.395 1.00 0.00 N ATOM 981 CA LYS A 67 25.227 -9.933 -18.069 1.00 0.00 C ATOM 982 C LYS A 67 24.429 -10.489 -19.231 1.00 0.00 C ATOM 983 O LYS A 67 24.153 -11.680 -19.244 1.00 0.00 O ATOM 984 CB LYS A 67 25.711 -10.990 -17.052 1.00 0.00 C ATOM 985 CG LYS A 67 27.168 -10.732 -16.649 1.00 0.00 C ATOM 986 CD LYS A 67 28.076 -11.854 -17.180 1.00 0.00 C ATOM 987 CE LYS A 67 29.537 -11.527 -16.860 1.00 0.00 C ATOM 988 NZ LYS A 67 30.001 -12.277 -15.674 1.00 0.00 N ATOM 0 H LYS A 67 23.487 -9.130 -17.215 1.00 0.00 H new ATOM 0 HA LYS A 67 26.136 -9.518 -18.505 1.00 0.00 H new ATOM 0 HB2 LYS A 67 25.075 -10.968 -16.167 1.00 0.00 H new ATOM 0 HB3 LYS A 67 25.620 -11.986 -17.485 1.00 0.00 H new ATOM 0 HG2 LYS A 67 27.497 -9.771 -17.044 1.00 0.00 H new ATOM 0 HG3 LYS A 67 27.247 -10.674 -15.563 1.00 0.00 H new ATOM 0 HD2 LYS A 67 27.798 -12.806 -16.727 1.00 0.00 H new ATOM 0 HD3 LYS A 67 27.945 -11.963 -18.257 1.00 0.00 H new ATOM 0 HE2 LYS A 67 30.164 -11.771 -17.717 1.00 0.00 H new ATOM 0 HE3 LYS A 67 29.643 -10.457 -16.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 30.994 -12.038 -15.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 29.416 -12.024 -14.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 29.920 -13.298 -15.855 1.00 0.00 H new ATOM 1002 N HIS A 68 23.976 -9.634 -20.145 1.00 0.00 N ATOM 1003 CA HIS A 68 23.171 -10.123 -21.282 1.00 0.00 C ATOM 1004 C HIS A 68 24.079 -10.762 -22.339 1.00 0.00 C ATOM 1005 O HIS A 68 25.233 -10.385 -22.509 1.00 0.00 O ATOM 1006 CB HIS A 68 22.365 -8.954 -21.848 1.00 0.00 C ATOM 1007 CG HIS A 68 21.511 -9.286 -23.055 1.00 0.00 C ATOM 1008 ND1 HIS A 68 21.953 -9.213 -24.351 1.00 0.00 N ATOM 1009 CD2 HIS A 68 20.209 -9.708 -23.072 1.00 0.00 C ATOM 1010 CE1 HIS A 68 20.932 -9.586 -25.142 1.00 0.00 C ATOM 1011 NE2 HIS A 68 19.852 -9.883 -24.398 1.00 0.00 N ATOM 0 H HIS A 68 24.141 -8.628 -20.132 1.00 0.00 H new ATOM 0 HA HIS A 68 22.477 -10.896 -20.952 1.00 0.00 H new ATOM 0 HB2 HIS A 68 21.719 -8.564 -21.062 1.00 0.00 H new ATOM 0 HB3 HIS A 68 23.055 -8.155 -22.119 1.00 0.00 H new ATOM 0 HD2 HIS A 68 19.578 -9.874 -22.211 1.00 0.00 H new ATOM 0 HE1 HIS A 68 20.973 -9.639 -26.220 1.00 0.00 H new ATOM 0 HE2 HIS A 68 18.941 -10.181 -24.746 1.00 0.00 H new ATOM 1020 N SER A 69 23.518 -11.646 -23.151 1.00 0.00 N ATOM 1021 CA SER A 69 24.249 -12.323 -24.220 1.00 0.00 C ATOM 1022 C SER A 69 23.366 -12.501 -25.439 1.00 0.00 C ATOM 1023 O SER A 69 22.313 -11.870 -25.569 1.00 0.00 O ATOM 1024 CB SER A 69 24.780 -13.660 -23.708 1.00 0.00 C ATOM 1025 OG SER A 69 26.174 -13.724 -23.879 1.00 0.00 O ATOM 0 H SER A 69 22.537 -11.918 -23.089 1.00 0.00 H new ATOM 0 HA SER A 69 25.098 -11.711 -24.523 1.00 0.00 H new ATOM 0 HB2 SER A 69 24.529 -13.780 -22.654 1.00 0.00 H new ATOM 0 HB3 SER A 69 24.302 -14.479 -24.245 1.00 0.00 H new ATOM 0 HG SER A 69 26.505 -14.584 -23.546 1.00 0.00 H new ATOM 1031 N LYS A 70 23.799 -13.345 -26.371 1.00 0.00 N ATOM 1032 CA LYS A 70 22.997 -13.649 -27.551 1.00 0.00 C ATOM 1033 C LYS A 70 21.975 -14.743 -27.241 1.00 0.00 C ATOM 1034 O LYS A 70 22.129 -15.866 -27.689 1.00 0.00 O ATOM 1035 CB LYS A 70 23.946 -14.015 -28.697 1.00 0.00 C ATOM 1036 CG LYS A 70 23.755 -13.043 -29.856 1.00 0.00 C ATOM 1037 CD LYS A 70 23.843 -13.757 -31.204 1.00 0.00 C ATOM 1038 CE LYS A 70 25.228 -13.578 -31.814 1.00 0.00 C ATOM 1039 NZ LYS A 70 25.137 -13.606 -33.292 1.00 0.00 N ATOM 0 H LYS A 70 24.696 -13.828 -26.332 1.00 0.00 H new ATOM 0 HA LYS A 70 22.414 -12.781 -27.858 1.00 0.00 H new ATOM 0 HB2 LYS A 70 24.979 -13.983 -28.350 1.00 0.00 H new ATOM 0 HB3 LYS A 70 23.753 -15.035 -29.030 1.00 0.00 H new ATOM 0 HG2 LYS A 70 22.786 -12.552 -29.765 1.00 0.00 H new ATOM 0 HG3 LYS A 70 24.514 -12.262 -29.806 1.00 0.00 H new ATOM 0 HD2 LYS A 70 23.631 -14.818 -31.074 1.00 0.00 H new ATOM 0 HD3 LYS A 70 23.087 -13.361 -31.882 1.00 0.00 H new ATOM 0 HE2 LYS A 70 25.660 -12.633 -31.486 1.00 0.00 H new ATOM 0 HE3 LYS A 70 25.892 -14.369 -31.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 26.085 -13.483 -33.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 24.743 -14.519 -33.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 24.518 -12.836 -33.616 1.00 0.00 H new ATOM 1053 N ASP A 71 20.952 -14.392 -26.480 1.00 0.00 N ATOM 1054 CA ASP A 71 19.876 -15.323 -26.099 1.00 0.00 C ATOM 1055 C ASP A 71 18.830 -14.613 -25.251 1.00 0.00 C ATOM 1056 O ASP A 71 17.628 -14.832 -25.393 1.00 0.00 O ATOM 1057 CB ASP A 71 20.434 -16.503 -25.286 1.00 0.00 C ATOM 1058 CG ASP A 71 20.298 -17.867 -25.979 1.00 0.00 C ATOM 1059 OD1 ASP A 71 20.273 -17.914 -27.240 1.00 0.00 O ATOM 1060 OD2 ASP A 71 20.168 -18.852 -25.234 1.00 0.00 O ATOM 0 H ASP A 71 20.834 -13.452 -26.102 1.00 0.00 H new ATOM 0 HA ASP A 71 19.424 -15.692 -27.020 1.00 0.00 H new ATOM 0 HB2 ASP A 71 21.488 -16.319 -25.076 1.00 0.00 H new ATOM 0 HB3 ASP A 71 19.920 -16.543 -24.326 1.00 0.00 H new ATOM 1065 N GLY A 72 19.320 -13.774 -24.336 1.00 0.00 N ATOM 1066 CA GLY A 72 18.483 -13.051 -23.393 1.00 0.00 C ATOM 1067 C GLY A 72 18.815 -13.421 -21.979 1.00 0.00 C ATOM 1068 O GLY A 72 19.058 -12.545 -21.154 1.00 0.00 O ATOM 0 H GLY A 72 20.316 -13.580 -24.233 1.00 0.00 H new ATOM 0 HA2 GLY A 72 18.617 -11.978 -23.532 1.00 0.00 H new ATOM 0 HA3 GLY A 72 17.434 -13.270 -23.592 1.00 0.00 H new ATOM 1072 N ASN A 73 18.904 -14.713 -21.719 1.00 0.00 N ATOM 1073 CA ASN A 73 19.235 -15.204 -20.409 1.00 0.00 C ATOM 1074 C ASN A 73 20.021 -16.502 -20.594 1.00 0.00 C ATOM 1075 O ASN A 73 19.433 -17.580 -20.598 1.00 0.00 O ATOM 1076 CB ASN A 73 17.950 -15.413 -19.617 1.00 0.00 C ATOM 1077 CG ASN A 73 18.217 -16.295 -18.431 1.00 0.00 C ATOM 1078 OD1 ASN A 73 19.343 -16.092 -17.786 1.00 0.00 O flip ATOM 1079 ND2 ASN A 73 17.415 -17.147 -18.102 1.00 0.00 N flip ATOM 0 H ASN A 73 18.748 -15.444 -22.413 1.00 0.00 H new ATOM 0 HA ASN A 73 19.847 -14.498 -19.848 1.00 0.00 H new ATOM 0 HB2 ASN A 73 17.557 -14.452 -19.285 1.00 0.00 H new ATOM 0 HB3 ASN A 73 17.190 -15.866 -20.254 1.00 0.00 H new ATOM 0 HD21 ASN A 73 16.553 -17.268 -18.634 1.00 0.00 H new ATOM 0 HD22 ASN A 73 17.604 -17.741 -17.294 1.00 0.00 H new ATOM 1086 N GLY A 74 21.335 -16.385 -20.791 1.00 0.00 N ATOM 1087 CA GLY A 74 22.189 -17.562 -20.917 1.00 0.00 C ATOM 1088 C GLY A 74 22.353 -18.290 -19.583 1.00 0.00 C ATOM 1089 O GLY A 74 21.395 -18.757 -18.974 1.00 0.00 O ATOM 0 H GLY A 74 21.826 -15.494 -20.866 1.00 0.00 H new ATOM 0 HA2 GLY A 74 21.762 -18.244 -21.653 1.00 0.00 H new ATOM 0 HA3 GLY A 74 23.168 -17.262 -21.290 1.00 0.00 H new ATOM 1093 N LYS A 75 23.591 -18.392 -19.100 1.00 0.00 N ATOM 1094 CA LYS A 75 23.879 -19.035 -17.807 1.00 0.00 C ATOM 1095 C LYS A 75 23.043 -18.462 -16.664 1.00 0.00 C ATOM 1096 O LYS A 75 21.991 -18.981 -16.305 1.00 0.00 O ATOM 1097 CB LYS A 75 25.390 -18.958 -17.532 1.00 0.00 C ATOM 1098 CG LYS A 75 26.141 -20.127 -18.175 1.00 0.00 C ATOM 1099 CD LYS A 75 27.164 -20.698 -17.192 1.00 0.00 C ATOM 1100 CE LYS A 75 27.940 -21.842 -17.839 1.00 0.00 C ATOM 1101 NZ LYS A 75 28.824 -22.504 -16.847 1.00 0.00 N ATOM 0 H LYS A 75 24.417 -18.038 -19.583 1.00 0.00 H new ATOM 0 HA LYS A 75 23.587 -20.084 -17.867 1.00 0.00 H new ATOM 0 HB2 LYS A 75 25.783 -18.017 -17.917 1.00 0.00 H new ATOM 0 HB3 LYS A 75 25.565 -18.960 -16.456 1.00 0.00 H new ATOM 0 HG2 LYS A 75 25.436 -20.904 -18.471 1.00 0.00 H new ATOM 0 HG3 LYS A 75 26.644 -19.792 -19.082 1.00 0.00 H new ATOM 0 HD2 LYS A 75 27.853 -19.914 -16.878 1.00 0.00 H new ATOM 0 HD3 LYS A 75 26.657 -21.055 -16.296 1.00 0.00 H new ATOM 0 HE2 LYS A 75 27.244 -22.570 -18.256 1.00 0.00 H new ATOM 0 HE3 LYS A 75 28.537 -21.460 -18.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 29.343 -23.279 -17.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 29.501 -21.811 -16.