USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 968 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: C 45 HIS : no HD1:sc= -0.164 K(o=-3,f=-4) USER MOD Set 1.2: C 48 GLN : amide:sc= -2.81! C(o=-3!,f=-3.9!) USER MOD Single : A 31 SER OG : rot -160:sc= -1.25 USER MOD Single : A 37 HIS : no HD1:sc= -6.56! C(o=-6.6!,f=-8.5!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc= -2.39 X(o=-2.4,f=-2) USER MOD Single : A 47 ASN : amide:sc= -0.624 K(o=-0.62,f=-2.3) USER MOD Single : A 48 GLN : amide:sc= -3.2! C(o=-3.2!,f=-5.7!) USER MOD Single : A 50 LYS NZ :NH3+ 152:sc= -0.22 (180deg=-1.15) USER MOD Single : B 23 SER OG : rot -39:sc= 0.255 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 37 HIS : no HD1:sc= -5.98! C(o=-6!,f=-10!) USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 HIS : no HE2:sc= -3.03! C(o=-3!,f=-6.5!) USER MOD Single : B 47 ASN : amide:sc= 0.103 X(o=0.1,f=-0.18) USER MOD Single : B 48 GLN : amide:sc= -6.32! C(o=-6.3!,f=-7.8!) USER MOD Single : B 50 LYS NZ :NH3+ -179:sc= -2.63 (180deg=-2.65) USER MOD Single : C 23 SER OG : rot -55:sc= 0.286 USER MOD Single : C 31 SER OG : rot 150:sc= 0 USER MOD Single : C 37 HIS : no HD1:sc= -8.79! C(o=-8.8!,f=-12!) USER MOD Single : C 42 THR OG1 : rot 180:sc= 0 USER MOD Single : C 47 ASN : amide:sc= -0.861 K(o=-0.86,f=-2.6!) USER MOD Single : C 50 LYS NZ :NH3+ 145:sc= -1.8 (180deg=-4.27!) USER MOD Single : D 23 SER OG : rot 43:sc= -0.034 USER MOD Single : D 31 SER OG : rot -148:sc= -1.58 USER MOD Single : D 37 HIS : no HD1:sc= -8.8! C(o=-8.8!,f=-12!) USER MOD Single : D 42 THR OG1 : rot -69:sc= 1.07 USER MOD Single : D 45 HIS : no HD1:sc= -1.71 X(o=-1.7,f=-1.4) USER MOD Single : D 47 ASN : amide:sc= -0.758 X(o=-0.76,f=-0.36) USER MOD Single : D 48 GLN :FLIP amide:sc= -6.81! C(o=-8.7!,f=-6.8!) USER MOD Single : D 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 11 N ASP A 24 77.984 4.671 4.589 1.00 0.00 N ATOM 12 CA ASP A 24 78.926 5.332 3.691 1.00 0.00 C ATOM 13 C ASP A 24 79.573 4.305 2.765 1.00 0.00 C ATOM 14 O ASP A 24 80.798 4.186 2.714 1.00 0.00 O ATOM 15 CB ASP A 24 80.006 6.077 4.495 1.00 0.00 C ATOM 16 CG ASP A 24 79.404 6.644 5.777 1.00 0.00 C ATOM 17 OD1 ASP A 24 78.587 7.546 5.675 1.00 0.00 O ATOM 18 OD2 ASP A 24 79.766 6.167 6.840 1.00 0.00 O ATOM 0 HA ASP A 24 78.381 6.059 3.089 1.00 0.00 H new ATOM 0 HB2 ASP A 24 80.824 5.398 4.737 1.00 0.00 H new ATOM 0 HB3 ASP A 24 80.427 6.883 3.894 1.00 0.00 H new ATOM 23 N PRO A 25 78.772 3.564 2.041 1.00 0.00 N ATOM 24 CA PRO A 25 79.273 2.522 1.101 1.00 0.00 C ATOM 25 C PRO A 25 79.982 3.136 -0.106 1.00 0.00 C ATOM 26 O PRO A 25 80.259 2.453 -1.087 1.00 0.00 O ATOM 27 CB PRO A 25 78.000 1.764 0.686 1.00 0.00 C ATOM 28 CG PRO A 25 76.886 2.747 0.869 1.00 0.00 C ATOM 29 CD PRO A 25 77.299 3.644 2.040 1.00 0.00 C ATOM 0 HA PRO A 25 80.020 1.873 1.558 1.00 0.00 H new ATOM 0 HB2 PRO A 25 78.062 1.426 -0.348 1.00 0.00 H new ATOM 0 HB3 PRO A 25 77.850 0.878 1.303 1.00 0.00 H new ATOM 0 HG2 PRO A 25 76.732 3.334 -0.036 1.00 0.00 H new ATOM 0 HG3 PRO A 25 75.947 2.236 1.082 1.00 0.00 H new ATOM 0 HD2 PRO A 25 76.954 4.668 1.900 1.00 0.00 H new ATOM 0 HD3 PRO A 25 76.878 3.292 2.982 1.00 0.00 H new ATOM 37 N LEU A 26 80.263 4.405 -0.030 1.00 0.00 N ATOM 38 CA LEU A 26 80.935 5.093 -1.131 1.00 0.00 C ATOM 39 C LEU A 26 82.282 4.435 -1.449 1.00 0.00 C ATOM 40 O LEU A 26 82.726 4.437 -2.597 1.00 0.00 O ATOM 41 CB LEU A 26 81.147 6.569 -0.768 1.00 0.00 C ATOM 42 CG LEU A 26 79.819 7.204 -0.316 1.00 0.00 C ATOM 43 CD1 LEU A 26 80.056 8.622 0.264 1.00 0.00 C ATOM 44 CD2 LEU A 26 78.841 7.262 -1.504 1.00 0.00 C ATOM 0 H LEU A 26 80.045 4.995 0.773 1.00 0.00 H new ATOM 0 HA LEU A 26 80.304 5.023 -2.017 1.00 0.00 H new ATOM 0 HB2 LEU A 26 81.887 6.652 0.028 1.00 0.00 H new ATOM 0 HB3 LEU A 26 81.542 7.109 -1.628 1.00 0.00 H new ATOM 0 HG LEU A 26 79.385 6.588 0.472 1.00 0.00 H new ATOM 0 HD11 LEU A 26 79.104 9.051 0.577 1.00 0.00 H new ATOM 0 HD12 LEU A 26 80.724 8.557 1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 26 80.507 9.257 -0.499 1.00 0.00 H new ATOM 0 HD21 LEU A 26 77.902 7.712 -1.181 1.00 0.00 H new ATOM 0 HD22 LEU A 26 79.275 7.863 -2.303 1.00 0.00 H new ATOM 0 HD23 LEU A 26 78.653 6.253 -1.870 1.00 0.00 H new ATOM 56 N VAL A 27 82.917 3.888 -0.447 1.00 0.00 N ATOM 57 CA VAL A 27 84.216 3.235 -0.633 1.00 0.00 C ATOM 58 C VAL A 27 84.101 2.004 -1.524 1.00 0.00 C ATOM 59 O VAL A 27 84.993 1.724 -2.324 1.00 0.00 O ATOM 60 CB VAL A 27 84.792 2.808 0.726 1.00 0.00 C ATOM 61 CG1 VAL A 27 86.213 2.262 0.540 1.00 0.00 C ATOM 