USER MOD reduce.3.24.130724 H: found=0, std=0, add=1045, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 853 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 76 ASN : amide:sc= -0.03 K(o=-0.03,f=-4.8!) USER MOD Set 1.2: A 112 SER OG : rot 140:sc= 0 USER MOD Single : A 3 SER OG : rot 148:sc= 1.41 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= -0.266 X(o=-0.27,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.0981 X(o=-0.098,f=-0.02) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -150:sc= -0.0185 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.774) USER MOD Single : A 55 TYR OH : rot 30:sc= 0 USER MOD Single : A 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.403 K(o=-0.4,f=-6.7!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.236 K(o=-0.24,f=-1.5) USER MOD Single : A 72 THR OG1 : rot 57:sc= 0.186 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 85 LYS NZ :NH3+ 161:sc= -0.0153 (180deg=-0.178) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.0566 K(o=-0.057,f=-1.3!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0.082) USER MOD Single : A 103 GLN : amide:sc= -0.0911 K(o=-0.091,f=-0.99!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.0585 K(o=-0.059,f=-1.1!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 57:sc= 0.137 USER MOD Single : A 114 SER OG : rot 130:sc= 0.173 USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 123 ASN : amide:sc= 0.406 X(o=0.41,f=-0.046) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 29 N SER A 3 -13.287 15.094 12.277 1.00 0.00 N ATOM 30 CA SER A 3 -12.561 16.028 11.397 1.00 0.00 C ATOM 31 C SER A 3 -12.710 15.736 9.894 1.00 0.00 C ATOM 32 O SER A 3 -13.269 16.547 9.149 1.00 0.00 O ATOM 33 CB SER A 3 -11.078 15.992 11.794 1.00 0.00 C ATOM 34 OG SER A 3 -10.649 14.636 11.858 1.00 0.00 O ATOM 0 HA SER A 3 -13.000 17.016 11.539 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.480 16.542 11.067 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.934 16.478 12.759 1.00 0.00 H new ATOM 0 HG SER A 3 -9.706 14.579 11.597 1.00 0.00 H new ATOM 39 N ILE A 4 -12.215 14.575 9.454 1.00 0.00 N ATOM 40 CA ILE A 4 -12.256 14.086 8.066 1.00 0.00 C ATOM 41 C ILE A 4 -12.298 12.551 7.996 1.00 0.00 C ATOM 42 O ILE A 4 -13.038 12.018 7.171 1.00 0.00 O ATOM 43 CB ILE A 4 -11.075 14.603 7.193 1.00 0.00 C ATOM 44 CG1 ILE A 4 -9.829 15.145 7.934 1.00 0.00 C ATOM 45 CG2 ILE A 4 -11.568 15.588 6.123 1.00 0.00 C ATOM 46 CD1 ILE A 4 -9.753 16.634 8.279 1.00 0.00 C ATOM 0 H ILE A 4 -11.753 13.918 10.082 1.00 0.00 H new ATOM 0 HA ILE A 4 -13.180 14.493 7.656 1.00 0.00 H new ATOM 0 HB ILE A 4 -10.697 13.696 6.722 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.733 14.587 8.866 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -8.956 14.904 7.327 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -10.722 15.933 5.528 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -12.289 15.090 5.474 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -12.044 16.442 6.606 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -8.815 16.840 8.795 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -9.800 17.223 7.363 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -10.589 16.901 8.925 1.00 0.00 H new ATOM 57 N VAL A 5 -11.545 11.858 8.871 1.00 0.00 N ATOM 58 CA VAL A 5 -11.526 10.390 9.078 1.00 0.00 C ATOM 59 C VAL A 5 -11.798 9.550 7.814 1.00 0.00 C ATOM 60 O VAL A 5 -12.903 9.046 7.598 1.00 0.00 O ATOM 61 CB VAL A 5 -12.405 9.969 10.278 1.00 0.00 C ATOM 62 CG1 VAL A 5 -11.745 10.433 11.584 1.00 0.00 C ATOM 63 CG2 VAL A 5 -13.838 10.516 10.255 1.00 0.00 C ATOM 0 H VAL A 5 -10.892 12.334 9.493 1.00 0.00 H new ATOM 0 HA VAL A 5 -10.492 10.154 9.328 1.00 0.00 H new ATOM 0 HB VAL A 5 -12.480 8.884 10.209 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -12.365 10.136 12.430 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -10.760 9.975 11.677 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.641 11.518 11.573 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -14.375 10.166 11.137 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -13.812 11.606 10.255 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -14.347 10.165 9.357 1.00 0.00 H new ATOM 73 N LEU A 6 -10.772 9.435 6.958 1.00 0.00 N ATOM 74 CA LEU A 6 -10.802 8.706 5.682 1.00 0.00 C ATOM 75 C LEU A 6 -11.486 7.328 5.768 1.00 0.00 C ATOM 76 O LEU A 6 -11.355 6.597 6.753 1.00 0.00 O ATOM 77 CB LEU A 6 -9.365 8.569 5.127 1.00 0.00 C ATOM 78 CG LEU A 6 -9.101 9.396 3.862 1.00 0.00 C ATOM 79 CD1 LEU A 6 -7.607 9.395 3.543 1.00 0.00 C ATOM 80 CD2 LEU A 6 -9.858 8.831 2.656 1.00 0.00 C ATOM 0 H LEU A 6 -9.865 9.863 7.143 1.00 0.00 H new ATOM 0 HA LEU A 6 -11.414 9.295 4.999 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.658 8.871 5.900 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -9.170 7.519 4.909 1.00 0.00 H new ATOM 0 HG LEU A 6 -9.449 10.411 4.054 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -7.427 9.984 2.644 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -7.056 9.829 4.378 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -7.270 8.371 3.380 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -9.649 9.440 1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -9.536 7.806 2.472 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -10.929 8.844 2.860 1.00 0.00 H new ATOM 91 N GLU A 7 -12.218 6.970 4.712 1.00 0.00 N ATOM 92 CA GLU A 7 -12.993 5.727 4.666 1.00 0.00 C ATOM 93 C GLU A 7 -12.114 4.464 4.748 1.00 0.00 C ATOM 94 O GLU A 7 -10.974 4.467 4.264 1.00 0.00 O ATOM 95 CB GLU A 7 -13.856 5.700 3.394 1.00 0.00 C ATOM 96 CG GLU A 7 -15.202 6.419 3.592 1.00 0.00 C ATOM 97 CD GLU A 7 -16.392 5.457 3.410 1.00 0.00 C ATOM 98 OE1 GLU A 7 -16.692 5.067 2.254 1.00 0.00 O ATOM 99 OE2 GLU A 7 -17.047 5.091 4.419 1.00 0.00 O ATOM 0 H GLU A 7 -12.291 7.533 3.864 1.00 0.00 H new ATOM 0 HA GLU A 7 -13.632 5.714 5.549 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.311 6.171 2.576 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.038 4.666 3.102 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.237 6.858 4.589 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -15.285 7.240 2.880 1.00 0.00 H new ATOM 104 N PRO A 8 -12.649 3.361 5.310 1.00 0.00 N ATOM 105 CA PRO A 8 -11.947 2.089 5.329 1.00 0.00 C ATOM 106 C PRO A 8 -11.770 1.570 3.901 1.00 0.00 C ATOM 107 O PRO A 8 -12.693 1.646 3.088 1.00 0.00 O ATOM 108 CB PRO A 8 -12.778 1.145 6.205 1.00 0.00 C ATOM 109 CG PRO A 8 -14.169 1.778 6.289 1.00 0.00 C ATOM 110 CD PRO A 8 -13.991 3.234 5.862 1.00 0.00 C ATOM 0 HA PRO A 8 -10.943 2.177 5.743 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -12.827 0.147 5.769 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -12.336 1.038 7.195 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -14.873 1.262 5.636 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -14.567 1.713 7.302 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -14.740 3.511 5.120 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -14.122 3.903 6.713 1.00 0.00 H new ATOM 115 N ILE A 9 -10.590 1.042 3.580 1.00 0.00 N ATOM 116 CA ILE A 9 -10.321 0.419 2.277 1.00 0.00 C ATOM 117 C ILE A 9 -10.870 -1.006 2.306 1.00 0.00 C ATOM 118 O ILE A 9 -10.448 -1.820 3.126 1.00 0.00 O ATOM 119 CB ILE A 9 -8.815 0.388 1.953 1.00 0.00 C ATOM 120 CG1 ILE A 9 -8.081 1.730 2.176 1.00 0.00 C ATOM 121 CG2 ILE A 9 -8.568 -0.150 0.534 1.00 0.00 C ATOM 122 CD1 ILE A 9 -8.501 2.866 1.233 1.00 0.00 C ATOM 0 H ILE A 9 -9.791 1.032 4.213 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.807 1.010 1.500 1.00 0.00 H new ATOM 0 HB ILE A 9 -8.379 -0.299 2.678 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -8.248 2.051 3.204 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -7.010 1.563 2.064 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -7.497 -0.162 0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.963 -1.163 0.455 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -9.068 0.492 -0.191 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.930 3.764 1.469 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -8.307 2.573 0.201 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.565 3.069 1.359 1.00 0.00 H new ATOM 133 N TYR A 10 -11.791 -1.316 1.400 1.00 0.00 N ATOM 134 CA TYR A 10 -12.473 -2.603 1.298 1.00 0.00 C ATOM 135 C TYR A 10 -11.910 -3.407 0.112 1.00 0.00 C ATOM 136 O TYR A 10 -12.495 -3.403 -0.970 1.00 0.00 O ATOM 137 CB TYR A 10 -14.001 -2.359 1.228 1.00 0.00 C ATOM 138 CG TYR A 10 -14.440 -1.214 0.323 1.00 0.00 C ATOM 139 CD1 TYR A 10 -14.436 0.108 0.808 1.00 0.00 C ATOM 140 CD2 TYR A 10 -14.795 -1.452 -1.013 1.00 0.00 C ATOM 141 CE1 TYR A 10 -14.673 1.191 -0.060 1.00 0.00 C ATOM 142 CE2 TYR A 10 -15.071 -0.379 -1.881 1.00 0.00 C ATOM 143 CZ TYR A 10 -14.968 0.949 -1.419 1.00 0.00 C ATOM 144 OH TYR A 10 -15.149 1.986 -2.280 1.00 0.00 O ATOM 0 H TYR A 10 -12.096 -0.652 0.688 1.00 0.00 H new ATOM 0 HA TYR A 10 -12.291 -3.215 2.181 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -14.483 -3.275 0.886 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -14.367 -2.164 2.236 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -14.249 0.293 1.856 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -14.857 -2.466 -1.378 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -14.629 2.204 0.313 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -15.362 -0.573 -2.903 1.00 0.00 H new ATOM 0 HH TYR A 10 -15.343 1.638 -3.175 1.00 0.00 H new ATOM 153 N TRP A 11 -10.788 -4.125 0.296 1.00 0.00 N ATOM 154 CA TRP A 11 -10.205 -4.988 -0.761 1.00 0.00 C ATOM 155 C TRP A 11 -11.200 -6.034 -1.320 1.00 0.00 C ATOM 156 O TRP A 11 -10.995 -6.580 -2.404 1.00 0.00 O ATOM 157 CB TRP A 11 -8.913 -5.680 -0.278 1.00 0.00 C ATOM 158 CG TRP A 11 -7.636 -5.345 -1.001 1.00 0.00 C ATOM 159 CD1 TRP A 11 -6.541 -4.787 -0.432 1.00 0.00 C ATOM 160 CD2 TRP A 11 -7.273 -5.568 -2.407 1.00 0.00 C ATOM 161 NE1 TRP A 11 -5.552 -4.623 -1.380 1.00 0.00 N ATOM 162 CE2 TRP A 11 -5.956 -5.060 -2.619 1.00 0.00 C ATOM 163 CE3 TRP A 11 -7.906 -6.144 -3.531 1.00 0.00 C ATOM 164 CZ2 TRP A 11 -5.327 -5.076 -3.874 1.00 0.00 C ATOM 165 CZ3 TRP A 11 -7.283 -6.164 -4.796 1.00 0.00 C ATOM 166 CH2 TRP A 11 -6.000 -5.625 -4.974 1.00 0.00 C ATOM 0 H TRP A 11 -10.261 -4.128 1.169 1.00 0.00 H new ATOM 0 HA TRP A 11 -9.959 -4.316 -1.583 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -8.776 -5.440 0.776 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -9.064 -6.758 -0.342 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -6.455 -4.511 0.609 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -4.633 -4.226 -1.185 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -8.888 -6.578 -3.419 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -4.333 -4.669 -3.991 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -7.800 -6.600 -5.638 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -5.536 -5.633 -5.949 1.00 0.00 H new ATOM 176 N ASN A 12 -12.310 -6.297 -0.618 1.00 0.00 N ATOM 177 CA ASN A 12 -13.464 -7.037 -1.142 1.00 0.00 C ATOM 178 C ASN A 12 -13.965 -6.531 -2.516 1.00 0.00 C ATOM 179 O ASN A 12 -14.430 -7.326 -3.336 1.00 0.00 O ATOM 180 CB ASN A 12 -14.598 -6.935 -0.106 1.00 0.00 C ATOM 181 CG ASN A 12 -15.743 -7.881 -0.432 1.00 0.00 C ATOM 182 OD1 ASN A 12 -16.737 -7.512 -1.043 1.00 0.00 O ATOM 183 ND2 ASN A 12 -15.630 -9.131 -0.042 1.00 0.00 N ATOM 0 H ASN A 12 -12.433 -5.995 0.349 1.00 0.00 H new ATOM 0 HA ASN A 12 -13.149 -8.068 -1.305 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -14.207 -7.164 0.885 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -14.970 -5.911 -0.073 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -16.373 -9.799 -0.248 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -14.799 -9.433 0.467 1.00 0.00 H new ATOM 189 N SER A 13 -13.852 -5.224 -2.765 1.00 0.00 N ATOM 190 CA SER A 13 -14.291 -4.528 -3.981 1.00 0.00 C ATOM 191 C SER A 13 -13.191 -3.567 -4.471 1.00 0.00 C ATOM 192 O SER A 13 -12.011 -3.742 -4.146 1.00 0.00 O ATOM 193 CB SER A 13 -15.622 -3.809 -3.690 1.00 0.00 C ATOM 194 OG SER A 13 -16.468 -3.834 -4.827 1.00 0.00 O ATOM 0 H SER A 13 -13.430 -4.587 -2.089 1.00 0.00 H new ATOM 0 HA SER A 13 -14.463 -5.240 -4.788 1.00 0.00 H new ATOM 0 HB2 SER A 13 -16.123 -4.288 -2.848 1.00 0.00 H new ATOM 0 HB3 SER A 13 -15.427 -2.777 -3.399 1.00 0.00 H new ATOM 0 HG SER A 13 -17.308 -3.374 -4.620 1.00 0.00 H new ATOM 199 N SER A 14 -13.541 -2.567 -5.285 1.00 0.00 N ATOM 200 CA SER A 14 -12.633 -1.475 -5.685 1.00 0.00 C ATOM 201 C SER A 14 -12.129 -0.631 -4.495 1.00 0.00 C ATOM 202 O SER A 14 -12.566 -0.796 -3.358 1.00 0.00 O ATOM 203 CB SER A 14 -13.333 -0.574 -6.711 1.00 0.00 C ATOM 204 OG SER A 14 -13.650 -1.321 -7.876 1.00 0.00 O ATOM 0 H SER A 14 -14.473 -2.487 -5.692 1.00 0.00 H new ATOM 0 HA SER A 14 -11.752 -1.941 -6.127 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.242 -0.155 -6.279 1.00 0.00 H new ATOM 0 HB3 SER A 14 -12.687 0.265 -6.971 1.00 0.00 H new ATOM 0 HG SER A 14 -14.098 -0.740 -8.526 1.00 0.00 H new ATOM 209 N ASN A 15 -11.206 0.303 -4.741 1.00 0.00 N ATOM 210 CA ASN A 15 -10.719 1.254 -3.733 1.00 0.00 C ATOM 211 C ASN A 15 -11.599 2.521 -3.661 1.00 0.00 C ATOM 212 O ASN A 15 -12.375 2.794 -4.577 1.00 0.00 O ATOM 213 CB ASN A 15 -9.258 1.591 -4.075 1.00 0.00 C ATOM 214 CG ASN A 15 -8.338 0.391 -3.877 1.00 0.00 C ATOM 215 OD1 ASN A 15 -8.161 -0.440 -4.757 1.00 0.00 O ATOM 216 ND2 ASN A 15 -7.729 0.264 -2.721 1.00 0.00 N ATOM 0 H ASN A 15 -10.770 0.423 -5.655 1.00 0.00 H new ATOM 0 HA ASN A 15 -10.775 0.803 -2.742 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -9.196 1.930 -5.109 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -8.919 2.416 -3.448 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.108 -0.528 -2.556 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -7.877 0.957 -1.988 1.00 0.00 H new ATOM 222 N SER A 16 -11.435 3.348 -2.614 1.00 0.00 N ATOM 223 CA SER A 16 -12.102 4.664 -2.526 1.00 0.00 C ATOM 224 C SER A 16 -11.727 5.576 -3.701 1.00 0.00 C ATOM 225 O SER A 16 -12.601 6.184 -4.329 1.00 0.00 O ATOM 226 CB SER A 16 -11.760 5.357 -1.198 1.00 0.00 C ATOM 227 OG SER A 16 -12.388 6.627 -1.114 1.00 0.00 O ATOM 0 H SER A 16 -10.844 3.129 -1.812 1.00 0.00 H new ATOM 0 HA SER A 16 -13.176 4.483 -2.571 1.00 0.00 H new ATOM 0 HB2 SER A 16 -12.080 4.732 -0.364 1.00 0.00 H new ATOM 0 HB3 SER A 16 -10.680 5.474 -1.112 1.00 0.00 H new ATOM 0 HG SER A 16 -12.158 7.050 -0.260 1.00 0.00 H new ATOM 232 N LYS A 17 -10.430 5.630 -4.049 1.00 0.00 N ATOM 233 CA LYS A 17 -9.945 6.434 -5.179 1.00 0.00 C ATOM 234 C LYS A 17 -10.254 5.833 -6.549 1.00 0.00 C ATOM 235 O LYS A 17 -10.467 6.602 -7.483 1.00 0.00 O ATOM 236 CB LYS A 17 -8.441 6.739 -5.026 1.00 0.00 C ATOM 237 CG LYS A 17 -8.135 8.178 -5.463 1.00 0.00 C ATOM 238 CD LYS A 17 -8.661 9.202 -4.435 1.00 0.00 C ATOM 239 CE LYS A 17 -8.547 10.631 -4.975 1.00 0.00 C ATOM 240 NZ LYS A 17 -9.879 11.288 -5.053 1.00 0.00 N ATOM 0 H LYS A 17 -9.695 5.121 -3.558 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.503 7.370 -5.143 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.139 6.596 -3.988 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.860 6.039 -5.626 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -7.059 8.302 -5.585 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.590 8.369 -6.435 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.702 8.982 -4.197 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -8.096 9.114 -3.507 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.889 11.214 -4.331 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.090 10.613 -5.