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 28.248 -22.886 -16.070 1.00 0.00 H new ATOM 1115 N THR A 76 23.556 -17.404 -16.047 1.00 0.00 N ATOM 1116 CA THR A 76 22.839 -16.718 -14.965 1.00 0.00 C ATOM 1117 C THR A 76 22.652 -15.251 -15.283 1.00 0.00 C ATOM 1118 O THR A 76 22.451 -14.460 -14.365 1.00 0.00 O ATOM 1119 CB THR A 76 23.552 -16.999 -13.629 1.00 0.00 C ATOM 1120 OG1 THR A 76 22.542 -17.291 -12.698 1.00 0.00 O ATOM 1121 CG2 THR A 76 24.415 -15.848 -13.085 1.00 0.00 C ATOM 0 H THR A 76 24.464 -16.999 -16.273 1.00 0.00 H new ATOM 0 HA THR A 76 21.826 -17.110 -14.867 1.00 0.00 H new ATOM 0 HB THR A 76 24.254 -17.816 -13.798 1.00 0.00 H new ATOM 0 HG1 THR A 76 22.946 -17.480 -11.825 1.00 0.00 H new ATOM 0 HG21 THR A 76 24.871 -16.150 -12.142 1.00 0.00 H new ATOM 0 HG22 THR A 76 25.196 -15.607 -13.806 1.00 0.00 H new ATOM 0 HG23 THR A 76 23.790 -14.970 -12.921 1.00 0.00 H new ATOM 1129 N ASP A 77 22.775 -14.890 -16.568 1.00 0.00 N ATOM 1130 CA ASP A 77 22.710 -13.519 -17.059 1.00 0.00 C ATOM 1131 C ASP A 77 21.768 -12.729 -16.193 1.00 0.00 C ATOM 1132 O ASP A 77 20.575 -12.947 -16.260 1.00 0.00 O ATOM 1133 CB ASP A 77 22.147 -13.481 -18.479 1.00 0.00 C ATOM 1134 CG ASP A 77 23.041 -14.150 -19.526 1.00 0.00 C ATOM 1135 OD1 ASP A 77 23.888 -14.984 -19.119 1.00 0.00 O ATOM 1136 OD2 ASP A 77 22.787 -13.909 -20.728 1.00 0.00 O ATOM 0 H ASP A 77 22.927 -15.570 -17.312 1.00 0.00 H new ATOM 0 HA ASP A 77 23.718 -13.105 -17.041 1.00 0.00 H new ATOM 0 HB2 ASP A 77 21.172 -13.969 -18.485 1.00 0.00 H new ATOM 0 HB3 ASP A 77 21.985 -12.442 -18.766 1.00 0.00 H new ATOM 1141 N HIS A 78 22.295 -11.870 -15.329 1.00 0.00 N ATOM 1142 CA HIS A 78 21.468 -11.110 -14.374 1.00 0.00 C ATOM 1143 C HIS A 78 21.006 -9.809 -15.017 1.00 0.00 C ATOM 1144 O HIS A 78 20.645 -8.856 -14.332 1.00 0.00 O ATOM 1145 CB HIS A 78 22.229 -10.858 -13.073 1.00 0.00 C ATOM 1146 CG HIS A 78 23.693 -10.569 -13.269 1.00 0.00 C ATOM 1147 ND1 HIS A 78 24.261 -9.322 -13.206 1.00 0.00 N ATOM 1148 CD2 HIS A 78 24.669 -11.488 -13.530 1.00 0.00 C ATOM 1149 CE1 HIS A 78 25.583 -9.477 -13.377 1.00 0.00 C ATOM 1150 NE2 HIS A 78 25.853 -10.778 -13.578 1.00 0.00 N ATOM 0 H HIS A 78 23.294 -11.675 -15.263 1.00 0.00 H new ATOM 0 HA HIS A 78 20.586 -11.698 -14.119 1.00 0.00 H new ATOM 0 HB2 HIS A 78 21.770 -10.018 -12.552 1.00 0.00 H new ATOM 0 HB3 HIS A 78 22.124 -11.730 -12.427 1.00 0.00 H new ATOM 0 HD1 HIS A 78 23.770 -8.441 -13.057 1.00 0.00 H new ATOM 0 HD2 HIS A 78 24.541 -12.551 -13.670 1.00 0.00 H new ATOM 0 HE1 HIS A 78 26.314 -8.682 -13.356 1.00 0.00 H new ATOM 1159 N TYR A 79 21.079 -9.776 -16.348 1.00 0.00 N ATOM 1160 CA TYR A 79 20.586 -8.714 -17.184 1.00 0.00 C ATOM 1161 C TYR A 79 19.243 -8.193 -16.671 1.00 0.00 C ATOM 1162 O TYR A 79 18.370 -8.942 -16.232 1.00 0.00 O ATOM 1163 CB TYR A 79 20.517 -9.250 -18.607 1.00 0.00 C ATOM 1164 CG TYR A 79 19.297 -10.117 -18.894 1.00 0.00 C ATOM 1165 CD1 TYR A 79 18.964 -11.185 -18.063 1.00 0.00 C ATOM 1166 CD2 TYR A 79 18.457 -9.818 -19.952 1.00 0.00 C ATOM 1167 CE1 TYR A 79 17.848 -12.000 -18.298 1.00 0.00 C ATOM 1168 CE2 TYR A 79 17.344 -10.630 -20.210 1.00 0.00 C ATOM 1169 CZ TYR A 79 17.059 -11.719 -19.398 1.00 0.00 C ATOM 1170 OH TYR A 79 15.967 -12.506 -19.633 1.00 0.00 O ATOM 0 H TYR A 79 21.506 -10.531 -16.885 1.00 0.00 H new ATOM 0 HA TYR A 79 21.254 -7.853 -17.163 1.00 0.00 H new ATOM 0 HB2 TYR A 79 20.521 -8.409 -19.300 1.00 0.00 H new ATOM 0 HB3 TYR A 79 21.417 -9.832 -18.807 1.00 0.00 H new ATOM 0 HD1 TYR A 79 19.589 -11.392 -17.207 1.00 0.00 H new ATOM 0 HD2 TYR A 79 18.658 -8.961 -20.578 1.00 0.00 H new ATOM 0 HE1 TYR A 79 17.612 -12.823 -17.640 1.00 0.00 H new ATOM 0 HE2 TYR A 79 16.702 -10.406 -21.049 1.00 0.00 H new ATOM 0 HH TYR A 79 15.161 -12.052 -19.311 1.00 0.00 H new ATOM 1180 N LEU A 80 19.128 -6.876 -16.642 1.00 0.00 N ATOM 1181 CA LEU A 80 17.863 -6.275 -16.252 1.00 0.00 C ATOM 1182 C LEU A 80 16.865 -6.395 -17.386 1.00 0.00 C ATOM 1183 O LEU A 80 17.268 -6.446 -18.547 1.00 0.00 O ATOM 1184 CB LEU A 80 18.124 -4.816 -15.877 1.00 0.00 C ATOM 1185 CG LEU A 80 18.281 -4.687 -14.366 1.00 0.00 C ATOM 1186 CD1 LEU A 80 19.335 -3.650 -14.005 1.00 0.00 C ATOM 1187 CD2 LEU A 80 16.950 -4.262 -13.766 1.00 0.00 C ATOM 0 H LEU A 80 19.871 -6.218 -16.876 1.00 0.00 H new ATOM 0 HA LEU A 80 17.436 -6.790 -15.391 1.00 0.00 H new ATOM 0 HB2 LEU A 80 19.025 -4.459 -16.376 1.00 0.00 H new ATOM 0 HB3 LEU A 80 17.300 -4.191 -16.220 1.00 0.00 H new ATOM 0 HG LEU A 80 18.596 -5.652 -13.970 1.00 0.00 H new ATOM 0 HD11 LEU A 80 19.422 -3.582 -12.921 1.00 0.00 H new ATOM 0 HD12 LEU A 80 20.295 -3.944 -14.429 1.00 0.00 H new ATOM 0 HD13 LEU A 80 19.043 -2.680 -14.407 1.00 0.00 H new ATOM 0 HD21 LEU A 80 17.052 -4.167 -12.685 1.00 0.00 H new ATOM 0 HD22 LEU A 80 16.650 -3.303 -14.188 1.00 0.00 H new ATOM 0 HD23 LEU A 80 16.192 -5.011 -13.994 1.00 0.00 H new ATOM 1199 N LEU A 81 15.583 -6.374 -17.069 1.00 0.00 N ATOM 1200 CA LEU A 81 14.525 -6.406 -18.076 1.00 0.00 C ATOM 1201 C LEU A 81 13.393 -5.480 -17.674 1.00 0.00 C ATOM 1202 O LEU A 81 13.137 -5.273 -16.488 1.00 0.00 O ATOM 1203 CB LEU A 81 14.003 -7.840 -18.245 1.00 0.00 C ATOM 1204 CG LEU A 81 15.035 -8.829 -18.806 1.00 0.00 C ATOM 1205 CD1 LEU A 81 15.458 -9.827 -17.724 1.00 0.00 C ATOM 1206 CD2 LEU A 81 14.539 -9.506 -20.092 1.00 0.00 C ATOM 0 H LEU A 81 15.241 -6.334 -16.109 1.00 0.00 H new ATOM 0 HA LEU A 81 14.933 -6.066 -19.028 1.00 0.00 H new ATOM 0 HB2 LEU A 81 13.657 -8.204 -17.278 1.00 0.00 H new ATOM 0 HB3 LEU A 81 13.137 -7.823 -18.907 1.00 0.00 H new ATOM 0 HG LEU A 81 15.926 -8.273 -19.097 1.00 0.00 H new ATOM 0 HD11 LEU A 81 16.190 -10.522 -18.136 1.00 0.00 H new ATOM 0 HD12 LEU A 81 15.900 -9.289 -16.886 1.00 0.00 H new ATOM 0 HD13 LEU A 81 14.585 -10.381 -17.379 1.00 0.00 H new ATOM 0 HD21 LEU A 81 15.299 -10.198 -20.456 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.620 -10.054 -19.884 1.00 0.00 H new ATOM 0 HD23 LEU A 81 14.346 -8.748 -20.851 1.00 0.00 H new ATOM 1218 N GLU A 82 12.699 -4.937 -18.672 1.00 0.00 N ATOM 1219 CA GLU A 82 11.594 -4.028 -18.441 1.00 0.00 C ATOM 1220 C GLU A 82 10.288 -4.632 -18.943 1.00 0.00 C ATOM 1221 O GLU A 82 10.258 -5.455 -19.870 1.00 0.00 O ATOM 1222 CB GLU A 82 11.860 -2.675 -19.115 1.00 0.00 C ATOM 1223 CG GLU A 82 11.792 -2.698 -20.623 1.00 0.00 C ATOM 1224 CD GLU A 82 13.125 -3.132 -21.198 1.00 0.00 C ATOM 1225 OE1 GLU A 82 13.273 -4.368 -21.335 1.00 0.00 O ATOM 1226 OE2 GLU A 82 13.873 -2.242 -21.585 1.00 0.00 O ATOM 0 H GLU A 82 12.891 -5.118 -19.657 1.00 0.00 H new ATOM 0 HA GLU A 82 11.503 -3.864 -17.367 1.00 0.00 H new ATOM 0 HB2 GLU A 82 11.136 -1.950 -18.743 1.00 0.00 H new ATOM 0 HB3 GLU A 82 12.847 -2.322 -18.815 1.00 0.00 H new ATOM 0 HG2 GLU A 82 11.007 -3.380 -20.949 1.00 0.00 H new ATOM 0 HG3 GLU A 82 11.530 -1.709 -20.998 1.00 0.00 H new ATOM 1233 N PHE A 83 9.177 -4.143 -18.396 1.00 0.00 N ATOM 1234 CA PHE A 83 7.869 -4.665 -18.771 1.00 0.00 C ATOM 1235 C PHE A 83 6.819 -3.557 -18.901 1.00 0.00 C ATOM 1236 O PHE A 83 6.763 -2.692 -18.030 1.00 0.00 O ATOM 1237 CB PHE A 83 7.409 -5.588 -17.665 1.00 0.00 C ATOM 1238 CG PHE A 83 6.252 -6.461 -18.069 1.00 0.00 C ATOM 1239 CD1 PHE A 83 6.446 -7.440 -19.046 1.00 0.00 C ATOM 1240 CD2 PHE A 83 4.998 -6.275 -17.475 1.00 0.00 C ATOM 1241 CE1 PHE A 83 5.387 -8.257 -19.437 1.00 0.00 C ATOM 1242 CE2 PHE A 83 3.955 -7.137 -17.828 1.00 0.00 C ATOM 1243 CZ PHE A 83 4.164 -8.100 -18.799 1.00 0.00 C ATOM 0 H PHE A 83 9.157 -3.396 -17.701 1.00 0.00 H new ATOM 0 HA PHE A 83 7.967 -5.167 -19.734 1.00 0.00 H new ATOM 0 HB2 PHE A 83 8.242 -6.219 -17.356 1.00 0.00 H new ATOM 0 HB3 PHE A 83 7.122 -4.992 -16.798 1.00 0.00 H new ATOM 0 HD1 PHE A 83 7.418 -7.564 -19.499 1.00 0.00 H new ATOM 0 HD2 PHE A 83 4.839 -5.482 -16.759 1.00 0.00 H new ATOM 0 HE1 PHE A 83 5.514 -8.994 -20.217 1.00 0.00 H new ATOM 0 HE2 PHE A 83 2.992 -7.052 -17.346 1.00 0.00 H new ATOM 0 HZ PHE A 83 3.347 -8.752 -19.070 1.00 0.00 H new ATOM 1253 N PRO A 84 6.015 -3.565 -19.987 1.00 0.00 N ATOM 1254 CA PRO A 84 5.049 -2.512 -20.295 1.00 0.00 C ATOM 1255 C PRO A 84 3.903 -2.539 -19.320 1.00 0.00 C ATOM 1256 O PRO A 84 2.909 -3.192 -19.578 1.00 0.00 O ATOM 1257 CB PRO A 84 4.593 -2.758 -21.737 1.00 0.00 C ATOM 1258 CG PRO A 84 4.989 -4.177 -22.056 1.00 0.00 C ATOM 1259 CD PRO A 84 5.956 -4.625 -20.966 1.00 0.00 C ATOM 0 HA PRO A 84 5.489 -1.519 -20.204 1.00 0.00 H new ATOM 0 HB2 PRO A 84 3.516 -2.621 -21.835 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.068 -2.056 -22.422 1.00 0.00 H new ATOM 0 