USER MOD reduce.3.24.130724 H: found=0, std=0, add=906, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 905 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 SER OG : rot 180:sc= 0.604 USER MOD Set 1.2: A 107 THR OG1 : rot -77:sc= 1.08 USER MOD Set 1.3: A 132 GLN : amide:sc= 0.936 K(o=2.6,f=1.4) USER MOD Set 2.1: A 78 THR OG1 : rot -98:sc= 0.852 USER MOD Set 2.2: A 93 THR OG1 : rot 180:sc= 0.752 USER MOD Set 3.1: A 42 GLN : amide:sc= 0 X(o=-0.85,f=-1.3) USER MOD Set 3.2: A 55 THR OG1 : rot 150:sc= -0.849 USER MOD Single : A 5 SER OG : rot -30:sc= 0.031 USER MOD Single : A 8 SER OG : rot 106:sc= 1.05 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0104 K(o=-0.01,f=-1.4) USER MOD Single : A 24 SER OG : rot -30:sc= 0.823 USER MOD Single : A 26 TYR OH : rot 147:sc= 0.31 USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 THR OG1 : rot -63:sc= 0.556 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 170:sc= 1.24 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 HIS : no HE2:sc= 1.66 K(o=1.7,f=-7.9!) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0.301 USER MOD Single : A 41 TYR OH : rot 180:sc=-0.00594 USER MOD Single : A 48 GLN : amide:sc= 0.866 K(o=0.87,f=-0.4) USER MOD Single : A 52 THR OG1 : rot 97:sc= 1.87 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 82 LYS NZ :NH3+ -107:sc= 0.882 (180deg=0.0177) USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 86 SER OG : rot 180:sc= 0.375 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -0.22 K(o=-0.22,f=-1.7!) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -101:sc= 1.29 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -1.29! C(o=-1.3!,f=-7.3!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 ASN : amide:sc= 0.339 K(o=0.34,f=-1.3!) USER MOD Single : A 140 LYS NZ :NH3+ 140:sc= 0.291 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 HIS : no HE2:sc= 0 X(o=0,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 60 N SER A 5 10.335 -0.670 4.423 1.00 0.00 N ATOM 61 CA SER A 5 11.108 -0.253 5.587 1.00 0.00 C ATOM 62 C SER A 5 11.575 -1.456 6.398 1.00 0.00 C ATOM 63 O SER A 5 10.980 -2.531 6.329 1.00 0.00 O ATOM 64 CB SER A 5 10.280 0.667 6.462 1.00 0.00 C ATOM 65 OG SER A 5 9.178 -0.010 7.001 1.00 0.00 O ATOM 0 HA SER A 5 11.988 0.282 5.231 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.898 1.062 7.268 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.937 1.520 5.876 1.00 0.00 H new ATOM 0 HG SER A 5 8.896 -0.719 6.385 1.00 0.00 H new ATOM 71 N ALA A 6 12.643 -1.267 7.165 1.00 0.00 N ATOM 72 CA ALA A 6 13.202 -2.341 7.977 1.00 0.00 C ATOM 73 C ALA A 6 13.738 -1.809 9.300 1.00 0.00 C ATOM 74 O ALA A 6 14.495 -0.838 9.329 1.00 0.00 O ATOM 75 CB ALA A 6 14.301 -3.066 7.214 1.00 0.00 C ATOM 0 H ALA A 6 13.139 -0.379 7.241 1.00 0.00 H new ATOM 0 HA ALA A 6 12.402 -3.047 8.197 1.00 0.00 H new ATOM 0 HB1 ALA A 6 14.708 -3.865 7.834 1.00 0.00 H new ATOM 0 HB2 ALA A 6 13.889 -3.491 6.299 1.00 0.00 H new ATOM 0 HB3 ALA A 6 15.094 -2.362 6.962 1.00 0.00 H new ATOM 81 N VAL A 7 13.342 -2.450 10.394 1.00 0.00 N ATOM 82 CA VAL A 7 13.779 -2.040 11.723 1.00 0.00 C ATOM 83 C VAL A 7 14.418 -3.199 12.476 1.00 0.00 C ATOM 84 O VAL A 7 13.889 -4.311 12.489 1.00 0.00 O ATOM 85 CB VAL A 7 12.586 -1.500 12.535 1.00 0.00 C ATOM 86 CG1 VAL A 7 13.024 -1.126 13.943 1.00 0.00 C ATOM 87 CG2 VAL A 7 11.976 -0.301 11.824 1.00 0.00 C ATOM 0 H VAL A 7 12.718 -3.257 10.386 1.00 0.00 H new ATOM 0 HA VAL A 7 14.523 -1.253 11.598 1.00 0.00 H new ATOM 0 HB VAL A 7 11.830 -2.281 12.614 1.00 0.00 H new ATOM 0 HG11 VAL A 7 12.168 -0.747 14.502 1.00 0.00 H new ATOM 0 HG12 VAL A 7 13.424 -2.007 14.446 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.794 -0.356 13.892 1.00 0.00 H new ATOM 0 HG21 VAL A 7 11.133 0.076 12.404 1.00 0.00 H new ATOM 0 HG22 VAL A 7 12.727 0.483 11.724 1.00 0.00 H new ATOM 0 HG23 VAL A 7 11.631 -0.602 10.835 1.00 0.00 H new ATOM 97 N SER A 8 15.559 -2.934 13.103 1.00 0.00 N ATOM 98 CA SER A 8 16.288 -3.963 13.836 1.00 0.00 C ATOM 99 C SER A 8 16.965 -3.384 15.071 1.00 0.00 C ATOM 100 O SER A 8 17.541 -2.296 15.023 1.00 0.00 O ATOM 101 CB SER A 8 17.323 -4.609 12.936 1.00 0.00 C ATOM 102 OG SER A 8 18.092 -5.541 13.646 1.00 0.00 O ATOM 0 H SER A 8 16.000 -2.014 13.118 1.00 0.00 H new ATOM 0 HA SER A 8 15.571 -4.717 14.162 1.00 0.00 H new ATOM 0 HB2 SER A 8 16.827 -5.102 12.100 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.972 -3.842 12.513 1.00 0.00 H new ATOM 0 HG SER A 8 17.819 -6.448 13.396 1.00 0.00 H new ATOM 108 N THR A 9 16.894 -4.117 16.177 1.00 0.00 N ATOM 109 CA THR A 9 17.496 -3.674 17.429 1.00 0.00 C ATOM 110 C THR A 9 18.432 -4.735 17.995 1.00 0.00 C ATOM 111 O THR A 9 18.107 -5.922 18.005 1.00 0.00 O ATOM 112 CB THR A 9 16.417 -3.328 18.471 1.00 0.00 C ATOM 113 OG1 THR A 9 15.574 -2.287 17.961 1.00 0.00 O ATOM 114 CG2 THR A 9 17.058 -2.865 19.770 1.00 0.00 C ATOM 0 H THR A 9 16.425 -5.021 16.232 1.00 0.00 H new ATOM 0 HA THR A 9 18.074 -2.777 17.209 1.00 0.00 H new ATOM 0 HB THR A 9 15.825 -4.221 18.669 1.00 0.00 H new ATOM 0 HG1 THR A 9 14.886 -2.068 18.624 1.00 0.00 H new ATOM 0 HG21 THR A 9 16.280 -2.625 20.494 1.00 0.00 H new ATOM 0 HG22 THR A 9 17.691 -3.659 20.167 1.00 0.00 H new ATOM 0 HG23 THR A 9 17.664 -1.979 19.581 1.00 0.00 H new ATOM 122 N VAL A 10 19.596 -4.299 18.466 1.00 0.00 N ATOM 123 CA VAL A 10 20.578 -5.209 19.044 1.00 0.00 C ATOM 124 C VAL A 10 21.077 -4.699 20.389 1.00 0.00 C ATOM 125 O VAL A 10 21.271 -3.497 20.575 1.00 0.00 O ATOM 126 CB VAL A 10 21.773 -5.383 18.088 1.00 0.00 C ATOM 127 CG1 VAL A 10 22.531 -4.072 17.939 1.00 0.00 C ATOM 128 CG2 VAL A 10 22.690 -6.482 18.600 1.00 0.00 C ATOM 0 H VAL A 10 19.882 -3.320 18.459 1.00 0.00 H new ATOM 0 HA VAL A 10 20.089 -6.171 19.196 1.00 0.00 H new ATOM 0 HB VAL A 10 21.401 -5.671 17.105 1.00 0.00 H new ATOM 0 HG11 VAL A 10 23.372 -4.213 17.260 1.00 0.00 H new ATOM 0 HG12 VAL A 10 21.864 -3.310 17.537 1.00 0.00 H new ATOM 0 HG13 VAL A 10 22.901 -3.753 18.913 1.00 0.00 H new ATOM 0 HG21 VAL A 10 23.533 -6.599 17.919 1.00 0.00 H new ATOM 0 HG22 VAL A 10 23.058 -6.216 19.591 1.00 0.00 H new ATOM 0 HG23 VAL A 10 22.137 -7.420 18.658 1.00 0.00 H new ATOM 138 N LEU A 11 21.284 -5.618 21.325 1.00 0.00 N ATOM 139 CA LEU A 11 21.909 -5.287 22.600 1.00 0.00 C ATOM 140 C LEU A 11 23.414 -5.515 22.552 1.00 0.00 C ATOM 141 O LEU A 11 23.878 -6.562 22.100 1.00 0.00 O ATOM 142 CB LEU A 11 21.293 -6.127 23.727 1.00 0.00 C ATOM 143 CG LEU A 11 19.785 -5.947 23.942 1.00 0.00 C ATOM 144 CD1 LEU A 11 19.312 -6.895 25.036 1.00 0.00 C ATOM 145 CD2 LEU A 11 19.493 -4.500 24.309 1.00 0.00 C ATOM 0 H LEU A 11 21.028 -6.600 21.225 1.00 0.00 H new ATOM 0 HA LEU A 11 21.728 -4.230 22.796 1.00 0.00 H new ATOM 0 HB2 LEU A 11 21.489 -7.179 23.520 1.00 0.00 H new ATOM 0 HB3 LEU A 11 21.806 -5.885 24.658 1.00 0.00 H new ATOM 0 HG LEU A 11 19.247 -6.184 23.024 1.00 0.00 H new ATOM 0 HD11 LEU A 11 18.240 -6.768 25.189 1.00 0.00 H new ATOM 0 HD12 LEU A 11 19.516 -7.924 24.739 1.00 0.00 H new ATOM 0 HD13 LEU A 11 19.840 -6.673 25.963 1.00 0.00 H new ATOM 0 HD21 LEU A 11 18.421 -4.373 24.462 1.00 0.00 H new ATOM 0 HD22 LEU A 11 20.023 -4.243 25.226 1.00 0.00 H new ATOM 0 HD23 LEU A 11 19.825 -3.846 23.503 1.00 0.00 H new ATOM 157 N ILE A 12 24.173 -4.530 23.021 1.00 0.00 N ATOM 158 CA ILE A 12 25.626 -4.562 22.909 1.00 0.00 C ATOM 159 C ILE A 12 26.288 -4.301 24.256 1.00 0.00 C ATOM 160 O ILE A 12 25.939 -3.351 24.956 1.00 0.00 O ATOM 161 CB ILE A 12 26.121 -3.526 21.883 1.00 0.00 C ATOM 162 CG1 ILE A 12 25.507 -3.802 20.508 1.00 0.00 C ATOM 163 CG2 ILE A 12 27.639 -3.540 21.804 1.00 0.00 C ATOM 164 CD1 ILE A 12 25.868 -2.772 19.461 1.00 0.00 C ATOM 0 H ILE A 12 23.805 -3.699 23.483 1.00 0.00 H new ATOM 0 HA ILE A 12 25.903 -5.560 22.569 1.00 0.00 H new ATOM 0 HB ILE A 12 25.804 -2.535 22.209 1.00 0.00 H new ATOM 0 HG12 ILE A 12 25.833 -4.784 20.165 1.00 0.00 H new ATOM 0 HG13 ILE A 12 24.422 -3.842 20.606 1.00 0.00 H new ATOM 0 HG21 ILE A 12 27.972 -2.802 21.074 1.00 0.00 H new ATOM 0 HG22 ILE A 12 28.056 -3.298 22.781 1.00 0.00 H new ATOM 0 HG23 ILE A 12 27.978 -4.530 21.500 1.00 0.00 H new ATOM 0 HD11 ILE A 12 25.396 -3.035 18.514 1.00 0.00 H new ATOM 0 HD12 ILE A 12 25.518 -1.790 19.780 1.00 0.00 H new ATOM 0 HD13 ILE A 12 26.950 -2.747 19.333 1.00 0.00 H new ATOM 176 N ASN A 13 27.245 -5.150 24.613 1.00 0.00 N ATOM 177 CA ASN A 13 27.994 -4.983 25.853 1.00 0.00 C ATOM 178 C ASN A 13 29.125 -3.976 25.682 1.00 0.00 C ATOM 179 O ASN A 13 30.301 -4.335 25.732 1.00 0.00 O ATOM 180 CB ASN A 13 28.535 -6.316 26.335 1.00 0.00 C ATOM 181 CG ASN A 13 29.102 -6.242 27.725 1.00 0.00 C ATOM 182 OD1 ASN A 13 28.848 -5.282 28.462 1.00 0.00 O ATOM 183 ND2 ASN A 13 29.864 -7.237 28.099 1.00 0.00 N ATOM 0 H ASN A 13 27.521 -5.962 24.061 1.00 0.00 H new ATOM 0 HA ASN A 13 27.310 -4.594 26.607 1.00 0.00 H new ATOM 0 HB2 ASN A 13 27.737 -7.058 26.311 1.00 0.00 H new ATOM 0 HB3 ASN A 13 29.309 -6.659 25.649 1.00 0.00 H new ATOM 0 HD21 ASN A 13 30.276 -7.241 29.032 1.00 0.00 H new ATOM 0 HD22 ASN A 13 30.047 -8.009 27.457 1.00 0.00 H new ATOM 190 N ALA A 14 28.762 -2.715 25.479 1.00 0.00 N ATOM 191 CA ALA A 14 29.744 -1.661 25.255 1.00 0.00 C ATOM 192 C ALA A 14 29.150 -0.286 25.532 1.00 0.00 C ATOM 193 O ALA A 14 27.941 -0.087 25.418 1.00 0.00 O ATOM 194 CB ALA A 14 30.278 -1.729 23.831 1.00 0.00 C ATOM 0 H ALA A 14 27.793 -2.397 25.465 1.00 0.00 H new ATOM 0 HA ALA A 14 30.569 -1.817 25.950 1.00 0.00 H new ATOM 0 HB1 ALA A 14 31.010 -0.936 23.679 1.00 0.00 H new ATOM 0 HB2 ALA A 14 30.752 -2.697 23.666 1.00 0.00 H new ATOM 0 HB3 ALA A 14 29.455 -1.603 23.127 1.00 0.00 H new ATOM 200 N GLU A 15 30.008 0.661 25.897 1.00 0.00 N ATOM 201 CA GLU A 15 29.570 2.020 26.191 1.00 0.00 C ATOM 202 C GLU A 15 28.845 2.634 25.001 1.00 0.00 C ATOM 203 O GLU A 15 29.324 2.570 23.869 1.00 0.00 O ATOM 204 CB GLU A 15 30.765 2.894 26.578 1.00 0.00 C ATOM 205 CG GLU A 15 30.397 4.305 27.015 1.00 0.00 C ATOM 206 CD GLU A 15 31.585 5.102 27.478 1.00 0.00 C ATOM 207 OE1 GLU A 15 32.661 4.556 27.527 1.00 0.00 O ATOM 208 OE2 GLU A 15 31.416 6.260 27.782 1.00 0.00 O ATOM 0 H GLU A 15 31.012 0.512 25.996 1.00 0.00 H new ATOM 0 HA GLU A 15 28.875 1.972 27.029 1.00 0.00 H new ATOM 0 HB2 GLU A 15 31.309 2.407 27.387 1.00 0.00 H new ATOM 0 HB3 GLU A 15 31.445 2.956 25.728 1.00 0.00 H new ATOM 0 HG2 GLU A 15 29.919 4.824 26.184 1.00 0.00 H new ATOM 0 HG3 GLU A 15 29.665 4.251 27.821 1.00 0.00 H new ATOM 215 N PRO A 16 27.686 3.230 25.263 1.00 0.00 N ATOM 216 CA PRO A 16 26.893 3.858 24.214 1.00 0.00 C ATOM 217 C PRO A 16 27.730 4.837 23.402 1.00 0.00 C ATOM 218 O PRO A 16 27.626 4.891 22.176 1.00 0.00 O ATOM 219 CB PRO A 16 25.789 4.574 24.999 1.00 0.00 C ATOM 220 CG PRO A 16 25.603 3.735 26.217 1.00 0.00 C ATOM 221 CD PRO A 16 26.995 3.296 26.586 1.00 0.00 C ATOM 0 HA PRO A 16 26.503 3.149 23.484 1.00 0.00 H new ATOM 0 HB2 PRO A 16 26.080 5.592 25.257 1.00 0.00 H new ATOM 0 HB3 PRO A 16 24.869 4.643 24.419 1.00 0.00 H new ATOM 0 HG2 PRO A 16 25.139 4.303 27.023 1.00 0.00 H new ATOM 0 HG3 PRO A 16 24.957 2.880 26.016 1.00 0.00 H new ATOM 0 HD2 PRO A 16 27.477 4.005 27.259 1.00 0.00 H new ATOM 0 HD3 PRO A 16 26.994 2.329 27.090 1.00 0.00 H new ATOM 229 N ALA A 17 28.560 5.612 24.092 1.00 0.00 N ATOM 230 CA ALA A 17 29.411 6.598 23.436 1.00 0.00 C ATOM 231 C ALA A 17 30.435 5.927 22.530 1.00 0.00 C ATOM 232 O ALA A 17 30.729 6.417 21.440 1.00 0.00 O ATOM 233 CB ALA A 17 30.110 7.467 24.472 1.00 0.00 C ATOM 0 H ALA A 17 28.662 5.576 25.106 1.00 0.00 H new ATOM 0 HA ALA A 17 28.776 7.230 22.815 1.00 0.00 H new ATOM 0 HB1 ALA A 17 30.742 8.198 23.967 1.00 0.00 H new ATOM 0 HB2 ALA A 17 29.364 7.986 25.074 1.00 0.00 H new ATOM 0 HB3 ALA A 17 30.725 6.840 25.117 1.00 0.00 H new ATOM 239 N ALA A 18 30.976 4.803 22.988 1.00 0.00 N ATOM 240 CA ALA A 18 31.944 4.044 22.205 1.00 0.00 C ATOM 241 C ALA A 18 31.313 3.495 20.932 1.00 0.00 C ATOM 242 O ALA A 18 31.929 3.507 19.867 1.00 0.00 O ATOM 243 CB ALA A 18 32.528 2.912 23.037 1.00 0.00 C ATOM 0 H ALA A 18 30.760 4.397 23.899 1.00 0.00 H new ATOM 0 HA ALA A 18 32.749 4.721 21.917 1.00 0.00 H new ATOM 0 HB1 ALA A 18 33.249 2.355 22.438 1.00 0.00 H new ATOM 0 HB2 ALA A 18 33.027 3.325 23.914 1.00 0.00 H new ATOM 0 HB3 ALA A 18 31.728 2.244 23.355 1.00 0.00 H new ATOM 249 N VAL A 19 30.080 3.013 21.049 1.00 0.00 N ATOM 250 CA VAL A 19 29.341 2.513 19.897 1.00 0.00 C ATOM 251 C VAL A 19 28.974 3.643 18.944 1.00 0.00 C ATOM 252 O VAL A 19 29.074 3.497 17.725 1.00 0.00 O ATOM 253 CB VAL A 19 28.057 1.796 20.356 1.00 0.00 C ATOM 254 CG1 VAL A 19 27.205 1.408 19.156 1.00 0.00 C ATOM 255 CG2 VAL A 19 28.415 0.570 21.182 1.00 0.00 C ATOM 0 H VAL A 19 29.572 2.958 21.932 1.00 0.00 H new ATOM 0 HA VAL