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -9.769 12.254 -5.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -10.498 10.744 -5.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -10.303 11.326 -4.104 1.00 0.00 H new ATOM 250 N PHE A 18 -10.300 4.495 -6.645 1.00 0.00 N ATOM 251 CA PHE A 18 -10.608 3.719 -7.859 1.00 0.00 C ATOM 252 C PHE A 18 -10.063 4.388 -9.137 1.00 0.00 C ATOM 253 O PHE A 18 -10.816 4.898 -9.970 1.00 0.00 O ATOM 254 CB PHE A 18 -12.124 3.427 -7.894 1.00 0.00 C ATOM 255 CG PHE A 18 -12.659 2.825 -9.183 1.00 0.00 C ATOM 256 CD1 PHE A 18 -12.204 1.569 -9.628 1.00 0.00 C ATOM 257 CD2 PHE A 18 -13.580 3.548 -9.965 1.00 0.00 C ATOM 258 CE1 PHE A 18 -12.656 1.050 -10.856 1.00 0.00 C ATOM 259 CE2 PHE A 18 -14.025 3.034 -11.195 1.00 0.00 C ATOM 260 CZ PHE A 18 -13.556 1.787 -11.644 1.00 0.00 C ATOM 0 H PHE A 18 -10.115 3.895 -5.841 1.00 0.00 H new ATOM 0 HA PHE A 18 -10.088 2.762 -7.825 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -12.362 2.749 -7.074 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -12.657 4.358 -7.703 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -11.508 1.003 -9.027 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -13.946 4.503 -9.618 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -12.310 0.084 -11.193 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -14.726 3.596 -11.794 1.00 0.00 H new ATOM 0 HZ PHE A 18 -13.887 1.396 -12.594 1.00 0.00 H new ATOM 269 N LEU A 19 -8.730 4.465 -9.255 1.00 0.00 N ATOM 270 CA LEU A 19 -8.059 5.185 -10.341 1.00 0.00 C ATOM 271 C LEU A 19 -7.507 4.181 -11.376 1.00 0.00 C ATOM 272 O LEU A 19 -6.484 3.544 -11.105 1.00 0.00 O ATOM 273 CB LEU A 19 -7.002 6.151 -9.750 1.00 0.00 C ATOM 274 CG LEU A 19 -6.943 7.549 -10.400 1.00 0.00 C ATOM 275 CD1 LEU A 19 -6.584 7.489 -11.887 1.00 0.00 C ATOM 276 CD2 LEU A 19 -8.255 8.322 -10.237 1.00 0.00 C ATOM 0 H LEU A 19 -8.086 4.027 -8.596 1.00 0.00 H new ATOM 0 HA LEU A 19 -8.763 5.812 -10.888 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.201 6.273 -8.685 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.020 5.686 -9.839 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.151 8.077 -9.868 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.556 8.499 -12.296 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -5.606 7.022 -12.007 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -7.334 6.903 -12.419 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -8.163 9.299 -10.711 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -9.066 7.766 -10.707 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -8.471 8.452 -9.177 1.00 0.00 H new ATOM 287 N PRO A 20 -8.178 3.986 -12.535 1.00 0.00 N ATOM 288 CA PRO A 20 -7.805 3.007 -13.561 1.00 0.00 C ATOM 289 C PRO A 20 -6.584 3.483 -14.373 1.00 0.00 C ATOM 290 O PRO A 20 -6.668 3.868 -15.542 1.00 0.00 O ATOM 291 CB PRO A 20 -9.074 2.781 -14.389 1.00 0.00 C ATOM 292 CG PRO A 20 -9.797 4.123 -14.311 1.00 0.00 C ATOM 293 CD PRO A 20 -9.399 4.676 -12.946 1.00 0.00 C ATOM 0 HA PRO A 20 -7.472 2.058 -13.140 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -8.838 2.512 -15.419 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -9.681 1.974 -13.980 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.490 4.790 -15.117 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.877 4.000 -14.393 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -9.232 5.752 -13.001 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.195 4.514 -12.219 1.00 0.00 H new ATOM 298 N GLY A 21 -5.437 3.501 -13.697 1.00 0.00 N ATOM 299 CA GLY A 21 -4.145 3.994 -14.165 1.00 0.00 C ATOM 300 C GLY A 21 -3.084 3.717 -13.105 1.00 0.00 C ATOM 301 O GLY A 21 -2.771 2.555 -12.861 1.00 0.00 O ATOM 0 H GLY A 21 -5.383 3.147 -12.742 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -3.875 3.507 -15.102 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -4.203 5.064 -14.367 1.00 0.00 H new ATOM 304 N GLN A 22 -2.563 4.755 -12.437 1.00 0.00 N ATOM 305 CA GLN A 22 -1.535 4.625 -11.389 1.00 0.00 C ATOM 306 C GLN A 22 -1.882 3.618 -10.274 1.00 0.00 C ATOM 307 O GLN A 22 -0.990 2.915 -9.813 1.00 0.00 O ATOM 308 CB GLN A 22 -1.240 6.002 -10.769 1.00 0.00 C ATOM 309 CG GLN A 22 -0.464 6.938 -11.711 1.00 0.00 C ATOM 310 CD GLN A 22 -0.213 8.321 -11.101 1.00 0.00 C ATOM 311 OE1 GLN A 22 -0.987 8.848 -10.311 1.00 0.00 O ATOM 312 NE2 GLN A 22 0.879 8.970 -11.445 1.00 0.00 N ATOM 0 H GLN A 22 -2.845 5.720 -12.609 1.00 0.00 H new ATOM 0 HA GLN A 22 -0.653 4.227 -11.890 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -2.181 6.477 -10.490 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -0.668 5.865 -9.851 1.00 0.00 H new ATOM 0 HG2 GLN A 22 0.492 6.479 -11.965 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -1.020 7.052 -12.641 1.00 0.00 H new ATOM 0 HE21 GLN A 22 1.537 8.549 -12.101 1.00 0.00 H new ATOM 0 HE22 GLN A 22 1.068 9.894 -11.055 1.00 0.00 H new ATOM 319 N GLY A 23 -3.144 3.525 -9.839 1.00 0.00 N ATOM 320 CA GLY A 23 -3.631 2.481 -8.925 1.00 0.00 C ATOM 321 C GLY A 23 -4.471 3.040 -7.777 1.00 0.00 C ATOM 322 O GLY A 23 -5.704 3.012 -7.818 1.00 0.00 O ATOM 0 H GLY A 23 -3.870 4.185 -10.117 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -4.226 1.762 -9.487 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.779 1.938 -8.515 1.00 0.00 H new ATOM 325 N LEU A 24 -3.793 3.597 -6.770 1.00 0.00 N ATOM 326 CA LEU A 24 -4.388 4.220 -5.584 1.00 0.00 C ATOM 327 C LEU A 24 -3.659 5.536 -5.276 1.00 0.00 C ATOM 328 O LEU A 24 -2.431 5.602 -5.319 1.00 0.00 O ATOM 329 CB LEU A 24 -4.284 3.222 -4.411 1.00 0.00 C ATOM 330 CG LEU A 24 -4.869 3.709 -3.071 1.00 0.00 C ATOM 331 CD1 LEU A 24 -6.395 3.651 -3.105 1.00 0.00 C ATOM 332 CD2 LEU A 24 -4.377 2.836 -1.916 1.00 0.00 C ATOM 0 H LEU A 24 -2.774 3.628 -6.758 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.438 4.458 -5.752 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.791 2.300 -4.695 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.233 2.974 -4.260 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.538 4.737 -2.919 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.794 3.998 -2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.766 4.289 -3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.716 2.624 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -4.802 3.198 -0.980 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.688 1.805 -2.081 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.289 2.883 -1.862 1.00 0.00 H new ATOM 343 N VAL A 25 -4.399 6.588 -4.923 1.00 0.00 N ATOM 344 CA VAL A 25 -3.817 7.896 -4.590 1.00 0.00 C ATOM 345 C VAL A 25 -4.507 8.426 -3.340 1.00 0.00 C ATOM 346 O VAL A 25 -5.697 8.727 -3.381 1.00 0.00 O ATOM 347 CB VAL A 25 -3.929 8.902 -5.759 1.00 0.00 C ATOM 348 CG1 VAL A 25 -3.084 10.149 -5.475 1.00 0.00 C ATOM 349 CG2 VAL A 25 -3.476 8.319 -7.104 1.00 0.00 C ATOM 0 H VAL A 25 -5.417 6.561 -4.859 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.751 7.770 -4.403 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.987 9.152 -5.833 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -3.174 10.847 -6.308 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.437 10.627 -4.561 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.040 9.861 -5.354 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.580 9.075 -7.882 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -2.433 8.011 -7.034 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.093 7.456 -7.353 1.00 0.00 H new ATOM 359 N LEU A 26 -3.780 8.537 -2.228 1.00 0.00 N ATOM 360 CA LEU A 26 -4.314 9.041 -0.957 1.00 0.00 C ATOM 361 C LEU A 26 -3.428 10.153 -0.390 1.00 0.00 C ATOM 362 O LEU A 26 -2.297 10.349 -0.831 1.00 0.00 O ATOM 363 CB LEU A 26 -4.519 7.882 0.058 1.00 0.00 C ATOM 364 CG LEU A 26 -5.945 7.300 0.203 1.00 0.00 C ATOM 365 CD1 LEU A 26 -7.061 8.344 0.177 1.00 0.00 C ATOM 366 CD2 LEU A 26 -6.270 6.259 -0.857 1.00 0.00 C ATOM 0 H LEU A 26 -2.795 8.278 -2.181 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.294 9.479 -1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.851 7.068 -0.223 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -4.199 8.234 1.039 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.918 6.841 1.191 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.026 7.848 0.285 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.921 9.047 0.998 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.034 8.882 -0.770 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.283 5.887 -0.703 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -6.195 6.711 -1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.565 5.431 -0.782 1.00 0.00 H new ATOM 377 N TYR A 27 -3.934 10.883 0.605 1.00 0.00 N ATOM 378 CA TYR A 27 -3.256 12.041 1.193 1.00 0.00 C ATOM 379 C TYR A 27 -3.168 11.859 2.724 1.00 0.00 C ATOM 380 O TYR A 27 -4.094 12.247 3.439 1.00 0.00 O ATOM 381 CB TYR A 27 -3.967 13.325 0.723 1.00 0.00 C ATOM 382 CG TYR A 27 -3.124 14.584 0.829 1.00 0.00 C ATOM 383 CD1 TYR A 27 -2.804 15.097 2.097 1.00 0.00 C ATOM 384 CD2 TYR A 27 -2.645 15.238 -0.328 1.00 0.00 C ATOM 385 CE1 TYR A 27 -1.983 16.231 2.219 1.00 0.00 C ATOM 386 CE2 TYR A 27 -1.830 16.383 -0.208 1.00 0.00 C ATOM 387 CZ TYR A 27 -1.487 16.870 1.071 1.00 0.00 C ATOM 388 OH TYR A 27 -0.682 17.952 1.237 1.00 0.00 O ATOM 0 H TYR A 27 -4.839 10.684 1.032 1.00 0.00 H new ATOM 0 HA TYR A 27 -2.224 12.130 0.854 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -4.276 13.196 -0.314 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -4.874 13.459 1.312 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -3.191 14.617 2.984 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -2.903 14.861 -1.306 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -1.733 16.612 3.198 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -1.469 16.886 -1.093 1.00 0.00 H new ATOM 0 HH TYR A 27 -0.410 18.295 0.360 1.00 0.00 H new ATOM 397 N PRO A 28 -2.112 11.197 3.246 1.00 0.00 N ATOM 398 CA PRO A 28 -1.928 10.891 4.669 1.00 0.00 C ATOM 399 C PRO A 28 -1.519 12.130 5.491 1.00 0.00 C ATOM 400 O PRO A 28 -0.408 12.227 6.017 1.00 0.00 O ATOM 401 CB PRO A 28 -0.922 9.734 4.721 1.00 0.00 C ATOM 402 CG PRO A 28 -0.113 9.879 3.440 1.00 0.00 C ATOM 403 CD PRO A 28 -1.048 10.590 2.461 1.00 0.00 C ATOM 0 HA PRO A 28 -2.862 10.588 5.142 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -0.285 9.800 5.603 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -1.428 8.769 4.765 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.795 10.458 3.610 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.196 8.907 3.056 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.507 11.348 1.894 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.458 9.884 1.739 1.00 0.00 H new ATOM 408 N GLN A 29 -2.419 13.111 5.575 1.00 0.00 N ATOM 409 CA GLN A 29 -2.258 14.325 6.381 1.00 0.00 C ATOM 410 C GLN A 29 -2.594 14.103 7.868 1.00 0.00 C ATOM 411 O GLN A 29 -3.292 13.157 8.248 1.00 0.00 O ATOM 412 CB GLN A 29 -3.092 15.480 5.795 1.00 0.00 C ATOM 413 CG GLN A 29 -4.543 15.111 5.477 1.00 0.00 C ATOM 414 CD GLN A 29 -5.427 16.329 5.210 1.00 0.00 C ATOM 415 OE1 GLN A 29 -5.828 17.062 6.105 1.00 0.00 O ATOM 416 NE2 GLN A 29 -5.749 16.610 3.963 1.00 0.00 N ATOM 0 H GLN A 29 -3.305 13.083 5.071 1.00 0.00 H new ATOM 0 HA GLN A 29 -1.203 14.595 6.338 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -3.087 16.311 6.501 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -2.611 15.834 4.883 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -4.563 14.457 4.605 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.958 14.544 6.310 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.424 16.010 3.205 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.323 17.427 3.756 1.00 0.00 H new ATOM 423 N ILE A 30 -2.097 15.006 8.720 1.00 0.00 N ATOM 424 CA ILE A 30 -2.231 14.915 10.178 1.00 0.00 C ATOM 425 C ILE A 30 -3.522 15.610 10.628 1.00 0.00 C ATOM 426 O ILE A 30 -3.632 16.840 10.621 1.00 0.00 O ATOM 427 CB ILE A 30 -0.963 15.448 10.888 1.00 0.00 C ATOM 428 CG1 ILE A 30 0.341 14.878 10.275 1.00 0.00 C ATOM 429 CG2 ILE A 30 -1.008 15.142 12.396 1.00 0.00 C ATOM 430 CD1 ILE A 30 0.398 13.346 10.149 1.00 0.00 C ATOM 0 H ILE A 30 -1.583 15.832 8.412 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.315 13.869 10.472 1.00 0.00 H new ATOM 0 HB ILE A 30 -0.955 16.528 10.739 1.00 0.00 H new ATOM 0 HG12 ILE A 30 0.476 15.312 9.284 1.00 0.00 H new ATOM 0 HG13 ILE A 30 1.183 15.207 10.885 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.106 15.526 12.872 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -1.883 15.618 12.838 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.067 14.064 12.547 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.351 13.052 9.709 1.00 0.00 H new ATOM 0 HD12 ILE A 30 0.300 12.896 11.137 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.417 13.003 9.512 1.00 0.00 H new ATOM 441 N GLY A 31 -4.522 14.795 10.968 1.00 0.00 N ATOM 442 CA GLY A 31 -5.889 15.201 11.305 1.00 0.00 C ATOM 443 C GLY A 31 -6.918 14.097 11.035 1.00 0.00 C ATOM 444 O GLY A 31 -8.024 14.147 11.571 1.00 0.00 O ATOM 0 H GLY A 31 -4.395 13.784 11.019 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -5.931 15.482 12.357 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.153 16.087 10.728 1.00 0.00 H new ATOM 447 N ASP A 32 -6.552 13.084 10.247 1.00 0.00 N ATOM 448 CA ASP A 32 -7.392 11.967 9.817 1.00 0.00 C ATOM 449 C ASP A 32 -6.659 10.633 9.946 1.00 0.00 C ATOM 450 O ASP A 32 -5.449 10.544 10.155 1.00 0.00 O ATOM 451 CB ASP A 32 -7.927 12.138 8.376 1.00 0.00 C ATOM 452 CG ASP A 32 -6.983 12.875 7.417 1.00 0.00 C ATOM 453 OD1 ASP A 32 -6.759 14.085 7.625 1.00 0.00 O ATOM 454 OD2 ASP A 32 -6.518 12.247 6.435 1.00 0.00 O ATOM 0 H ASP A 32 -5.606 13.019 9.871 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.251 11.966 10.488 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.141 11.152 7.965 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.873 12.678 8.417 1.00 0.00 H new ATOM 458 N LYS A 33 -7.435 9.570 9.804 1.00 0.00 N ATOM 459 CA LYS A 33 -7.010 8.187 9.952 1.00 0.00 C ATOM 460 C LYS A 33 -7.603 7.360 8.824 1.00 0.00 C ATOM 461 O LYS A 33 -8.702 7.657 8.344 1.00 0.00 O ATOM 462 CB LYS A 33 -7.440 7.673 11.336 1.00 0.00 C ATOM 463 CG LYS A 33 -8.907 7.948 11.696 1.00 0.00 C ATOM 464 CD LYS A 33 -9.578 6.732 12.335 1.00 0.00 C ATOM 465 CE LYS A 33 -11.033 7.078 12.657 1.00 0.00 C ATOM 466 NZ LYS A 33 -11.721 5.939 13.313 1.00 0.00 N ATOM 0 H LYS A 33 -8.425 9.652 9.572 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.925 8.105 9.889 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.265 6.598 11.380 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.803 8.131 12.093 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.959 8.793 12.382 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.454 8.233 10.797 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.535 5.879 11.658 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.049 6.445 13.244 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -11.067 7.951 13.309 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.558 7.344 11.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.706 6.201 13.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.708 5.114 12.