HG2 PRO A 84 4.113 -4.825 -22.084 1.00 0.00 H new ATOM 0 HG3 PRO A 84 5.460 -4.235 -23.037 1.00 0.00 H new ATOM 0 HD2 PRO A 84 5.616 -5.554 -20.508 1.00 0.00 H new ATOM 0 HD3 PRO A 84 6.944 -4.819 -21.384 1.00 0.00 H new ATOM 1267 N THR A 85 4.067 -1.837 -18.205 1.00 0.00 N ATOM 1268 CA THR A 85 3.042 -1.773 -17.168 1.00 0.00 C ATOM 1269 C THR A 85 2.000 -0.714 -17.499 1.00 0.00 C ATOM 1270 O THR A 85 2.341 0.415 -17.845 1.00 0.00 O ATOM 1271 CB THR A 85 3.653 -1.557 -15.779 1.00 0.00 C ATOM 1272 OG1 THR A 85 2.655 -1.306 -14.815 1.00 0.00 O ATOM 1273 CG2 THR A 85 4.619 -0.374 -15.745 1.00 0.00 C ATOM 0 H THR A 85 4.908 -1.299 -17.994 1.00 0.00 H new ATOM 0 HA THR A 85 2.535 -2.738 -17.142 1.00 0.00 H new ATOM 0 HB THR A 85 4.191 -2.477 -15.552 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.909 -1.928 -14.947 1.00 0.00 H new ATOM 0 HG21 THR A 85 5.024 -0.264 -14.739 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.434 -0.549 -16.447 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.089 0.537 -16.024 1.00 0.00 H new ATOM 1281 N PHE A 86 0.726 -1.101 -17.449 1.00 0.00 N ATOM 1282 CA PHE A 86 -0.386 -0.206 -17.762 1.00 0.00 C ATOM 1283 C PHE A 86 -0.958 0.390 -16.482 1.00 0.00 C ATOM 1284 O PHE A 86 -0.900 -0.249 -15.425 1.00 0.00 O ATOM 1285 CB PHE A 86 -1.482 -0.989 -18.488 1.00 0.00 C ATOM 1286 CG PHE A 86 -1.088 -1.449 -19.887 1.00 0.00 C ATOM 1287 CD1 PHE A 86 0.017 -2.284 -20.077 1.00 0.00 C ATOM 1288 CD2 PHE A 86 -1.825 -1.031 -20.998 1.00 0.00 C ATOM 1289 CE1 PHE A 86 0.354 -2.767 -21.332 1.00 0.00 C ATOM 1290 CE2 PHE A 86 -1.469 -1.495 -22.274 1.00 0.00 C ATOM 1291 CZ PHE A 86 -0.403 -2.386 -22.425 1.00 0.00 C ATOM 0 H PHE A 86 0.436 -2.044 -17.190 1.00 0.00 H new ATOM 0 HA PHE A 86 -0.022 0.600 -18.400 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -1.748 -1.861 -17.891 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.374 -0.366 -18.558 1.00 0.00 H new ATOM 0 HD1 PHE A 86 0.622 -2.559 -19.226 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -2.660 -0.357 -20.876 1.00 0.00 H new ATOM 0 HE1 PHE A 86 1.196 -3.432 -21.455 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -2.020 -1.163 -23.141 1.00 0.00 H new ATOM 0 HZ PHE A 86 -0.168 -2.780 -23.403 1.00 0.00 H new ATOM 1301 N PRO A 87 -1.542 1.596 -16.602 1.00 0.00 N ATOM 1302 CA PRO A 87 -2.136 2.268 -15.466 1.00 0.00 C ATOM 1303 C PRO A 87 -3.432 1.631 -15.040 1.00 0.00 C ATOM 1304 O PRO A 87 -3.600 1.367 -13.853 1.00 0.00 O ATOM 1305 CB PRO A 87 -2.371 3.703 -15.926 1.00 0.00 C ATOM 1306 CG PRO A 87 -2.317 3.691 -17.435 1.00 0.00 C ATOM 1307 CD PRO A 87 -1.726 2.349 -17.829 1.00 0.00 C ATOM 0 HA PRO A 87 -1.482 2.210 -14.596 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -3.337 4.068 -15.577 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -1.612 4.369 -15.517 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -3.312 3.818 -17.861 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -1.704 4.511 -17.809 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -2.390 1.819 -18.512 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -0.776 2.482 -18.347 1.00 0.00 H new ATOM 1315 N ASP A 88 -4.321 1.368 -16.005 1.00 0.00 N ATOM 1316 CA ASP A 88 -5.621 0.744 -15.775 1.00 0.00 C ATOM 1317 C ASP A 88 -5.485 -0.414 -14.791 1.00 0.00 C ATOM 1318 O ASP A 88 -6.318 -0.653 -13.914 1.00 0.00 O ATOM 1319 CB ASP A 88 -6.216 0.181 -17.081 1.00 0.00 C ATOM 1320 CG ASP A 88 -5.965 1.026 -18.325 1.00 0.00 C ATOM 1321 OD1 ASP A 88 -4.806 1.046 -18.767 1.00 0.00 O ATOM 1322 OD2 ASP A 88 -6.968 1.547 -18.871 1.00 0.00 O ATOM 0 H ASP A 88 -4.149 1.589 -16.986 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.279 1.516 -15.376 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -5.806 -0.815 -17.249 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -7.292 0.065 -16.951 1.00 0.00 H new ATOM 1327 N GLY A 89 -4.405 -1.173 -14.977 1.00 0.00 N ATOM 1328 CA GLY A 89 -4.100 -2.319 -14.155 1.00 0.00 C ATOM 1329 C GLY A 89 -4.627 -3.587 -14.808 1.00 0.00 C ATOM 1330 O GLY A 89 -4.789 -4.612 -14.135 1.00 0.00 O ATOM 0 H GLY A 89 -3.719 -0.999 -15.711 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -3.022 -2.396 -14.011 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -4.546 -2.197 -13.168 1.00 0.00 H new ATOM 1334 N HIS A 90 -4.923 -3.547 -16.110 1.00 0.00 N ATOM 1335 CA HIS A 90 -5.363 -4.754 -16.816 1.00 0.00 C ATOM 1336 C HIS A 90 -4.148 -5.528 -17.311 1.00 0.00 C ATOM 1337 O HIS A 90 -3.139 -4.916 -17.606 1.00 0.00 O ATOM 1338 CB HIS A 90 -6.339 -4.343 -17.919 1.00 0.00 C ATOM 1339 CG HIS A 90 -5.745 -3.640 -19.139 1.00 0.00 C ATOM 1340 ND1 HIS A 90 -4.704 -4.061 -19.925 1.00 0.00 N flip ATOM 1341 CD2 HIS A 90 -6.204 -2.446 -19.658 1.00 0.00 C flip ATOM 1342 CE1 HIS A 90 -4.521 -3.113 -20.908 1.00 0.00 C flip ATOM 1343 NE2 HIS A 90 -5.445 -2.149 -20.730 1.00 0.00 N flip ATOM 0 H HIS A 90 -4.868 -2.709 -16.688 1.00 0.00 H new ATOM 0 HA HIS A 90 -5.900 -5.436 -16.157 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -6.859 -5.237 -18.262 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -7.090 -3.686 -17.480 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -7.023 -1.857 -19.274 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -3.770 -3.138 -21.684 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -5.553 -1.322 -21.317 1.00 0.00 H new ATOM 1352 N ASP A 91 -4.217 -6.847 -17.368 1.00 0.00 N ATOM 1353 CA ASP A 91 -3.131 -7.668 -17.946 1.00 0.00 C ATOM 1354 C ASP A 91 -2.936 -7.388 -19.441 1.00 0.00 C ATOM 1355 O ASP A 91 -3.895 -7.159 -20.175 1.00 0.00 O ATOM 1356 CB ASP A 91 -3.501 -9.139 -17.796 1.00 0.00 C ATOM 1357 CG ASP A 91 -2.264 -10.042 -17.776 1.00 0.00 C ATOM 1358 OD1 ASP A 91 -1.633 -10.159 -16.719 1.00 0.00 O ATOM 1359 OD2 ASP A 91 -1.962 -10.589 -18.876 1.00 0.00 O ATOM 0 H ASP A 91 -5.011 -7.387 -17.024 1.00 0.00 H new ATOM 0 HA ASP A 91 -2.209 -7.421 -17.419 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -4.067 -9.279 -16.875 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.153 -9.435 -18.618 1.00 0.00 H new ATOM 1364 N TYR A 92 -1.679 -7.341 -19.867 1.00 0.00 N ATOM 1365 CA TYR A 92 -1.315 -6.975 -21.226 1.00 0.00 C ATOM 1366 C TYR A 92 -1.130 -8.261 -22.019 1.00 0.00 C ATOM 1367 O TYR A 92 -0.681 -9.284 -21.504 1.00 0.00 O ATOM 1368 CB TYR A 92 -0.040 -6.112 -21.167 1.00 0.00 C ATOM 1369 CG TYR A 92 0.254 -5.499 -19.791 1.00 0.00 C ATOM 1370 CD1 TYR A 92 -0.763 -4.839 -19.082 1.00 0.00 C ATOM 1371 CD2 TYR A 92 1.528 -5.576 -19.226 1.00 0.00 C ATOM 1372 CE1 TYR A 92 -0.515 -4.272 -17.807 1.00 0.00 C ATOM 1373 CE2 TYR A 92 1.768 -4.982 -17.959 1.00 0.00 C ATOM 1374 CZ TYR A 92 0.748 -4.353 -17.261 1.00 0.00 C ATOM 1375 OH TYR A 92 0.963 -3.771 -16.031 1.00 0.00 O ATOM 0 H TYR A 92 -0.879 -7.558 -19.272 1.00 0.00 H new ATOM 0 HA TYR A 92 -2.084 -6.384 -21.724 1.00 0.00 H new ATOM 0 HB2 TYR A 92 0.811 -6.724 -21.467 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -0.128 -5.308 -21.897 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -1.749 -4.762 -19.515 1.00 0.00 H new ATOM 0 HD2 TYR A 92 2.325 -6.084 -19.749 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -1.310 -3.780 -17.267 1.00 0.00 H new ATOM 0 HE2 TYR A 92 2.759 -5.021 -17.533 1.00 0.00 H new ATOM 0 HH TYR A 92 0.134 -3.794 -15.509 1.00 0.00 H new ATOM 1385 N LYS A 93 -1.458 -8.222 -23.297 1.00 0.00 N ATOM 1386 CA LYS A 93 -1.223 -9.376 -24.159 1.00 0.00 C ATOM 1387 C LYS A 93 0.221 -9.375 -24.654 1.00 0.00 C ATOM 1388 O LYS A 93 0.497 -9.140 -25.830 1.00 0.00 O ATOM 1389 CB LYS A 93 -2.266 -9.390 -25.262 1.00 0.00 C ATOM 1390 CG LYS A 93 -2.451 -7.992 -25.877 1.00 0.00 C ATOM 1391 CD LYS A 93 -3.106 -8.110 -27.239 1.00 0.00 C ATOM 1392 CE LYS A 93 -4.510 -8.674 -27.162 1.00 0.00 C ATOM 1393 NZ LYS A 93 -4.543 -10.034 -27.741 1.00 0.00 N ATOM 0 H LYS A 93 -1.882 -7.418 -23.760 1.00 0.00 H new ATOM 0 HA LYS A 93 -1.340 -10.310 -23.609 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.967 -10.094 -26.039 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.217 -9.742 -24.861 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -3.065 -7.375 -25.221 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.485 -7.495 -25.970 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -3.138 -7.127 -27.709 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.496 -8.749 -27.878 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.842 -8.704 -26.124 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -5.201 -8.025 -27.