A 19 29.986 1.809 19.371 1.00 0.00 H new ATOM 0 HB VAL A 19 27.475 2.477 20.977 1.00 0.00 H new ATOM 0 HG11 VAL A 19 26.302 0.903 19.499 1.00 0.00 H new ATOM 0 HG12 VAL A 19 26.930 2.304 18.600 1.00 0.00 H new ATOM 0 HG13 VAL A 19 27.772 0.739 18.509 1.00 0.00 H new ATOM 0 HG21 VAL A 19 27.502 0.068 21.503 1.00 0.00 H new ATOM 0 HG22 VAL A 19 29.012 -0.114 20.578 1.00 0.00 H new ATOM 0 HG23 VAL A 19 28.988 0.876 22.057 1.00 0.00 H new ATOM 265 N LEU A 20 28.550 4.770 19.506 1.00 0.00 N ATOM 266 CA LEU A 20 28.268 5.961 18.714 1.00 0.00 C ATOM 267 C LEU A 20 29.476 6.369 17.881 1.00 0.00 C ATOM 268 O LEU A 20 29.348 6.681 16.697 1.00 0.00 O ATOM 269 CB LEU A 20 27.857 7.121 19.631 1.00 0.00 C ATOM 270 CG LEU A 20 27.561 8.452 18.927 1.00 0.00 C ATOM 271 CD1 LEU A 20 26.410 8.265 17.949 1.00 0.00 C ATOM 272 CD2 LEU A 20 27.228 9.512 19.966 1.00 0.00 C ATOM 0 H LEU A 20 28.394 4.883 20.508 1.00 0.00 H new ATOM 0 HA LEU A 20 27.448 5.725 18.036 1.00 0.00 H new ATOM 0 HB2 LEU A 20 26.970 6.822 20.190 1.00 0.00 H new ATOM 0 HB3 LEU A 20 28.652 7.285 20.358 1.00 0.00 H new ATOM 0 HG LEU A 20 28.437 8.781 18.368 1.00 0.00 H new ATOM 0 HD11 LEU A 20 26.200 9.211 17.449 1.00 0.00 H new ATOM 0 HD12 LEU A 20 26.682 7.515 17.207 1.00 0.00 H new ATOM 0 HD13 LEU A 20 25.523 7.936 18.490 1.00 0.00 H new ATOM 0 HD21 LEU A 20 27.018 10.458 19.466 1.00 0.00 H new ATOM 0 HD22 LEU A 20 26.353 9.200 20.536 1.00 0.00 H new ATOM 0 HD23 LEU A 20 28.075 9.639 20.641 1.00 0.00 H new ATOM 284 N ALA A 21 30.648 6.363 18.506 1.00 0.00 N ATOM 285 CA ALA A 21 31.892 6.659 17.804 1.00 0.00 C ATOM 286 C ALA A 21 32.129 5.677 16.664 1.00 0.00 C ATOM 287 O ALA A 21 32.528 6.068 15.568 1.00 0.00 O ATOM 288 CB ALA A 21 33.065 6.639 18.773 1.00 0.00 C ATOM 0 H ALA A 21 30.763 6.156 19.498 1.00 0.00 H new ATOM 0 HA ALA A 21 31.807 7.657 17.375 1.00 0.00 H new ATOM 0 HB1 ALA A 21 33.986 6.862 18.234 1.00 0.00 H new ATOM 0 HB2 ALA A 21 32.909 7.388 19.549 1.00 0.00 H new ATOM 0 HB3 ALA A 21 33.142 5.653 19.231 1.00 0.00 H new ATOM 294 N ALA A 22 31.882 4.399 16.931 1.00 0.00 N ATOM 295 CA ALA A 22 32.032 3.362 15.917 1.00 0.00 C ATOM 296 C ALA A 22 31.081 3.592 14.749 1.00 0.00 C ATOM 297 O ALA A 22 31.430 3.346 13.594 1.00 0.00 O ATOM 298 CB ALA A 22 31.799 1.987 16.526 1.00 0.00 C ATOM 0 H ALA A 22 31.577 4.056 17.842 1.00 0.00 H new ATOM 0 HA ALA A 22 33.052 3.410 15.536 1.00 0.00 H new ATOM 0 HB1 ALA A 22 31.915 1.224 15.756 1.00 0.00 H new ATOM 0 HB2 ALA A 22 32.524 1.813 17.321 1.00 0.00 H new ATOM 0 HB3 ALA A 22 30.791 1.937 16.938 1.00 0.00 H new ATOM 304 N ILE A 23 29.878 4.064 15.056 1.00 0.00 N ATOM 305 CA ILE A 23 28.898 4.391 14.028 1.00 0.00 C ATOM 306 C ILE A 23 29.374 5.549 13.161 1.00 0.00 C ATOM 307 O ILE A 23 29.345 5.471 11.933 1.00 0.00 O ATOM 308 CB ILE A 23 27.538 4.746 14.658 1.00 0.00 C ATOM 309 CG1 ILE A 23 26.909 3.508 15.302 1.00 0.00 C ATOM 310 CG2 ILE A 23 26.606 5.338 13.612 1.00 0.00 C ATOM 311 CD1 ILE A 23 25.721 3.816 16.185 1.00 0.00 C ATOM 0 H ILE A 23 29.558 4.229 16.010 1.00 0.00 H new ATOM 0 HA ILE A 23 28.780 3.508 13.400 1.00 0.00 H new ATOM 0 HB ILE A 23 27.700 5.493 15.435 1.00 0.00 H new ATOM 0 HG12 ILE A 23 26.597 2.820 14.516 1.00 0.00 H new ATOM 0 HG13 ILE A 23 27.666 2.994 15.894 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.650 5.583 14.074 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.052 6.243 13.198 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.448 4.613 12.813 1.00 0.00 H new ATOM 0 HD11 ILE A 23 25.330 2.889 16.605 1.00 0.00 H new ATOM 0 HD12 ILE A 23 26.030 4.479 16.993 1.00 0.00 H new ATOM 0 HD13 ILE A 23 24.945 4.302 15.594 1.00 0.00 H new ATOM 323 N SER A 24 29.813 6.624 13.808 1.00 0.00 N ATOM 324 CA SER A 24 30.258 7.817 13.097 1.00 0.00 C ATOM 325 C SER A 24 31.511 7.536 12.278 1.00 0.00 C ATOM 326 O SER A 24 31.721 8.134 11.223 1.00 0.00 O ATOM 327 CB SER A 24 30.527 8.940 14.080 1.00 0.00 C ATOM 328 OG SER A 24 31.645 8.654 14.875 1.00 0.00 O ATOM 0 H SER A 24 29.870 6.693 14.824 1.00 0.00 H new ATOM 0 HA SER A 24 29.464 8.117 12.413 1.00 0.00 H new ATOM 0 HB2 SER A 24 30.690 9.871 13.538 1.00 0.00 H new ATOM 0 HB3 SER A 24 29.654 9.090 14.715 1.00 0.00 H new ATOM 0 HG SER A 24 31.721 7.684 14.996 1.00 0.00 H new ATOM 334 N ASP A 25 32.340 6.622 12.770 1.00 0.00 N ATOM 335 CA ASP A 25 33.537 6.206 12.048 1.00 0.00 C ATOM 336 C ASP A 25 33.221 5.100 11.048 1.00 0.00 C ATOM 337 O ASP A 25 33.510 3.929 11.292 1.00 0.00 O ATOM 338 CB ASP A 25 34.613 5.726 13.025 1.00 0.00 C ATOM 339 CG ASP A 25 35.905 5.319 12.329 1.00 0.00 C ATOM 340 OD1 ASP A 25 35.845 4.933 11.186 1.00 0.00 O ATOM 341 OD2 ASP A 25 36.939 5.398 12.948 1.00 0.00 O ATOM 0 H ASP A 25 32.205 6.155 13.667 1.00 0.00 H new ATOM 0 HA ASP A 25 33.910 7.071 11.500 1.00 0.00 H new ATOM 0 HB2 ASP A 25 34.826 6.519 13.741 1.00 0.00 H new ATOM 0 HB3 ASP A 25 34.229 4.878 13.593 1.00 0.00 H new ATOM 346 N TYR A 26 32.625 5.480 9.923 1.00 0.00 N ATOM 347 CA TYR A 26 32.208 4.514 8.914 1.00 0.00 C ATOM 348 C TYR A 26 33.404 3.980 8.135 1.00 0.00 C ATOM 349 O TYR A 26 33.389 2.846 7.657 1.00 0.00 O ATOM 350 CB TYR A 26 31.191 5.143 7.959 1.00 0.00 C ATOM 351 CG TYR A 26 29.824 5.350 8.572 1.00 0.00 C ATOM 352 CD1 TYR A 26 29.366 6.634 8.829 1.00 0.00 C ATOM 353 CD2 TYR A 26 29.029 4.256 8.879 1.00 0.00 C ATOM 354 CE1 TYR A 26 28.118 6.823 9.389 1.00 0.00 C ATOM 355 CE2 TYR A 26 27.780 4.444 9.439 1.00 0.00 C ATOM 356 CZ TYR A 26 27.325 5.722 9.694 1.00 0.00 C ATOM 357 OH TYR A 26 26.081 5.910 10.253 1.00 0.00 O ATOM 0 H TYR A 26 32.420 6.451 9.687 1.00 0.00 H new ATOM 0 HA TYR A 26 31.737 3.676 9.428 1.00 0.00 H new ATOM 0 HB2 TYR A 26 31.574 6.104 7.617 1.00 0.00 H new ATOM 0 HB3 TYR A 26 31.092 4.508 7.079 1.00 0.00 H new ATOM 0 HD1 TYR A 26 29.986 7.486 8.591 1.00 0.00 H new ATOM 0 HD2 TYR A 26 29.386 3.256 8.680 1.00 0.00 H new ATOM 0 HE1 TYR A 26 27.759 7.822 9.589 1.00 0.00 H new ATOM 0 HE2 TYR A 26 27.160 3.592 9.677 1.00 0.00 H new ATOM 0 HH TYR A 26 25.473 5.208 9.941 1.00 0.00 H new ATOM 367 N GLN A 27 34.438 4.804 8.011 1.00 0.00 N ATOM 368 CA GLN A 27 35.571 4.488 7.149 1.00 0.00 C ATOM 369 C GLN A 27 36.168 3.132 7.499 1.00 0.00 C ATOM 370 O GLN A 27 36.382 2.292 6.625 1.00 0.00 O ATOM 371 CB GLN A 27 36.644 5.575 7.254 1.00 0.00 C ATOM 372 CG GLN A 27 37.838 5.361 6.339 1.00 0.00 C ATOM 373 CD GLN A 27 38.876 6.458 6.477 1.00 0.00 C ATOM 374 OE1 GLN A 27 39.568 6.554 7.495 1.00 0.00 O ATOM 375 NE2 GLN A 27 38.992 7.294 5.451 1.00 0.00 N ATOM 0 H GLN A 27 34.515 5.697 8.497 1.00 0.00 H new ATOM 0 HA GLN A 27 35.206 4.446 6.123 1.00 0.00 H new ATOM 0 HB2 GLN A 27 36.192 6.540 7.023 1.00 0.00 H new ATOM 0 HB3 GLN A 27 36.995 5.625 8.285 1.00 0.00 H new ATOM 0 HG2 GLN A 27 38.298 4.399 6.565 1.00 0.00 H new ATOM 0 HG3 GLN A 27 37.496 5.316 5.305 1.00 0.00 H new ATOM 0 HE21 GLN A 27 38.399 7.178 4.629 1.00 0.00 H new ATOM 0 HE22 GLN A 27 39.674 8.052 5.485 1.00 0.00 H new ATOM 384 N THR A 28 36.436 2.923 8.784 1.00 0.00 N ATOM 385 CA THR A 28 37.241 1.790 9.224 1.00 0.00 C ATOM 386 C THR A 28 36.365 0.679 9.791 1.00 0.00 C ATOM 387 O THR A 28 36.826 -0.444 9.996 1.00 0.00 O ATOM 388 CB THR A 28 38.276 2.222 10.279 1.00 0.00 C ATOM 389 OG1 THR A 28 37.599 2.720 11.441 1.00 0.00 O ATOM 390 CG2 THR A 28 39.185 3.307 9.722 1.00 0.00 C ATOM 0 H THR A 28 36.107 3.524 9.539 1.00 0.00 H new ATOM 0 HA THR A 28 37.768 1.409 8.349 1.00 0.00 H new ATOM 0 HB THR A 28 38.882 1.357 10.546 1.00 0.00 H new ATOM 0 HG1 THR A 28 37.085 3.520 11.203 1.00 0.00 H new ATOM 0 HG21 THR A 28 39.910 3.600 10.482 1.00 0.00 H new ATOM 0 HG22 THR A 28 39.711 2.927 8.846 1.00 0.00 H new ATOM 0 HG23 THR A 28 38.587 4.173 9.439 1.00 0.00 H new ATOM 398 N VAL A 29 35.101 1.000 10.042 1.00 0.00 N ATOM 399 CA VAL A 29 34.198 0.080 10.724 1.00 0.00 C ATOM 400 C VAL A 29 33.363 -0.713 9.726 1.00 0.00 C ATOM 401 O VAL A 29 33.196 -1.924 9.867 1.00 0.00 O ATOM 402 CB VAL A 29 33.262 0.854 11.671 1.00 0.00 C ATOM 403 CG1 VAL A 29 32.196 -0.071 12.239 1.00 0.00 C ATOM 404 CG2 VAL A 29 34.071 1.495 12.788 1.00 0.00 C ATOM 0 H VAL A 29 34.678 1.891 9.783 1.00 0.00 H new ATOM 0 HA VAL A 29 34.807 -0.616 11.301 1.00 0.00 H new ATOM 0 HB VAL A 29 32.761 1.641 11.108 1.00 0.00 H new ATOM 0 HG11 VAL A 29 31.543 0.492 12.906 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.607 -0.491 11.424 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.673 -0.878 12.795 1.00 0.00 H new ATOM 0 HG21 VAL A 29 33.403 2.041 13.454 1.00 0.00 H new ATOM 0 HG22 VAL A 29 34.591 0.720 13.351 1.00 0.00 H new ATOM 0 HG23 VAL A 29 34.799 2.184 12.360 1.00 0.00 H new ATOM 414 N ARG A 30 32.841 -0.023 8.719 1.00 0.00 N ATOM 415 CA ARG A 30 31.919 -0.633 7.768 1.00 0.00 C ATOM 416 C ARG A 30 32.542 -1.853 7.103 1.00 0.00 C ATOM 417 O ARG A 30 31.899 -2.894 6.965 1.00 0.00 O ATOM 418 CB ARG A 30 31.509 0.370 6.700 1.00 0.00 C ATOM 419 CG ARG A 30 30.521 1.429 7.163 1.00 0.00 C ATOM 420 CD ARG A 30 30.047 2.269 6.033 1.00 0.00 C ATOM 421 NE ARG A 30 29.079 1.567 5.205 1.00 0.00 N ATOM 422 CZ ARG A 30 27.742 1.674 5.332 1.00 0.00 C ATOM 423 NH1 ARG A 30 27.231 2.457 6.256 1.00 0.00 N ATOM 424 NH2 ARG A 30 26.945 0.993 4.527 1.00 0.00 N ATOM 0 H ARG A 30 33.041 0.961 8.540 1.00 0.00 H new ATOM 0 HA ARG A 30 31.036 -0.949 8.324 1.00 0.00 H new ATOM 0 HB2 ARG A 30 32.404 0.867 6.326 1.00 0.00 H new ATOM 0 HB3 ARG A 30 31.072 -0.172 5.861 1.00 0.00 H new ATOM 0 HG2 ARG A 30 29.668 0.947 7.641 1.00 0.00 H new ATOM 0 HG3 ARG A 30 30.992 2.062 7.915 1.00 0.00 H new ATOM 0 HD2 ARG A 30 29.597 3.182 6.423 1.00 0.00 H new ATOM 0 HD3 ARG A 30 30.898 2.569 5.422 1.00 0.00 H new ATOM 0 HE ARG A 30 29.438 0.950 4.476 1.00 0.00 H new ATOM 0 HH11 ARG A 30 27.847 2.983 6.876 1.00 0.00 H new ATOM 0 HH12 ARG A 30 26.219 2.539 6.353 1.00 0.00 H new ATOM 0 HH21 ARG A 30 27.342 0.386 3.810 1.00 0.00 H new ATOM 0 HH22 ARG A 30 25.933 1.074 4.623 1.00 0.00 H new ATOM 438 N PRO A 31 33.798 -1.719 6.690 1.00 0.00 N ATOM 439 CA PRO A 31 34.510 -2.809 6.035 1.00 0.00 C ATOM 440 C PRO A 31 34.410 -4.097 6.843 1.00 0.00 C ATOM 441 O PRO A 31 34.431 -5.194 6.285 1.00 0.00 O ATOM 442 CB PRO A 31 35.951 -2.292 5.972 1.00 0.00 C ATOM 443 CG PRO A 31 35.803 -0.814 5.838 1.00 0.00 C ATOM 444 CD PRO A 31 34.651 -0.470 6.744 1.00 0.00 C ATOM 0 HA PRO A 31 34.106 -3.060 5.054 1.00 0.00 H new ATOM 0 HB2 PRO A 31 36.509 -2.557 6.870 1.00 0.00 H new ATOM 0 HB3 PRO A 31 36.490 -2.717 5.125 1.00 0.00 H new ATOM 0 HG2 PRO A 31 36.713 -0.295 6.138 1.00 0.00 H new ATOM 0 HG3 PRO A 31 35.597 -0.527 4.807 1.00 0.00 H new ATOM 0 HD2 PRO A 31 34.985 -0.252 7.758 1.00 0.00 H new ATOM 0 HD3 PRO A 31 34.107 0.407 6.392 1.00 0.00 H new ATOM 452 N LYS A 32 34.302 -3.956 8.159 1.00 0.00 N ATOM 453 CA LYS A 32 34.400 -5.096 9.062 1.00 0.00 C ATOM 454 C LYS A 32 33.022 -5.649 9.403 1.00 0.00 C ATOM 455 O LYS A 32 32.839 -6.861 9.514 1.00 0.00 O ATOM 456 CB LYS A 32 35.141 -4.704 10.342 1.00 0.00 C ATOM 457 CG LYS A 32 36.568 -4.221 10.120 1.00 0.00 C ATOM 458 CD LYS A 32 37.429 -5.309 9.495 1.00 0.00 C ATOM 459 CE LYS A 32 38.870 -4.848 9.328 1.00 0.00 C ATOM 460 NZ LYS A 32 39.718 -5.893 8.693 1.00 0.00 N ATOM 0 H LYS A 32 34.146 -3.062 8.625 1.00 0.00 H new ATOM 0 HA LYS A 32 34.964 -5.877 8.552 1.00 0.00 H new ATOM 0 HB2 LYS A 32 34.579 -3.918 10.847 1.00 0.00 H new ATOM 0 HB3 LYS A 32 35.161 -5.563 11.013 1.00 0.00 H new ATOM 0 HG2 LYS A 32 36.561 -3.344 9.473 1.00 0.00 H new ATOM 0 HG3 LYS A 32 37.002 -3.912 11.071 1.00 0.00 H new ATOM 0 HD2 LYS A 32 37.401 -6.202 10.120 1.00 0.00 H new ATOM 0 HD3 LYS A 32 37.019 -5.587 8.524 1.00 0.00 H new ATOM 0 HE2 LYS A 32 38.893 -3.943 8.721 1.00 0.00 H new ATOM 0 HE3 LYS A 32 39.283 -4.588 10.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 40.691 -5.539 8.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 39.717 -6.748 9.