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.232 5.702 14.200 1.00 0.00 H new ATOM 476 N LEU A 34 -6.857 6.352 8.397 1.00 0.00 N ATOM 477 CA LEU A 34 -7.210 5.467 7.301 1.00 0.00 C ATOM 478 C LEU A 34 -6.913 4.031 7.733 1.00 0.00 C ATOM 479 O LEU A 34 -5.873 3.735 8.326 1.00 0.00 O ATOM 480 CB LEU A 34 -6.582 5.892 5.942 1.00 0.00 C ATOM 481 CG LEU A 34 -5.150 6.466 5.824 1.00 0.00 C ATOM 482 CD1 LEU A 34 -4.994 7.897 6.354 1.00 0.00 C ATOM 483 CD2 LEU A 34 -4.079 5.601 6.476 1.00 0.00 C ATOM 0 H LEU A 34 -5.958 6.121 8.820 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.277 5.539 7.093 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -6.619 5.016 5.295 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -7.251 6.636 5.510 1.00 0.00 H new ATOM 0 HG LEU A 34 -4.997 6.474 4.745 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.960 8.219 6.232 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -5.650 8.565 5.796 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.261 7.925 7.411 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.104 6.072 6.350 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -4.295 5.494 7.539 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.070 4.617 6.007 1.00 0.00 H new ATOM 494 N ASP A 35 -7.867 3.145 7.469 1.00 0.00 N ATOM 495 CA ASP A 35 -7.830 1.744 7.880 1.00 0.00 C ATOM 496 C ASP A 35 -8.020 0.845 6.663 1.00 0.00 C ATOM 497 O ASP A 35 -9.085 0.811 6.043 1.00 0.00 O ATOM 498 CB ASP A 35 -8.830 1.413 9.015 1.00 0.00 C ATOM 499 CG ASP A 35 -9.955 2.435 9.294 1.00 0.00 C ATOM 500 OD1 ASP A 35 -10.649 2.871 8.344 1.00 0.00 O ATOM 501 OD2 ASP A 35 -10.178 2.768 10.482 1.00 0.00 O ATOM 0 H ASP A 35 -8.711 3.387 6.949 1.00 0.00 H new ATOM 0 HA ASP A 35 -6.846 1.551 8.308 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -9.295 0.455 8.785 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.262 1.278 9.935 1.00 0.00 H new ATOM 505 N ILE A 36 -6.969 0.113 6.296 1.00 0.00 N ATOM 506 CA ILE A 36 -7.069 -0.908 5.258 1.00 0.00 C ATOM 507 C ILE A 36 -7.710 -2.172 5.844 1.00 0.00 C ATOM 508 O ILE A 36 -7.452 -2.522 6.999 1.00 0.00 O ATOM 509 CB ILE A 36 -5.690 -1.156 4.602 1.00 0.00 C ATOM 510 CG1 ILE A 36 -5.817 -1.610 3.132 1.00 0.00 C ATOM 511 CG2 ILE A 36 -4.871 -2.142 5.437 1.00 0.00 C ATOM 512 CD1 ILE A 36 -4.479 -1.860 2.428 1.00 0.00 C ATOM 0 H ILE A 36 -6.039 0.209 6.703 1.00 0.00 H new ATOM 0 HA ILE A 36 -7.720 -0.566 4.454 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.155 -0.206 4.580 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -6.408 -2.525 3.097 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.369 -0.852 2.577 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.904 -2.306 4.962 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.720 -1.734 6.437 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -5.405 -3.090 5.508 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -4.662 -2.175 1.401 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.891 -0.942 2.427 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.931 -2.641 2.955 1.00 0.00 H new ATOM 523 N ILE A 37 -8.511 -2.868 5.042 1.00 0.00 N ATOM 524 CA ILE A 37 -9.124 -4.163 5.347 1.00 0.00 C ATOM 525 C ILE A 37 -9.000 -5.036 4.093 1.00 0.00 C ATOM 526 O ILE A 37 -9.335 -4.594 2.992 1.00 0.00 O ATOM 527 CB ILE A 37 -10.601 -3.966 5.790 1.00 0.00 C ATOM 528 CG1 ILE A 37 -10.675 -3.485 7.259 1.00 0.00 C ATOM 529 CG2 ILE A 37 -11.454 -5.239 5.610 1.00 0.00 C ATOM 530 CD1 ILE A 37 -12.024 -2.872 7.659 1.00 0.00 C ATOM 0 H ILE A 37 -8.765 -2.529 4.114 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.619 -4.657 6.177 1.00 0.00 H new ATOM 0 HB ILE A 37 -11.018 -3.200 5.136 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -10.464 -4.329 7.916 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -9.891 -2.747 7.427 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -12.475 -5.042 5.936 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -11.458 -5.529 4.559 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -11.032 -6.047 6.208 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -11.988 -2.562 8.703 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -12.231 -2.006 7.031 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -12.813 -3.612 7.527 1.00 0.00 H new ATOM 541 N CYS A 38 -8.578 -6.293 4.260 1.00 0.00 N ATOM 542 CA CYS A 38 -8.667 -7.322 3.222 1.00 0.00 C ATOM 543 C CYS A 38 -9.394 -8.558 3.771 1.00 0.00 C ATOM 544 O CYS A 38 -8.995 -9.085 4.821 1.00 0.00 O ATOM 545 CB CYS A 38 -7.287 -7.701 2.665 1.00 0.00 C ATOM 546 SG CYS A 38 -7.399 -8.521 1.048 1.00 0.00 S ATOM 0 H CYS A 38 -8.161 -6.627 5.129 1.00 0.00 H new ATOM 0 HA CYS A 38 -9.240 -6.910 2.392 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -6.675 -6.803 2.573 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -6.781 -8.361 3.370 1.00 0.00 H new ATOM 550 N PRO A 39 -10.449 -9.040 3.085 1.00 0.00 N ATOM 551 CA PRO A 39 -11.127 -10.280 3.441 1.00 0.00 C ATOM 552 C PRO A 39 -10.260 -11.496 3.090 1.00 0.00 C ATOM 553 O PRO A 39 -9.124 -11.369 2.623 1.00 0.00 O ATOM 554 CB PRO A 39 -12.438 -10.255 2.646 1.00 0.00 C ATOM 555 CG PRO A 39 -12.072 -9.480 1.386 1.00 0.00 C ATOM 556 CD PRO A 39 -10.996 -8.501 1.843 1.00 0.00 C ATOM 0 HA PRO A 39 -11.316 -10.360 4.511 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.785 -11.261 2.412 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.236 -9.764 3.202 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -11.700 -10.143 0.605 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -12.936 -8.958 0.975 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -10.217 -8.400 1.087 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -11.417 -7.508 2.002 1.00 0.00 H new ATOM 561 N LYS A 40 -10.812 -12.699 3.282 1.00 0.00 N ATOM 562 CA LYS A 40 -10.168 -13.941 2.848 1.00 0.00 C ATOM 563 C LYS A 40 -10.649 -14.424 1.479 1.00 0.00 C ATOM 564 O LYS A 40 -11.710 -14.037 0.985 1.00 0.00 O ATOM 565 CB LYS A 40 -10.271 -15.013 3.942 1.00 0.00 C ATOM 566 CG LYS A 40 -11.709 -15.486 4.231 1.00 0.00 C ATOM 567 CD LYS A 40 -11.836 -17.009 4.090 1.00 0.00 C ATOM 568 CE LYS A 40 -13.191 -17.473 4.633 1.00 0.00 C ATOM 569 NZ LYS A 40 -13.320 -18.953 4.575 1.00 0.00 N ATOM 0 H LYS A 40 -11.713 -12.838 3.740 1.00 0.00 H new ATOM 0 HA LYS A 40 -9.109 -13.727 2.701 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.670 -15.874 3.649 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.838 -14.620 4.862 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -11.996 -15.187 5.239 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -12.400 -14.997 3.544 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -11.737 -17.295 3.043 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -11.029 -17.502 4.633 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.307 -17.136 5.663 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -13.993 -17.013 4.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -14.248 -19.236 4.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -13.234 -19.271 3.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.569 -19.390 5.146 1.00 0.00 H new ATOM 579 N VAL A 41 -9.841 -15.301 0.891 1.00 0.00 N ATOM 580 CA VAL A 41 -10.004 -15.868 -0.448 1.00 0.00 C ATOM 581 C VAL A 41 -9.656 -17.355 -0.352 1.00 0.00 C ATOM 582 O VAL A 41 -8.562 -17.701 0.089 1.00 0.00 O ATOM 583 CB VAL A 41 -9.088 -15.143 -1.459 1.00 0.00 C ATOM 584 CG1 VAL A 41 -9.283 -15.699 -2.869 1.00 0.00 C ATOM 585 CG2 VAL A 41 -9.344 -13.631 -1.534 1.00 0.00 C ATOM 0 H VAL A 41 -9.008 -15.656 1.360 1.00 0.00 H new ATOM 0 HA VAL A 41 -11.027 -15.742 -0.803 1.00 0.00 H new ATOM 0 HB VAL A 41 -8.075 -15.316 -1.097 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.627 -15.172 -3.562 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -9.041 -16.762 -2.878 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -10.320 -15.560 -3.175 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.668 -13.183 -2.262 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -10.375 -13.451 -1.838 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.171 -13.184 -0.555 1.00 0.00 H new ATOM 595 N ASP A 42 -10.619 -18.200 -0.724 1.00 0.00 N ATOM 596 CA ASP A 42 -10.641 -19.674 -0.731 1.00 0.00 C ATOM 597 C ASP A 42 -12.113 -20.092 -0.880 1.00 0.00 C ATOM 598 O ASP A 42 -12.631 -20.042 -1.994 1.00 0.00 O ATOM 599 CB ASP A 42 -9.941 -20.334 0.485 1.00 0.00 C ATOM 600 CG ASP A 42 -8.438 -20.612 0.274 1.00 0.00 C ATOM 601 OD1 ASP A 42 -8.029 -20.935 -0.866 1.00 0.00 O ATOM 602 OD2 ASP A 42 -7.677 -20.582 1.275 1.00 0.00 O ATOM 0 H ASP A 42 -11.506 -17.831 -1.068 1.00 0.00 H new ATOM 0 HA ASP A 42 -10.047 -20.040 -1.568 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -10.061 -19.688 1.354 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -10.444 -21.273 0.714 1.00 0.00 H new ATOM 606 N SER A 43 -12.832 -20.385 0.212 1.00 0.00 N ATOM 607 CA SER A 43 -14.248 -20.799 0.174 1.00 0.00 C ATOM 608 C SER A 43 -15.204 -19.748 -0.408 1.00 0.00 C ATOM 609 O SER A 43 -16.197 -20.108 -1.045 1.00 0.00 O ATOM 610 CB SER A 43 -14.736 -21.169 1.580 1.00 0.00 C ATOM 611 OG SER A 43 -13.967 -22.236 2.113 1.00 0.00 O ATOM 0 H SER A 43 -12.448 -20.342 1.156 1.00 0.00 H new ATOM 0 HA SER A 43 -14.270 -21.659 -0.495 1.00 0.00 H new ATOM 0 HB2 SER A 43 -14.666 -20.301 2.235 1.00 0.00 H new ATOM 0 HB3 SER A 43 -15.787 -21.455 1.542 1.00 0.00 H new ATOM 0 HG SER A 43 -14.292 -22.457 3.011 1.00 0.00 H new ATOM 616 N LYS A 44 -14.926 -18.450 -0.201 1.00 0.00 N ATOM 617 CA LYS A 44 -15.776 -17.339 -0.678 1.00 0.00 C ATOM 618 C LYS A 44 -15.653 -17.115 -2.188 1.00 0.00 C ATOM 619 O LYS A 44 -16.666 -16.986 -2.878 1.00 0.00 O ATOM 620 CB LYS A 44 -15.445 -16.044 0.095 1.00 0.00 C ATOM 621 CG LYS A 44 -15.771 -16.112 1.599 1.00 0.00 C ATOM 622 CD LYS A 44 -17.278 -16.212 1.921 1.00 0.00 C ATOM 623 CE LYS A 44 -17.859 -14.903 2.485 1.00 0.00 C ATOM 624 NZ LYS A 44 -18.909 -14.321 1.607 1.00 0.00 N ATOM 0 H LYS A 44 -14.098 -18.137 0.306 1.00 0.00 H new ATOM 0 HA LYS A 44 -16.812 -17.617 -0.484 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.385 -15.821 -0.027 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -15.998 -15.216 -0.349 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -15.262 -16.974 2.030 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -15.366 -15.225 2.087 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -17.820 -16.484 1.015 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -17.438 -17.014 2.641 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -18.280 -15.092 3.473 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -17.055 -14.178 2.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -19.268 -13.442 2.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -18.504 -14.114 0.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -19.690 -14.999 1.504 1.00 0.00 H new ATOM 634 N THR A 45 -14.420 -17.095 -2.699 1.00 0.00 N ATOM 635 CA THR A 45 -14.108 -16.944 -4.129 1.00 0.00 C ATOM 636 C THR A 45 -14.283 -18.270 -4.870 1.00 0.00 C ATOM 637 O THR A 45 -15.259 -18.415 -5.610 1.00 0.00 O ATOM 638 CB THR A 45 -12.696 -16.361 -4.297 1.00 0.00 C ATOM 639 OG1 THR A 45 -12.719 -15.054 -3.763 1.00 0.00 O ATOM 640 CG2 THR A 45 -12.203 -16.247 -5.739 1.00 0.00 C ATOM 0 H THR A 45 -13.587 -17.185 -2.118 1.00 0.00 H new ATOM 0 HA THR A 45 -14.811 -16.243 -4.578 1.00 0.00 H new ATOM 0 HB THR A 45 -12.018 -17.049 -3.792 1.00 0.00 H new ATOM 0 HG1 THR A 45 -12.068 -14.495 -4.237 1.00 0.00 H new ATOM 0 HG21 THR A 45 -11.198 -15.825 -5.748 1.00 0.00 H new ATOM 0 HG22 THR A 45 -12.185 -17.236 -6.197 1.00 0.00 H new ATOM 0 HG23 THR A 45 -12.874 -15.599 -6.303 1.00 0.00 H new ATOM 705 N GLU A 50 -4.528 -15.907 -3.580 1.00 0.00 N ATOM 706 CA GLU A 50 -4.140 -14.758 -4.423 1.00 0.00 C ATOM 707 C GLU A 50 -3.919 -13.444 -3.651 1.00 0.00 C ATOM 708 O GLU A 50 -4.597 -12.429 -3.838 1.00 0.00 O ATOM 709 CB GLU A 50 -5.091 -14.630 -5.629 1.00 0.00 C ATOM 710 CG GLU A 50 -4.494 -13.744 -6.738 1.00 0.00 C ATOM 711 CD GLU A 50 -4.626 -14.395 -8.128 1.00 0.00 C ATOM 712 OE1 GLU A 50 -3.915 -15.394 -8.403 1.00 0.00 O ATOM 713 OE2 GLU A 50 -5.425 -13.905 -8.966 1.00 0.00 O ATOM 0 HA GLU A 50 -3.145 -14.972 -4.814 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.304 -15.621 -6.031 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.041 -14.209 -5.300 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.998 -12.777 -6.741 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.442 -13.555 -6.524 1.00 0.00 H new ATOM 718 N TYR A 51 -2.976 -13.515 -2.714 1.00 0.00 N ATOM 719 CA TYR A 51 -2.531 -12.405 -1.885 1.00 0.00 C ATOM 720 C TYR A 51 -1.594 -11.468 -2.652 1.00 0.00 C ATOM 721 O TYR A 51 -1.002 -11.832 -3.676 1.00 0.00 O ATOM 722 CB TYR A 51 -1.843 -12.975 -0.635 1.00 0.00 C ATOM 723 CG TYR A 51 -0.813 -14.053 -0.905 1.00 0.00 C ATOM 724 CD1 TYR A 51 0.524 -13.710 -1.177 1.00 0.00 C ATOM 725 CD2 TYR A 51 -1.209 -15.403 -0.905 1.00 0.00 C ATOM 726 CE1 TYR A 51 1.466 -14.720 -1.454 1.00 0.00 C ATOM 727 CE2 TYR A 51 -0.275 -16.415 -1.189 1.00 0.00 C ATOM 728 CZ TYR A 51 1.068 -16.076 -1.463 1.00 0.00 C ATOM 729 OH TYR A 51 1.972 -17.057 -1.728 1.00 0.00 O ATOM 0 H TYR A 51 -2.483 -14.384 -2.506 1.00 0.00 H new ATOM 0 HA TYR A 51 -3.394 -11.808 -1.591 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -1.359 -12.157 -0.101 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.607 -13.381 0.028 1.00 0.00 H new ATOM 0 HD1 TYR A 51 0.828 -12.674 -1.173 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -2.234 -15.663 -0.686 1.00 0.00 H new ATOM 0 HE1 TYR A 51 2.493 -14.458 -1.660 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -0.584 -17.450 -1.198 1.00 0.00 H new ATOM 0 HH TYR A 51 1.528 -17.930 -1.692 1.00 0.00 H new ATOM 738 N TYR A 52 -1.422 -10.267 -2.109 1.00 0.00 N ATOM 739 CA TYR A 52 -0.611 -9.203 -2.692 1.00 0.00 C ATOM 740 C TYR A 52 0.271 -8.588 -1.605 1.00 0.00 C ATOM 741 O TYR A 52 -0.097 -8.596 -0.427 1.00 0.00 O ATOM 742 CB TYR A 52 -1.529 -8.144 -3.325 1.00 0.00 C ATOM 743 CG TYR A 52 -2.674 -8.663 -4.178 1.00 0.00 C ATOM 744 CD1 TYR A 52 -2.415 -9.475 -5.299 1.00 0.00 C ATOM 745 CD2 TYR A 52 -4.002 -8.329 -3.849 1.00 0.00 C ATOM 746 CE1 TYR A 52 -3.475 -9.933 -6.106 1.00 0.00 C ATOM 747 CE2 TYR A 52 -5.064 -8.800 -4.642 1.00 0.00 C ATOM 748 CZ TYR A 52 -4.805 -9.588 -5.783 1.00 0.00 C ATOM 749 OH TYR A 52 -5.835 -9.992 -6.577 1.00 0.00 O ATOM 0 H TYR A 52 -1.856 -9.999 -1.225 1.00 0.00 H new ATOM 0 HA TYR A 52 0.033 -9.607 -3.473 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -1.949 -7.534 -2.525 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -0.916 -7.485 -3.940 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -1.399 -9.748 -5.541 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.205 -7.711 -2.987 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.270 -10.547 -6.970 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -6.082 -8.557 -4.376 1.00 0.00 H new ATOM 0 HH TYR A 52 -6.682 -9.667 -6.205 1.00 0.00 H new ATOM 758 N LYS A 53 1.421 -8.033 -1.996 1.00 0.00 N ATOM 759 CA LYS A 53 2.473 -7.562 -1.084 1.00 0.00 C ATOM 760 C LYS A 53 2.924 -6.165 -1.516 1.00 0.00 C ATOM 761 O LYS A 53 3.618 -6.006 -2.519 1.00 0.00 O ATOM 762 CB LYS A 53 3.628 -8.581 -1.080 1.00 0.00 C ATOM 763 CG LYS A 53 3.289 -9.919 -0.393 1.00 0.00 C ATOM 764 CD LYS A 53 4.099 -11.089 -0.971 1.00 0.00 C ATOM 765 CE LYS A 53 4.199 -12.266 0.011 1.00 0.00 C ATOM 766 NZ LYS A 53 5.259 -12.033 1.029 1.00 0.00 N ATOM 0 H LYS A 53 1.655 -7.894 -2.979 1.00 0.00 H new ATOM 0 HA LYS A 53 2.100 -7.484 -0.063 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.926 -8.779 -2.110 1.00 0.00 H new ATOM 0 HB3 LYS A 53 4.488 -8.136 -0.579 1.00 0.00 H new ATOM 0 HG2 LYS A 53 3.485 -9.837 0.676 1.00 0.00 H new ATOM 0 HG3 LYS A 53 2.225 -10.125 -0.507 1.00 0.00 H new ATOM 0 HD2 LYS A 53 3.634 -11.429 -1.896 1.00 0.00 H new ATOM 0 HD3 LYS A 53 5.101 -10.744 -1.226 1.00 0.00 H new ATOM 0 HE2 LYS A 53 3.240 -12.410 0.508 1.00 0.00 H new ATOM 0 HE3 LYS A 53 4.414 -13.183 -0.