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.521 -10.279 -27.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.945 -10.064 -28.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.186 -10.717 -27.043 1.00 0.00 H new ATOM 1407 N PHE A 94 1.143 -9.617 -23.731 1.00 0.00 N ATOM 1408 CA PHE A 94 2.564 -9.699 -24.047 1.00 0.00 C ATOM 1409 C PHE A 94 2.935 -11.089 -24.552 1.00 0.00 C ATOM 1410 O PHE A 94 3.895 -11.231 -25.296 1.00 0.00 O ATOM 1411 CB PHE A 94 3.369 -9.352 -22.798 1.00 0.00 C ATOM 1412 CG PHE A 94 2.911 -10.101 -21.546 1.00 0.00 C ATOM 1413 CD1 PHE A 94 3.406 -11.374 -21.237 1.00 0.00 C ATOM 1414 CD2 PHE A 94 1.940 -9.522 -20.731 1.00 0.00 C ATOM 1415 CE1 PHE A 94 2.934 -12.038 -20.095 1.00 0.00 C ATOM 1416 CE2 PHE A 94 1.457 -10.189 -19.600 1.00 0.00 C ATOM 1417 CZ PHE A 94 1.967 -11.442 -19.277 1.00 0.00 C ATOM 0 H PHE A 94 0.928 -9.762 -22.744 1.00 0.00 H new ATOM 0 HA PHE A 94 2.794 -8.990 -24.842 1.00 0.00 H new ATOM 0 HB2 PHE A 94 4.420 -9.575 -22.980 1.00 0.00 H new ATOM 0 HB3 PHE A 94 3.297 -8.280 -22.616 1.00 0.00 H new ATOM 0 HD1 PHE A 94 4.145 -11.840 -21.872 1.00 0.00 H new ATOM 0 HD2 PHE A 94 1.554 -8.543 -20.976 1.00 0.00 H new ATOM 0 HE1 PHE A 94 3.319 -13.016 -19.845 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.695 -9.735 -18.983 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.617 -11.956 -18.394 1.00 0.00 H new ATOM 1427 N ASP A 95 2.148 -12.103 -24.201 1.00 0.00 N ATOM 1428 CA ASP A 95 2.376 -13.489 -24.622 1.00 0.00 C ATOM 1429 C ASP A 95 1.635 -13.793 -25.925 1.00 0.00 C ATOM 1430 O ASP A 95 1.993 -14.672 -26.712 1.00 0.00 O ATOM 1431 CB ASP A 95 1.861 -14.435 -23.531 1.00 0.00 C ATOM 1432 CG ASP A 95 2.752 -15.668 -23.350 1.00 0.00 C ATOM 1433 OD1 ASP A 95 3.467 -16.010 -24.323 1.00 0.00 O ATOM 1434 OD2 ASP A 95 2.731 -16.223 -22.233 1.00 0.00 O ATOM 0 H ASP A 95 1.325 -11.988 -23.610 1.00 0.00 H new ATOM 0 HA ASP A 95 3.445 -13.631 -24.783 1.00 0.00 H new ATOM 0 HB2 ASP A 95 1.799 -13.894 -22.586 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.850 -14.756 -23.781 1.00 0.00 H new ATOM 1439 N SER A 96 0.577 -13.026 -26.198 1.00 0.00 N ATOM 1440 CA SER A 96 -0.227 -13.195 -27.402 1.00 0.00 C ATOM 1441 C SER A 96 0.412 -12.401 -28.525 1.00 0.00 C ATOM 1442 O SER A 96 0.380 -11.170 -28.534 1.00 0.00 O ATOM 1443 CB SER A 96 -1.665 -12.737 -27.170 1.00 0.00 C ATOM 1444 OG SER A 96 -2.561 -13.752 -27.564 1.00 0.00 O ATOM 0 H SER A 96 0.257 -12.273 -25.589 1.00 0.00 H new ATOM 0 HA SER A 96 -0.262 -14.251 -27.669 1.00 0.00 H new ATOM 0 HB2 SER A 96 -1.814 -12.497 -26.117 1.00 0.00 H new ATOM 0 HB3 SER A 96 -1.862 -11.826 -27.736 1.00 0.00 H new ATOM 0 HG SER A 96 -3.482 -13.453 -27.411 1.00 0.00 H new ATOM 1450 N LYS A 97 0.998 -13.109 -29.488 1.00 0.00 N ATOM 1451 CA LYS A 97 1.625 -12.460 -30.644 1.00 0.00 C ATOM 1452 C LYS A 97 0.618 -11.641 -31.420 1.00 0.00 C ATOM 1453 O LYS A 97 0.876 -10.493 -31.809 1.00 0.00 O ATOM 1454 CB LYS A 97 2.360 -13.502 -31.503 1.00 0.00 C ATOM 1455 CG LYS A 97 1.458 -14.165 -32.546 1.00 0.00 C ATOM 1456 CD LYS A 97 2.191 -15.141 -33.454 1.00 0.00 C ATOM 1457 CE LYS A 97 1.896 -16.572 -33.019 1.00 0.00 C ATOM 1458 NZ LYS A 97 2.913 -17.046 -32.046 1.00 0.00 N ATOM 0 H LYS A 97 1.053 -14.127 -29.494 1.00 0.00 H new ATOM 0 HA LYS A 97 2.378 -11.752 -30.297 1.00 0.00 H new ATOM 0 HB2 LYS A 97 3.198 -13.021 -32.009 1.00 0.00 H new ATOM 0 HB3 LYS A 97 2.779 -14.270 -30.853 1.00 0.00 H new ATOM 0 HG2 LYS A 97 0.653 -14.692 -32.035 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.994 -13.391 -33.158 1.00 0.00 H new ATOM 0 HD2 LYS A 97 1.879 -14.994 -34.488 1.00 0.00 H new ATOM 0 HD3 LYS A 97 3.264 -14.953 -33.415 1.00 0.00 H new ATOM 0 HE2 LYS A 97 0.904 -16.624 -32.570 1.00 0.00 H new ATOM 0 HE3 LYS A 97 1.886 -17.227 -33.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 2.694 -18.022 -31.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 3.855 -17.016 -32.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 2.904 -16.432 -31.207 1.00 0.00 H new ATOM 1472 N LYS A 98 -0.528 -12.281 -31.692 1.00 0.00 N ATOM 1473 CA LYS A 98 -1.615 -11.686 -32.442 1.00 0.00 C ATOM 1474 C LYS A 98 -2.970 -12.058 -31.804 1.00 0.00 C ATOM 1475 O LYS A 98 -3.220 -13.227 -31.554 1.00 0.00 O ATOM 1476 CB LYS A 98 -1.517 -12.031 -33.933 1.00 0.00 C ATOM 1477 CG LYS A 98 -1.906 -10.812 -34.784 1.00 0.00 C ATOM 1478 CD LYS A 98 -1.151 -10.796 -36.119 1.00 0.00 C ATOM 1479 CE LYS A 98 0.026 -9.809 -36.069 1.00 0.00 C ATOM 1480 NZ LYS A 98 -0.209 -8.658 -36.980 1.00 0.00 N ATOM 0 H LYS A 98 -0.717 -13.236 -31.389 1.00 0.00 H new ATOM 0 HA LYS A 98 -1.536 -10.600 -32.391 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -0.502 -12.345 -34.176 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.173 -12.870 -34.164 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -2.980 -10.825 -34.972 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -1.691 -9.897 -34.232 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.783 -11.797 -36.346 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.832 -10.517 -36.923 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.161 -9.449 -35.049 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.947 -10.320 -36.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.599 -8.005 -36.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.315 -9.003 -37.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.076 -8.160 -36.693 1.00 0.00 H new ATOM 1494 N PRO A 99 -3.806 -11.044 -31.538 1.00 0.00 N ATOM 1495 CA PRO A 99 -3.436 -9.645 -31.725 1.00 0.00 C ATOM 1496 C PRO A 99 -2.396 -9.200 -30.703 1.00 0.00 C ATOM 1497 O PRO A 99 -2.056 -9.968 -29.812 1.00 0.00 O ATOM 1498 CB PRO A 99 -4.730 -8.841 -31.653 1.00 0.00 C ATOM 1499 CG PRO A 99 -5.707 -9.748 -30.930 1.00 0.00 C ATOM 1500 CD PRO A 99 -5.106 -11.162 -30.902 1.00 0.00 C ATOM 0 HA PRO A 99 -2.957 -9.485 -32.691 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -4.585 -7.905 -31.114 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.092 -8.583 -32.648 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -5.883 -9.388 -29.916 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -6.671 -9.753 -31.439 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -5.011 -11.528 -29.880 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -5.741 -11.869 -31.436 1.00 0.00 H new ATOM 1508 N LYS A 100 -1.934 -7.967 -30.831 1.00 0.00 N ATOM 1509 CA LYS A 100 -0.957 -7.365 -29.932 1.00 0.00 C ATOM 1510 C LYS A 100 -1.332 -5.914 -29.691 1.00 0.00 C ATOM 1511 O LYS A 100 -1.457 -5.165 -30.654 1.00 0.00 O ATOM 1512 CB LYS A 100 0.443 -7.541 -30.504 1.00 0.00 C ATOM 1513 CG LYS A 100 1.384 -6.402 -30.084 1.00 0.00 C ATOM 1514 CD LYS A 100 2.830 -6.851 -30.020 1.00 0.00 C ATOM 1515 CE LYS A 100 3.574 -6.726 -31.333 1.00 0.00 C ATOM 1516 NZ LYS A 100 2.899 -7.510 -32.387 1.00 0.00 N ATOM 0 H LYS A 100 -2.233 -7.341 -31.579 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.960 -7.862 -28.962 1.00 0.00 H new ATOM 0 HB2 LYS A 100 0.854 -8.493 -30.169 1.00 0.00 H new ATOM 0 HB3 LYS A 100 0.388 -7.583 -31.592 1.00 0.00 H new ATOM 0 HG2 LYS A 100 1.292 -5.577 -30.791 1.00 0.00 H new ATOM 0 HG3 LYS A 100 1.079 -6.022 -29.109 1.00 0.00 H new ATOM 0 HD2 LYS A 100 3.349 -6.263 -29.263 1.00 0.00 H new ATOM 0 HD3 LYS A 100 2.863 -7.890 -29.694 1.00 0.00 H new ATOM 0 HE2 LYS A 100 3.628 -5.678 -31.629 1.00 0.00 H new ATOM 0 HE3 LYS A 100 4.599 -7.076 -31.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 3.572 -7.712 -33.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 2.552 -8.405 -31.