USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1075 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 90 TYR OH : rot 157:sc= 0.971 USER MOD Set 1.2: A 124 HIS : no HD1:sc= -1.5 K(o=-0.52,f=-5.1!) USER MOD Set 2.1: A 48 ASN : amide:sc=-0.00554 X(o=-0.0055,f=0.1) USER MOD Set 2.2: A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 1 VAL N :NH3+ -120:sc= -0.425 (180deg=-0.619) USER MOD Single : A 2 GLN : amide:sc= -1.08 X(o=-1.1,f=-0.74) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.29 USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.696 X(o=-0.7,f=-0.8) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.0335 X(o=-0.033,f=-0.033) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -1.32 K(o=-1.3,f=-5.6!) USER MOD Single : A 27 ASN : amide:sc= -0.106 K(o=-0.11,f=-2.2!) USER MOD Single : A 29 GLN : amide:sc= -0.0451 K(o=-0.045,f=-1.5!) USER MOD Single : A 31 MET CE :methyl 165:sc= 0 (180deg=-0.603) USER MOD Single : A 33 SER OG : rot 120:sc= -0.175 USER MOD Single : A 34 ASN : amide:sc= 0.257 K(o=0.26,f=-2.5!) USER MOD Single : A 36 MET CE :methyl -160:sc= -1.89 (180deg=-3.46!) USER MOD Single : A 39 GLN : amide:sc= -0.704 K(o=-0.7,f=-2.3) USER MOD Single : A 51 HIS : no HD1:sc= -2.38 K(o=-2.4,f=-0.54) USER MOD Single : A 53 GLN : amide:sc= -0.555 X(o=-0.55,f=-0.28) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 74 HIS : no HE2:sc= -0.303 K(o=-0.3,f=-1.4) USER MOD Single : A 76 THR OG1 : rot -160:sc= -0.687 USER MOD Single : A 77 SER OG : rot 39:sc= 1.22 USER MOD Single : A 84 SER OG : rot 109:sc= 1.29 USER MOD Single : A 91 THR OG1 : rot 87:sc= 0.479 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -2.87 K(o=-2.9,f=-4.8!) USER MOD Single : A 99 TYR OH : rot -130:sc= -0.894 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl 169:sc= -0.745 (180deg=-0.9) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -0.504 K(o=-0.5,f=-2.3) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc=-0.00262 K(o=-0.0026,f=-0.51) USER MOD Single : A 126 LYS NZ :NH3+ -165:sc= 0.231 (180deg=-0.159) USER MOD Single : A 131 SER OG : rot 99:sc= -1.6! USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 7.644 -16.465 8.081 1.00 0.00 N ATOM 2 CA VAL A 1 7.236 -15.092 7.810 1.00 0.00 C ATOM 3 C VAL A 1 8.447 -14.188 7.609 1.00 0.00 C ATOM 4 O VAL A 1 9.589 -14.625 7.748 1.00 0.00 O ATOM 5 CB VAL A 1 6.371 -14.527 8.954 1.00 0.00 C ATOM 6 CG1 VAL A 1 5.089 -15.333 9.102 1.00 0.00 C ATOM 7 CG2 VAL A 1 7.157 -14.514 10.257 1.00 0.00 C ATOM 0 H1 VAL A 1 7.258 -17.093 7.347 1.00 0.00 H new ATOM 0 H2 VAL A 1 8.682 -16.526 8.078 1.00 0.00 H new ATOM 0 H3 VAL A 1 7.283 -16.757 9.012 1.00 0.00 H new ATOM 0 HA VAL A 1 6.646 -15.112 6.894 1.00 0.00 H new ATOM 0 HB VAL A 1 6.099 -13.500 8.710 1.00 0.00 H new ATOM 0 HG11 VAL A 1 4.491 -14.920 9.914 1.00 0.00 H new ATOM 0 HG12 VAL A 1 4.521 -15.287 8.173 1.00 0.00 H new ATOM 0 HG13 VAL A 1 5.336 -16.371 9.325 1.00 0.00 H new ATOM 0 HG21 VAL A 1 6.532 -14.112 11.055 1.00 0.00 H new ATOM 0 HG22 VAL A 1 7.459 -15.530 10.510 1.00 0.00 H new ATOM 0 HG23 VAL A 1 8.043 -13.890 10.141 1.00 0.00 H new ATOM 17 N GLN A 2 8.189 -12.926 7.283 1.00 0.00 N ATOM 18 CA GLN A 2 9.258 -11.960 7.063 1.00 0.00 C ATOM 19 C GLN A 2 8.933 -10.625 7.727 1.00 0.00 C ATOM 20 O GLN A 2 7.885 -10.472 8.355 1.00 0.00 O ATOM 21 CB GLN A 2 9.489 -11.755 5.565 1.00 0.00 C ATOM 22 CG GLN A 2 8.203 -11.677 4.756 1.00 0.00 C ATOM 23 CD GLN A 2 7.672 -13.043 4.374 1.00 0.00 C ATOM 24 OE1 GLN A 2 8.285 -13.763 3.585 1.00 0.00 O ATOM 25 NE2 GLN A 2 6.523 -13.411 4.932 1.00 0.00 N ATOM 0 H GLN A 2 7.249 -12.549 7.165 1.00 0.00 H new ATOM 0 HA GLN A 2 10.168 -12.356 7.513 1.00 0.00 H new ATOM 0 HB2 GLN A 2 10.059 -10.838 5.416 1.00 0.00 H new ATOM 0 HB3 GLN A 2 10.099 -12.574 5.184 1.00 0.00 H new ATOM 0 HG2 GLN A 2 7.446 -11.146 5.333 1.00 0.00 H new ATOM 0 HG3 GLN A 2 8.381 -11.095 3.852 1.00 0.00 H new ATOM 0 HE21 GLN A 2 6.047 -12.784 5.581 1.00 0.00 H new ATOM 0 HE22 GLN A 2 6.117 -14.320 4.711 1.00 0.00 H new ATOM 34 N THR A 3 9.838 -9.663 7.584 1.00 0.00 N ATOM 35 CA THR A 3 9.648 -8.342 8.171 1.00 0.00 C ATOM 36 C THR A 3 10.391 -7.275 7.376 1.00 0.00 C ATOM 37 O THR A 3 11.556 -7.453 7.017 1.00 0.00 O ATOM 38 CB THR A 3 10.126 -8.304 9.634 1.00 0.00 C ATOM 39 OG1 THR A 3 9.850 -9.555 10.272 1.00 0.00 O ATOM 40 CG2 THR A 3 9.443 -7.178 10.397 1.00 0.00 C ATOM 0 H THR A 3 10.710 -9.773 7.067 1.00 0.00 H new ATOM 0 HA THR A 3 8.579 -8.133 8.141 1.00 0.00 H new ATOM 0 HB THR A 3 11.201 -8.124 9.638 1.00 0.00 H new ATOM 0 HG1 THR A 3 10.158 -9.523 11.202 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.796 -7.171 11.428 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.679 -6.224 9.926 1.00 0.00 H new ATOM 0 HG23 THR A 3 8.364 -7.332 10.384 1.00 0.00 H new ATOM 48 N VAL A 4 9.714 -6.164 7.106 1.00 0.00 N ATOM 49 CA VAL A 4 10.312 -5.067 6.354 1.00 0.00 C ATOM 50 C VAL A 4 11.646 -4.647 6.964 1.00 0.00 C ATOM 51 O VAL A 4 12.647 -4.517 6.261 1.00 0.00 O ATOM 52 CB VAL A 4 9.376 -3.844 6.304 1.00 0.00 C ATOM 53 CG1 VAL A 4 10.036 -2.697 5.555 1.00 0.00 C ATOM 54 CG2 VAL A 4 8.048 -4.218 5.663 1.00 0.00 C ATOM 0 H VAL A 4 8.750 -5.999 7.397 1.00 0.00 H new ATOM 0 HA VAL A 4 10.477 -5.431 5.340 1.00 0.00 H new ATOM 0 HB VAL A 4 9.181 -3.514 7.324 1.00 0.00 H new ATOM 0 HG11 VAL A 4 9.360 -1.842 5.530 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.959 -2.415 6.061 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.263 -3.010 4.536 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.398 -3.343 5.635 1.00 0.00 H new ATOM 0 HG22 VAL A 4 8.222 -4.573 4.647 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.571 -5.006 6.247 1.00 0.00 H new ATOM 64 N GLY A 5 11.650 -4.437 8.277 1.00 0.00 N ATOM 65 CA GLY A 5 12.866 -4.034 8.959 1.00 0.00 C ATOM 66 C GLY A 5 14.005 -5.009 8.737 1.00 0.00 C ATOM 67 O GLY A 5 15.148 -4.600 8.533 1.00 0.00 O ATOM 0 H GLY A 5 10.834 -4.539 8.880 1.00 0.00 H new ATOM 0 HA2 GLY A 5 13.164 -3.046 8.610 1.00 0.00 H new ATOM 0 HA3 GLY A 5 12.668 -3.948 10.027 1.00 0.00 H new ATOM 71 N GLN A 6 13.695 -6.301 8.779 1.00 0.00 N ATOM 72 CA GLN A 6 14.703 -7.335 8.583 1.00 0.00 C ATOM 73 C GLN A 6 15.279 -7.273 7.172 1.00 0.00 C ATOM 74 O GLN A 6 16.495 -7.225 6.991 1.00 0.00 O ATOM 75 CB GLN A 6 14.101 -8.718 8.840 1.00 0.00 C ATOM 76 CG GLN A 6 15.137 -9.829 8.904 1.00 0.00 C ATOM 77 CD GLN A 6 14.517 -11.209 8.814 1.00 0.00 C ATOM 78 OE1 GLN A 6 13.310 -11.374 8.993 1.00 0.00 O ATOM 79 NE2 GLN A 6 15.342 -12.212 8.534 1.00 0.00 N ATOM 0 H GLN A 6 12.754 -6.656 8.947 1.00 0.00 H new ATOM 0 HA GLN A 6 15.511 -7.160 9.294 1.00 0.00 H new ATOM 0 HB2 GLN A 6 13.546 -8.695 9.778 1.00 0.00 H new ATOM 0 HB3 GLN A 6 13.384 -8.946 8.051 1.00 0.00 H new ATOM 0 HG2 GLN A 6 15.852 -9.702 8.091 1.00 0.00 H new ATOM 0 HG3 GLN A 6 15.696 -9.746 9.836 1.00 0.00 H new ATOM 0 HE21 GLN A 6 16.336 -12.031 8.393 1.00 0.00 H new ATOM 0 HE22 GLN A 6 14.982 -13.163 8.460 1.00 0.00 H new ATOM 88 N TRP A 7 14.399 -7.275 6.179 1.00 0.00 N ATOM 89 CA TRP A 7 14.821 -7.219 4.784 1.00 0.00 C ATOM 90 C TRP A 7 15.585 -5.930 4.497 1.00 0.00 C ATOM 91 O TRP A 7 16.703 -5.962 3.980 1.00 0.00 O ATOM 92 CB TRP A 7 13.607 -7.323 3.857 1.00 0.00 C ATOM 93 CG TRP A 7 13.921 -6.991 2.429 1.00 0.00 C ATOM 94 CD1 TRP A 7 14.678 -7.727 1.564 1.00 0.00 C ATOM 95 CD2 TRP A 7 13.484 -5.837 1.702 1.00 0.00 C ATOM 96 NE1 TRP A 7 14.739 -7.101 0.343 1.00 0.00 N ATOM 97 CE2 TRP A 7 14.015 -5.940 0.402 1.00 0.00 C ATOM 98 CE3 TRP A 7 12.696 -4.730 2.023 1.00 0.00 C ATOM 99 CZ2 TRP A 7 13.782 -4.975 -0.574 1.00 0.00 C ATOM 100 CZ3 TRP A 7 12.466 -3.773 1.053 1.00 0.00 C ATOM 101 CH2 TRP A 7 13.006 -3.901 -0.233 1.00 0.00 C ATOM 0 H TRP A 7 13.389 -7.315 6.313 1.00 0.00 H new ATOM 0 HA TRP A 7 15.485 -8.063 4.598 1.00 0.00 H new ATOM 0 HB2 TRP A 7 13.206 -8.335 3.908 1.00 0.00 H new ATOM 0 HB3 TRP A 7 12.826 -6.652 4.216 1.00 0.00 H new ATOM 0 HD1 TRP A 7 15.158 -8.664 1.804 1.00 0.00 H new ATOM 0 HE1 TRP A 7 15.242 -7.445 -0.475 1.00 0.00 H new ATOM 0 HE3 TRP A 7 12.274 -4.624 3.011 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 14.199 -5.071 -1.566 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 11.859 -2.912 1.291 1.00 0.00 H new ATOM 0 HH2 TRP A 7 12.806 -3.137 -0.970 1.00 0.00 H new ATOM 112 N LEU A 8 14.976 -4.799 4.836 1.00 0.00 N ATOM 113 CA LEU A 8 15.601 -3.500 4.614 1.00 0.00 C ATOM 114 C LEU A 8 16.986 -3.446 5.251 1.00 0.00 C ATOM 115 O LEU A 8 17.940 -2.964 4.642 1.00 0.00 O ATOM 116 CB LEU A 8 14.721 -2.385 5.185 1.00 0.00 C ATOM 117 CG LEU A 8 14.696 -1.078 4.393 1.00 0.00 C ATOM 118 CD1 LEU A 8 13.327 -0.421 4.490 1.00 0.00 C ATOM 119 CD2 LEU A 8 15.780 -0.133 4.891 1.00 0.00 C ATOM 0 H LEU A 8 14.052 -4.755 5.265 1.00 0.00 H new ATOM 0 HA LEU A 8 15.710 -3.355 3.539 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.700 -2.759 5.263 1.00 0.00 H new ATOM 0 HB3 LEU A 8 15.058 -2.166 6.198 1.00 0.00 H new ATOM 0 HG LEU A 8 14.893 -1.306 3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 8 13.328 0.508 3.920 1.00 0.00 H new ATOM 0 HD12 LEU A 8 12.571 -1.094 4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.100 -0.206 5.534 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.748 0.793 4.316 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.613 0.089 5.945 1.00 0.00 H new ATOM 0 HD23 LEU A 8 16.756 -0.602 4.769 1.00 0.00 H new ATOM 131 N GLU A 9 17.087 -3.945 6.479 1.00 0.00 N ATOM 132 CA GLU A 9 18.356 -3.955 7.196 1.00 0.00 C ATOM 133 C GLU A 9 19.355 -4.892 6.524 1.00 0.00 C ATOM 134 O GLU A 9 20.554 -4.615 6.485 1.00 0.00 O ATOM 135 CB GLU A 9 18.142 -4.379 8.651 1.00 0.00 C ATOM 136 CG GLU A 9 17.721 -3.239 9.562 1.00 0.00 C ATOM 137 CD GLU A 9 18.282 -3.375 10.964 1.00 0.00 C ATOM 138 OE1 GLU A 9 19.500 -3.618 11.096 1.00 0.00 O ATOM 139 OE2 GLU A 9 17.503 -3.240 11.931 1.00 0.00 O ATOM 0 H GLU A 9 16.306 -4.347 6.997 1.00 0.00 H new ATOM 0 HA GLU A 9 18.763 -2.944 7.175 1.00 0.00 H new ATOM 0 HB2 GLU A 9 17.382 -5.160 8.685 1.00 0.00 H new ATOM 0 HB3 GLU A 9 19.065 -4.816 9.033 1.00 0.00 H new ATOM 0 HG2 GLU A 9 18.053 -2.294 9.132 1.00 0.00 H new ATOM 0 HG3 GLU A 9 16.633 -3.202 9.612 1.00 0.00 H new ATOM 146 N SER A 10 18.852 -6.002 5.995 1.00 0.00 N ATOM 147 CA SER A 10 19.699 -6.984 5.327 1.00 0.00 C ATOM 148 C SER A 10 20.310 -6.399 4.058 1.00 0.00 C ATOM 149 O SER A 10 21.473 -6.654 3.741 1.00 0.00 O ATOM 150 CB SER A 10 18.893 -8.238 4.988 1.00 0.00 C ATOM 151 OG SER A 10 19.742 -9.293 4.568 1.00 0.00 O ATOM 0 H SER A 10 17.861 -6.245 6.016 1.00 0.00 H new ATOM 0 HA SER A 10 20.507 -7.254 6.007 1.00 0.00 H new ATOM 0 HB2 SER A 10 18.321 -8.553 5.861 1.00 0.00 H new ATOM 0 HB3 SER A 10 18.174 -8.010 4.201 1.00 0.00 H new ATOM 0 HG SER A 10 19.202 -10.084 4.359 1.00 0.00 H new ATOM 157 N ILE A 11 19.519 -5.615 3.334 1.00 0.00 N ATOM 158 CA ILE A 11 19.981 -4.993 2.100 1.00 0.00 C ATOM 159 C ILE A 11 20.764 -3.716 2.387 1.00 0.00 C ATOM 160 O ILE A 11 21.604 -3.299 1.591 1.00 0.00 O ATOM 161 CB ILE A 11 18.806 -4.660 1.162 1.00 0.00 C ATOM 162 CG1 ILE A 11 17.861 -3.659 1.828 1.00 0.00 C ATOM 163 CG2 ILE A 11 18.057 -5.929 0.780 1.00 0.00 C ATOM 164 CD1 ILE A 11 16.795 -3.122 0.898 1.00 0.00 C ATOM 0 H ILE A 11 18.554 -5.395 3.581 1.00 0.00 H new ATOM 0 HA ILE A 11 20.634 -5.715 1.609 1.00 0.00 H new ATOM 0 HB ILE A 11 19.203 -4.207 0.253 1.00 0.00 H new ATOM 0 HG12 ILE A 11 17.380 -4.138 2.681 1.00 0.00 H new ATOM 0 HG13 ILE A 11 18.445 -2.825 2.218 1.00 0.00 H new ATOM 0 HG21 ILE A 11 17.229 -5.677 0.117 1.00 0.00 H new ATOM 0 HG22 ILE A 11 18.736 -6.613 0.270 1.00 0.00 H new ATOM 0 HG23 ILE A 11 17.669 -6.407 1.679 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.162 -2.418 1.438 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.268 -2.614 0.058 1.00 0.00 H new ATOM 0 HD13 ILE A 11 16.186 -3.947 0.527 1.00 0.00 H new ATOM 176 N GLY A 12 20.484 -3.101 3.533 1.00 0.00 N ATOM 177 CA GLY A 12 21.172 -1.879 3.906 1.00 0.00 C ATOM 178 C GLY A 12 21.237 -1.687 5.409 1.00 0.00 C ATOM 179 O GLY A 12 21.920 -2.437 6.109 1.00 0.00 O ATOM 0 H GLY A 12 19.793 -3.427 4.209 1.00 0.00 H new ATOM 0 HA2 GLY A 12 22.184 -1.897 3.501 1.00 0.00 H new ATOM 0 HA3 GLY A 12 20.663 -1.027 3.455 1.00 0.00 H new ATOM 183 N LEU A 13 20.529 -0.680 5.906 1.00 0.00 N ATOM 184 CA LEU A 13 20.509 -0.390 7.335 1.00 0.00 C ATOM 185 C LEU A 13 19.154 0.165 7.761 1.00 0.00 C ATOM 186 O LEU A 13 18.383 0.677 6.949 1.00 0.00 O ATOM 187 CB LEU A 13 21.616 0.606 7.688 1.00 0.00 C ATOM 188 CG LEU A 13 21.908 1.682 6.641 1.00 0.00 C ATOM 189 CD1 LEU A 13 22.361 2.970 7.312 1.00 0.00 C ATOM 190 CD2 LEU A 13 22.959 1.194 5.654 1.00 0.00 C ATOM 0 H LEU A 13 19.961 -0.050 5.340 1.00 0.00 H new ATOM 0 HA LEU A 13 20.682 -1.323 7.872 1.00 0.00 H new ATOM 0 HB2 LEU A 13 21.349 1.099 8.623 1.00 0.00 H new ATOM 0 HB3 LEU A 13 22.534 0.048 7.873 1.00 0.00 H new ATOM 0 HG LEU A 13 20.989 1.886 6.091 1.00 0.00 H new ATOM 0 HD11 LEU A 13 22.564 3.724 6.552 1.00 0.00 H new ATOM 0 HD12 LEU A 13 21.576 3.329 7.978 1.00 0.00 H new ATOM 0 HD13 LEU A 13 23.267 2.781 7.887 1.00 0.00 H new ATOM 0 HD21 LEU A 13 23.154 1.972 4.916 1.00 0.00 H new ATOM 0 HD22 LEU A 13 23.880 0.961 6.189 1.00 0.00 H new ATOM 0 HD23 LEU A 13 22.596 0.299 5.149 1.00 0.00 H new ATOM 202 N PRO A 14 18.857 0.066 9.066 1.00 0.00 N ATOM 203 CA PRO A 14 17.596 0.555 9.629 1.00 0.00 C ATOM 204 C PRO A 14 17.511 2.077 9.626 1.00 0.00 C ATOM 205 O PRO A 14 17.620 2.715 10.673 1.00 0.00 O ATOM 206 CB PRO A 14 17.618 0.024 11.064 1.00 0.00 C ATOM 207 CG PRO A 14 19.064 -0.146 11.382 1.00 0.00 C ATOM 208 CD PRO A 14 19.729 -0.533 10.090 1.00 0.00 C ATOM 0 HA PRO A 14 16.735 0.221 9.050 1.00 0.00 H new ATOM 0 HB2 PRO A 14 17.141 0.722 11.752 1.00 0.00 H new ATOM 0 HB3 PRO A 14 17.081 -0.921 11.145 1.00 0.00 H new ATOM 0 HG2 PRO A 14 19.488 0.777 11.778 1.00 0.00 H new ATOM 0 HG3 PRO A 14 19.209 -0.915 12.141 1.00 0.00 H new ATOM 0 HD2 PRO A 14 20.746 -0.145 10.029 1.00 0.00 H new ATOM 0 HD3 PRO A 14 19.794 -1.615 9.980 1.00 0.00 H new ATOM 216 N GLN A 15 17.315 2.652 8.443 1.00 0.00 N ATOM 217 CA GLN A 15 17.216 4.101 8.306 1.00 0.00 C ATOM 218 C GLN A 15 15.986 4.488 7.492 1.00 0.00 C ATOM 219 O GLN A 15 15.747 5.667 7.232 1.00 0.00 O ATOM 220 CB GLN A 15 18.477 4.658 7.642 1.00 0.00 C ATOM 221 CG GLN A 15 18.926 5.993 8.214 1.00 0.00 C ATOM 222 CD GLN A 15 18.132 7.161 7.663 1.00 0.00 C ATOM 223 OE1 GLN A 15 17.299 7.744 8.359 1.00 0.00 O ATOM 224 NE2 GLN A 15 18.386 7.509 6.408 1.00 0.00 N ATOM 0 H GLN A 15 17.222 2.138 7.567 1.00 0.00 H new ATOM 0 HA GLN A 15 17.119 4.530 9.303 1.00 0.00 H new ATOM 0 HB2 GLN A 15 19.285 3.935 7.752 1.00 0.00 H new ATOM 0 HB3 GLN A 15 18.295 4.773 6.573 1.00 0.00 H new ATOM 0 HG2 GLN A 15 18.827 5.971 9.299 1.00 0.00 H new ATOM 0 HG3 GLN A 15 19.983 6.141 7.994 1.00 0.00 H new ATOM 0 HE21 GLN A 15 19.085 6.998 5.868 1.00 0.00 H new ATOM 0 HE22 GLN A 15 17.883 8.288 5.983 1.00 0.00 H new ATOM 233 N TYR A 16 15.209 3.487 7.093 1.00 0.00 N ATOM 234 CA TYR A 16 14.004 3.722 6.306 1.00 0.00 C ATOM 235 C TYR A 16 12.854 2.845 6.793 1.00 0.00 C ATOM 236 O TYR A 16 11.810 2.757 6.149 1.00 0.00 O ATOM 237 CB TYR A 16 14.276 3.450 4.826 1.00 0.00 C ATOM 238 CG TYR A 16 15.558 4.071 4.321 1.00 0.00 C ATOM 239 CD1 TYR A 16 16.770 3.400 4.438 1.00 0.00 C ATOM 240 CD2 TYR A 16 15.559 5.328 3.727 1.00 0.00 C ATOM 241 CE1 TYR A 16 17.944 3.965 3.979 1.00 0.00 C ATOM 242 CE2 TYR A 16 16.729 5.898 3.264 1.00 0.00 C ATOM 243 CZ TYR A 16 17.919 5.213 3.392 1.00 0.00 C ATOM 244 OH TYR A 16 19.086 5.778 2.934 1.00 0.00 O ATOM 0 H TYR A 16 15.392 2.505 7.302 1.00 0.00 H new ATOM 0 HA TYR A 16 13.718 4.766 6.431 1.00 0.00 H new ATOM 0 HB2 TYR A 16 14.316 2.373 4.665 1.00 0.00 H new ATOM 0 HB3 TYR A 16 13.442 3.830 4.236 1.00 0.00 H new ATOM 0 HD1 TYR A 16 16.794 2.422 4.895 1.00 0.00 H new ATOM 0 HD2 TYR A 16 14.629 5.868 3.626 1.00 0.00 H new ATOM 0 HE1 TYR A 16 