62 CG2 VAL A 27 84.835 4.006 1.677 1.00 0.00 C ATOM 0 H VAL A 27 82.569 3.874 0.512 1.00 0.00 H new ATOM 0 HA VAL A 27 84.877 3.956 -1.114 1.00 0.00 H new ATOM 0 HB VAL A 27 84.154 2.032 1.149 1.00 0.00 H new ATOM 0 HG11 VAL A 27 86.616 1.961 1.507 1.00 0.00 H new ATOM 0 HG12 VAL A 27 86.187 1.400 -0.127 1.00 0.00 H new ATOM 0 HG13 VAL A 27 86.847 3.036 0.108 1.00 0.00 H new ATOM 0 HG21 VAL A 27 85.245 3.694 2.638 1.00 0.00 H new ATOM 0 HG22 VAL A 27 85.465 4.787 1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 27 83.826 4.392 1.821 1.00 0.00 H new ATOM 72 N VAL A 28 83.029 1.278 -1.381 1.00 0.00 N ATOM 73 CA VAL A 28 82.831 0.071 -2.177 1.00 0.00 C ATOM 74 C VAL A 28 82.491 0.386 -3.639 1.00 0.00 C ATOM 75 O VAL A 28 82.824 -0.395 -4.528 1.00 0.00 O ATOM 76 CB VAL A 28 81.747 -0.829 -1.528 1.00 0.00 C ATOM 77 CG1 VAL A 28 80.354 -0.551 -2.124 1.00 0.00 C ATOM 78 CG2 VAL A 28 82.099 -2.310 -1.744 1.00 0.00 C ATOM 0 H VAL A 28 82.274 1.488 -0.728 1.00 0.00 H new ATOM 0 HA VAL A 28 83.775 -0.473 -2.190 1.00 0.00 H new ATOM 0 HB VAL A 28 81.721 -0.601 -0.462 1.00 0.00 H new ATOM 0 HG11 VAL A 28 79.618 -1.199 -1.647 1.00 0.00 H new ATOM 0 HG12 VAL A 28 80.086 0.491 -1.952 1.00 0.00 H new ATOM 0 HG13 VAL A 28 80.371 -0.749 -3.196 1.00 0.00 H new ATOM 0 HG21 VAL A 28 81.334 -2.936 -1.286 1.00 0.00 H new ATOM 0 HG22 VAL A 28 82.148 -2.520 -2.812 1.00 0.00 H new ATOM 0 HG23 VAL A 28 83.065 -2.525 -1.287 1.00 0.00 H new ATOM 88 N ALA A 29 81.800 1.475 -3.888 1.00 0.00 N ATOM 89 CA ALA A 29 81.397 1.795 -5.257 1.00 0.00 C ATOM 90 C ALA A 29 82.582 2.029 -6.189 1.00 0.00 C ATOM 91 O ALA A 29 82.656 1.402 -7.245 1.00 0.00 O ATOM 92 CB ALA A 29 80.505 3.038 -5.253 1.00 0.00 C ATOM 0 H ALA A 29 81.505 2.149 -3.182 1.00 0.00 H new ATOM 0 HA ALA A 29 80.854 0.930 -5.637 1.00 0.00 H new ATOM 0 HB1 ALA A 29 80.206 3.275 -6.274 1.00 0.00 H new ATOM 0 HB2 ALA A 29 79.617 2.847 -4.650 1.00 0.00 H new ATOM 0 HB3 ALA A 29 81.055 3.879 -4.832 1.00 0.00 H new ATOM 98 N ALA A 30 83.494 2.904 -5.842 1.00 0.00 N ATOM 99 CA ALA A 30 84.618 3.139 -6.722 1.00 0.00 C ATOM 100 C ALA A 30 85.369 1.837 -6.935 1.00 0.00 C ATOM 101 O ALA A 30 85.649 1.435 -8.064 1.00 0.00 O ATOM 102 CB ALA A 30 85.536 4.156 -6.090 1.00 0.00 C ATOM 0 H ALA A 30 83.486 3.453 -4.982 1.00 0.00 H new ATOM 0 HA ALA A 30 84.265 3.514 -7.683 1.00 0.00 H new ATOM 0 HB1 ALA A 30 86.386 4.338 -6.748 1.00 0.00 H new ATOM 0 HB2 ALA A 30 84.993 5.088 -5.932 1.00 0.00 H new ATOM 0 HB3 ALA A 30 85.893 3.778 -5.132 1.00 0.00 H new ATOM 108 N SER A 31 85.667 1.193 -5.846 1.00 0.00 N ATOM 109 CA SER A 31 86.369 -0.079 -5.894 1.00 0.00 C ATOM 110 C SER A 31 85.692 -1.015 -6.899 1.00 0.00 C ATOM 111 O SER A 31 86.354 -1.608 -7.751 1.00 0.00 O ATOM 112 CB SER A 31 86.358 -0.717 -4.511 1.00 0.00 C ATOM 113 OG SER A 31 87.017 -1.975 -4.569 1.00 0.00 O ATOM 0 H SER A 31 85.440 1.519 -4.906 1.00 0.00 H new ATOM 0 HA SER A 31 87.399 0.092 -6.208 1.00 0.00 H new ATOM 0 HB2 SER A 31 86.856 -0.065 -3.793 1.00 0.00 H new ATOM 0 HB3 SER A 31 85.332 -0.846 -4.166 1.00 0.00 H new ATOM 0 HG SER A 31 86.748 -2.521 -3.801 1.00 0.00 H new ATOM 119 N ILE A 32 84.396 -1.147 -6.785 1.00 0.00 N ATOM 120 CA ILE A 32 83.639 -2.022 -7.681 1.00 0.00 C ATOM 121 C ILE A 32 83.955 -1.715 -9.151 1.00 0.00 C ATOM 122 O ILE A 32 84.265 -2.626 -9.918 1.00 0.00 O ATOM 123 CB ILE A 32 82.128 -1.872 -7.393 1.00 0.00 C ATOM 124 CG1 ILE A 32 81.756 -2.726 -6.172 1.00 0.00 C ATOM 125 CG2 ILE A 32 81.288 -2.332 -8.593 1.00 0.00 C ATOM 126 CD1 ILE A 32 80.347 -2.366 -5.695 1.00 0.00 C ATOM 0 H ILE A 32 83.831 -0.666 -6.085 1.00 0.00 H new ATOM 0 HA ILE A 32 83.933 -3.055 -7.497 1.00 0.00 H new ATOM 0 HB ILE A 32 81.920 -0.819 -7.202 1.00 0.00 H new ATOM 0 HG12 ILE A 32 81.803 -3.784 -6.429 1.00 0.00 H new ATOM 0 HG13 ILE A 32 82.475 -2.561 -5.369 1.00 0.00 H new ATOM 0 HG21 ILE A 32 80.229 -2.215 -8.362 1.00 0.00 H new ATOM 0 HG22 ILE A 32 81.538 -1.728 -9.465 1.00 0.00 H new ATOM 0 HG23 ILE A 32 81.500 -3.380 -8.805 1.00 0.00 H new ATOM 0 HD11 ILE A 32 80.089 -2.975 -4.829 1.00 0.00 H new ATOM 0 HD12 ILE A 32 80.314 -1.312 -5.420 1.00 0.00 H new ATOM 0 HD13 ILE A 32 79.632 -2.554 -6.496 1.00 0.00 H new ATOM 138 N ILE A 33 83.884 -0.469 -9.541 1.00 0.00 N ATOM 139 CA ILE A 33 84.178 -0.120 -10.930 1.00 0.00 C ATOM 140 C ILE A 33 85.599 -0.563 -11.275 1.00 0.00 C ATOM 141 O ILE A 33 85.843 -1.172 -12.315 1.00 0.00 O ATOM 142 CB ILE A 33 84.040 1.393 -11.152 1.00 0.00 C ATOM 143 CG1 ILE A 33 82.582 1.820 -10.931 1.00 0.00 C ATOM 144 CG2 ILE A 33 