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 2.097 -6.966 -32.764 1.00 0.00 H new ATOM 1530 N GLU A 101 -1.515 -5.574 -28.424 1.00 0.00 N ATOM 1531 CA GLU A 101 -1.839 -4.212 -28.036 1.00 0.00 C ATOM 1532 C GLU A 101 -0.562 -3.411 -27.833 1.00 0.00 C ATOM 1533 O GLU A 101 0.527 -3.976 -27.682 1.00 0.00 O ATOM 1534 CB GLU A 101 -2.718 -4.215 -26.771 1.00 0.00 C ATOM 1535 CG GLU A 101 -3.687 -3.032 -26.763 1.00 0.00 C ATOM 1536 CD GLU A 101 -4.516 -3.028 -28.055 1.00 0.00 C ATOM 1537 OE1 GLU A 101 -5.130 -4.070 -28.360 1.00 0.00 O ATOM 1538 OE2 GLU A 101 -4.408 -2.006 -28.775 1.00 0.00 O ATOM 0 H GLU A 101 -1.444 -6.228 -27.644 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.409 -3.734 -28.833 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.280 -5.148 -26.718 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.084 -4.174 -25.885 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -4.346 -3.097 -25.898 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -3.133 -2.097 -26.673 1.00 0.00 H new ATOM 1545 N ASN A 102 -0.708 -2.084 -27.838 1.00 0.00 N ATOM 1546 CA ASN A 102 0.407 -1.177 -27.607 1.00 0.00 C ATOM 1547 C ASN A 102 1.180 -1.563 -26.339 1.00 0.00 C ATOM 1548 O ASN A 102 0.614 -2.145 -25.426 1.00 0.00 O ATOM 1549 CB ASN A 102 -0.103 0.272 -27.478 1.00 0.00 C ATOM 1550 CG ASN A 102 0.503 1.168 -28.540 1.00 0.00 C ATOM 1551 OD1 ASN A 102 0.578 0.847 -29.710 1.00 0.00 O ATOM 1552 ND2 ASN A 102 1.011 2.310 -28.129 1.00 0.00 N ATOM 0 H ASN A 102 -1.599 -1.615 -28.002 1.00 0.00 H new ATOM 0 HA ASN A 102 1.081 -1.251 -28.461 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.189 0.286 -27.565 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.143 0.659 -26.489 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.471 2.932 -28.794 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.945 2.573 -27.146 1.00 0.00 H new ATOM 1559 N PRO A 103 2.472 -1.201 -26.264 1.00 0.00 N ATOM 1560 CA PRO A 103 3.265 -1.493 -25.084 1.00 0.00 C ATOM 1561 C PRO A 103 2.896 -0.590 -23.913 1.00 0.00 C ATOM 1562 O PRO A 103 2.075 -0.917 -23.067 1.00 0.00 O ATOM 1563 CB PRO A 103 4.705 -1.300 -25.563 1.00 0.00 C ATOM 1564 CG PRO A 103 4.656 -0.456 -26.826 1.00 0.00 C ATOM 1565 CD PRO A 103 3.203 -0.471 -27.277 1.00 0.00 C ATOM 0 HA PRO A 103 3.098 -2.497 -24.694 1.00 0.00 H new ATOM 0 HB2 PRO A 103 5.302 -0.807 -24.795 1.00 0.00 H new ATOM 0 HB3 PRO A 103 5.175 -2.263 -25.763 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.994 0.561 -26.630 1.00 0.00 H new ATOM 0 HG3 PRO A 103 5.309 -0.866 -27.596 1.00 0.00 H new ATOM 0 HD2 PRO A 103 2.817 0.543 -27.380 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.103 -0.951 -28.251 1.00 0.00 H new ATOM 1573 N GLY A 104 3.529 0.573 -23.841 1.00 0.00 N ATOM 1574 CA GLY A 104 3.293 1.517 -22.765 1.00 0.00 C ATOM 1575 C GLY A 104 4.554 2.316 -22.456 1.00 0.00 C ATOM 1576 O GLY A 104 5.650 1.889 -22.838 1.00 0.00 O ATOM 0 H GLY A 104 4.218 0.885 -24.526 1.00 0.00 H new ATOM 0 HA2 GLY A 104 2.486 2.196 -23.042 1.00 0.00 H new ATOM 0 HA3 GLY A 104 2.968 0.983 -21.872 1.00 0.00 H new ATOM 1580 N PRO A 105 4.389 3.480 -21.800 1.00 0.00 N ATOM 1581 CA PRO A 105 5.502 4.343 -21.438 1.00 0.00 C ATOM 1582 C PRO A 105 6.250 3.790 -20.232 1.00 0.00 C ATOM 1583 O PRO A 105 7.359 3.270 -20.382 1.00 0.00 O ATOM 1584 CB PRO A 105 4.881 5.721 -21.164 1.00 0.00 C ATOM 1585 CG PRO A 105 3.399 5.473 -20.962 1.00 0.00 C ATOM 1586 CD PRO A 105 3.109 4.045 -21.416 1.00 0.00 C ATOM 0 HA PRO A 105 6.248 4.408 -22.230 1.00 0.00 H new ATOM 0 HB2 PRO A 105 5.324 6.181 -20.281 1.00 0.00 H new ATOM 0 HB3 PRO A 105 5.054 6.401 -21.998 1.00 0.00 H new ATOM 0 HG2 PRO A 105 3.127 5.606 -19.915 1.00 0.00 H new ATOM 0 HG3 PRO A 105 2.809 6.186 -21.537 1.00 0.00 H new ATOM 0 HD2 PRO A 105 2.652 3.466 -20.614 1.00 0.00 H new ATOM 0 HD3 PRO A 105 2.411 4.036 -22.253 1.00 0.00 H new ATOM 1594 N ALA A 106 5.634 3.901 -19.056 1.00 0.00 N ATOM 1595 CA ALA A 106 6.237 3.393 -17.849 1.00 0.00 C ATOM 1596 C ALA A 106 6.420 1.888 -17.950 1.00 0.00 C ATOM 1597 O ALA A 106 5.670 1.191 -18.642 1.00 0.00 O ATOM 1598 CB ALA A 106 5.372 3.749 -16.651 1.00 0.00 C ATOM 0 H ALA A 106 4.722 4.338 -18.925 1.00 0.00 H new ATOM 0 HA ALA A 106 7.218 3.850 -17.718 1.00 0.00 H new ATOM 0 HB1 ALA A 106 5.833 3.363 -15.742 1.00 0.00 H new ATOM 0 HB2 ALA A 106 5.279 4.833 -16.578 1.00 0.00 H new ATOM 0 HB3 ALA A 106 4.383 3.308 -16.772 1.00 0.00 H new ATOM 1604 N ARG A 107 7.439 1.397 -17.244 1.00 0.00 N ATOM 1605 CA ARG A 107 7.780 -0.016 -17.242 1.00 0.00 C ATOM 1606 C ARG A 107 8.462 -0.407 -15.949 1.00 0.00 C ATOM 1607 O ARG A 107 9.246 0.372 -15.408 1.00 0.00 O ATOM 1608 CB ARG A 107 8.693 -0.338 -18.427 1.00 0.00 C ATOM 1609 CG ARG A 107 7.890 -0.431 -19.726 1.00 0.00 C ATOM 1610 CD ARG A 107 8.427 -1.507 -20.677 1.00 0.00 C ATOM 1611 NE ARG A 107 9.084 -0.900 -21.835 1.00 0.00 N ATOM 1612 CZ ARG A 107 8.416 -0.382 -22.852 1.00 0.00 C ATOM 1613 NH1 ARG A 107 7.102 -0.407 -22.902 1.00 0.00 N ATOM 1614 NH2 ARG A 107 9.055 0.182 -23.842 1.00 0.00 N ATOM 0 H ARG A 107 8.047 1.971 -16.660 1.00 0.00 H new ATOM 0 HA ARG A 107 6.856 -0.588 -17.331 1.00 0.00 H new ATOM 0 HB2 ARG A 107 9.458 0.433 -18.522 1.00 0.00 H new ATOM 0 HB3 ARG A 107 9.211 -1.280 -18.247 1.00 0.00 H new ATOM 0 HG2 ARG A 107 6.848 -0.648 -19.490 1.00 0.00 H new ATOM 0 HG3 ARG A 107 7.908 0.535 -20.230 1.00 0.00 H new ATOM 0 HD2 ARG A 107 9.133 -2.147 -20.147 1.00 0.00 H new ATOM 0 HD3 ARG A 107 7.608 -2.144 -21.011 1.00 0.00 H new ATOM 0 HE ARG A 107 10.103 -0.875 -21.859 1.00 0.00 H new ATOM 0 HH11 ARG A 107 6.571 -0.834 -22.143 1.00 0.00 H new ATOM 0 HH12 ARG A 107 6.614 0.001 -23.700 1.00 0.00 H new ATOM 0 HH21 ARG A 107 10.074 0.224 -23.833 1.00 0.00 H new ATOM 0 HH22 ARG A 107 8.535 0.580 -24.624 1.00 0.00 H new ATOM 1628 N VAL A 108 8.154 -1.608 -15.472 1.00 0.00 N ATOM 1629 CA VAL A 108 8.753 -2.135 -14.248 1.00 0.00 C ATOM 1630 C VAL A 108 10.115 -2.723 -14.564 1.00 0.00 C ATOM 1631 O VAL A 108 10.244 -3.561 -15.453 1.00 0.00 O ATOM 1632 CB VAL A 108 7.827 -3.154 -13.577 1.00 0.00 C ATOM 1633 CG1 VAL A 108 7.403 -4.272 -14.533 1.00 0.00 C ATOM 1634 CG2 VAL A 108 8.471 -3.721 -12.307 1.00 0.00 C ATOM 0 H VAL A 108 7.488 -2.240 -15.917 1.00 0.00 H new ATOM 0 HA VAL A 108 8.890 -1.323 -13.534 1.00 0.00 H new ATOM 0 HB VAL A 108 6.917 -2.625 -13.292 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.748 -4.969 -14.010 1.00 0.00 H new ATOM 0 HG12 VAL A 108 6.872 -3.842 -15.383 1.00 0.00 H new ATOM 0 HG13 VAL A 108 8.287 -4.802 -14.888 1.00 0.00 H new ATOM 0 HG21 VAL A 108 7.795 -4.442 -11.847 1.00 0.00 H new ATOM 0 HG22 VAL A 108 9.409 -4.214 -12.564 1.00 0.00 H new ATOM 0 HG23 VAL A 108 8.668 -2.910 -11.606 1.00 0.00 H new ATOM 1644 N ILE A 109 11.133 -2.243 -13.862 1.00 0.00 N ATOM 1645 CA ILE A 109 12.499 -2.708 -14.069 1.00 0.00 C ATOM 1646 C ILE A 109 12.904 -3.624 -12.944 1.00 0.00 C ATOM 1647 O ILE A 109 12.544 -3.392 -11.790 1.00 0.00 O ATOM 1648 CB ILE A 109 13.432 -1.506 -14.227 1.00 0.00 C ATOM 1649 CG1 ILE A 109 13.011 -0.611 -15.393 1.00 0.00 C ATOM 1650 CG2 ILE A 109 14.872 -1.956 -14.429 1.00 0.00 C ATOM 1651 CD1 ILE A 109 12.478 -1.361 -16.593 1.00 0.00 C ATOM 0 H ILE A 109 11.038 -1.528 -13.141 1.00 0.00 H new ATOM 0 HA ILE A 109 12.567 -3.289 -14.989 1.00 0.00 H new ATOM 0 HB ILE A 109 13.361 -0.929 -13.305 1.00 0.00 H new ATOM 0 HG12 ILE A 109 12.247 0.084 -15.045 1.00 0.00 H new ATOM 0 HG13 ILE A 109 13.867 -0.013 -15.704 1.00 0.00 H new ATOM 0 HG21 ILE A 109 15.514 -1.082 -14.539 1.00 0.00 H new ATOM 0 HG22 ILE A 109 15.196 -2.538 -13.566 1.00 0.00 H new ATOM 0 HG23 ILE A 109 14.939 -2.570 -15.327 1.00 0.00 H new ATOM 0 HD11 ILE A 109 12.203 -0.651 -17.373 1.00 0.00 H new ATOM 0 HD12 ILE A 109 13.246 -2.036 -16.971 1.00 0.00 H new ATOM 0 HD13 ILE A 109 11.600 -1.938 -16.301 1.00 0.00 H new ATOM 1663 N TYR A 110 13.655 -4.667 -13.296 1.00 0.00 N ATOM 1664 CA TYR A 110 14.098 -5.658 -12.341 1.00 0.00 C ATOM 1665 C TYR A 110 15.244 -6.503 -12.894 1.00 0.00 C ATOM 1666 O TYR A 110 15.356 -6.755 -14.097 1.00 0.00 O ATOM 1667 CB TYR A 110 12.895 -6.542 -12.040 1.00 0.00 C ATOM 1668 CG TYR A 110 12.381 -7.293 -13.266 1.00 0.00 C ATOM 1669 CD1 TYR A 110 13.132 -8.340 -13.817 1.00 0.00 C ATOM 1670 CD2 TYR A 110 11.155 -6.947 -13.845 1.00 0.00 C ATOM 1671 CE1 