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 5.794 -12.912 1.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.903 -11.288 0.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 4.821 -11.736 1.924 1.00 0.00 H new ATOM 776 N VAL A 54 2.448 -5.148 -0.792 1.00 0.00 N ATOM 777 CA VAL A 54 2.806 -3.731 -1.004 1.00 0.00 C ATOM 778 C VAL A 54 4.226 -3.510 -0.510 1.00 0.00 C ATOM 779 O VAL A 54 4.519 -3.827 0.640 1.00 0.00 O ATOM 780 CB VAL A 54 1.787 -2.781 -0.318 1.00 0.00 C ATOM 781 CG1 VAL A 54 2.332 -1.705 0.632 1.00 0.00 C ATOM 782 CG2 VAL A 54 0.862 -2.149 -1.369 1.00 0.00 C ATOM 0 H VAL A 54 1.789 -5.283 -0.025 1.00 0.00 H new ATOM 0 HA VAL A 54 2.764 -3.495 -2.067 1.00 0.00 H new ATOM 0 HB VAL A 54 1.244 -3.445 0.355 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.504 -1.121 1.033 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.870 -2.182 1.451 1.00 0.00 H new ATOM 0 HG13 VAL A 54 3.009 -1.048 0.087 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.152 -1.485 -0.876 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.457 -1.579 -2.082 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.319 -2.934 -1.895 1.00 0.00 H new ATOM 792 N TYR A 55 5.085 -2.932 -1.342 1.00 0.00 N ATOM 793 CA TYR A 55 6.470 -2.636 -0.989 1.00 0.00 C ATOM 794 C TYR A 55 6.794 -1.181 -1.315 1.00 0.00 C ATOM 795 O TYR A 55 6.571 -0.709 -2.434 1.00 0.00 O ATOM 796 CB TYR A 55 7.406 -3.580 -1.749 1.00 0.00 C ATOM 797 CG TYR A 55 7.359 -5.035 -1.318 1.00 0.00 C ATOM 798 CD1 TYR A 55 7.974 -5.428 -0.112 1.00 0.00 C ATOM 799 CD2 TYR A 55 6.737 -6.005 -2.128 1.00 0.00 C ATOM 800 CE1 TYR A 55 7.981 -6.782 0.277 1.00 0.00 C ATOM 801 CE2 TYR A 55 6.745 -7.361 -1.744 1.00 0.00 C ATOM 802 CZ TYR A 55 7.362 -7.755 -0.538 1.00 0.00 C ATOM 803 OH TYR A 55 7.348 -9.062 -0.158 1.00 0.00 O ATOM 0 H TYR A 55 4.837 -2.652 -2.291 1.00 0.00 H new ATOM 0 HA TYR A 55 6.611 -2.787 0.081 1.00 0.00 H new ATOM 0 HB2 TYR A 55 7.164 -3.526 -2.811 1.00 0.00 H new ATOM 0 HB3 TYR A 55 8.428 -3.219 -1.636 1.00 0.00 H new ATOM 0 HD1 TYR A 55 8.443 -4.686 0.518 1.00 0.00 H new ATOM 0 HD2 TYR A 55 6.252 -5.709 -3.046 1.00 0.00 H new ATOM 0 HE1 TYR A 55 8.460 -7.076 1.199 1.00 0.00 H new ATOM 0 HE2 TYR A 55 6.277 -8.102 -2.376 1.00 0.00 H new ATOM 0 HH TYR A 55 7.348 -9.118 0.820 1.00 0.00 H new ATOM 812 N MET A 56 7.329 -0.453 -0.332 1.00 0.00 N ATOM 813 CA MET A 56 7.828 0.901 -0.559 1.00 0.00 C ATOM 814 C MET A 56 8.977 0.869 -1.579 1.00 0.00 C ATOM 815 O MET A 56 9.866 0.014 -1.503 1.00 0.00 O ATOM 816 CB MET A 56 8.295 1.522 0.765 1.00 0.00 C ATOM 817 CG MET A 56 8.570 3.018 0.585 1.00 0.00 C ATOM 818 SD MET A 56 9.558 3.759 1.909 1.00 0.00 S ATOM 819 CE MET A 56 10.727 4.692 0.882 1.00 0.00 C ATOM 0 H MET A 56 7.427 -0.781 0.629 1.00 0.00 H new ATOM 0 HA MET A 56 7.023 1.517 -0.960 1.00 0.00 H new ATOM 0 HB2 MET A 56 7.534 1.375 1.531 1.00 0.00 H new ATOM 0 HB3 MET A 56 9.198 1.019 1.112 1.00 0.00 H new ATOM 0 HG2 MET A 56 9.084 3.169 -0.364 1.00 0.00 H new ATOM 0 HG3 MET A 56 7.618 3.545 0.519 1.00 0.00 H new ATOM 0 HE1 MET A 56 11.429 5.225 1.523 1.00 0.00 H new ATOM 0 HE2 MET A 56 11.274 4.004 0.237 1.00 0.00 H new ATOM 0 HE3 MET A 56 10.181 5.408 0.268 1.00 0.00 H new ATOM 827 N VAL A 57 8.978 1.822 -2.511 1.00 0.00 N ATOM 828 CA VAL A 57 10.063 1.999 -3.481 1.00 0.00 C ATOM 829 C VAL A 57 10.191 3.475 -3.892 1.00 0.00 C ATOM 830 O VAL A 57 9.292 4.275 -3.632 1.00 0.00 O ATOM 831 CB VAL A 57 9.843 1.033 -4.674 1.00 0.00 C ATOM 832 CG1 VAL A 57 8.975 1.603 -5.794 1.00 0.00 C ATOM 833 CG2 VAL A 57 11.188 0.586 -5.229 1.00 0.00 C ATOM 0 H VAL A 57 8.222 2.498 -2.616 1.00 0.00 H new ATOM 0 HA VAL A 57 11.021 1.739 -3.031 1.00 0.00 H new ATOM 0 HB VAL A 57 9.289 0.182 -4.276 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.872 0.863 -6.587 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.990 1.851 -5.400 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.443 2.502 -6.195 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.028 -0.093 -6.067 1.00 0.00 H new ATOM 0 HG22 VAL A 57 11.749 1.457 -5.569 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.751 0.073 -4.449 1.00 0.00 H new ATOM 843 N ASP A 58 11.302 3.868 -4.516 1.00 0.00 N ATOM 844 CA ASP A 58 11.509 5.237 -5.020 1.00 0.00 C ATOM 845 C ASP A 58 10.586 5.533 -6.218 1.00 0.00 C ATOM 846 O ASP A 58 10.312 4.641 -7.021 1.00 0.00 O ATOM 847 CB ASP A 58 12.962 5.437 -5.498 1.00 0.00 C ATOM 848 CG ASP A 58 14.077 5.226 -4.452 1.00 0.00 C ATOM 849 OD1 ASP A 58 13.947 4.395 -3.522 1.00 0.00 O ATOM 850 OD2 ASP A 58 15.138 5.884 -4.597 1.00 0.00 O ATOM 0 H ASP A 58 12.092 3.246 -4.690 1.00 0.00 H new ATOM 0 HA ASP A 58 11.284 5.911 -4.193 1.00 0.00 H new ATOM 0 HB2 ASP A 58 13.143 4.755 -6.329 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.053 6.449 -5.891 1.00 0.00 H new ATOM 854 N LYS A 59 10.186 6.795 -6.423 1.00 0.00 N ATOM 855 CA LYS A 59 9.370 7.216 -7.584 1.00 0.00 C ATOM 856 C LYS A 59 9.918 6.768 -8.943 1.00 0.00 C ATOM 857 O LYS A 59 9.153 6.385 -9.822 1.00 0.00 O ATOM 858 CB LYS A 59 9.133 8.740 -7.535 1.00 0.00 C ATOM 859 CG LYS A 59 10.403 9.597 -7.689 1.00 0.00 C ATOM 860 CD LYS A 59 10.658 10.097 -9.123 1.00 0.00 C ATOM 861 CE LYS A 59 12.148 10.427 -9.281 1.00 0.00 C ATOM 862 NZ LYS A 59 12.403 11.376 -10.393 1.00 0.00 N ATOM 0 H LYS A 59 10.417 7.560 -5.789 1.00 0.00 H new ATOM 0 HA LYS A 59 8.416 6.697 -7.495 1.00 0.00 H new ATOM 0 HB2 LYS A 59 8.432 9.010 -8.325 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.657 8.989 -6.587 1.00 0.00 H new ATOM 0 HG2 LYS A 59 10.330 10.458 -7.024 1.00 0.00 H new ATOM 0 HG3 LYS A 59 11.263 9.013 -7.361 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.363 9.336 -9.845 1.00 0.00 H new ATOM 0 HD3 LYS A 59 10.053 10.981 -9.326 1.00 0.00 H new ATOM 0 HE2 LYS A 59 12.524 10.853 -8.351 1.00 0.00 H new ATOM 0 HE3 LYS A 59 12.704 9.507 -9.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 13.423 11.567 -10.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 12.070 10.961 -11.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.895 12.266 -10.214 1.00 0.00 H new ATOM 872 N ASP A 60 11.243 6.786 -9.106 1.00 0.00 N ATOM 873 CA ASP A 60 11.911 6.360 -10.339 1.00 0.00 C ATOM 874 C ASP A 60 11.800 4.839 -10.531 1.00 0.00 C ATOM 875 O ASP A 60 11.412 4.351 -11.589 1.00 0.00 O ATOM 876 CB ASP A 60 13.386 6.794 -10.286 1.00 0.00 C ATOM 877 CG ASP A 60 13.887 7.273 -11.654 1.00 0.00 C ATOM 878 OD1 ASP A 60 14.304 6.429 -12.481 1.00 0.00 O ATOM 879 OD2 ASP A 60 13.872 8.505 -11.894 1.00 0.00 O ATOM 0 H ASP A 60 11.888 7.099 -8.380 1.00 0.00 H new ATOM 0 HA ASP A 60 11.422 6.833 -11.191 1.00 0.00 H new ATOM 0 HB2 ASP A 60 13.504 7.594 -9.555 1.00 0.00 H new ATOM 0 HB3 ASP A 60 13.999 5.959 -9.946 1.00 0.00 H new ATOM 883 N GLN A 61 12.071 4.086 -9.464 1.00 0.00 N ATOM 884 CA GLN A 61 12.026 2.623 -9.431 1.00 0.00 C ATOM 885 C GLN A 61 10.601 2.064 -9.571 1.00 0.00 C ATOM 886 O GLN A 61 10.378 1.037 -10.217 1.00 0.00 O ATOM 887 CB GLN A 61 12.644 2.158 -8.115 1.00 0.00 C ATOM 888 CG GLN A 61 14.133 2.516 -7.981 1.00 0.00 C ATOM 889 CD GLN A 61 14.679 2.093 -6.626 1.00 0.00 C ATOM 890 OE1 GLN A 61 14.233 1.128 -6.033 1.00 0.00 O ATOM 891 NE2 GLN A 61 15.628 2.807 -6.062 1.00 0.00 N ATOM 0 H GLN A 61 12.337 4.492 -8.567 1.00 0.00 H new ATOM 0 HA GLN A 61 12.587 2.245 -10.286 1.00 0.00 H new ATOM 0 HB2 GLN A 61 12.094 2.604 -7.286 1.00 0.00 H new ATOM 0 HB3 GLN A 61 12.528 1.078 -8.029 1.00 0.00 H new ATOM 0 HG2 GLN A 61 14.700 2.028 -8.773 1.00 0.00 H new ATOM 0 HG3 GLN A 61 14.265 3.590 -8.110 1.00 0.00 H new ATOM 0 HE21 GLN A 61 16.012 3.618 -6.546 1.00 0.00 H new ATOM 0 HE22 GLN A 61 15.980 2.549 -5.140 1.00 0.00 H new ATOM 898 N ALA A 62 9.616 2.782 -9.029 1.00 0.00 N ATOM 899 CA ALA A 62 8.205 2.497 -9.225 1.00 0.00 C ATOM 900 C ALA A 62 7.760 2.662 -10.687 1.00 0.00 C ATOM 901 O ALA A 62 6.813 2.010 -11.124 1.00 0.00 O ATOM 902 CB ALA A 62 7.397 3.414 -8.322 1.00 0.00 C ATOM 0 H ALA A 62 9.786 3.591 -8.432 1.00 0.00 H new ATOM 0 HA ALA A 62 8.032 1.452 -8.969 1.00 0.00 H new ATOM 0 HB1 ALA A 62 6.334 3.213 -8.457 1.00 0.00 H new ATOM 0 HB2 ALA A 62 7.671 3.235 -7.282 1.00 0.00 H new ATOM 0 HB3 ALA A 62 7.605 4.453 -8.578 1.00 0.00 H new ATOM 908 N ASP A 63 8.446 3.511 -11.459 1.00 0.00 N ATOM 909 CA ASP A 63 8.254 3.647 -12.906 1.00 0.00 C ATOM 910 C ASP A 63 9.057 2.593 -13.697 1.00 0.00 C ATOM 911 O ASP A 63 8.577 2.075 -14.709 1.00 0.00 O ATOM 912 CB ASP A 63 8.655 5.069 -13.343 1.00 0.00 C ATOM 913 CG ASP A 63 7.579 5.758 -14.198 1.00 0.00 C ATOM 914 OD1 ASP A 63 7.051 5.130 -15.148 1.00 0.00 O ATOM 915 OD2 ASP A 63 7.262 6.944 -13.936 1.00 0.00 O ATOM 0 H ASP A 63 9.163 4.134 -11.089 1.00 0.00 H new ATOM 0 HA ASP A 63 7.200 3.477 -13.127 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.851 5.674 -12.458 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.586 5.021 -13.909 1.00 0.00 H new ATOM 919 N ARG A 64 10.255 2.217 -13.215 1.00 0.00 N ATOM 920 CA ARG A 64 11.075 1.107 -13.753 1.00 0.00 C ATOM 921 C ARG A 64 10.447 -0.275 -13.560 1.00 0.00 C ATOM 922 O ARG A 64 10.929 -1.245 -14.150 1.00 0.00 O ATOM 923 CB ARG A 64 12.478 1.104 -13.121 1.00 0.00 C ATOM 924 CG ARG A 64 13.324 2.302 -13.569 1.00 0.00 C ATOM 925 CD ARG A 64 14.751 2.243 -13.004 1.00 0.00 C ATOM 926 NE ARG A 64 15.698 1.688 -13.993 1.00 0.00 N ATOM 927 CZ ARG A 64 16.981 1.429 -13.809 1.00 0.00 C ATOM 928 NH1 ARG A 64 17.556 1.555 -12.645 1.00 0.00 N ATOM 929 NH2 ARG A 64 17.718 1.038 -14.809 1.00 0.00 N ATOM 0 H ARG A 64 10.694 2.685 -12.422 1.00 0.00 H new ATOM 0 HA ARG A 64 11.137 1.292 -14.825 1.00 0.00 H new ATOM 0 HB2 ARG A 64 12.384 1.115 -12.035 1.00 0.00 H new ATOM 0 HB3 ARG A 64 12.992 0.180 -13.387 1.00 0.00 H new ATOM 0 HG2 ARG A 64 13.366 2.329 -14.658 1.00 0.00 H new ATOM 0 HG3 ARG A 64 12.844 3.226 -13.246 1.00 0.00 H new ATOM 0 HD2 ARG A 64 15.071 3.244 -12.713 1.00 0.00 H new ATOM 0 HD3 ARG A 64 14.762 1.630 -12.103 1.00 0.00 H new ATOM 0 HE ARG A 64 15.321 1.482 -14.918 1.00 0.00 H new ATOM 0 HH11 ARG A 64 17.013 1.863 -11.838 1.00 0.00 H new ATOM 0 HH12 ARG A 64 18.549 1.346 -12.541 1.00 0.00 H new ATOM 0 HH21 ARG A 64 17.305 0.931 -15.736 1.00 0.00 H new ATOM 0 HH22 ARG A 64 18.708 0.838 -14.666 1.00 0.00 H new ATOM 940 N CYS A 65 9.396 -0.375 -12.747 1.00 0.00 N ATOM 941 CA CYS A 65 8.777 -1.627 -12.336 1.00 0.00 C ATOM 942 C CYS A 65 9.781 -2.576 -11.678 1.00 0.00 C ATOM 943 O CYS A 65 10.077 -3.661 -12.183 1.00 0.00 O ATOM 944 CB CYS A 65 7.961 -2.226 -13.489 1.00 0.00 C ATOM 945 SG CYS A 65 6.684 -1.120 -14.142 1.00 0.00 S ATOM 0 H CYS A 65 8.939 0.443 -12.345 1.00 0.00 H new ATOM 0 HA CYS A 65 8.056 -1.429 -11.543 1.00 0.00 H new ATOM 0 HB2 CYS A 65 8.640 -2.498 -14.298 1.00 0.00 H new ATOM 0 HB3 CYS A 65 7.489 -3.147 -13.146 1.00 0.00 H new ATOM 949 N THR A 66 10.302 -2.151 -10.528 1.00 0.00 N ATOM 950 CA THR A 66 11.187 -2.921 -9.643 1.00 0.00 C ATOM 951 C THR A 66 10.890 -2.586 -8.174 1.00 0.00 C ATOM 952 O THR A 66 10.262 -1.566 -7.883 1.00 0.00 O ATOM 953 CB THR A 66 12.676 -2.669 -9.973 1.00 0.00 C ATOM 954 OG1 THR A 66 12.968 -1.284 -9.992 1.00 0.00 O ATOM 955 CG2 THR A 66 13.080 -3.217 -11.346 1.00 0.00 C ATOM 0 H THR A 66 10.112 -1.216 -10.167 1.00 0.00 H new ATOM 0 HA THR A 66 10.991 -3.980 -9.808 1.00 0.00 H new ATOM 0 HB THR A 66 13.231 -3.184 -9.190 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.916 -1.152 -10.201 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.136 -3.011 -11.524 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.911 -4.293 -11.372 1.00 0.00 H new ATOM 0 HG23 THR A 66 12.481 -2.737 -12.120 1.00 0.00 H new ATOM 963 N ILE A 67 11.321 -3.446 -7.242 1.00 0.00 N ATOM 964 CA ILE A 67 11.304 -3.222 -5.780 1.00 0.00 C ATOM 965 C ILE A 67 12.758 -2.964 -5.337 1.00 0.00 C ATOM 966 O ILE A 67 13.702 -3.354 -6.031 1.00 0.00 O ATOM 967 CB ILE A 67 10.691 -4.431 -5.003 1.00 0.00 C ATOM 968 CG1 ILE A 67 9.456 -5.088 -5.657 1.00 0.00 C ATOM 969 CG2 ILE A 67 10.396 -4.089 -3.531 1.00 0.00 C ATOM 970 CD1 ILE A 67 8.164 -4.320 -5.435 1.00 0.00 C ATOM 0 H ILE A 67 11.708 -4.356 -7.490 1.00 0.00 H new ATOM 0 HA ILE A 67 10.669 -2.366 -5.550 1.00 0.00 H new ATOM 0 HB ILE A 67 11.480 -5.182 -5.049 1.00 0.00 H new ATOM 0 HG12 ILE A 67 9.631 -5.184 -6.729 1.00 0.00 H new ATOM 0 HG13 ILE A 67 9.341 -6.097 -5.262 1.00 0.00 H new ATOM 0 HG21 ILE A 67 9.971 -4.961 -3.033 1.00 0.00 H new ATOM 0 HG22 ILE A 67 11.321 -3.801 -3.032 1.00 0.00 H new ATOM 0 HG23 ILE A 67 9.686 -3.263 -3.485 1.00 0.00 H new ATOM 0 HD11 ILE A 67 7.342 -4.843 -5.924 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.963 -4.247 -4.366 1.00 0.00 H new ATOM 0 HD13 ILE A 67 8.259 -3.319 -5.856 1.00 0.00 H new ATOM 981 N LYS A 68 12.969 -2.351 -4.167 1.00 0.00 N ATOM 982 CA LYS A 68 14.304 -2.200 -3.567 1.00 0.00 C ATOM 983 C LYS A 68 14.540 -3.280 -2.520 1.00 0.00 C ATOM 984 O LYS A 68 13.675 -3.529 -1.687 1.00 0.00 O ATOM 985 CB LYS A 68 14.458 -0.781 -2.970 1.00 0.00 C ATOM 986 CG LYS A 68 15.596 0.006 -3.640 1.00 0.00 C ATOM 987 CD LYS A 68 16.979 -0.182 -3.014 1.00 0.00 C ATOM 988 CE LYS A 68 18.039 0.551 -3.851 1.00 0.00 C ATOM 989 NZ LYS A 68 18.793 -0.362 -4.751 1.00 0.00 N ATOM 0 H LYS A 68 12.220 -1.944 -3.607 1.00 0.00 H new ATOM 0 HA LYS A 68 15.062 -2.322 -4.340 1.00 0.00 H new ATOM 0 HB2 LYS A 68 13.522 -0.235 -3.087 1.00 0.00 H new ATOM 0 HB3 LYS A 68 14.651 -0.857 -1.900 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.648 -0.285 -4.689 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.345 1.067 -3.615 1.00 0.00 H new ATOM 0 HD2 LYS A 68 16.981 0.201 -1.994 1.00 0.00 H new ATOM 0 HD3 LYS A 68 17.220 -1.243 -2.956 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.554 1.324 -4.448 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.738 1.055 -3.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 19.494 0.184 -5.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 19.280 -1.085 -4.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 18.133 -0.825 -5.408 1.00 0.00 H new ATOM 999 N LYS A 69 15.743 -3.856 -2.494 1.00 0.00 N ATOM 1000 CA LYS A 69 16.209 -4.751 -1.415 1.00 0.00 C ATOM 1001 C LYS A 69 16.233 -4.093 -0.026 1.00 0.00 C ATOM 1002 O LYS A 69 16.232 -4.783 0.991 1.00 0.00 O ATOM 1003 CB LYS A 69 17.576 -5.336 -1.812 1.00 0.00 C ATOM 1004 CG LYS A 69 18.725 -4.306 -1.769 1.00 0.00 C ATOM 1005 CD LYS A 69 19.611 -4.462 -0.525 1.00 0.00 C ATOM 1006 CE LYS A 69 20.565 -5.650 -0.712 1.00 0.00 C ATOM 1007 NZ LYS A 69 21.316 -5.956 0.533 1.00 0.00 N ATOM 0 H LYS A 69 16.436 -3.717 -3.229 1.00 0.00 H new ATOM 0 HA LYS A 69 15.483 -5.557 -1.310 1.00 0.00 H new ATOM 0 HB2 LYS A 69 17.816 -6.163 -1.144 1.00 0.00 H new ATOM 0 HB3 LYS A 69 17.507 -5.749 -2.818 1.00 0.00 H new ATOM 0 HG2 LYS A 69 19.339 -4.414 -2.663 1.00 0.00 H new ATOM 0 HG3 LYS A 69 18.307 -3.300 -1.789 1.00 0.00 H new ATOM 0 HD2 LYS A 69 20.182 -3.549 -0.357 1.00 0.00 H new ATOM 0 HD3 LYS A 69 18.990 -4.617 0.358 1.00 0.00 H new ATOM 0 HE2 LYS A 69 19.996 -6.528 -1.019 1.00 0.00 H new ATOM 0 HE3 LYS A 69 21.268 -5.429 -1.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 21.949 -6.764 0.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 21.878 -5.127 0.