18.878 3.432 4.079 1.00 0.00 H new ATOM 0 HE2 TYR A 16 16.712 6.875 2.804 1.00 0.00 H new ATOM 0 HH TYR A 16 18.894 6.658 2.547 1.00 0.00 H new ATOM 254 N GLU A 17 13.056 2.197 7.936 1.00 0.00 N ATOM 255 CA GLU A 17 12.038 1.326 8.511 1.00 0.00 C ATOM 256 C GLU A 17 10.791 2.122 8.887 1.00 0.00 C ATOM 257 O GLU A 17 9.686 1.809 8.444 1.00 0.00 O ATOM 258 CB GLU A 17 12.588 0.606 9.745 1.00 0.00 C ATOM 259 CG GLU A 17 11.639 -0.436 10.313 1.00 0.00 C ATOM 260 CD GLU A 17 11.915 -0.740 11.773 1.00 0.00 C ATOM 261 OE1 GLU A 17 13.014 -0.390 12.254 1.00 0.00 O ATOM 262 OE2 GLU A 17 11.034 -1.329 12.434 1.00 0.00 O ATOM 0 H GLU A 17 13.915 2.259 8.482 1.00 0.00 H new ATOM 0 HA GLU A 17 11.763 0.586 7.760 1.00 0.00 H new ATOM 0 HB2 GLU A 17 13.530 0.124 9.484 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.810 1.343 10.517 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.613 -0.084 10.206 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.723 -1.354 9.732 1.00 0.00 H new ATOM 269 N ASN A 18 10.977 3.151 9.706 1.00 0.00 N ATOM 270 CA ASN A 18 9.868 3.991 10.143 1.00 0.00 C ATOM 271 C ASN A 18 9.129 4.582 8.946 1.00 0.00 C ATOM 272 O ASN A 18 7.902 4.509 8.863 1.00 0.00 O ATOM 273 CB ASN A 18 10.377 5.115 11.047 1.00 0.00 C ATOM 274 CG ASN A 18 11.104 4.590 12.270 1.00 0.00 C ATOM 275 OD1 ASN A 18 12.313 4.774 12.413 1.00 0.00 O ATOM 276 ND2 ASN A 18 10.368 3.931 13.158 1.00 0.00 N ATOM 0 H ASN A 18 11.886 3.424 10.081 1.00 0.00 H new ATOM 0 HA ASN A 18 9.173 3.368 10.706 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.047 5.759 10.478 1.00 0.00 H new ATOM 0 HB3 ASN A 18 9.536 5.731 11.365 1.00 0.00 H new ATOM 0 HD21 ASN A 18 10.802 3.553 14.000 1.00 0.00 H new ATOM 0 HD22 ASN A 18 9.369 3.803 12.998 1.00 0.00 H new ATOM 283 N HIS A 19 9.884 5.164 8.020 1.00 0.00 N ATOM 284 CA HIS A 19 9.301 5.766 6.826 1.00 0.00 C ATOM 285 C HIS A 19 8.429 4.760 6.080 1.00 0.00 C ATOM 286 O HIS A 19 7.234 4.984 5.883 1.00 0.00 O ATOM 287 CB HIS A 19 10.402 6.288 5.902 1.00 0.00 C ATOM 288 CG HIS A 19 10.601 7.770 5.984 1.00 0.00 C ATOM 289 ND1 HIS A 19 10.658 8.457 7.179 1.00 0.00 N ATOM 290 CD2 HIS A 19 10.757 8.697 5.010 1.00 0.00 C ATOM 291 CE1 HIS A 19 10.839 9.743 6.937 1.00 0.00 C ATOM 292 NE2 HIS A 19 10.903 9.916 5.628 1.00 0.00 N ATOM 0 H HIS A 19 10.900 5.232 8.073 1.00 0.00 H new ATOM 0 HA HIS A 19 8.674 6.601 7.140 1.00 0.00 H new ATOM 0 HB2 HIS A 19 11.339 5.790 6.150 1.00 0.00 H new ATOM 0 HB3 HIS A 19 10.160 6.019 4.874 1.00 0.00 H new ATOM 0 HD2 HIS A 19 10.765 8.513 3.946 1.00 0.00 H new ATOM 0 HE1 HIS A 19 10.921 10.521 7.682 1.00 0.00 H new ATOM 0 HE2 HIS A 19 11.039 10.809 5.154 1.00 0.00 H new ATOM 300 N LEU A 20 9.035 3.652 5.668 1.00 0.00 N ATOM 301 CA LEU A 20 8.314 2.612 4.944 1.00 0.00 C ATOM 302 C LEU A 20 7.031 2.227 5.674 1.00 0.00 C ATOM 303 O LEU A 20 5.934 2.352 5.129 1.00 0.00 O ATOM 304 CB LEU A 20 9.201 1.377 4.767 1.00 0.00 C ATOM 305 CG LEU A 20 9.793 1.170 3.372 1.00 0.00 C ATOM 306 CD1 LEU A 20 10.902 2.176 3.108 1.00 0.00 C ATOM 307 CD2 LEU A 20 10.312 -0.252 3.218 1.00 0.00 C ATOM 0 H LEU A 20 10.023 3.451 5.823 1.00 0.00 H new ATOM 0 HA LEU A 20 8.048 3.007 3.963 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.021 1.438 5.482 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.616 0.494 5.026 1.00 0.00 H new ATOM 0 HG LEU A 20 9.004 1.329 2.637 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.311 2.013 2.111 1.00 0.00 H new ATOM 0 HD12 LEU A 20 10.500 3.187 3.175 1.00 0.00 H new ATOM 0 HD13 LEU A 20 11.691 2.050 3.849 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.729 -0.381 2.219 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.086 -0.439 3.962 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.492 -0.956 3.362 1.00 0.00 H new ATOM 319 N MET A 21 7.175 1.764 6.911 1.00 0.00 N ATOM 320 CA MET A 21 6.027 1.366 7.718 1.00 0.00 C ATOM 321 C MET A 21 4.965 2.461 7.729 1.00 0.00 C ATOM 322 O MET A 21 3.817 2.228 7.355 1.00 0.00 O ATOM 323 CB MET A 21 6.467 1.051 9.148 1.00 0.00 C ATOM 324 CG MET A 21 5.341 0.537 10.030 1.00 0.00 C ATOM 325 SD MET A 21 5.657 0.801 11.785 1.00 0.00 S ATOM 326 CE MET A 21 6.622 -0.656 12.179 1.00 0.00 C ATOM 0 H MET A 21 8.076 1.655 7.377 1.00 0.00 H new ATOM 0 HA MET A 21 5.594 0.470 7.273 1.00 0.00 H new ATOM 0 HB2 MET A 21 7.263 0.307 9.119 1.00 0.00 H new ATOM 0 HB3 MET A 21 6.887 1.951 9.597 1.00 0.00 H new ATOM 0 HG2 MET A 21 4.412 1.035 9.753 1.00 0.00 H new ATOM 0 HG3 MET A 21 5.199 -0.528 9.847 1.00 0.00 H new ATOM 0 HE1 MET A 21 6.895 -0.637 13.234 1.00 0.00 H new ATOM 0 HE2 MET A 21 6.033 -1.549 11.972 1.00 0.00 H new ATOM 0 HE3 MET A 21 7.526 -0.669 11.571 1.00 0.00 H new ATOM 336 N ALA A 22 5.358 3.656 8.159 1.00 0.00 N ATOM 337 CA ALA A 22 4.440 4.787 8.217 1.00 0.00 C ATOM 338 C ALA A 22 3.839 5.076 6.847 1.00 0.00 C ATOM 339 O ALA A 22 2.768 5.672 6.742 1.00 0.00 O ATOM 340 CB ALA A 22 5.154 6.018 8.754 1.00 0.00 C ATOM 0 H ALA A 22 6.306 3.866 8.472 1.00 0.00 H new ATOM 0 HA ALA A 22 3.626 4.529 8.894 1.00 0.00 H new ATOM 0 HB1 ALA A 22 4.457 6.855 8.792 1.00 0.00 H new ATOM 0 HB2 ALA A 22 5.529 5.812 9.756 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.988 6.270 8.099 1.00 0.00 H new ATOM 346 N ASN A 23 4.536 4.652 5.798 1.00 0.00 N ATOM 347 CA ASN A 23 4.071 4.867 4.432 1.00 0.00 C ATOM 348 C ASN A 23 3.269 3.668 3.935 1.00 0.00 C ATOM 349 O ASN A 23 3.108 3.472 2.732 1.00 0.00 O ATOM 350 CB ASN A 23 5.257 5.123 3.501 1.00 0.00 C ATOM 351 CG ASN A 23 4.876 5.961 2.295 1.00 0.00 C ATOM 352 OD1 ASN A 23 3.857 5.713 1.652 1.00 0.00 O ATOM 353 ND2 ASN A 23 5.696 6.958 1.985 1.00 0.00 N ATOM 0 H ASN A 23 5.425 4.157 5.867 1.00 0.00 H new ATOM 0 HA ASN A 23 3.421 5.742 4.430 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.048 5.628 4.055 1.00 0.00 H new ATOM 0 HB3 ASN A 23 5.663 4.169 3.164 1.00 0.00 H new ATOM 0 HD21 ASN A 23 5.492 7.556 1.184 1.00 0.00 H new ATOM 0 HD22 ASN A 23 6.530 7.126 2.548 1.00 0.00 H new ATOM 360 N GLY A 24 2.770 2.867 4.872 1.00 0.00 N ATOM 361 CA GLY A 24 1.990 1.698 4.510 1.00 0.00 C ATOM 362 C GLY A 24 2.844 0.452 4.376 1.00 0.00 C ATOM 363 O GLY A 24 2.349 -0.666 4.519 1.00 0.00 O ATOM 0 H GLY A 24 2.892 3.007 5.875 1.00 0.00 H new ATOM 0 HA2 GLY A 24 1.222 1.529 5.265 1.00 0.00 H new ATOM 0 HA3 GLY A 24 1.475 1.886 3.568 1.00 0.00 H new ATOM 367 N PHE A 25 4.129 0.643 4.100 1.00 0.00 N ATOM 368 CA PHE A 25 5.053 -0.474 3.944 1.00 0.00 C ATOM 369 C PHE A 25 5.467 -1.031 5.303 1.00 0.00 C ATOM 370 O PHE A 25 6.614 -0.880 5.724 1.00 0.00 O ATOM 371 CB PHE A 25 6.291 -0.035 3.161 1.00 0.00 C ATOM 372 CG PHE A 25 6.214 -0.345 1.693 1.00 0.00 C ATOM 373 CD1 PHE A 25 6.342 -1.649 1.241 1.00 0.00 C ATOM 374 CD2 PHE A 25 6.016 0.666 0.767 1.00 0.00 C ATOM 375 CE1 PHE A 25 6.271 -1.938 -0.109 1.00 0.00 C ATOM 376 CE2 PHE A 25 5.943 0.382 -0.583 1.00 0.00 C ATOM 377 CZ PHE A 25 6.073 -0.922 -1.022 1.00 0.00 C ATOM 0 H PHE A 25 4.555 1.562 3.980 1.00 0.00 H new ATOM 0 HA PHE A 25 4.542 -1.261 3.389 1.00 0.00 H new ATOM 0 HB2 PHE A 25 6.431 1.038 3.291 1.00 0.00 H new ATOM 0 HB3 PHE A 25 7.169 -0.524 3.582 1.00 0.00 H new ATOM 0 HD1 PHE A 25 6.499 -2.448 1.951 1.00 0.00 H new ATOM 0 HD2 PHE A 25 5.918 1.687 1.104 1.00 0.00 H new ATOM 0 HE1 PHE A 25 6.370 -2.958 -0.449 1.00 0.00 H new ATOM 0 HE2 PHE A 25 5.784 1.179 -1.295 1.00 0.00 H new ATOM 0 HZ PHE A 25 6.020 -1.146 -2.077 1.00 0.00 H new ATOM 387 N ASP A 26 4.525 -1.672 5.985 1.00 0.00 N ATOM 388 CA ASP A 26 4.791 -2.252 7.297 1.00 0.00 C ATOM 389 C ASP A 26 4.953 -3.766 7.199 1.00 0.00 C ATOM 390 O ASP A 26 5.597 -4.387 8.044 1.00 0.00 O ATOM 391 CB ASP A 26 3.661 -1.909 8.268 1.00 0.00 C ATOM 392 CG ASP A 26 2.423 -2.753 8.038 1.00 0.00 C ATOM 393 OD1 ASP A 26 1.694 -2.485 7.059 1.00 0.00 O ATOM 394 OD2 ASP A 26 2.183 -3.684 8.836 1.00 0.00 O ATOM 0 H ASP A 26 3.570 -1.804 5.652 1.00 0.00 H new ATOM 0 HA ASP A 26 5.723 -1.829 7.672 1.00 0.00 H new ATOM 0 HB2 ASP A 26 4.009 -2.052 9.291 1.00 0.00 H new ATOM 0 HB3 ASP A 26 3.403 -0.855 8.163 1.00 0.00 H new ATOM 399 N ASN A 27 4.362 -4.353 6.164 1.00 0.00 N ATOM 400 CA ASN A 27 4.438 -5.795 5.957 1.00 0.00 C ATOM 401 C ASN A 27 5.066 -6.117 4.603 1.00 0.00 C ATOM 402 O ASN A 27 4.655 -5.582 3.574 1.00 0.00 O ATOM 403 CB ASN A 27 3.045 -6.420 6.048 1.00 0.00 C ATOM 404 CG ASN A 27 3.088 -7.864 6.510 1.00 0.00 C ATOM 405 OD1 ASN A 27 4.128 -8.358 6.943 1.00 0.00 O ATOM 406 ND2 ASN A 27 1.953 -8.546 6.420 1.00 0.00 N ATOM 0 H ASN A 27 3.825 -3.853 5.455 1.00 0.00 H new ATOM 0 HA ASN A 27 5.068 -6.217 6.740 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.433 -5.839 6.738 1.00 0.00 H new ATOM 0 HB3 ASN A 27 2.562 -6.368 5.072 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.919 -9.521 6.717 1.00 0.00 H new ATOM 0 HD22 ASN A 27 1.115 -8.095 6.054 1.00 0.00 H new ATOM 413 N VAL A 28 6.062 -6.998 4.613 1.00 0.00 N ATOM 414 CA VAL A 28 6.744 -7.394 3.388 1.00 0.00 C ATOM 415 C VAL A 28 5.769 -8.006 2.389 1.00 0.00 C ATOM 416 O VAL A 28 6.024 -8.017 1.185 1.00 0.00 O ATOM 417 CB VAL A 28 7.872 -8.404 3.674 1.00 0.00 C ATOM 418 CG1 VAL A 28 8.725 -8.618 2.433 1.00 0.00 C ATOM 419 CG2 VAL A 28 8.724 -7.932 4.842 1.00 0.00 C ATOM 0 H VAL A 28 6.414 -7.451 5.457 1.00 0.00 H new ATOM 0 HA VAL A 28 7.177 -6.490 2.961 1.00 0.00 H new ATOM 0 HB VAL A 28 7.422 -9.359 3.944 1.00 0.00 H new ATOM 0 HG11 VAL A 28 9.516 -9.334 2.654 1.00 0.00 H new ATOM 0 HG12 VAL A 28 8.102 -9.003 1.626 1.00 0.00 H new ATOM 0 HG13 VAL A 28 9.169 -7.670 2.128 1.00 0.00 H new ATOM 0 HG21 VAL A 28 9.516 -8.657 5.031 1.00 0.00 H new ATOM 0 HG22 VAL A 28 9.166 -6.965 4.602 1.00 0.00 H new ATOM 0 HG23 VAL A 28 8.101 -7.835 5.731 1.00 0.00 H new ATOM 429 N GLN A 29 4.652 -8.515 2.897 1.00 0.00 N ATOM 430 CA GLN A 29 3.637 -9.131 2.049 1.00 0.00 C ATOM 431 C GLN A 29 3.103 -8.131 1.028 1.00 0.00 C ATOM 432 O GLN A 29 2.563 -8.518 -0.009 1.00 0.00 O ATOM 433 CB GLN A 29 2.488 -9.671 2.902 1.00 0.00 C ATOM 434 CG GLN A 29 1.601 -10.664 2.168 1.00 0.00 C ATOM 435 CD GLN A 29 0.726 -11.470 3.108 1.00 0.00 C ATOM 436 OE1 GLN A 29 0.879 -11.402 4.328 1.00 0.00 O ATOM 437 NE2 GLN A 29 -0.198 -12.238 2.544 1.00 0.00 N ATOM 0 H GLN A 29 4.426 -8.513 3.892 1.00 0.00 H new ATOM 0 HA GLN A 29 4.100 -9.959 1.512 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.900 -10.151 3.790 1.00 0.00 H new ATOM 0 HB3 GLN A 29 1.878 -8.836 3.246 1.00 0.00 H new ATOM 0 HG2 GLN A 29 0.969 -10.127 1.460 1.00 0.00 H new ATOM 0 HG3 GLN A 29 2.225 -11.343 1.587 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -0.289 -12.264 1.528 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -0.817 -12.803 3.126 1.00 0.00 H new ATOM 446 N ALA A 30 3.257 -6.846 1.328 1.00 0.00 N ATOM 447 CA ALA A 30 2.792 -5.793 0.436 1.00 0.00 C ATOM 448 C ALA A 30 3.466 -5.891 -0.928 1.00 0.00 C ATOM 449 O ALA A 30 2.966 -5.357 -1.918 1.00 0.00 O ATOM 450 CB ALA A 30 3.045 -4.426 1.055 1.00 0.00 C ATOM 0 H ALA A 30 3.701 -6.510 2.183 1.00 0.00 H new ATOM 0 HA ALA A 30 1.719 -5.921 0.292 1.00 0.00 H new ATOM 0 HB1 ALA A 30 2.692 -3.649 0.377 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.511 -4.351 2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 30 4.113 -4.298 1.230 1.00 0.00 H new ATOM 456 N MET A 31 4.605 -6.573 -0.972 1.00 0.00 N ATOM 457 CA MET A 31 5.347 -6.741 -2.216 1.00 0.00 C ATOM 458 C MET A 31 4.942 -8.032 -2.922 1.00 0.00 C ATOM 459 O MET A 31 5.362 -8.292 -4.048 1.00 0.00 O ATOM 460 CB MET A 31 6.852 -6.748 -1.940 1.00 0.00 C ATOM 461 CG MET A 31 7.377 -5.426 -1.404 1.00 0.00 C ATOM 462 SD MET A 31 7.476 -5.396 0.396 1.00 0.00 S ATOM 463 CE MET A 31 9.109 -4.698 0.634 1.00 0.00 C ATOM 0 H MET A 31 5.034 -7.018 -0.161 1.00 0.00 H new ATOM 0 HA MET A 31 5.108 -5.901 -2.868 1.00 0.00 H new ATOM 0 HB2 MET A 31 7.078 -7.537 -1.223 1.00 0.00 H new ATOM 0 HB3 MET A 31 7.381 -6.993 -2.861 1.00 0.00 H new ATOM 0 HG2 MET A 31 8.366 -5.236 -1.822 1.00 0.00 H new ATOM 0 HG3 MET A 31 6.728 -4.618 -1.742 1.00 0.00 H new ATOM 0 HE1 MET A 31 9.217 -4.369 1.668 1.00 0.00 H new ATOM 0 HE2 MET A 31 9.863 -5.453 0.412 1.00 0.00 H new ATOM 0 HE3 MET A 31 9.241 -3.846 -0.033 1.00 0.00 H new ATOM 473 N GLY A 32 4.125 -8.837 -2.249 1.00 0.00 N ATOM 474 CA GLY A 32 3.679 -10.091 -2.828 1.00 0.00 C ATOM 475 C GLY A 32 3.078 -9.912 -4.208 1.00 0.00 C ATOM 476 O GLY A 32 2.340 -8.958 -4.452 1.00 0.00 O ATOM 0 H GLY A 32 3.765 -8.643 -1.315 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.522 -10.779 -2.889 1.00 0.00 H new ATOM 0 HA3 GLY A 32 2.940 -10.549 -2.170 1.00 0.00 H new ATOM 480 N SER A 33 3.396 -10.831 -5.114 1.00 0.00 N ATOM 481 CA SER A 33 2.886 -10.767 -6.479 1.00 0.00 C ATOM 482 C SER A 33 3.159 -9.399 -7.096 1.00 0.00 C ATOM 483 O SER A 33 2.379 -8.906 -7.910 1.00 0.00 O ATOM 484 CB SER A 33 1.384 -11.057 -6.499 1.00 0.00 C ATOM 485 OG SER A 33 1.038 -12.022 -5.521 1.00 0.00 O ATOM 0 H SER A 33 4.004 -11.628 -4.928 1.00 0.00 H new ATOM 0 HA SER A 33 3.403 -11.523 -7.070 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.830 -10.136 -6.317 1.00 0.00 H new ATOM 0 HB3 SER A 33 1.093 -11.415 -7.487 1.00 0.00 H new ATOM 0 HG SER A 33 0.397 -11.633 -4.890 1.00 0.00 H new ATOM 491 N ASN A 34 4.274 -8.791 -6.703 1.00 0.00 N ATOM 492 CA ASN A 34 4.651 -7.479 -7.218 1.00 0.00 C ATOM 493 C ASN A 34 6.090 -7.140 -6.841 1.00 0.00 C ATOM 494 O ASN A 34 6.780 -7.935 -6.202 1.00 0.00 O ATOM 495 CB ASN A 34 3.704 -6.405 -6.678 1.00 0.00 C ATOM 496 CG ASN A 34 3.492 -5.273 -7.664 1.00 0.00 C ATOM 497 OD1 ASN A 34 4.229 -4.287 -7.663 1.00 0.00 O ATOM 498 ND2 ASN A 34 2.479 -5.409 -8.512 1.00 0.00 N ATOM 0 H ASN A 34 4.932 -9.185 -6.030 1.00 0.00 H new ATOM 0 HA ASN A 34 4.576 -7.507 -8.305 1.00 0.00 H new ATOM 0 HB2 ASN A 34 2.743 -6.859 -6.438 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.107 -6.003 -5.749 1.00 0.00 H new ATOM 0 HD21 ASN A 34 2.287 -4.679 -9.198 1.00 0.00 H new ATOM 0 HD22 ASN A 34 1.893 -6.243 -8.477 1.00 0.00 H new ATOM 505 N VAL A 35 6.537 -5.954 -7.241 1.00 0.00 N ATOM 506 CA VAL A 35 7.894 -5.508 -6.944 1.00 0.00 C ATOM 507 C VAL A 35 7.948 -3.995 -6.767 1.00 0.00 C ATOM 508 O VAL A 35 7.444 -3.244 -7.601 1.00 0.00 O ATOM 509 CB VAL A 35 8.876 -5.920 -8.057 1.00 0.00 C ATOM 510 CG1 VAL A 35 9.163 -7.413 -7.990 1.00 0.00 C ATOM 511 CG2 VAL A 35 8.326 -5.535 -9.422 1.00 0.00 C ATOM 0 H VAL A 35 5.980 -5.284 -7.772 1.00 0.00 H new ATOM 0 HA VAL A 35 8.190 -5.990 -6.012 1.00 0.00 H new ATOM 0 HB VAL A 35 9.815 -5.387 -7.906 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.858 -7.686 -8.784 1.00 0.00 H new ATOM 0 HG12 VAL A 35 9.603 -7.656 -7.023 1.00 0.00 H new ATOM 0 HG13 VAL A 35 8.233 -7.968 -8.115 1.00 0.00 H new ATOM 0 HG21 VAL A 35 9.033 -5.833 -10.196 1.00 0.00 H new ATOM 0 HG22 VAL A 35 7.374 -6.039 -9.586 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.177 -4.456 -9.463 1.00 0.00 H new ATOM 521 N MET A 36 8.565 -3.555 -5.676 1.00 0.00 N ATOM 522 CA MET A 36 8.687 -2.130 -5.390 1.00 0.00 C ATOM 523 C MET A 36 9.275 -1.384 -6.584 1.00 0.00 C ATOM 524 O MET A 36 10.465 -1.502 -6.876 1.00 0.00 O ATOM 525 CB MET A 36 9.562 -1.908 -4.155 1.00 0.00 C ATOM 526 CG MET A 36 9.318 -0.575 -3.467 1.00 0.00 C ATOM 527 SD MET A 36 10.468 -0.270 -2.114 1.00 0.00 S ATOM 528 CE MET A 36 9.332 -0.021 -0.752 1.00 0.00 C ATOM 0 H MET A 36 8.988 -4.164 -4.976 1.00 0.00 H new ATOM 0 HA MET A 36 7.689 -1.738 -5.194 1.00 0.00 H new ATOM 0 HB2 MET A 36 9.381 -2.713 -3.443 1.00 0.00 H new ATOM 0 HB3 MET A 36 10.610 -1.970 -4.447 1.00 0.00 H new ATOM 0 HG2 MET A 36 9.404 0.228 -4.199 1.00 0.00 H new ATOM 0 HG3 MET A 36 8.298 -0.550 -3.084 1.00 0.00 H new ATOM 0 HE1 MET A 36 9.839 0.514 0.051 1.00 0.00 H new ATOM 0 HE2 MET A 36 8.477 0.562 -1.094 1.00 0.00 H new ATOM 0 HE3 MET A 36 8.989 -0.988 -0.383 1.00 0.00 H new ATOM 538 N GLU A 37 8.433 -0.618 -7.271 1.00 0.00 N ATOM 539 CA GLU A 37 8.870 0.145 -8.434 1.00 0.00 C ATOM 540 C GLU A 37 9.582 1.425 -8.008 1.00 0.00 C