TYR A 110 12.700 -9.020 -14.962 1.00 0.00 C ATOM 1672 CE2 TYR A 110 10.684 -7.673 -14.965 1.00 0.00 C ATOM 1673 CZ TYR A 110 11.470 -8.692 -15.513 1.00 0.00 C ATOM 1674 OH TYR A 110 11.008 -9.430 -16.574 1.00 0.00 O ATOM 0 H TYR A 110 13.968 -4.840 -14.251 1.00 0.00 H new ATOM 0 HA TYR A 110 14.475 -5.170 -11.442 1.00 0.00 H new ATOM 0 HB2 TYR A 110 13.165 -7.262 -11.267 1.00 0.00 H new ATOM 0 HB3 TYR A 110 12.092 -5.926 -11.635 1.00 0.00 H new ATOM 0 HD1 TYR A 110 14.062 -8.628 -13.349 1.00 0.00 H new ATOM 0 HD2 TYR A 110 10.573 -6.132 -13.440 1.00 0.00 H new ATOM 0 HE1 TYR A 110 13.314 -9.787 -15.409 1.00 0.00 H new ATOM 0 HE2 TYR A 110 9.721 -7.441 -15.395 1.00 0.00 H new ATOM 0 HH TYR A 110 10.134 -9.087 -16.855 1.00 0.00 H new ATOM 1684 N THR A 111 16.127 -6.925 -11.995 1.00 0.00 N ATOM 1685 CA THR A 111 17.281 -7.722 -12.398 1.00 0.00 C ATOM 1686 C THR A 111 16.874 -9.180 -12.504 1.00 0.00 C ATOM 1687 O THR A 111 15.784 -9.567 -12.062 1.00 0.00 O ATOM 1688 CB THR A 111 18.454 -7.479 -11.433 1.00 0.00 C ATOM 1689 OG1 THR A 111 18.298 -8.177 -10.222 1.00 0.00 O ATOM 1690 CG2 THR A 111 18.530 -6.019 -10.983 1.00 0.00 C ATOM 0 H THR A 111 16.068 -6.732 -10.995 1.00 0.00 H new ATOM 0 HA THR A 111 17.632 -7.418 -13.384 1.00 0.00 H new ATOM 0 HB THR A 111 19.331 -7.799 -11.995 1.00 0.00 H new ATOM 0 HG1 THR A 111 19.065 -7.996 -9.639 1.00 0.00 H new ATOM 0 HG21 THR A 111 19.372 -5.891 -10.303 1.00 0.00 H new ATOM 0 HG22 THR A 111 18.666 -5.377 -11.853 1.00 0.00 H new ATOM 0 HG23 THR A 111 17.606 -5.747 -10.472 1.00 0.00 H new ATOM 1698 N TYR A 112 17.768 -9.985 -13.065 1.00 0.00 N ATOM 1699 CA TYR A 112 17.510 -11.415 -13.179 1.00 0.00 C ATOM 1700 C TYR A 112 18.452 -12.233 -12.256 1.00 0.00 C ATOM 1701 O TYR A 112 19.561 -11.807 -11.945 1.00 0.00 O ATOM 1702 CB TYR A 112 17.615 -11.788 -14.666 1.00 0.00 C ATOM 1703 CG TYR A 112 17.737 -13.282 -14.959 1.00 0.00 C ATOM 1704 CD1 TYR A 112 18.876 -13.995 -14.532 1.00 0.00 C ATOM 1705 CD2 TYR A 112 16.720 -13.973 -15.625 1.00 0.00 C ATOM 1706 CE1 TYR A 112 18.981 -15.385 -14.711 1.00 0.00 C ATOM 1707 CE2 TYR A 112 16.813 -15.375 -15.792 1.00 0.00 C ATOM 1708 CZ TYR A 112 17.921 -16.067 -15.294 1.00 0.00 C ATOM 1709 OH TYR A 112 18.029 -17.441 -15.422 1.00 0.00 O ATOM 0 H TYR A 112 18.665 -9.679 -13.443 1.00 0.00 H new ATOM 0 HA TYR A 112 16.507 -11.664 -12.832 1.00 0.00 H new ATOM 0 HB2 TYR A 112 16.735 -11.404 -15.182 1.00 0.00 H new ATOM 0 HB3 TYR A 112 18.481 -11.280 -15.090 1.00 0.00 H new ATOM 0 HD1 TYR A 112 19.686 -13.461 -14.057 1.00 0.00 H new ATOM 0 HD2 TYR A 112 15.865 -13.438 -16.011 1.00 0.00 H new ATOM 0 HE1 TYR A 112 19.870 -15.913 -14.401 1.00 0.00 H new ATOM 0 HE2 TYR A 112 16.028 -15.911 -16.304 1.00 0.00 H new ATOM 0 HH TYR A 112 17.134 -17.841 -15.426 1.00 0.00 H new ATOM 1719 N PRO A 113 18.020 -13.444 -11.851 1.00 0.00 N ATOM 1720 CA PRO A 113 16.678 -13.955 -12.113 1.00 0.00 C ATOM 1721 C PRO A 113 15.671 -13.261 -11.238 1.00 0.00 C ATOM 1722 O PRO A 113 14.735 -12.660 -11.744 1.00 0.00 O ATOM 1723 CB PRO A 113 16.725 -15.461 -11.879 1.00 0.00 C ATOM 1724 CG PRO A 113 17.982 -15.690 -11.058 1.00 0.00 C ATOM 1725 CD PRO A 113 18.831 -14.414 -11.146 1.00 0.00 C ATOM 0 HA PRO A 113 16.364 -13.758 -13.138 1.00 0.00 H new ATOM 0 HB2 PRO A 113 15.838 -15.806 -11.348 1.00 0.00 H new ATOM 0 HB3 PRO A 113 16.764 -16.006 -12.822 1.00 0.00 H new ATOM 0 HG2 PRO A 113 17.728 -15.910 -10.021 1.00 0.00 H new ATOM 0 HG3 PRO A 113 18.538 -16.547 -11.439 1.00 0.00 H new ATOM 0 HD2 PRO A 113 19.096 -14.053 -10.153 1.00 0.00 H new ATOM 0 HD3 PRO A 113 19.764 -14.602 -11.677 1.00 0.00 H new ATOM 1733 N ASN A 114 15.882 -13.333 -9.928 1.00 0.00 N ATOM 1734 CA ASN A 114 15.016 -12.681 -8.968 1.00 0.00 C ATOM 1735 C ASN A 114 14.692 -11.276 -9.454 1.00 0.00 C ATOM 1736 O ASN A 114 15.611 -10.476 -9.604 1.00 0.00 O ATOM 1737 CB ASN A 114 15.738 -12.548 -7.615 1.00 0.00 C ATOM 1738 CG ASN A 114 15.123 -13.460 -6.585 1.00 0.00 C ATOM 1739 OD1 ASN A 114 14.627 -14.533 -6.875 1.00 0.00 O ATOM 1740 ND2 ASN A 114 15.107 -13.010 -5.355 1.00 0.00 N ATOM 0 H ASN A 114 16.658 -13.845 -9.508 1.00 0.00 H new ATOM 0 HA ASN A 114 14.109 -13.275 -8.858 1.00 0.00 H new ATOM 0 HB2 ASN A 114 16.794 -12.790 -7.736 1.00 0.00 H new ATOM 0 HB3 ASN A 114 15.685 -11.515 -7.270 1.00 0.00 H new ATOM 0 HD21 ASN A 114 14.672 -13.562 -4.616 1.00 0.00 H new ATOM 0 HD22 ASN A 114 15.529 -12.108 -5.137 1.00 0.00 H new ATOM 1747 N LYS A 115 13.415 -11.010 -9.727 1.00 0.00 N ATOM 1748 CA LYS A 115 12.947 -9.717 -10.222 1.00 0.00 C ATOM 1749 C LYS A 115 13.178 -8.684 -9.141 1.00 0.00 C ATOM 1750 O LYS A 115 12.278 -8.368 -8.362 1.00 0.00 O ATOM 1751 CB LYS A 115 11.457 -9.782 -10.614 1.00 0.00 C ATOM 1752 CG LYS A 115 11.302 -10.040 -12.108 1.00 0.00 C ATOM 1753 CD LYS A 115 10.389 -11.190 -12.471 1.00 0.00 C ATOM 1754 CE LYS A 115 10.932 -12.466 -11.828 1.00 0.00 C ATOM 1755 NZ LYS A 115 10.063 -12.874 -10.706 1.00 0.00 N ATOM 0 H LYS A 115 12.668 -11.695 -9.609 1.00 0.00 H new ATOM 0 HA LYS A 115 13.501 -9.443 -11.120 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.962 -10.573 -10.050 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.965 -8.846 -10.349 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.923 -9.133 -12.580 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.288 -10.232 -12.532 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.375 -10.993 -12.122 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.337 -11.305 -13.554 1.00 0.00 H new ATOM 0 HE2 LYS A 115 10.982 -13.264 -12.569 1.00 0.00 H new ATOM 0 HE3 LYS A 115 11.948 -12.299 -11.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.651 -13.167 -9.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.462 -12.074 -10.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.463 -13.670 -11.003 1.00 0.00 H new ATOM 1769 N VAL A 116 14.429 -8.221 -9.042 1.00 0.00 N ATOM 1770 CA VAL A 116 14.867 -7.269 -8.025 1.00 0.00 C ATOM 1771 C VAL A 116 14.294 -5.923 -8.419 1.00 0.00 C ATOM 1772 O VAL A 116 14.986 -5.101 -9.011 1.00 0.00 O ATOM 1773 CB VAL A 116 16.400 -7.207 -7.935 1.00 0.00 C ATOM 1774 CG1 VAL A 116 16.874 -6.158 -6.923 1.00 0.00 C ATOM 1775 CG2 VAL A 116 17.001 -8.571 -7.582 1.00 0.00 C ATOM 0 H VAL A 116 15.174 -8.504 -9.678 1.00 0.00 H new ATOM 0 HA VAL A 116 14.516 -7.573 -7.039 1.00 0.00 H new ATOM 0 HB VAL A 116 16.752 -6.914 -8.924 1.00 0.00 H new ATOM 0 HG11 VAL A 116 17.964 -6.149 -6.892 1.00 0.00 H new ATOM 0 HG12 VAL A 116 16.511 -5.175 -7.221 1.00 0.00 H new ATOM 0 HG13 VAL A 116 16.485 -6.404 -5.935 1.00 0.00 H new ATOM 0 HG21 VAL A 116 18.086 -8.487 -7.527 1.00 0.00 H new ATOM 0 HG22 VAL A 116 16.614 -8.901 -6.618 1.00 0.00 H new ATOM 0 HG23 VAL A 116 16.731 -9.297 -8.349 1.00 0.00 H new ATOM 1785 N PHE A 117 12.989 -5.774 -8.172 1.00 0.00 N ATOM 1786 CA PHE A 117 12.201 -4.598 -8.467 1.00 0.00 C ATOM 1787 C PHE A 117 13.033 -3.349 -8.197 1.00 0.00 C ATOM 1788 O PHE A 117 13.302 -2.996 -7.047 1.00 0.00 O ATOM 1789 CB PHE A 117 10.961 -4.637 -7.578 1.00 0.00 C ATOM 1790 CG PHE A 117 10.176 -3.346 -7.627 1.00 0.00 C ATOM 1791 CD1 PHE A 117 9.604 -2.939 -8.836 1.00 0.00 C ATOM 1792 CD2 PHE A 117 10.093 -2.544 -6.481 1.00 0.00 C ATOM 1793 CE1 PHE A 117 8.940 -1.718 -8.903 1.00 0.00 C ATOM 1794 CE2 PHE A 117 9.397 -1.338 -6.535 1.00 0.00 C ATOM 1795 CZ PHE A 117 8.851 -0.935 -7.752 1.00 0.00 C ATOM 0 H PHE A 117 12.436 -6.514 -7.739 1.00 0.00 H new ATOM 0 HA PHE A 117 11.899 -4.577 -9.514 1.00 0.00 H new ATOM 0 HB2 PHE A 117 10.319 -5.461 -7.890 1.00 0.00 H new ATOM 0 HB3 PHE A 117 11.261 -4.838 -6.549 1.00 0.00 H new ATOM 0 HD1 PHE A 117 9.677 -3.567 -9.711 1.00 0.00 H new ATOM 0 HD2 PHE A 117 10.565 -2.858 -5.562 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.501 -1.382 -9.831 1.00 0.00 H new ATOM 0 HE2 PHE A 117 9.283 -0.728 -5.651 1.00 0.00 H new ATOM 0 HZ PHE A 117 8.342 0.016 -7.806 1.00 0.00 H new ATOM 1805 N CYS A 118 13.510 -2.728 -9.263 1.00 0.00 N ATOM 1806 CA CYS A 118 14.346 -1.554 -9.135 1.00 0.00 C ATOM 1807 C CYS A 118 13.451 -0.337 -8.959 1.00 0.00 C ATOM 1808 O CYS A 118 13.703 0.532 -8.121 1.00 0.00 O ATOM 1809 CB CYS