84.450 1.733 -12.589 1.00 0.00 C ATOM 145 CD1 ILE A 33 82.476 3.353 -10.933 1.00 0.00 C ATOM 0 H ILE A 33 83.632 0.316 -8.940 1.00 0.00 H new ATOM 0 HA ILE A 33 83.464 -0.630 -11.577 1.00 0.00 H new ATOM 0 HB ILE A 33 84.683 1.920 -10.447 1.00 0.00 H new ATOM 0 HG12 ILE A 33 81.950 1.403 -11.715 1.00 0.00 H new ATOM 0 HG13 ILE A 33 82.218 1.424 -9.983 1.00 0.00 H new ATOM 0 HG21 ILE A 33 84.353 2.807 -12.751 1.00 0.00 H new ATOM 0 HG22 ILE A 33 85.485 1.433 -12.753 1.00 0.00 H new ATOM 0 HG23 ILE A 33 83.804 1.201 -13.287 1.00 0.00 H new ATOM 0 HD11 ILE A 33 81.438 3.646 -10.776 1.00 0.00 H new ATOM 0 HD12 ILE A 33 83.094 3.761 -10.133 1.00 0.00 H new ATOM 0 HD13 ILE A 33 82.821 3.740 -11.892 1.00 0.00 H new ATOM 157 N GLY A 34 86.516 -0.223 -10.416 1.00 0.00 N ATOM 158 CA GLY A 34 87.920 -0.551 -10.634 1.00 0.00 C ATOM 159 C GLY A 34 88.106 -2.015 -11.039 1.00 0.00 C ATOM 160 O GLY A 34 88.833 -2.310 -11.986 1.00 0.00 O ATOM 0 H GLY A 34 86.329 0.284 -9.551 1.00 0.00 H new ATOM 0 HA2 GLY A 34 88.328 0.096 -11.411 1.00 0.00 H new ATOM 0 HA3 GLY A 34 88.485 -0.351 -9.724 1.00 0.00 H new ATOM 164 N ILE A 35 87.467 -2.914 -10.342 1.00 0.00 N ATOM 165 CA ILE A 35 87.591 -4.336 -10.664 1.00 0.00 C ATOM 166 C ILE A 35 86.881 -4.665 -11.977 1.00 0.00 C ATOM 167 O ILE A 35 87.278 -5.581 -12.697 1.00 0.00 O ATOM 168 CB ILE A 35 86.992 -5.187 -9.542 1.00 0.00 C ATOM 169 CG1 ILE A 35 87.584 -4.750 -8.200 1.00 0.00 C ATOM 170 CG2 ILE A 35 87.326 -6.662 -9.786 1.00 0.00 C ATOM 171 CD1 ILE A 35 86.918 -5.534 -7.069 1.00 0.00 C ATOM 0 H ILE A 35 86.857 -2.705 -9.552 1.00 0.00 H new ATOM 0 HA ILE A 35 88.652 -4.562 -10.770 1.00 0.00 H new ATOM 0 HB ILE A 35 85.910 -5.055 -9.525 1.00 0.00 H new ATOM 0 HG12 ILE A 35 88.660 -4.923 -8.192 1.00 0.00 H new ATOM 0 HG13 ILE A 35 87.432 -3.681 -8.054 1.00 0.00 H new ATOM 0 HG21 ILE A 35 86.900 -7.269 -8.987 1.00 0.00 H new ATOM 0 HG22 ILE A 35 86.908 -6.976 -10.743 1.00 0.00 H new ATOM 0 HG23 ILE A 35 88.408 -6.792 -9.802 1.00 0.00 H new ATOM 0 HD11 ILE A 35 87.340 -5.223 -6.113 1.00 0.00 H new ATOM 0 HD12 ILE A 35 85.846 -5.339 -7.073 1.00 0.00 H new ATOM 0 HD13 ILE A 35 87.093 -6.600 -7.213 1.00 0.00 H new ATOM 183 N LEU A 36 85.841 -3.934 -12.263 1.00 0.00 N ATOM 184 CA LEU A 36 85.061 -4.156 -13.477 1.00 0.00 C ATOM 185 C LEU A 36 85.908 -3.955 -14.734 1.00 0.00 C ATOM 186 O LEU A 36 85.676 -4.599 -15.758 1.00 0.00 O ATOM 187 CB LEU A 36 83.881 -3.175 -13.501 1.00 0.00 C ATOM 188 CG LEU A 36 82.872 -3.566 -14.594 1.00 0.00 C ATOM 189 CD1 LEU A 36 82.040 -4.785 -14.156 1.00 0.00 C ATOM 190 CD2 LEU A 36 81.934 -2.380 -14.854 1.00 0.00 C ATOM 0 H LEU A 36 85.501 -3.172 -11.677 1.00 0.00 H new ATOM 0 HA LEU A 36 84.705 -5.186 -13.470 1.00 0.00 H new ATOM 0 HB2 LEU A 36 83.388 -3.168 -12.529 1.00 0.00 H new ATOM 0 HB3 LEU A 36 84.246 -2.164 -13.681 1.00 0.00 H new ATOM 0 HG LEU A 36 83.417 -3.825 -15.502 1.00 0.00 H new ATOM 0 HD11 LEU A 36 81.333 -5.045 -14.944 1.00 0.00 H new ATOM 0 HD12 LEU A 36 82.703 -5.630 -13.970 1.00 0.00 H new ATOM 0 HD13 LEU A 36 81.495 -4.544 -13.243 1.00 0.00 H new ATOM 0 HD21 LEU A 36 81.215 -2.648 -15.628 1.00 0.00 H new ATOM 0 HD22 LEU A 36 81.403 -2.128 -13.936 1.00 0.00 H new ATOM 0 HD23 LEU A 36 82.517 -1.520 -15.183 1.00 0.00 H new ATOM 202 N HIS A 37 86.861 -3.068 -14.655 1.00 0.00 N ATOM 203 CA HIS A 37 87.725 -2.782 -15.798 1.00 0.00 C ATOM 204 C HIS A 37 88.714 -3.921 -16.081 1.00 0.00 C ATOM 205 O HIS A 37 89.139 -4.111 -17.220 1.00 0.00 O ATOM 206 CB HIS A 37 88.463 -1.440 -15.569 1.00 0.00 C ATOM 207 CG HIS A 37 89.790 -1.634 -14.866 1.00 0.00 C ATOM 208 ND1 HIS A 37 90.768 -2.498 -15.337 1.00 0.00 N ATOM 209 CD2 HIS A 37 90.318 -1.062 -13.734 1.00 0.00 C ATOM 210 CE1 HIS A 37 91.817 -2.422 -14.501 1.00 0.00 C ATOM 211 NE2 HIS A 37 91.596 -1.561 -13.506 1.00 0.00 N ATOM 0 H HIS A 37 87.070 -2.524 -13.818 1.00 0.00 H new ATOM 0 HA HIS A 37 87.096 -2.697 -16.684 1.00 0.00 H new ATOM 0 HB2 HIS A 37 88.629 -0.950 -16.528 1.00 0.00 H new ATOM 0 HB3 HIS A 37 87.833 -0.776 -14.977 1.00 0.00 H new ATOM 0 HD2 HIS A 37 89.816 -0.334 -13.114 1.00 0.00 H new ATOM 0 HE1 HIS A 37 92.728 -2.989 -14.620 1.00 0.00 H new ATOM 0 HE2 HIS A 37 92.228 -1.321 -12.743 1.00 0.00 H new ATOM 220 N PHE A 38 89.104 -4.631 -15.055 1.00 0.00 N ATOM 221 CA PHE A 38 90.083 -5.710 -15.209 1.00 0.00 C ATOM 222 C PHE A 38 89.722 -6.668 -16.345 1.00 0.00 C ATOM 223 O PHE A 38 90.563 -6.971 -17.192 1.00 0.00 O ATOM 224 CB PHE A 38 90.212 -6.497 -13.902 1.00 0.00 C ATOM 225 CG PHE A 38 91.302 -7.532 -14.051 1.00 0.00 