ATOM 541 O GLU A 37 9.403 1.906 -6.889 1.00 0.00 O ATOM 542 CB GLU A 37 7.676 0.485 -9.327 1.00 0.00 C ATOM 543 CG GLU A 37 6.884 -0.732 -9.776 1.00 0.00 C ATOM 544 CD GLU A 37 7.435 -1.348 -11.048 1.00 0.00 C ATOM 545 OE1 GLU A 37 8.530 -0.937 -11.481 1.00 0.00 O ATOM 546 OE2 GLU A 37 6.768 -2.243 -11.609 1.00 0.00 O ATOM 0 H GLU A 37 7.445 -0.510 -7.042 1.00 0.00 H new ATOM 0 HA GLU A 37 9.572 -0.470 -8.998 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.012 1.162 -8.789 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.032 1.021 -10.207 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.891 -1.479 -8.982 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.844 -0.446 -9.936 1.00 0.00 H new ATOM 553 N ASP A 38 10.393 1.972 -8.909 1.00 0.00 N ATOM 554 CA ASP A 38 11.132 3.197 -8.628 1.00 0.00 C ATOM 555 C ASP A 38 10.193 4.303 -8.155 1.00 0.00 C ATOM 556 O ASP A 38 10.490 5.013 -7.195 1.00 0.00 O ATOM 557 CB ASP A 38 11.893 3.656 -9.873 1.00 0.00 C ATOM 558 CG ASP A 38 10.971 3.954 -11.038 1.00 0.00 C ATOM 559 OD1 ASP A 38 10.561 2.999 -11.730 1.00 0.00 O ATOM 560 OD2 ASP A 38 10.660 5.143 -11.260 1.00 0.00 O ATOM 0 H ASP A 38 10.554 1.586 -9.839 1.00 0.00 H new ATOM 0 HA ASP A 38 11.846 2.986 -7.832 1.00 0.00 H new ATOM 0 HB2 ASP A 38 12.471 4.549 -9.633 1.00 0.00 H new ATOM 0 HB3 ASP A 38 12.605 2.884 -10.165 1.00 0.00 H new ATOM 565 N GLN A 39 9.061 4.442 -8.836 1.00 0.00 N ATOM 566 CA GLN A 39 8.080 5.462 -8.486 1.00 0.00 C ATOM 567 C GLN A 39 7.782 5.442 -6.991 1.00 0.00 C ATOM 568 O GLN A 39 7.921 6.456 -6.306 1.00 0.00 O ATOM 569 CB GLN A 39 6.788 5.250 -9.278 1.00 0.00 C ATOM 570 CG GLN A 39 6.455 3.787 -9.518 1.00 0.00 C ATOM 571 CD GLN A 39 4.999 3.466 -9.238 1.00 0.00 C ATOM 572 OE1 GLN A 39 4.492 3.732 -8.148 1.00 0.00 O ATOM 573 NE2 GLN A 39 4.319 2.892 -10.224 1.00 0.00 N ATOM 0 H GLN A 39 8.800 3.861 -9.633 1.00 0.00 H new ATOM 0 HA GLN A 39 8.499 6.435 -8.741 1.00 0.00 H new ATOM 0 HB2 GLN A 39 5.962 5.719 -8.743 1.00 0.00 H new ATOM 0 HB3 GLN A 39 6.873 5.757 -10.239 1.00 0.00 H new ATOM 0 HG2 GLN A 39 6.687 3.530 -10.552 1.00 0.00 H new ATOM 0 HG3 GLN A 39 7.088 3.166 -8.885 1.00 0.00 H new ATOM 0 HE21 GLN A 39 4.780 2.690 -11.111 1.00 0.00 H new ATOM 0 HE22 GLN A 39 3.336 2.654 -10.094 1.00 0.00 H new ATOM 582 N ASP A 40 7.373 4.281 -6.490 1.00 0.00 N ATOM 583 CA ASP A 40 7.057 4.129 -5.075 1.00 0.00 C ATOM 584 C ASP A 40 8.283 4.405 -4.211 1.00 0.00 C ATOM 585 O ASP A 40 8.223 5.187 -3.260 1.00 0.00 O ATOM 586 CB ASP A 40 6.531 2.720 -4.797 1.00 0.00 C ATOM 587 CG ASP A 40 5.566 2.241 -5.864 1.00 0.00 C ATOM 588 OD1 ASP A 40 4.379 2.628 -5.809 1.00 0.00 O ATOM 589 OD2 ASP A 40 5.997 1.481 -6.755 1.00 0.00 O ATOM 0 H ASP A 40 7.253 3.432 -7.043 1.00 0.00 H new ATOM 0 HA ASP A 40 6.285 4.855 -4.821 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.371 2.028 -4.734 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.033 2.706 -3.828 1.00 0.00 H new ATOM 594 N LEU A 41 9.396 3.760 -4.547 1.00 0.00 N ATOM 595 CA LEU A 41 10.636 3.937 -3.801 1.00 0.00 C ATOM 596 C LEU A 41 10.946 5.417 -3.600 1.00 0.00 C ATOM 597 O LEU A 41 11.166 5.868 -2.475 1.00 0.00 O ATOM 598 CB LEU A 41 11.795 3.257 -4.533 1.00 0.00 C ATOM 599 CG LEU A 41 13.143 3.264 -3.810 1.00 0.00 C ATOM 600 CD1 LEU A 41 12.976 2.823 -2.365 1.00 0.00 C ATOM 601 CD2 LEU A 41 14.139 2.368 -4.532 1.00 0.00 C ATOM 0 H LEU A 41 9.464 3.111 -5.331 1.00 0.00 H new ATOM 0 HA LEU A 41 10.510 3.475 -2.822 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.516 2.222 -4.730 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.922 3.742 -5.501 1.00 0.00 H new ATOM 0 HG LEU A 41 13.531 4.283 -3.814 1.00 0.00 H new ATOM 0 HD11 LEU A 41 13.945 2.834 -1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.297 3.505 -1.853 1.00 0.00 H new ATOM 0 HD13 LEU A 41 12.566 1.813 -2.338 1.00 0.00 H new ATOM 0 HD21 LEU A 41 15.093 2.385 -4.004 1.00 0.00 H new ATOM 0 HD22 LEU A 41 13.757 1.347 -4.559 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.282 2.729 -5.550 1.00 0.00 H new ATOM 613 N LEU A 42 10.959 6.167 -4.696 1.00 0.00 N ATOM 614 CA LEU A 42 11.240 7.598 -4.640 1.00 0.00 C ATOM 615 C LEU A 42 10.108 8.347 -3.944 1.00 0.00 C ATOM 616 O LEU A 42 10.331 9.384 -3.318 1.00 0.00 O ATOM 617 CB LEU A 42 11.442 8.153 -6.050 1.00 0.00 C ATOM 618 CG LEU A 42 12.422 9.320 -6.178 1.00 0.00 C ATOM 619 CD1 LEU A 42 11.897 10.541 -5.440 1.00 0.00 C ATOM 620 CD2 LEU A 42 13.794 8.924 -5.651 1.00 0.00 C ATOM 0 H LEU A 42 10.778 5.809 -5.634 1.00 0.00 H new ATOM 0 HA LEU A 42 12.155 7.742 -4.065 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.787 7.343 -6.692 1.00 0.00 H new ATOM 0 HB3 LEU A 42 10.474 8.474 -6.435 1.00 0.00 H new ATOM 0 HG LEU A 42 12.520 9.574 -7.234 1.00 0.00 H new ATOM 0 HD11 LEU A 42 12.608 11.361 -5.542 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.937 10.837 -5.863 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.769 10.301 -4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 42 14.479 9.766 -5.750 1.00 0.00 H new ATOM 0 HD22 LEU A 42 13.713 8.643 -4.601 1.00 0.00 H new ATOM 0 HD23 LEU A 42 14.174 8.078 -6.224 1.00 0.00 H new ATOM 632 N GLU A 43 8.895 7.813 -4.054 1.00 0.00 N ATOM 633 CA GLU A 43 7.730 8.432 -3.433 1.00 0.00 C ATOM 634 C GLU A 43 7.824 8.364 -1.911 1.00 0.00 C ATOM 635 O GLU A 43 7.327 9.245 -1.210 1.00 0.00 O ATOM 636 CB GLU A 43 6.447 7.745 -3.907 1.00 0.00 C ATOM 637 CG GLU A 43 5.181 8.501 -3.542 1.00 0.00 C ATOM 638 CD GLU A 43 4.007 8.137 -4.430 1.00 0.00 C ATOM 639 OE1 GLU A 43 3.856 8.759 -5.502 1.00 0.00 O ATOM 640 OE2 GLU A 43 3.238 7.227 -4.052 1.00 0.00 O ATOM 0 H GLU A 43 8.694 6.954 -4.567 1.00 0.00 H new ATOM 0 HA GLU A 43 7.704 9.480 -3.732 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.488 7.624 -4.989 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.400 6.745 -3.476 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.924 8.292 -2.503 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.368 9.572 -3.615 1.00 0.00 H new ATOM 647 N ILE A 44 8.463 7.314 -1.411 1.00 0.00 N ATOM 648 CA ILE A 44 8.623 7.131 0.026 1.00 0.00 C ATOM 649 C ILE A 44 9.463 8.249 0.633 1.00 0.00 C ATOM 650 O ILE A 44 8.940 9.146 1.293 1.00 0.00 O ATOM 651 CB ILE A 44 9.279 5.777 0.353 1.00 0.00 C ATOM 652 CG1 ILE A 44 8.398 4.627 -0.138 1.00 0.00 C ATOM 653 CG2 ILE A 44 9.532 5.657 1.849 1.00 0.00 C ATOM 654 CD1 ILE A 44 9.171 3.367 -0.458 1.00 0.00 C ATOM 0 H ILE A 44 8.879 6.576 -1.979 1.00 0.00 H new ATOM 0 HA ILE A 44 7.623 7.155 0.459 1.00 0.00 H new ATOM 0 HB ILE A 44 10.238 5.721 -0.163 1.00 0.00 H new ATOM 0 HG12 ILE A 44 7.651 4.402 0.623 1.00 0.00 H new ATOM 0 HG13 ILE A 44 7.858 4.948 -1.029 1.00 0.00 H new ATOM 0 HG21 ILE A 44 9.996 4.694 2.063 1.00 0.00 H new ATOM 0 HG22 ILE A 44 10.196 6.459 2.171 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.586 5.731 2.385 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.482 2.595 -0.800 1.00 0.00 H new ATOM 0 HD12 ILE A 44 9.900 3.576 -1.241 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.689 3.021 0.436 1.00 0.00 H new ATOM 666 N GLY A 45 10.772 8.192 0.402 1.00 0.00 N ATOM 667 CA GLY A 45 11.664 9.207 0.931 1.00 0.00 C ATOM 668 C GLY A 45 13.125 8.833 0.773 1.00 0.00 C ATOM 669 O GLY A 45 13.883 8.845 1.743 1.00 0.00 O ATOM 0 H GLY A 45 11.230 7.461 -0.142 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.477 10.152 0.422 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.444 9.365 1.987 1.00 0.00 H new ATOM 673 N ILE A 46 13.519 8.499 -0.450 1.00 0.00 N ATOM 674 CA ILE A 46 14.899 8.119 -0.729 1.00 0.00 C ATOM 675 C ILE A 46 15.580 9.145 -1.629 1.00 0.00 C ATOM 676 O ILE A 46 14.921 9.854 -2.391 1.00 0.00 O ATOM 677 CB ILE A 46 14.977 6.734 -1.399 1.00 0.00 C ATOM 678 CG1 ILE A 46 14.050 5.748 -0.689 1.00 0.00 C ATOM 679 CG2 ILE A 46 16.410 6.222 -1.391 1.00 0.00 C ATOM 680 CD1 ILE A 46 14.327 5.615 0.792 1.00 0.00 C ATOM 0 H ILE A 46 12.904 8.483 -1.263 1.00 0.00 H new ATOM 0 HA ILE A 46 15.416 8.080 0.230 1.00 0.00 H new ATOM 0 HB ILE A 46 14.651 6.829 -2.435 1.00 0.00 H new ATOM 0 HG12 ILE A 46 13.017 6.067 -0.830 1.00 0.00 H new ATOM 0 HG13 ILE A 46 14.147 4.769 -1.158 1.00 0.00 H new ATOM 0 HG21 ILE A 46 16.449 5.243 -1.868 1.00 0.00 H new ATOM 0 HG22 ILE A 46 17.048 6.917 -1.937 1.00 0.00 H new ATOM 0 HG23 ILE A 46 16.761 6.139 -0.362 1.00 0.00 H new ATOM 0 HD11 ILE A 46 13.631 4.899 1.229 1.00 0.00 H new ATOM 0 HD12 ILE A 46 15.349 5.266 0.941 1.00 0.00 H new ATOM 0 HD13 ILE A 46 14.201 6.584 1.274 1.00 0.00 H new ATOM 692 N LEU A 47 16.903 9.219 -1.538 1.00 0.00 N ATOM 693 CA LEU A 47 17.676 10.157 -2.345 1.00 0.00 C ATOM 694 C LEU A 47 17.681 9.737 -3.812 1.00 0.00 C ATOM 695 O LEU A 47 17.056 8.746 -4.186 1.00 0.00 O ATOM 696 CB LEU A 47 19.111 10.249 -1.823 1.00 0.00 C ATOM 697 CG LEU A 47 19.281 10.865 -0.435 1.00 0.00 C ATOM 698 CD1 LEU A 47 19.000 9.834 0.646 1.00 0.00 C ATOM 699 CD2 LEU A 47 20.682 11.439 -0.275 1.00 0.00 C ATOM 0 H LEU A 47 17.464 8.640 -0.913 1.00 0.00 H new ATOM 0 HA LEU A 47 17.206 11.137 -2.268 1.00 0.00 H new ATOM 0 HB2 LEU A 47 19.536 9.245 -1.808 1.00 0.00 H new ATOM 0 HB3 LEU A 47 19.698 10.833 -2.532 1.00 0.00 H new ATOM 0 HG LEU A 47 18.562 11.677 -0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 47 19.126 10.292 1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 47 17.978 9.470 0.544 1.00 0.00 H new ATOM 0 HD13 LEU A 47 19.694 9.000 0.543 1.00 0.00 H new ATOM 0 HD21 LEU A 47 20.786 11.874 0.719 1.00 0.00 H new ATOM 0 HD22 LEU A 47 21.417 10.645 -0.402 1.00 0.00 H new ATOM 0 HD23 LEU A 47 20.847 12.210 -1.027 1.00 0.00 H new ATOM 711 N ASN A 48 18.393 10.498 -4.637 1.00 0.00 N ATOM 712 CA ASN A 48 18.481 10.204 -6.062 1.00 0.00 C ATOM 713 C ASN A 48 19.154 8.855 -6.299 1.00 0.00 C ATOM 714 O ASN A 48 18.500 7.879 -6.666 1.00 0.00 O ATOM 715 CB ASN A 48 19.258 11.308 -6.784 1.00 0.00 C ATOM 716 CG ASN A 48 19.535 10.964 -8.235 1.00 0.00 C ATOM 717 OD1 ASN A 48 18.614 10.812 -9.036 1.00 0.00 O ATOM 718 ND2 ASN A 48 20.812 10.839 -8.580 1.00 0.00 N ATOM 0 H ASN A 48 18.917 11.322 -4.343 1.00 0.00 H new ATOM 0 HA ASN A 48 17.468 10.160 -6.462 1.00 0.00 H new ATOM 0 HB2 ASN A 48 18.692 12.238 -6.735 1.00 0.00 H new ATOM 0 HB3 ASN A 48 20.202 11.482 -6.268 1.00 0.00 H new ATOM 0 HD21 ASN A 48 21.060 10.608 -9.542 1.00 0.00 H new ATOM 0 HD22 ASN A 48 21.544 10.974 -7.883 1.00 0.00 H new ATOM 725 N SER A 49 20.465 8.808 -6.087 1.00 0.00 N ATOM 726 CA SER A 49 21.228 7.580 -6.279 1.00 0.00 C ATOM 727 C SER A 49 21.855 7.119 -4.967 1.00 0.00 C ATOM 728 O SER A 49 22.911 6.487 -4.958 1.00 0.00 O ATOM 729 CB SER A 49 22.318 7.792 -7.332 1.00 0.00 C ATOM 730 OG SER A 49 21.773 7.775 -8.640 1.00 0.00 O ATOM 0 H SER A 49 21.022 9.607 -5.782 1.00 0.00 H new ATOM 0 HA SER A 49 20.543 6.806 -6.625 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.818 8.744 -7.155 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.074 7.012 -7.239 1.00 0.00 H new ATOM 0 HG SER A 49 22.489 7.914 -9.295 1.00 0.00 H new ATOM 736 N GLY A 50 21.194 7.439 -3.858 1.00 0.00 N ATOM 737 CA GLY A 50 21.701 7.049 -2.555 1.00 0.00 C ATOM 738 C GLY A 50 21.373 5.610 -2.212 1.00 0.00 C ATOM 739 O GLY A 50 22.213 4.722 -2.360 1.00 0.00 O ATOM 0 H GLY A 50 20.318 7.961 -3.839 1.00 0.00 H new ATOM 0 HA2 GLY A 50 22.782 7.187 -2.533 1.00 0.00 H new ATOM 0 HA3 GLY A 50 21.280 7.706 -1.794 1.00 0.00 H new ATOM 743 N HIS A 51 20.148 5.377 -1.751 1.00 0.00 N ATOM 744 CA HIS A 51 19.712 4.035 -1.384 1.00 0.00 C ATOM 745 C HIS A 51 18.687 3.505 -2.383 1.00 0.00 C ATOM 746 O HIS A 51 18.303 2.336 -2.333 1.00 0.00 O ATOM 747 CB HIS A 51 19.116 4.036 0.024 1.00 0.00 C ATOM 748 CG HIS A 51 19.187 2.703 0.705 1.00 0.00 C ATOM 749 ND1 HIS A 51 20.376 2.062 0.981 1.00 0.00 N ATOM 750 CD2 HIS A 51 18.207 1.893 1.169 1.00 0.00 C ATOM 751 CE1 HIS A 51 20.125 0.913 1.583 1.00 0.00 C ATOM 752 NE2 HIS A 51 18.815 0.787 1.710 1.00 0.00 N ATOM 0 H HIS A 51 19.440 6.100 -1.623 1.00 0.00 H new ATOM 0 HA HIS A 51 20.583 3.380 -1.401 1.00 0.00 H new ATOM 0 HB2 HIS A 51 19.641 4.774 0.631 1.00 0.00 H new ATOM 0 HB3 HIS A 51 18.074 4.352 -0.031 1.00 0.00 H new ATOM 0 HD2 HIS A 51 17.145 2.081 1.122 1.00 0.00 H new ATOM 0 HE1 HIS A 51 20.864 0.199 1.915 1.00 0.00 H new ATOM 0 HE2 HIS A 51 18.334 -0.003 2.140 1.00 0.00 H new ATOM 760 N ARG A 52 18.247 4.373 -3.289 1.00 0.00 N ATOM 761 CA ARG A 52 17.265 3.993 -4.296 1.00 0.00 C ATOM 762 C ARG A 52 17.697 2.724 -5.025 1.00 0.00 C ATOM 763 O ARG A 52 17.029 1.694 -4.947 1.00 0.00 O ATOM 764 CB ARG A 52 17.069 5.129 -5.302 1.00 0.00 C ATOM 765 CG ARG A 52 15.762 5.042 -6.073 1.00 0.00 C ATOM 766 CD ARG A 52 15.689 6.094 -7.168 1.00 0.00 C ATOM 767 NE ARG A 52 15.690 5.497 -8.501 1.00 0.00 N ATOM 768 CZ ARG A 52 16.798 5.222 -9.183 1.00 0.00 C ATOM 769 NH1 ARG A 52 17.986 5.487 -8.658 1.00 0.00 N ATOM 770 NH2 ARG A 52 16.717 4.679 -10.390 1.00 0.00 N ATOM 0 H ARG A 52 18.555 5.344 -3.346 1.00 0.00 H new ATOM 0 HA ARG A 52 16.320 3.797 -3.790 1.00 0.00 H new ATOM 0 HB2 ARG A 52 17.106 6.081 -4.773 1.00 0.00 H new ATOM 0 HB3 ARG A 52 17.899 5.124 -6.009 1.00 0.00 H new ATOM 0 HG2 ARG A 52 15.664 4.050 -6.513 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.925 5.171 -5.387 1.00 0.00 H new ATOM 0 HD2 ARG A 52 14.786 6.690 -7.038 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.536 6.774 -7.075 1.00 0.00 H new ATOM 0 HE ARG A 52 14.792 5.279 -8.932 1.00 0.00 H new ATOM 0 HH11 ARG A 52 18.052 5.903 -7.729 1.00 0.00 H new ATOM 0 HH12 ARG A 52 18.834 5.275 -9.183 1.00 0.00 H new ATOM 0 HH21 ARG A 52 15.804 4.472 -10.796 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.567 4.468 -10.913 1.00 0.00 H new ATOM 784 N GLN A 53 18.818 2.808 -5.735 1.00 0.00 N ATOM 785 CA GLN A 53 19.338 1.667 -6.478 1.00 0.00 C ATOM 786 C GLN A 53 19.458 0.440 -5.579 1.00 0.00 C ATOM 787 O GLN A 53 19.198 -0.684 -6.010 1.00 0.00 O ATOM 788 CB GLN A 53 20.702 2.004 -7.084 1.00 0.00 C ATOM 789 CG GLN A 53 21.183 0.986 -8.106 1.00 0.00 C ATOM 790 CD GLN A 53 20.140 0.682 -9.162 1.00 0.00 C ATOM 791 OE1 GLN A 53 19.629 1.584 -9.825 1.00 0.00 O ATOM 792 NE2 GLN A 53 19.816 -0.596 -9.323 1.00 0.00 N ATOM 0 H GLN A 53 19.383 3.654 -5.811 1.00 0.00 H new ATOM 0 HA GLN A 53 18.637 1.440 -7.281 1.00 0.00 H new ATOM 0 HB2 GLN A 53 20.647 2.984 -7.558 1.00 0.00 H new ATOM 0 HB3 GLN A 53 21.438 2.078 -6.283 1.00 0.00 H new ATOM 0 HG2 GLN A 53 22.085 1.361 -8.589 1.00 0.00 H new ATOM 0 HG3 GLN A 53 21.455 0.063 -7.594 1.00 0.00 H new ATOM 0 HE21 GLN A 53 20.265 -1.312 -8.751 1.00 0.00 H new ATOM 0 HE22 GLN A 53 19.118 -0.862 -10.018 1.00 0.00 H new ATOM 801 N ARG A 54 19.851 0.664 -4.331 1.00 0.00 N ATOM 802 CA ARG A 54 20.006 -0.424 -3.372 1.00 0.00 C ATOM 803 C ARG A 54 18.706 -1.211 -3.227 1.00 0.00 C ATOM 804 O ARG A 54 18.651 -2.398 -3.548 1.00 0.00 O ATOM 805 CB ARG A 54 20.436 0.125 -2.011 1.00 0.00 C ATOM 806 CG ARG A 54 21.312 -0.830 -1.218 1.00 0.00 C ATOM 807 CD ARG A 54 22.696 -0.959 -1.835 1.00 0.00 C ATOM 808 NE ARG A 54 23.441 -2.086 -1.278 1.00 0.00 N ATOM 809 CZ ARG A 54 23.213 -3.352 -1.607 1.00 0.00 C ATOM 810 NH1 ARG A 54 22.264 -3.651 -2.484 1.00 0.00 N ATOM 811 NH2 ARG A 54 23.932 -4.321 -1.057 1.00 0.00 N ATOM 0 H ARG A 54 20.068 1.589 -3.959 1.00 0.00 H new ATOM 0 HA ARG A 54 20.778 -1.097 -3.746 1.00 0.00 H new ATOM 0 HB2 ARG A 54 20.975 1.060 -2.160 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.547 0.360 -1.426 1.00 0.00 H new ATOM 0 HG2 ARG A 54 21.402 -0.476 -0.191 1.00 0.00 H new ATOM 0 HG3 ARG A 54 20.838 -1.811 -1.176 1.00 0.00 H new ATOM 0 HD2 ARG A 54 22.602 -1.084 -2.914 1.00 0.00 H new ATOM 0 HD3 ARG A 54 23.254 -0.038 -1.669 1.00 0.00 H new ATOM 0 HE ARG A 54 24.177 -1.889 -0.599 1.00 0.00 H new ATOM 0 HH11 ARG A 54 21.708 -2.908 -2.907 1.00 0.00 H new ATOM 0 HH12 ARG A 54 22.090 -4.624 -2.736 1.00 0.00 H new ATOM 0 HH21 ARG A 54 24.661 -4.094 -0.381 1.00 0.00 H new ATOM 0 HH22 ARG A 54 23.756 -5.293 -1.310 1.00 0.00 H new ATOM 825 N ILE A 55 17.666 -0.541 -2.745 1.00 0.00 N ATOM 826 CA ILE A 55 16.368 -1.178 -2.559 1.00 0.00 C ATOM 827 C ILE A 55 15.826 -1.716 -3.878 1.00 0.00 C ATOM 828 O ILE A 55 15.161 -2.753 -3.912 1.00 0.00 O ATOM 829 CB ILE A 55 15.342 -0.199 -1.957 1.00 0.00 C ATOM 830 CG1 ILE A 55 15.818 0.295 -0.589 1.00 0.00 C ATOM 831 CG2 ILE A 55 13.980 -0.866 -1.840 1.00 0.00 C ATOM 832 CD1 ILE A 55 14.911 1.338 0.026 1.00 0.00 C ATOM 0 H ILE A 55 17.696 0.442 -2.476 1.00 0.00 H new ATOM 0 HA ILE A 55 16.519 -2.006 -1.866 1.00 0.00 H new ATOM 0 HB ILE A 55 15.249 0.661 -2.621 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.893 -0.555 0.089 1.00 0.00 H new ATOM 0 HG13 ILE A 55 16.820 0.711 -0.691 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.266 -0.162 -1.413 1.00 0.00 H new ATOM 0 HG22 ILE A 55 13.640 -1.174 -2.829 1.00 0.00 H new ATOM 0 HG23 ILE A 55 14.058 -1.741 -1.194 1.00 0.00 H new ATOM 0 HD11 ILE A 55 15.310 1.642 0.994 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.855 2.205 -0.632 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.914 0.919 0.160 1.00 0.00 H new ATOM 844 N LEU A 56 16.116 -1.008 -4.964 1.00 0.00 N ATOM 845 CA LEU A 56 15.660 -1.415 -6.289 1.00 0.00 C ATOM 846 C LEU A 56 16.235 -2.777 -6.667 1.00 0.00 C ATOM 847 O LEU A 56 15.495 -3.745 -6.841 1.00 0.00 O ATOM 848 CB LEU A 56 16.063 -0.371 -7.332 1.00 0.00 C ATOM 849 CG LEU A 56 15.005 0.681 -7.672 1.00 0.00 C ATOM 850 CD1 LEU A 56 15.550 1.678 -8.682 1.00 0.00 C ATOM 851 CD2 LEU A 56 13.744 0.015 -8.203 1.00 0.00 C ATOM 0 H LEU A 56 16.665 -0.149 -4.953 1.00 0.00 H new ATOM 0 HA LEU A 56 14.573 -1.494 -6.265 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.956 0.143 -6.977 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.338 -0.891 -8.250 1.00 0.00 H new ATOM 0 HG LEU A 56 14.750 1.222 -6.761 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.784 2.419 -8.912 1.00 0.00 H new ATOM 0 HD12 LEU A 56 16.424 2.178 -8.265 1.00 0.00 H new ATOM 0 HD13 LEU A 56 15.833 1.154 -9.595 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.002 0.777 -8.440 1.00 0.00 H new ATOM 0 HD22 LEU A 56 13.983 -0.551 -9.103 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.343 -0.659 -7.447 1.00 0.00 H new ATOM 863 N GLN A 57 17.556 -2.841 -6.791 1.00 0.00 N ATOM 864 CA GLN A 57 18.228 -4.085 -7.148 1.00 0.00 C ATOM 865 C GLN A 57 17.903 -5.188 -6.146 1.00 0.00 C ATOM 866 O GLN A 57 17.799 -6.359 -6.508 1.00 0.00 O ATOM 867 CB GLN A 57 19.742 -3.871 -7.213 1.00 0.00 C ATOM 868 CG GLN A 57 20.519 -5.127 -7.574 1.00 0.00 C ATOM 869 CD GLN A 57 21.914 -4.823 -8.085 1.00 0.00 C ATOM 870 OE1 GLN A 57 22.824 -4.534 -7.307 1.00 0.00 O ATOM 871 NE2 GLN A 57 22.089 -4.886 -9.400 1.00 0.00 N ATOM 0 H GLN A 57 18.182 -2.048 -6.650 1.00 0.00 H new ATOM 0 HA GLN A 57 17.868 -4.393 -8.130 1.00 0.00 H new ATOM 0 HB2 GLN A 57 19.960 -3.095 -7.947 1.00 0.00 H new ATOM 0 HB3 GLN A 57 20.090 -3.503 -6.248 1.00 0.00 H new ATOM 0 HG2 GLN A 57 20.590 -5.771 -6.697 1.00 0.00 H new ATOM 0 HG3 GLN A 57 19.971 -5.683 -8.334 1.00 0.00 H new ATOM 0 HE21 GLN A 57 21.307 -5.130 -10.008 1.00 0.00 H new ATOM 0 HE22 GLN A 57 23.006 -4.691 -9.802 1.00 0.00 H new ATOM 880 N ALA A 58 17.742 -4.804 -4.883 1.00 0.00 N ATOM 881 CA ALA A 58 17.425 -5.760 -3.830 1.00 0.00 C ATOM 882 C ALA A 58 16.036 -6.355 -4.026 1.00 0.00 C ATOM 883 O ALA A 58 15.896 -7.534 -4.351 1.00 0.00 O ATOM 884 CB ALA A 58 17.527 -5.093 -2.465 1.00 0.00 C ATOM 0 H ALA A 58 17.826 -3.838 -4.565 1.00 0.00 H new ATOM 0 HA ALA A 58 18.149 -6.573 -3.882 1.00 0.00 H new ATOM 0 HB1 ALA A 58 17.288 -5.818 -1.687 1.00 0.00 H new ATOM 0 HB2 ALA A 58 18.541 -4.722 -2.316 1.00 0.00 H new ATOM 0 HB3 ALA A 58 16.825 -4.261 -2.413 1.00 0.00 H new ATOM 890 N ILE A 59 15.011 -5.533 -3.829 1.00 0.00 N ATOM 891 CA ILE A 59 13.632 -5.979 -3.986 1.00 0.00 C ATOM 892 C ILE A 59 13.421 -6.644 -5.341 1.00 0.00 C ATOM 893 O ILE A 59 12.569 -7.520 -5.487 1.00 0.00 O ATOM 894 CB ILE A 59 12.643 -4.808 -3.841 1.00 0.00 C ATOM 895 CG1 ILE A 59 11.217 -5.336 -3.670 1.00 0.00 C ATOM 896 CG2 ILE A 59 12.730 -3.887 -5.048 1.00 0.00 C ATOM 897 CD1 ILE A 59 10.891 -5.751 -2.253 1.00 0.00 C ATOM 0 H ILE A 59 15.109 -4.554 -3.560 1.00 0.00 H new ATOM 0 HA ILE A 59 13.442 -6.704 -3.195 1.00 0.00 H new ATOM 0 HB ILE A 59 12.909 -4.236 -2.952 1.00 0.00 H new ATOM 0 HG12 ILE A 59 10.513 -4.566 -3.985 1.00 0.00 H new ATOM 0 HG13 ILE A 59 11.073 -6.190 -4.332 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.025 -3.065 -4.930 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.741 -3.489 -5.130 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.487 -4.447 -5.951 1.00 0.00 H new ATOM 0 HD11 ILE A 59 9.864 -6.115 -2.207 1.00 0.00 H new ATOM 0 HD12 ILE A 59 11.571 -6.544 -1.940 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.002 -4.894 -1.588 1.00 0.00 H new ATOM 909 N GLN A 60 14.203 -6.222 -6.330 1.00 0.00 N ATOM 910 CA GLN A 60 14.102 -6.778 -7.673 1.00 0.00 C ATOM 911 C GLN A 60 14.814 -8.124 -7.761 1.00 0.00 C ATOM 912 O GLN A 60 14.399 -9.012 -8.507 1.00 0.00 O ATOM 913 CB GLN A 60 14.694 -5.808 -8.697 1.00 0.00 C ATOM 914 CG GLN A 60 14.519 -6.260 -10.137 1.00 0.00 C ATOM 915 CD GLN A 60 13.152 -5.919 -10.694 1.00 0.00 C ATOM 916 OE1 GLN A 60 12.874 -4.767 -11.030 1.00 0.00 O ATOM 917 NE2 GLN A 60 12.287 -6.922 -10.797 1.00 0.00 N ATOM 0 H GLN A 60 14.913 -5.497 -6.226 1.00 0.00 H new ATOM 0 HA GLN A 60 13.046 -6.930 -7.896 1.00 0.00 H new ATOM 0 HB2 GLN A 60 14.226 -4.831 -8.572 1.00 0.00 H new ATOM 0 HB3 GLN A 60 15.757 -5.681 -8.492 1.00 0.00 H new ATOM 0 HG2 GLN A 60 15.286 -5.794 -10.756 1.00 0.00 H new ATOM 0 HG3 GLN A 60 14.673 -7.337 -10.197 1.00 0.00 H new ATOM 0 HE21 GLN A 60 12.559 -7.861 -10.507 1.00 0.00 H new ATOM 0 HE22 GLN A 60 11.351 -6.753 -11.166 1.00 0.00 H new ATOM 926 N LEU A 61 15.890 -8.270 -6.994 1.00 0.00 N ATOM 927 CA LEU A 61 16.661 -9.507 -6.985 1.00 0.00 C ATOM 928 C LEU A 61 15.993 -10.559 -6.104 1.00 0.00 C ATOM 929 O LEU A 61 16.249 -11.755 -6.246 1.00 0.00 O ATOM 930 CB LEU A 61 18.084 -9.241 -6.491 1.00 0.00 C ATOM 931 CG LEU A 61 19.077 -8.740 -7.541 1.00 0.00 C ATOM 932 CD1 LEU A 61 20.395 -8.354 -6.889 1.00 0.00 C ATOM 933 CD2 LEU A 61 19.299 -9.797 -8.612 1.00 0.00 C ATOM 0 H LEU A 61 16.247 -7.546 -6.371 1.00 0.00 H new ATOM 0 HA LEU A 61 16.702 -9.887 -8.006 1.00 0.00 H new ATOM 0 HB2 LEU A 61 18.036 -8.508 -5.686 1.00 0.00 H new ATOM 0 HB3 LEU A 61 18.476 -10.162 -6.060 1.00 0.00 H new ATOM 0 HG LEU A 61 18.657 -7.853 -8.016 1.00 0.00 H new ATOM 0 HD11 LEU A 61 21.088 -8.000 -7.652 1.00 0.00 H new ATOM 0 HD12 LEU A 61 20.222 -7.562 -6.160 1.00 0.00 H new ATOM 0 HD13 LEU A 61 20.821 -9.223 -6.387 1.00 0.00 H new ATOM 0 HD21 LEU A 61 20.008 -9.423 -9.351 1.00 0.00 H new ATOM 0 HD22 LEU A 61 19.696 -10.702 -8.153 1.00 0.00 H new ATOM 0 HD23 LEU A 61 18.352 -10.024 -9.101 1.00 0.00 H new ATOM 945 N LEU A 62 15.135 -10.104 -5.197 1.00 0.00 N ATOM 946 CA LEU A 62 14.428 -11.006 -4.295 1.00 0.00 C ATOM 947 C LEU A 62 13.804 -12.167 -5.062 1.00 0.00 C ATOM 948 O LEU A 62 12.819 -12.008 -5.785 1.00 0.00 O ATOM 949 CB LEU A 62 13.344 -10.245 -3.529 1.00 0.00 C ATOM 950 CG LEU A 62 13.836 -9.294 -2.437 1.00 0.00 C ATOM 951 CD1 LEU A 62 12.660 -8.662 -1.710 1.00 0.00 C ATOM 952 CD2 LEU A 62 14.739 -10.028 -1.457 1.00 0.00 C ATOM 0 H LEU A 62 14.913 -9.117 -5.067 1.00 0.00 H new ATOM 0 HA LEU A 62 15.151 -11.411 -3.586 1.00 0.00 H new ATOM 0 HB2 LEU A 62 12.756 -9.671 -4.245 1.00 0.00 H new ATOM 0 HB3 LEU A 62 12.671 -10.972 -3.074 1.00 0.00 H new ATOM 0 HG LEU A 62 14.415 -8.500 -2.908 1.00 0.00 H new ATOM 0 HD11 LEU A 62 13.030 -7.989 -0.937 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.052 -8.101 -2.420 1.00 0.00 H new ATOM 0 HD13 LEU A 62 12.053 -9.443 -1.251 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.079 -9.335 -0.687 1.00 0.00 H new ATOM 0 HD22 LEU A 62 14.185 -10.843 -0.992 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.601 -10.432 -1.989 1.00 0.00 H new ATOM 964 N PRO A 63 14.388 -13.364 -4.905 1.00 0.00 N ATOM 965 CA PRO A 63 13.904 -14.575 -5.573 1.00 0.00 C ATOM 966 C PRO A 63 12.564 -15.047 -5.020 1.00 0.00 C ATOM 967 O PRO A 63 11.922 -14.346 -4.237 1.00 0.00 O ATOM 968 CB PRO A 63 14.998 -15.605 -5.275 1.00 0.00 C ATOM 969 CG PRO A 63 15.634 -15.128 -4.016 1.00 0.00 C ATOM 970 CD PRO A 63 15.565 -13.627 -4.059 1.00 0.00 C ATOM 0 HA PRO A 63 13.730 -14.412 -6.637 1.00 0.00 H new ATOM 0 HB2 PRO A 63 14.579 -16.604 -5.153 1.00 0.00 H new ATOM 0 HB3 PRO A 63 15.722 -15.660 -6.088 1.00 0.00 H new ATOM 0 HG2 PRO A 63 15.111 -15.518 -3.143 1.00 0.00 H new ATOM 0 HG3 PRO A 63 16.667 -15.469 -3.947 1.00 0.00 H new ATOM 0 HD2 PRO A 63 15.447 -13.201 -3.063 1.00 0.00 H new ATOM 0 HD3 PRO A 63 16.471 -13.195 -4.485 1.00 0.00 H new ATOM 978 N LYS A 64 12.146 -16.239 -5.429 1.00 0.00 N ATOM 979 CA LYS A 64 10.883 -16.807 -4.974 1.00 0.00 C ATOM 980 C LYS A 64 11.027 -18.298 -4.689 1.00 0.00 C ATOM 981 O LYS A 64 11.275 -19.091 -5.598 1.00 0.00 O ATOM 982 CB LYS A 64 9.790 -16.580 -6.022 1.00 0.00 C ATOM 983 CG LYS A 64 10.217 -16.946 -7.434 1.00 0.00 C ATOM 984 CD LYS A 64 9.113 -16.663 -8.440 1.00 0.00 C ATOM 985 CE LYS A 64 9.483 -17.165 -9.828 1.00 0.00 C ATOM 986 NZ LYS A 64 10.251 -16.147 -10.599 1.00 0.00 N ATOM 0 H LYS A 64 12.665 -16.832 -6.077 1.00 0.00 H new ATOM 0 HA LYS A 64 10.601 -16.304 -4.049 1.00 0.00 H new ATOM 0 HB2 LYS A 64 8.912 -17.168 -5.753 1.00 0.00 H new ATOM 0 HB3 LYS A 64 9.491 -15.532 -6.002 1.00 0.00 H new ATOM 0 HG2 LYS A 64 11.110 -16.382 -7.703 1.00 0.00 H new ATOM 0 HG3 LYS A 64 10.484 -18.002 -7.472 1.00 0.00 H new ATOM 0 HD2 LYS A 64 8.190 -17.141 -8.113 1.00 0.00 H new ATOM 0 HD3 LYS A 64 8.920 -15.591 -8.479 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.075 -18.076 -9.739 1.00 0.00 H new ATOM 0 HE3 LYS A 64 8.576 -17.426 -10.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 10.484 -16.527 -11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 9.677 -15.287 -10.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 11.129 -15.916 -10.091 1.00 0.00 H new ATOM 1000 N MET A 65 10.867 -18.673 -3.425 1.00 0.00 N ATOM 1001 CA MET A 65 10.977 -20.070 -3.023 1.00 0.00 C ATOM 1002 C MET A 65 9.601 -20.724 -2.950 1.00 0.00 C ATOM 1003 O MET A 65 9.443 -21.897 -3.291 1.00 0.00 O ATOM 1004 CB MET A 65 11.679 -20.179 -1.667 1.00 0.00 C ATOM 1005 CG MET A 65 13.191 -20.061 -1.754 1.00 0.00 C ATOM 1006 SD MET A 65 14.000 -20.299 -0.160 1.00 0.00 S ATOM 1007 CE MET A 65 14.881 -21.831 -0.453 1.00 0.00 C ATOM 0 H MET A 65 10.661 -18.029 -2.661 1.00 0.00 H new ATOM 0 HA MET A 65 11.569 -20.593 -3.774 1.00 0.00 H new ATOM 0 HB2 MET A 65 11.299 -19.399 -1.007 1.00 0.00 H new ATOM 0 HB3 MET A 65 11.423 -21.135 -1.211 1.00 0.00 H new ATOM 0 HG2 MET A 65 13.569 -20.798 -2.462 1.00 0.00 H new ATOM 0 HG3 MET A 65 13.453 -19.078 -2.147 1.00 0.00 H new ATOM 0 HE1 MET A 65 15.432 -22.111 0.445 1.00 0.00 H new ATOM 0 HE2 MET A 65 14.169 -22.618 -0.702 1.00 0.00 H new ATOM 0 HE3 MET A 65 15.578 -21.697 -1.280 1.00 0.00 H new ATOM 1017 N ARG A 66 8.609 -19.960 -2.504 1.00 0.00 N ATOM 1018 CA ARG A 66 7.248 -20.468 -2.385 1.00 0.00 C ATOM 1019 C ARG A 66 6.233 -19.333 -2.500 1.00 0.00 C ATOM 1020 O ARG A 66 5.585 -18.947 -1.528 1.00 0.00 O ATOM 1021 CB ARG A 66 7.066 -21.196 -1.053 1.00 0.00 C ATOM 1022 CG ARG A 66 5.999 -22.279 -1.091 1.00 0.00 C ATOM 1023 CD ARG A 66 4.602 -21.688 -0.984 1.00 0.00 C ATOM 1024 NE ARG A 66 4.427 -20.913 0.242 1.00 0.00 N ATOM 1025 CZ ARG A 66 3.356 -20.168 0.493 1.00 0.00 C ATOM 1026 NH1 ARG A 66 2.372 -20.095 -0.391 1.00 0.00 N ATOM 1027 NH2 ARG A 66 3.270 -19.492 1.632 1.00 0.00 N ATOM 0 H ARG A 66 8.723 -18.987 -2.219 1.00 0.00 H new ATOM 0 HA ARG A 66 7.077 -21.171 -3.200 1.00 0.00 H new ATOM 0 HB2 ARG A 66 8.016 -21.644 -0.761 1.00 0.00 H new ATOM 0 HB3 ARG A 66 6.806 -20.469 -0.284 1.00 0.00 H new ATOM 0 HG2 ARG A 66 6.086 -22.845 -2.019 1.00 0.00 H new ATOM 0 HG3 ARG A 66 6.162 -22.981 -0.273 1.00 0.00 H new ATOM 0 HD2 ARG A 66 4.412 -21.049 -1.847 1.00 0.00 H new ATOM 0 HD3 ARG A 66 3.866 -22.491 -1.013 1.00 0.00 H new ATOM 0 HE ARG A 66 5.167 -20.946 0.943 1.00 0.00 H new ATOM 0 HH11 ARG A 66 2.435 -20.612 -1.268 1.00 0.00 H new ATOM 0 HH12 ARG A 66 1.551 -19.522 -0.195 1.00 0.00 H new ATOM 0 HH21 ARG A 66 4.026 -19.544 2.315 1.00 0.00 H new ATOM 0 HH22 ARG A 66 2.448 -18.920 1.825 1.00 0.00 H new ATOM 1041 N PRO A 67 6.093 -18.785 -3.715 1.00 0.00 N ATOM 1042 CA PRO A 67 5.160 -17.687 -3.987 1.00 0.00 C ATOM 1043 C PRO A 67 3.704 -18.133 -3.912 1.00 0.00 C ATOM 1044 O PRO A 67 3.414 -19.291 -3.613 1.00 0.00 O ATOM 1045 CB PRO A 67 5.517 -17.262 -5.413 1.00 0.00 C ATOM 1046 CG PRO A 67 6.119 -18.477 -6.031 1.00 0.00 C ATOM 1047 CD PRO A 67 6.835 -19.194 -4.921 1.00 0.00 C ATOM 0 HA PRO A 67 5.250 -16.885 -3.255 1.00 0.00 H new ATOM 0 HB2 PRO A 67 4.634 -16.935 -5.962 1.00 0.00 H new ATOM 0 HB3 PRO A 67 6.219 -16.428 -5.414 1.00 0.00 H new ATOM 0 HG2 PRO A 67 5.351 -19.111 -6.474 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.809 -18.207 -6.830 1.00 0.00 H new ATOM 0 HD2 PRO A 67 6.811 -20.275 -5.060 1.00 0.00 H new ATOM 0 HD3 PRO A 67 7.884 -18.903 -4.865 1.00 0.00 H new ATOM 1055 N ILE A 68 2.791 -17.207 -4.186 1.00 0.00 N ATOM 1056 CA ILE A 68 1.365 -17.506 -4.151 1.00 0.00 C ATOM 1057 C ILE A 68 0.828 -17.784 -5.551 1.00 0.00 C ATOM 1058 O ILE A 68 1.229 -17.143 -6.521 1.00 0.00 O ATOM 1059 CB ILE A 68 0.563 -16.349 -3.526 1.00 0.00 C ATOM 1060 CG1 ILE A 68 1.179 -15.935 -2.189 1.00 0.00 C ATOM 1061 CG2 ILE A 68 -0.893 -16.753 -3.342 1.00 0.00 C ATOM 1062 CD1 ILE A 68 1.249 -17.062 -1.182 1.00 0.00 C ATOM 0 H ILE A 68 3.014 -16.243 -4.435 1.00 0.00 H new ATOM 0 HA ILE A 68 1.243 -18.396 -3.534 1.00 0.00 H new ATOM 0 HB ILE A 68 0.601 -15.494 -4.201 1.00 0.00 H new ATOM 0 HG12 ILE A 68 2.184 -15.552 -2.364 1.00 0.00 H new ATOM 0 HG13 ILE A 68 0.595 -15.117 -1.767 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -1.447 -15.925 -2.899 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -1.326 -17.003 -4.310 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -0.950 -17.620 -2.684 1.00 0.00 H new ATOM 0 HD11 ILE A 68 1.697 -16.697 -0.258 1.00 0.00 H new ATOM 0 HD12 ILE A 68 0.244 -17.430 -0.978 1.00 0.00 H new ATOM 0 HD13 ILE A 68 1.857 -17.872 -1.584 1.00 0.00 H new ATOM 1074 N GLY A 69 -0.085 -18.746 -5.647 1.00 0.00 N ATOM 1075 CA GLY A 69 -0.665 -19.093 -6.931 1.00 0.00 C ATOM 1076 C GLY A 69 -1.308 -17.903 -7.617 1.00 0.00 C ATOM 1077 O GLY A 69 -0.874 -17.486 -8.691 1.00 0.00 O ATOM 0 H GLY A 69 -0.433 -19.291 -4.858 1.00 0.00 H new ATOM 0 HA2 GLY A 69 0.110 -19.506 -7.577 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -1.412 -19.874 -6.790 1.00 0.00 H new ATOM 1081 N HIS A 70 -2.349 -17.356 -6.997 1.00 0.00 N ATOM 1082 CA HIS A 70 -3.054 -16.208 -7.555 1.00 0.00 C ATOM 1083 C HIS A 70 -3.346 -15.172 -6.473 1.00 0.00 C ATOM 1084 O HIS A 70 -3.846 -15.505 -5.399 1.00 0.00 O ATOM 1085 CB HIS A 70 -4.360 -16.656 -8.213 1.00 0.00 C ATOM 1086 CG HIS A 70 -4.166 -17.290 -9.556 1.00 0.00 C ATOM 1087 ND1 HIS A 70 -3.749 -16.587 -10.667 1.00 0.00 N ATOM 1088 CD2 HIS A 70 -4.333 -18.570 -9.963 1.00 0.00 C ATOM 1089 CE1 HIS A 70 -3.670 -17.407 -11.700 1.00 0.00 C ATOM 1090 NE2 HIS A 70 -4.019 -18.616 -11.299 1.00 0.00 N ATOM 0 H HIS A 70 -2.723 -17.689 -6.108 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.414 -15.750 -8.309 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.865 -17.364 -7.555 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.019 -15.794 -8.319 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -4.653 -19.400 -9.351 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.371 -17.135 -12.702 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -4.050 -19.449 -11.887 1.00 0.00 H new ATOM 1098 N ASP A 71 -3.028 -13.914 -6.765 1.00 0.00 N ATOM 1099 CA ASP A 71 -3.256 -12.830 -5.818 1.00 0.00 C ATOM 1100 C ASP A 71 -4.696 -12.336 -5.894 1.00 0.00 C ATOM 1101 O ASP A 71 -5.370 -12.507 -6.910 1.00 0.00 O ATOM 1102 CB ASP A 71 -2.292 -11.674 -6.092 1.00 0.00 C ATOM 1103 CG ASP A 71 -2.276 -10.655 -4.970 1.00 0.00 C ATOM 1104 OD1 ASP A 71 -1.873 -11.016 -3.846 1.00 0.00 O ATOM 1105 OD2 ASP A 71 -2.668 -9.494 -5.217 1.00 0.00 O ATOM 0 H ASP A 71 -2.612 -13.622 -7.649 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.075 -13.214 -4.814 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.286 -12.069 -6.234 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.575 -11.181 -7.022 1.00 0.00 H new ATOM 1110 N GLY A 72 -5.165 -11.721 -4.812 1.00 0.00 N ATOM 1111 CA GLY A 72 -6.523 -11.212 -4.777 1.00 0.00 C ATOM 1112 C GLY A 72 -7.548 -12.268 -5.143 1.00 0.00 C ATOM 1113 O GLY A 72 -7.761 -13.221 -4.393 1.00 0.00 O ATOM 0 H GLY A 72 -4.628 -11.566 -3.959 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -6.739 -10.831 -3.779 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -6.610 -10.371 -5.465 1.00 0.00 H new ATOM 1117 N ALA A 73 -8.184 -12.099 -6.297 1.00 0.00 N ATOM 1118 CA ALA A 73 -9.191 -13.045 -6.760 1.00 0.00 C ATOM 1119 C ALA A 73 -10.283 -13.240 -5.714 1.00 0.00 C ATOM 1120 O ALA A 73 -10.686 -14.368 -5.426 1.00 0.00 O ATOM 1121 CB ALA A 73 -8.543 -14.378 -7.105 1.00 0.00 C ATOM 0 H ALA A 73 -8.020 -11.315 -6.929 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.654 -12.635 -7.658 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.307 -15.075 -7.449 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -7.804 -14.230 -7.893 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.053 -14.784 -6.220 1.00 0.00 H new ATOM 1127 N HIS A 74 -10.758 -12.136 -5.147 1.00 0.00 N ATOM 1128 CA HIS A 74 -11.804 -12.186 -4.132 1.00 0.00 C ATOM 1129 C HIS A 74 -13.086 -11.534 -4.641 1.00 0.00 C ATOM 1130 O HIS A 74 -13.443 -10.423 -4.249 1.00 0.00 O ATOM 1131 CB HIS A 74 -11.337 -11.492 -2.853 1.00 0.00 C ATOM 1132 CG HIS A 74 -10.295 -12.261 -2.100 1.00 0.00 C ATOM 1133 ND1 HIS A 74 -10.435 -13.592 -1.767 1.00 0.00 N ATOM 1134 CD2 HIS A 74 -9.090 -11.879 -1.617 1.00 0.00 C ATOM 1135 CE1 HIS A 74 -9.363 -13.995 -1.110 1.00 0.00 C ATOM 1136 NE2 HIS A 74 -8.530 -12.974 -1.005 1.00 0.00 N ATOM 0 H HIS A 74 -10.435 -11.195 -5.373 1.00 0.00 H new ATOM 0 HA HIS A 74 -12.013 -13.233 -3.912 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -10.939 -10.510 -3.107 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -12.197 -11.329 -2.203 1.00 0.00 H new ATOM 0 HD1 HIS A 74 -11.241 -14.174 -1.993 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -8.650 -10.896 -1.698 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -9.195 -14.990 -0.724 1.00 0.00 H new ATOM 1144 N PRO A 75 -13.796 -12.239 -5.534 1.00 0.00 N ATOM 1145 CA PRO A 75 -15.049 -11.747 -6.115 1.00 0.00 C ATOM 1146 C PRO A 75 -16.184 -11.709 -5.098 1.00 0.00 C ATOM 1147 O PRO A 75 -17.259 -11.173 -5.370 1.00 0.00 O ATOM 1148 CB PRO A 75 -15.352 -12.766 -7.217 1.00 0.00 C ATOM 1149 CG PRO A 75 -14.666 -14.012 -6.779 1.00 0.00 C ATOM 1150 CD PRO A 75 -13.430 -13.570 -6.046 1.00 0.00 C ATOM 0 HA PRO A 75 -14.957 -10.723 -6.476 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -16.425 -12.923 -7.327 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -14.978 -12.427 -8.183 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -15.312 -14.606 -6.132 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -14.410 -14.637 -7.634 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -13.175 -14.256 -5.238 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -12.565 -13.522 -6.708 1.00 0.00 H new ATOM 1158 N THR A 76 -15.939 -12.280 -3.922 1.00 0.00 N ATOM 1159 CA THR A 76 -16.940 -12.311 -2.864 1.00 0.00 C ATOM 1160 C THR A 76 -17.492 -10.917 -2.587 1.00 0.00 C ATOM 1161 O THR A 76 -18.654 -10.632 -2.874 1.00 0.00 O ATOM 1162 CB THR A 76 -16.361 -12.889 -1.559 1.00 0.00 C ATOM 1163 OG1 THR A 76 -15.021 -12.419 -1.367 1.00 0.00 O ATOM 1164 CG2 THR A 76 -16.369 -14.410 -1.590 1.00 0.00 C ATOM 0 H THR A 76 -15.055 -12.727 -3.679 1.00 0.00 H new ATOM 0 HA THR A 76 -17.747 -12.956 -3.212 1.00 0.00 H new ATOM 0 HB THR A 76 -16.986 -12.554 -0.731 1.00 0.00 H new ATOM 0 HG1 THR A 76 -14.553 -13.010 -0.741 1.00 0.00 H new ATOM 0 HG21 THR A 76 -15.956 -14.795 -0.658 1.00 0.00 H new ATOM 0 HG22 THR A 76 -17.392 -14.766 -1.707 1.00 0.00 H new ATOM 0 HG23 THR A 76 -15.765 -14.760 -2.427 1.00 0.00 H new ATOM 1172 N SER A 77 -16.651 -10.052 -2.031 1.00 0.00 N ATOM 1173 CA SER A 77 -17.057 -8.688 -1.712 1.00 0.00 C ATOM 1174 C SER A 77 -15.857 -7.851 -1.281 1.00 0.00 C ATOM 1175 O SER A 77 -14.812 -8.387 -0.911 1.00 0.00 O ATOM 1176 CB SER A 77 -18.114 -8.693 -0.607 1.00 0.00 C ATOM 1177 OG SER A 77 -19.416 -8.845 -1.146 1.00 0.00 O ATOM 0 H SER A 77 -15.684 -10.271 -1.792 1.00 0.00 H new ATOM 0 HA SER A 77 -17.484 -8.243 -2.611 1.00 0.00 H new ATOM 0 HB2 SER A 77 -17.910 -9.504 0.092 1.00 0.00 H new ATOM 0 HB3 SER A 77 -18.058 -7.763 -0.042 1.00 0.00 H new ATOM 0 HG SER A 77 -19.390 -9.485 -1.887 1.00 0.00 H new ATOM 1183 N VAL A 78 -16.014 -6.532 -1.332 1.00 0.00 N ATOM 1184 CA VAL A 78 -14.945 -5.619 -0.945 1.00 0.00 C ATOM 1185 C VAL A 78 -14.389 -5.974 0.429 1.00 0.00 C ATOM 1186 O VAL A 78 -13.185 -5.874 0.668 1.00 0.00 O ATOM 1187 CB VAL A 78 -15.433 -4.158 -0.928 1.00 0.00 C ATOM 1188 CG1 VAL A 78 -14.278 -3.212 -0.638 1.00 0.00 C ATOM 1189 CG2 VAL A 78 -16.103 -3.805 -2.247 1.00 0.00 C ATOM 0 H VAL A 78 -16.871 -6.072 -1.638 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.156 -5.722 -1.690 1.00 0.00 H new ATOM 0 HB VAL A 78 -16.169 -4.049 -0.132 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -14.642 -2.185 -0.630 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -13.847 -3.452 0.334 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -13.516 -3.321 -1.410 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -16.442 -2.769 -2.217 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -15.390 -3.931 -3.062 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -16.958 -4.462 -2.408 1.00 0.00 H new ATOM 1199 N ALA A 79 -15.273 -6.389 1.329 1.00 0.00 N ATOM 1200 CA ALA A 79 -14.871 -6.762 2.680 1.00 0.00 C ATOM 1201 C ALA A 79 -13.907 -7.944 2.659 1.00 0.00 C ATOM 1202 O ALA A 79 -12.803 -7.865 3.197 1.00 0.00 O ATOM 1203 CB ALA A 79 -16.094 -7.090 3.524 1.00 0.00 C ATOM 0 H ALA A 79 -16.273 -6.476 1.148 1.00 0.00 H new ATOM 0 HA ALA A 79 -14.354 -5.913 3.126 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -15.778 -7.367 4.530 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -16.745 -6.218 3.575 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -16.636 -7.921 3.072 1.00 0.00 H new ATOM 1209 N GLU A 80 -14.333 -9.038 2.036 1.00 0.00 N ATOM 1210 CA GLU A 80 -13.507 -10.237 1.948 1.00 0.00 C ATOM 1211 C GLU A 80 -12.329 -10.017 1.003 1.00 0.00 C ATOM 1212 O GLU A 80 -11.373 -10.793 0.995 1.00 0.00 O ATOM 1213 CB GLU A 80 -14.343 -11.425 1.470 1.00 0.00 C ATOM 1214 CG GLU A 80 -15.405 -11.861 2.465 1.00 0.00 C ATOM 1215 CD GLU A 80 -14.814 -12.364 3.767 1.00 0.00 C ATOM 1216 OE1 GLU A 80 -14.392 -13.538 3.814 1.00 0.00 O ATOM 1217 OE2 GLU A 80 -14.773 -11.582 4.740 1.00 0.00 O ATOM 0 H GLU A 80 -15.244 -9.119 1.585 1.00 0.00 H new ATOM 0 HA GLU A 80 -13.118 -10.453 2.943 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -14.825 -11.164 0.528 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -13.681 -12.266 1.266 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -16.069 -11.022 2.672 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -16.014 -12.647 2.019 1.00 0.00 H new ATOM 1224 N TRP A 81 -12.406 -8.955 0.209 1.00 0.00 N ATOM 1225 CA TRP A 81 -11.346 -8.634 -0.741 1.00 0.00 C ATOM 1226 C TRP A 81 -10.200 -7.903 -0.050 1.00 0.00 C ATOM 1227 O TRP A 81 -9.029 -8.140 -0.350 1.00 0.00 O ATOM 1228 CB TRP A 81 -11.899 -7.779 -1.883 1.00 0.00 C ATOM 1229 CG TRP A 81 -10.843 -6.998 -2.605 1.00 0.00 C ATOM 1230 CD1 TRP A 81 -9.770 -7.503 -3.283 1.00 0.00 C ATOM 1231 CD2 TRP A 81 -10.758 -5.573 -2.719 1.00 0.00 C ATOM 1232 NE1 TRP A 81 -9.024 -6.478 -3.812 1.00 0.00 N ATOM 1233 CE2 TRP A 81 -9.609 -5.284 -3.481 1.00 0.00 C ATOM 1234 CE3 TRP A 81 -11.542 -4.514 -2.254 1.00 0.00 C ATOM 1235 CZ2 TRP A 81 -9.227 -3.981 -3.785 1.00 0.00 C ATOM 1236 CZ3 TRP A 81 -11.161 -3.221 -2.557 1.00 0.00 C ATOM 1237 CH2 TRP A 81 -10.012 -2.963 -3.316 1.00 0.00 C ATOM 0 H TRP A 81 -13.190 -8.302 0.204 1.00 0.00 H new ATOM 0 HA TRP A 81 -10.962 -9.569 -1.150 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -12.414 -8.425 -2.595 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -12.642 -7.089 -1.484 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -9.542 -8.553 -3.388 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -8.172 -6.588 -4.362 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -12.430 -4.703 -1.668 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -8.342 -3.780 -4.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -11.759 -2.395 -2.203 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -9.741 -1.941 -3.535 1.00 0.00 H new ATOM 1248 N LEU A 82 -10.544 -7.012 0.874 1.00 0.00 N ATOM 1249 CA LEU A 82 -9.542 -6.246 1.607 1.00 0.00 C ATOM 1250 C LEU A 82 -9.142 -6.964 2.893 1.00 0.00 C ATOM 1251 O LEU A 82 -7.961 -7.040 3.230 1.00 0.00 O ATOM 1252 CB LEU A 82 -10.078 -4.851 1.935 1.00 0.00 C ATOM 1253 CG LEU A 82 -9.981 -3.816 0.813 1.00 0.00 C ATOM 1254 CD1 LEU A 82 -11.096 -2.789 0.938 1.00 0.00 C ATOM 1255 CD2 LEU A 82 -8.620 -3.134 0.833 1.00 0.00 C ATOM 0 H LEU A 82 -11.508 -6.803 1.133 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.659 -6.151 0.975 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.124 -4.944 2.227 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -9.538 -4.470 2.802 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.093 -4.330 -0.142 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -11.012 -2.060 0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -12.062 -3.291 0.874 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -11.015 -2.279 1.898 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.569 -2.401 0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.478 -2.632 1.790 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -7.837 -3.880 0.695 1.00 0.00 H new ATOM 1267 N ASP A 83 -10.133 -7.489 3.604 1.00 0.00 N ATOM 1268 CA ASP A 83 -9.884 -8.204 4.851 1.00 0.00 C ATOM 1269 C ASP A 83 -8.935 -9.377 4.625 1.00 0.00 C ATOM 1270 O ASP A 83 -8.223 -9.796 5.536 1.00 0.00 O ATOM 1271 CB ASP A 83 -11.200 -8.704 5.449 1.00 0.00 C ATOM 1272 CG ASP A 83 -11.072 -9.055 6.918 1.00 0.00 C ATOM 1273 OD1 ASP A 83 -10.741 -10.220 7.222 1.00 0.00 O ATOM 1274 OD2 ASP A 83 -11.303 -8.165 7.764 1.00 0.00 O ATOM 0 H ASP A 83 -11.116 -7.433 3.339 1.00 0.00 H new ATOM 0 HA ASP A 83 -9.416 -7.511 5.551 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -11.965 -7.938 5.327 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -11.536 -9.581 4.897 1.00 0.00 H new ATOM 1279 N SER A 84 -8.934 -9.903 3.404 1.00 0.00 N ATOM 1280 CA SER A 84 -8.077 -11.031 3.059 1.00 0.00 C ATOM 1281 C SER A 84 -6.675 -10.557 2.691 1.00 0.00 C ATOM 1282 O SER A 84 -5.742 -11.355 2.599 1.00 0.00 O ATOM 1283 CB SER A 84 -8.682 -11.821 1.897 1.00 0.00 C ATOM 1284 OG SER A 84 -9.850 -12.513 2.302 1.00 0.00 O ATOM 0 H SER A 84 -9.517 -9.566 2.638 1.00 0.00 H new ATOM 0 HA SER A 84 -8.004 -11.680 3.932 1.00 0.00 H new ATOM 0 HB2 SER A 84 -8.923 -11.142 1.079 1.00 0.00 H new ATOM 0 HB3 SER A 84 -7.949 -12.532 1.516 1.00 0.00 H new ATOM 0 HG SER A 84 -10.637 -12.092 1.897 1.00 0.00 H new ATOM 1290 N ILE A 85 -6.535 -9.252 2.483 1.00 0.00 N ATOM 1291 CA ILE A 85 -5.247 -8.670 2.126 1.00 0.00 C ATOM 1292 C ILE A 85 -4.445 -8.306 3.371 1.00 0.00 C ATOM 1293 O ILE A 85 -3.459 -8.965 3.700 1.00 0.00 O ATOM 1294 CB ILE A 85 -5.420 -7.412 1.255 1.00 0.00 C ATOM 1295 CG1 ILE A 85 -5.943 -7.793 -0.132 1.00 0.00 C ATOM 1296 CG2 ILE A 85 -4.102 -6.661 1.141 1.00 0.00 C ATOM 1297 CD1 ILE A 85 -6.373 -6.606 -0.963 1.00 0.00 C ATOM 0 H ILE A 85 -7.297 -8.578 2.556 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.706 -9.425 1.556 1.00 0.00 H new ATOM 0 HB ILE A 85 -6.150 -6.757 1.731 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -5.166 -8.338 -0.667 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -6.788 -8.472 -0.019 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -4.241 -5.774 0.522 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.767 -6.362 2.134 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -3.353 -7.308 0.685 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -6.732 -6.951 -1.932 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -7.173 -6.073 -0.449 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -5.525 -5.937 -1.108 1.00 0.00 H new ATOM 1309 N GLU A 86 -4.877 -7.254 4.060 1.00 0.00 N ATOM 1310 CA GLU A 86 -4.198 -6.804 5.270 1.00 0.00 C ATOM 1311 C GLU A 86 -5.124 -5.943 6.124 1.00 0.00 C ATOM 1312 O GLU A 86 -5.330 -6.217 7.307 1.00 0.00 O ATOM 1313 CB GLU A 86 -2.938 -6.014 4.911 1.00 0.00 C ATOM 1314 CG GLU A 86 -1.923 -5.942 6.038 1.00 0.00 C ATOM 1315 CD GLU A 86 -0.492 -5.942 5.537 1.00 0.00 C ATOM 1316 OE1 GLU A 86 -0.203 -6.678 4.570 1.00 0.00 O ATOM 1317 OE2 GLU A 86 0.339 -5.208 6.110 1.00 0.00 O ATOM 0 H GLU A 86 -5.692 -6.698 3.802 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.914 -7.685 5.846 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.469 -6.471 4.040 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.223 -5.002 4.625 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.099 -5.039 6.623 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -2.069 -6.789 6.708 1.00 0.00 H new ATOM 1324 N LEU A 87 -5.681 -4.901 5.517 1.00 0.00 N ATOM 1325 CA LEU A 87 -6.585 -3.998 6.221 1.00 0.00 C ATOM 1326 C LEU A 87 -7.956 -3.968 5.552 1.00 0.00 C ATOM 1327 O LEU A 87 -8.071 -3.669 4.364 1.00 0.00 O ATOM 1328 CB LEU A 87 -5.996 -2.587 6.266 1.00 0.00 C ATOM 1329 CG LEU A 87 -5.584 -1.989 4.921 1.00 0.00 C ATOM 1330 CD1 LEU A 87 -5.560 -0.471 4.997 1.00 0.00 C ATOM 1331 CD2 LEU A 87 -4.225 -2.525 4.493 1.00 0.00 C ATOM 0 H LEU A 87 -5.523 -4.660 4.539 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.706 -4.367 7.239 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.728 -1.924 6.727 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.123 -2.600 6.918 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.320 -2.283 4.173 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.265 -0.063 4.030 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.553 -0.104 5.258 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.845 -0.156 5.757 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.948 -2.089 3.533 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.478 -2.261 5.241 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.275 -3.610 4.397 1.00 0.00 H new ATOM 1343 N GLY A 88 -8.992 -4.280 6.323 1.00 0.00 N ATOM 1344 CA GLY A 88 -10.341 -4.281 5.787 1.00 0.00 C ATOM 1345 C GLY A 88 -11.090 -3.000 6.098 1.00 0.00 C ATOM 1346 O GLY A 88 -12.230 -2.820 5.672 1.00 0.00 O ATOM 0 H GLY A 88 -8.922 -4.532 7.309 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.299 -4.421 4.707 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.891 -5.128 6.197 1.00 0.00 H new ATOM 1350 N ASP A 89 -10.448 -2.108 6.845 1.00 0.00 N ATOM 1351 CA ASP A 89 -11.060 -0.838 7.214 1.00 0.00 C ATOM 1352 C ASP A 89 -11.547 -0.090 5.976 1.00 0.00 C ATOM 1353 O ASP A 89 -12.626 0.504 5.982 1.00 0.00 O ATOM 1354 CB ASP A 89 -10.063 0.027 7.988 1.00 0.00 C ATOM 1355 CG ASP A 89 -9.698 -0.572 9.332 1.00 0.00 C ATOM 1356 OD1 ASP A 89 -10.189 -1.678 9.641 1.00 0.00 O ATOM 1357 OD2 ASP A 89 -8.922 0.065 10.074 1.00 0.00 O ATOM 0 H ASP A 89 -9.504 -2.242 7.207 1.00 0.00 H new ATOM 0 HA ASP A 89 -11.919 -1.048 7.852 