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 39.339 -6.123 7.752 1.00 0.00 H new ATOM 474 N ILE A 33 32.055 -4.753 9.569 1.00 0.00 N ATOM 475 CA ILE A 33 30.762 -5.117 10.135 1.00 0.00 C ATOM 476 C ILE A 33 29.767 -5.486 9.043 1.00 0.00 C ATOM 477 O ILE A 33 28.800 -6.207 9.289 1.00 0.00 O ATOM 478 CB ILE A 33 30.191 -3.967 10.985 1.00 0.00 C ATOM 479 CG1 ILE A 33 29.846 -2.769 10.097 1.00 0.00 C ATOM 480 CG2 ILE A 33 31.180 -3.564 12.068 1.00 0.00 C ATOM 481 CD1 ILE A 33 29.062 -1.689 10.808 1.00 0.00 C ATOM 0 H ILE A 33 32.143 -3.768 9.319 1.00 0.00 H new ATOM 0 HA ILE A 33 30.920 -5.986 10.773 1.00 0.00 H new ATOM 0 HB ILE A 33 29.277 -4.313 11.468 1.00 0.00 H new ATOM 0 HG12 ILE A 33 30.769 -2.339 9.708 1.00 0.00 H new ATOM 0 HG13 ILE A 33 29.271 -3.118 9.239 1.00 0.00 H new ATOM 0 HG21 ILE A 33 30.760 -2.750 12.659 1.00 0.00 H new ATOM 0 HG22 ILE A 33 31.379 -4.418 12.716 1.00 0.00 H new ATOM 0 HG23 ILE A 33 32.111 -3.235 11.606 1.00 0.00 H new ATOM 0 HD11 ILE A 33 28.855 -0.874 10.115 1.00 0.00 H new ATOM 0 HD12 ILE A 33 28.122 -2.102 11.173 1.00 0.00 H new ATOM 0 HD13 ILE A 33 29.643 -1.311 11.649 1.00 0.00 H new ATOM 493 N LEU A 34 30.009 -4.986 7.836 1.00 0.00 N ATOM 494 CA LEU A 34 29.143 -5.276 6.699 1.00 0.00 C ATOM 495 C LEU A 34 29.295 -6.722 6.246 1.00 0.00 C ATOM 496 O LEU A 34 30.393 -7.278 6.269 1.00 0.00 O ATOM 497 CB LEU A 34 29.465 -4.332 5.534 1.00 0.00 C ATOM 498 CG LEU A 34 29.164 -2.848 5.777 1.00 0.00 C ATOM 499 CD1 LEU A 34 29.522 -2.046 4.534 1.00 0.00 C ATOM 500 CD2 LEU A 34 27.694 -2.679 6.132 1.00 0.00 C ATOM 0 H LEU A 34 30.798 -4.377 7.620 1.00 0.00 H new ATOM 0 HA LEU A 34 28.112 -5.122 7.016 1.00 0.00 H new ATOM 0 HB2 LEU A 34 30.522 -4.434 5.290 1.00 0.00 H new ATOM 0 HB3 LEU A 34 28.903 -4.659 4.659 1.00 0.00 H new ATOM 0 HG LEU A 34 29.763 -2.478 6.609 1.00 0.00 H new ATOM 0 HD11 LEU A 34 29.308 -0.991 4.707 1.00 0.00 H new ATOM 0 HD12 LEU A 34 30.582 -2.170 4.314 1.00 0.00 H new ATOM 0 HD13 LEU A 34 28.932 -2.402 3.689 1.00 0.00 H new ATOM 0 HD21 LEU A 34 27.480 -1.624 6.305 1.00 0.00 H new ATOM 0 HD22 LEU A 34 27.077 -3.045 5.311 1.00 0.00 H new ATOM 0 HD23 LEU A 34 27.470 -3.247 7.035 1.00 0.00 H new ATOM 512 N SER A 35 28.186 -7.328 5.834 1.00 0.00 N ATOM 513 CA SER A 35 28.157 -8.755 5.537 1.00 0.00 C ATOM 514 C SER A 35 28.364 -9.013 4.050 1.00 0.00 C ATOM 515 O SER A 35 28.823 -8.137 3.316 1.00 0.00 O ATOM 516 CB SER A 35 26.838 -9.354 5.984 1.00 0.00 C ATOM 517 OG SER A 35 25.804 -9.004 5.107 1.00 0.00 O ATOM 0 H SER A 35 27.294 -6.852 5.698 1.00 0.00 H new ATOM 0 HA SER A 35 28.973 -9.228 6.083 1.00 0.00 H new ATOM 0 HB2 SER A 35 26.926 -10.439 6.033 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.600 -9.007 6.990 1.00 0.00 H new ATOM 0 HG SER A 35 25.001 -9.521 5.325 1.00 0.00 H new ATOM 523 N SER A 36 28.024 -10.219 3.611 1.00 0.00 N ATOM 524 CA SER A 36 28.235 -10.618 2.224 1.00 0.00 C ATOM 525 C SER A 36 27.221 -9.956 1.300 1.00 0.00 C ATOM 526 O SER A 36 27.329 -10.048 0.077 1.00 0.00 O ATOM 527 CB SER A 36 28.142 -12.126 2.095 1.00 0.00 C ATOM 528 OG SER A 36 26.834 -12.570 2.327 1.00 0.00 O ATOM 0 H SER A 36 27.600 -10.939 4.196 1.00 0.00 H new ATOM 0 HA SER A 36 29.232 -10.291 1.928 1.00 0.00 H new ATOM 0 HB2 SER A 36 28.461 -12.430 1.098 1.00 0.00 H new ATOM 0 HB3 SER A 36 28.821 -12.598 2.805 1.00 0.00 H new ATOM 0 HG SER A 36 26.799 -13.545 2.237 1.00 0.00 H new ATOM 534 N HIS A 37 26.236 -9.290 1.891 1.00 0.00 N ATOM 535 CA HIS A 37 25.241 -8.551 1.123 1.00 0.00 C ATOM 536 C HIS A 37 25.736 -7.151 0.782 1.00 0.00 C ATOM 537 O HIS A 37 24.986 -6.327 0.260 1.00 0.00 O ATOM 538 CB HIS A 37 23.920 -8.458 1.894 1.00 0.00 C ATOM 539 CG HIS A 37 23.161 -9.748 1.945 1.00 0.00 C ATOM 540 ND1 HIS A 37 22.487 -10.257 0.855 1.00 0.00 N ATOM 541 CD2 HIS A 37 22.970 -10.631 2.953 1.00 0.00 C ATOM 542 CE1 HIS A 37 21.913 -11.399 1.191 1.00 0.00 C ATOM 543 NE2 HIS A 37 22.191 -11.648 2.458 1.00 0.00 N ATOM 0 H HIS A 37 26.105 -9.247 2.902 1.00 0.00 H new ATOM 0 HA HIS A 37 25.074 -9.096 0.194 1.00 0.00 H new ATOM 0 HB2 HIS A 37 24.126 -8.127 2.912 1.00 0.00 H new ATOM 0 HB3 HIS A 37 23.293 -7.696 1.432 1.00 0.00 H new ATOM 0 HD1 HIS A 37 22.439 -9.821 -0.066 1.00 0.00 H new ATOM 0 HD2 HIS A 37 23.357 -10.551 3.958 1.00 0.00 H new ATOM 0 HE1 HIS A 37 21.318 -12.023 0.540 1.00 0.00 H new ATOM 551 N TYR A 38 27.004 -6.889 1.081 1.00 0.00 N ATOM 552 CA TYR A 38 27.649 -5.651 0.661 1.00 0.00 C ATOM 553 C TYR A 38 28.889 -5.933 -0.177 1.00 0.00 C ATOM 554 O TYR A 38 29.645 -6.862 0.108 1.00 0.00 O ATOM 555 CB TYR A 38 28.015 -4.798 1.878 1.00 0.00 C ATOM 556 CG TYR A 38 26.821 -4.359 2.697 1.00 0.00 C ATOM 557 CD1 TYR A 38 26.269 -5.221 3.634 1.00 0.00 C ATOM 558 CD2 TYR A 38 26.279 -3.097 2.511 1.00 0.00 C ATOM 559 CE1 TYR A 38 25.179 -4.820 4.383 1.00 0.00 C ATOM 560 CE2 TYR A 38 25.189 -2.696 3.259 1.00 0.00 C ATOM 561 CZ TYR A 38 24.640 -3.553 4.192 1.00 0.00 C ATOM 562 OH TYR A 38 23.554 -3.154 4.937 1.00 0.00 O ATOM 0 H TYR A 38 27.605 -7.518 1.613 1.00 0.00 H new ATOM 0 HA TYR A 38 26.941 -5.098 0.043 1.00 0.00 H new ATOM 0 HB2 TYR A 38 28.693 -5.364 2.516 1.00 0.00 H new ATOM 0 HB3 TYR A 38 28.557 -3.915 1.541 1.00 0.00 H new ATOM 0 HD1 TYR A 38 26.691 -6.205 3.778 1.00 0.00 H new ATOM 0 HD2 TYR A 38 26.709 -2.427 1.781 1.00 0.00 H new ATOM 0 HE1 TYR A 38 24.748 -5.488 5.114 1.00 0.00 H new ATOM 0 HE2 TYR A 38 24.767 -1.713 3.114 1.00 0.00 H new ATOM 0 HH TYR A 38 23.300 -2.242 4.683 1.00 0.00 H new ATOM 572 N SER A 39 29.093 -5.127 -1.213 1.00 0.00 N ATOM 573 CA SER A 39 30.208 -5.326 -2.131 1.00 0.00 C ATOM 574 C SER A 39 31.122 -4.107 -2.160 1.00 0.00 C ATOM 575 O SER A 39 31.469 -3.555 -1.116 1.00 0.00 O ATOM 576 CB SER A 39 29.690 -5.613 -3.527 1.00 0.00 C ATOM 577 OG SER A 39 30.743 -5.920 -4.400 1.00 0.00 O ATOM 0 H SER A 39 28.500 -4.328 -1.438 1.00 0.00 H new ATOM 0 HA SER A 39 30.787 -6.179 -1.777 1.00 0.00 H new ATOM 0 HB2 SER A 39 28.986 -6.445 -3.494 1.00 0.00 H new ATOM 0 HB3 SER A 39 29.143 -4.747 -3.901 1.00 0.00 H new ATOM 0 HG SER A 39 30.384 -6.103 -5.293 1.00 0.00 H new ATOM 583 N GLY A 40 31.510 -3.693 -3.361 1.00 0.00 N ATOM 584 CA GLY A 40 32.393 -2.545 -3.528 1.00 0.00 C ATOM 585 C GLY A 40 32.026 -1.423 -2.565 1.00 0.00 C ATOM 586 O GLY A 40 30.848 -1.161 -2.323 1.00 0.00 O ATOM 0 H GLY A 40 31.226 -4.136 -4.235 1.00 0.00 H new ATOM 0 HA2 GLY A 40 33.426 -2.850 -3.359 1.00 0.00 H new ATOM 0 HA3 GLY A 40 32.332 -2.182 -4.554 1.00 0.00 H new ATOM 590 N TYR A 41 33.042 -0.765 -2.017 1.00 0.00 N ATOM 591 CA TYR A 41 32.828 0.358 -1.112 1.00 0.00 C ATOM 592 C TYR A 41 34.014 1.314 -1.129 1.00 0.00 C ATOM 593 O TYR A 41 35.135 0.921 -1.451 1.00 0.00 O ATOM 594 CB TYR A 41 32.571 -0.143 0.311 1.00 0.00 C ATOM 595 CG TYR A 41 33.756 -0.848 0.933 1.00 0.00 C ATOM 596 CD1 TYR A 41 34.734 -0.113 1.589 1.00 0.00 C ATOM 597 CD2 TYR A 41 33.865 -2.228 0.849 1.00 0.00 C ATOM 598 CE1 TYR A 41 35.816 -0.757 2.157 1.00 0.00 C ATOM 599 CE2 TYR A 41 34.948 -2.871 1.417 1.00 0.00 C ATOM 600 CZ TYR A 41 35.920 -2.141 2.069 1.00 0.00 C ATOM 601 OH TYR A 41 36.998 -2.782 2.634 1.00 0.00 O ATOM 0 H TYR A 41 34.023 -0.990 -2.184 1.00 0.00 H new ATOM 0 HA TYR A 41 31.950 0.903 -1.458 1.00 0.00 H new ATOM 0 HB2 TYR A 41 32.292 0.703 0.939 1.00 0.00 H new ATOM 0 HB3 TYR A 41 31.720 -0.824 0.298 1.00 0.00 H new ATOM 0 HD1 TYR A 41 34.649 0.962 1.655 1.00 0.00 H new ATOM 0 HD2 TYR A 41 33.103 -2.800 0.340 1.00 0.00 H new ATOM 0 HE1 TYR A 41 36.579 -0.188 2.668 1.00 0.00 H new ATOM 0 HE2 TYR A 41 35.034 -3.946 1.350 1.00 0.00 H new ATOM 0 HH TYR A 41 36.919 -3.747 2.485 1.00 0.00 H new ATOM 611 N GLN A 42 33.760 2.571 -0.782 1.00 0.00 N ATOM 612 CA GLN A 42 34.824 3.557 -0.642 1.00 0.00 C ATOM 613 C GLN A 42 34.337 4.792 0.105 1.00 0.00 C ATOM 614 O GLN A 42 33.137 5.064 0.158 1.00 0.00 O ATOM 615 CB GLN A 42 35.366 3.959 -2.017 1.00 0.00 C ATOM 616 CG GLN A 42 34.362 4.689 -2.892 1.00 0.00 C ATOM 617 CD GLN A 42 34.891 4.944 -4.291 1.00 0.00 C ATOM 618 OE1 GLN A 42 36.102 5.053 -4.501 1.00 0.00 O ATOM 619 NE2 GLN A 42 33.985 5.039 -5.257 1.00 0.00 N ATOM 0 H GLN A 42 32.825 2.931 -0.592 1.00 0.00 H new ATOM 0 HA GLN A 42 35.626 3.100 -0.062 1.00 0.00 H new ATOM 0 HB2 GLN A 42 36.241 4.595 -1.879 1.00 0.00 H new ATOM 0 HB3 GLN A 42 35.702 3.063 -2.539 1.00 0.00 H new ATOM 0 HG2 GLN A 42 33.445 4.103 -2.955 1.00 0.00 H new ATOM 0 HG3 GLN A 42 34.102 5.639 -2.426 1.00 0.00 H new ATOM 0 HE21 GLN A 42 32.994 4.942 -5.038 1.00 0.00 H new ATOM 0 HE22 GLN A 42 34.280 5.209 -6.218 1.00 0.00 H new ATOM 628 N VAL A 43 35.274 5.536 0.683 1.00 0.00 N ATOM 629 CA VAL A 43 34.964 6.828 1.282 1.00 0.00 C ATOM 630 C VAL A 43 35.502 7.973 0.432 1.00 0.00 C ATOM 631 O VAL A 43 36.704 8.059 0.179 1.00 0.00 O ATOM 632 CB VAL A 43 35.564 6.918 2.698 1.00 0.00 C ATOM 633 CG1 VAL A 43 35.292 8.286 3.306 1.00 0.00 C ATOM 634 CG2 VAL A 43 34.992 5.814 3.574 1.00 0.00 C ATOM 0 H VAL A 43 36.255 5.266 0.749 1.00 0.00 H new ATOM 0 HA VAL A 43 33.879 6.915 1.338 1.00 0.00 H new ATOM 0 HB VAL A 43 36.644 6.787 2.634 1.00 0.00 H new ATOM 0 HG11 VAL A 43 35.723 8.332 4.306 1.00 0.00 H new ATOM 0 HG12 VAL A 43 35.742 9.058 2.681 1.00 0.00 H new ATOM 0 HG13 VAL A 43 34.216 8.450 3.367 1.00 0.00 H new ATOM 0 HG21 VAL A 43 35.421 5.884 4.574 1.00 0.00 H new ATOM 0 HG22 VAL A 43 33.909 5.922 3.635 1.00 0.00 H new ATOM 0 HG23 VAL A 43 35.236 4.843 3.142 1.00 0.00 H new ATOM 644 N LEU A 44 34.605 8.850 -0.006 1.00 0.00 N ATOM 645 CA LEU A 44 34.972 9.935 -0.908 1.00 0.00 C ATOM 646 C LEU A 44 35.388 11.178 -0.133 1.00 0.00 C ATOM 647 O LEU A 44 36.244 11.942 -0.579 1.00 0.00 O ATOM 648 CB LEU A 44 33.799 10.272 -1.836 1.00 0.00 C ATOM 649 CG LEU A 44 33.330 9.137 -2.756 1.00 0.00 C ATOM 650 CD1 LEU A 44 32.101 9.587 -3.533 1.00 0.00 C ATOM 651 CD2 LEU A 44 34.460 8.748 -3.698 1.00 0.00 C ATOM 0 H LEU A 44 33.618 8.830 0.249 1.00 0.00 H new ATOM 0 HA LEU A 44 35.821 9.602 -1.505 1.00 0.00 H new ATOM 0 HB2 LEU A 44 32.955 10.590 -1.224 1.00 0.00 H new ATOM 0 HB3 LEU A 44 34.083 11.123 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 44 33.060 8.264 -2.162 1.00 0.00 H new ATOM 0 HD11 LEU A 44 31.768 8.781 -4.186 1.00 0.00 H new ATOM 0 HD12 LEU A 44 31.303 9.842 -2.836 1.00 0.00 H new ATOM 0 HD13 LEU A 44 32.351 10.461 -4.134 1.00 0.00 H new ATOM 0 HD21 LEU A 44 34.127 7.942 -4.352 1.00 0.00 H new ATOM 0 HD22 LEU A 44 34.744 9.610 -4.301 1.00 0.00 H new ATOM 0 HD23 LEU A 44 35.319 8.413 -3.117 1.00 0.00 H new ATOM 663 N GLU A 45 34.778 11.376 1.031 1.00 0.00 N ATOM 664 CA GLU A 45 35.098 12.517 1.880 1.00 0.00 C ATOM 665 C GLU A 45 34.941 12.168 3.354 1.00 0.00 C ATOM 666 O GLU A 45 33.948 11.564 3.757 1.00 0.00 O ATOM 667 CB GLU A 45 34.204 13.709 1.530 1.00 0.00 C ATOM 668 CG GLU A 45 34.503 14.974 2.323 1.00 0.00 C ATOM 669 CD GLU A 45 33.679 16.151 1.881 1.00 0.00 C ATOM 670 OE1 GLU A 45 32.917 16.004 0.956 1.00 0.00 O ATOM 671 OE2 GLU A 45 33.812 17.198 2.469 1.00 0.00 O ATOM 0 H GLU A 45 34.058 10.760 1.408 1.00 0.00 H new ATOM 0 HA GLU A 45 36.139 12.785 1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 45 34.310 13.927 0.467 1.00 0.00 H new ATOM 0 HB3 GLU A 45 33.164 13.428 1.696 1.00 0.00 H new ATOM 0 HG2 GLU A 45 34.319 14.785 3.381 1.00 0.00 H new ATOM 0 HG3 GLU A 45 35.560 15.219 2.222 1.00 0.00 H new ATOM 678 N GLY A 46 35.929 12.553 4.156 1.00 0.00 N ATOM 679 CA GLY A 46 35.857 12.371 5.601 1.00 0.00 C ATOM 680 C GLY A 46 36.011 10.904 5.980 1.00 0.00 C ATOM 681 O GLY A 46 37.047 10.291 5.721 1.00 0.00 O ATOM 0 H GLY A 46 36.789 12.993 3.829 1.00 0.00 H new ATOM 0 HA2 GLY A 46 36.639 12.958 6.083 1.00 0.00 H new ATOM 0 HA3 GLY A 46 34.903 12.746 5.970 1.00 0.00 H new ATOM 685 N GLY A 47 34.974 10.345 6.595 1.00 0.00 N ATOM 686 CA GLY A 47 35.016 8.966 7.067 1.00 0.00 C ATOM 687 C GLY A 47 34.713 8.885 8.558 1.00 0.00 C ATOM 688 O GLY A 47 34.494 7.801 9.099 1.00 0.00 O ATOM 0 H GLY A 47 34.094 10.826 6.778 1.00 0.00 H new ATOM 0 HA2 GLY A 47 34.293 8.367 6.513 1.00 0.00 H new ATOM 0 HA3 GLY A 47 36.000 8.541 6.869 1.00 0.00 H new ATOM 692 N GLN A 48 34.701 10.039 9.217 1.00 0.00 N ATOM 693 CA GLN A 48 34.465 10.097 10.655 1.00 0.00 C ATOM 694 C GLN A 48 33.613 11.304 11.025 1.00 0.00 C ATOM 695 O GLN A 48 34.123 12.416 11.164 1.00 0.00 O ATOM 696 CB GLN A 48 35.793 10.141 11.415 1.00 0.00 C ATOM 697 CG GLN A 48 36.634 8.884 11.274 1.00 0.00 C ATOM 698 CD GLN A 48 37.958 8.987 12.007 1.00 0.00 C ATOM 699 OE1 GLN A 48 38.612 10.033 11.991 1.00 0.00 O ATOM 700 NE2 GLN A 48 38.360 7.901 12.656 1.00 0.00 N ATOM 0 H GLN A 48 34.852 10.947 8.778 1.00 0.00 H new ATOM 0 HA GLN A 48 33.923 9.195 10.940 1.00 0.00 H new ATOM 0 HB2 GLN A 48 36.373 10.994 11.062 1.00 0.00 H new ATOM 0 HB3 GLN A 48 35.588 10.311 12.472 1.00 0.00 H new ATOM 0 HG2 GLN A 48 36.075 8.031 11.659 1.00 0.00 H new ATOM 0 HG3 GLN A 48 36.821 8.692 10.217 1.00 0.00 H new ATOM 0 HE21 GLN A 48 37.787 7.057 12.642 1.00 0.00 H new ATOM 0 HE22 GLN A 48 39.242 7.910 13.168 1.00 0.00 H new ATOM 709 N GLY A 49 32.313 11.079 11.183 1.00 0.00 N ATOM 710 CA GLY A 49 31.407 12.120 11.651 1.00 0.00 C ATOM 711 C GLY A 49 30.604 12.710 10.499 1.00 0.00 C ATOM 712 O GLY A 49 30.663 12.217 9.372 1.00 0.00 O ATOM 0 H GLY A 49 31.863 10.183 10.993 1.00 0.00 H new ATOM 0 HA2 GLY A 49 30.728 11.707 12.397 1.00 0.00 H new ATOM 0 HA3 GLY A 49 31.977 12.909 12.142 1.00 0.00 H new ATOM 716 N ALA A 50 29.854 13.769 10.787 1.00 0.00 N ATOM 717 CA ALA A 50 28.959 14.365 9.803 1.00 0.00 C ATOM 718 C ALA A 50 29.741 15.002 8.662 1.00 0.00 C ATOM 719 O ALA A 50 30.827 15.544 8.868 1.00 0.00 O ATOM 720 CB ALA A 50 28.055 15.395 10.464 1.00 0.00 C ATOM 