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 20.647 -6.192 1.293 1.00 0.00 H new ATOM 1017 N GLU A 70 16.235 -2.755 0.016 1.00 0.00 N ATOM 1018 CA GLU A 70 16.047 -1.949 1.231 1.00 0.00 C ATOM 1019 C GLU A 70 14.579 -1.889 1.705 1.00 0.00 C ATOM 1020 O GLU A 70 14.273 -1.200 2.682 1.00 0.00 O ATOM 1021 CB GLU A 70 16.618 -0.534 1.027 1.00 0.00 C ATOM 1022 CG GLU A 70 18.113 -0.552 0.672 1.00 0.00 C ATOM 1023 CD GLU A 70 18.793 0.786 1.019 1.00 0.00 C ATOM 1024 OE1 GLU A 70 18.491 1.817 0.367 1.00 0.00 O ATOM 1025 OE2 GLU A 70 19.650 0.816 1.938 1.00 0.00 O ATOM 0 H GLU A 70 16.371 -2.185 -0.819 1.00 0.00 H new ATOM 0 HA GLU A 70 16.599 -2.449 2.027 1.00 0.00 H new ATOM 0 HB2 GLU A 70 16.065 -0.033 0.233 1.00 0.00 H new ATOM 0 HB3 GLU A 70 16.470 0.049 1.936 1.00 0.00 H new ATOM 0 HG2 GLU A 70 18.606 -1.362 1.210 1.00 0.00 H new ATOM 0 HG3 GLU A 70 18.233 -0.757 -0.392 1.00 0.00 H new ATOM 1030 N ASN A 71 13.659 -2.611 1.049 1.00 0.00 N ATOM 1031 CA ASN A 71 12.349 -2.958 1.601 1.00 0.00 C ATOM 1032 C ASN A 71 12.446 -3.709 2.954 1.00 0.00 C ATOM 1033 O ASN A 71 13.515 -4.119 3.411 1.00 0.00 O ATOM 1034 CB ASN A 71 11.531 -3.746 0.553 1.00 0.00 C ATOM 1035 CG ASN A 71 12.012 -5.172 0.270 1.00 0.00 C ATOM 1036 OD1 ASN A 71 12.967 -5.692 0.830 1.00 0.00 O ATOM 1037 ND2 ASN A 71 11.337 -5.874 -0.607 1.00 0.00 N ATOM 0 H ASN A 71 13.810 -2.973 0.108 1.00 0.00 H new ATOM 0 HA ASN A 71 11.824 -2.030 1.825 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.495 -3.792 0.888 1.00 0.00 H new ATOM 0 HB3 ASN A 71 11.540 -3.187 -0.383 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.611 -6.835 -0.811 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.537 -5.459 -1.085 1.00 0.00 H new ATOM 1043 N THR A 72 11.282 -3.888 3.581 1.00 0.00 N ATOM 1044 CA THR A 72 11.045 -4.551 4.875 1.00 0.00 C ATOM 1045 C THR A 72 9.543 -4.633 5.154 1.00 0.00 C ATOM 1046 O THR A 72 9.064 -5.737 5.440 1.00 0.00 O ATOM 1047 CB THR A 72 11.795 -3.850 6.037 1.00 0.00 C ATOM 1048 OG1 THR A 72 12.963 -4.595 6.320 1.00 0.00 O ATOM 1049 CG2 THR A 72 11.048 -3.755 7.375 1.00 0.00 C ATOM 0 H THR A 72 10.412 -3.550 3.171 1.00 0.00 H new ATOM 0 HA THR A 72 11.447 -5.562 4.811 1.00 0.00 H new ATOM 0 HB THR A 72 11.955 -2.833 5.680 1.00 0.00 H new ATOM 0 HG1 THR A 72 13.508 -4.669 5.509 1.00 0.00 H new ATOM 0 HG21 THR A 72 11.675 -3.245 8.106 1.00 0.00 H new ATOM 0 HG22 THR A 72 10.123 -3.195 7.236 1.00 0.00 H new ATOM 0 HG23 THR A 72 10.814 -4.758 7.733 1.00 0.00 H new ATOM 1057 N PRO A 73 8.762 -3.530 5.047 1.00 0.00 N ATOM 1058 CA PRO A 73 7.330 -3.611 5.251 1.00 0.00 C ATOM 1059 C PRO A 73 6.679 -4.290 4.047 1.00 0.00 C ATOM 1060 O PRO A 73 7.034 -4.023 2.895 1.00 0.00 O ATOM 1061 CB PRO A 73 6.842 -2.175 5.455 1.00 0.00 C ATOM 1062 CG PRO A 73 7.899 -1.290 4.796 1.00 0.00 C ATOM 1063 CD PRO A 73 9.142 -2.170 4.659 1.00 0.00 C ATOM 0 HA PRO A 73 7.064 -4.212 6.121 1.00 0.00 H new ATOM 0 HB2 PRO A 73 5.863 -2.024 4.999 1.00 0.00 H new ATOM 0 HB3 PRO A 73 6.739 -1.942 6.515 1.00 0.00 H new ATOM 0 HG2 PRO A 73 7.561 -0.934 3.823 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.107 -0.409 5.403 1.00 0.00 H new ATOM 0 HD2 PRO A 73 9.513 -2.153 3.634 1.00 0.00 H new ATOM 0 HD3 PRO A 73 9.946 -1.800 5.295 1.00 0.00 H new ATOM 1068 N LEU A 74 5.693 -5.139 4.336 1.00 0.00 N ATOM 1069 CA LEU A 74 4.785 -5.719 3.354 1.00 0.00 C ATOM 1070 C LEU A 74 3.348 -5.505 3.835 1.00 0.00 C ATOM 1071 O LEU A 74 3.048 -5.672 5.023 1.00 0.00 O ATOM 1072 CB LEU A 74 5.160 -7.186 3.049 1.00 0.00 C ATOM 1073 CG LEU A 74 4.596 -8.284 3.982 1.00 0.00 C ATOM 1074 CD1 LEU A 74 3.162 -8.687 3.613 1.00 0.00 C ATOM 1075 CD2 LEU A 74 5.472 -9.534 3.858 1.00 0.00 C ATOM 0 H LEU A 74 5.501 -5.449 5.288 1.00 0.00 H new ATOM 0 HA LEU A 74 4.874 -5.217 2.391 1.00 0.00 H new ATOM 0 HB2 LEU A 74 4.835 -7.410 2.033 1.00 0.00 H new ATOM 0 HB3 LEU A 74 6.247 -7.263 3.060 1.00 0.00 H new ATOM 0 HG LEU A 74 4.594 -7.880 4.994 1.00 0.00 H new ATOM 0 HD11 LEU A 74 2.814 -9.460 4.298 1.00 0.00 H new ATOM 0 HD12 LEU A 74 2.509 -7.817 3.686 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.143 -9.071 2.593 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.085 -10.316 4.511 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.461 -9.885 2.826 1.00 0.00 H new ATOM 0 HD23 LEU A 74 6.494 -9.292 4.148 1.00 0.00 H new ATOM 1086 N LEU A 75 2.458 -5.134 2.914 1.00 0.00 N ATOM 1087 CA LEU A 75 1.033 -4.945 3.202 1.00 0.00 C ATOM 1088 C LEU A 75 0.199 -5.315 1.964 1.00 0.00 C ATOM 1089 O LEU A 75 0.437 -6.369 1.386 1.00 0.00 O ATOM 1090 CB LEU A 75 0.835 -3.511 3.754 1.00 0.00 C ATOM 1091 CG LEU A 75 -0.414 -3.200 4.617 1.00 0.00 C ATOM 1092 CD1 LEU A 75 -1.169 -2.025 4.001 1.00 0.00 C ATOM 1093 CD2 LEU A 75 -1.390 -4.361 4.851 1.00 0.00 C ATOM 0 H LEU A 75 2.705 -4.955 1.941 1.00 0.00 H new ATOM 0 HA LEU A 75 0.669 -5.616 3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.715 -3.264 4.348 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.824 -2.830 2.903 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.017 -2.971 5.606 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.049 -1.802 4.604 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.519 -1.151 3.970 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.479 -2.282 2.988 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.221 -4.019 5.468 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.771 -4.715 3.893 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.872 -5.175 5.359 1.00 0.00 H new ATOM 1104 N ASN A 76 -0.742 -4.471 1.528 1.00 0.00 N ATOM 1105 CA ASN A 76 -1.710 -4.698 0.445 1.00 0.00 C ATOM 1106 C ASN A 76 -2.802 -5.682 0.887 1.00 0.00 C ATOM 1107 O ASN A 76 -3.905 -5.259 1.228 1.00 0.00 O ATOM 1108 CB ASN A 76 -1.009 -5.128 -0.868 1.00 0.00 C ATOM 1109 CG ASN A 76 -1.694 -4.665 -2.138 1.00 0.00 C ATOM 1110 OD1 ASN A 76 -2.790 -4.133 -2.122 1.00 0.00 O ATOM 1111 ND2 ASN A 76 -1.042 -4.833 -3.265 1.00 0.00 N ATOM 0 H ASN A 76 -0.857 -3.549 1.949 1.00 0.00 H new ATOM 0 HA ASN A 76 -2.205 -3.752 0.226 1.00 0.00 H new ATOM 0 HB2 ASN A 76 0.011 -4.743 -0.861 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -0.939 -6.216 -0.886 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -1.452 -4.516 -4.144 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -0.125 -5.280 -3.262 1.00 0.00 H new ATOM 1117 N CYS A 77 -2.480 -6.980 0.942 1.00 0.00 N ATOM 1118 CA CYS A 77 -3.380 -8.044 1.374 1.00 0.00 C ATOM 1119 C CYS A 77 -2.581 -9.325 1.673 1.00 0.00 C ATOM 1120 O CYS A 77 -2.489 -10.207 0.818 1.00 0.00 O ATOM 1121 CB CYS A 77 -4.454 -8.296 0.302 1.00 0.00 C ATOM 1122 SG CYS A 77 -5.668 -9.546 0.801 1.00 0.00 S ATOM 0 H CYS A 77 -1.557 -7.324 0.678 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.883 -7.738 2.291 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -4.971 -7.361 0.086 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -3.971 -8.614 -0.622 1.00 0.00 H new ATOM 1126 N ALA A 78 -1.966 -9.421 2.858 1.00 0.00 N ATOM 1127 CA ALA A 78 -1.189 -10.602 3.242 1.00 0.00 C ATOM 1128 C ALA A 78 -2.071 -11.810 3.616 1.00 0.00 C ATOM 1129 O ALA A 78 -1.970 -12.852 2.966 1.00 0.00 O ATOM 1130 CB ALA A 78 -0.242 -10.227 4.386 1.00 0.00 C ATOM 0 H ALA A 78 -1.993 -8.690 3.569 1.00 0.00 H new ATOM 0 HA ALA A 78 -0.611 -10.921 2.374 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.340 -11.101 4.678 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.432 -9.436 4.056 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -0.823 -9.877 5.239 1.00 0.00 H new ATOM 1136 N LYS A 79 -2.925 -11.659 4.648 1.00 0.00 N ATOM 1137 CA LYS A 79 -3.831 -12.686 5.217 1.00 0.00 C ATOM 1138 C LYS A 79 -3.225 -14.112 5.196 1.00 0.00 C ATOM 1139 O LYS A 79 -3.555 -14.930 4.337 1.00 0.00 O ATOM 1140 CB LYS A 79 -5.247 -12.488 4.611 1.00 0.00 C ATOM 1141 CG LYS A 79 -6.244 -13.662 4.733 1.00 0.00 C ATOM 1142 CD LYS A 79 -6.274 -14.530 3.462 1.00 0.00 C ATOM 1143 CE LYS A 79 -6.281 -16.026 3.805 1.00 0.00 C ATOM 1144 NZ LYS A 79 -5.780 -16.833 2.664 1.00 0.00 N ATOM 0 H LYS A 79 -3.008 -10.768 5.137 1.00 0.00 H new ATOM 0 HA LYS A 79 -3.954 -12.549 6.291 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -5.696 -11.614 5.083 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -5.131 -12.254 3.553 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.972 -14.281 5.588 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -7.242 -13.271 4.928 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -7.159 -14.286 2.874 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -5.407 -14.301 2.843 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.660 -16.205 4.683 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -7.293 -16.340 4.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.794 -17.841 2.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -6.388 -16.677 1.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.806 -16.547 2.437 1.00 0.00 H new ATOM 1154 N PRO A 80 -2.295 -14.448 6.115 1.00 0.00 N ATOM 1155 CA PRO A 80 -1.684 -15.776 6.130 1.00 0.00 C ATOM 1156 C PRO A 80 -2.683 -16.864 6.561 1.00 0.00 C ATOM 1157 O PRO A 80 -2.717 -17.936 5.955 1.00 0.00 O ATOM 1158 CB PRO A 80 -0.477 -15.664 7.063 1.00 0.00 C ATOM 1159 CG PRO A 80 -0.786 -14.475 7.973 1.00 0.00 C ATOM 1160 CD PRO A 80 -1.782 -13.614 7.192 1.00 0.00 C ATOM 0 HA PRO A 80 -1.369 -16.087 5.134 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -0.340 -16.578 7.641 1.00 0.00 H new ATOM 0 HB3 PRO A 80 0.442 -15.501 6.500 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -1.211 -14.806 8.921 1.00 0.00 H new ATOM 0 HG3 PRO A 80 0.119 -13.914 8.208 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -2.591 -13.274 7.838 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -1.296 -12.723 6.795 1.00 0.00 H new ATOM 1165 N ASP A 81 -3.531 -16.584 7.560 1.00 0.00 N ATOM 1166 CA ASP A 81 -4.592 -17.493 8.037 1.00 0.00 C ATOM 1167 C ASP A 81 -5.751 -16.763 8.773 1.00 0.00 C ATOM 1168 O ASP A 81 -6.542 -17.382 9.488 1.00 0.00 O ATOM 1169 CB ASP A 81 -3.946 -18.571 8.932 1.00 0.00 C ATOM 1170 CG ASP A 81 -4.832 -19.811 9.161 1.00 0.00 C ATOM 1171 OD1 ASP A 81 -5.532 -20.259 8.218 1.00 0.00 O ATOM 1172 OD2 ASP A 81 -4.781 -20.389 10.276 1.00 0.00 O ATOM 0 H ASP A 81 -3.501 -15.702 8.072 1.00 0.00 H new ATOM 0 HA ASP A 81 -5.059 -17.954 7.167 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -3.006 -18.888 8.480 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.702 -18.128 9.898 1.00 0.00 H new ATOM 1176 N GLN A 82 -5.840 -15.435 8.632 1.00 0.00 N ATOM 1177 CA GLN A 82 -6.818 -14.555 9.296 1.00 0.00 C ATOM 1178 C GLN A 82 -7.021 -13.274 8.467 1.00 0.00 C ATOM 1179 O GLN A 82 -6.106 -12.857 7.753 1.00 0.00 O ATOM 1180 CB GLN A 82 -6.297 -14.222 10.714 1.00 0.00 C ATOM 1181 CG GLN A 82 -7.191 -13.241 11.489 1.00 0.00 C ATOM 1182 CD GLN A 82 -6.729 -12.966 12.921 1.00 0.00 C ATOM 1183 OE1 GLN A 82 -6.261 -13.836 13.647 1.00 0.00 O ATOM 1184 NE2 GLN A 82 -6.854 -11.740 13.383 1.00 0.00 N ATOM 0 H GLN A 82 -5.204 -14.918 8.025 1.00 0.00 H new ATOM 0 HA GLN A 82 -7.783 -15.055 9.377 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -6.208 -15.146 11.285 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -5.295 -13.800 10.633 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -7.232 -12.297 10.945 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -8.206 -13.637 11.517 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.242 -11.008 12.788 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.563 -11.522 14.336 1.00 0.00 H new ATOM 1191 N ASP A 83 -8.191 -12.630 8.578 1.00 0.00 N ATOM 1192 CA ASP A 83 -8.459 -11.304 7.998 1.00 0.00 C ATOM 1193 C ASP A 83 -7.324 -10.296 8.267 1.00 0.00 C ATOM 1194 O ASP A 83 -6.816 -10.201 9.391 1.00 0.00 O ATOM 1195 CB ASP A 83 -9.816 -10.765 8.497 1.00 0.00 C ATOM 1196 CG ASP A 83 -9.785 -10.118 9.899 1.00 0.00 C ATOM 1197 OD1 ASP A 83 -9.601 -10.844 10.906 1.00 0.00 O ATOM 1198 OD2 ASP A 83 -10.011 -8.888 9.997 1.00 0.00 O ATOM 0 H ASP A 83 -8.989 -13.019 9.080 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.506 -11.428 6.916 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -10.183 -10.029 7.782 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.534 -11.585 8.507 1.00 0.00 H new ATOM 1202 N ILE A 84 -6.930 -9.524 7.246 1.00 0.00 N ATOM 1203 CA ILE A 84 -5.933 -8.463 7.417 1.00 0.00 C ATOM 1204 C ILE A 84 -6.658 -7.136 7.613 1.00 0.00 C ATOM 1205 O ILE A 84 -7.601 -6.800 6.891 1.00 0.00 O ATOM 1206 CB ILE A 84 -4.858 -8.476 6.294 1.00 0.00 C ATOM 1207 CG1 ILE A 84 -3.416 -8.486 6.854 1.00 0.00 C ATOM 1208 CG2 ILE A 84 -4.936 -7.285 5.324 1.00 0.00 C ATOM 1209 CD1 ILE A 84 -3.064 -9.684 7.750 1.00 0.00 C ATOM 0 H ILE A 84 -7.287 -9.615 6.295 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.345 -8.638 8.318 1.00 0.00 H new ATOM 0 HB ILE A 84 -5.083 -9.397 5.756 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -2.719 -8.464 6.016 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -3.259 -7.570 7.423 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.150 -7.375 4.574 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.909 -7.280 4.832 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.805 -6.355 5.878 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.032 -9.594 8.089 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.729 -9.701 8.613 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.181 -10.608 7.184 1.00 0.00 H new ATOM 1220 N LYS A 85 -6.214 -6.385 8.617 1.00 0.00 N ATOM 1221 CA LYS A 85 -6.726 -5.060 8.954 1.00 0.00 C ATOM 1222 C LYS A 85 -5.602 -4.239 9.578 1.00 0.00 C ATOM 1223 O LYS A 85 -4.885 -4.719 10.459 1.00 0.00 O ATOM 1224 CB LYS A 85 -7.982 -5.166 9.848 1.00 0.00 C ATOM 1225 CG LYS A 85 -7.798 -6.068 11.082 1.00 0.00 C ATOM 1226 CD LYS A 85 -8.930 -5.904 12.109 1.00 0.00 C ATOM 1227 CE LYS A 85 -8.436 -6.228 13.526 1.00 0.00 C ATOM 1228 NZ LYS A 85 -7.530 -5.165 14.045 1.00 0.00 N ATOM 0 H LYS A 85 -5.465 -6.691 9.238 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.053 -4.539 8.054 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -8.265 -4.167 10.180 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.809 -5.549 9.251 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.750 -7.109 10.762 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -6.845 -5.837 11.558 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -9.310 -4.883 12.077 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -9.760 -6.562 11.850 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.290 -6.337 14.194 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.912 -7.184 13.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.472 -5.234 15.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.582 -5.287 13.