C ATOM 226 CD1 PHE A 38 92.647 -7.161 -13.912 1.00 0.00 C ATOM 227 CD2 PHE A 38 90.970 -8.863 -14.335 1.00 0.00 C ATOM 228 CE1 PHE A 38 93.656 -8.122 -14.057 1.00 0.00 C ATOM 229 CE2 PHE A 38 91.980 -9.821 -14.480 1.00 0.00 C ATOM 230 CZ PHE A 38 93.322 -9.450 -14.342 1.00 0.00 C ATOM 0 H PHE A 38 88.769 -4.493 -14.102 1.00 0.00 H new ATOM 0 HA PHE A 38 91.035 -5.241 -15.460 1.00 0.00 H new ATOM 0 HB2 PHE A 38 90.445 -5.822 -13.079 1.00 0.00 H new ATOM 0 HB3 PHE A 38 89.266 -6.980 -13.660 1.00 0.00 H new ATOM 0 HD1 PHE A 38 92.905 -6.135 -13.693 1.00 0.00 H new ATOM 0 HD2 PHE A 38 89.934 -9.150 -14.442 1.00 0.00 H new ATOM 0 HE1 PHE A 38 94.692 -7.837 -13.949 1.00 0.00 H new ATOM 0 HE2 PHE A 38 91.723 -10.847 -14.699 1.00 0.00 H new ATOM 0 HZ PHE A 38 94.101 -10.190 -14.456 1.00 0.00 H new ATOM 240 N ILE A 39 88.510 -7.148 -16.359 1.00 0.00 N ATOM 241 CA ILE A 39 88.090 -8.083 -17.401 1.00 0.00 C ATOM 242 C ILE A 39 88.212 -7.450 -18.785 1.00 0.00 C ATOM 243 O ILE A 39 88.524 -8.127 -19.761 1.00 0.00 O ATOM 244 CB ILE A 39 86.639 -8.538 -17.173 1.00 0.00 C ATOM 245 CG1 ILE A 39 86.468 -9.101 -15.731 1.00 0.00 C ATOM 246 CG2 ILE A 39 86.297 -9.624 -18.202 1.00 0.00 C ATOM 247 CD1 ILE A 39 85.871 -8.033 -14.801 1.00 0.00 C ATOM 0 H ILE A 39 87.791 -6.919 -15.673 1.00 0.00 H new ATOM 0 HA ILE A 39 88.749 -8.950 -17.349 1.00 0.00 H new ATOM 0 HB ILE A 39 85.967 -7.688 -17.291 1.00 0.00 H new ATOM 0 HG12 ILE A 39 85.820 -9.977 -15.751 1.00 0.00 H new ATOM 0 HG13 ILE A 39 87.434 -9.428 -15.346 1.00 0.00 H new ATOM 0 HG21 ILE A 39 85.270 -9.957 -18.052 1.00 0.00 H new ATOM 0 HG22 ILE A 39 86.404 -9.219 -19.208 1.00 0.00 H new ATOM 0 HG23 ILE A 39 86.974 -10.469 -18.078 1.00 0.00 H new ATOM 0 HD11 ILE A 39 85.759 -8.445 -13.798 1.00 0.00 H new ATOM 0 HD12 ILE A 39 86.534 -7.169 -14.766 1.00 0.00 H new ATOM 0 HD13 ILE A 39 84.895 -7.726 -15.178 1.00 0.00 H new ATOM 259 N ALA A 40 87.974 -6.173 -18.857 1.00 0.00 N ATOM 260 CA ALA A 40 88.071 -5.463 -20.124 1.00 0.00 C ATOM 261 C ALA A 40 89.528 -5.299 -20.545 1.00 0.00 C ATOM 262 O ALA A 40 89.836 -5.199 -21.728 1.00 0.00 O ATOM 263 CB ALA A 40 87.402 -4.092 -20.007 1.00 0.00 C ATOM 0 H ALA A 40 87.711 -5.592 -18.061 1.00 0.00 H new ATOM 0 HA ALA A 40 87.558 -6.049 -20.887 1.00 0.00 H new ATOM 0 HB1 ALA A 40 87.479 -3.567 -20.959 1.00 0.00 H new ATOM 0 HB2 ALA A 40 86.351 -4.221 -19.748 1.00 0.00 H new ATOM 0 HB3 ALA A 40 87.899 -3.510 -19.231 1.00 0.00 H new ATOM 269 N TRP A 41 90.401 -5.223 -19.585 1.00 0.00 N ATOM 270 CA TRP A 41 91.817 -5.015 -19.860 1.00 0.00 C ATOM 271 C TRP A 41 92.445 -6.178 -20.631 1.00 0.00 C ATOM 272 O TRP A 41 93.131 -5.971 -21.633 1.00 0.00 O ATOM 273 CB TRP A 41 92.541 -4.840 -18.525 1.00 0.00 C ATOM 274 CG TRP A 41 93.927 -4.342 -18.754 1.00 0.00 C ATOM 275 CD1 TRP A 41 94.914 -5.034 -19.369 1.00 0.00 C ATOM 276 CD2 TRP A 41 94.500 -3.063 -18.364 1.00 0.00 C ATOM 277 NE1 TRP A 41 96.053 -4.248 -19.402 1.00 0.00 N ATOM 278 CE2 TRP A 41 95.846 -3.023 -18.792 1.00 0.00 C ATOM 279 CE3 TRP A 41 93.984 -1.939 -17.693 1.00 0.00 C ATOM 280 CZ2 TRP A 41 96.651 -1.907 -18.562 1.00 0.00 C ATOM 281 CZ3 TRP A 41 94.796 -0.818 -17.454 1.00 0.00 C ATOM 282 CH2 TRP A 41 96.127 -0.803 -17.891 1.00 0.00 C ATOM 0 H TRP A 41 90.169 -5.301 -18.595 1.00 0.00 H new ATOM 0 HA TRP A 41 91.915 -4.129 -20.487 1.00 0.00 H new ATOM 0 HB2 TRP A 41 91.994 -4.138 -17.895 1.00 0.00 H new ATOM 0 HB3 TRP A 41 92.571 -5.790 -17.992 1.00 0.00 H new ATOM 0 HD1 TRP A 41 94.827 -6.034 -19.768 1.00 0.00 H new ATOM 0 HE1 TRP A 41 96.936 -4.536 -19.824 1.00 0.00 H new ATOM 0 HE3 TRP A 41 92.957 -1.938 -17.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 97.676 -1.898 -18.902 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 94.392 0.036 -16.931 1.00 0.00 H new ATOM 0 HH2 TRP A 41 96.746 0.063 -17.708 1.00 0.00 H new ATOM 293 N THR A 42 92.251 -7.366 -20.142 1.00 0.00 N ATOM 294 CA THR A 42 92.840 -8.557 -20.757 1.00 0.00 C ATOM 295 C THR A 42 92.584 -8.644 -22.264 1.00 0.00 C ATOM 296 O THR A 42 93.477 -9.042 -23.012 1.00 0.00 O ATOM 297 CB THR A 42 92.304 -9.822 -20.079 1.00 0.00 C ATOM 298 OG1 THR A 42 92.461 -10.928 -20.957 1.00 0.00 O ATOM 299 CG2 THR A 42 90.825 -9.638 -19.751 1.00 0.00 C ATOM 0 H THR A 42 91.688 -7.555 -19.313 1.00 0.00 H new ATOM 0 HA THR A 42 93.918 -8.476 -20.614 1.00 0.00 H new ATOM 0 HB THR A 42 92.858 -10.005 -19.158 1.00 0.00 H new ATOM 0 HG1 THR A 42 92.120 -11.739 -20.525 1.00 0.00 H new ATOM 0 HG21 THR A 42 90.445 -10.538 -19.269 1.00 0.00 H new ATOM 0 HG22 THR A 42 90.704 -8.788 -19.079 1.00 0.00 H new ATOM 0 HG23 THR A 42 90.268 -9.456 -20.670 1.00 0.00 H new ATOM 307 N ILE A 43 91.401 -8.310 -22.713 1.00 0.00 N ATOM 308 CA ILE A 43 91.118 -8.407 -24.147 1.00 0.00 C ATOM 309 C ILE A 43 91.983 -7.429 -24.950 1.00 0.00 C ATOM 310 O ILE A 43 92.534 -7.795 -25.989 1.00 0.00 O ATOM 311 CB ILE A 43 89.627 -8.170 -24.438 1.00 0.00 C ATOM 312 CG1 ILE A 43 89.132 -6.926 -23.701 1.00 0.00 C ATOM 313 CG2 ILE A 43 88.817 -9.381 -23.969 1.00 0.00 C ATOM 314 CD1 ILE A 43 87.771 -6.510 -24.260 1.00 0.00 C ATOM 0 H ILE A 43 90.629 -7.976 -22.136 1.00 0.00 H new ATOM 0 HA ILE A 43 91.369 -9.420 -24.461 1.00 0.00 H new ATOM 0 HB ILE A 43 89.499 -8.026 -25.511 1.00 0.00 H new ATOM 0 HG12 ILE A 43 89.051 -7.131 -22.633 1.00 0.00 H new ATOM 0 HG13 ILE A 43 89.848 -6.113 -23.816 1.00 0.00 H new ATOM 0 HG21 ILE A 43 87.760 -9.214 -24.175 1.00 0.00 H new ATOM 0 HG22 ILE A 43 89.154 -10.272 -24.500 1.00 0.00 H new ATOM 0 HG23 ILE A 43 88.960 -9.522 -22.898 1.00 0.00 H new ATOM 0 HD11 ILE A 43 87.418 -5.623 -23.735 1.00 0.00 H new ATOM 0 HD12 ILE A 43 87.867 -6.288 -25.323 1.00 0.00 H new ATOM 0 HD13 ILE A 43 87.057 -7.322 -24.122 1.00 0.00 H new ATOM 326 N GLY A 44 92.101 -6.215 -24.481 1.00 0.00 N ATOM 327 CA GLY A 44 92.905 -5.207 -25.176 1.00 0.00 C ATOM 328 C GLY A 44 94.374 -5.619 -25.244 1.00 0.00 C ATOM 329 O GLY A 44 95.066 -5.332 -26.220 1.00 0.00 O ATOM 0 H GLY A 44 91.657 -5.887 -23.623 1.00 0.00 H new ATOM 0 HA2 GLY A 44 92.518 -5.063 -26.185 1.00 0.00 H new ATOM 0 HA3 GLY A 44 92.817 -4.250 -24.661 1.00 0.00 H new ATOM 333 N HIS A 45 94.830 -6.273 -24.214 1.00 0.00 N ATOM 334 CA HIS A 45 96.217 -6.715 -24.144 1.00 0.00 C ATOM 335 C HIS A 45 96.632 -7.430 -25.427 1.00 0.00 C ATOM 336 O HIS A 45 97.816 -7.484 -25.761 1.00 0.00 O ATOM 337 CB HIS A 45 96.421 -7.640 -22.950 1.00 0.00 C ATOM 338 CG HIS A 45 97.894 -7.897 -22.773 1.00 0.00 C ATOM 339 ND1 HIS A 45 98.406 -9.162 -22.528 1.00 0.00 N ATOM 340 CD2 HIS A 45 98.980 -7.054 -22.805 1.00 0.00 C ATOM 341 CE1 HIS A 45 99.744 -9.046 -22.425 1.00 0.00 C ATOM 342 NE2 HIS A 45 100.145 -7.783 -22.586 1.00 0.00 N ATOM 0 H HIS A 45 94.267 -6.519 -23.400 1.00 0.00 H new ATOM 0 HA HIS A 45 96.842 -5.830 -24.023 1.00 0.00 H new ATOM 0 HB2 HIS A 45 96.007 -7.188 -22.049 1.00 0.00 H new ATOM 0 HB3 HIS A 45 95.891 -8.580 -23.107 1.00 0.00 H new ATOM 0 HD2 HIS A 45 98.936 -5.988 -22.974 1.00 0.00 H new ATOM 0 HE1 HIS A 45 100.411 -9.874 -22.235 1.00 0.00 H new ATOM 0 HE2 HIS A 45 101.101 -7.428 -22.555 1.00 0.00 H new ATOM 351 N LEU A 46 95.679 -8.001 -26.110 1.00 0.00 N ATOM 352 CA LEU A 46 95.973 -8.752 -27.328 1.00 0.00 C ATOM 353 C LEU A 46 96.947 -7.984 -28.227 1.00 0.00 C ATOM 354 O LEU A 46 97.727 -8.593 -28.958 1.00 0.00 O ATOM 355 CB LEU A 46 94.652 -9.041 -28.084 1.00 0.00 C ATOM 356 CG LEU A 46 94.275 -7.856 -29.012 1.00 0.00 C ATOM 357 CD1 LEU A 46 95.023 -7.944 -30.371 1.00 0.00 C ATOM 358 CD2 LEU A 46 92.756 -7.846 -29.254 1.00 0.00 C ATOM 0 H LEU A 46 94.692 -7.969 -25.856 1.00 0.00 H new ATOM 0 HA LEU A 46 96.448 -9.694 -27.054 1.00 0.00 H new ATOM 0 HB2 LEU A 46 94.758 -9.951 -28.674 1.00 0.00 H new ATOM 0 HB3 LEU A 46 93.849 -9.217 -27.368 1.00 0.00 H new ATOM 0 HG LEU A 46 94.574 -6.931 -28.519 1.00 0.00 H new ATOM 0 HD11 LEU A 46 94.738 -7.100 -30.999 1.00 0.00 H new ATOM 0 HD12 LEU A 46 96.099 -7.919 -30.197 1.00 0.00 H new ATOM 0 HD13 LEU A 46 94.758 -8.875 -30.872 1.00 0.00 H new ATOM 0 HD21 LEU A 46 92.497 -7.012 -29.906 1.00 0.00 H new ATOM 0 HD22 LEU A 46 92.457 -8.782 -29.726 1.00 0.00 H new ATOM 0 HD23 LEU A 46 92.237 -7.737 -28.302 1.00 0.00 H new ATOM 370 N ASN A 47 96.907 -6.681 -28.178 1.00 0.00 N ATOM 371 CA ASN A 47 97.809 -5.886 -29.009 1.00 0.00 C ATOM 372 C ASN A 47 99.269 -6.138 -28.618 1.00 0.00 C ATOM 373 O ASN A 47 100.102 -6.443 -29.471 1.00 0.00 O ATOM 374 CB ASN A 47 97.485 -4.400 -28.848 1.00 0.00 C ATOM 375 CG ASN A 47 98.248 -3.582 -29.883 1.00 0.00 C ATOM 376 OD1 ASN A 47 99.377 -3.160 -29.631 1.00 0.00 O ATOM 377 ND2 ASN A 47 97.695 -3.324 -31.036 1.00 0.00 N ATOM 0 H ASN A 47 96.275 -6.141 -27.586 1.00 0.00 H new ATOM 0 HA ASN A 47 97.670 -6.181 -30.049 1.00 0.00 H new ATOM 0 HB2 ASN A 47 96.413 -4.239 -28.964 1.00 0.00 H new ATOM 0 HB3 ASN A 47 97.750 -4.069 -27.844 1.00 0.00 H new ATOM 0 HD21 ASN A 47 98.198 -2.772 -31.731 1.00 0.00 H new ATOM 0 HD22 ASN A 47 96.760 -3.674 -31.243 1.00 0.00 H new ATOM 384 N GLN A 48 99.568 -5.999 -27.354 1.00 0.00 N ATOM 385 CA GLN A 48 100.933 -6.201 -26.875 1.00 0.00 C ATOM 386 C GLN A 48 101.497 -7.523 -27.389 1.00 0.00 C ATOM 387 O GLN A 48 102.611 -7.567 -27.914 1.00 0.00 O ATOM 388 CB GLN A 48 100.963 -6.188 -25.342 1.00 0.00 C ATOM 389 CG GLN A 48 102.403 -6.004 -24.845 1.00 0.00 C ATOM 390 CD GLN A 48 103.216 -7.269 -25.106 1.00 0.00 C ATOM 391 OE1 GLN A 48 102.715 -8.377 -24.923 1.00 0.00 O ATOM 392 NE2 GLN A 48 104.448 -7.169 -25.527 1.00 0.00 N ATOM 0 H GLN A 48 98.895 -5.748 -26.630 1.00 0.00 H new ATOM 0 HA GLN A 48 101.550 -5.387 -27.254 1.00 0.00 H new ATOM 0 HB2 GLN A 48 100.334 -5.382 -24.965 1.00 0.00 H new ATOM 0 HB3 GLN A 48 100.552 -7.120 -24.954 1.00 0.00 H new ATOM 0 HG2 GLN A 48 102.864 -5.156 -25.350 1.00 0.00 H new ATOM 0 HG3 GLN A 48 102.401 -5.777 -23.779 1.00 0.00 H new ATOM 0 HE21 GLN A 48 104.862 -6.249 -25.678 1.00 0.00 H new ATOM 0 HE22 GLN A 48 104.996 -8.011 -25.705 1.00 0.00 H new ATOM 401 N ILE A 49 100.748 -8.582 -27.234 1.00 0.00 N ATOM 402 CA ILE A 49 101.202 -9.895 -27.682 1.00 0.00 C ATOM 403 C ILE A 49 101.679 -9.835 -29.131 1.00 0.00 C ATOM 404 O ILE A 49 102.773 -10.297 -29.453 1.00 0.00 O ATOM 405 CB ILE A 49 100.060 -10.909 -27.568 1.00 0.00 C ATOM 406 CG1 ILE A 49 99.408 -10.811 -26.181 1.00 0.00 C ATOM 407 CG2 ILE A 49 100.606 -12.324 -27.777 1.00 0.00 C ATOM 408 CD1 ILE A 49 100.475 -10.898 -25.084 1.00 0.00 C ATOM 0 H ILE A 49 99.823 -8.574 -26.804 1.00 0.00 H new ATOM 0 HA ILE A 49 102.033 -10.204 -27.048 1.00 0.00 H new ATOM 0 HB ILE A 49 99.313 -10.690 -28.331 1.00 0.00 H new ATOM 0 HG12 ILE A 49 98.863 -9.871 -26.094 1.00 0.00 H new ATOM 0 HG13 ILE A 49 98.682 -11.614 -26.056 1.00 0.00 H new ATOM 0 HG21 ILE A 49 99.792 -13.044 -27.695 1.00 0.00 H new ATOM 0 HG22 ILE A 49 101.057 -12.397 -28.766 1.00 0.00 H new ATOM 0 HG23 ILE A 49 101.358 -12.540 -27.018 1.00 0.00 H new ATOM 0 HD11 ILE A 49 99.998 -10.827 -24.106 1.00 0.00 H new ATOM 0 HD12 ILE A 49 101.001 -11.849 -25.163 1.00 0.00 H new ATOM 0 HD13 ILE A 49 101.185 -10.080 -25.202 1.00 0.00 H new ATOM 420 N LYS A 50 100.863 -9.277 -29.986 1.00 0.00 N ATOM 421 CA LYS A 50 101.208 -9.166 -31.403 1.00 0.00 C ATOM 422 C LYS A 50 102.148 -7.982 -31.636 1.00 0.00 C ATOM 423 O LYS A 50 103.330 -8.164 -31.928 1.00 0.00 O ATOM 424 CB LYS A 50 99.921 -8.998 -32.235 1.00 0.00 C ATOM 425 CG LYS A 50 100.114 -9.572 -33.646 1.00 0.00 C ATOM 426 CD LYS A 50 101.287 -8.874 -34.338 1.00 0.00 C ATOM 427 CE LYS A 50 101.259 -9.193 -35.835 1.00 0.00 C ATOM 428 NZ LYS A 50 99.996 -8.673 -36.430 1.00 0.00 N ATOM 0 H LYS A 50 99.953 -8.889 -29.739 1.00 0.00 H new ATOM 0 HA LYS A 50 101.722 -10.075 -31.715 1.00 0.00 H new ATOM 0 HB2 LYS A 50 99.092 -9.505 -31.740 1.00 0.00 H new ATOM 0 HB3 LYS A 50 99.657 -7.942 -32.298 1.00 0.00 H new ATOM 0 HG2 LYS A 50 100.300 -10.644 -33.589 1.00 0.00 H new ATOM 0 HG3 LYS A 50 99.204 -9.437 -34.230 1.00 0.00 H new ATOM 0 HD2 LYS A 50 101.225 -7.797 -34.184 1.00 0.00 H new ATOM 0 HD3 LYS A 50 102.230 -9.205 -33.902 1.00 0.00 H new ATOM 0 HE2 LYS A 50 102.119 -8.742 -36.330 1.00 0.00 H new ATOM 0 HE3 LYS A 50 101.330 -10.270 -35.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 100.152 -8.449 -37.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 99.251 -9.394 -36.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 99.703 -7.813 -35.925 1.00 0.00 H new ATOM 442 N ARG A 51 101.624 -6.793 -31.509 1.00 0.00 N ATOM 443 CA ARG A 51 102.425 -5.589 -31.711 1.00 0.00 C ATOM 444 C ARG A 51 103.386 -5.383 -30.543 1.00 0.00 C ATOM 445 O ARG A 51 102.991 -5.465 -29.381 1.00 0.00 O ATOM 446 CB ARG A 51 101.511 -4.371 -31.844 1.00 0.00 C ATOM 447 CG ARG A 51 102.312 -3.182 -32.379 1.00 0.00 C ATOM 448 CD ARG A 51 101.368 -2.004 -32.632 1.00 0.00 C ATOM 449 NE ARG A 51 102.083 -0.918 -33.293 1.00 0.00 N ATOM 450 CZ ARG A 51 101.447 0.122 -33.760 1.00 0.00 C ATOM 451 NH1 ARG A 51 100.149 0.200 -33.645 1.00 0.00 N ATOM 452 NH2 ARG A 51 102.109 1.084 -34.344 1.00 0.00 N ATOM 0 H ARG A 51 100.648 -6.619 -31.267 1.00 0.00 H new ATOM 0 HA ARG A 51 103.005 -5.709 -32.626 1.00 0.00 H new ATOM 0 HB2 ARG A 51 100.684 -4.597 -32.517 1.00 0.00 H new ATOM 0 HB3 ARG A 51 101.076 -4.123 -30.876 1.00 0.00 H new ATOM 0 HG2 ARG A 51 103.083 -2.897 -31.663 1.00 0.00 H new ATOM 0 HG3 ARG A 51 102.821 -3.459 -33.302 1.00 0.00 H new ATOM 0 HD2 ARG A 51 100.530 -2.326 -33.250 1.00 0.00 H new ATOM 0 HD3 ARG A 51 100.951 -1.653 -31.688 1.00 0.00 H new ATOM 0 HE ARG A 51 103.097 -0.972 -33.392 1.00 0.00 H new ATOM 0 HH11 ARG A 51 99.631 -0.552 -33.190 1.00 0.00 H new ATOM 0 HH12 ARG A 51 99.653 1.013 -34.010 1.00 0.00 H new ATOM 0 HH21 ARG A 51 103.123 