0 H ALA A 50 29.849 14.232 11.696 1.00 0.00 H new ATOM 0 HA ALA A 50 28.341 13.570 9.386 1.00 0.00 H new ATOM 0 HB1 ALA A 50 27.393 15.831 9.716 1.00 0.00 H new ATOM 0 HB2 ALA A 50 27.459 14.912 11.239 1.00 0.00 H new ATOM 0 HB3 ALA A 50 28.664 16.180 10.911 1.00 0.00 H new ATOM 726 N GLY A 51 29.183 14.934 7.458 1.00 0.00 N ATOM 727 CA GLY A 51 29.838 15.485 6.278 1.00 0.00 C ATOM 728 C GLY A 51 30.554 14.398 5.487 1.00 0.00 C ATOM 729 O GLY A 51 31.000 14.627 4.362 1.00 0.00 O ATOM 0 H GLY A 51 28.277 14.502 7.274 1.00 0.00 H new ATOM 0 HA2 GLY A 51 29.099 15.973 5.643 1.00 0.00 H new ATOM 0 HA3 GLY A 51 30.554 16.250 6.580 1.00 0.00 H new ATOM 733 N THR A 52 30.662 13.215 6.081 1.00 0.00 N ATOM 734 CA THR A 52 31.281 12.076 5.413 1.00 0.00 C ATOM 735 C THR A 52 30.491 11.666 4.177 1.00 0.00 C ATOM 736 O THR A 52 29.271 11.511 4.231 1.00 0.00 O ATOM 737 CB THR A 52 31.407 10.875 6.369 1.00 0.00 C ATOM 738 OG1 THR A 52 32.322 11.195 7.425 1.00 0.00 O ATOM 739 CG2 THR A 52 31.910 9.649 5.621 1.00 0.00 C ATOM 0 H THR A 52 30.329 13.019 7.025 1.00 0.00 H new ATOM 0 HA THR A 52 32.279 12.386 5.103 1.00 0.00 H new ATOM 0 HB THR A 52 30.424 10.656 6.785 1.00 0.00 H new ATOM 0 HG1 THR A 52 31.821 11.500 8.210 1.00 0.00 H new ATOM 0 HG21 THR A 52 31.993 8.810 6.312 1.00 0.00 H new ATOM 0 HG22 THR A 52 31.210 9.396 4.825 1.00 0.00 H new ATOM 0 HG23 THR A 52 32.888 9.862 5.190 1.00 0.00 H new ATOM 747 N VAL A 53 31.194 11.490 3.063 1.00 0.00 N ATOM 748 CA VAL A 53 30.580 10.981 1.842 1.00 0.00 C ATOM 749 C VAL A 53 31.221 9.669 1.409 1.00 0.00 C ATOM 750 O VAL A 53 32.444 9.570 1.303 1.00 0.00 O ATOM 751 CB VAL A 53 30.713 12.014 0.708 1.00 0.00 C ATOM 752 CG1 VAL A 53 30.104 11.474 -0.578 1.00 0.00 C ATOM 753 CG2 VAL A 53 30.045 13.319 1.114 1.00 0.00 C ATOM 0 H VAL A 53 32.190 11.693 2.981 1.00 0.00 H new ATOM 0 HA VAL A 53 29.525 10.801 2.051 1.00 0.00 H new ATOM 0 HB VAL A 53 31.771 12.206 0.527 1.00 0.00 H new ATOM 0 HG11 VAL A 53 30.207 12.217 -1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 53 30.621 10.560 -0.869 1.00 0.00 H new ATOM 0 HG13 VAL A 53 29.048 11.258 -0.418 1.00 0.00 H new ATOM 0 HG21 VAL A 53 30.143 14.045 0.307 1.00 0.00 H new ATOM 0 HG22 VAL A 53 28.989 13.140 1.314 1.00 0.00 H new ATOM 0 HG23 VAL A 53 30.524 13.709 2.012 1.00 0.00 H new ATOM 763 N ALA A 54 30.389 8.664 1.159 1.00 0.00 N ATOM 764 CA ALA A 54 30.876 7.324 0.857 1.00 0.00 C ATOM 765 C ALA A 54 29.897 6.570 -0.035 1.00 0.00 C ATOM 766 O ALA A 54 28.705 6.874 -0.060 1.00 0.00 O ATOM 767 CB ALA A 54 31.124 6.548 2.142 1.00 0.00 C ATOM 0 H ALA A 54 29.373 8.753 1.160 1.00 0.00 H new ATOM 0 HA ALA A 54 31.818 7.423 0.317 1.00 0.00 H new ATOM 0 HB1 ALA A 54 31.487 5.549 1.900 1.00 0.00 H new ATOM 0 HB2 ALA A 54 31.869 7.069 2.744 1.00 0.00 H new ATOM 0 HB3 ALA A 54 30.194 6.469 2.705 1.00 0.00 H new ATOM 773 N THR A 55 30.409 5.587 -0.768 1.00 0.00 N ATOM 774 CA THR A 55 29.569 4.740 -1.607 1.00 0.00 C ATOM 775 C THR A 55 29.706 3.273 -1.220 1.00 0.00 C ATOM 776 O THR A 55 30.751 2.845 -0.729 1.00 0.00 O ATOM 777 CB THR A 55 29.917 4.917 -3.096 1.00 0.00 C ATOM 778 OG1 THR A 55 31.243 4.429 -3.342 1.00 0.00 O ATOM 779 CG2 THR A 55 29.839 6.384 -3.492 1.00 0.00 C ATOM 0 H THR A 55 31.402 5.357 -0.798 1.00 0.00 H new ATOM 0 HA THR A 55 28.536 5.049 -1.447 1.00 0.00 H new ATOM 0 HB THR A 55 29.199 4.352 -3.690 1.00 0.00 H new ATOM 0 HG1 THR A 55 31.302 4.091 -4.260 1.00 0.00 H new ATOM 0 HG21 THR A 55 30.088 6.490 -4.548 1.00 0.00 H new ATOM 0 HG22 THR A 55 28.829 6.754 -3.319 1.00 0.00 H new ATOM 0 HG23 THR A 55 30.544 6.960 -2.893 1.00 0.00 H new ATOM 787 N TRP A 56 28.645 2.506 -1.445 1.00 0.00 N ATOM 788 CA TRP A 56 28.656 1.078 -1.151 1.00 0.00 C ATOM 789 C TRP A 56 27.523 0.358 -1.872 1.00 0.00 C ATOM 790 O TRP A 56 26.403 0.864 -1.949 1.00 0.00 O ATOM 791 CB TRP A 56 28.537 0.842 0.356 1.00 0.00 C ATOM 792 CG TRP A 56 27.473 1.672 1.009 1.00 0.00 C ATOM 793 CD1 TRP A 56 27.615 2.930 1.513 1.00 0.00 C ATOM 794 CD2 TRP A 56 26.091 1.304 1.233 1.00 0.00 C ATOM 795 NE1 TRP A 56 26.423 3.368 2.034 1.00 0.00 N ATOM 796 CE2 TRP A 56 25.479 2.387 1.870 1.00 0.00 C ATOM 797 CE3 TRP A 56 25.335 0.160 0.948 1.00 0.00 C ATOM 798 CZ2 TRP A 56 24.141 2.364 2.232 1.00 0.00 C ATOM 799 CZ3 TRP A 56 23.993 0.138 1.310 1.00 0.00 C ATOM 800 CH2 TRP A 56 23.412 1.213 1.935 1.00 0.00 C ATOM 0 H TRP A 56 27.765 2.850 -1.831 1.00 0.00 H new ATOM 0 HA TRP A 56 29.604 0.674 -1.506 1.00 0.00 H new ATOM 0 HB2 TRP A 56 28.325 -0.212 0.535 1.00 0.00 H new ATOM 0 HB3 TRP A 56 29.496 1.059 0.827 1.00 0.00 H new ATOM 0 HD1 TRP A 56 28.532 3.500 1.504 1.00 0.00 H new ATOM 0 HE1 TRP A 56 26.265 4.276 2.472 1.00 0.00 H new ATOM 0 HE3 TRP A 56 25.786 -0.689 0.456 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 23.680 3.207 2.726 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 23.399 -0.738 1.096 1.00 0.00 H new ATOM 0 HH2 TRP A 56 22.367 1.166 2.203 1.00 0.00 H new ATOM 811 N LYS A 57 27.821 -0.824 -2.400 1.00 0.00 N ATOM 812 CA LYS A 57 26.841 -1.595 -3.154 1.00 0.00 C ATOM 813 C LYS A 57 26.073 -2.548 -2.248 1.00 0.00 C ATOM 814 O LYS A 57 26.667 -3.294 -1.469 1.00 0.00 O ATOM 815 CB LYS A 57 27.524 -2.376 -4.279 1.00 0.00 C ATOM 816 CG LYS A 57 28.124 -1.504 -5.374 1.00 0.00 C ATOM 817 CD LYS A 57 28.767 -2.351 -6.463 1.00 0.00 C ATOM 818 CE LYS A 57 29.375 -1.482 -7.554 1.00 0.00 C ATOM 819 NZ LYS A 57 30.023 -2.296 -8.618 1.00 0.00 N ATOM 0 H LYS A 57 28.735 -1.269 -2.319 1.00 0.00 H new ATOM 0 HA LYS A 57 26.130 -0.893 -3.590 1.00 0.00 H new ATOM 0 HB2 LYS A 57 28.313 -2.993 -3.850 1.00 0.00 H new ATOM 0 HB3 LYS A 57 26.798 -3.054 -4.728 1.00 0.00 H new ATOM 0 HG2 LYS A 57 27.346 -0.876 -5.810 1.00 0.00 H new ATOM 0 HG3 LYS A 57 28.869 -0.835 -4.943 1.00 0.00 H new ATOM 0 HD2 LYS A 57 29.540 -2.983 -6.026 1.00 0.00 H new ATOM 0 HD3 LYS A 57 28.020 -3.015 -6.898 1.00 0.00 H new ATOM 0 HE2 LYS A 57 28.598 -0.859 -7.997 1.00 0.00 H new ATOM 0 HE3 LYS A 57 30.111 -0.809 -7.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 30.424 -1.666 -9.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 30.782 -2.872 -8.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 29.316 -2.920 -9.056 1.00 0.00 H new ATOM 833 N LEU A 58 24.748 -2.519 -2.353 1.00 0.00 N ATOM 834 CA LEU A 58 23.899 -3.429 -1.595 1.00 0.00 C ATOM 835 C LEU A 58 23.392 -4.568 -2.470 1.00 0.00 C ATOM 836 O LEU A 58 22.572 -4.358 -3.364 1.00 0.00 O ATOM 837 CB LEU A 58 22.710 -2.668 -0.994 1.00 0.00 C ATOM 838 CG LEU A 58 21.752 -3.503 -0.134 1.00 0.00 C ATOM 839 CD1 LEU A 58 22.498 -4.046 1.077 1.00 0.00 C ATOM 840 CD2 LEU A 58 20.572 -2.643 0.291 1.00 0.00 C ATOM 0 H LEU A 58 24.239 -1.874 -2.957 1.00 0.00 H new ATOM 0 HA LEU A 58 24.499 -3.855 -0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 58 23.096 -1.850 -0.386 1.00 0.00 H new ATOM 0 HB3 LEU A 58 22.141 -2.219 -1.808 1.00 0.00 H new ATOM 0 HG LEU A 58 21.373 -4.347 -0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 58 21.817 -4.639 1.688 1.00 0.00 H new ATOM 0 HD12 LEU A 58 23.326 -4.672 0.744 1.00 0.00 H new ATOM 0 HD13 LEU A 58 22.886 -3.216 1.668 1.00 0.00 H new ATOM 0 HD21 LEU A 58 19.891 -3.236 0.902 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.932 -1.792 0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 58 20.046 -2.284 -0.594 1.00 0.00 H new ATOM 852 N GLN A 59 23.884 -5.774 -2.208 1.00 0.00 N ATOM 853 CA GLN A 59 23.567 -6.928 -3.040 1.00 0.00 C ATOM 854 C GLN A 59 22.639 -7.893 -2.313 1.00 0.00 C ATOM 855 O GLN A 59 23.064 -8.620 -1.415 1.00 0.00 O ATOM 856 CB GLN A 59 24.848 -7.652 -3.463 1.00 0.00 C ATOM 857 CG GLN A 59 24.619 -8.827 -4.399 1.00 0.00 C ATOM 858 CD GLN A 59 25.918 -9.443 -4.882 1.00 0.00 C ATOM 859 OE1 GLN A 59 26.976 -9.253 -4.275 1.00 0.00 O ATOM 860 NE2 GLN A 59 25.847 -10.187 -5.980 1.00 0.00 N ATOM 0 H GLN A 59 24.505 -5.978 -1.425 1.00 0.00 H new ATOM 0 HA GLN A 59 23.054 -6.565 -3.930 1.00 0.00 H new ATOM 0 HB2 GLN A 59 25.512 -6.938 -3.950 1.00 0.00 H new ATOM 0 HB3 GLN A 59 25.363 -8.008 -2.570 1.00 0.00 H new ATOM 0 HG2 GLN A 59 24.028 -9.586 -3.887 1.00 0.00 H new ATOM 0 HG3 GLN A 59 24.036 -8.495 -5.258 1.00 0.00 H new ATOM 0 HE21 GLN A 59 24.951 -10.318 -6.450 1.00 0.00 H new ATOM 0 HE22 GLN A 59 26.688 -10.628 -6.353 1.00 0.00 H new ATOM 950 N VAL A 65 21.614 -5.960 -7.189 1.00 0.00 N ATOM 951 CA VAL A 65 22.575 -5.131 -6.472 1.00 0.00 C ATOM 952 C VAL A 65 22.440 -3.666 -6.866 1.00 0.00 C ATOM 953 O VAL A 65 22.295 -3.341 -8.045 1.00 0.00 O ATOM 954 CB VAL A 65 24.011 -5.607 -6.759 1.00 0.00 C ATOM 955 CG1 VAL A 65 24.313 -5.520 -8.248 1.00 0.00 C ATOM 956 CG2 VAL A 65 25.002 -4.776 -5.958 1.00 0.00 C ATOM 0 HA VAL A 65 22.365 -5.227 -5.407 1.00 0.00 H new ATOM 0 HB VAL A 65 24.105 -6.650 -6.456 1.00 0.00 H new ATOM 0 HG11 VAL A 65 25.332 -5.860 -8.433 1.00 0.00 H new ATOM 0 HG12 VAL A 65 23.614 -6.150 -8.798 1.00 0.00 H new ATOM 0 HG13 VAL A 65 24.209 -4.487 -8.581 1.00 0.00 H new ATOM 0 HG21 VAL A 65 26.016 -5.118 -6.166 1.00 0.00 H new ATOM 0 HG22 VAL A 65 24.908 -3.727 -6.239 1.00 0.00 H new ATOM 0 HG23 VAL A 65 24.793 -4.886 -4.894 1.00 0.00 H new ATOM 966 N ARG A 66 22.489 -2.784 -5.873 1.00 0.00 N ATOM 967 CA ARG A 66 22.366 -1.351 -6.114 1.00 0.00 C ATOM 968 C ARG A 66 23.543 -0.590 -5.517 1.00 0.00 C ATOM 969 O ARG A 66 23.956 -0.851 -4.388 1.00 0.00 O ATOM 970 CB ARG A 66 21.069 -0.819 -5.523 1.00 0.00 C ATOM 971 CG ARG A 66 19.804 -1.450 -6.084 1.00 0.00 C ATOM 972 CD ARG A 66 19.593 -1.084 -7.508 1.00 0.00 C ATOM 973 NE ARG A 66 19.414 0.349 -7.679 1.00 0.00 N ATOM 974 CZ ARG A 66 18.241 0.996 -7.535 1.00 0.00 C ATOM 975 NH1 ARG A 66 17.156 0.326 -7.217 1.00 0.00 N ATOM 976 NH2 ARG A 66 18.182 2.304 -7.712 1.00 0.00 N ATOM 0 H ARG A 66 22.613 -3.037 -4.893 1.00 0.00 H new ATOM 0 HA ARG A 66 22.361 -1.199 -7.193 1.00 0.00 H new ATOM 0 HB2 ARG A 66 21.088 -0.974 -4.444 1.00 0.00 H new ATOM 0 HB3 ARG A 66 21.025 0.257 -5.689 1.00 0.00 H new ATOM 0 HG2 ARG A 66 19.867 -2.534 -5.992 1.00 0.00 H new ATOM 0 HG3 ARG A 66 18.945 -1.129 -5.495 1.00 0.00 H new ATOM 0 HD2 ARG A 66 20.447 -1.416 -8.099 1.00 0.00 H new ATOM 0 HD3 ARG A 66 18.717 -1.608 -7.891 1.00 0.00 H new ATOM 0 HE ARG A 66 20.234 0.903 -7.925 1.00 0.00 H new ATOM 0 HH11 ARG A 66 17.202 -0.684 -7.079 1.00 0.00 H new ATOM 0 HH12 ARG A 66 16.268 0.816 -7.108 1.00 0.00 H new ATOM 0 HH21 ARG A 66 19.024 2.824 -7.958 1.00 0.00 H new ATOM 0 HH22 ARG A 66 17.294 2.794 -7.603 1.00 0.00 H new ATOM 990 N ASP A 67 24.079 0.354 -6.283 1.00 0.00 N ATOM 991 CA ASP A 67 25.181 1.187 -5.815 1.00 0.00 C ATOM 992 C ASP A 67 24.666 2.424 -5.089 1.00 0.00 C ATOM 993 O ASP A 67 24.076 3.314 -5.701 1.00 0.00 O ATOM 994 CB ASP A 67 26.070 1.609 -6.987 1.00 0.00 C ATOM 995 CG ASP A 67 27.298 2.394 -6.546 1.00 0.00 C ATOM 996 OD1 ASP A 67 27.355 2.776 -5.401 1.00 0.00 O ATOM 997 OD2 ASP A 67 28.167 2.605 -7.358 1.00 0.00 O ATOM 0 H ASP A 67 23.768 0.562 -7.232 1.00 0.00 H new ATOM 0 HA ASP A 67 25.769 0.594 -5.114 1.00 0.00 H new ATOM 0 HB2 ASP A 67 26.389 0.721 -7.533 1.00 0.00 H new ATOM 0 HB3 ASP A 67 25.486 2.216 -7.679 1.00 0.00 H new ATOM 1002 N VAL A 68 24.894 2.473 -3.781 1.00 0.00 N ATOM 1003 CA VAL A 68 24.342 3.534 -2.947 1.00 0.00 C ATOM 1004 C VAL A 68 25.397 4.584 -2.621 1.00 0.00 C ATOM 1005 O VAL A 68 26.426 4.277 -2.018 1.00 0.00 O ATOM 1006 CB VAL A 68 23.783 2.948 -1.637 1.00 0.00 C ATOM 1007 CG1 VAL A 68 23.235 4.055 -0.749 1.00 0.00 C ATOM 1008 CG2 VAL A 68 22.705 1.922 -1.948 1.00 0.00 C ATOM 0 H VAL A 68 25.458 1.790 -3.275 1.00 0.00 H new ATOM 0 HA VAL A 68 23.537 4.010 -3.507 1.00 0.00 H new ATOM 0 HB VAL A 68 24.591 2.453 -1.098 1.00 0.00 H new ATOM 0 HG11 VAL A 68 22.844 3.623 0.172 1.00 0.00 H new ATOM 0 HG12 VAL A 68 24.033 4.758 -0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 68 22.435 4.578 -1.272 1.00 0.00 H new ATOM 0 HG21 VAL A 68 22.314 1.512 -1.017 1.00 0.00 H new ATOM 0 HG22 VAL A 68 21.897 2.400 -2.502 1.00 0.00 H new ATOM 0 HG23 VAL A 68 23.130 1.118 -2.549 1.00 0.00 H new ATOM 1018 N LYS A 69 25.135 5.823 -3.023 1.00 0.00 N ATOM 1019 CA LYS A 69 25.960 6.952 -2.611 1.00 0.00 C ATOM 1020 C LYS A 69 25.262 7.782 -1.541 1.00 0.00 C ATOM 1021 O LYS A 69 24.210 8.372 -1.787 1.00 0.00 O ATOM 1022 CB LYS A 69 26.307 7.830 -3.814 1.00 0.00 C ATOM 1023 CG LYS A 69 27.162 9.046 -3.481 1.00 0.00 C ATOM 1024 CD LYS A 69 27.493 9.848 -4.730 1.00 0.00 C ATOM 1025 CE LYS A 69 28.327 11.076 -4.395 1.00 0.00 C ATOM 1026 NZ LYS A 69 28.644 11.880 -5.607 1.00 0.00 N ATOM 0 H LYS A 69 24.357 6.071 -3.634 1.00 0.00 H new ATOM 0 HA LYS A 69 26.882 6.554 -2.187 1.00 0.00 H new ATOM 0 HB2 LYS A 69 26.832 7.223 -4.552 1.00 0.00 H new ATOM 0 HB3 LYS A 69 25.382 8.169 -4.280 1.00 0.00 H new ATOM 0 HG2 LYS A 69 26.634 9.680 -2.768 1.00 0.00 H new ATOM 0 HG3 LYS A 69 28.085 8.723 -2.998 1.00 0.00 H new ATOM 0 HD2 LYS A 69 28.036 9.219 -5.435 1.00 0.00 H new ATOM 0 HD3 LYS A 69 26.570 10.156 -5.222 1.00 0.00 H new ATOM 0 HE2 LYS A 69 27.788 11.696 -3.679 1.00 0.00 H new ATOM 0 HE3 LYS A 69 29.254 10.765 -3.