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -7.904 -4.231 13.781 1.00 0.00 H new ATOM 1238 N PHE A 86 -5.419 -3.018 9.090 1.00 0.00 N ATOM 1239 CA PHE A 86 -4.305 -2.144 9.463 1.00 0.00 C ATOM 1240 C PHE A 86 -4.825 -0.713 9.571 1.00 0.00 C ATOM 1241 O PHE A 86 -5.100 -0.062 8.561 1.00 0.00 O ATOM 1242 CB PHE A 86 -3.151 -2.282 8.445 1.00 0.00 C ATOM 1243 CG PHE A 86 -1.857 -2.818 9.014 1.00 0.00 C ATOM 1244 CD1 PHE A 86 -1.706 -4.204 9.212 1.00 0.00 C ATOM 1245 CD2 PHE A 86 -0.789 -1.950 9.310 1.00 0.00 C ATOM 1246 CE1 PHE A 86 -0.497 -4.718 9.707 1.00 0.00 C ATOM 1247 CE2 PHE A 86 0.422 -2.466 9.803 1.00 0.00 C ATOM 1248 CZ PHE A 86 0.569 -3.850 10.001 1.00 0.00 C ATOM 0 H PHE A 86 -6.052 -2.596 8.410 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.897 -2.433 10.432 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.475 -2.939 7.638 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.958 -1.305 8.002 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.522 -4.873 8.983 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -0.900 -0.887 9.158 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.386 -5.781 9.862 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.240 -1.799 10.030 1.00 0.00 H new ATOM 0 HZ PHE A 86 1.500 -4.246 10.379 1.00 0.00 H new ATOM 1257 N THR A 87 -4.996 -0.237 10.806 1.00 0.00 N ATOM 1258 CA THR A 87 -5.451 1.128 11.093 1.00 0.00 C ATOM 1259 C THR A 87 -4.260 2.028 11.409 1.00 0.00 C ATOM 1260 O THR A 87 -3.416 1.703 12.252 1.00 0.00 O ATOM 1261 CB THR A 87 -6.530 1.146 12.191 1.00 0.00 C ATOM 1262 OG1 THR A 87 -7.000 2.467 12.343 1.00 0.00 O ATOM 1263 CG2 THR A 87 -6.104 0.643 13.571 1.00 0.00 C ATOM 0 H THR A 87 -4.821 -0.792 11.644 1.00 0.00 H new ATOM 0 HA THR A 87 -5.930 1.532 10.202 1.00 0.00 H new ATOM 0 HB THR A 87 -7.289 0.446 11.842 1.00 0.00 H new ATOM 0 HG1 THR A 87 -7.689 2.491 13.039 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.949 0.704 14.257 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.773 -0.393 13.495 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.286 1.258 13.946 1.00 0.00 H new ATOM 1271 N ILE A 88 -4.182 3.165 10.715 1.00 0.00 N ATOM 1272 CA ILE A 88 -3.222 4.238 10.978 1.00 0.00 C ATOM 1273 C ILE A 88 -3.996 5.447 11.482 1.00 0.00 C ATOM 1274 O ILE A 88 -4.915 5.935 10.819 1.00 0.00 O ATOM 1275 CB ILE A 88 -2.384 4.560 9.716 1.00 0.00 C ATOM 1276 CG1 ILE A 88 -1.194 3.585 9.665 1.00 0.00 C ATOM 1277 CG2 ILE A 88 -1.897 6.027 9.657 1.00 0.00 C ATOM 1278 CD1 ILE A 88 -0.283 3.750 8.438 1.00 0.00 C ATOM 0 H ILE A 88 -4.803 3.370 9.932 1.00 0.00 H new ATOM 0 HA ILE A 88 -2.506 3.929 11.740 1.00 0.00 H new ATOM 0 HB ILE A 88 -3.025 4.434 8.844 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.595 3.716 10.566 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.576 2.564 9.682 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -1.317 6.181 8.747 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.757 6.696 9.657 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -1.273 6.238 10.525 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.527 3.023 8.486 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.863 3.587 7.530 1.00 0.00 H new ATOM 0 HD13 ILE A 88 0.134 4.757 8.427 1.00 0.00 H new ATOM 1289 N LYS A 89 -3.555 5.960 12.631 1.00 0.00 N ATOM 1290 CA LYS A 89 -3.953 7.250 13.187 1.00 0.00 C ATOM 1291 C LYS A 89 -2.898 8.306 12.850 1.00 0.00 C ATOM 1292 O LYS A 89 -1.700 8.029 12.907 1.00 0.00 O ATOM 1293 CB LYS A 89 -4.222 7.110 14.700 1.00 0.00 C ATOM 1294 CG LYS A 89 -3.073 6.456 15.497 1.00 0.00 C ATOM 1295 CD LYS A 89 -3.314 6.339 17.011 1.00 0.00 C ATOM 1296 CE LYS A 89 -3.584 7.686 17.700 1.00 0.00 C ATOM 1297 NZ LYS A 89 -5.016 7.864 18.062 1.00 0.00 N ATOM 0 H LYS A 89 -2.885 5.468 13.222 1.00 0.00 H new ATOM 0 HA LYS A 89 -4.887 7.587 12.737 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.418 8.099 15.114 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -5.127 6.520 14.842 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.894 5.459 15.095 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -2.163 7.033 15.333 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.161 5.676 17.185 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -2.444 5.872 17.473 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.973 7.759 18.600 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -3.276 8.496 17.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -5.145 8.787 18.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -5.599 7.822 17.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -5.306 7.107 18.714 1.00 0.00 H new ATOM 1307 N PHE A 90 -3.349 9.520 12.527 1.00 0.00 N ATOM 1308 CA PHE A 90 -2.516 10.711 12.300 1.00 0.00 C ATOM 1309 C PHE A 90 -1.395 10.886 13.339 1.00 0.00 C ATOM 1310 O PHE A 90 -0.248 11.173 12.991 1.00 0.00 O ATOM 1311 CB PHE A 90 -3.419 11.959 12.300 1.00 0.00 C ATOM 1312 CG PHE A 90 -4.329 12.121 13.509 1.00 0.00 C ATOM 1313 CD1 PHE A 90 -5.531 11.392 13.614 1.00 0.00 C ATOM 1314 CD2 PHE A 90 -3.949 12.981 14.554 1.00 0.00 C ATOM 1315 CE1 PHE A 90 -6.312 11.477 14.779 1.00 0.00 C ATOM 1316 CE2 PHE A 90 -4.736 13.076 15.716 1.00 0.00 C ATOM 1317 CZ PHE A 90 -5.908 12.310 15.835 1.00 0.00 C ATOM 0 H PHE A 90 -4.344 9.712 12.411 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.024 10.578 11.337 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.785 12.842 12.226 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.039 11.935 11.404 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -5.853 10.765 12.795 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.049 13.571 14.464 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -7.222 10.902 14.862 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.440 13.738 16.517 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.498 12.362 16.738 1.00 0.00 H new ATOM 1326 N GLN A 91 -1.727 10.686 14.617 1.00 0.00 N ATOM 1327 CA GLN A 91 -0.816 10.796 15.751 1.00 0.00 C ATOM 1328 C GLN A 91 -0.241 9.418 16.114 1.00 0.00 C ATOM 1329 O GLN A 91 -0.818 8.687 16.920 1.00 0.00 O ATOM 1330 CB GLN A 91 -1.573 11.430 16.929 1.00 0.00 C ATOM 1331 CG GLN A 91 -0.663 11.764 18.127 1.00 0.00 C ATOM 1332 CD GLN A 91 -0.219 13.229 18.219 1.00 0.00 C ATOM 1333 OE1 GLN A 91 -0.647 14.121 17.497 1.00 0.00 O ATOM 1334 NE2 GLN A 91 0.666 13.535 19.143 1.00 0.00 N ATOM 0 H GLN A 91 -2.675 10.434 14.897 1.00 0.00 H new ATOM 0 HA GLN A 91 0.030 11.434 15.494 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -2.064 12.342 16.588 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -2.358 10.749 17.257 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -1.187 11.501 19.046 1.00 0.00 H new ATOM 0 HG3 GLN A 91 0.225 11.134 18.075 1.00 0.00 H new ATOM 0 HE21 GLN A 91 1.036 12.808 19.755 1.00 0.00 H new ATOM 0 HE22 GLN A 91 0.982 14.499 19.247 1.00 0.00 H new ATOM 1341 N GLU A 92 0.903 9.058 15.535 1.00 0.00 N ATOM 1342 CA GLU A 92 1.604 7.806 15.847 1.00 0.00 C ATOM 1343 C GLU A 92 3.124 8.011 15.830 1.00 0.00 C ATOM 1344 O GLU A 92 3.827 7.512 14.949 1.00 0.00 O ATOM 1345 CB GLU A 92 1.145 6.673 14.908 1.00 0.00 C ATOM 1346 CG GLU A 92 1.638 5.279 15.332 1.00 0.00 C ATOM 1347 CD GLU A 92 0.810 4.662 16.475 1.00 0.00 C ATOM 1348 OE1 GLU A 92 0.879 5.154 17.627 1.00 0.00 O ATOM 1349 OE2 GLU A 92 0.105 3.648 16.235 1.00 0.00 O ATOM 0 H GLU A 92 1.375 9.627 14.832 1.00 0.00 H new ATOM 0 HA GLU A 92 1.342 7.500 16.860 1.00 0.00 H new ATOM 0 HB2 GLU A 92 0.056 6.666 14.867 1.00 0.00 H new ATOM 0 HB3 GLU A 92 1.501 6.883 13.899 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.608 4.613 14.470 1.00 0.00 H new ATOM 0 HG3 GLU A 92 2.680 5.349 15.644 1.00 0.00 H new ATOM 1354 N PHE A 93 3.642 8.795 16.784 1.00 0.00 N ATOM 1355 CA PHE A 93 5.088 8.940 16.973 1.00 0.00 C ATOM 1356 C PHE A 93 5.757 7.559 17.149 1.00 0.00 C ATOM 1357 O PHE A 93 5.227 6.684 17.845 1.00 0.00 O ATOM 1358 CB PHE A 93 5.393 9.894 18.141 1.00 0.00 C ATOM 1359 CG PHE A 93 5.368 9.274 19.530 1.00 0.00 C ATOM 1360 CD1 PHE A 93 4.152 9.088 20.212 1.00 0.00 C ATOM 1361 CD2 PHE A 93 6.572 8.860 20.132 1.00 0.00 C ATOM 1362 CE1 PHE A 93 4.137 8.471 21.477 1.00 0.00 C ATOM 1363 CE2 PHE A 93 6.559 8.246 21.396 1.00 0.00 C ATOM 1364 CZ PHE A 93 5.339 8.043 22.065 1.00 0.00 C ATOM 0 H PHE A 93 3.079 9.339 17.437 1.00 0.00 H new ATOM 0 HA PHE A 93 5.516 9.389 16.077 1.00 0.00 H new ATOM 0 HB2 PHE A 93 6.377 10.333 17.978 1.00 0.00 H new ATOM 0 HB3 PHE A 93 4.671 10.710 18.116 1.00 0.00 H new ATOM 0 HD1 PHE A 93 3.227 9.420 19.764 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.510 9.015 19.620 1.00 0.00 H new ATOM 0 HE1 PHE A 93 3.201 8.327 21.996 1.00 0.00 H new ATOM 0 HE2 PHE A 93 7.485 7.930 21.853 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.326 7.558 23.030 1.00 0.00 H new ATOM 1373 N SER A 94 6.921 7.351 16.526 1.00 0.00 N ATOM 1374 CA SER A 94 7.649 6.077 16.574 1.00 0.00 C ATOM 1375 C SER A 94 9.158 6.330 16.564 1.00 0.00 C ATOM 1376 O SER A 94 9.633 7.099 15.725 1.00 0.00 O ATOM 1377 CB SER A 94 7.270 5.208 15.368 1.00 0.00 C ATOM 1378 OG SER A 94 7.828 3.913 15.515 1.00 0.00 O ATOM 0 H SER A 94 7.389 8.067 15.970 1.00 0.00 H new ATOM 0 HA SER A 94 7.378 5.557 17.493 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.185 5.139 15.284 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.632 5.668 14.449 1.00 0.00 H new ATOM 0 HG SER A 94 7.582 3.361 14.743 1.00 0.00 H new ATOM 1383 N PRO A 95 9.950 5.687 17.442 1.00 0.00 N ATOM 1384 CA PRO A 95 11.391 5.913 17.490 1.00 0.00 C ATOM 1385 C PRO A 95 12.123 5.363 16.250 1.00 0.00 C ATOM 1386 O PRO A 95 13.256 5.763 15.972 1.00 0.00 O ATOM 1387 CB PRO A 95 11.859 5.262 18.794 1.00 0.00 C ATOM 1388 CG PRO A 95 10.810 4.190 19.096 1.00 0.00 C ATOM 1389 CD PRO A 95 9.538 4.681 18.411 1.00 0.00 C ATOM 0 HA PRO A 95 11.626 6.977 17.474 1.00 0.00 H new ATOM 0 HB2 PRO A 95 12.851 4.824 18.683 1.00 0.00 H new ATOM 0 HB3 PRO A 95 11.921 5.993 19.601 1.00 0.00 H new ATOM 0 HG2 PRO A 95 11.116 3.218 18.710 1.00 0.00 H new ATOM 0 HG3 PRO A 95 10.661 4.074 20.170 1.00 0.00 H new ATOM 0 HD2 PRO A 95 9.020 3.858 17.919 1.00 0.00 H new ATOM 0 HD3 PRO A 95 8.845 5.104 19.138 1.00 0.00 H new ATOM 1394 N ASN A 96 11.476 4.472 15.485 1.00 0.00 N ATOM 1395 CA ASN A 96 12.011 3.892 14.250 1.00 0.00 C ATOM 1396 C ASN A 96 11.790 4.780 13.009 1.00 0.00 C ATOM 1397 O ASN A 96 12.559 4.711 12.050 1.00 0.00 O ATOM 1398 CB ASN A 96 11.341 2.514 14.054 1.00 0.00 C ATOM 1399 CG ASN A 96 12.259 1.475 13.421 1.00 0.00 C ATOM 1400 OD1 ASN A 96 13.158 1.761 12.646 1.00 0.00 O ATOM 1401 ND2 ASN A 96 12.064 0.219 13.753 1.00 0.00 N ATOM 0 H ASN A 96 10.544 4.128 15.716 1.00 0.00 H new ATOM 0 HA ASN A 96 13.092 3.801 14.352 1.00 0.00 H new ATOM 0 HB2 ASN A 96 11.000 2.144 15.021 1.00 0.00 H new ATOM 0 HB3 ASN A 96 10.457 2.635 13.428 1.00 0.00 H new ATOM 0 HD21 ASN A 96 12.662 -0.510 13.364 1.00 0.00 H new ATOM 0 HD22 ASN A 96 11.315 -0.027 14.400 1.00 0.00 H new ATOM 1407 N LEU A 97 10.715 5.585 12.997 1.00 0.00 N ATOM 1408 CA LEU A 97 10.221 6.413 11.876 1.00 0.00 C ATOM 1409 C LEU A 97 9.739 5.630 10.629 1.00 0.00 C ATOM 1410 O LEU A 97 8.982 6.160 9.816 1.00 0.00 O ATOM 1411 CB LEU A 97 11.273 7.492 11.538 1.00 0.00 C ATOM 1412 CG LEU A 97 10.681 8.826 11.029 1.00 0.00 C ATOM 1413 CD1 LEU A 97 11.094 9.977 11.948 1.00 0.00 C ATOM 1414 CD2 LEU A 97 11.170 9.154 9.617 1.00 0.00 C ATOM 0 H LEU A 97 10.126 5.684 13.824 1.00 0.00 H new ATOM 0 HA LEU A 97 9.304 6.890 12.222 1.00 0.00 H new ATOM 0 HB2 LEU A 97 11.871 7.690 12.428 1.00 0.00 H new ATOM 0 HB3 LEU A 97 11.950 7.097 10.781 1.00 0.00 H new ATOM 0 HG LEU A 97 9.597 8.710 11.021 1.00 0.00 H new ATOM 0 HD11 LEU A 97 10.669 10.910 11.576 1.00 0.00 H new ATOM 0 HD12 LEU A 97 10.726 9.787 12.956 1.00 0.00 H new ATOM 0 HD13 LEU A 97 12.181 10.055 11.967 1.00 0.00 H new ATOM 0 HD21 LEU A 97 10.734 10.098 9.291 1.00 0.00 H new ATOM 0 HD22 LEU A 97 12.257 9.238 9.619 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.868 8.360 8.934 1.00 0.00 H new ATOM 1425 N TRP A 98 10.121 4.355 10.504 1.00 0.00 N ATOM 1426 CA TRP A 98 9.704 3.405 9.464 1.00 0.00 C ATOM 1427 C TRP A 98 8.480 2.556 9.848 1.00 0.00 C ATOM 1428 O TRP A 98 8.051 1.704 9.067 1.00 0.00 O ATOM 1429 CB TRP A 98 10.907 2.505 9.132 1.00 0.00 C ATOM 1430 CG TRP A 98 11.882 3.060 8.139 1.00 0.00 C ATOM 1431 CD1 TRP A 98 12.383 4.318 8.119 1.00 0.00 C ATOM 1432 CD2 TRP A 98 12.475 2.376 6.990 1.00 0.00 C ATOM 1433 NE1 TRP A 98 13.223 4.467 7.031 1.00 0.00 N ATOM 1434 CE2 TRP A 98 13.317 3.302 6.304 1.00 0.00 C ATOM 1435 CE3 TRP A 98 12.385 1.071 6.462 1.00 0.00 C ATOM 1436 CZ2 TRP A 98 14.028 2.952 5.145 1.00 0.00 C ATOM 1437 CZ3 TRP A 98 13.099 0.709 5.299 1.00 0.00 C ATOM 1438 CH2 TRP A 98 13.916 1.647 4.641 1.00 0.00 C ATOM 0 H TRP A 98 10.770 3.931 11.167 1.00 0.00 H new ATOM 0 HA TRP A 98 9.387 3.980 8.594 1.00 0.00 H new ATOM 0 HB2 TRP A 98 11.442 2.290 10.057 1.00 0.00 H new ATOM 0 HB3 TRP A 98 10.532 1.555 8.752 1.00 0.00 H new ATOM 0 HD1 TRP A 98 12.160 5.088 8.843 1.00 0.00 H new ATOM 0 HE1 TRP A 98 13.711 5.331 6.797 1.00 0.00 H new ATOM 0 HE3 TRP A 98 11.762 0.339 6.954 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 14.654 3.678 4.647 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 13.018 -0.296 4.911 1.00 0.00 H new ATOM 0 HH2 TRP A 98 14.456 1.363 3.750 1.00 0.00 H new ATOM 1448 N GLY A 99 7.902 2.771 11.038 1.00 0.00 N ATOM 1449 CA GLY A 99 6.685 2.080 11.473 1.00 0.00 C ATOM 1450 C GLY A 99 5.452 2.595 10.732 1.00 0.00 C ATOM 1451 O GLY A 99 5.004 2.002 9.748 1.00 0.00 O ATOM 0 H GLY A 99 8.267 3.430 11.725 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.793 1.009 11.301 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.550 2.219 12.546 1.00 0.00 H new ATOM 1454 N LEU A 100 4.918 3.724 11.209 1.00 0.00 N ATOM 1455 CA LEU A 100 3.685 4.348 10.709 1.00 0.00 C ATOM 1456 C LEU A 100 3.794 5.890 10.682 1.00 0.00 C ATOM 1457 O LEU A 100 2.820 6.574 10.363 1.00 0.00 O ATOM 1458 CB LEU A 100 2.493 3.892 11.585 1.00 0.00 C ATOM 1459 CG LEU A 100 2.338 2.372 11.836 1.00 0.00 C ATOM 1460 CD1 LEU A 100 1.426 2.114 13.030 1.00 0.00 C ATOM 1461 CD2 LEU A 100 1.776 1.603 10.641 1.00 0.00 C ATOM 0 H LEU A 100 5.343 4.245 11.976 1.00 0.00 H new ATOM 0 HA LEU A 100 3.524 4.026 9.680 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.576 4.387 12.553 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.575 4.253 11.120 1.00 0.00 H new ATOM 0 HG LEU A 100 3.349 2.011 12.024 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.330 1.040 13.189 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.852 2.576 13.920 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.442 2.541 12.835 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.697 0.546 10.893 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.789 1.991 10.390 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.441 1.723 9.786 1.00 0.00 H new ATOM 1472 N GLU A 101 4.963 6.458 11.024 1.00 0.00 N ATOM 1473 CA GLU A 101 5.207 7.902 10.924 1.00 0.00 C ATOM 1474 C GLU A 101 5.238 8.376 9.467 1.00 0.00 C ATOM 1475 O GLU A 101 5.768 7.706 8.573 1.00 0.00 O ATOM 1476 CB GLU A 101 6.519 8.316 11.620 1.00 0.00 C ATOM 1477 CG GLU A 101 6.343 8.485 13.134 1.00 0.00 C ATOM 1478 CD GLU A 101 7.155 9.668 13.687 1.00 0.00 C ATOM 1479 OE1 GLU A 101 6.644 10.811 13.678 1.00 0.00 O ATOM 1480 OE2 GLU A 101 8.285 9.456 14.183 1.00 0.00 O ATOM 0 H GLU A 101 5.761 5.929 11.376 1.00 0.00 H new ATOM 0 HA GLU A 101 4.372 8.383 11.435 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.284 7.564 11.427 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.876 9.252 11.191 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.287 8.634 13.360 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.651 7.569 13.638 1.00 0.00 H new ATOM 1485 N PHE A 102 4.699 9.574 9.243 1.00 0.00 N ATOM 1486 CA PHE A 102 4.799 10.283 7.972 1.00 0.00 C ATOM 1487 C PHE A 102 6.105 11.095 7.886 1.00 0.00 C ATOM 1488 O PHE A 102 6.794 11.302 8.891 1.00 0.00 O ATOM 1489 CB PHE A 102 3.540 11.150 7.789 1.00 0.00 C ATOM 1490 CG PHE A 102 3.625 12.596 8.256 1.00 0.00 C ATOM 1491 CD1 PHE A 102 3.930 12.920 9.593 1.00 0.00 C ATOM 1492 CD2 PHE A 102 3.358 13.630 7.340 1.00 0.00 C ATOM 1493 CE1 PHE A 102 3.973 14.264 10.003 1.00 0.00 C ATOM 1494 CE2 PHE A 102 3.406 14.974 7.747 1.00 0.00 C ATOM 1495 CZ PHE A 