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.159 0.155 7.393 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -10.488 1.019 8.139 1.00 0.00 H new ATOM 1362 N TYR A 90 -10.746 -0.123 4.918 1.00 0.00 N ATOM 1363 CA TYR A 90 -11.094 0.554 3.674 1.00 0.00 C ATOM 1364 C TYR A 90 -12.491 0.155 3.209 1.00 0.00 C ATOM 1365 O TYR A 90 -13.188 0.933 2.558 1.00 0.00 O ATOM 1366 CB TYR A 90 -10.068 0.228 2.587 1.00 0.00 C ATOM 1367 CG TYR A 90 -8.902 1.188 2.547 1.00 0.00 C ATOM 1368 CD1 TYR A 90 -9.103 2.548 2.342 1.00 0.00 C ATOM 1369 CD2 TYR A 90 -7.599 0.737 2.712 1.00 0.00 C ATOM 1370 CE1 TYR A 90 -8.040 3.429 2.304 1.00 0.00 C ATOM 1371 CE2 TYR A 90 -6.530 1.611 2.676 1.00 0.00 C ATOM 1372 CZ TYR A 90 -6.755 2.956 2.471 1.00 0.00 C ATOM 1373 OH TYR A 90 -5.694 3.831 2.435 1.00 0.00 O ATOM 0 H TYR A 90 -9.851 -0.611 4.896 1.00 0.00 H new ATOM 0 HA TYR A 90 -11.087 1.628 3.860 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -9.691 -0.782 2.747 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -10.565 0.233 1.617 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -10.107 2.922 2.210 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -7.418 -0.316 2.871 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -8.214 4.483 2.144 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -5.523 1.243 2.808 1.00 0.00 H new ATOM 0 HH TYR A 90 -4.931 3.439 2.909 1.00 0.00 H new ATOM 1383 N THR A 91 -12.894 -1.066 3.548 1.00 0.00 N ATOM 1384 CA THR A 91 -14.206 -1.572 3.166 1.00 0.00 C ATOM 1385 C THR A 91 -15.290 -0.528 3.413 1.00 0.00 C ATOM 1386 O THR A 91 -16.240 -0.409 2.638 1.00 0.00 O ATOM 1387 CB THR A 91 -14.561 -2.857 3.938 1.00 0.00 C ATOM 1388 OG1 THR A 91 -13.559 -3.854 3.714 1.00 0.00 O ATOM 1389 CG2 THR A 91 -15.919 -3.389 3.508 1.00 0.00 C ATOM 0 H THR A 91 -12.330 -1.723 4.087 1.00 0.00 H new ATOM 0 HA THR A 91 -14.159 -1.800 2.101 1.00 0.00 H new ATOM 0 HB THR A 91 -14.603 -2.617 5.000 1.00 0.00 H new ATOM 0 HG1 THR A 91 -12.837 -3.745 4.367 1.00 0.00 H new ATOM 0 HG21 THR A 91 -16.148 -4.297 4.067 1.00 0.00 H new ATOM 0 HG22 THR A 91 -16.684 -2.638 3.707 1.00 0.00 H new ATOM 0 HG23 THR A 91 -15.900 -3.614 2.442 1.00 0.00 H new ATOM 1397 N LYS A 92 -15.143 0.226 4.496 1.00 0.00 N ATOM 1398 CA LYS A 92 -16.108 1.261 4.845 1.00 0.00 C ATOM 1399 C LYS A 92 -16.170 2.335 3.764 1.00 0.00 C ATOM 1400 O LYS A 92 -17.250 2.694 3.293 1.00 0.00 O ATOM 1401 CB LYS A 92 -15.742 1.897 6.189 1.00 0.00 C ATOM 1402 CG LYS A 92 -16.472 1.283 7.372 1.00 0.00 C ATOM 1403 CD LYS A 92 -17.843 1.909 7.566 1.00 0.00 C ATOM 1404 CE LYS A 92 -18.255 1.905 9.030 1.00 0.00 C ATOM 1405 NZ LYS A 92 -18.894 0.620 9.423 1.00 0.00 N ATOM 0 H LYS A 92 -14.364 0.140 5.148 1.00 0.00 H new ATOM 0 HA LYS A 92 -17.090 0.794 4.925 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -14.668 1.801 6.346 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -15.964 2.963 6.149 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -16.580 0.209 7.217 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -15.878 1.417 8.276 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -17.833 2.933 7.193 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -18.580 1.363 6.978 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -17.379 2.081 9.654 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -18.948 2.726 9.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -19.160 0.658 10.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -19.745 0.464 8.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -18.225 -0.161 9.271 1.00 0.00 H new ATOM 1419 N ALA A 93 -15.006 2.841 3.372 1.00 0.00 N ATOM 1420 CA ALA A 93 -14.929 3.871 2.343 1.00 0.00 C ATOM 1421 C ALA A 93 -15.452 3.352 1.008 1.00 0.00 C ATOM 1422 O ALA A 93 -16.245 4.017 0.341 1.00 0.00 O ATOM 1423 CB ALA A 93 -13.497 4.363 2.195 1.00 0.00 C ATOM 0 H ALA A 93 -14.103 2.555 3.751 1.00 0.00 H new ATOM 0 HA ALA A 93 -15.558 4.706 2.651 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -13.454 5.132 1.423 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -13.156 4.780 3.142 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -12.853 3.530 1.913 1.00 0.00 H new ATOM 1429 N PHE A 94 -15.003 2.162 0.623 1.00 0.00 N ATOM 1430 CA PHE A 94 -15.426 1.555 -0.634 1.00 0.00 C ATOM 1431 C PHE A 94 -16.947 1.448 -0.702 1.00 0.00 C ATOM 1432 O PHE A 94 -17.562 1.813 -1.705 1.00 0.00 O ATOM 1433 CB PHE A 94 -14.799 0.170 -0.792 1.00 0.00 C ATOM 1434 CG PHE A 94 -13.429 0.198 -1.406 1.00 0.00 C ATOM 1435 CD1 PHE A 94 -12.310 0.444 -0.627 1.00 0.00 C ATOM 1436 CD2 PHE A 94 -13.259 -0.023 -2.763 1.00 0.00 C ATOM 1437 CE1 PHE A 94 -11.049 0.472 -1.190 1.00 0.00 C ATOM 1438 CE2 PHE A 94 -12.001 0.003 -3.333 1.00 0.00 C ATOM 1439 CZ PHE A 94 -10.894 0.250 -2.544 1.00 0.00 C ATOM 0 H PHE A 94 -14.346 1.599 1.163 1.00 0.00 H new ATOM 0 HA PHE A 94 -15.088 2.195 -1.449 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -14.740 -0.307 0.186 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -15.452 -0.447 -1.409 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -12.425 0.616 0.433 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -14.121 -0.218 -3.383 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -10.185 0.667 -0.572 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -11.883 -0.169 -4.393 1.00 0.00 H new ATOM 0 HZ PHE A 94 -9.909 0.269 -2.986 1.00 0.00 H new ATOM 1449 N LEU A 95 -17.548 0.947 0.371 1.00 0.00 N ATOM 1450 CA LEU A 95 -18.997 0.791 0.434 1.00 0.00 C ATOM 1451 C LEU A 95 -19.694 2.145 0.350 1.00 0.00 C ATOM 1452 O LEU A 95 -20.441 2.411 -0.593 1.00 0.00 O ATOM 1453 CB LEU A 95 -19.397 0.079 1.728 1.00 0.00 C ATOM 1454 CG LEU A 95 -19.140 -1.428 1.771 1.00 0.00 C ATOM 1455 CD1 LEU A 95 -19.191 -1.937 3.204 1.00 0.00 C ATOM 1456 CD2 LEU A 95 -20.151 -2.166 0.905 1.00 0.00 C ATOM 0 H LEU A 95 -17.054 0.642 1.210 1.00 0.00 H new ATOM 0 HA LEU A 95 -19.310 0.188 -0.418 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -18.860 0.543 2.555 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -20.459 0.251 1.901 1.00 0.00 H new ATOM 0 HG LEU A 95 -18.143 -1.619 1.374 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -19.006 -3.011 3.215 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -18.429 -1.431 3.797 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -20.175 -1.734 3.628 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -19.953 -3.237 0.947 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -21.158 -1.968 1.272 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -20.067 -1.822 -0.126 1.00 0.00 H new ATOM 1468 N ILE A 96 -19.445 2.997 1.338 1.00 0.00 N ATOM 1469 CA ILE A 96 -20.045 4.324 1.372 1.00 0.00 C ATOM 1470 C ILE A 96 -19.860 5.047 0.042 1.00 0.00 C ATOM 1471 O ILE A 96 -20.683 5.873 -0.347 1.00 0.00 O ATOM 1472 CB ILE A 96 -19.445 5.186 2.499 1.00 0.00 C ATOM 1473 CG1 ILE A 96 -17.992 5.541 2.180 1.00 0.00 C ATOM 1474 CG2 ILE A 96 -19.537 4.455 3.830 1.00 0.00 C ATOM 1475 CD1 ILE A 96 -17.353 6.451 3.206 1.00 0.00 C ATOM 0 H ILE A 96 -18.831 2.792 2.126 1.00 0.00 H new ATOM 0 HA ILE A 96 -21.109 4.182 1.561 1.00 0.00 H new ATOM 0 HB ILE A 96 -20.017 6.111 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -17.409 4.623 2.108 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -17.950 6.022 1.203 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.109 5.076 4.617 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -20.582 4.247 4.060 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -18.986 3.517 3.769 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -16.324 6.661 2.915 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.912 7.385 3.262 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -17.363 5.964 4.181 1.00 0.00 H new ATOM 1487 N ASN A 97 -18.772 4.726 -0.652 1.00 0.00 N ATOM 1488 CA ASN A 97 -18.479 5.344 -1.941 1.00 0.00 C ATOM 1489 C ASN A 97 -19.398 4.795 -3.029 1.00 0.00 C ATOM 1490 O ASN A 97 -19.809 5.521 -3.932 1.00 0.00 O ATOM 1491 CB ASN A 97 -17.017 5.105 -2.323 1.00 0.00 C ATOM 1492 CG ASN A 97 -16.565 5.997 -3.463 1.00 0.00 C ATOM 1493 OD1 ASN A 97 -16.043 7.089 -3.242 1.00 0.00 O ATOM 1494 ND2 ASN A 97 -16.762 5.532 -4.692 1.00 0.00 N ATOM 0 H ASN A 97 -18.080 4.043 -0.344 1.00 0.00 H new ATOM 0 HA ASN A 97 -18.653 6.416 -1.851 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -16.383 5.282 -1.454 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -16.884 4.061 -2.607 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -16.476 6.087 -5.499 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -17.199 4.620 -4.828 1.00 0.00 H new ATOM 1501 N GLY A 98 -19.714 3.508 -2.934 1.00 0.00 N ATOM 1502 CA GLY A 98 -20.582 2.883 -3.916 1.00 0.00 C ATOM 1503 C GLY A 98 -20.054 1.541 -4.385 1.00 0.00 C ATOM 1504 O GLY A 98 -20.763 0.787 -5.051 1.00 0.00 O ATOM 0 H GLY A 98 -19.385 2.886 -2.195 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -21.575 2.749 -3.486 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -20.692 3.547 -4.774 1.00 0.00 H new ATOM 1508 N TYR A 99 -18.808 1.243 -4.037 1.00 0.00 N ATOM 1509 CA TYR A 99 -18.185 -0.015 -4.431 1.00 0.00 C ATOM 1510 C TYR A 99 -18.886 -1.199 -3.772 1.00 0.00 C ATOM 1511 O TYR A 99 -18.610 -1.537 -2.620 1.00 0.00 O ATOM 1512 CB TYR A 99 -16.702 -0.014 -4.057 1.00 0.00 C ATOM 1513 CG TYR A 99 -15.890 1.021 -4.803 1.00 0.00 C ATOM 1514 CD1 TYR A 99 -15.430 0.774 -6.091 1.00 0.00 C ATOM 1515 CD2 TYR A 99 -15.583 2.244 -4.222 1.00 0.00 C ATOM 1516 CE1 TYR A 99 -14.688 1.715 -6.778 1.00 0.00 C ATOM 1517 CE2 TYR A 99 -14.843 3.192 -4.901 1.00 0.00 C ATOM 1518 CZ TYR A 99 -14.398 2.924 -6.178 1.00 0.00 C ATOM 1519 OH TYR A 99 -13.659 3.865 -6.858 1.00 0.00 O ATOM 0 H TYR A 99 -18.209 1.855 -3.483 1.00 0.00 H new ATOM 0 HA TYR A 99 -18.280 -0.115 -5.512 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -16.606 0.164 -2.986 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -16.285 -1.002 -4.254 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -15.657 -0.170 -6.563 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -15.929 2.458 -3.221 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -14.337 1.506 -7.778 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -14.614 4.138 -4.434 1.00 0.00 H new ATOM 0 HH TYR A 99 -12.928 4.181 -6.288 1.00 0.00 H new ATOM 1529 N THR A 100 -19.795 -1.828 -4.511 1.00 0.00 N ATOM 1530 CA THR A 100 -20.536 -2.974 -4.000 1.00 0.00 C ATOM 1531 C THR A 100 -20.006 -4.277 -4.588 1.00 0.00 C ATOM 1532 O THR A 100 -19.891 -5.283 -3.887 1.00 0.00 O ATOM 1533 CB THR A 100 -22.039 -2.856 -4.315 1.00 0.00 C ATOM 1534 OG1 THR A 100 -22.436 -1.480 -4.302 1.00 0.00 O ATOM 1535 CG2 THR A 100 -22.866 -3.637 -3.305 1.00 0.00 C ATOM 0 H THR A 100 -20.035 -1.562 -5.466 1.00 0.00 H new ATOM 0 HA THR A 100 -20.398 -2.984 -2.919 1.00 0.00 H new ATOM 0 HB THR A 100 -22.214 -3.275 -5.306 1.00 0.00 H new ATOM 0 HG1 THR A 100 -23.392 -1.414 -4.505 1.00 0.00 H new ATOM 0 HG21 THR A 100 -23.924 -3.539 -3.548 1.00 0.00 H new ATOM 0 HG22 THR A 100 -22.582 -4.689 -3.338 1.00 0.00 H new ATOM 0 HG23 THR A 100 -22.685 -3.244 -2.305 1.00 0.00 H new ATOM 1543 N SER A 101 -19.685 -4.253 -5.877 1.00 0.00 N ATOM 1544 CA SER A 101 -19.170 -5.435 -6.558 1.00 0.00 C ATOM 1545 C SER A 101 -17.678 -5.290 -6.844 1.00 0.00 C ATOM 1546 O SER A 101 -17.130 -4.190 -6.797 1.00 0.00 O ATOM 1547 CB SER A 101 -19.931 -5.667 -7.865 1.00 0.00 C ATOM 1548 OG SER A 101 -21.328 -5.721 -7.639 1.00 0.00 O ATOM 0 H SER A 101 -19.772 -3.428 -6.471 1.00 0.00 H new ATOM 0 HA SER A 101 -19.315 -6.294 -5.903 1.00 0.00 H new ATOM 0 HB2 SER A 101 -19.704 -4.866 -8.569 1.00 0.00 H new ATOM 0 HB3 SER A 101 -19.597 -6.598 -8.323 1.00 0.00 H new ATOM 0 HG SER A 101 -21.792 -5.868 -8.490 1.00 0.00 H new ATOM 1554 N MET A 102 -17.028 -6.411 -7.140 1.00 0.00 N ATOM 1555 CA MET A 102 -15.599 -6.409 -7.434 1.00 0.00 C ATOM 1556 C MET A 102 -15.330 -5.828 -8.818 1.00 0.00 C ATOM 1557 O MET A 102 -14.403 -5.037 -8.999 1.00 0.00 O ATOM 1558 CB MET A 102 -15.038 -7.830 -7.347 1.00 0.00 C ATOM 1559 CG MET A 102 -13.616 -7.955 -7.872 1.00 0.00 C ATOM 1560 SD MET A 102 -12.652 -9.187 -6.977 1.00 0.00 S ATOM 1561 CE MET A 102 -12.075 -8.220 -5.584 1.00 0.00 C ATOM 0 H MET A 102 -17.467 -7.331 -7.183 1.00 0.00 H new ATOM 0 HA MET A 102 -15.101 -5.783 -6.694 1.00 0.00 H new ATOM 0 HB2 MET A 102 -15.063 -8.159 -6.308 1.00 0.00 H new ATOM 0 HB3 MET A 102 -15.685 -8.503 -7.910 1.00 0.00 H new ATOM 0 HG2 MET A 102 -13.645 -8.220 -8.929 1.00 0.00 H new ATOM 0 HG3 MET A 102 -13.119 -6.987 -7.799 1.00 0.00 H new ATOM 0 HE1 MET A 102 -11.631 -8.882 -4.841 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.328 -7.502 -5.924 1.00 0.00 H new ATOM 0 HE3 MET A 102 -12.915 -7.686 -5.139 1.00 0.00 H new ATOM 1571 N ASP A 103 -16.143 -6.224 -9.790 1.00 0.00 N ATOM 1572 CA ASP A 103 -15.993 -5.742 -11.158 1.00 0.00 C ATOM 1573 C ASP A 103 -15.875 -4.220 -11.187 1.00 0.00 C ATOM 1574 O ASP A 103 -15.098 -3.663 -11.963 1.00 0.00 O ATOM 1575 CB ASP A 103 -17.179 -6.190 -12.013 1.00 0.00 C ATOM 1576 CG ASP A 103 -18.497 -6.096 -11.270 1.00 0.00 C ATOM 1577 OD1 ASP A 103 -19.118 -5.013 -11.297 1.00 0.00 O ATOM 1578 OD2 ASP A 103 -18.907 -7.106 -10.660 1.00 0.00 O ATOM 0 H ASP A 103 -16.914 -6.878 -9.656 1.00 0.00 H new ATOM 0 HA ASP A 103 -15.078 -6.168 -11.569 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -17.228 -5.576 -12.912 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -17.021 -7.218 -12.338 1.00 0.00 H new ATOM 1583 N LEU A 104 -16.651 -3.556 -10.339 1.00 0.00 N ATOM 1584 CA LEU A 104 -16.634 -2.098 -10.268 1.00 0.00 C ATOM 1585 C LEU A 104 -15.233 -1.585 -9.953 1.00 0.00 C ATOM 1586 O LEU A 104 -14.804 -0.556 -10.480 1.00 0.00 O ATOM 1587 CB LEU A 104 -17.620 -1.609 -9.206 1.00 0.00 C ATOM 1588 CG LEU A 104 -18.270 -0.250 -9.468 1.00 0.00 C ATOM 1589 CD1 LEU A 104 -19.353 0.032 -8.438 1.00 0.00 C ATOM 1590 CD2 LEU A 104 -17.222 0.853 -9.459 1.00 0.00 C ATOM 0 H LEU A 104 -17.300 -4.002 -9.691 1.00 0.00 H new ATOM 0 HA LEU A 104 -16.933 -1.707 -11.240 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -18.410 -2.353 -9.102 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -17.099 -1.562 -8.250 1.00 0.00 H new ATOM 0 HG LEU A 104 -18.734 -0.275 -10.454 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -19.804 1.003 -8.641 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -20.118 -0.742 -8.494 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -18.914 0.037 -7.440 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -17.703 1.813 -9.647 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -16.729 0.878 -8.487 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -16.483 0.659 -10.236 1.00 0.00 H new ATOM 1602 N LEU A 105 -14.523 -2.307 -9.094 1.00 0.00 N ATOM 1603 CA LEU A 105 -13.168 -1.925 -8.710 1.00 0.00 C ATOM 1604 C LEU A 105 -12.224 -1.996 -9.906 1.00 0.00 C ATOM 1605 O LEU A 105 -11.156 -1.384 -9.904 1.00 0.00 O ATOM 1606 CB LEU A 105 -12.660 -2.833 -7.588 1.00 0.00 C ATOM 1607 CG LEU A 105 -13.604 -3.027 -6.402 1.00 0.00 C ATOM 1608 CD1 LEU A 105 -13.219 -4.267 -5.611 1.00 0.00 C ATOM 1609 CD2 LEU A 105 -13.595 -1.797 -5.506 1.00 0.00 C ATOM 0 H LEU A 105 -14.862 -3.160 -8.650 1.00 0.00 H new ATOM 0 HA LEU A 105 -13.193 -0.896 -8.352 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -12.437 -3.812 -8.013 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -11.720 -2.425 -7.216 1.00 0.00 H new ATOM 0 HG LEU A 105 -14.615 -3.165 -6.786 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -13.902 -4.389 -4.770 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -13.278 -5.143 -6.257 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -12.201 -4.159 -5.238 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -14.273 -1.953 -4.667 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -12.586 -1.628 -5.131 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -13.920 -0.928 -6.078 1.00 0.00 H new ATOM 1621 N LYS A 106 -12.625 -2.745 -10.926 1.00 0.00 N ATOM 1622 CA LYS A 106 -11.817 -2.895 -12.131 1.00 0.00 C ATOM 1623 C LYS A 106 -12.105 -1.771 -13.121 1.00 0.00 C ATOM 1624 O LYS A 106 -11.416 -1.628 -14.132 1.00 0.00 O ATOM 1625 CB LYS A 106 -12.090 -4.250 -12.789 1.00 0.00 C ATOM 1626 CG LYS A 106 -11.179 -4.549 -13.966 1.00 0.00 C ATOM 1627 CD LYS A 106 -11.048 -6.044 -14.204 1.00 0.00 C ATOM 1628 CE LYS A 106 -10.052 -6.676 -13.244 1.00 0.00 C ATOM 1629 NZ LYS A 106 -9.816 -8.113 -13.554 1.00 0.00 N ATOM 0 H LYS A 106 -13.506 -3.259 -10.943 1.00 0.00 H new ATOM 0 HA LYS A 106 -10.767 -2.843 -11.843 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.976 -5.036 -12.043 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.126 -4.279 -13.126 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -11.572 -4.070 -14.863 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -10.193 -4.121 -13.782 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -12.022 -6.519 -14.085 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.729 -6.223 -15.231 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -9.107 -6.134 -13.293 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.422 -6.581 -12.