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 29.213 12.707 -5.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 29.180 11.296 -6.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 27.760 12.199 -6.053 1.00 0.00 H new ATOM 1040 N ALA A 70 25.854 7.824 -0.352 1.00 0.00 N ATOM 1041 CA ALA A 70 25.186 8.383 0.817 1.00 0.00 C ATOM 1042 C ALA A 70 26.064 9.416 1.512 1.00 0.00 C ATOM 1043 O ALA A 70 27.291 9.338 1.459 1.00 0.00 O ATOM 1044 CB ALA A 70 24.802 7.276 1.788 1.00 0.00 C ATOM 0 H ALA A 70 26.796 7.477 -0.173 1.00 0.00 H new ATOM 0 HA ALA A 70 24.280 8.885 0.478 1.00 0.00 H new ATOM 0 HB1 ALA A 70 24.304 7.709 2.655 1.00 0.00 H new ATOM 0 HB2 ALA A 70 24.127 6.577 1.294 1.00 0.00 H new ATOM 0 HB3 ALA A 70 25.699 6.748 2.111 1.00 0.00 H new ATOM 1050 N THR A 71 25.428 10.384 2.164 1.00 0.00 N ATOM 1051 CA THR A 71 26.144 11.358 2.978 1.00 0.00 C ATOM 1052 C THR A 71 25.721 11.274 4.438 1.00 0.00 C ATOM 1053 O THR A 71 24.534 11.159 4.745 1.00 0.00 O ATOM 1054 CB THR A 71 25.918 12.789 2.455 1.00 0.00 C ATOM 1055 OG1 THR A 71 26.389 12.888 1.105 1.00 0.00 O ATOM 1056 CG2 THR A 71 26.659 13.797 3.321 1.00 0.00 C ATOM 0 H THR A 71 24.417 10.514 2.144 1.00 0.00 H new ATOM 0 HA THR A 71 27.205 11.120 2.907 1.00 0.00 H new ATOM 0 HB THR A 71 24.851 13.008 2.492 1.00 0.00 H new ATOM 0 HG1 THR A 71 26.243 13.799 0.773 1.00 0.00 H new ATOM 0 HG21 THR A 71 26.488 14.802 2.936 1.00 0.00 H new ATOM 0 HG22 THR A 71 26.294 13.734 4.346 1.00 0.00 H new ATOM 0 HG23 THR A 71 27.727 13.578 3.302 1.00 0.00 H new ATOM 1064 N VAL A 72 26.698 11.332 5.337 1.00 0.00 N ATOM 1065 CA VAL A 72 26.448 11.109 6.756 1.00 0.00 C ATOM 1066 C VAL A 72 25.949 12.378 7.434 1.00 0.00 C ATOM 1067 O VAL A 72 26.574 13.434 7.334 1.00 0.00 O ATOM 1068 CB VAL A 72 27.734 10.628 7.455 1.00 0.00 C ATOM 1069 CG1 VAL A 72 27.509 10.503 8.955 1.00 0.00 C ATOM 1070 CG2 VAL A 72 28.179 9.299 6.864 1.00 0.00 C ATOM 0 H VAL A 72 27.672 11.532 5.107 1.00 0.00 H new ATOM 0 HA VAL A 72 25.677 10.343 6.840 1.00 0.00 H new ATOM 0 HB VAL A 72 28.522 11.363 7.291 1.00 0.00 H new ATOM 0 HG11 VAL A 72 28.427 10.162 9.433 1.00 0.00 H new ATOM 0 HG12 VAL A 72 27.226 11.474 9.363 1.00 0.00 H new ATOM 0 HG13 VAL A 72 26.712 9.784 9.145 1.00 0.00 H new ATOM 0 HG21 VAL A 72 29.089 8.965 7.363 1.00 0.00 H new ATOM 0 HG22 VAL A 72 27.394 8.556 7.006 1.00 0.00 H new ATOM 0 HG23 VAL A 72 28.374 9.422 5.799 1.00 0.00 H new ATOM 1080 N ASP A 73 24.819 12.268 8.124 1.00 0.00 N ATOM 1081 CA ASP A 73 24.296 13.374 8.919 1.00 0.00 C ATOM 1082 C ASP A 73 24.171 12.986 10.386 1.00 0.00 C ATOM 1083 O ASP A 73 23.152 12.439 10.809 1.00 0.00 O ATOM 1084 CB ASP A 73 22.934 13.821 8.384 1.00 0.00 C ATOM 1085 CG ASP A 73 22.383 15.041 9.112 1.00 0.00 C ATOM 1086 OD1 ASP A 73 22.946 15.415 10.113 1.00 0.00 O ATOM 1087 OD2 ASP A 73 21.406 15.586 8.659 1.00 0.00 O ATOM 0 H ASP A 73 24.247 11.424 8.149 1.00 0.00 H new ATOM 0 HA ASP A 73 25.001 14.202 8.840 1.00 0.00 H new ATOM 0 HB2 ASP A 73 23.023 14.048 7.322 1.00 0.00 H new ATOM 0 HB3 ASP A 73 22.225 12.998 8.476 1.00 0.00 H new ATOM 1092 N VAL A 74 25.212 13.272 11.160 1.00 0.00 N ATOM 1093 CA VAL A 74 25.226 12.940 12.580 1.00 0.00 C ATOM 1094 C VAL A 74 24.366 13.909 13.381 1.00 0.00 C ATOM 1095 O VAL A 74 24.567 15.123 13.326 1.00 0.00 O ATOM 1096 CB VAL A 74 26.668 12.969 13.121 1.00 0.00 C ATOM 1097 CG1 VAL A 74 26.680 12.700 14.619 1.00 0.00 C ATOM 1098 CG2 VAL A 74 27.519 11.947 12.383 1.00 0.00 C ATOM 0 H VAL A 74 26.058 13.734 10.827 1.00 0.00 H new ATOM 0 HA VAL A 74 24.815 11.937 12.690 1.00 0.00 H new ATOM 0 HB VAL A 74 27.089 13.960 12.952 1.00 0.00 H new ATOM 0 HG11 VAL A 74 27.707 12.724 14.985 1.00 0.00 H new ATOM 0 HG12 VAL A 74 26.094 13.464 15.131 1.00 0.00 H new ATOM 0 HG13 VAL A 74 26.248 11.719 14.816 1.00 0.00 H new ATOM 0 HG21 VAL A 74 28.537 11.973 12.771 1.00 0.00 H new ATOM 0 HG22 VAL A 74 27.100 10.951 12.529 1.00 0.00 H new ATOM 0 HG23 VAL A 74 27.530 12.183 11.319 1.00 0.00 H new ATOM 1108 N ALA A 75 23.408 13.367 14.125 1.00 0.00 N ATOM 1109 CA ALA A 75 22.512 14.184 14.934 1.00 0.00 C ATOM 1110 C ALA A 75 22.471 13.694 16.376 1.00 0.00 C ATOM 1111 O ALA A 75 21.488 13.094 16.810 1.00 0.00 O ATOM 1112 CB ALA A 75 21.112 14.185 14.336 1.00 0.00 C ATOM 0 H ALA A 75 23.232 12.364 14.184 1.00 0.00 H new ATOM 0 HA ALA A 75 22.896 15.204 14.936 1.00 0.00 H new ATOM 0 HB1 ALA A 75 20.454 14.799 14.951 1.00 0.00 H new ATOM 0 HB2 ALA A 75 21.148 14.592 13.325 1.00 0.00 H new ATOM 0 HB3 ALA A 75 20.730 13.165 14.303 1.00 0.00 H new ATOM 1118 N GLY A 76 23.545 13.954 17.114 1.00 0.00 N ATOM 1119 CA GLY A 76 23.603 13.610 18.529 1.00 0.00 C ATOM 1120 C GLY A 76 23.918 12.132 18.725 1.00 0.00 C ATOM 1121 O GLY A 76 25.052 11.698 18.523 1.00 0.00 O ATOM 0 H GLY A 76 24.388 14.402 16.755 1.00 0.00 H new ATOM 0 HA2 GLY A 76 24.364 14.215 19.022 1.00 0.00 H new ATOM 0 HA3 GLY A 76 22.651 13.847 19.003 1.00 0.00 H new ATOM 1125 N HIS A 77 22.908 11.364 19.118 1.00 0.00 N ATOM 1126 CA HIS A 77 23.073 9.931 19.331 1.00 0.00 C ATOM 1127 C HIS A 77 22.469 9.130 18.185 1.00 0.00 C ATOM 1128 O HIS A 77 22.501 7.900 18.190 1.00 0.00 O ATOM 1129 CB HIS A 77 22.431 9.503 20.655 1.00 0.00 C ATOM 1130 CG HIS A 77 23.070 10.119 21.861 1.00 0.00 C ATOM 1131 ND1 HIS A 77 24.329 9.763 22.298 1.00 0.00 N ATOM 1132 CD2 HIS A 77 22.625 11.064 22.721 1.00 0.00 C ATOM 1133 CE1 HIS A 77 24.631 10.465 23.376 1.00 0.00 C ATOM 1134 NE2 HIS A 77 23.614 11.261 23.653 1.00 0.00 N ATOM 0 H HIS A 77 21.965 11.710 19.296 1.00 0.00 H new ATOM 0 HA HIS A 77 24.143 9.726 19.371 1.00 0.00 H new ATOM 0 HB2 HIS A 77 21.374 9.769 20.639 1.00 0.00 H new ATOM 0 HB3 HIS A 77 22.485 8.418 20.741 1.00 0.00 H new ATOM 0 HD2 HIS A 77 21.671 11.569 22.682 1.00 0.00 H new ATOM 0 HE1 HIS A 77 25.553 10.399 23.935 1.00 0.00 H new ATOM 0 HE2 HIS A 77 23.570 11.916 24.433 1.00 0.00 H new ATOM 1142 N THR A 78 21.919 9.836 17.203 1.00 0.00 N ATOM 1143 CA THR A 78 21.422 9.200 15.988 1.00 0.00 C ATOM 1144 C THR A 78 22.160 9.712 14.758 1.00 0.00 C ATOM 1145 O THR A 78 22.180 10.913 14.489 1.00 0.00 O ATOM 1146 CB THR A 78 19.910 9.434 15.819 1.00 0.00 C ATOM 1147 OG1 THR A 78 19.206 8.846 16.921 1.00 0.00 O ATOM 1148 CG2 THR A 78 19.417 8.815 14.519 1.00 0.00 C ATOM 0 H THR A 78 21.806 10.849 17.225 1.00 0.00 H new ATOM 0 HA THR A 78 21.604 8.130 16.086 1.00 0.00 H new ATOM 0 HB THR A 78 19.725 10.508 15.792 1.00 0.00 H new ATOM 0 HG1 THR A 78 18.867 7.965 16.660 1.00 0.00 H new ATOM 0 HG21 THR A 78 18.346 8.990 14.416 1.00 0.00 H new ATOM 0 HG22 THR A 78 19.941 9.269 13.678 1.00 0.00 H new ATOM 0 HG23 THR A 78 19.610 7.742 14.531 1.00 0.00 H new ATOM 1156 N VAL A 79 22.766 8.794 14.013 1.00 0.00 N ATOM 1157 CA VAL A 79 23.446 9.141 12.770 1.00 0.00 C ATOM 1158 C VAL A 79 22.619 8.733 11.558 1.00 0.00 C ATOM 1159 O VAL A 79 22.292 7.559 11.384 1.00 0.00 O ATOM 1160 CB VAL A 79 24.823 8.454 12.704 1.00 0.00 C ATOM 1161 CG1 VAL A 79 25.527 8.797 11.400 1.00 0.00 C ATOM 1162 CG2 VAL A 79 25.667 8.871 13.899 1.00 0.00 C ATOM 0 H VAL A 79 22.800 7.802 14.249 1.00 0.00 H new ATOM 0 HA VAL A 79 23.577 10.223 12.755 1.00 0.00 H new ATOM 0 HB VAL A 79 24.682 7.374 12.737 1.00 0.00 H new ATOM 0 HG11 VAL A 79 26.498 8.303 11.370 1.00 0.00 H new ATOM 0 HG12 VAL A 79 24.922 8.458 10.559 1.00 0.00 H new ATOM 0 HG13 VAL A 79 25.666 9.876 11.335 1.00 0.00 H new ATOM 0 HG21 VAL A 79 26.639 8.382 13.846 1.00 0.00 H new ATOM 0 HG22 VAL A 79 25.804 9.952 13.888 1.00 0.00 H new ATOM 0 HG23 VAL A 79 25.163 8.578 14.820 1.00 0.00 H new ATOM 1172 N ILE A 80 22.284 9.709 10.721 1.00 0.00 N ATOM 1173 CA ILE A 80 21.382 9.480 9.599 1.00 0.00 C ATOM 1174 C ILE A 80 22.151 9.356 8.290 1.00 0.00 C ATOM 1175 O ILE A 80 22.736 10.326 7.809 1.00 0.00 O ATOM 1176 CB ILE A 80 20.349 10.616 9.483 1.00 0.00 C ATOM 1177 CG1 ILE A 80 19.583 10.777 10.798 1.00 0.00 C ATOM 1178 CG2 ILE A 80 19.390 10.349 8.333 1.00 0.00 C ATOM 1179 CD1 ILE A 80 18.736 12.028 10.863 1.00 0.00 C ATOM 0 H ILE A 80 22.624 10.667 10.799 1.00 0.00 H new ATOM 0 HA ILE A 80 20.860 8.542 9.789 1.00 0.00 H new ATOM 0 HB ILE A 80 20.879 11.546 9.277 1.00 0.00 H new ATOM 0 HG12 ILE A 80 18.942 9.908 10.943 1.00 0.00 H new ATOM 0 HG13 ILE A 80 20.295 10.789 11.623 1.00 0.00 H new ATOM 0 HG21 ILE A 80 18.667 11.162 8.266 1.00 0.00 H new ATOM 0 HG22 ILE A 80 19.950 10.283 7.400 1.00 0.00 H new ATOM 0 HG23 ILE A 80 18.865 9.410 8.508 1.00 0.00 H new ATOM 0 HD11 ILE A 80 18.224 12.071 11.824 1.00 0.00 H new ATOM 0 HD12 ILE A 80 19.373 12.905 10.751 1.00 0.00 H new ATOM 0 HD13 ILE A 80 17.999 12.010 10.060 1.00 0.00 H new ATOM 1191 N GLU A 81 22.146 8.157 7.717 1.00 0.00 N ATOM 1192 CA GLU A 81 22.821 7.911 6.449 1.00 0.00 C ATOM 1193 C GLU A 81 21.899 8.194 5.270 1.00 0.00 C ATOM 1194 O GLU A 81 21.000 7.408 4.970 1.00 0.00 O ATOM 1195 CB GLU A 81 23.321 6.466 6.382 1.00 0.00 C ATOM 1196 CG GLU A 81 24.143 6.142 5.143 1.00 0.00 C ATOM 1197 CD GLU A 81 24.820 4.802 5.224 1.00 0.00 C ATOM 1198 OE1 GLU A 81 24.557 4.080 6.156 1.00 0.00 O ATOM 1199 OE2 GLU A 81 25.601 4.500 4.353 1.00 0.00 O ATOM 0 H GLU A 81 21.681 7.340 8.112 1.00 0.00 H new ATOM 0 HA GLU A 81 23.673 8.588 6.389 1.00 0.00 H new ATOM 0 HB2 GLU A 81 23.924 6.262 7.267 1.00 0.00 H new ATOM 0 HB3 GLU A 81 22.463 5.795 6.419 1.00 0.00 H new ATOM 0 HG2 GLU A 81 23.495 6.163 4.267 1.00 0.00 H new ATOM 0 HG3 GLU A 81 24.897 6.916 5.001 1.00 0.00 H new ATOM 1206 N LYS A 82 22.127 9.321 4.604 1.00 0.00 N ATOM 1207 CA LYS A 82 21.206 9.808 3.584 1.00 0.00 C ATOM 1208 C LYS A 82 21.740 9.536 2.184 1.00 0.00 C ATOM 1209 O LYS A 82 22.761 10.091 1.780 1.00 0.00 O ATOM 1210 CB LYS A 82 20.948 11.305 3.767 1.00 0.00 C ATOM 1211 CG LYS A 82 20.278 11.672 5.084 1.00 0.00 C ATOM 1212 CD LYS A 82 20.090 13.176 5.209 1.00 0.00 C ATOM 1213 CE LYS A 82 19.454 13.547 6.540 1.00 0.00 C ATOM 1214 NZ LYS A 82 19.331 15.021 6.707 1.00 0.00 N ATOM 0 H LYS A 82 22.943 9.915 4.753 1.00 0.00 H new ATOM 0 HA LYS A 82 20.265 9.270 3.700 1.00 0.00 H new ATOM 0 HB2 LYS A 82 21.897 11.836 3.696 1.00 0.00 H new ATOM 0 HB3 LYS A 82 20.324 11.657 2.946 1.00 0.00 H new ATOM 0 HG2 LYS A 82 19.310 11.176 5.153 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.882 11.309 5.915 1.00 0.00 H new ATOM 0 HD2 LYS A 82 21.055 13.674 5.114 1.00 0.00 H new ATOM 0 HD3 LYS A 82 19.464 13.535 4.392 1.00 0.00 H new ATOM 0 HE2 LYS A 82 18.467 13.090 6.610 1.00 0.00 H new ATOM 0 HE3 LYS A 82 20.052 13.138 7.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 20.031 15.351 7.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 19.501 15.489 5.