102 3.717 15.291 9.079 1.00 0.00 C ATOM 0 H PHE A 102 4.173 10.085 9.952 1.00 0.00 H new ATOM 0 HA PHE A 102 4.844 9.569 7.149 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.279 11.150 6.731 1.00 0.00 H new ATOM 0 HB3 PHE A 102 2.718 10.670 8.320 1.00 0.00 H new ATOM 0 HD1 PHE A 102 4.131 12.133 10.305 1.00 0.00 H new ATOM 0 HD2 PHE A 102 3.114 13.389 6.316 1.00 0.00 H new ATOM 0 HE1 PHE A 102 4.203 14.507 11.030 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.204 15.762 7.036 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.759 16.323 9.393 1.00 0.00 H new ATOM 1504 N GLN A 103 6.425 11.607 6.695 1.00 0.00 N ATOM 1505 CA GLN A 103 7.490 12.595 6.496 1.00 0.00 C ATOM 1506 C GLN A 103 6.916 13.849 5.823 1.00 0.00 C ATOM 1507 O GLN A 103 5.958 13.759 5.052 1.00 0.00 O ATOM 1508 CB GLN A 103 8.642 12.005 5.661 1.00 0.00 C ATOM 1509 CG GLN A 103 9.292 10.740 6.260 1.00 0.00 C ATOM 1510 CD GLN A 103 8.752 9.414 5.710 1.00 0.00 C ATOM 1511 OE1 GLN A 103 8.139 9.325 4.655 1.00 0.00 O ATOM 1512 NE2 GLN A 103 8.994 8.316 6.391 1.00 0.00 N ATOM 0 H GLN A 103 5.948 11.345 5.833 1.00 0.00 H new ATOM 0 HA GLN A 103 7.896 12.871 7.469 1.00 0.00 H new ATOM 0 HB2 GLN A 103 8.266 11.767 4.666 1.00 0.00 H new ATOM 0 HB3 GLN A 103 9.411 12.768 5.538 1.00 0.00 H new ATOM 0 HG2 GLN A 103 10.366 10.781 6.079 1.00 0.00 H new ATOM 0 HG3 GLN A 103 9.150 10.753 7.341 1.00 0.00 H new ATOM 0 HE21 GLN A 103 9.503 8.365 7.273 1.00 0.00 H new ATOM 0 HE22 GLN A 103 8.672 7.415 6.037 1.00 0.00 H new ATOM 1519 N LYS A 104 7.502 15.022 6.093 1.00 0.00 N ATOM 1520 CA LYS A 104 7.074 16.308 5.512 1.00 0.00 C ATOM 1521 C LYS A 104 7.962 16.683 4.320 1.00 0.00 C ATOM 1522 O LYS A 104 9.147 16.347 4.288 1.00 0.00 O ATOM 1523 CB LYS A 104 7.051 17.379 6.626 1.00 0.00 C ATOM 1524 CG LYS A 104 5.995 18.486 6.440 1.00 0.00 C ATOM 1525 CD LYS A 104 6.532 19.781 5.808 1.00 0.00 C ATOM 1526 CE LYS A 104 5.387 20.786 5.619 1.00 0.00 C ATOM 1527 NZ LYS A 104 5.795 21.949 4.786 1.00 0.00 N ATOM 0 H LYS A 104 8.296 15.110 6.728 1.00 0.00 H new ATOM 0 HA LYS A 104 6.063 16.230 5.113 1.00 0.00 H new ATOM 0 HB2 LYS A 104 6.874 16.885 7.581 1.00 0.00 H new ATOM 0 HB3 LYS A 104 8.036 17.843 6.685 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.188 18.100 5.817 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.561 18.724 7.411 1.00 0.00 H new ATOM 0 HD2 LYS A 104 7.305 20.213 6.444 1.00 0.00 H new ATOM 0 HD3 LYS A 104 6.996 19.561 4.847 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.539 20.285 5.151 1.00 0.00 H new ATOM 0 HE3 LYS A 104 5.051 21.139 6.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 4.992 22.602 4.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 6.587 22.443 5.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 6.092 21.616 3.846 1.00 0.00 H new ATOM 1537 N ASN A 105 7.384 17.392 3.348 1.00 0.00 N ATOM 1538 CA ASN A 105 8.008 17.787 2.074 1.00 0.00 C ATOM 1539 C ASN A 105 8.624 16.603 1.292 1.00 0.00 C ATOM 1540 O ASN A 105 9.698 16.718 0.692 1.00 0.00 O ATOM 1541 CB ASN A 105 8.981 18.959 2.330 1.00 0.00 C ATOM 1542 CG ASN A 105 9.198 19.839 1.104 1.00 0.00 C ATOM 1543 OD1 ASN A 105 8.334 20.000 0.252 1.00 0.00 O ATOM 1544 ND2 ASN A 105 10.343 20.469 0.992 1.00 0.00 N ATOM 0 H ASN A 105 6.423 17.724 3.427 1.00 0.00 H new ATOM 0 HA ASN A 105 7.230 18.141 1.398 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.595 19.571 3.145 1.00 0.00 H new ATOM 0 HB3 ASN A 105 9.941 18.561 2.658 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.509 21.088 0.199 1.00 0.00 H new ATOM 0 HD22 ASN A 105 11.068 20.340 1.698 1.00 0.00 H new ATOM 1550 N LYS A 106 7.946 15.448 1.327 1.00 0.00 N ATOM 1551 CA LYS A 106 8.411 14.152 0.804 1.00 0.00 C ATOM 1552 C LYS A 106 7.266 13.470 0.051 1.00 0.00 C ATOM 1553 O LYS A 106 6.124 13.487 0.506 1.00 0.00 O ATOM 1554 CB LYS A 106 8.901 13.291 1.997 1.00 0.00 C ATOM 1555 CG LYS A 106 10.393 12.914 1.971 1.00 0.00 C ATOM 1556 CD LYS A 106 10.712 11.668 1.126 1.00 0.00 C ATOM 1557 CE LYS A 106 12.123 11.165 1.470 1.00 0.00 C ATOM 1558 NZ LYS A 106 12.587 10.105 0.536 1.00 0.00 N ATOM 0 H LYS A 106 7.015 15.387 1.739 1.00 0.00 H new ATOM 0 HA LYS A 106 9.237 14.286 0.105 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.696 13.831 2.921 1.00 0.00 H new ATOM 0 HB3 LYS A 106 8.313 12.374 2.027 1.00 0.00 H new ATOM 0 HG2 LYS A 106 10.963 13.758 1.583 1.00 0.00 H new ATOM 0 HG3 LYS A 106 10.731 12.743 2.993 1.00 0.00 H new ATOM 0 HD2 LYS A 106 9.978 10.886 1.320 1.00 0.00 H new ATOM 0 HD3 LYS A 106 10.649 11.909 0.065 1.00 0.00 H new ATOM 0 HE2 LYS A 106 12.821 12.001 1.443 1.00 0.00 H new ATOM 0 HE3 LYS A 106 12.130 10.777 2.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 13.543 9.797 0.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 11.937 9.295 0.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 12.607 10.481 -0.433 1.00 0.00 H new ATOM 1568 N ASP A 107 7.550 12.859 -1.096 1.00 0.00 N ATOM 1569 CA ASP A 107 6.572 12.032 -1.812 1.00 0.00 C ATOM 1570 C ASP A 107 6.745 10.561 -1.418 1.00 0.00 C ATOM 1571 O ASP A 107 7.855 10.021 -1.455 1.00 0.00 O ATOM 1572 CB ASP A 107 6.715 12.214 -3.335 1.00 0.00 C ATOM 1573 CG ASP A 107 5.653 13.175 -3.890 1.00 0.00 C ATOM 1574 OD1 ASP A 107 4.457 12.800 -3.910 1.00 0.00 O ATOM 1575 OD2 ASP A 107 6.009 14.298 -4.322 1.00 0.00 O ATOM 0 H ASP A 107 8.458 12.920 -1.557 1.00 0.00 H new ATOM 0 HA ASP A 107 5.568 12.352 -1.532 1.00 0.00 H new ATOM 0 HB2 ASP A 107 7.709 12.597 -3.565 1.00 0.00 H new ATOM 0 HB3 ASP A 107 6.624 11.246 -3.828 1.00 0.00 H new ATOM 1579 N TYR A 108 5.640 9.906 -1.057 1.00 0.00 N ATOM 1580 CA TYR A 108 5.607 8.464 -0.828 1.00 0.00 C ATOM 1581 C TYR A 108 5.208 7.754 -2.119 1.00 0.00 C ATOM 1582 O TYR A 108 4.250 8.149 -2.793 1.00 0.00 O ATOM 1583 CB TYR A 108 4.608 8.117 0.287 1.00 0.00 C ATOM 1584 CG TYR A 108 5.189 7.417 1.495 1.00 0.00 C ATOM 1585 CD1 TYR A 108 5.742 6.127 1.368 1.00 0.00 C ATOM 1586 CD2 TYR A 108 5.122 8.034 2.759 1.00 0.00 C ATOM 1587 CE1 TYR A 108 6.246 5.465 2.503 1.00 0.00 C ATOM 1588 CE2 TYR A 108 5.615 7.370 3.896 1.00 0.00 C ATOM 1589 CZ TYR A 108 6.187 6.085 3.770 1.00 0.00 C ATOM 1590 OH TYR A 108 6.666 5.436 4.868 1.00 0.00 O ATOM 0 H TYR A 108 4.740 10.365 -0.915 1.00 0.00 H new ATOM 0 HA TYR A 108 6.599 8.133 -0.519 1.00 0.00 H new ATOM 0 HB2 TYR A 108 4.129 9.038 0.619 1.00 0.00 H new ATOM 0 HB3 TYR A 108 3.826 7.485 -0.135 1.00 0.00 H new ATOM 0 HD1 TYR A 108 5.779 5.647 0.401 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.691 9.020 2.855 1.00 0.00 H new ATOM 0 HE1 TYR A 108 6.679 4.480 2.405 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.556 7.842 4.865 1.00 0.00 H new ATOM 0 HH TYR A 108 6.550 6.002 5.659 1.00 0.00 H new ATOM 1599 N TYR A 109 5.908 6.660 -2.409 1.00 0.00 N ATOM 1600 CA TYR A 109 5.625 5.780 -3.530 1.00 0.00 C ATOM 1601 C TYR A 109 5.715 4.327 -3.055 1.00 0.00 C ATOM 1602 O TYR A 109 6.595 3.938 -2.279 1.00 0.00 O ATOM 1603 CB TYR A 109 6.589 6.086 -4.689 1.00 0.00 C ATOM 1604 CG TYR A 109 5.966 6.233 -6.063 1.00 0.00 C ATOM 1605 CD1 TYR A 109 5.346 5.127 -6.670 1.00 0.00 C ATOM 1606 CD2 TYR A 109 6.112 7.427 -6.790 1.00 0.00 C ATOM 1607 CE1 TYR A 109 4.928 5.210 -8.004 1.00 0.00 C ATOM 1608 CE2 TYR A 109 5.683 7.510 -8.135 1.00 0.00 C ATOM 1609 CZ TYR A 109 5.091 6.393 -8.751 1.00 0.00 C ATOM 1610 OH TYR A 109 4.712 6.423 -10.057 1.00 0.00 O ATOM 0 H TYR A 109 6.708 6.357 -1.854 1.00 0.00 H new ATOM 0 HA TYR A 109 4.616 5.945 -3.906 1.00 0.00 H new ATOM 0 HB2 TYR A 109 7.122 7.007 -4.455 1.00 0.00 H new ATOM 0 HB3 TYR A 109 7.332 5.290 -4.734 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.193 4.217 -6.110 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.556 8.290 -6.317 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.471 4.349 -8.470 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.810 8.429 -8.688 1.00 0.00 H new ATOM 0 HH TYR A 109 4.890 7.312 -10.429 1.00 0.00 H new ATOM 1619 N ILE A 110 4.783 3.516 -3.539 1.00 0.00 N ATOM 1620 CA ILE A 110 4.696 2.080 -3.269 1.00 0.00 C ATOM 1621 C ILE A 110 4.426 1.392 -4.598 1.00 0.00 C ATOM 1622 O ILE A 110 3.768 1.963 -5.464 1.00 0.00 O ATOM 1623 CB ILE A 110 3.562 1.798 -2.257 1.00 0.00 C ATOM 1624 CG1 ILE A 110 3.792 2.566 -0.928 1.00 0.00 C ATOM 1625 CG2 ILE A 110 3.342 0.310 -2.012 1.00 0.00 C ATOM 1626 CD1 ILE A 110 2.881 2.189 0.253 1.00 0.00 C ATOM 0 H ILE A 110 4.039 3.848 -4.152 1.00 0.00 H new ATOM 0 HA ILE A 110 5.621 1.704 -2.831 1.00 0.00 H new ATOM 0 HB ILE A 110 2.643 2.171 -2.709 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.827 2.414 -0.622 1.00 0.00 H new ATOM 0 HG13 ILE A 110 3.671 3.631 -1.125 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.534 0.175 -1.293 1.00 0.00 H new ATOM 0 HG22 ILE A 110 3.078 -0.178 -2.950 1.00 0.00 H new ATOM 0 HG23 ILE A 110 4.256 -0.133 -1.617 1.00 0.00 H new ATOM 0 HD11 ILE A 110 3.141 2.795 1.121 1.00 0.00 H new ATOM 0 HD12 ILE A 110 1.841 2.370 -0.018 1.00 0.00 H new ATOM 0 HD13 ILE A 110 3.015 1.134 0.494 1.00 0.00 H new ATOM 1637 N ILE A 111 4.888 0.157 -4.745 1.00 0.00 N ATOM 1638 CA ILE A 111 4.642 -0.702 -5.903 1.00 0.00 C ATOM 1639 C ILE A 111 4.377 -2.136 -5.400 1.00 0.00 C ATOM 1640 O ILE A 111 4.764 -2.488 -4.280 1.00 0.00 O ATOM 1641 CB ILE A 111 5.845 -0.578 -6.875 1.00 0.00 C ATOM 1642 CG1 ILE A 111 5.552 -1.140 -8.286 1.00 0.00 C ATOM 1643 CG2 ILE A 111 7.056 -1.267 -6.249 1.00 0.00 C ATOM 1644 CD1 ILE A 111 6.779 -1.304 -9.193 1.00 0.00 C ATOM 0 H ILE A 111 5.466 -0.294 -4.036 1.00 0.00 H new ATOM 0 HA ILE A 111 3.758 -0.401 -6.466 1.00 0.00 H new ATOM 0 HB ILE A 111 6.049 0.483 -7.022 1.00 0.00 H new ATOM 0 HG12 ILE A 111 5.067 -2.110 -8.179 1.00 0.00 H new ATOM 0 HG13 ILE A 111 4.840 -0.480 -8.781 1.00 0.00 H new ATOM 0 HG21 ILE A 111 7.909 -1.187 -6.923 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.297 -0.788 -5.300 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.827 -2.319 -6.077 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.467 -1.704 -10.158 1.00 0.00 H new ATOM 0 HD12 ILE A 111 7.256 -0.335 -9.339 1.00 0.00 H new ATOM 0 HD13 ILE A 111 7.487 -1.990 -8.727 1.00 0.00 H new ATOM 1655 N SER A 112 3.762 -2.981 -6.229 1.00 0.00 N ATOM 1656 CA SER A 112 3.597 -4.420 -5.956 1.00 0.00 C ATOM 1657 C SER A 112 3.865 -5.253 -7.209 1.00 0.00 C ATOM 1658 O SER A 112 3.895 -4.720 -8.321 1.00 0.00 O ATOM 1659 CB SER A 112 2.200 -4.749 -5.408 1.00 0.00 C ATOM 1660 OG SER A 112 1.772 -3.825 -4.419 1.00 0.00 O ATOM 0 H SER A 112 3.359 -2.688 -7.119 1.00 0.00 H new ATOM 0 HA SER A 112 4.330 -4.676 -5.191 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.483 -4.755 -6.229 1.00 0.00 H new ATOM 0 HB3 SER A 112 2.207 -5.753 -4.984 1.00 0.00 H new ATOM 0 HG SER A 112 0.820 -3.628 -4.545 1.00 0.00 H new ATOM 1665 N THR A 113 4.047 -6.571 -7.056 1.00 0.00 N ATOM 1666 CA THR A 113 4.474 -7.474 -8.147 1.00 0.00 C ATOM 1667 C THR A 113 3.587 -8.728 -8.254 1.00 0.00 C ATOM 1668 O THR A 113 4.059 -9.846 -8.428 1.00 0.00 O ATOM 1669 CB THR A 113 5.988 -7.794 -8.086 1.00 0.00 C ATOM 1670 OG1 THR A 113 6.301 -8.730 -7.074 1.00 0.00 O ATOM 1671 CG2 THR A 113 6.841 -6.570 -7.755 1.00 0.00 C ATOM 0 H THR A 113 3.902 -7.050 -6.167 1.00 0.00 H new ATOM 0 HA THR A 113 4.325 -6.932 -9.081 1.00 0.00 H new ATOM 0 HB THR A 113 6.209 -8.179 -9.082 1.00 0.00 H new ATOM 0 HG1 THR A 113 5.783 -9.550 -7.215 1.00 0.00 H new ATOM 0 HG21 THR A 113 7.892 -6.856 -7.726 1.00 0.00 H new ATOM 0 HG22 THR A 113 6.694 -5.806 -8.519 1.00 0.00 H new ATOM 0 HG23 THR A 113 6.546 -6.173 -6.784 1.00 0.00 H new ATOM 1679 N SER A 114 2.264 -8.544 -8.166 1.00 0.00 N ATOM 1680 CA SER A 114 1.230 -9.604 -8.189 1.00 0.00 C ATOM 1681 C SER A 114 1.349 -10.651 -9.328 1.00 0.00 C ATOM 1682 O SER A 114 0.967 -11.812 -9.155 1.00 0.00 O ATOM 1683 CB SER A 114 -0.144 -8.909 -8.146 1.00 0.00 C ATOM 1684 OG SER A 114 -1.189 -9.666 -8.727 1.00 0.00 O ATOM 0 H SER A 114 1.859 -7.612 -8.072 1.00 0.00 H new ATOM 0 HA SER A 114 1.379 -10.231 -7.310 1.00 0.00 H new ATOM 0 HB2 SER A 114 -0.399 -8.693 -7.108 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.072 -7.952 -8.662 1.00 0.00 H new ATOM 0 HG SER A 114 -1.945 -9.711 -8.105 1.00 0.00 H new ATOM 1689 N ASN A 115 1.948 -10.285 -10.468 1.00 0.00 N ATOM 1690 CA ASN A 115 2.270 -11.162 -11.605 1.00 0.00 C ATOM 1691 C ASN A 115 3.370 -12.196 -11.281 1.00 0.00 C ATOM 1692 O ASN A 115 3.472 -13.215 -11.966 1.00 0.00 O ATOM 1693 CB ASN A 115 2.711 -10.276 -12.798 1.00 0.00 C ATOM 1694 CG ASN A 115 1.716 -10.229 -13.951 1.00 0.00 C ATOM 1695 OD1 ASN A 115 0.507 -10.259 -13.779 1.00 0.00 O ATOM 1696 ND2 ASN A 115 2.198 -10.135 -15.170 1.00 0.00 N ATOM 0 H ASN A 115 2.237 -9.321 -10.633 1.00 0.00 H new ATOM 0 HA ASN A 115 1.375 -11.734 -11.850 1.00 0.00 H new ATOM 0 HB2 ASN A 115 2.879 -9.261 -12.438 1.00 0.00 H new ATOM 0 HB3 ASN A 115 3.666 -10.643 -13.174 1.00 0.00 H new ATOM 0 HD21 ASN A 115 1.563 -10.087 -15.967 1.00 0.00 H new ATOM 0 HD22 ASN A 115 3.207 -10.110 -15.319 1.00 0.00 H new ATOM 1702 N GLY A 116 4.199 -11.922 -10.264 1.00 0.00 N ATOM 1703 CA GLY A 116 5.333 -12.722 -9.792 1.00 0.00 C ATOM 1704 C GLY A 116 6.227 -13.282 -10.901 1.00 0.00 C ATOM 1705 O GLY A 116 6.522 -14.480 -10.895 1.00 0.00 O ATOM 0 H GLY A 116 4.084 -11.073 -9.711 1.00 0.00 H new ATOM 0 HA2 GLY A 116 5.942 -12.108 -9.129 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.952 -13.552 -9.197 1.00 0.00 H new ATOM 1784 N ASN A 123 14.285 -11.338 -7.916 1.00 0.00 N ATOM 1785 CA ASN A 123 15.102 -10.206 -8.381 1.00 0.00 C ATOM 1786 C ASN A 123 14.397 -8.852 -8.148 1.00 0.00 C ATOM 1787 O ASN A 123 14.823 -7.827 -8.686 1.00 0.00 O ATOM 1788 CB ASN A 123 15.446 -10.416 -9.873 1.00 0.00 C ATOM 1789 CG ASN A 123 16.756 -9.762 -10.313 1.00 0.00 C ATOM 1790 OD1 ASN A 123 17.760 -10.426 -10.531 1.00 0.00 O ATOM 1791 ND2 ASN A 123 16.799 -8.458 -10.464 1.00 0.00 N ATOM 0 HA ASN A 123 16.023 -10.173 -7.799 1.00 0.00 H new ATOM 0 HB2 ASN A 123 15.502 -11.486 -10.074 1.00 0.00 H new ATOM 0 HB3 ASN A 123 14.633 -10.019 -10.481 1.00 0.00 H new ATOM 0 HD21 ASN A 123 17.665 -8.007 -10.761 1.00 0.00 H new ATOM 0 HD22 ASN A 123 15.967 -7.896 -10.285 1.00 0.00 H new ATOM 1797 N GLN A 124 13.297 -8.828 -7.382 1.00 0.00 N ATOM 1798 CA GLN A 124 12.522 -7.623 -7.112 1.00 0.00 C ATOM 1799 C GLN A 124 12.055 -6.925 -8.411 1.00 0.00 C ATOM 1800 O GLN A 124 12.252 -5.724 -8.588 1.00 0.00 O ATOM 1801 CB GLN A 124 13.328 -6.717 -6.151 1.00 0.00 C ATOM 1802 CG GLN A 124 13.311 -7.169 -4.675 1.00 0.00 C ATOM 1803 CD GLN A 124 14.632 -7.781 -4.213 1.00 0.00 C ATOM 1804 OE1 GLN A 124 15.699 -7.190 -4.323 1.00 0.00 O ATOM 1805 NE2 GLN A 124 14.615 -8.963 -3.640 1.00 0.00 N ATOM 0 H GLN A 124 12.921 -9.661 -6.929 1.00 0.00 H new ATOM 0 HA GLN A 124 11.590 -7.884 -6.611 1.00 0.00 H new ATOM 0 HB2 GLN A 124 14.362 -6.676 -6.493 1.00 0.00 H new ATOM 0 HB3 GLN A 124 12.932 -5.703 -6.211 1.00 0.00 H new ATOM 0 HG2 GLN A 124 13.075 -6.313 -4.043 1.00 0.00 H new ATOM 0 HG3 GLN A 124 12.513 -7.898 -4.535 1.00 0.00 H new ATOM 0 HE21 GLN A 124 13.735 -9.469 -3.540 1.00 0.00 H new ATOM 0 HE22 GLN A 124 15.482 -9.375 -3.295 1.00 0.00 H new ATOM 1812 N GLU A 125 11.442 -7.665 -9.344 1.00 0.00 N ATOM 1813 CA GLU A 125 10.924 -7.107 -10.606 1.00 0.00 C ATOM 1814 C GLU A 125 9.390 -7.015 -10.615 1.00 0.00 C ATOM 1815 O GLU A 125 8.674 -7.977 -10.326 1.00 0.00 O ATOM 1816 CB GLU A 125 11.414 -7.911 -11.819 1.00 0.00 C ATOM 1817 CG GLU A 125 12.921 -7.718 -12.055 1.00 0.00 C ATOM 1818 CD GLU A 125 13.456 -8.507 -13.268 1.00 0.00 C ATOM 1819 OE1 GLU A 125 12.706 -8.745 -14.247 1.00 