1.023 -34.435 1.00 0.00 H new ATOM 0 HH22 ARG A 51 101.612 1.897 -34.709 1.00 0.00 H new ATOM 466 N GLY A 52 104.625 -5.120 -30.858 1.00 0.00 N ATOM 467 CA GLY A 52 105.637 -4.904 -29.830 1.00 0.00 C ATOM 468 C GLY A 52 105.131 -3.951 -28.754 1.00 0.00 C ATOM 0 H GLY A 52 104.970 -5.048 -31.815 1.00 0.00 H new ATOM 0 HA2 GLY A 52 105.909 -5.857 -29.377 1.00 0.00 H new ATOM 0 HA3 GLY A 52 106.541 -4.498 -30.284 1.00 0.00 H new ATOM 473 N SER B 23 86.773 17.632 5.424 1.00 0.00 N ATOM 474 CA SER B 23 85.883 18.304 4.435 1.00 0.00 C ATOM 475 C SER B 23 86.451 18.115 3.033 1.00 0.00 C ATOM 476 O SER B 23 86.842 19.080 2.377 1.00 0.00 O ATOM 477 CB SER B 23 85.795 19.796 4.766 1.00 0.00 C ATOM 478 OG SER B 23 87.107 20.322 4.913 1.00 0.00 O ATOM 0 HA SER B 23 84.885 17.867 4.479 1.00 0.00 H new ATOM 0 HB2 SER B 23 85.265 20.325 3.974 1.00 0.00 H new ATOM 0 HB3 SER B 23 85.226 19.944 5.684 1.00 0.00 H new ATOM 0 HG SER B 23 87.670 19.671 5.382 1.00 0.00 H new ATOM 483 N ASP B 24 86.501 16.886 2.589 1.00 0.00 N ATOM 484 CA ASP B 24 87.034 16.579 1.263 1.00 0.00 C ATOM 485 C ASP B 24 86.537 15.211 0.782 1.00 0.00 C ATOM 486 O ASP B 24 87.230 14.208 0.945 1.00 0.00 O ATOM 487 CB ASP B 24 88.563 16.571 1.316 1.00 0.00 C ATOM 488 CG ASP B 24 89.087 17.995 1.467 1.00 0.00 C ATOM 489 OD1 ASP B 24 89.088 18.713 0.480 1.00 0.00 O ATOM 490 OD2 ASP B 24 89.479 18.348 2.567 1.00 0.00 O ATOM 0 H ASP B 24 86.182 16.073 3.117 1.00 0.00 H new ATOM 0 HA ASP B 24 86.689 17.343 0.566 1.00 0.00 H new ATOM 0 HB2 ASP B 24 88.903 15.959 2.152 1.00 0.00 H new ATOM 0 HB3 ASP B 24 88.964 16.121 0.408 1.00 0.00 H new ATOM 495 N PRO B 25 85.358 15.152 0.206 1.00 0.00 N ATOM 496 CA PRO B 25 84.759 13.872 -0.305 1.00 0.00 C ATOM 497 C PRO B 25 85.679 13.126 -1.283 1.00 0.00 C ATOM 498 O PRO B 25 85.380 13.011 -2.471 1.00 0.00 O ATOM 499 CB PRO B 25 83.459 14.329 -0.992 1.00 0.00 C ATOM 500 CG PRO B 25 83.119 15.633 -0.346 1.00 0.00 C ATOM 501 CD PRO B 25 84.456 16.294 -0.016 1.00 0.00 C ATOM 0 HA PRO B 25 84.593 13.155 0.499 1.00 0.00 H new ATOM 0 HB2 PRO B 25 83.600 14.446 -2.067 1.00 0.00 H new ATOM 0 HB3 PRO B 25 82.661 13.599 -0.853 1.00 0.00 H new ATOM 0 HG2 PRO B 25 82.528 16.259 -1.015 1.00 0.00 H new ATOM 0 HG3 PRO B 25 82.525 15.480 0.555 1.00 0.00 H new ATOM 0 HD2 PRO B 25 84.803 16.927 -0.833 1.00 0.00 H new ATOM 0 HD3 PRO B 25 84.384 16.926 0.869 1.00 0.00 H new ATOM 509 N LEU B 26 86.767 12.617 -0.775 1.00 0.00 N ATOM 510 CA LEU B 26 87.720 11.868 -1.593 1.00 0.00 C ATOM 511 C LEU B 26 87.098 10.560 -2.067 1.00 0.00 C ATOM 512 O LEU B 26 87.273 10.154 -3.217 1.00 0.00 O ATOM 513 CB LEU B 26 88.967 11.552 -0.755 1.00 0.00 C ATOM 514 CG LEU B 26 89.839 12.816 -0.572 1.00 0.00 C ATOM 515 CD1 LEU B 26 90.611 12.726 0.748 1.00 0.00 C ATOM 516 CD2 LEU B 26 90.829 12.940 -1.737 1.00 0.00 C ATOM 0 H LEU B 26 87.030 12.700 0.207 1.00 0.00 H new ATOM 0 HA LEU B 26 87.990 12.471 -2.460 1.00 0.00 H new ATOM 0 HB2 LEU B 26 88.668 11.167 0.220 1.00 0.00 H new ATOM 0 HB3 LEU B 26 89.550 10.770 -1.242 1.00 0.00 H new ATOM 0 HG LEU B 26 89.193 13.694 -0.554 1.00 0.00 H new ATOM 0 HD11 LEU B 26 91.224 13.619 0.873 1.00 0.00 H new ATOM 0 HD12 LEU B 26 89.907 12.651 1.577 1.00 0.00 H new ATOM 0 HD13 LEU B 26 91.252 11.845 0.735 1.00 0.00 H new ATOM 0 HD21 LEU B 26 91.440 13.832 -1.602 1.00 0.00 H new ATOM 0 HD22 LEU B 26 91.472 12.060 -1.763 1.00 0.00 H new ATOM 0 HD23 LEU B 26 90.279 13.015 -2.675 1.00 0.00 H new ATOM 528 N VAL B 27 86.414 9.905 -1.178 1.00 0.00 N ATOM 529 CA VAL B 27 85.797 8.624 -1.486 1.00 0.00 C ATOM 530 C VAL B 27 84.838 8.712 -2.665 1.00 0.00 C ATOM 531 O VAL B 27 84.917 7.909 -3.595 1.00 0.00 O ATOM 532 CB VAL B 27 85.031 8.124 -0.268 1.00 0.00 C ATOM 533 CG1 VAL B 27 84.552 6.707 -0.538 1.00 0.00 C ATOM 534 CG2 VAL B 27 85.947 8.119 0.954 1.00 0.00 C ATOM 0 H VAL B 27 86.261 10.229 -0.223 1.00 0.00 H new ATOM 0 HA VAL B 27 86.598 7.935 -1.754 1.00 0.00 H new ATOM 0 HB VAL B 27 84.181 8.779 -0.077 1.00 0.00 H new ATOM 0 HG11 VAL B 27 84.002 6.338 0.327 1.00 0.00 H new ATOM 0 HG12 VAL B 27 83.900 6.704 -1.411 1.00 0.00 H new ATOM 0 HG13 VAL B 27 85.411 6.062 -0.724 1.00 0.00 H new ATOM 0 HG21 VAL B 27 85.394 7.761 1.822 1.00 0.00 H new ATOM 0 HG22 VAL B 27 86.797 7.462 0.769 1.00 0.00 H new ATOM 0 HG23 VAL B 27 86.305 9.131 1.144 1.00 0.00 H new ATOM 544 N VAL B 28 83.955 9.668 -2.639 1.00 0.00 N ATOM 545 CA VAL B 28 82.994 9.852 -3.718 1.00 0.00 C ATOM 546 C VAL B 28 83.688 10.359 -4.975 1.00 0.00 C ATOM 547 O VAL B 28 83.194 10.184 -6.089 1.00 0.00 O ATOM 548 