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -9.131 -8.506 -12.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.713 -8.635 -13.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -9.439 -8.203 -14.519 1.00 0.00 H new ATOM 1643 N LYS A 107 -13.124 -0.973 -12.824 1.00 0.00 N ATOM 1644 CA LYS A 107 -13.501 0.142 -13.686 1.00 0.00 C ATOM 1645 C LYS A 107 -12.833 1.434 -13.228 1.00 0.00 C ATOM 1646 O LYS A 107 -13.262 2.529 -13.594 1.00 0.00 O ATOM 1647 CB LYS A 107 -15.022 0.316 -13.693 1.00 0.00 C ATOM 1648 CG LYS A 107 -15.564 0.866 -15.001 1.00 0.00 C ATOM 1649 CD LYS A 107 -17.083 0.925 -14.994 1.00 0.00 C ATOM 1650 CE LYS A 107 -17.609 1.884 -16.050 1.00 0.00 C ATOM 1651 NZ LYS A 107 -17.439 1.341 -17.426 1.00 0.00 N ATOM 0 H LYS A 107 -13.705 -1.077 -11.992 1.00 0.00 H new ATOM 0 HA LYS A 107 -13.162 -0.082 -14.697 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -15.491 -0.647 -13.491 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -15.307 0.985 -12.881 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -15.161 1.864 -15.172 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -15.227 0.240 -15.827 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -17.488 -0.071 -15.172 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -17.431 1.239 -14.010 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -18.665 2.083 -15.866 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -17.086 2.837 -15.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -17.810 2.024 -18.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -16.429 1.174 -17.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -17.959 0.445 -17.512 1.00 0.00 H new ATOM 1665 N ILE A 108 -11.781 1.299 -12.427 1.00 0.00 N ATOM 1666 CA ILE A 108 -11.052 2.457 -11.923 1.00 0.00 C ATOM 1667 C ILE A 108 -9.548 2.213 -11.947 1.00 0.00 C ATOM 1668 O ILE A 108 -9.084 1.104 -11.678 1.00 0.00 O ATOM 1669 CB ILE A 108 -11.481 2.809 -10.487 1.00 0.00 C ATOM 1670 CG1 ILE A 108 -11.383 1.577 -9.585 1.00 0.00 C ATOM 1671 CG2 ILE A 108 -12.896 3.368 -10.478 1.00 0.00 C ATOM 1672 CD1 ILE A 108 -11.079 1.907 -8.140 1.00 0.00 C ATOM 0 H ILE A 108 -11.415 0.400 -12.113 1.00 0.00 H new ATOM 0 HA ILE A 108 -11.292 3.292 -12.581 1.00 0.00 H new ATOM 0 HB ILE A 108 -10.807 3.573 -10.100 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -12.322 1.026 -9.633 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -10.606 0.916 -9.969 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.184 3.612 -9.456 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -12.935 4.269 -11.091 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.583 2.625 -10.881 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -11.024 0.986 -7.560 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -10.125 2.431 -8.079 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -11.868 2.542 -7.738 1.00 0.00 H new ATOM 1684 N ALA A 109 -8.789 3.255 -12.269 1.00 0.00 N ATOM 1685 CA ALA A 109 -7.336 3.155 -12.323 1.00 0.00 C ATOM 1686 C ALA A 109 -6.701 3.684 -11.042 1.00 0.00 C ATOM 1687 O ALA A 109 -7.398 4.004 -10.080 1.00 0.00 O ATOM 1688 CB ALA A 109 -6.800 3.910 -13.532 1.00 0.00 C ATOM 0 H ALA A 109 -9.157 4.179 -12.497 1.00 0.00 H new ATOM 0 HA ALA A 109 -7.072 2.102 -12.419 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -5.714 3.827 -13.560 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -7.220 3.484 -14.443 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -7.082 4.960 -13.459 1.00 0.00 H new ATOM 1694 N GLU A 110 -5.374 3.773 -11.038 1.00 0.00 N ATOM 1695 CA GLU A 110 -4.645 4.263 -9.874 1.00 0.00 C ATOM 1696 C GLU A 110 -5.186 5.616 -9.422 1.00 0.00 C ATOM 1697 O GLU A 110 -5.691 5.756 -8.308 1.00 0.00 O ATOM 1698 CB GLU A 110 -3.152 4.377 -10.189 1.00 0.00 C ATOM 1699 CG GLU A 110 -2.293 4.661 -8.969 1.00 0.00 C ATOM 1700 CD GLU A 110 -1.057 5.474 -9.303 1.00 0.00 C ATOM 1701 OE1 GLU A 110 -1.165 6.715 -9.378 1.00 0.00 O ATOM 1702 OE2 GLU A 110 0.019 4.868 -9.488 1.00 0.00 O ATOM 0 H GLU A 110 -4.783 3.512 -11.827 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.784 3.547 -9.064 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.815 3.450 -10.652 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.003 5.171 -10.921 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.886 5.197 -8.228 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -1.991 3.718 -8.514 1.00 0.00 H new ATOM 1709 N VAL A 111 -5.077 6.611 -10.296 1.00 0.00 N ATOM 1710 CA VAL A 111 -5.556 7.954 -9.989 1.00 0.00 C ATOM 1711 C VAL A 111 -6.981 7.920 -9.450 1.00 0.00 C ATOM 1712 O VAL A 111 -7.308 8.617 -8.490 1.00 0.00 O ATOM 1713 CB VAL A 111 -5.510 8.864 -11.231 1.00 0.00 C ATOM 1714 CG1 VAL A 111 -6.241 8.214 -12.396 1.00 0.00 C ATOM 1715 CG2 VAL A 111 -6.101 10.229 -10.914 1.00 0.00 C ATOM 0 H VAL A 111 -4.661 6.513 -11.222 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.892 8.360 -9.226 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.468 9.004 -11.519 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -6.198 8.871 -13.265 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -5.767 7.262 -12.637 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -7.282 8.042 -12.122 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -6.060 10.859 -11.803 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -7.138 10.112 -10.599 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.529 10.696 -10.112 1.00 0.00 H new ATOM 1725 N GLU A 112 -7.825 7.103 -10.073 1.00 0.00 N ATOM 1726 CA GLU A 112 -9.216 6.979 -9.656 1.00 0.00 C ATOM 1727 C GLU A 112 -9.309 6.480 -8.216 1.00 0.00 C ATOM 1728 O GLU A 112 -10.146 6.942 -7.440 1.00 0.00 O ATOM 1729 CB GLU A 112 -9.967 6.026 -10.587 1.00 0.00 C ATOM 1730 CG GLU A 112 -10.520 6.701 -11.832 1.00 0.00 C ATOM 1731 CD GLU A 112 -9.435 7.070 -12.824 1.00 0.00 C ATOM 1732 OE1 GLU A 112 -8.537 6.234 -13.059 1.00 0.00 O ATOM 1733 OE2 GLU A 112 -9.484 8.193 -13.367 1.00 0.00 O ATOM 0 H GLU A 112 -7.569 6.518 -10.868 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.675 7.966 -9.711 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -9.296 5.221 -10.888 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -10.789 5.567 -10.037 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -11.237 6.036 -12.314 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -11.064 7.600 -11.542 1.00 0.00 H new ATOM 1740 N LEU A 113 -8.445 5.533 -7.868 1.00 0.00 N ATOM 1741 CA LEU A 113 -8.429 4.970 -6.522 1.00 0.00 C ATOM 1742 C LEU A 113 -7.960 6.005 -5.504 1.00 0.00 C ATOM 1743 O LEU A 113 -8.478 6.071 -4.388 1.00 0.00 O ATOM 1744 CB LEU A 113 -7.519 3.742 -6.473 1.00 0.00 C ATOM 1745 CG LEU A 113 -7.211 3.189 -5.081 1.00 0.00 C ATOM 1746 CD1 LEU A 113 -8.472 2.641 -4.433 1.00 0.00 C ATOM 1747 CD2 LEU A 113 -6.137 2.114 -5.158 1.00 0.00 C ATOM 0 H LEU A 113 -7.747 5.139 -8.498 1.00 0.00 H new ATOM 0 HA LEU A 113 -9.446 4.672 -6.267 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -7.980 2.950 -7.063 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.576 3.994 -6.959 1.00 0.00 H new ATOM 0 HG LEU A 113 -6.835 4.004 -4.463 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -8.233 2.252 -3.443 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -9.210 3.438 -4.341 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -8.879 1.839 -5.049 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -5.931 1.733 -4.158 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.483 1.299 -5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -5.226 2.540 -5.578 1.00 0.00 H new ATOM 1759 N ILE A 114 -6.980 6.811 -5.897 1.00 0.00 N ATOM 1760 CA ILE A 114 -6.445 7.845 -5.019 1.00 0.00 C ATOM 1761 C ILE A 114 -7.336 9.082 -5.020 1.00 0.00 C ATOM 1762 O ILE A 114 -7.238 9.932 -4.135 1.00 0.00 O ATOM 1763 CB ILE A 114 -5.019 8.253 -5.434 1.00 0.00 C ATOM 1764 CG1 ILE A 114 -4.149 7.012 -5.643 1.00 0.00 C ATOM 1765 CG2 ILE A 114 -4.404 9.168 -4.386 1.00 0.00 C ATOM 1766 CD1 ILE A 114 -2.739 7.330 -6.088 1.00 0.00 C ATOM 0 H ILE A 114 -6.540 6.768 -6.816 1.00 0.00 H new ATOM 0 HA ILE A 114 -6.416 7.422 -4.015 1.00 0.00 H new ATOM 0 HB ILE A 114 -5.073 8.797 -6.377 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -4.109 6.446 -4.712 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -4.620 6.369 -6.387 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -3.396 9.448 -4.693 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -5.014 10.065 -4.283 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -4.360 8.648 -3.429 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -2.180 6.403 -6.216 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -2.769 7.870 -7.035 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -2.250 7.947 -5.334 1.00 0.00 H new ATOM 1778 N ASN A 115 -8.209 9.177 -6.018 1.00 0.00 N ATOM 1779 CA ASN A 115 -9.120 10.309 -6.133 1.00 0.00 C ATOM 1780 C ASN A 115 -10.486 9.971 -5.545 1.00 0.00 C ATOM 1781 O ASN A 115 -11.260 10.860 -5.192 1.00 0.00 O ATOM 1782 CB ASN A 115 -9.271 10.721 -7.599 1.00 0.00 C ATOM 1783 CG ASN A 115 -8.058 11.470 -8.117 1.00 0.00 C ATOM 1784 OD1 ASN A 115 -6.919 11.108 -7.821 1.00 0.00 O ATOM 1785 ND2 ASN A 115 -8.299 12.520 -8.893 1.00 0.00 N ATOM 0 H ASN A 115 -8.304 8.483 -6.759 1.00 0.00 H new ATOM 0 HA ASN A 115 -8.698 11.141 -5.570 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -9.433 9.832 -8.209 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -10.156 11.348 -7.708 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -7.523 13.064 -9.271 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -9.260 12.783 -9.112 1.00 0.00 H new ATOM 1792 N VAL A 116 -10.776 8.677 -5.443 1.00 0.00 N ATOM 1793 CA VAL A 116 -12.048 8.220 -4.896 1.00 0.00 C ATOM 1794 C VAL A 116 -11.886 7.733 -3.461 1.00 0.00 C ATOM 1795 O VAL A 116 -12.605 8.170 -2.561 1.00 0.00 O ATOM 1796 CB VAL A 116 -12.650 7.085 -5.747 1.00 0.00 C ATOM 1797 CG1 VAL A 116 -13.920 6.551 -5.103 1.00 0.00 C ATOM 1798 CG2 VAL A 116 -12.923 7.568 -7.163 1.00 0.00 C ATOM 0 H VAL A 116 -10.147 7.928 -5.732 1.00 0.00 H new ATOM 0 HA VAL A 116 -12.725 9.074 -4.912 1.00 0.00 H new ATOM 0 HB VAL A 116 -11.927 6.271 -5.799 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -14.331 5.750 -5.718 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -13.690 6.164 -4.110 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -14.651 7.355 -5.019 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -13.348 6.754 -7.750 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -13.627 8.400 -7.134 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -11.990 7.897 -7.621 1.00 0.00 H new ATOM 1808 N LEU A 117 -10.937 6.827 -3.253 1.00 0.00 N ATOM 1809 CA LEU A 117 -10.679 6.281 -1.926 1.00 0.00 C ATOM 1810 C LEU A 117 -9.618 7.100 -1.196 1.00 0.00 C ATOM 1811 O LEU A 117 -9.130 6.702 -0.138 1.00 0.00 O ATOM 1812 CB LEU A 117 -10.229 4.822 -2.032 1.00 0.00 C ATOM 1813 CG LEU A 117 -11.329 3.802 -2.327 1.00 0.00 C ATOM 1814 CD1 LEU A 117 -12.448 3.910 -1.303 1.00 0.00 C ATOM 1815 CD2 LEU A 117 -11.870 3.995 -3.736 1.00 0.00 C ATOM 0 H LEU A 117 -10.334 6.455 -3.987 1.00 0.00 H new ATOM 0 HA LEU A 117 -11.606 6.329 -1.354 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -9.475 4.751 -2.816 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.744 4.543 -1.097 1.00 0.00 H new ATOM 0 HG LEU A 117 -10.899 2.803 -2.258 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -13.221 3.176 -1.530 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -12.049 3.720 -0.307 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -12.877 4.911 -1.337 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -12.652 3.261 -3.929 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -12.283 4.999 -3.833 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -11.063 3.864 -4.457 1.00 0.00 H new ATOM 1827 N LYS A 118 -9.268 8.248 -1.766 1.00 0.00 N ATOM 1828 CA LYS A 118 -8.269 9.125 -1.170 1.00 0.00 C ATOM 1829 C LYS A 118 -7.125 8.317 -0.567 1.00 0.00 C ATOM 1830 O LYS A 118 -6.686 8.584 0.552 1.00 0.00 O ATOM 1831 CB LYS A 118 -8.910 10.005 -0.093 1.00 0.00 C ATOM 1832 CG LYS A 118 -9.514 9.215 1.056 1.00 0.00 C ATOM 1833 CD LYS A 118 -9.787 10.102 2.259 1.00 0.00 C ATOM 1834 CE LYS A 118 -9.636 9.334 3.562 1.00 0.00 C ATOM 1835 NZ LYS A 118 -10.010 10.164 4.741 1.00 0.00 N ATOM 0 H LYS A 118 -9.662 8.593 -2.641 1.00 0.00 H new ATOM 0 HA LYS A 118 -7.865 9.761 -1.957 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -8.158 10.688 0.302 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -9.687 10.617 -0.551 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -10.443 8.748 0.729 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -8.836 8.411 1.342 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -9.100 10.948 2.252 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -10.795 10.510 2.190 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -10.262 8.442 3.533 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -8.605 8.997 3.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -9.894 9.605 5.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -9.396 11.003 4.