0.00 O ATOM 1820 OE2 GLU A 125 14.656 -8.875 -13.257 1.00 0.00 O ATOM 0 H GLU A 125 11.290 -8.669 -9.248 1.00 0.00 H new ATOM 0 HA GLU A 125 11.318 -6.093 -10.679 1.00 0.00 H new ATOM 0 HB2 GLU A 125 11.202 -8.969 -11.665 1.00 0.00 H new ATOM 0 HB3 GLU A 125 10.864 -7.602 -12.708 1.00 0.00 H new ATOM 0 HG2 GLU A 125 13.126 -6.657 -12.202 1.00 0.00 H new ATOM 0 HG3 GLU A 125 13.464 -8.027 -11.162 1.00 0.00 H new ATOM 1825 N GLY A 126 8.890 -5.835 -10.983 1.00 0.00 N ATOM 1826 CA GLY A 126 7.477 -5.522 -11.159 1.00 0.00 C ATOM 1827 C GLY A 126 6.910 -6.079 -12.459 1.00 0.00 C ATOM 1828 O GLY A 126 7.345 -5.703 -13.547 1.00 0.00 O ATOM 0 H GLY A 126 9.492 -5.034 -11.175 1.00 0.00 H new ATOM 0 HA2 GLY A 126 6.912 -5.925 -10.319 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.344 -4.440 -11.143 1.00 0.00 H new ATOM 1831 N GLY A 127 5.896 -6.939 -12.336 1.00 0.00 N ATOM 1832 CA GLY A 127 5.202 -7.549 -13.476 1.00 0.00 C ATOM 1833 C GLY A 127 3.836 -6.921 -13.749 1.00 0.00 C ATOM 1834 O GLY A 127 3.481 -6.692 -14.906 1.00 0.00 O ATOM 0 H GLY A 127 5.528 -7.236 -11.432 1.00 0.00 H new ATOM 0 HA2 GLY A 127 5.824 -7.454 -14.366 1.00 0.00 H new ATOM 0 HA3 GLY A 127 5.075 -8.615 -13.289 1.00 0.00 H new ATOM 1837 N VAL A 128 3.083 -6.570 -12.694 1.00 0.00 N ATOM 1838 CA VAL A 128 1.808 -5.842 -12.839 1.00 0.00 C ATOM 1839 C VAL A 128 2.039 -4.362 -13.127 1.00 0.00 C ATOM 1840 O VAL A 128 1.343 -3.781 -13.954 1.00 0.00 O ATOM 1841 CB VAL A 128 0.870 -6.013 -11.627 1.00 0.00 C ATOM 1842 CG1 VAL A 128 0.515 -7.473 -11.421 1.00 0.00 C ATOM 1843 CG2 VAL A 128 1.433 -5.475 -10.314 1.00 0.00 C ATOM 0 H VAL A 128 3.335 -6.779 -11.728 1.00 0.00 H new ATOM 0 HA VAL A 128 1.306 -6.293 -13.695 1.00 0.00 H new ATOM 0 HB VAL A 128 -0.011 -5.421 -11.876 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -0.147 -7.569 -10.561 1.00 0.00 H new ATOM 0 HG12 VAL A 128 0.012 -7.854 -12.310 1.00 0.00 H new ATOM 0 HG13 VAL A 128 1.425 -8.047 -11.244 1.00 0.00 H new ATOM 0 HG21 VAL A 128 0.709 -5.636 -9.515 1.00 0.00 H new ATOM 0 HG22 VAL A 128 2.360 -5.996 -10.075 1.00 0.00 H new ATOM 0 HG23 VAL A 128 1.632 -4.408 -10.414 1.00 0.00 H new ATOM 1853 N CYS A 129 3.057 -3.743 -12.520 1.00 0.00 N ATOM 1854 CA CYS A 129 3.443 -2.357 -12.805 1.00 0.00 C ATOM 1855 C CYS A 129 3.626 -2.085 -14.309 1.00 0.00 C ATOM 1856 O CYS A 129 3.290 -1.003 -14.796 1.00 0.00 O ATOM 1857 CB CYS A 129 4.703 -2.036 -12.003 1.00 0.00 C ATOM 1858 SG CYS A 129 5.612 -0.549 -12.505 1.00 0.00 S ATOM 0 H CYS A 129 3.640 -4.192 -11.813 1.00 0.00 H new ATOM 0 HA CYS A 129 2.634 -1.694 -12.499 1.00 0.00 H new ATOM 0 HB2 CYS A 129 4.424 -1.930 -10.955 1.00 0.00 H new ATOM 0 HB3 CYS A 129 5.378 -2.889 -12.069 1.00 0.00 H new ATOM 1862 N GLN A 130 4.102 -3.098 -15.038 1.00 0.00 N ATOM 1863 CA GLN A 130 4.376 -3.068 -16.473 1.00 0.00 C ATOM 1864 C GLN A 130 3.155 -2.677 -17.331 1.00 0.00 C ATOM 1865 O GLN A 130 3.338 -2.031 -18.366 1.00 0.00 O ATOM 1866 CB GLN A 130 4.952 -4.448 -16.852 1.00 0.00 C ATOM 1867 CG GLN A 130 6.057 -4.421 -17.920 1.00 0.00 C ATOM 1868 CD GLN A 130 5.566 -4.761 -19.328 1.00 0.00 C ATOM 1869 OE1 GLN A 130 4.987 -5.810 -19.583 1.00 0.00 O ATOM 1870 NE2 GLN A 130 5.816 -3.915 -20.303 1.00 0.00 N ATOM 0 H GLN A 130 4.316 -4.004 -14.621 1.00 0.00 H new ATOM 0 HA GLN A 130 5.098 -2.280 -16.688 1.00 0.00 H new ATOM 0 HB2 GLN A 130 5.349 -4.919 -15.952 1.00 0.00 H new ATOM 0 HB3 GLN A 130 4.138 -5.079 -17.209 1.00 0.00 H new ATOM 0 HG2 GLN A 130 6.512 -3.430 -17.934 1.00 0.00 H new ATOM 0 HG3 GLN A 130 6.839 -5.126 -17.638 1.00 0.00 H new ATOM 0 HE21 GLN A 130 6.297 -3.038 -20.106 1.00 0.00 H new ATOM 0 HE22 GLN A 130 5.529 -4.136 -21.256 1.00 0.00 H new ATOM 1877 N THR A 131 1.924 -2.999 -16.889 1.00 0.00 N ATOM 1878 CA THR A 131 0.663 -2.657 -17.594 1.00 0.00 C ATOM 1879 C THR A 131 -0.510 -2.356 -16.655 1.00 0.00 C ATOM 1880 O THR A 131 -1.122 -1.291 -16.775 1.00 0.00 O ATOM 1881 CB THR A 131 0.249 -3.786 -18.560 1.00 0.00 C ATOM 1882 OG1 THR A 131 1.187 -3.887 -19.611 1.00 0.00 O ATOM 1883 CG2 THR A 131 -1.116 -3.551 -19.218 1.00 0.00 C ATOM 0 H THR A 131 1.770 -3.511 -16.020 1.00 0.00 H new ATOM 0 HA THR A 131 0.883 -1.743 -18.145 1.00 0.00 H new ATOM 0 HB THR A 131 0.202 -4.690 -17.952 1.00 0.00 H new ATOM 0 HG1 THR A 131 0.920 -4.607 -20.220 1.00 0.00 H new ATOM 0 HG21 THR A 131 -1.346 -4.382 -19.885 1.00 0.00 H new ATOM 0 HG22 THR A 131 -1.884 -3.480 -18.448 1.00 0.00 H new ATOM 0 HG23 THR A 131 -1.089 -2.623 -19.790 1.00 0.00 H new ATOM 1891 N ARG A 132 -0.826 -3.249 -15.697 1.00 0.00 N ATOM 1892 CA ARG A 132 -1.824 -3.011 -14.627 1.00 0.00 C ATOM 1893 C ARG A 132 -1.525 -1.727 -13.851 1.00 0.00 C ATOM 1894 O ARG A 132 -2.462 -1.075 -13.397 1.00 0.00 O ATOM 1895 CB ARG A 132 -1.897 -4.254 -13.703 1.00 0.00 C ATOM 1896 CG ARG A 132 -2.472 -4.069 -12.281 1.00 0.00 C ATOM 1897 CD ARG A 132 -3.970 -3.751 -12.287 1.00 0.00 C ATOM 1898 NE ARG A 132 -4.523 -3.640 -10.920 1.00 0.00 N ATOM 1899 CZ ARG A 132 -5.771 -3.319 -10.621 1.00 0.00 C ATOM 1900 NH1 ARG A 132 -6.643 -3.038 -11.547 1.00 0.00 N ATOM 1901 NH2 ARG A 132 -6.181 -3.275 -9.385 1.00 0.00 N ATOM 0 H ARG A 132 -0.391 -4.170 -15.641 1.00 0.00 H new ATOM 0 HA ARG A 132 -2.804 -2.864 -15.082 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -2.496 -5.011 -14.209 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -0.889 -4.657 -13.606 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -2.300 -4.977 -11.703 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -1.936 -3.264 -11.778 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -4.139 -2.817 -12.822 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -4.503 -4.531 -12.831 1.00 0.00 H new ATOM 0 HE ARG A 132 -3.889 -3.827 -10.143 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -6.370 -3.063 -12.529 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -7.599 -2.793 -11.290 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -5.535 -3.490 -8.625 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -7.148 -3.025 -9.177 1.00 0.00 H new ATOM 1912 N ALA A 133 -0.242 -1.363 -13.738 1.00 0.00 N ATOM 1913 CA ALA A 133 0.238 -0.228 -12.961 1.00 0.00 C ATOM 1914 C ALA A 133 -0.281 -0.308 -11.514 1.00 0.00 C ATOM 1915 O ALA A 133 -1.136 0.462 -11.089 1.00 0.00 O ATOM 1916 CB ALA A 133 -0.023 1.073 -13.732 1.00 0.00 C ATOM 0 H ALA A 133 0.511 -1.871 -14.203 1.00 0.00 H new ATOM 0 HA ALA A 133 1.321 -0.250 -12.837 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.337 1.920 -13.148 1.00 0.00 H new ATOM 0 HB2 ALA A 133 0.501 1.041 -14.687 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -1.093 1.183 -13.909 1.00 0.00 H new ATOM 1922 N MET A 134 0.216 -1.293 -10.753 1.00 0.00 N ATOM 1923 CA MET A 134 0.004 -1.351 -9.304 1.00 0.00 C ATOM 1924 C MET A 134 1.073 -0.529 -8.593 1.00 0.00 C ATOM 1925 O MET A 134 2.109 -1.051 -8.167 1.00 0.00 O ATOM 1926 CB MET A 134 -0.037 -2.787 -8.771 1.00 0.00 C ATOM 1927 CG MET A 134 -0.384 -2.819 -7.278 1.00 0.00 C ATOM 1928 SD MET A 134 -1.518 -4.146 -6.802 1.00 0.00 S ATOM 1929 CE MET A 134 -3.070 -3.265 -7.121 1.00 0.00 C ATOM 0 H MET A 134 0.771 -2.065 -11.122 1.00 0.00 H new ATOM 0 HA MET A 134 -0.976 -0.922 -9.095 1.00 0.00 H new ATOM 0 HB2 MET A 134 -0.774 -3.363 -9.330 1.00 0.00 H new ATOM 0 HB3 MET A 134 0.930 -3.264 -8.932 1.00 0.00 H new ATOM 0 HG2 MET A 134 0.538 -2.923 -6.705 1.00 0.00 H new ATOM 0 HG3 MET A 134 -0.826 -1.862 -7.000 1.00 0.00 H new ATOM 0 HE1 MET A 134 -3.913 -3.916 -6.888 1.00 0.00 H new ATOM 0 HE2 MET A 134 -3.117 -2.373 -6.496 1.00 0.00 H new ATOM 0 HE3 MET A 134 -3.115 -2.976 -8.171 1.00 0.00 H new ATOM 1937 N LYS A 135 0.799 0.767 -8.455 1.00 0.00 N ATOM 1938 CA LYS A 135 1.502 1.630 -7.515 1.00 0.00 C ATOM 1939 C LYS A 135 0.525 2.461 -6.695 1.00 0.00 C ATOM 1940 O LYS A 135 -0.678 2.503 -6.969 1.00 0.00 O ATOM 1941 CB LYS A 135 2.592 2.475 -8.208 1.00 0.00 C ATOM 1942 CG LYS A 135 2.165 3.332 -9.413 1.00 0.00 C ATOM 1943 CD LYS A 135 2.376 2.627 -10.764 1.00 0.00 C ATOM 1944 CE LYS A 135 2.723 3.667 -11.840 1.00 0.00 C ATOM 1945 NZ LYS A 135 3.475 3.067 -12.974 1.00 0.00 N ATOM 0 H LYS A 135 0.080 1.247 -8.996 1.00 0.00 H new ATOM 0 HA LYS A 135 2.034 0.993 -6.808 1.00 0.00 H new ATOM 0 HB2 LYS A 135 3.030 3.138 -7.462 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.382 1.800 -8.538 1.00 0.00 H new ATOM 0 HG2 LYS A 135 1.112 3.595 -9.308 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.729 4.265 -9.405 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.178 1.893 -10.681 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.474 2.084 -11.047 1.00 0.00 H new ATOM 0 HE2 LYS A 135 1.806 4.122 -12.214 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.316 4.466 -11.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.689 3.803 -13.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.363 2.655 -12.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.900 2.322 -13.417 1.00 0.00 H new ATOM 1955 N ILE A 136 1.054 3.112 -5.666 1.00 0.00 N ATOM 1956 CA ILE A 136 0.313 4.095 -4.888 1.00 0.00 C ATOM 1957 C ILE A 136 1.164 5.350 -4.724 1.00 0.00 C ATOM 1958 O ILE A 136 2.395 5.269 -4.645 1.00 0.00 O ATOM 1959 CB ILE A 136 -0.273 3.525 -3.561 1.00 0.00 C ATOM 1960 CG1 ILE A 136 0.597 3.770 -2.315 1.00 0.00 C ATOM 1961 CG2 ILE A 136 -0.598 2.020 -3.644 1.00 0.00 C ATOM 1962 CD1 ILE A 136 0.211 4.998 -1.511 1.00 0.00 C ATOM 0 H ILE A 136 2.013 2.972 -5.347 1.00 0.00 H new ATOM 0 HA ILE A 136 -0.584 4.378 -5.439 1.00 0.00 H new ATOM 0 HB ILE A 136 -1.195 4.094 -3.440 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.538 2.894 -1.668 1.00 0.00 H new ATOM 0 HG13 ILE A 136 1.637 3.867 -2.627 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -1.002 1.682 -2.690 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -1.333 1.849 -4.431 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.311 1.463 -3.870 1.00 0.00 H new ATOM 0 HD11 ILE A 136 0.875 5.094 -0.652 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.298 5.885 -2.138 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -0.818 4.898 -1.165 1.00 0.00 H new ATOM 1973 N LEU A 137 0.500 6.502 -4.653 1.00 0.00 N ATOM 1974 CA LEU A 137 1.130 7.805 -4.457 1.00 0.00 C ATOM 1975 C LEU A 137 0.493 8.538 -3.276 1.00 0.00 C ATOM 1976 O LEU A 137 -0.730 8.541 -3.117 1.00 0.00 O ATOM 1977 CB LEU A 137 1.029 8.618 -5.763 1.00 0.00 C ATOM 1978 CG LEU A 137 2.242 8.400 -6.684 1.00 0.00 C ATOM 1979 CD1 LEU A 137 1.948 8.899 -8.098 1.00 0.00 C ATOM 1980 CD2 LEU A 137 3.464 9.139 -6.134 1.00 0.00 C ATOM 0 H LEU A 137 -0.515 6.556 -4.732 1.00 0.00 H new ATOM 0 HA LEU A 137 2.185 7.673 -4.216 1.00 0.00 H new ATOM 0 HB2 LEU A 137 0.119 8.338 -6.293 1.00 0.00 H new ATOM 0 HB3 LEU A 137 0.944 9.678 -5.523 1.00 0.00 H new ATOM 0 HG LEU A 137 2.447 7.330 -6.721 1.00 0.00 H new ATOM 0 HD11 LEU A 137 2.820 8.734 -8.731 1.00 0.00 H new ATOM 0 HD12 LEU A 137 1.096 8.355 -8.506 1.00 0.00 H new ATOM 0 HD13 LEU A 137 1.718 9.964 -8.068 1.00 0.00 H new ATOM 0 HD21 LEU A 137 4.315 8.977 -6.795 1.00 0.00 H new ATOM 0 HD22 LEU A 137 3.248 10.206 -6.076 1.00 0.00 H new ATOM 0 HD23 LEU A 137 3.700 8.762 -5.139 1.00 0.00 H new ATOM 1991 N MET A 138 1.343 9.166 -2.461 1.00 0.00 N ATOM 1992 CA MET A 138 0.944 9.929 -1.281 1.00 0.00 C ATOM 1993 C MET A 138 1.740 11.229 -1.185 1.00 0.00 C ATOM 1994 O MET A 138 2.937 11.235 -0.878 1.00 0.00 O ATOM 1995 CB MET A 138 1.105 9.090 -0.009 1.00 0.00 C ATOM 1996 CG MET A 138 0.064 7.989 0.186 1.00 0.00 C ATOM 1997 SD MET A 138 0.553 6.798 1.469 1.00 0.00 S ATOM 1998 CE MET A 138 -1.068 6.283 2.091 1.00 0.00 C ATOM 0 H MET A 138 2.352 9.157 -2.609 1.00 0.00 H new ATOM 0 HA MET A 138 -0.111 10.186 -1.381 1.00 0.00 H new ATOM 0 HB2 MET A 138 2.095 8.633 -0.018 1.00 0.00 H new ATOM 0 HB3 MET A 138 1.070 9.757 0.853 1.00 0.00 H new ATOM 0 HG2 MET A 138 -0.891 8.439 0.456 1.00 0.00 H new ATOM 0 HG3 MET A 138 -0.086 7.463 -0.757 1.00 0.00 H new ATOM 0 HE1 MET A 138 -0.936 5.550 2.887 1.00 0.00 H new ATOM 0 HE2 MET A 138 -1.600 7.150 2.481 1.00 0.00 H new ATOM 0 HE3 MET A 138 -1.644 5.838 1.280 1.00 0.00 H new ATOM 2006 N LYS A 139 1.046 12.339 -1.443 1.00 0.00 N ATOM 2007 CA LYS A 139 1.532 13.711 -1.260 1.00 0.00 C ATOM 2008 C LYS A 139 1.444 14.110 0.215 1.00 0.00 C ATOM 2009 O LYS A 139 0.361 14.074 0.798 1.00 0.00 O ATOM 2010 CB LYS A 139 0.683 14.647 -2.144 1.00 0.00 C ATOM 2011 CG LYS A 139 1.206 14.696 -3.590 1.00 0.00 C ATOM 2012 CD LYS A 139 2.033 15.969 -3.835 1.00 0.00 C ATOM 2013 CE LYS A 139 2.728 15.929 -5.201 1.00 0.00 C ATOM 2014 NZ LYS A 139 2.396 17.115 -6.035 1.00 0.00 N ATOM 0 H LYS A 139 0.091 12.307 -1.800 1.00 0.00 H new ATOM 0 HA LYS A 139 2.578 13.786 -1.556 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -0.353 14.307 -2.143 1.00 0.00 H new ATOM 0 HB3 LYS A 139 0.689 15.651 -1.721 1.00 0.00 H new ATOM 0 HG2 LYS A 139 1.818 13.817 -3.789 1.00 0.00 H new ATOM 0 HG3 LYS A 139 0.367 14.664 -4.285 1.00 0.00 H new ATOM 0 HD2 LYS A 139 1.384 16.843 -3.781 1.00 0.00 H new ATOM 0 HD3 LYS A 139 2.779 16.077 -3.048 1.00 0.00 H new ATOM 0 HE2 LYS A 139 3.807 15.879 -5.056 1.00 0.00 H new ATOM 0 HE3 LYS A 139 2.435 15.022 -5.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 2.888 17.045 -6.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 1.369 17.150 -6.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 2.699 17.980 -5.544 1.00 0.00 H new ATOM 2024 N VAL A 140 2.578 14.487 0.811 1.00 0.00 N ATOM 2025 CA VAL A 140 2.687 14.937 2.209 1.00 0.00 C ATOM 2026 C VAL A 140 3.735 16.046 2.357 1.00 0.00 C ATOM 2027 O VAL A 140 4.948 15.818 2.332 1.00 0.00 O ATOM 2028 CB VAL A 140 2.942 13.773 3.199 1.00 0.00 C ATOM 2029 CG1 VAL A 140 1.656 12.991 3.452 1.00 0.00 C ATOM 2030 CG2 VAL A 140 4.003 12.750 2.773 1.00 0.00 C ATOM 0 H VAL A 140 3.474 14.489 0.324 1.00 0.00 H new ATOM 0 HA VAL A 140 1.717 15.355 2.477 1.00 0.00 H new ATOM 0 HB VAL A 140 3.316 14.280 4.089 1.00 0.00 H new ATOM 0 HG11 VAL A 140 1.856 12.178 4.150 1.00 0.00 H new ATOM 0 HG12 VAL A 140 0.903 13.656 3.876 1.00 0.00 H new ATOM 0 HG13 VAL A 140 1.289 12.580 2.511 1.00 0.00 H new ATOM 0 HG21 VAL A 140 4.097 11.982 3.541 1.00 0.00 H new ATOM 0 HG22 VAL A 140 3.705 12.288 1.832 1.00 0.00 H new ATOM 0 HG23 VAL A 140 4.961 13.253 2.643 1.00 0.00 H new ATOM 2040 N GLY A 141 3.258 17.288 2.480 1.00 0.00 N ATOM 2041 CA GLY A 141 4.089 18.468 2.721 1.00 0.00 C ATOM 2042 C GLY A 141 3.511 19.760 2.147 1.00 0.00 C ATOM 2043 O GLY A 141 3.396 20.752 2.871 1.00 0.00 O ATOM 0 H GLY A 141 2.263 17.504 2.413 1.00 0.00 H new ATOM 0 HA2 GLY A 141 4.228 18.589 3.795 1.00 0.00 H new ATOM 0 HA3 GLY A 141 5.076 18.300 2.289 1.00 0.00 H new ATOM 2046 N GLN A 142 3.159 19.744 0.857 1.00 0.00 N ATOM 2047 CA GLN A 142 2.619 20.899 0.123 1.00 0.00 C ATOM 2048 C GLN A 142 1.091 21.025 0.287 1.00 0.00 C ATOM 2049 O GLN A 142 0.638 22.019 0.895 1.00 0.00 O ATOM 2050 CB GLN A 142 3.035 20.824 -1.364 1.00 0.00 C ATOM 2051 CG GLN A 142 3.641 22.153 -1.844 1.00 0.00 C ATOM 2052 CD GLN A 142 3.553 22.318 -3.364 1.00 0.00 C ATOM 2053 OE1 GLN A 142 4.504 22.112 -4.109 1.00 0.00 O ATOM 2054 NE2 GLN A 142 2.401 22.700 -3.879 1.00 0.00 N ATOM 0 H GLN A 142 3.243 18.908 0.278 1.00 0.00 H new ATOM 0 HA GLN A 142 3.047 21.805 0.553 1.00 0.00 H new ATOM 0 HB2 GLN A 142 3.760 20.021 -1.501 1.00 0.00 H new ATOM 0 HB3 GLN A 142 2.167 20.577 -1.974 1.00 0.00 H new ATOM 0 HG2 GLN A 142 3.123 22.981 -1.361 1.00 0.00 H new ATOM 0 HG3 GLN A 142 4.685 22.206 -1.535 1.00 0.00 H new ATOM 0 HE21 GLN A 142 1.602 22.874 -3.269 1.00 0.00 H new ATOM 0 HE22 GLN A 142 2.308 22.821 -4.888 1.00 0.00 H new