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 18.374 15.254 7.042 1.00 0.00 H new ATOM 1228 N ASP A 83 21.043 8.678 1.447 1.00 0.00 N ATOM 1229 CA ASP A 83 21.400 8.389 0.064 1.00 0.00 C ATOM 1230 C ASP A 83 21.209 9.613 -0.822 1.00 0.00 C ATOM 1231 O ASP A 83 20.087 10.081 -1.017 1.00 0.00 O ATOM 1232 CB ASP A 83 20.564 7.226 -0.475 1.00 0.00 C ATOM 1233 CG ASP A 83 20.981 6.794 -1.875 1.00 0.00 C ATOM 1234 OD1 ASP A 83 21.767 7.485 -2.479 1.00 0.00 O ATOM 1235 OD2 ASP A 83 20.510 5.777 -2.326 1.00 0.00 O ATOM 0 H ASP A 83 20.226 8.170 1.786 1.00 0.00 H new ATOM 0 HA ASP A 83 22.454 8.111 0.047 1.00 0.00 H new ATOM 0 HB2 ASP A 83 20.652 6.377 0.203 1.00 0.00 H new ATOM 0 HB3 ASP A 83 19.513 7.516 -0.488 1.00 0.00 H new ATOM 1240 N ALA A 84 22.311 10.129 -1.356 1.00 0.00 N ATOM 1241 CA ALA A 84 22.266 11.298 -2.226 1.00 0.00 C ATOM 1242 C ALA A 84 21.749 10.933 -3.612 1.00 0.00 C ATOM 1243 O ALA A 84 21.275 11.793 -4.354 1.00 0.00 O ATOM 1244 CB ALA A 84 23.643 11.937 -2.327 1.00 0.00 C ATOM 0 H ALA A 84 23.247 9.755 -1.201 1.00 0.00 H new ATOM 0 HA ALA A 84 21.575 12.018 -1.787 1.00 0.00 H new ATOM 0 HB1 ALA A 84 23.593 12.808 -2.980 1.00 0.00 H new ATOM 0 HB2 ALA A 84 23.975 12.245 -1.335 1.00 0.00 H new ATOM 0 HB3 ALA A 84 24.349 11.216 -2.738 1.00 0.00 H new ATOM 1250 N ASN A 85 21.844 9.653 -3.956 1.00 0.00 N ATOM 1251 CA ASN A 85 21.435 9.181 -5.273 1.00 0.00 C ATOM 1252 C ASN A 85 19.919 9.067 -5.371 1.00 0.00 C ATOM 1253 O ASN A 85 19.299 9.655 -6.257 1.00 0.00 O ATOM 1254 CB ASN A 85 22.093 7.851 -5.592 1.00 0.00 C ATOM 1255 CG ASN A 85 21.860 7.417 -7.012 1.00 0.00 C ATOM 1256 OD1 ASN A 85 22.145 8.163 -7.957 1.00 0.00 O ATOM 1257 ND2 ASN A 85 21.348 6.225 -7.182 1.00 0.00 N ATOM 0 H ASN A 85 22.201 8.923 -3.340 1.00 0.00 H new ATOM 0 HA ASN A 85 21.764 9.915 -6.009 1.00 0.00 H new ATOM 0 HB2 ASN A 85 23.165 7.927 -5.411 1.00 0.00 H new ATOM 0 HB3 ASN A 85 21.709 7.088 -4.915 1.00 0.00 H new ATOM 0 HD21 ASN A 85 21.168 5.877 -8.124 1.00 0.00 H new ATOM 0 HD22 ASN A 85 21.129 5.644 -6.373 1.00 0.00 H new ATOM 1264 N SER A 86 19.328 8.306 -4.457 1.00 0.00 N ATOM 1265 CA SER A 86 17.893 8.047 -4.486 1.00 0.00 C ATOM 1266 C SER A 86 17.297 8.086 -3.085 1.00 0.00 C ATOM 1267 O SER A 86 17.945 8.529 -2.137 1.00 0.00 O ATOM 1268 CB SER A 86 17.619 6.700 -5.125 1.00 0.00 C ATOM 1269 OG SER A 86 16.249 6.526 -5.362 1.00 0.00 O ATOM 0 H SER A 86 19.821 7.857 -3.685 1.00 0.00 H new ATOM 0 HA SER A 86 17.422 8.831 -5.079 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.167 6.621 -6.064 1.00 0.00 H new ATOM 0 HB3 SER A 86 17.983 5.904 -4.475 1.00 0.00 H new ATOM 0 HG SER A 86 16.097 5.651 -5.776 1.00 0.00 H new ATOM 1275 N SER A 87 16.059 7.621 -2.961 1.00 0.00 N ATOM 1276 CA SER A 87 15.313 7.751 -1.715 1.00 0.00 C ATOM 1277 C SER A 87 15.609 6.591 -0.773 1.00 0.00 C ATOM 1278 O SER A 87 14.755 5.736 -0.539 1.00 0.00 O ATOM 1279 CB SER A 87 13.825 7.815 -2.001 1.00 0.00 C ATOM 1280 OG SER A 87 13.093 7.985 -0.819 1.00 0.00 O ATOM 0 H SER A 87 15.550 7.150 -3.709 1.00 0.00 H new ATOM 0 HA SER A 87 15.627 8.675 -1.230 1.00 0.00 H new ATOM 0 HB2 SER A 87 13.617 8.639 -2.683 1.00 0.00 H new ATOM 0 HB3 SER A 87 13.508 6.900 -2.501 1.00 0.00 H new ATOM 0 HG SER A 87 12.137 8.025 -1.029 1.00 0.00 H new ATOM 1286 N LEU A 88 16.823 6.569 -0.234 1.00 0.00 N ATOM 1287 CA LEU A 88 17.212 5.551 0.735 1.00 0.00 C ATOM 1288 C LEU A 88 17.901 6.175 1.942 1.00 0.00 C ATOM 1289 O LEU A 88 18.974 6.766 1.820 1.00 0.00 O ATOM 1290 CB LEU A 88 18.145 4.525 0.080 1.00 0.00 C ATOM 1291 CG LEU A 88 18.769 3.492 1.028 1.00 0.00 C ATOM 1292 CD1 LEU A 88 17.666 2.670 1.680 1.00 0.00 C ATOM 1293 CD2 LEU A 88 19.727 2.603 0.251 1.00 0.00 C ATOM 0 H LEU A 88 17.555 7.245 -0.452 1.00 0.00 H new ATOM 0 HA LEU A 88 16.306 5.050 1.077 1.00 0.00 H new ATOM 0 HB2 LEU A 88 17.586 3.993 -0.690 1.00 0.00 H new ATOM 0 HB3 LEU A 88 18.949 5.062 -0.423 1.00 0.00 H new ATOM 0 HG LEU A 88 19.331 3.998 1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.109 1.936 2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 88 17.006 3.329 2.245 1.00 0.00 H new ATOM 0 HD13 LEU A 88 17.092 2.155 0.909 1.00 0.00 H new ATOM 0 HD21 LEU A 88 20.170 1.869 0.925 1.00 0.00 H new ATOM 0 HD22 LEU A 88 19.184 2.087 -0.541 1.00 0.00 H new ATOM 0 HD23 LEU A 88 20.515 3.214 -0.189 1.00 0.00 H new ATOM 1305 N VAL A 89 17.278 6.040 3.108 1.00 0.00 N ATOM 1306 CA VAL A 89 17.829 6.592 4.340 1.00 0.00 C ATOM 1307 C VAL A 89 17.874 5.541 5.442 1.00 0.00 C ATOM 1308 O VAL A 89 16.866 4.904 5.748 1.00 0.00 O ATOM 1309 CB VAL A 89 16.985 7.791 4.812 1.00 0.00 C ATOM 1310 CG1 VAL A 89 17.527 8.339 6.124 1.00 0.00 C ATOM 1311 CG2 VAL A 89 16.974 8.870 3.740 1.00 0.00 C ATOM 0 H VAL A 89 16.390 5.552 3.226 1.00 0.00 H new ATOM 0 HA VAL A 89 18.847 6.921 4.130 1.00 0.00 H new ATOM 0 HB VAL A 89 15.961 7.459 4.982 1.00 0.00 H new ATOM 0 HG11 VAL A 89 16.919 9.186 6.443 1.00 0.00 H new ATOM 0 HG12 VAL A 89 17.493 7.560 6.886 1.00 0.00 H new ATOM 0 HG13 VAL A 89 18.558 8.665 5.984 1.00 0.00 H new ATOM 0 HG21 VAL A 89 16.375 9.715 4.080 1.00 0.00 H new ATOM 0 HG22 VAL A 89 17.994 9.202 3.548 1.00 0.00 H new ATOM 0 HG23 VAL A 89 16.545 8.467 2.823 1.00 0.00 H new ATOM 1321 N SER A 90 19.050 5.365 6.036 1.00 0.00 N ATOM 1322 CA SER A 90 19.211 4.450 7.160 1.00 0.00 C ATOM 1323 C SER A 90 19.566 5.202 8.436 1.00 0.00 C ATOM 1324 O SER A 90 20.499 6.004 8.456 1.00 0.00 O ATOM 1325 CB SER A 90 20.285 3.427 6.849 1.00 0.00 C ATOM 1326 OG SER A 90 19.879 2.568 5.820 1.00 0.00 O ATOM 0 H SER A 90 19.906 5.845 5.757 1.00 0.00 H new ATOM 0 HA SER A 90 18.261 3.940 7.318 1.00 0.00 H new ATOM 0 HB2 SER A 90 21.204 3.936 6.560 1.00 0.00 H new ATOM 0 HB3 SER A 90 20.509 2.847 7.744 1.00 0.00 H new ATOM 0 HG SER A 90 20.589 1.918 5.637 1.00 0.00 H new ATOM 1332 N ASN A 91 18.816 4.938 9.500 1.00 0.00 N ATOM 1333 CA ASN A 91 19.013 5.631 10.768 1.00 0.00 C ATOM 1334 C ASN A 91 19.829 4.786 11.737 1.00 0.00 C ATOM 1335 O ASN A 91 19.533 3.611 11.953 1.00 0.00 O ATOM 1336 CB ASN A 91 17.677 6.009 11.383 1.00 0.00 C ATOM 1337 CG ASN A 91 16.893 6.959 10.521 1.00 0.00 C ATOM 1338 OD1 ASN A 91 17.302 8.107 10.309 1.00 0.00 O ATOM 1339 ND2 ASN A 91 15.773 6.505 10.021 1.00 0.00 N ATOM 0 H ASN A 91 18.065 4.248 9.510 1.00 0.00 H new ATOM 0 HA ASN A 91 19.573 6.544 10.567 1.00 0.00 H new ATOM 0 HB2 ASN A 91 17.089 5.106 11.550 1.00 0.00 H new ATOM 0 HB3 ASN A 91 17.846 6.464 12.359 1.00 0.00 H new ATOM 0 HD21 ASN A 91 15.198 7.105 9.430 1.00 0.00 H new ATOM 0 HD22 ASN A 91 15.474 5.551 10.222 1.00 0.00 H new ATOM 1346 N TRP A 92 20.859 5.392 12.319 1.00 0.00 N ATOM 1347 CA TRP A 92 21.721 4.696 13.267 1.00 0.00 C ATOM 1348 C TRP A 92 21.572 5.269 14.670 1.00 0.00 C ATOM 1349 O TRP A 92 22.329 6.152 15.074 1.00 0.00 O ATOM 1350 CB TRP A 92 23.183 4.789 12.826 1.00 0.00 C ATOM 1351 CG TRP A 92 23.460 4.105 11.521 1.00 0.00 C ATOM 1352 CD1 TRP A 92 23.123 4.553 10.279 1.00 0.00 C ATOM 1353 CD2 TRP A 92 24.137 2.841 11.322 1.00 0.00 C ATOM 1354 NE1 TRP A 92 23.540 3.658 9.325 1.00 0.00 N ATOM 1355 CE2 TRP A 92 24.164 2.605 9.945 1.00 0.00 C ATOM 1356 CE3 TRP A 92 24.714 1.905 12.189 1.00 0.00 C ATOM 1357 CZ2 TRP A 92 24.744 1.468 9.406 1.00 0.00 C ATOM 1358 CZ3 TRP A 92 25.297 0.765 11.649 1.00 0.00 C ATOM 1359 CH2 TRP A 92 25.312 0.553 10.293 1.00 0.00 C ATOM 0 H TRP A 92 21.117 6.364 12.150 1.00 0.00 H new ATOM 0 HA TRP A 92 21.416 3.650 13.287 1.00 0.00 H new ATOM 0 HB2 TRP A 92 23.463 5.839 12.743 1.00 0.00 H new ATOM 0 HB3 TRP A 92 23.815 4.351 13.598 1.00 0.00 H new ATOM 0 HD1 TRP A 92 22.603 5.478 10.075 1.00 0.00 H new ATOM 0 HE1 TRP A 92 23.407 3.759 8.319 1.00 0.00 H new ATOM 0 HE3 TRP A 92 24.706 2.066 13.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 24.756 1.297 8.340 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 25.745 0.035 12.306 1.00 0.00 H new ATOM 0 HH2 TRP A 92 25.774 -0.342 9.904 1.00 0.00 H new ATOM 1370 N THR A 93 20.592 4.762 15.410 1.00 0.00 N ATOM 1371 CA THR A 93 20.332 5.234 16.765 1.00 0.00 C ATOM 1372 C THR A 93 20.998 4.336 17.799 1.00 0.00 C ATOM 1373 O THR A 93 20.833 3.117 17.775 1.00 0.00 O ATOM 1374 CB THR A 93 18.819 5.311 17.044 1.00 0.00 C ATOM 1375 OG1 THR A 93 18.215 6.261 16.157 1.00 0.00 O ATOM 1376 CG2 THR A 93 18.563 5.731 18.483 1.00 0.00 C ATOM 0 H THR A 93 19.964 4.023 15.094 1.00 0.00 H new ATOM 0 HA THR A 93 20.757 6.235 16.845 1.00 0.00 H new ATOM 0 HB THR A 93 18.384 4.325 16.882 1.00 0.00 H new ATOM 0 HG1 THR A 93 17.252 6.308 16.334 1.00 0.00 H new ATOM 0 HG21 THR A 93 17.489 5.780 18.662 1.00 0.00 H new ATOM 0 HG22 THR A 93 19.011 5.003 19.160 1.00 0.00 H new ATOM 0 HG23 THR A 93 19.006 6.711 18.660 1.00 0.00 H new ATOM 1384 N VAL A 94 21.753 4.947 18.707 1.00 0.00 N ATOM 1385 CA VAL A 94 22.359 4.218 19.814 1.00 0.00 C ATOM 1386 C VAL A 94 22.039 4.877 21.149 1.00 0.00 C ATOM 1387 O VAL A 94 22.046 6.103 21.265 1.00 0.00 O ATOM 1388 CB VAL A 94 23.887 4.147 19.634 1.00 0.00 C ATOM 1389 CG1 VAL A 94 24.481 5.546 19.565 1.00 0.00 C ATOM 1390 CG2 VAL A 94 24.507 3.354 20.774 1.00 0.00 C ATOM 0 H VAL A 94 21.959 5.946 18.697 1.00 0.00 H new ATOM 0 HA VAL A 94 21.943 3.210 19.814 1.00 0.00 H new ATOM 0 HB VAL A 94 24.109 3.639 18.695 1.00 0.00 H new ATOM 0 HG11 VAL A 94 25.561 5.477 19.438 1.00 0.00 H new ATOM 0 HG12 VAL A 94 24.050 6.083 18.720 1.00 0.00 H new ATOM 0 HG13 VAL A 94 24.258 6.082 20.488 1.00 0.00 H new ATOM 0 HG21 VAL A 94 25.588 3.308 20.640 1.00 0.00 H new ATOM 0 HG22 VAL A 94 24.279 3.841 21.722 1.00 0.00 H new ATOM 0 HG23 VAL A 94 24.099 2.343 20.778 1.00 0.00 H new ATOM 1400 N ALA A 95 21.757 4.057 22.156 1.00 0.00 N ATOM 1401 CA ALA A 95 21.364 4.560 23.467 1.00 0.00 C ATOM 1402 C ALA A 95 21.694 3.556 24.564 1.00 0.00 C ATOM 1403 O ALA A 95 21.824 2.359 24.305 1.00 0.00 O ATOM 1404 CB ALA A 95 19.879 4.892 23.483 1.00 0.00 C ATOM 0 H ALA A 95 21.793 3.040 22.089 1.00 0.00 H new ATOM 0 HA ALA A 95 21.931 5.470 23.662 1.00 0.00 H new ATOM 0 HB1 ALA A 95 19.600 5.266 24.468 1.00 0.00 H new ATOM 0 HB2 ALA A 95 19.668 5.654 22.732 1.00 0.00 H new ATOM 0 HB3 ALA A 95 19.303 3.994 23.260 1.00 0.00 H new ATOM 1410 N PRO A 96 21.829 4.050 25.790 1.00 0.00 N ATOM 1411 CA PRO A 96 22.095 3.190 26.937 1.00 0.00 C ATOM 1412 C PRO A 96 21.024 2.117 27.082 1.00 0.00 C ATOM 1413 O PRO A 96 19.852 2.352 26.788 1.00 0.00 O ATOM 1414 CB PRO A 96 22.075 4.170 28.114 1.00 0.00 C ATOM 1415 CG PRO A 96 22.442 5.480 27.506 1.00 0.00 C ATOM 1416 CD PRO A 96 21.771 5.469 26.158 1.00 0.00 C ATOM 0 HA PRO A 96 23.034 2.642 26.857 1.00 0.00 H new ATOM 0 HB2 PRO A 96 21.091 4.210 28.582 1.00 0.00 H new ATOM 0 HB3 PRO A 96 22.785 3.877 28.888 1.00 0.00 H new ATOM 0 HG2 PRO A 96 22.093 6.313 28.117 1.00 0.00 H new ATOM 0 HG3 PRO A 96 23.523 5.585 27.411 1.00 0.00 H new ATOM 0 HD2 PRO A 96 20.745 5.833 26.212 1.00 0.00 H new ATOM 0 HD3 PRO A 96 22.295 6.097 25.438 1.00 0.00 H new ATOM 1424 N ALA A 97 21.433 0.937 27.536 1.00 0.00 N ATOM 1425 CA ALA A 97 20.501 -0.162 27.763 1.00 0.00 C ATOM 1426 C ALA A 97 20.879 -0.956 29.006 1.00 0.00 C ATOM 1427 O ALA A 97 21.494 -2.019 28.913 1.00 0.00 O ATOM 1428 CB ALA A 97 20.453 -1.074 26.546 1.00 0.00 C ATOM 0 H ALA A 97 22.405 0.717 27.754 1.00 0.00 H new ATOM 0 HA ALA A 97 19.510 0.263 27.924 1.00 0.00 H new ATOM 0 HB1 ALA A 97 19.754 -1.890 26.730 1.00 0.00 H new ATOM 0 HB2 ALA A 97 20.125 -0.504 25.677 1.00 0.00 H new ATOM 0 HB3 ALA A 97 21.446 -1.483 26.358 1.00 0.00 H new ATOM 1434 N GLY A 98 20.508 -0.435 30.171 1.00 0.00 N ATOM 1435 CA GLY A 98 20.769 -1.117 31.433 1.00 0.00 C ATOM 1436 C GLY A 98 22.209 -0.911 31.883 1.00 0.00 C ATOM 1437 O GLY A 98 22.578 0.170 32.343 1.00 0.00 O ATOM 0 H GLY A 98 20.025 0.458 30.267 1.00 0.00 H new ATOM 0 HA2 GLY A 98 20.089 -0.743 32.199 1.00 0.00 H new ATOM 0 HA3 GLY A 98 20.569 -2.183 31.322 1.00 0.00 H new ATOM 1441 N THR A 99 23.021 -1.954 31.746 1.00 0.00 N ATOM 1442 CA THR A 99 24.437 -1.872 32.082 1.00 0.00 C ATOM 1443 C THR A 99 25.288 -1.663 30.835 1.00 0.00 C ATOM 1444 O THR A 99 26.475 -1.351 30.927 1.00 0.00 O ATOM 1445 CB THR A 99 24.906 -3.138 32.822 1.00 0.00 C ATOM 1446 OG1 THR A 99 24.747 -4.280 31.969 1.00 0.00 O ATOM 1447 CG2 THR A 99 24.097 -3.344 34.093 1.00 0.00 C ATOM 0 H THR A 99 22.722 -2.867 31.404 1.00 0.00 H new ATOM 0 HA THR A 99 24.563 -1.013 32.740 1.00 0.00 H new ATOM 0 HB THR A 99 25.956 -3.017 33.088 1.00 0.00 H new ATOM 0 HG1 THR A 99 25.047 -5.085 32.441 1.00 0.00 H new ATOM 0 HG21 THR A 99 24.443 -4.243 34.603 1.00 0.00 H new ATOM 0 HG22 THR A 99 24.225 -2.483 34.749 1.00 0.00 H new ATOM 0 HG23 THR A 99 23.043 -3.453 33.839 1.00 0.00 H new ATOM 1455 N GLY A 100 24.673 -1.838 29.670 1.00 0.00 N ATOM 1456 CA GLY A 100 25.384 -1.714 28.403 1.00 0.00 C ATOM 1457 C GLY A 100 24.698 -0.713 27.483 1.00 0.00 C ATOM 1458 O GLY A 100 24.284 0.362 27.917 1.00 0.00 O ATOM 0 H GLY A 100 23.683 -2.066 29.577 1.00 0.00 H new ATOM 0 HA2 GLY A 100 26.410 -1.398 28.588 1.00 0.00 H new ATOM 0 HA3 GLY A 100 25.434 -2.687 27.914 1.00 0.00 H new ATOM 1462 N SER A 101 24.580 -1.072 26.209 1.00 0.00 N ATOM 1463 CA SER A 101 23.982 -0.188 25.216 1.00 0.00 C ATOM 1464 C SER A 101 23.154 -0.973 24.206 1.00 0.00 C ATOM 1465 O SER A 101 23.135 -2.203 24.228 1.00 0.00 O ATOM 1466 CB SER A 101 25.063 0.595 24.496 1.00 0.00 C ATOM 1467 OG SER A 101 25.879 -0.255 23.738 1.00 0.00 O ATOM 0 H SER A 101 24.891 -1.970 25.840 1.00 0.00 H new ATOM 0 HA SER A 101 23.320 0.503 25.737 1.00 0.00 H new ATOM 0 HB2 SER A 101 24.605 1.340 23.846 1.00 0.00 H new ATOM 0 HB3 SER A 101 25.670 1.135 25.222 1.00 0.00 H new ATOM 0 HG SER A 101 26.717 -0.418 24.219 1.00 0.00 H new ATOM 1473 N SER A 102 22.471 -0.254 23.322 1.00 0.00 N ATOM 1474 CA SER A 102 21.713 -0.881 22.246 1.00 0.00 C ATOM 1475 C SER A 102 21.700 -0.007 20.999 1.00 0.00 C ATOM 1476 O SER A 102 21.833 1.214 21.084 1.00 0.00 O ATOM 1477 CB SER A 102 20.292 -1.153 22.699 1.00 0.00 C ATOM 1478 OG SER A 102 19.593 0.044 22.905 1.00 0.00 O ATOM 0 H SER A 102 22.427 0.765 23.330 1.00 0.00 H new ATOM 0 HA SER A 102 22.200 -1.824 21.997 1.00 0.00 H new ATOM 0 HB2 SER A 102 19.777 -1.755 21.950 1.00 0.00 H new ATOM 0 HB3 SER A 102 20.305 -1.734 23.621 1.00 0.00 H new ATOM 0 HG SER A 102 18.679 -0.157 23.195 1.00 0.00 H new ATOM 1484 N VAL A 103 21.538 -0.639 19.842 1.00 0.00 N ATOM 1485 CA VAL A 103 21.453 0.085 18.579 1.00 0.00 C ATOM 1486 C VAL A 103 20.163 -0.247 17.839 1.00 0.00 C ATOM 1487 O VAL A 103 19.821 -1.417 17.663 1.00 0.00 O ATOM 1488 CB VAL A 103 22.658 -0.258 17.683 1.00 0.00 C ATOM 1489 CG1 VAL A 103 22.536 0.438 16.336 1.00 0.00 C ATOM 