A 118 15.257 -1.406 -10.347 1.00 0.00 C ATOM 1810 SG CYS A 118 16.071 -2.914 -10.879 1.00 0.00 S ATOM 0 H CYS A 118 13.331 -3.019 -10.224 1.00 0.00 H new ATOM 0 HA CYS A 118 14.992 -1.652 -8.262 1.00 0.00 H new ATOM 0 HB2 CYS A 118 14.669 -1.017 -11.178 1.00 0.00 H new ATOM 0 HB3 CYS A 118 16.020 -0.661 -10.120 1.00 0.00 H new ATOM 1815 N GLY A 119 12.401 -0.277 -9.779 1.00 0.00 N ATOM 1816 CA GLY A 119 11.441 0.799 -9.745 1.00 0.00 C ATOM 1817 C GLY A 119 10.735 0.905 -11.078 1.00 0.00 C ATOM 1818 O GLY A 119 10.474 -0.093 -11.753 1.00 0.00 O ATOM 0 H GLY A 119 12.202 -0.984 -10.486 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.714 0.624 -8.952 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.943 1.738 -9.515 1.00 0.00 H new ATOM 1822 N ILE A 120 10.367 2.121 -11.449 1.00 0.00 N ATOM 1823 CA ILE A 120 9.621 2.338 -12.680 1.00 0.00 C ATOM 1824 C ILE A 120 10.345 3.392 -13.472 1.00 0.00 C ATOM 1825 O ILE A 120 10.866 4.340 -12.882 1.00 0.00 O ATOM 1826 CB ILE A 120 8.185 2.750 -12.366 1.00 0.00 C ATOM 1827 CG1 ILE A 120 7.550 1.870 -11.276 1.00 0.00 C ATOM 1828 CG2 ILE A 120 7.341 2.766 -13.659 1.00 0.00 C ATOM 1829 CD1 ILE A 120 6.627 0.787 -11.792 1.00 0.00 C ATOM 0 H ILE A 120 10.571 2.969 -10.920 1.00 0.00 H new ATOM 0 HA ILE A 120 9.562 1.421 -13.266 1.00 0.00 H new ATOM 0 HB ILE A 120 8.208 3.761 -11.959 1.00 0.00 H new ATOM 0 HG12 ILE A 120 8.346 1.403 -10.696 1.00 0.00 H new ATOM 0 HG13 ILE A 120 6.991 2.509 -10.593 1.00 0.00 H new ATOM 0 HG21 ILE A 120 6.319 3.061 -13.423 1.00 0.00 H new ATOM 0 HG22 ILE A 120 7.770 3.477 -14.365 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.338 1.771 -14.104 1.00 0.00 H new ATOM 0 HD11 ILE A 120 6.227 0.219 -10.952 1.00 0.00 H new ATOM 0 HD12 ILE A 120 5.806 1.242 -12.346 1.00 0.00 H new ATOM 0 HD13 ILE A 120 7.182 0.119 -12.450 1.00 0.00 H new ATOM 1841 N ILE A 121 10.412 3.223 -14.773 1.00 0.00 N ATOM 1842 CA ILE A 121 11.135 4.176 -15.613 1.00 0.00 C ATOM 1843 C ILE A 121 10.226 4.598 -16.745 1.00 0.00 C ATOM 1844 O ILE A 121 9.337 3.841 -17.134 1.00 0.00 O ATOM 1845 CB ILE A 121 12.449 3.562 -16.128 1.00 0.00 C ATOM 1846 CG1 ILE A 121 12.172 2.606 -17.308 1.00 0.00 C ATOM 1847 CG2 ILE A 121 13.226 2.858 -14.996 1.00 0.00 C ATOM 1848 CD1 ILE A 121 13.472 2.165 -17.942 1.00 0.00 C ATOM 0 H ILE A 121 9.983 2.447 -15.277 1.00 0.00 H new ATOM 0 HA ILE A 121 11.411 5.056 -15.033 1.00 0.00 H new ATOM 0 HB ILE A 121 13.082 4.371 -16.491 1.00 0.00 H new ATOM 0 HG12 ILE A 121 11.617 1.736 -16.957 1.00 0.00 H new ATOM 0 HG13 ILE A 121 11.548 3.104 -18.050 1.00 0.00 H new ATOM 0 HG21 ILE A 121 14.148 2.436 -15.395 1.00 0.00 H new ATOM 0 HG22 ILE A 121 13.466 3.580 -14.215 1.00 0.00 H new ATOM 0 HG23 ILE A 121 12.614 2.060 -14.576 1.00 0.00 H new ATOM 0 HD11 ILE A 121 13.262 1.491 -18.773 1.00 0.00 H new ATOM 0 HD12 ILE A 121 14.012 3.038 -18.310 1.00 0.00 H new ATOM 0 HD13 ILE A 121 14.081 1.648 -17.201 1.00 0.00 H new ATOM 1860 N ALA A 122 10.464 5.779 -17.306 1.00 0.00 N ATOM 1861 CA ALA A 122 9.689 6.286 -18.426 1.00 0.00 C ATOM 1862 C ALA A 122 10.300 7.604 -18.907 1.00 0.00 C ATOM 1863 O ALA A 122 10.955 8.339 -18.164 1.00 0.00 O ATOM 1864 CB ALA A 122 8.236 6.509 -17.999 1.00 0.00 C ATOM 0 H ALA A 122 11.202 6.411 -16.994 1.00 0.00 H new ATOM 0 HA ALA A 122 9.707 5.559 -19.238 1.00 0.00 H new ATOM 0 HB1 ALA A 122 7.663 6.889 -18.844 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.806 5.565 -17.664 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.203 7.232 -17.184 1.00 0.00 H new ATOM 1870 N HIS A 123 10.091 7.898 -20.188 1.00 0.00 N ATOM 1871 CA HIS A 123 10.645 9.091 -20.816 1.00 0.00 C ATOM 1872 C HIS A 123 9.645 10.229 -20.678 1.00 0.00 C ATOM 1873 O HIS A 123 8.787 10.397 -21.533 1.00 0.00 O ATOM 1874 CB HIS A 123 11.035 8.822 -22.286 1.00 0.00 C ATOM 1875 CG HIS A 123 11.629 7.455 -22.566 1.00 0.00 C ATOM 1876 ND1 HIS A 123 10.962 6.258 -22.573 1.00 0.00 N flip ATOM 1877 CD2 HIS A 123 12.958 7.215 -22.829 1.00 0.00 C flip ATOM 1878 CE1 HIS A 123 11.909 5.283 -22.824 1.00 0.00 C flip ATOM 1879 NE2 HIS A 123 13.101 5.888 -22.993 1.00 0.00 N flip ATOM 0 H HIS A 123 9.535 7.318 -20.816 1.00 0.00 H new ATOM 0 HA HIS A 123 11.567 9.378 -20.311 1.00 0.00 H new ATOM 0 HB2 HIS A 123 10.148 8.947 -22.907 1.00 0.00 H new ATOM 0 HB3 HIS A 123 11.752 9.581 -22.598 1.00 0.00 H new ATOM 0 HD1 HIS A 123 9.963 6.115 -22.423 1.00 0.00 H new ATOM 0 HD2 HIS A 123 13.742 7.956 -22.892 1.00 0.00 H new ATOM 0 HE1 HIS A 123 11.725 4.220 -22.876 1.00 0.00 H new ATOM 1888 N THR A 124 9.779 11.021 -19.618 1.00 0.00 N ATOM 1889 CA THR A 124 8.872 12.157 -19.362 1.00 0.00 C ATOM 1890 C THR A 124 9.490 13.470 -19.856 1.00 0.00 C ATOM 1891 O THR A 124 9.530 14.487 -19.164 1.00 0.00 O ATOM 1892 CB THR A 124 8.472 12.172 -17.884 1.00 0.00 C ATOM 1893 OG1 THR A 124 7.271 12.883 -17.790 1.00 0.00 O ATOM 1894 CG2 THR A 124 9.500 12.848 -16.975 1.00 0.00 C ATOM 0 H THR A 124 10.508 10.903 -18.914 1.00 0.00 H new ATOM 0 HA THR A 124 7.951 12.039 -19.934 1.00 0.00 H new ATOM 0 HB THR A 124 8.390 11.138 -17.550 1.00 0.00 H new ATOM 0 HG1 THR A 124 7.385 13.772 -18.186 1.00 0.00 H new ATOM 0 HG21 THR A 124 9.148 12.820 -15.944 1.00 0.00 H new ATOM 0 HG22 THR A 124 10.452 12.322 -17.048 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.634 13.884 -17.285 1.00 0.00 H new ATOM 1902 N LYS A 125 10.080 13.414 -21.047 1.00 0.00 N ATOM 1903 CA LYS A 125 10.680 14.602 -21.653 1.00 0.00 C ATOM 1904 C LYS A 125 9.801 15.131 -22.770 1.00 0.00 C ATOM 1905 O LYS A 125 9.834 16.324 -23.030 1.00 0.00 O ATOM 1906 CB LYS A 125 12.107 14.275 -22.078 1.00 0.00 C ATOM 1907 CG LYS A 125 12.761 15.474 -22.761 1.00 0.00 C ATOM 1908 CD LYS A 125 14.172 15.147 -23.240 1.00 0.00 C ATOM 1909 CE LYS A 125 14.207 14.962 -24.759 1.00 0.00 C ATOM 1910 NZ LYS A 125 15.365 15.681 -25.336 1.00 0.00 N ATOM 0 H LYS A 125 10.156 12.566 -21.609 1.00 0.00 H new ATOM 0 HA LYS A 125 10.745 15.416 -20.931 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.693 13.984 -21.206 1.00 0.00 H new ATOM 0 HB3 LYS A 125 12.102 13.423 -22.757 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.152 15.787 -23.609 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.797 16.314 -22.067 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.852 15.948 -22.952 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.524 14.239 -22.751 1.00 0.00 H new ATOM 0 HE2 LYS A 125 14.271 13.901 -25.002 1.00 0.00 H new ATOM 0 HE3 LYS A 125 13.282 15.335 -25.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 15.378 15.548 -26.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 15.287 16.695 -25.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.245 15.306 -24.928 1.00 0.00 H new ATOM 1924 N GLU A 126 9.027 14.249 -23.396 1.00 0.00 N ATOM 1925 CA GLU A 126 8.122 14.622 -24.480 1.00 0.00 C ATOM 1926 C GLU A 126 7.230 13.446 -24.866 1.00 0.00 C ATOM 1927 O GLU A 126 6.030 13.456 -24.622 1.00 0.00 O ATOM 1928 CB GLU A 126 8.944 15.125 -25.676 1.00 0.00 C ATOM 1929 CG GLU A 126 8.522 16.542 -26.076 1.00 0.00 C ATOM 1930 CD GLU A 126 7.479 16.513 -27.198 1.00 0.00 C ATOM 1931 OE1 GLU A 126 7.742 15.811 -28.192 1.00 0.00 O ATOM 1932 OE2 GLU A 126 6.437 17.195 -27.037 1.00 0.00 O ATOM 0 H GLU A 126 9.009 13.255 -23.166 1.00 0.00 H new ATOM 0 HA GLU A 126 7.466 15.426 -24.147 1.00 0.00 H new ATOM 0 HB2 GLU A 126 10.004 15.115 -25.423 1.00 0.00 H new ATOM 0 HB3 GLU A 126 8.812 14.450 -26.522 1.00 0.00 H new ATOM 0 HG2 GLU A 126 8.113 17.061 -25.209 1.00 0.00 H new ATOM 0 HG3 GLU A 126 9.396 17.106 -26.402 1.00 0.00 H new ATOM 1939 N ASN A 127 7.842 12.387 -25.391 1.00 0.00 N ATOM 1940 CA ASN A 127 7.160 11.164 -25.800 1.00 0.00 C ATOM 1941 C ASN A 127 8.128 9.984 -25.737 1.00 0.00 C ATOM 1942 O ASN A 127 7.842 8.925 -25.173 1.00 0.00 O ATOM 1943 CB ASN A 127 6.617 11.352 -27.226 1.00 0.00 C ATOM 1944 CG ASN A 127 6.023 10.064 -27.771 1.00 0.00 C ATOM 1945 OD1 ASN A 127 5.398 9.270 -27.088 1.00 0.00 O ATOM 1946 ND2 ASN A 127 6.260 9.802 -29.039 1.00 0.00 N ATOM 0 H ASN A 127 8.850 12.356 -25.547 1.00 0.00 H new ATOM 0 HA ASN A 127 6.329 10.955 -25.127 1.00 0.00 H new ATOM 0 HB2 ASN