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -11.002 10.465 4.653 1.00 0.00 H new ATOM 1849 N ILE A 119 -6.644 7.330 -1.316 1.00 0.00 N ATOM 1850 CA ILE A 119 -5.550 6.485 -0.856 1.00 0.00 C ATOM 1851 C ILE A 119 -4.204 7.025 -1.327 1.00 0.00 C ATOM 1852 O ILE A 119 -3.795 6.794 -2.464 1.00 0.00 O ATOM 1853 CB ILE A 119 -5.711 5.036 -1.350 1.00 0.00 C ATOM 1854 CG1 ILE A 119 -7.034 4.449 -0.855 1.00 0.00 C ATOM 1855 CG2 ILE A 119 -4.540 4.184 -0.883 1.00 0.00 C ATOM 1856 CD1 ILE A 119 -7.259 3.016 -1.283 1.00 0.00 C ATOM 0 H ILE A 119 -6.995 7.096 -2.245 1.00 0.00 H new ATOM 0 HA ILE A 119 -5.581 6.493 0.234 1.00 0.00 H new ATOM 0 HB ILE A 119 -5.722 5.039 -2.440 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -7.061 4.503 0.233 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -7.855 5.063 -1.225 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -4.668 3.162 -1.240 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -3.611 4.593 -1.280 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -4.501 4.185 0.206 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.216 2.667 -0.896 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -7.265 2.958 -2.371 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -6.458 2.389 -0.891 1.00 0.00 H new ATOM 1868 N ASN A 120 -3.518 7.743 -0.444 1.00 0.00 N ATOM 1869 CA ASN A 120 -2.216 8.314 -0.770 1.00 0.00 C ATOM 1870 C ASN A 120 -1.089 7.393 -0.314 1.00 0.00 C ATOM 1871 O ASN A 120 -0.045 7.303 -0.964 1.00 0.00 O ATOM 1872 CB ASN A 120 -2.061 9.689 -0.116 1.00 0.00 C ATOM 1873 CG ASN A 120 -0.981 10.525 -0.775 1.00 0.00 C ATOM 1874 OD1 ASN A 120 0.193 10.154 -0.776 1.00 0.00 O ATOM 1875 ND2 ASN A 120 -1.376 11.661 -1.340 1.00 0.00 N ATOM 0 H ASN A 120 -3.842 7.943 0.502 1.00 0.00 H new ATOM 0 HA ASN A 120 -2.156 8.424 -1.853 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.011 10.222 -0.167 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -1.824 9.561 0.940 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -0.695 12.266 -1.799 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -2.360 11.928 -1.315 1.00 0.00 H new ATOM 1882 N LEU A 121 -1.305 6.709 0.803 1.00 0.00 N ATOM 1883 CA LEU A 121 -0.308 5.793 1.345 1.00 0.00 C ATOM 1884 C LEU A 121 0.166 4.810 0.278 1.00 0.00 C ATOM 1885 O LEU A 121 -0.640 4.110 -0.336 1.00 0.00 O ATOM 1886 CB LEU A 121 -0.883 5.029 2.539 1.00 0.00 C ATOM 1887 CG LEU A 121 0.065 4.814 3.719 1.00 0.00 C ATOM 1888 CD1 LEU A 121 0.293 6.120 4.464 1.00 0.00 C ATOM 1889 CD2 LEU A 121 -0.485 3.751 4.658 1.00 0.00 C ATOM 0 H LEU A 121 -2.162 6.771 1.352 1.00 0.00 H new ATOM 0 HA LEU A 121 0.547 6.382 1.676 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -1.762 5.564 2.898 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -1.224 4.054 2.191 1.00 0.00 H new ATOM 0 HG LEU A 121 1.023 4.468 3.333 1.00 0.00 H new ATOM 0 HD11 LEU A 121 0.970 5.948 5.301 1.00 0.00 H new ATOM 0 HD12 LEU A 121 0.731 6.853 3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.659 6.496 4.839 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.203 3.611 5.492 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.456 4.068 5.038 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.596 2.811 4.118 1.00 0.00 H new ATOM 1901 N ILE A 122 1.477 4.762 0.066 1.00 0.00 N ATOM 1902 CA ILE A 122 2.057 3.864 -0.924 1.00 0.00 C ATOM 1903 C ILE A 122 1.717 2.410 -0.613 1.00 0.00 C ATOM 1904 O ILE A 122 1.249 1.672 -1.479 1.00 0.00 O ATOM 1905 CB ILE A 122 3.588 4.017 -0.994 1.00 0.00 C ATOM 1906 CG1 ILE A 122 3.963 5.465 -1.317 1.00 0.00 C ATOM 1907 CG2 ILE A 122 4.167 3.070 -2.035 1.00 0.00 C ATOM 1908 CD1 ILE A 122 5.454 5.719 -1.309 1.00 0.00 C ATOM 0 H ILE A 122 2.157 5.334 0.567 1.00 0.00 H new ATOM 0 HA ILE A 122 1.628 4.137 -1.888 1.00 0.00 H new ATOM 0 HB ILE A 122 4.009 3.760 -0.022 1.00 0.00 H new ATOM 0 HG12 ILE A 122 3.564 5.725 -2.297 1.00 0.00 H new ATOM 0 HG13 ILE A 122 3.486 6.126 -0.593 1.00 0.00 H new ATOM 0 HG21 ILE A 122 5.250 3.189 -2.073 1.00 0.00 H new ATOM 0 HG22 ILE A 122 3.925 2.042 -1.766 1.00 0.00 H new ATOM 0 HG23 ILE A 122 3.742 3.300 -3.012 1.00 0.00 H new ATOM 0 HD11 ILE A 122 5.646 6.765 -1.546 1.00 0.00 H new ATOM 0 HD12 ILE A 122 5.857 5.491 -0.322 1.00 0.00 H new ATOM 0 HD13 ILE A 122 5.935 5.084 -2.053 1.00 0.00 H new ATOM 1920 N GLY A 123 1.954 2.006 0.631 1.00 0.00 N ATOM 1921 CA GLY A 123 1.666 0.642 1.036 1.00 0.00 C ATOM 1922 C GLY A 123 0.265 0.207 0.652 1.00 0.00 C ATOM 1923 O GLY A 123 0.090 -0.704 -0.158 1.00 0.00 O ATOM 0 H GLY A 123 2.340 2.599 1.366 1.00 0.00 H new ATOM 0 HA2 GLY A 123 2.391 -0.031 0.577 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.788 0.553 2.116 1.00 0.00 H new ATOM 1927 N HIS A 124 -0.735 0.859 1.234 1.00 0.00 N ATOM 1928 CA HIS A 124 -2.129 0.534 0.949 1.00 0.00 C ATOM 1929 C HIS A 124 -2.396 0.562 -0.553 1.00 0.00 C ATOM 1930 O HIS A 124 -2.903 -0.406 -1.120 1.00 0.00 O ATOM 1931 CB HIS A 124 -3.060 1.514 1.663 1.00 0.00 C ATOM 1932 CG HIS A 124 -2.898 1.517 3.152 1.00 0.00 C ATOM 1933 ND1 HIS A 124 -3.639 2.326 3.988 1.00 0.00 N ATOM 1934 CD2 HIS A 124 -2.073 0.804 3.955 1.00 0.00 C ATOM 1935 CE1 HIS A 124 -3.277 2.110 5.240 1.00 0.00 C ATOM 1936 NE2 HIS A 124 -2.328 1.191 5.247 1.00 0.00 N ATOM 0 H HIS A 124 -0.607 1.616 1.906 1.00 0.00 H new ATOM 0 HA HIS A 124 -2.324 -0.473 1.317 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -2.876 2.519 1.284 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -4.093 1.265 1.419 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -1.349 0.068 3.638 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -3.687 2.601 6.110 1.00 0.00 H new ATOM 0 HE2 HIS A 124 -1.861 0.828 6.078 1.00 0.00 H new ATOM 1944 N ARG A 125 -2.055 1.678 -1.190 1.00 0.00 N ATOM 1945 CA ARG A 125 -2.260 1.832 -2.624 1.00 0.00 C ATOM 1946 C ARG A 125 -1.598 0.693 -3.394 1.00 0.00 C ATOM 1947 O ARG A 125 -2.041 0.324 -4.482 1.00 0.00 O ATOM 1948 CB ARG A 125 -1.702 3.175 -3.099 1.00 0.00 C ATOM 1949 CG ARG A 125 -1.646 3.310 -4.612 1.00 0.00 C ATOM 1950 CD ARG A 125 -0.297 2.875 -5.161 1.00 0.00 C ATOM 1951 NE ARG A 125 0.193 3.782 -6.195 1.00 0.00 N ATOM 1952 CZ ARG A 125 0.862 4.900 -5.934 1.00 0.00 C ATOM 1953 NH1 ARG A 125 1.120 5.245 -4.681 1.00 0.00 N ATOM 1954 NH2 ARG A 125 1.275 5.675 -6.930 1.00 0.00 N ATOM 0 H ARG A 125 -1.635 2.489 -0.735 1.00 0.00 H new ATOM 0 HA ARG A 125 -3.332 1.803 -2.817 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -2.317 3.978 -2.693 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -0.699 3.306 -2.694 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -2.435 2.707 -5.062 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -1.838 4.346 -4.893 1.00 0.00 H new ATOM 0 HD2 ARG A 125 0.427 2.828 -4.348 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -0.381 1.869 -5.572 1.00 0.00 H new ATOM 0 HE ARG A 125 0.012 3.545 -7.170 1.00 0.00 H new ATOM 0 HH11 ARG A 125 0.805 4.652 -3.913 1.00 0.00 H new ATOM 0 HH12 ARG A 125 1.634 6.104 -4.484 1.00 0.00 H new ATOM 0 HH21 ARG A 125 1.079 5.412 -7.896 1.00 0.00 H new ATOM 0 HH22 ARG A 125 1.788 6.533 -6.729 1.00 0.00 H new ATOM 1968 N LYS A 126 -0.534 0.140 -2.822 1.00 0.00 N ATOM 1969 CA LYS A 126 0.190 -0.957 -3.453 1.00 0.00 C ATOM 1970 C LYS A 126 -0.595 -2.261 -3.344 1.00 0.00 C ATOM 1971 O LYS A 126 -1.002 -2.836 -4.353 1.00 0.00 O ATOM 1972 CB LYS A 126 1.567 -1.124 -2.807 1.00 0.00 C ATOM 1973 CG LYS A 126 2.503 -2.026 -3.594 1.00 0.00 C ATOM 1974 CD LYS A 126 3.413 -1.224 -4.509 1.00 0.00 C ATOM 1975 CE LYS A 126 2.640 -0.619 -5.671 1.00 0.00 C ATOM 1976 NZ LYS A 126 2.206 0.777 -5.382 1.00 0.00 N ATOM 0 H LYS A 126 -0.154 0.434 -1.922 1.00 0.00 H new ATOM 0 HA LYS A 126 0.317 -0.716 -4.509 1.00 0.00 H new ATOM 0 HB2 LYS A 126 2.029 -0.143 -2.697 1.00 0.00 H new ATOM 0 HB3 LYS A 126 1.441 -1.532 -1.804 1.00 0.00 H new ATOM 0 HG2 LYS A 126 3.107 -2.615 -2.904 1.00 0.00 H new ATOM 0 HG3 LYS A 126 1.918 -2.730 -4.187 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.896 -0.430 -3.939 1.00 0.00 H new ATOM 0 HD3 LYS A 126 4.204 -1.868 -4.893 1.00 0.00 H new ATOM 0 HE2 LYS A 126 3.263 -0.628 -6.565 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.766 -1.234 -5.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 1.480 1.064 -6.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 1.811 0.826 -4.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.023 1.416 -5.454 1.00 0.00 H new ATOM 1990 N ARG A 127 -0.804 -2.720 -2.114 1.00 0.00 N ATOM 1991 CA ARG A 127 -1.541 -3.955 -1.875 1.00 0.00 C ATOM 1992 C ARG A 127 -2.841 -3.976 -2.674 1.00 0.00 C ATOM 1993 O ARG A 127 -3.217 -5.004 -3.238 1.00 0.00 O ATOM 1994 CB ARG A 127 -1.844 -4.113 -0.384 1.00 0.00 C ATOM 1995 CG ARG A 127 -2.417 -2.859 0.257 1.00 0.00 C ATOM 1996 CD ARG A 127 -2.870 -3.120 1.684 1.00 0.00 C ATOM 1997 NE ARG A 127 -1.828 -2.804 2.657 1.00 0.00 N ATOM 1998 CZ ARG A 127 -0.908 -3.674 3.057 1.00 0.00 C ATOM 1999 NH1 ARG A 127 -0.902 -4.908 2.572 1.00 0.00 N ATOM 2000 NH2 ARG A 127 0.009 -3.310 3.946 1.00 0.00 N ATOM 0 H ARG A 127 -0.473 -2.255 -1.268 1.00 0.00 H new ATOM 0 HA ARG A 127 -0.920 -4.788 -2.203 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -2.549 -4.934 -0.250 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -0.928 -4.391 0.137 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -1.665 -2.070 0.251 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -3.260 -2.500 -0.333 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -3.757 -2.524 1.897 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -3.157 -4.167 1.787 1.00 0.00 H new ATOM 0 HE ARG A 127 -1.806 -1.863 3.051 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -1.605 -5.191 1.890 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -0.194 -5.574 2.881 1.00 0.00 H new ATOM 0 HH21 ARG A 127 0.007 -2.362 4.322 1.00 0.00 H new ATOM 0 HH22 ARG A 127 0.715 -3.979 4.253 1.00 0.00 H new ATOM 2014 N ILE A 128 -3.521 -2.835 -2.718 1.00 0.00 N ATOM 2015 CA ILE A 128 -4.778 -2.724 -3.447 1.00 0.00 C ATOM 2016 C ILE A 128 -4.543 -2.754 -4.954 1.00 0.00 C ATOM 2017 O ILE A 128 -5.174 -3.525 -5.677 1.00 0.00 O ATOM 2018 CB ILE A 128 -5.528 -1.429 -3.082 1.00 0.00 C ATOM 2019 CG1 ILE A 128 -5.880 -1.422 -1.593 1.00 0.00 C ATOM 2020 CG2 ILE A 128 -6.783 -1.288 -3.929 1.00 0.00 C ATOM 2021 CD1 ILE A 128 -6.799 -0.287 -1.195 1.00 0.00 C ATOM 0 H ILE A 128 -3.223 -1.975 -2.258 1.00 0.00 H new ATOM 0 HA ILE A 128 -5.387 -3.581 -3.159 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.878 -0.579 -3.287 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.353 -2.369 -1.335 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -4.961 -1.356 -1.011 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -7.302 -0.368 -3.660 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -6.508 -1.254 -4.983 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -7.439 -2.140 -3.752 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -7.006 -0.344 -0.126 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -6.320 0.666 -1.421 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -7.734 -0.364 -1.750 1.00 0.00 H new ATOM 2033 N LEU A 129 -3.630 -1.910 -5.422 1.00 0.00 N ATOM 2034 CA LEU A 129 -3.309 -1.840 -6.843 1.00 0.00 C ATOM 2035 C LEU A 129 -3.006 -3.227 -7.401 1.00 0.00 C ATOM 2036 O LEU A 129 -3.520 -3.610 -8.452 1.00 0.00 O ATOM 2037 CB LEU A 129 -2.114 -0.913 -7.072 1.00 0.00 C ATOM 2038 CG LEU A 129 -1.634 -0.781 -8.516 1.00 0.00 C ATOM 2039 CD1 LEU A 129 -2.744 -0.232 -9.399 1.00 0.00 C ATOM 2040 CD2 LEU A 129 -0.401 0.109 -8.590 1.00 0.00 C ATOM 0 H LEU A 129 -3.099 -1.264 -4.838 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.177 -1.439 -7.367 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.374 0.080 -6.705 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.282 -1.269 -6.465 1.00 0.00 H new ATOM 0 HG LEU A 129 -1.364 -1.772 -8.881 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.384 -0.145 -10.424 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.599 -0.908 -9.371 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.046 0.750 -9.036 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.073 0.191 -9.626 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.644 1.100 -8.206 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.398 -0.326 -7.990 1.00 0.00 H new ATOM 2052 N ALA A 130 -2.169 -3.975 -6.690 1.00 0.00 N ATOM 2053 CA ALA A 130 -1.801 -5.321 -7.113 1.00 0.00 C ATOM 2054 C ALA A 130 -2.973 -6.285 -6.958 1.00 0.00 C ATOM 2055 O ALA A 130 -3.233 -7.108 -7.836 1.00 0.00 O ATOM 2056 CB ALA A 130 -0.601 -5.814 -6.318 1.00 0.00 C ATOM 0 H ALA A 130 -1.733 -3.672 -5.819 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.533 -5.283 -8.169 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -0.337 -6.820 -6.644 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.244 -5.146 -6.483 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.849 -5.830 -5.257 1.00 0.00 H new ATOM 2062 N SER A 131 -3.676 -6.178 -5.834 1.00 0.00 N ATOM 2063 CA SER A 131 -4.817 -7.044 -5.562 1.00 0.00 C ATOM 2064 C SER A 131 -5.867 -6.921 -6.663 1.00 0.00 C ATOM 2065 O SER A 131 -6.566 -7.884 -6.982 1.00 0.00 O ATOM 2066 CB SER A 131 -5.438 -6.694 -4.209 1.00 0.00 C ATOM 2067 OG SER A 131 -6.512 -7.566 -3.899 1.00 0.00 O ATOM 0 H SER A 131 -3.475 -5.501 -5.098 1.00 0.00 H new ATOM 0 HA SER A 131 -4.462 -8.074 -5.536 1.00 0.00 H new ATOM 0 HB2 SER A 131 -4.678 -6.756 -3.430 1.00 0.00 H new ATOM 0 HB3 SER A 131 -5.795 -5.664 -4.225 1.00 0.00 H new ATOM 0 HG SER A 131 -6.199 -8.267 -3.290 1.00 0.00 H new ATOM 2073 N LEU A 132 -5.973 -5.729 -7.239 1.00 0.00 N ATOM 2074 CA LEU A 132 -6.938 -5.477 -8.305 1.00 0.00 C ATOM 2075 C LEU A 132 -6.402 -5.958 -9.650 1.00 0.00 C ATOM 2076 O LEU A 132 -7.070 -6.702 -10.365 1.00 0.00 O ATOM 2077 CB LEU A 132 -7.269 -3.986 -8.379 1.00 0.00 C ATOM 2078 CG LEU A 132 -8.107 -3.427 -7.229 1.00 0.00 C ATOM 2079 CD1 LEU A 132 -8.340 -1.935 -7.415 1.00 0.00 C ATOM 2080 CD2 LEU A 132 -9.432 -4.167 -7.124 1.00 0.00 C ATOM 0 H LEU A 132 -5.403 -4.922 -6.986 1.00 0.00 H new ATOM 0 HA LEU A 132 -7.847 -6.033 -8.077 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -6.334 -3.428 -8.425 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -7.798 -3.798 -9.313 1.00 0.00 H new ATOM 0 HG LEU A 132 -7.558 -3.575 -6.299 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -8.938 -1.554 -6.587 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.381 -1.417 -7.438 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -8.868 -1.763 -8.353 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -10.014 -3.755 -6.300 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.988 -4.052 -8.055 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -9.244 -5.225 -6.942 1.00 0.00 H new ATOM 2092 N GLY A 133 -5.189 -5.528 -9.985 1.00 0.00 N ATOM 2093 CA GLY A 133 -4.582 -5.927 -11.242 1.00 0.00 C ATOM 2094 C GLY A 133 -4.828 -4.921 -12.348 1.00 0.00 C ATOM 2095 O GLY A 133 -5.912 -4.878 -12.929 1.00 0.00 O ATOM 0 H GLY A 133 -4.616 -4.911 -9.409 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -3.508 -6.052 -11.100 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -4.979 -6.897 -11.542 1.00 0.00 H new ATOM 2099 N ASP A 134 -3.818 -4.107 -12.641 1.00 0.00 N ATOM 2100 CA ASP A 134 -3.930 -3.096 -13.684 1.00 0.00 C ATOM 2101 C ASP A 134 -3.062 -3.458 -14.886 1.00 0.00 C ATOM 2102 O ASP A 134 -3.377 -3.100 -16.021 1.00 0.00 O ATOM 2103 CB ASP A 134 -3.524 -1.724 -13.141 1.00 0.00 C ATOM 2104 CG ASP A 134 -3.370 -0.690 -14.238 1.00 0.00 C ATOM 2105 OD1 ASP A 134 -4.286 -0.575 -15.078 1.00 0.00 O ATOM 2106 OD2 ASP A 134 -2.332 0.006 -14.257 1.00 0.00 O ATOM 0 H ASP A 134 -2.913 -4.129 -12.170 1.00 0.00 H new ATOM 0 HA ASP A 134 -4.970 -3.056 -14.007 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -4.273 -1.383 -12.427 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -2.584 -1.815 -12.597 1.00 0.00 H new ATOM 2111 N ARG A 135 -1.968 -4.167 -14.628 1.00 0.00 N ATOM 2112 CA ARG A 135 -1.055 -4.575 -15.688 1.00 0.00 C ATOM 2113 C ARG A 135 -1.473 -5.917 -16.279 1.00 0.00 C ATOM 2114 O ARG A 135 -1.173 -6.218 -17.434 1.00 0.00 O ATOM 2115 CB ARG A 135 0.375 -4.664 -15.151 1.00 0.00 C ATOM 2116 CG ARG A 135 0.546 -5.690 -14.042 1.00 0.00 C ATOM 2117 CD ARG A 135 1.977 -6.202 -13.972 1.00 0.00 C ATOM 2118 NE ARG A 135 2.078 -7.442 -13.209 1.00 0.00 N ATOM 2119 CZ ARG A 135 3.229 -8.046 -12.935 1.00 0.00 C ATOM 2120 NH1 ARG A 135 4.371 -7.524 -13.359 1.00 0.00 N ATOM 2121 NH2 ARG A 135 3.239 -9.172 -12.233 1.00 0.00 N ATOM 0 H ARG A 135 -1.693 -4.471 -13.694 1.00 0.00 H new ATOM 0 HA ARG A 135 -1.094 -3.823 -16.477 1.00 0.00 H new ATOM 0 HB2 ARG A 135 1.048 -4.913 -15.972 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.676 -3.685 -14.778 1.00 0.00 H new ATOM 0 HG2 ARG A 135 0.271 -5.244 -13.086 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -0.133 -6.526 -14.210 1.00 0.00 H new ATOM 0 HD2 ARG A 135 2.353 -6.366 -14.982 1.00 0.00 H new ATOM 0 HD3 ARG A 135 2.612 -5.443 -13.515 1.00 0.00 H new ATOM 0 HE ARG A 135 1.217 -7.869 -12.867 1.00 0.00 H new ATOM 0 HH11 ARG A 135 4.367 -6.657 -13.897 1.00 0.00 H new ATOM 0 HH12 ARG A 135 5.254 -7.989 -13.148 1.00 0.00 H new ATOM 0 HH21 ARG A 135 2.362 -9.575 -11.903 1.00 0.00 H new ATOM 0 HH22 ARG A 135 4.124 -9.635 -12.023 1.00 0.00 H new TER 2135 ARG A 135