1490 CG2 VAL A 103 23.950 0.138 18.380 1.00 0.00 C ATOM 0 H VAL A 103 21.463 -1.652 19.752 1.00 0.00 H new ATOM 0 HA VAL A 103 21.460 1.151 18.808 1.00 0.00 H new ATOM 0 HB VAL A 103 22.673 -1.333 17.506 1.00 0.00 H new ATOM 0 HG11 VAL A 103 23.396 0.184 15.716 1.00 0.00 H new ATOM 0 HG12 VAL A 103 21.622 0.112 15.840 1.00 0.00 H new ATOM 0 HG13 VAL A 103 22.503 1.517 16.486 1.00 0.00 H new ATOM 0 HG21 VAL A 103 24.798 -0.107 17.741 1.00 0.00 H new ATOM 0 HG22 VAL A 103 23.943 1.210 18.578 1.00 0.00 H new ATOM 0 HG23 VAL A 103 24.036 -0.404 19.322 1.00 0.00 H new ATOM 1500 N ASN A 104 19.450 0.788 17.409 1.00 0.00 N ATOM 1501 CA ASN A 104 18.195 0.607 16.689 1.00 0.00 C ATOM 1502 C ASN A 104 18.280 1.183 15.281 1.00 0.00 C ATOM 1503 O ASN A 104 18.330 2.399 15.099 1.00 0.00 O ATOM 1504 CB ASN A 104 17.045 1.236 17.454 1.00 0.00 C ATOM 1505 CG ASN A 104 15.716 1.007 16.790 1.00 0.00 C ATOM 1506 OD1 ASN A 104 15.636 0.868 15.564 1.00 0.00 O ATOM 1507 ND2 ASN A 104 14.670 0.964 17.577 1.00 0.00 N ATOM 0 H ASN A 104 19.720 1.762 17.547 1.00 0.00 H new ATOM 0 HA ASN A 104 18.010 -0.464 16.603 1.00 0.00 H new ATOM 0 HB2 ASN A 104 17.018 0.826 18.464 1.00 0.00 H new ATOM 0 HB3 ASN A 104 17.220 2.308 17.549 1.00 0.00 H new ATOM 0 HD21 ASN A 104 13.742 0.811 17.183 1.00 0.00 H new ATOM 0 HD22 ASN A 104 14.784 1.084 18.584 1.00 0.00 H new ATOM 1514 N LEU A 105 18.296 0.301 14.287 1.00 0.00 N ATOM 1515 CA LEU A 105 18.377 0.720 12.893 1.00 0.00 C ATOM 1516 C LEU A 105 16.991 0.846 12.274 1.00 0.00 C ATOM 1517 O LEU A 105 16.098 0.050 12.562 1.00 0.00 O ATOM 1518 CB LEU A 105 19.215 -0.280 12.087 1.00 0.00 C ATOM 1519 CG LEU A 105 20.678 -0.427 12.524 1.00 0.00 C ATOM 1520 CD1 LEU A 105 21.412 -1.337 11.548 1.00 0.00 C ATOM 1521 CD2 LEU A 105 21.330 0.946 12.588 1.00 0.00 C ATOM 0 H LEU A 105 18.254 -0.709 14.421 1.00 0.00 H new ATOM 0 HA LEU A 105 18.856 1.699 12.865 1.00 0.00 H new ATOM 0 HB2 LEU A 105 18.737 -1.258 12.147 1.00 0.00 H new ATOM 0 HB3 LEU A 105 19.196 0.020 11.039 1.00 0.00 H new ATOM 0 HG LEU A 105 20.727 -0.877 13.516 1.00 0.00 H new ATOM 0 HD11 LEU A 105 22.451 -1.441 11.859 1.00 0.00 H new ATOM 0 HD12 LEU A 105 20.937 -2.318 11.537 1.00 0.00 H new ATOM 0 HD13 LEU A 105 21.374 -0.904 10.548 1.00 0.00 H new ATOM 0 HD21 LEU A 105 22.370 0.841 12.899 1.00 0.00 H new ATOM 0 HD22 LEU A 105 21.291 1.414 11.604 1.00 0.00 H new ATOM 0 HD23 LEU A 105 20.798 1.568 13.307 1.00 0.00 H new ATOM 1533 N LYS A 106 16.818 1.850 11.421 1.00 0.00 N ATOM 1534 CA LYS A 106 15.616 1.963 10.603 1.00 0.00 C ATOM 1535 C LYS A 106 15.955 2.404 9.185 1.00 0.00 C ATOM 1536 O LYS A 106 16.434 3.517 8.969 1.00 0.00 O ATOM 1537 CB LYS A 106 14.627 2.942 11.237 1.00 0.00 C ATOM 1538 CG LYS A 106 13.330 3.118 10.458 1.00 0.00 C ATOM 1539 CD LYS A 106 12.340 3.985 11.221 1.00 0.00 C ATOM 1540 CE LYS A 106 11.073 4.223 10.413 1.00 0.00 C ATOM 1541 NZ LYS A 106 10.055 4.985 11.186 1.00 0.00 N ATOM 0 H LYS A 106 17.496 2.598 11.278 1.00 0.00 H new ATOM 0 HA LYS A 106 15.153 0.977 10.551 1.00 0.00 H new ATOM 0 HB2 LYS A 106 14.388 2.598 12.243 1.00 0.00 H new ATOM 0 HB3 LYS A 106 15.111 3.914 11.338 1.00 0.00 H new ATOM 0 HG2 LYS A 106 13.543 3.572 9.490 1.00 0.00 H new ATOM 0 HG3 LYS A 106 12.886 2.142 10.262 1.00 0.00 H new ATOM 0 HD2 LYS A 106 12.086 3.504 12.166 1.00 0.00 H new ATOM 0 HD3 LYS A 106 12.803 4.941 11.464 1.00 0.00 H new ATOM 0 HE2 LYS A 106 11.321 4.769 9.503 1.00 0.00 H new ATOM 0 HE3 LYS A 106 10.653 3.265 10.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 9.208 5.126 10.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 9.799 4.453 12.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 10.446 5.910 11.457 1.00 0.00 H new ATOM 1555 N THR A 107 15.703 1.525 8.222 1.00 0.00 N ATOM 1556 CA THR A 107 15.964 1.828 6.820 1.00 0.00 C ATOM 1557 C THR A 107 14.670 2.105 6.065 1.00 0.00 C ATOM 1558 O THR A 107 13.740 1.299 6.092 1.00 0.00 O ATOM 1559 CB THR A 107 16.725 0.677 6.136 1.00 0.00 C ATOM 1560 OG1 THR A 107 18.010 0.518 6.752 1.00 0.00 O ATOM 1561 CG2 THR A 107 16.911 0.967 4.654 1.00 0.00 C ATOM 0 H THR A 107 15.318 0.595 8.387 1.00 0.00 H new ATOM 0 HA THR A 107 16.583 2.725 6.795 1.00 0.00 H new ATOM 0 HB THR A 107 16.144 -0.239 6.247 1.00 0.00 H new ATOM 0 HG1 THR A 107 18.614 1.223 6.436 1.00 0.00 H new ATOM 0 HG21 THR A 107 17.451 0.143 4.187 1.00 0.00 H new ATOM 0 HG22 THR A 107 15.936 1.077 4.180 1.00 0.00 H new ATOM 0 HG23 THR A 107 17.480 1.889 4.532 1.00 0.00 H new ATOM 1569 N THR A 108 14.616 3.250 5.393 1.00 0.00 N ATOM 1570 CA THR A 108 13.467 3.601 4.568 1.00 0.00 C ATOM 1571 C THR A 108 13.858 3.723 3.101 1.00 0.00 C ATOM 1572 O THR A 108 14.782 4.460 2.755 1.00 0.00 O ATOM 1573 CB THR A 108 12.824 4.917 5.044 1.00 0.00 C ATOM 1574 OG1 THR A 108 12.379 4.772 6.399 1.00 0.00 O ATOM 1575 CG2 THR A 108 11.640 5.282 4.162 1.00 0.00 C ATOM 0 H THR A 108 15.356 3.952 5.404 1.00 0.00 H new ATOM 0 HA THR A 108 12.739 2.796 4.670 1.00 0.00 H new ATOM 0 HB THR A 108 13.569 5.711 4.982 1.00 0.00 H new ATOM 0 HG1 THR A 108 11.972 5.611 6.701 1.00 0.00 H new ATOM 0 HG21 THR A 108 11.198 6.214 4.513 1.00 0.00 H new ATOM 0 HG22 THR A 108 11.977 5.405 3.133 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.895 4.488 4.207 1.00 0.00 H new ATOM 1818 N PRO A 125 10.978 -5.681 3.086 1.00 0.00 N ATOM 1819 CA PRO A 125 11.100 -5.202 4.458 1.00 0.00 C ATOM 1820 C PRO A 125 11.816 -6.221 5.335 1.00 0.00 C ATOM 1821 O PRO A 125 12.670 -5.864 6.146 1.00 0.00 O ATOM 1822 CB PRO A 125 9.642 -5.011 4.888 1.00 0.00 C ATOM 1823 CG PRO A 125 8.930 -4.668 3.624 1.00 0.00 C ATOM 1824 CD PRO A 125 9.575 -5.542 2.582 1.00 0.00 C ATOM 0 HA PRO A 125 11.691 -4.290 4.546 1.00 0.00 H new ATOM 0 HB2 PRO A 125 9.238 -5.917 5.339 1.00 0.00 H new ATOM 0 HB3 PRO A 125 9.546 -4.216 5.628 1.00 0.00 H new ATOM 0 HG2 PRO A 125 7.861 -4.867 3.703 1.00 0.00 H new ATOM 0 HG3 PRO A 125 9.040 -3.611 3.380 1.00 0.00 H new ATOM 0 HD2 PRO A 125 9.077 -6.508 2.500 1.00 0.00 H new ATOM 0 HD3 PRO A 125 9.544 -5.083 1.594 1.00 0.00 H new ATOM 1832 N LEU A 126 11.462 -7.490 5.168 1.00 0.00 N ATOM 1833 CA LEU A 126 12.030 -8.558 5.983 1.00 0.00 C ATOM 1834 C LEU A 126 13.439 -8.910 5.525 1.00 0.00 C ATOM 1835 O LEU A 126 14.301 -9.247 6.337 1.00 0.00 O ATOM 1836 CB LEU A 126 11.138 -9.804 5.921 1.00 0.00 C ATOM 1837 CG LEU A 126 9.749 -9.661 6.556 1.00 0.00 C ATOM 1838 CD1 LEU A 126 8.947 -10.932 6.315 1.00 0.00 C ATOM 1839 CD2 LEU A 126 9.898 -9.381 8.044 1.00 0.00 C ATOM 0 H LEU A 126 10.783 -7.805 4.475 1.00 0.00 H new ATOM 0 HA LEU A 126 12.082 -8.202 7.012 1.00 0.00 H new ATOM 0 HB2 LEU A 126 11.012 -10.086 4.876 1.00 0.00 H new ATOM 0 HB3 LEU A 126 11.659 -10.626 6.412 1.00 0.00 H new ATOM 0 HG LEU A 126 9.215 -8.827 6.101 1.00 0.00 H new ATOM 0 HD11 LEU A 126 7.960 -10.830 6.766 1.00 0.00 H new ATOM 0 HD12 LEU A 126 8.841 -11.097 5.243 1.00 0.00 H new ATOM 0 HD13 LEU A 126 9.465 -11.780 6.763 1.00 0.00 H new ATOM 0 HD21 LEU A 126 8.911 -9.279 8.496 1.00 0.00 H new ATOM 0 HD22 LEU A 126 10.431 -10.205 8.518 1.00 0.00 H new ATOM 0 HD23 LEU A 126 10.459 -8.457 8.186 1.00 0.00 H new ATOM 1851 N GLY A 127 13.668 -8.832 4.218 1.00 0.00 N ATOM 1852 CA GLY A 127 14.985 -9.103 3.654 1.00 0.00 C ATOM 1853 C GLY A 127 16.005 -8.070 4.113 1.00 0.00 C ATOM 1854 O GLY A 127 17.122 -8.415 4.499 1.00 0.00 O ATOM 0 H GLY A 127 12.958 -8.583 3.529 1.00 0.00 H new ATOM 0 HA2 GLY A 127 15.313 -10.099 3.952 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.925 -9.100 2.566 1.00 0.00 H new ATOM 1858 N LEU A 128 15.615 -6.800 4.069 1.00 0.00 N ATOM 1859 CA LEU A 128 16.480 -5.717 4.521 1.00 0.00 C ATOM 1860 C LEU A 128 16.727 -5.799 6.022 1.00 0.00 C ATOM 1861 O LEU A 128 17.828 -5.520 6.496 1.00 0.00 O ATOM 1862 CB LEU A 128 15.856 -4.360 4.173 1.00 0.00 C ATOM 1863 CG LEU A 128 15.789 -4.023 2.678 1.00 0.00 C ATOM 1864 CD1 LEU A 128 14.995 -2.739 2.481 1.00 0.00 C ATOM 1865 CD2 LEU A 128 17.200 -3.882 2.126 1.00 0.00 C ATOM 0 H LEU A 128 14.704 -6.496 3.724 1.00 0.00 H new ATOM 0 HA LEU A 128 17.437 -5.818 4.009 1.00 0.00 H new ATOM 0 HB2 LEU A 128 14.845 -4.331 4.579 1.00 0.00 H new ATOM 0 HB3 LEU A 128 16.425 -3.579 4.678 1.00 0.00 H new ATOM 0 HG LEU A 128 15.286 -4.825 2.138 1.00 0.00 H new ATOM 0 HD11 LEU A 128 14.948 -2.500 1.419 1.00 0.00 H new ATOM 0 HD12 LEU A 128 13.985 -2.873 2.868 1.00 0.00 H new ATOM 0 HD13 LEU A 128 15.483 -1.924 3.015 1.00 0.00 H new ATOM 0 HD21 LEU A 128 17.153 -3.643 1.064 1.00 0.00 H new ATOM 0 HD22 LEU A 128 17.720 -3.083 2.655 1.00 0.00 H new ATOM 0 HD23 LEU A 128 17.740 -4.819 2.263 1.00 0.00 H new ATOM 1877 N ARG A 129 15.695 -6.183 6.766 1.00 0.00 N ATOM 1878 CA ARG A 129 15.822 -6.388 8.204 1.00 0.00 C ATOM 1879 C ARG A 129 16.854 -7.463 8.518 1.00 0.00 C ATOM 1880 O ARG A 129 17.701 -7.288 9.394 1.00 0.00 O ATOM 1881 CB ARG A 129 14.482 -6.783 8.809 1.00 0.00 C ATOM 1882 CG ARG A 129 14.488 -6.954 10.319 1.00 0.00 C ATOM 1883 CD ARG A 129 13.193 -7.484 10.817 1.00 0.00 C ATOM 1884 NE ARG A 129 12.927 -8.824 10.319 1.00 0.00 N ATOM 1885 CZ ARG A 129 13.526 -9.942 10.773 1.00 0.00 C ATOM 1886 NH1 ARG A 129 14.420 -9.864 11.733 1.00 0.00 N ATOM 1887 NH2 ARG A 129 13.215 -11.116 10.253 1.00 0.00 N ATOM 0 H ARG A 129 14.761 -6.359 6.396 1.00 0.00 H new ATOM 0 HA ARG A 129 16.153 -5.446 8.641 1.00 0.00 H new ATOM 0 HB2 ARG A 129 13.744 -6.025 8.547 1.00 0.00 H new ATOM 0 HB3 ARG A 129 14.155 -7.718 8.353 1.00 0.00 H new ATOM 0 HG2 ARG A 129 15.293 -7.631 10.605 1.00 0.00 H new ATOM 0 HG3 ARG A 129 14.695 -5.995 10.793 1.00 0.00 H new ATOM 0 HD2 ARG A 129 13.201 -7.497 11.907 1.00 0.00 H new ATOM 0 HD3 ARG A 129 12.387 -6.817 10.512 1.00 0.00 H new ATOM 0 HE ARG A 129 12.238 -8.925 9.573 1.00 0.00 H new ATOM 0 HH11 ARG A 129 14.660 -8.957 12.134 1.00 0.00 H new ATOM 0 HH12 ARG A 129 14.874 -10.710 12.077 1.00 0.00 H new ATOM 0 HH21 ARG A 129 12.521 -11.176 9.508 1.00 0.00 H new ATOM 0 HH22 ARG A 129 13.669 -11.962 10.597 1.00 0.00 H new ATOM 1901 N ARG A 130 16.778 -8.578 7.798 1.00 0.00 N ATOM 1902 CA ARG A 130 17.759 -9.647 7.936 1.00 0.00 C ATOM 1903 C ARG A 130 19.174 -9.128 7.716 1.00 0.00 C ATOM 1904 O ARG A 130 20.092 -9.462 8.465 1.00 0.00 O ATOM 1905 CB ARG A 130 17.473 -10.767 6.946 1.00 0.00 C ATOM 1906 CG ARG A 130 18.484 -11.903 6.956 1.00 0.00 C ATOM 1907 CD ARG A 130 18.134 -12.958 5.971 1.00 0.00 C ATOM 1908 NE ARG A 130 19.180 -13.961 5.856 1.00 0.00 N ATOM 1909 CZ ARG A 130 20.261 -13.852 5.060 1.00 0.00 C ATOM 1910 NH1 ARG A 130 20.424 -12.780 4.317 1.00 0.00 N ATOM 1911 NH2 ARG A 130 21.158 -14.822 5.027 1.00 0.00 N ATOM 0 H ARG A 130 16.046 -8.764 7.112 1.00 0.00 H new ATOM 0 HA ARG A 130 17.681 -10.033 8.952 1.00 0.00 H new ATOM 0 HB2 ARG A 130 16.486 -11.177 7.158 1.00 0.00 H new ATOM 0 HB3 ARG A 130 17.433 -10.344 5.942 1.00 0.00 H new ATOM 0 HG2 ARG A 130 19.475 -11.510 6.731 1.00 0.00 H new ATOM 0 HG3 ARG A 130 18.532 -12.338 7.954 1.00 0.00 H new ATOM 0 HD2 ARG A 130 17.202 -13.438 6.269 1.00 0.00 H new ATOM 0 HD3 ARG A 130 17.960 -12.502 4.997 1.00 0.00 H new ATOM 0 HE ARG A 130 19.089 -14.807 6.418 1.00 0.00 H new ATOM 0 HH11 ARG A 130 19.732 -12.031 4.343 1.00 0.00 H new ATOM 0 HH12 ARG A 130 21.243 -12.697 3.714 1.00 0.00 H new ATOM 0 HH21 ARG A 130 21.032 -15.653 5.604 1.00 0.00 H new ATOM 0 HH22 ARG A 130 21.977 -14.739 4.424 1.00 0.00 H new ATOM 1925 N ILE A 131 19.344 -8.308 6.683 1.00 0.00 N ATOM 1926 CA ILE A 131 20.636 -7.696 6.396 1.00 0.00 C ATOM 1927 C ILE A 131 21.102 -6.824 7.556 1.00 0.00 C ATOM 1928 O ILE A 131 22.273 -6.851 7.933 1.00 0.00 O ATOM 1929 CB ILE A 131 20.569 -6.849 5.112 1.00 0.00 C ATOM 1930 CG1 ILE A 131 20.378 -7.750 3.889 1.00 0.00 C ATOM 1931 CG2 ILE A 131 21.825 -6.005 4.965 1.00 0.00 C ATOM 1932 CD1 ILE A 131 20.031 -6.997 2.625 1.00 0.00 C ATOM 0 H ILE A 131 18.603 -8.052 6.031 1.00 0.00 H new ATOM 0 HA ILE A 131 21.354 -8.504 6.253 1.00 0.00 H new ATOM 0 HB ILE A 131 19.713 -6.178 5.183 1.00 0.00 H new ATOM 0 HG12 ILE A 131 21.292 -8.319 3.722 1.00 0.00 H new ATOM 0 HG13 ILE A 131 19.588 -8.471 4.100 1.00 0.00 H new ATOM 0 HG21 ILE A 131 21.761 -5.413 4.052 1.00 0.00 H new ATOM 0 HG22 ILE A 131 21.919 -5.340 5.823 1.00 0.00 H new ATOM 0 HG23 ILE A 131 22.697 -6.657 4.914 1.00 0.00 H new ATOM 0 HD11 ILE A 131 19.911 -7.702 1.803 1.00 0.00 H new ATOM 0 HD12 ILE A 131 19.100 -6.449 2.772 1.00 0.00 H new ATOM 0 HD13 ILE A 131 20.831 -6.296 2.388 1.00 0.00 H new ATOM 1944 N GLN A 132 20.178 -6.052 8.118 1.00 0.00 N ATOM 1945 CA GLN A 132 20.473 -5.232 9.286 1.00 0.00 C ATOM 1946 C GLN A 132 20.960 -6.085 10.450 1.00 0.00 C ATOM 1947 O GLN A 132 21.920 -5.731 11.134 1.00 0.00 O ATOM 1948 CB GLN A 132 19.236 -4.433 9.706 1.00 0.00 C ATOM 1949 CG GLN A 132 18.864 -3.314 8.748 1.00 0.00 C