A 127 5.857 12.133 -27.227 1.00 0.00 H new ATOM 0 HB3 ASN A 127 7.421 11.689 -27.881 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.921 8.933 -29.452 1.00 0.00 H new ATOM 0 HD22 ASN A 127 6.783 10.468 -29.608 1.00 0.00 H new ATOM 1953 N GLN A 128 9.318 10.186 -26.301 1.00 0.00 N ATOM 1954 CA GLN A 128 10.341 9.161 -26.370 1.00 0.00 C ATOM 1955 C GLN A 128 11.721 9.792 -26.537 1.00 0.00 C ATOM 1956 O GLN A 128 12.294 9.807 -27.620 1.00 0.00 O ATOM 1957 CB GLN A 128 10.006 8.157 -27.495 1.00 0.00 C ATOM 1958 CG GLN A 128 9.558 6.812 -26.917 1.00 0.00 C ATOM 1959 CD GLN A 128 10.141 5.625 -27.668 1.00 0.00 C ATOM 1960 OE1 GLN A 128 11.299 5.561 -28.036 1.00 0.00 O ATOM 1961 NE2 GLN A 128 9.352 4.589 -27.827 1.00 0.00 N ATOM 0 H GLN A 128 9.594 11.072 -26.723 1.00 0.00 H new ATOM 0 HA GLN A 128 10.363 8.604 -25.434 1.00 0.00 H new ATOM 0 HB2 GLN A 128 9.218 8.565 -28.128 1.00 0.00 H new ATOM 0 HB3 GLN A 128 10.881 8.011 -28.129 1.00 0.00 H new ATOM 0 HG2 GLN A 128 9.855 6.755 -25.870 1.00 0.00 H new ATOM 0 HG3 GLN A 128 8.470 6.754 -26.944 1.00 0.00 H new ATOM 0 HE21 GLN A 128 8.380 4.636 -27.521 1.00 0.00 H new ATOM 0 HE22 GLN A 128 9.710 3.736 -28.257 1.00 0.00 H new ATOM 1970 N GLY A 129 12.252 10.335 -25.444 1.00 0.00 N ATOM 1971 CA GLY A 129 13.575 10.952 -25.467 1.00 0.00 C ATOM 1972 C GLY A 129 14.458 10.331 -24.398 1.00 0.00 C ATOM 1973 O GLY A 129 14.853 9.166 -24.487 1.00 0.00 O ATOM 0 H GLY A 129 11.789 10.360 -24.536 1.00 0.00 H new ATOM 0 HA2 GLY A 129 14.030 10.819 -26.448 1.00 0.00 H new ATOM 0 HA3 GLY A 129 13.487 12.025 -25.299 1.00 0.00 H new ATOM 1977 N GLU A 130 14.696 11.076 -23.326 1.00 0.00 N ATOM 1978 CA GLU A 130 15.541 10.597 -22.238 1.00 0.00 C ATOM 1979 C GLU A 130 14.752 9.697 -21.300 1.00 0.00 C ATOM 1980 O GLU A 130 13.575 9.944 -21.040 1.00 0.00 O ATOM 1981 CB GLU A 130 16.110 11.776 -21.447 1.00 0.00 C ATOM 1982 CG GLU A 130 17.609 11.910 -21.703 1.00 0.00 C ATOM 1983 CD GLU A 130 17.831 12.700 -23.001 1.00 0.00 C ATOM 1984 OE1 GLU A 130 17.388 13.865 -23.078 1.00 0.00 O ATOM 1985 OE2 GLU A 130 18.338 12.068 -23.962 1.00 0.00 O ATOM 0 H GLU A 130 14.317 12.013 -23.186 1.00 0.00 H new ATOM 0 HA GLU A 130 16.359 10.025 -22.675 1.00 0.00 H new ATOM 0 HB2 GLU A 130 15.601 12.696 -21.735 1.00 0.00 H new ATOM 0 HB3 GLU A 130 15.927 11.631 -20.382 1.00 0.00 H new ATOM 0 HG2 GLU A 130 18.089 12.419 -20.867 1.00 0.00 H new ATOM 0 HG3 GLU A 130 18.066 10.924 -21.781 1.00 0.00 H new ATOM 1992 N LEU A 131 15.401 8.657 -20.781 1.00 0.00 N ATOM 1993 CA LEU A 131 14.762 7.748 -19.835 1.00 0.00 C ATOM 1994 C LEU A 131 15.172 8.087 -18.411 1.00 0.00 C ATOM 1995 O LEU A 131 16.325 8.404 -18.148 1.00 0.00 O ATOM 1996 CB LEU A 131 15.114 6.309 -20.226 1.00 0.00 C ATOM 1997 CG LEU A 131 14.172 5.229 -19.676 1.00 0.00 C ATOM 1998 CD1 LEU A 131 12.705 5.639 -19.671 1.00 0.00 C ATOM 1999 CD2 LEU A 131 14.370 3.934 -20.466 1.00 0.00 C ATOM 0 H LEU A 131 16.369 8.424 -21.000 1.00 0.00 H new ATOM 0 HA LEU A 131 13.678 7.856 -19.874 1.00 0.00 H new ATOM 0 HB2 LEU A 131 15.125 6.238 -21.314 1.00 0.00 H new ATOM 0 HB3 LEU A 131 16.126 6.094 -19.882 1.00 0.00 H new ATOM 0 HG LEU A 131 14.436 5.077 -18.629 1.00 0.00 H new ATOM 0 HD11 LEU A 131 12.101 4.825 -19.269 1.00 0.00 H new ATOM 0 HD12 LEU A 131 12.577 6.526 -19.051 1.00 0.00 H new ATOM 0 HD13 LEU A 131 12.385 5.859 -20.690 1.00 0.00 H new ATOM 0 HD21 LEU A 131 13.702 3.165 -20.078 1.00 0.00 H new ATOM 0 HD22 LEU A 131 14.146 4.112 -21.518 1.00 0.00 H new ATOM 0 HD23 LEU A 131 15.403 3.601 -20.366 1.00 0.00 H new ATOM 2011 N LYS A 132 14.210 8.026 -17.498 1.00 0.00 N ATOM 2012 CA LYS A 132 14.433 8.322 -16.086 1.00 0.00 C ATOM 2013 C LYS A 132 13.506 7.469 -15.246 1.00 0.00 C ATOM 2014 O LYS A 132 12.610 6.828 -15.788 1.00 0.00 O ATOM 2015 CB LYS A 132 14.242 9.818 -15.838 1.00 0.00 C ATOM 2016 CG LYS A 132 12.994 10.381 -16.540 1.00 0.00 C ATOM 2017 CD LYS A 132 12.578 11.711 -15.925 1.00 0.00 C ATOM 2018 CE LYS A 132 13.032 12.886 -16.795 1.00 0.00 C ATOM 2019 NZ LYS A 132 12.687 14.175 -16.147 1.00 0.00 N ATOM 0 H LYS A 132 13.248 7.768 -17.717 1.00 0.00 H new ATOM 0 HA LYS A 132 15.456 8.078 -15.799 1.00 0.00 H new ATOM 0 HB2 LYS A 132 14.163 9.997 -14.766 1.00 0.00 H new ATOM 0 HB3 LYS A 132 15.124 10.356 -16.187 1.00 0.00 H new ATOM 0 HG2 LYS A 132 13.199 10.515 -17.602 1.00 0.00 H new ATOM 0 HG3 LYS A 132 12.174 9.667 -16.461 1.00 0.00 H new ATOM 0 HD2 LYS A 132 11.495 11.738 -15.808 1.00 0.00 H new ATOM 0 HD3 LYS A 132 13.009 11.805 -14.928 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.108 12.831 -16.958 1.00 0.00 H new ATOM 0 HE3 LYS A 132 12.557 12.826 -17.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 13.002 14.962 -16.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 11.657 14.232 -16.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 13.160 14.236 -15.223 1.00 0.00 H new ATOM 2033 N LEU A 133 13.739 7.472 -13.937 1.00 0.00 N ATOM 2034 CA LEU A 133 12.906 6.728 -13.003 1.00 0.00 C ATOM 2035 C LEU A 133 11.679 7.570 -12.643 1.00 0.00 C ATOM 2036 O LEU A 133 11.751 8.802 -12.607 1.00 0.00 O ATOM 2037 CB LEU A 133 13.743 6.321 -11.775 1.00 0.00 C ATOM 2038 CG LEU A 133 13.272 5.022 -11.098 1.00 0.00 C ATOM 2039 CD1 LEU A 133 13.834 3.802 -11.817 1.00 0.00 C ATOM 2040 CD2 LEU A 133 13.703 4.973 -9.643 1.00 0.00 C ATOM 0 H LEU A 133 14.503 7.986 -13.499 1.00 0.00 H new ATOM 0 HA LEU A 133 12.542 5.805 -13.455 1.00 0.00 H new ATOM 0 HB2 LEU A 133 14.783 6.203 -12.080 1.00 0.00 H new ATOM 0 HB3 LEU A 133 13.715 7.130 -11.045 1.00 0.00 H new ATOM 0 HG LEU A 133 12.183 5.009 -11.151 1.00 0.00 H new ATOM 0 HD11 LEU A 133 13.488 2.896 -11.321 1.00 0.00 H new ATOM 0 HD12 LEU A 133 13.494 3.801 -12.853 1.00 0.00 H new ATOM 0 HD13 LEU A 133 14.923 3.835 -11.793 1.00 0.00 H new ATOM 0 HD21 LEU A 133 13.356 4.044 -9.192 1.00 0.00 H new ATOM 0 HD22 LEU A 133 14.790 5.021 -9.584 1.00 0.00 H new ATOM 0 HD23 LEU A 133 13.273 5.819 -9.107 1.00 0.00 H new ATOM 2052 N CYS A 134 10.556 6.898 -12.381 1.00 0.00 N ATOM 2053 CA CYS A 134 9.334 7.546 -11.924 1.00 0.00 C ATOM 2054 C CYS A 134 9.539 8.115 -10.518 1.00 0.00 C ATOM 2055 O CYS A 134 10.622 8.055 -9.935 1.00 0.00 O ATOM 2056 CB CYS A 134 8.181 6.533 -11.922 1.00 0.00 C ATOM 2057 SG CYS A 134 7.752 5.837 -13.525 1.00 0.00 S ATOM 0 H CYS A 134 10.473 5.886 -12.481 1.00 0.00 H new ATOM 0 HA CYS A 134 9.087 8.364 -12.600 1.00 0.00 H new ATOM 0 HB2 CYS A 134 8.441 5.716 -11.249 1.00 0.00 H new ATOM 0 HB3 CYS A 134 7.297 7.018 -11.508 1.00 0.00 H new ATOM 2062 N SER A 135 8.463 8.634 -9.941 1.00 0.00 N ATOM 2063 CA SER A 135 8.525 9.250 -8.620 1.00 0.00 C ATOM 2064 C SER A 135 7.434 8.646 -7.754 1.00 0.00 C ATOM 2065 O SER A 135 6.281 9.052 -7.841 1.00 0.00 O ATOM 2066 CB SER A 135 8.373 10.764 -8.738 1.00 0.00 C ATOM 2067 OG SER A 135 9.276 11.309 -9.687 1.00 0.00 O ATOM 0 H SER A 135 7.536 8.641 -10.366 1.00 0.00 H new ATOM 0 HA SER A 135 9.492 9.057 -8.156 1.00 0.00 H new ATOM 0 HB2 SER A 135 7.350 11.006 -9.028 1.00 0.00 H new ATOM 0 HB3 SER A 135 8.546 11.224 -7.765 1.00 0.00 H new ATOM 0 HG SER A 135 9.150 12.280 -9.738 1.00 0.00 H new ATOM 2073 N HIS A 136 7.802 7.632 -6.979 1.00 0.00 N ATOM 2074 CA HIS A 136 6.896 6.981 -6.036 1.00 0.00 C ATOM 2075 C HIS A 136 7.133 7.486 -4.615 1.00 0.00 C ATOM 2076 O HIS A 136 8.204 7.225 -4.062 1.00 0.00 O ATOM 2077 CB HIS A 136 7.020 5.471 -6.137 1.00 0.00 C ATOM 2078 CG HIS A 136 8.325 4.913 -5.589 1.00 0.00 C ATOM 2079 ND1 HIS A 136 9.568 5.169 -6.112 1.00 0.00 N ATOM 2080 CD2 HIS A 136 8.499 4.157 -4.464 1.00 0.00 C ATOM 2081 CE1 HIS A 136 10.484 4.564 -5.336 1.00 0.00 C ATOM 2082 NE2 HIS A 136 9.858 3.936 -4.325 1.00 0.00 N ATOM 2083 OXT HIS A 136 6.194 8.102 -4.070 1.00 0.00 O ATOM 0 H HIS A 136 8.742 7.235 -6.986 1.00 0.00 H new ATOM 0 HA HIS A 136 5.871 7.242 -6.298 1.00 0.00 H new ATOM 0 HB2 HIS A 136 6.189 5.013 -5.601 1.00 0.00 H new ATOM 0 HB3 HIS A 136 6.924 5.179 -7.183 1.00 0.00 H new ATOM 0 HD2 HIS A 136 7.721 3.799 -3.806 1.00 0.00 H new ATOM 0 HE1 HIS A 136 11.552 4.580 -5.499 1.00 0.00 H new ATOM 0 HE2 HIS A 136 10.306 3.393 -3.587 1.00 0.00 H new TER 2092 HIS A 136