ATOM 1950 CD GLN A 132 17.555 -2.644 9.122 1.00 0.00 C ATOM 1951 OE1 GLN A 132 16.741 -3.207 9.858 1.00 0.00 O ATOM 1952 NE2 GLN A 132 17.345 -1.434 8.615 1.00 0.00 N ATOM 0 H GLN A 132 19.218 -5.977 7.783 1.00 0.00 H new ATOM 0 HA GLN A 132 21.269 -4.539 9.013 1.00 0.00 H new ATOM 0 HB2 GLN A 132 18.390 -5.115 9.797 1.00 0.00 H new ATOM 0 HB3 GLN A 132 19.410 -4.007 10.694 1.00 0.00 H new ATOM 0 HG2 GLN A 132 19.660 -2.569 8.737 1.00 0.00 H new ATOM 0 HG3 GLN A 132 18.788 -3.715 7.737 1.00 0.00 H new ATOM 0 HE21 GLN A 132 18.046 -1.006 8.010 1.00 0.00 H new ATOM 0 HE22 GLN A 132 16.483 -0.933 8.830 1.00 0.00 H new ATOM 1961 N ASP A 133 20.291 -7.212 10.671 1.00 0.00 N ATOM 1962 CA ASP A 133 20.646 -8.112 11.762 1.00 0.00 C ATOM 1963 C ASP A 133 22.100 -8.555 11.660 1.00 0.00 C ATOM 1964 O ASP A 133 22.822 -8.582 12.657 1.00 0.00 O ATOM 1965 CB ASP A 133 19.731 -9.339 11.765 1.00 0.00 C ATOM 1966 CG ASP A 133 18.307 -9.016 12.195 1.00 0.00 C ATOM 1967 OD1 ASP A 133 18.095 -7.952 12.728 1.00 0.00 O ATOM 1968 OD2 ASP A 133 17.444 -9.835 11.988 1.00 0.00 O ATOM 0 H ASP A 133 19.499 -7.524 10.108 1.00 0.00 H new ATOM 0 HA ASP A 133 20.516 -7.566 12.696 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.713 -9.775 10.766 1.00 0.00 H new ATOM 0 HB3 ASP A 133 20.145 -10.093 12.435 1.00 0.00 H new ATOM 1973 N GLU A 134 22.523 -8.904 10.450 1.00 0.00 N ATOM 1974 CA GLU A 134 23.889 -9.359 10.218 1.00 0.00 C ATOM 1975 C GLU A 134 24.897 -8.262 10.534 1.00 0.00 C ATOM 1976 O GLU A 134 25.927 -8.514 11.159 1.00 0.00 O ATOM 1977 CB GLU A 134 24.059 -9.819 8.768 1.00 0.00 C ATOM 1978 CG GLU A 134 23.306 -11.096 8.421 1.00 0.00 C ATOM 1979 CD GLU A 134 23.466 -11.496 6.981 1.00 0.00 C ATOM 1980 OE1 GLU A 134 23.984 -10.713 6.221 1.00 0.00 O ATOM 1981 OE2 GLU A 134 23.069 -12.585 6.640 1.00 0.00 O ATOM 0 H GLU A 134 21.939 -8.880 9.614 1.00 0.00 H new ATOM 0 HA GLU A 134 24.077 -10.200 10.885 1.00 0.00 H new ATOM 0 HB2 GLU A 134 23.723 -9.022 8.105 1.00 0.00 H new ATOM 0 HB3 GLU A 134 25.120 -9.972 8.570 1.00 0.00 H new ATOM 0 HG2 GLU A 134 23.660 -11.906 9.059 1.00 0.00 H new ATOM 0 HG3 GLU A 134 22.247 -10.958 8.639 1.00 0.00 H new ATOM 1988 N VAL A 135 24.594 -7.044 10.100 1.00 0.00 N ATOM 1989 CA VAL A 135 25.483 -5.909 10.319 1.00 0.00 C ATOM 1990 C VAL A 135 25.600 -5.579 11.802 1.00 0.00 C ATOM 1991 O VAL A 135 26.695 -5.341 12.310 1.00 0.00 O ATOM 1992 CB VAL A 135 24.967 -4.672 9.560 1.00 0.00 C ATOM 1993 CG1 VAL A 135 25.770 -3.438 9.945 1.00 0.00 C ATOM 1994 CG2 VAL A 135 25.039 -4.917 8.061 1.00 0.00 C ATOM 0 H VAL A 135 23.738 -6.817 9.594 1.00 0.00 H new ATOM 0 HA VAL A 135 26.469 -6.183 9.944 1.00 0.00 H new ATOM 0 HB VAL A 135 23.927 -4.497 9.834 1.00 0.00 H new ATOM 0 HG11 VAL A 135 25.392 -2.573 9.400 1.00 0.00 H new ATOM 0 HG12 VAL A 135 25.674 -3.261 11.016 1.00 0.00 H new ATOM 0 HG13 VAL A 135 26.819 -3.594 9.695 1.00 0.00 H new ATOM 0 HG21 VAL A 135 24.673 -4.038 7.531 1.00 0.00 H new ATOM 0 HG22 VAL A 135 26.072 -5.110 7.773 1.00 0.00 H new ATOM 0 HG23 VAL A 135 24.424 -5.779 7.803 1.00 0.00 H new ATOM 2004 N LEU A 136 24.464 -5.568 12.491 1.00 0.00 N ATOM 2005 CA LEU A 136 24.434 -5.237 13.911 1.00 0.00 C ATOM 2006 C LEU A 136 25.121 -6.313 14.742 1.00 0.00 C ATOM 2007 O LEU A 136 25.742 -6.020 15.763 1.00 0.00 O ATOM 2008 CB LEU A 136 22.985 -5.065 14.384 1.00 0.00 C ATOM 2009 CG LEU A 136 22.284 -3.780 13.925 1.00 0.00 C ATOM 2010 CD1 LEU A 136 20.836 -3.794 14.397 1.00 0.00 C ATOM 2011 CD2 LEU A 136 23.027 -2.572 14.477 1.00 0.00 C ATOM 0 H LEU A 136 23.552 -5.784 12.089 1.00 0.00 H new ATOM 0 HA LEU A 136 24.974 -4.300 14.048 1.00 0.00 H new ATOM 0 HB2 LEU A 136 22.404 -5.919 14.034 1.00 0.00 H new ATOM 0 HB3 LEU A 136 22.972 -5.095 15.474 1.00 0.00 H new ATOM 0 HG LEU A 136 22.290 -3.721 12.837 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.338 -2.881 14.071 1.00 0.00 H new ATOM 0 HD12 LEU A 136 20.324 -4.658 13.974 1.00 0.00 H new ATOM 0 HD13 LEU A 136 20.809 -3.853 15.485 1.00 0.00 H new ATOM 0 HD21 LEU A 136 22.529 -1.659 14.151 1.00 0.00 H new ATOM 0 HD22 LEU A 136 23.031 -2.614 15.566 1.00 0.00 H new ATOM 0 HD23 LEU A 136 24.053 -2.577 14.110 1.00 0.00 H new ATOM 2023 N GLU A 137 25.005 -7.560 14.299 1.00 0.00 N ATOM 2024 CA GLU A 137 25.672 -8.675 14.962 1.00 0.00 C ATOM 2025 C GLU A 137 27.186 -8.534 14.886 1.00 0.00 C ATOM 2026 O GLU A 137 27.892 -8.775 15.866 1.00 0.00 O ATOM 2027 CB GLU A 137 25.241 -10.003 14.337 1.00 0.00 C ATOM 2028 CG GLU A 137 25.866 -11.233 14.980 1.00 0.00 C ATOM 2029 CD GLU A 137 25.431 -11.433 16.405 1.00 0.00 C ATOM 2030 OE1 GLU A 137 24.410 -10.904 16.774 1.00 0.00 O ATOM 2031 OE2 GLU A 137 26.121 -12.115 17.125 1.00 0.00 O ATOM 0 H GLU A 137 24.454 -7.825 13.482 1.00 0.00 H new ATOM 0 HA GLU A 137 25.378 -8.662 16.012 1.00 0.00 H new ATOM 0 HB2 GLU A 137 24.156 -10.086 14.402 1.00 0.00 H new ATOM 0 HB3 GLU A 137 25.497 -9.992 13.278 1.00 0.00 H new ATOM 0 HG2 GLU A 137 25.601 -12.115 14.397 1.00 0.00 H new ATOM 0 HG3 GLU A 137 26.952 -11.142 14.946 1.00 0.00 H new ATOM 2038 N ASN A 138 27.681 -8.143 13.717 1.00 0.00 N ATOM 2039 CA ASN A 138 29.110 -7.926 13.524 1.00 0.00 C ATOM 2040 C ASN A 138 29.578 -6.668 14.245 1.00 0.00 C ATOM 2041 O ASN A 138 30.656 -6.647 14.840 1.00 0.00 O ATOM 2042 CB ASN A 138 29.444 -7.849 12.045 1.00 0.00 C ATOM 2043 CG ASN A 138 29.301 -9.176 11.352 1.00 0.00 C ATOM 2044 OD1 ASN A 138 29.402 -10.234 11.983 1.00 0.00 O ATOM 2045 ND2 ASN A 138 29.069 -9.139 10.064 1.00 0.00 N ATOM 0 H ASN A 138 27.113 -7.970 12.888 1.00 0.00 H new ATOM 0 HA ASN A 138 29.639 -8.776 13.955 1.00 0.00 H new ATOM 0 HB2 ASN A 138 28.790 -7.120 11.566 1.00 0.00 H new ATOM 0 HB3 ASN A 138 30.466 -7.488 11.925 1.00 0.00 H new ATOM 0 HD21 ASN A 138 28.964 -10.008 9.540 1.00 0.00 H new ATOM 0 HD22 ASN A 138 28.993 -8.242 9.585 1.00 0.00 H new ATOM 2052 N LEU A 139 28.763 -5.621 14.187 1.00 0.00 N ATOM 2053 CA LEU A 139 29.064 -4.376 14.883 1.00 0.00 C ATOM 2054 C LEU A 139 29.162 -4.595 16.387 1.00 0.00 C ATOM 2055 O LEU A 139 30.103 -4.132 17.032 1.00 0.00 O ATOM 2056 CB LEU A 139 27.988 -3.326 14.582 1.00 0.00 C ATOM 2057 CG LEU A 139 28.141 -1.986 15.314 1.00 0.00 C ATOM 2058 CD1 LEU A 139 29.469 -1.348 14.931 1.00 0.00 C ATOM 2059 CD2 LEU A 139 26.975 -1.077 14.958 1.00 0.00 C ATOM 0 H LEU A 139 27.887 -5.610 13.664 1.00 0.00 H new ATOM 0 HA LEU A 139 30.029 -4.018 14.524 1.00 0.00 H new ATOM 0 HB2 LEU A 139 27.984 -3.134 13.509 1.00 0.00 H new ATOM 0 HB3 LEU A 139 27.015 -3.747 14.834 1.00 0.00 H new ATOM 0 HG LEU A 139 28.134 -2.147 16.392 1.00 0.00 H new ATOM 0 HD11 LEU A 139 29.579 -0.396 15.450 1.00 0.00 H new ATOM 0 HD12 LEU A 139 30.286 -2.012 15.213 1.00 0.00 H new ATOM 0 HD13 LEU A 139 29.494 -1.179 13.855 1.00 0.00 H new ATOM 0 HD21 LEU A 139 27.084 -0.125 15.478 1.00 0.00 H new ATOM 0 HD22 LEU A 139 26.964 -0.903 13.882 1.00 0.00 H new ATOM 0 HD23 LEU A 139 26.040 -1.550 15.259 1.00 0.00 H new ATOM 2071 N LYS A 140 28.184 -5.303 16.941 1.00 0.00 N ATOM 2072 CA LYS A 140 28.226 -5.701 18.343 1.00 0.00 C ATOM 2073 C LYS A 140 29.574 -6.311 18.703 1.00 0.00 C ATOM 2074 O LYS A 140 30.242 -5.860 19.633 1.00 0.00 O ATOM 2075 CB LYS A 140 27.101 -6.691 18.653 1.00 0.00 C ATOM 2076 CG LYS A 140 27.119 -7.238 20.074 1.00 0.00 C ATOM 2077 CD LYS A 140 25.935 -8.159 20.326 1.00 0.00 C ATOM 2078 CE LYS A 140 25.971 -9.372 19.408 1.00 0.00 C ATOM 2079 NZ LYS A 140 24.912 -10.360 19.748 1.00 0.00 N ATOM 0 H LYS A 140 27.352 -5.613 16.440 1.00 0.00 H new ATOM 0 HA LYS A 140 28.086 -4.805 18.948 1.00 0.00 H new ATOM 0 HB2 LYS A 140 26.143 -6.201 18.477 1.00 0.00 H new ATOM 0 HB3 LYS A 140 27.165 -7.525 17.955 1.00 0.00 H new ATOM 0 HG2 LYS A 140 28.048 -7.781 20.245 1.00 0.00 H new ATOM 0 HG3 LYS A 140 27.098 -6.412 20.784 1.00 0.00 H new ATOM 0 HD2 LYS A 140 25.942 -8.487 21.365 1.00 0.00 H new ATOM 0 HD3 LYS A 140 25.006 -7.611 20.171 1.00 0.00 H new ATOM 0 HE2 LYS A 140 25.847 -9.048 18.375 1.00 0.00 H new ATOM 0 HE3 LYS A 140 26.948 -9.850 19.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 24.504 -10.746 18.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 25.325 -11.133 20.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 24.166 -9.892 20.301 1.00 0.00 H new ATOM 2093 N LYS A 141 29.970 -7.340 17.961 1.00 0.00 N ATOM 2094 CA LYS A 141 31.239 -8.016 18.202 1.00 0.00 C ATOM 2095 C LYS A 141 32.416 -7.077 17.972 1.00 0.00 C ATOM 2096 O LYS A 141 33.429 -7.155 18.667 1.00 0.00 O ATOM 2097 CB LYS A 141 31.367 -9.250 17.307 1.00 0.00 C ATOM 2098 CG LYS A 141 30.420 -10.388 17.664 1.00 0.00 C ATOM 2099 CD LYS A 141 30.584 -11.563 16.712 1.00 0.00 C ATOM 2100 CE LYS A 141 29.633 -12.698 17.063 1.00 0.00 C ATOM 2101 NZ LYS A 141 29.757 -13.840 16.117 1.00 0.00 N ATOM 0 H LYS A 141 29.429 -7.724 17.186 1.00 0.00 H new ATOM 0 HA LYS A 141 31.255 -8.332 19.245 1.00 0.00 H new ATOM 0 HB2 LYS A 141 31.187 -8.954 16.273 1.00 0.00 H new ATOM 0 HB3 LYS A 141 32.392 -9.617 17.359 1.00 0.00 H new ATOM 0 HG2 LYS A 141 30.611 -10.716 18.686 1.00 0.00 H new ATOM 0 HG3 LYS A 141 29.391 -10.031 17.631 1.00 0.00 H new ATOM 0 HD2 LYS A 141 30.398 -11.234 15.690 1.00 0.00 H new ATOM 0 HD3 LYS A 141 31.612 -11.923 16.749 1.00 0.00 H new ATOM 0 HE2 LYS A 141 29.838 -13.043 18.077 1.00 0.00 H new ATOM 0 HE3 LYS A 141 28.608 -12.328 17.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 29.093 -14.592 16.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 29.537 -13.518 15.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 30.729 -14.210 16.145 1.00 0.00 H new ATOM 2115 N HIS A 142 32.276 -6.190 16.992 1.00 0.00 N ATOM 2116 CA HIS A 142 33.346 -5.266 16.637 1.00 0.00 C ATOM 2117 C HIS A 142 33.698 -4.355 17.806 1.00 0.00 C ATOM 2118 O HIS A 142 34.866 -4.217 18.169 1.00 0.00 O ATOM 2119 CB HIS A 142 32.949 -4.419 15.423 1.00 0.00 C ATOM 2120 CG HIS A 142 33.983 -3.410 15.030 1.00 0.00 C ATOM 2121 ND1 HIS A 142 35.166 -3.758 14.414 1.00 0.00 N ATOM 2122 CD2 HIS A 142 34.011 -2.063 15.167 1.00 0.00 C ATOM 2123 CE1 HIS A 142 35.878 -2.668 14.187 1.00 0.00 C ATOM 2124 NE2 HIS A 142 35.199 -1.627 14.635 1.00 0.00 N ATOM 0 H HIS A 142 31.431 -6.092 16.429 1.00 0.00 H new ATOM 0 HA HIS A 142 34.224 -5.861 16.385 1.00 0.00 H new ATOM 0 HB2 HIS A 142 32.758 -5.079 14.577 1.00 0.00 H new ATOM 0 HB3 HIS A 142 32.014 -3.902 15.641 1.00 0.00 H new ATOM 0 HD1 HIS A 142 35.448 -4.708 14.171 1.00 0.00 H new ATOM 0 HD2 HIS A 142 33.243 -1.447 15.611 1.00 0.00 H new ATOM 0 HE1 HIS A 142 36.849 -2.634 13.716 1.00 0.00 H new ATOM 2132 N VAL A 143 32.680 -3.734 18.392 1.00 0.00 N ATOM 2133 CA VAL A 143 32.889 -2.740 19.439 1.00 0.00 C ATOM 2134 C VAL A 143 33.185 -3.405 20.777 1.00 0.00 C ATOM 2135 O VAL A 143 33.832 -2.816 21.644 1.00 0.00 O ATOM 2136 CB VAL A 143 31.646 -1.842 19.579 1.00 0.00 C ATOM 2137 CG1 VAL A 143 31.357 -1.124 18.269 1.00 0.00 C ATOM 2138 CG2 VAL A 143 30.450 -2.677 20.012 1.00 0.00 C ATOM 0 H VAL A 143 31.701 -3.901 18.160 1.00 0.00 H new ATOM 0 HA VAL A 143 33.748 -2.133 19.153 1.00 0.00 H new ATOM 0 HB VAL A 143 31.839 -1.088 20.342 1.00 0.00 H new ATOM 0 HG11 VAL A 143 30.475 -0.494 18.386 1.00 0.00 H new ATOM 0 HG12 VAL A 143 32.212 -0.505 17.997 1.00 0.00 H new ATOM 0 HG13 VAL A 143 31.176 -1.858 17.484 1.00 0.00 H new ATOM 0 HG21 VAL A 143 29.574 -2.035 20.109 1.00 0.00 H new ATOM 0 HG22 VAL A 143 30.255 -3.447 19.266 1.00 0.00 H new ATOM 0 HG23 VAL A 143 30.663 -3.148 20.972 1.00 0.00 H new ATOM 2148 N GLU A 144 32.709 -4.634 20.940 1.00 0.00 N ATOM 2149 CA GLU A 144 32.964 -5.400 22.154 1.00 0.00 C ATOM 2150 C GLU A 144 34.398 -5.912 22.192 1.00 0.00 C ATOM 2151 O GLU A 144 35.043 -5.904 23.240 1.00 0.00 O ATOM 2152 CB GLU A 144 31.989 -6.575 22.258 1.00 0.00 C ATOM 2153 CG GLU A 144 30.568 -6.182 22.635 1.00 0.00 C ATOM 2154 CD GLU A 144 29.622 -7.350 22.651 1.00 0.00 C ATOM 2155 OE1 GLU A 144 30.004 -8.406 22.206 1.00 0.00 O ATOM 2156 OE2 GLU A 144 28.516 -7.187 23.110 1.00 0.00 O ATOM 0 H GLU A 144 32.143 -5.122 20.245 1.00 0.00 H new ATOM 0 HA GLU A 144 32.815 -4.735 23.005 1.00 0.00 H new ATOM 0 HB2 GLU A 144 31.967 -7.098 21.302 1.00 0.00 H new ATOM 0 HB3 GLU A 144 32.367 -7.280 22.999 1.00 0.00 H new ATOM 0 HG2 GLU A 144 30.575 -5.713 23.619 1.00 0.00 H new ATOM 0 HG3 GLU A 144 30.204 -5.436 21.929 1.00 0.00 H new ATOM 2163 N GLY A 145 34.891 -6.358 21.042 1.00 0.00 N ATOM 2164 CA GLY A 145 36.255 -6.865 20.938 1.00 0.00 C ATOM 2165 C GLY A 145 36.862 -6.537 19.580 1.00 0.00 C ATOM 2166 O GLY A 145 37.305 -5.441 19.370 1.00 0.00 O ATOM 2167 OXT GLY A 145 36.898 -7.373 18.721 1.00 0.00 O ATOM 0 H GLY A 145 34.366 -6.379 20.168 1.00 0.00 H new ATOM 0 HA2 GLY A 145 36.868 -6.431 21.728 1.00 0.00 H new ATOM 0 HA3 GLY A 145 36.257 -7.944 21.089 1.00 0.00 H new