CB VAL B 28 81.914 10.847 -3.289 1.00 0.00 C ATOM 549 CG1 VAL B 28 80.845 10.943 -4.378 1.00 0.00 C ATOM 550 CG2 VAL B 28 81.271 10.371 -1.984 1.00 0.00 C ATOM 0 H VAL B 28 83.871 10.344 -1.880 1.00 0.00 H new ATOM 0 HA VAL B 28 82.534 8.889 -3.938 1.00 0.00 H new ATOM 0 HB VAL B 28 82.365 11.828 -3.136 1.00 0.00 H new ATOM 0 HG11 VAL B 28 80.076 11.652 -4.071 1.00 0.00 H new ATOM 0 HG12 VAL B 28 81.302 11.283 -5.307 1.00 0.00 H new ATOM 0 HG13 VAL B 28 80.394 9.963 -4.532 1.00 0.00 H new ATOM 0 HG21 VAL B 28 80.501 11.080 -1.678 1.00 0.00 H new ATOM 0 HG22 VAL B 28 80.821 9.390 -2.137 1.00 0.00 H new ATOM 0 HG23 VAL B 28 82.032 10.304 -1.207 1.00 0.00 H new ATOM 560 N ALA B 29 84.811 10.993 -4.782 1.00 0.00 N ATOM 561 CA ALA B 29 85.572 11.544 -5.892 1.00 0.00 C ATOM 562 C ALA B 29 86.020 10.464 -6.876 1.00 0.00 C ATOM 563 O ALA B 29 86.014 10.690 -8.084 1.00 0.00 O ATOM 564 CB ALA B 29 86.802 12.287 -5.366 1.00 0.00 C ATOM 0 H ALA B 29 85.230 11.147 -3.865 1.00 0.00 H new ATOM 0 HA ALA B 29 84.914 12.232 -6.423 1.00 0.00 H new ATOM 0 HB1 ALA B 29 87.366 12.696 -6.204 1.00 0.00 H new ATOM 0 HB2 ALA B 29 86.484 13.099 -4.711 1.00 0.00 H new ATOM 0 HB3 ALA B 29 87.433 11.596 -4.807 1.00 0.00 H new ATOM 570 N ALA B 30 86.409 9.312 -6.384 1.00 0.00 N ATOM 571 CA ALA B 30 86.847 8.266 -7.300 1.00 0.00 C ATOM 572 C ALA B 30 85.665 7.656 -8.065 1.00 0.00 C ATOM 573 O ALA B 30 85.681 7.590 -9.294 1.00 0.00 O ATOM 574 CB ALA B 30 87.593 7.187 -6.535 1.00 0.00 C ATOM 0 H ALA B 30 86.435 9.072 -5.393 1.00 0.00 H new ATOM 0 HA ALA B 30 87.517 8.717 -8.032 1.00 0.00 H new ATOM 0 HB1 ALA B 30 87.917 6.409 -7.226 1.00 0.00 H new ATOM 0 HB2 ALA B 30 88.464 7.624 -6.046 1.00 0.00 H new ATOM 0 HB3 ALA B 30 86.934 6.753 -5.783 1.00 0.00 H new ATOM 580 N SER B 31 84.673 7.200 -7.344 1.00 0.00 N ATOM 581 CA SER B 31 83.499 6.573 -7.963 1.00 0.00 C ATOM 582 C SER B 31 82.845 7.455 -9.032 1.00 0.00 C ATOM 583 O SER B 31 82.395 6.957 -10.064 1.00 0.00 O ATOM 584 CB SER B 31 82.456 6.258 -6.890 1.00 0.00 C ATOM 585 OG SER B 31 81.247 5.851 -7.517 1.00 0.00 O ATOM 0 H SER B 31 84.641 7.244 -6.325 1.00 0.00 H new ATOM 0 HA SER B 31 83.852 5.663 -8.449 1.00 0.00 H new ATOM 0 HB2 SER B 31 82.821 5.470 -6.232 1.00 0.00 H new ATOM 0 HB3 SER B 31 82.280 7.136 -6.269 1.00 0.00 H new ATOM 0 HG SER B 31 80.576 5.647 -6.832 1.00 0.00 H new ATOM 591 N ILE B 32 82.781 8.730 -8.779 1.00 0.00 N ATOM 592 CA ILE B 32 82.153 9.634 -9.741 1.00 0.00 C ATOM 593 C ILE B 32 82.980 9.698 -11.026 1.00 0.00 C ATOM 594 O ILE B 32 82.431 9.707 -12.127 1.00 0.00 O ATOM 595 CB ILE B 32 81.941 11.043 -9.134 1.00 0.00 C ATOM 596 CG1 ILE B 32 80.715 11.711 -9.775 1.00 0.00 C ATOM 597 CG2 ILE B 32 83.165 11.931 -9.377 1.00 0.00 C ATOM 598 CD1 ILE B 32 80.549 13.123 -9.212 1.00 0.00 C ATOM 0 H ILE B 32 83.144 9.176 -7.936 1.00 0.00 H new ATOM 0 HA ILE B 32 81.167 9.240 -9.989 1.00 0.00 H new ATOM 0 HB ILE B 32 81.788 10.927 -8.061 1.00 0.00 H new ATOM 0 HG12 ILE B 32 80.835 11.752 -10.858 1.00 0.00 H new ATOM 0 HG13 ILE B 32 79.820 11.121 -9.575 1.00 0.00 H new ATOM 0 HG21 ILE B 32 82.993 12.915 -8.942 1.00 0.00 H new ATOM 0 HG22 ILE B 32 84.041 11.478 -8.913 1.00 0.00 H new ATOM 0 HG23 ILE B 32 83.334 12.033 -10.449 1.00 0.00 H new ATOM 0 HD11 ILE B 32 79.679 13.596 -9.667 1.00 0.00 H new ATOM 0 HD12 ILE B 32 80.410 13.070 -8.132 1.00 0.00 H new ATOM 0 HD13 ILE B 32 81.440 13.711 -9.435 1.00 0.00 H new ATOM 610 N ILE B 33 84.275 9.734 -10.880 1.00 0.00 N ATOM 611 CA ILE B 33 85.163 9.785 -12.034 1.00 0.00 C ATOM 612 C ILE B 33 85.180 8.448 -12.784 1.00 0.00 C ATOM 613 O ILE B 33 85.174 8.425 -14.011 1.00 0.00 O ATOM 614 CB ILE B 33 86.585 10.172 -11.587 1.00 0.00 C ATOM 615 CG1 ILE B 33 86.619 11.667 -11.247 1.00 0.00 C ATOM 616 CG2 ILE B 33 87.593 9.893 -12.710 1.00 0.00 C ATOM 617 CD1 ILE B 33 87.893 11.988 -10.468 1.00 0.00 C ATOM 0 H ILE B 33 84.750 9.729 -9.978 1.00 0.00 H new ATOM 0 HA ILE B 33 84.787 10.544 -12.720 1.00 0.00 H new ATOM 0 HB ILE B 33 86.852 9.580 -10.712 1.00 0.00 H new ATOM 0 HG12 ILE B 33 86.581 12.259 -12.162 1.00 0.00 H new ATOM 0 HG13 ILE B 33 85.743 11.936 -10.657 1.00 0.00 H new ATOM 0 HG21 ILE B 33 88.593 10.172 -12.379 1.00 0.00 H new ATOM 0 HG22 ILE B 33 87.576 8.832 -12.959 1.00 0.00 H new ATOM 0 HG23 ILE B 33 87.327 10.477 -13.591 1.00 0.00 H new ATOM 0 HD11 ILE B 33 87.914 13.051 -10.228 1.00 0.00 H new ATOM 0 HD12 ILE B 33 87.912 11.407 -9.546 1.00 0.00 H new ATOM 0 HD13 ILE B 33 88.763 11.735 -11.074 1.00 0.00 H new ATOM 629 N GLY B 34 85.263 7.356 -12.066 1.00 0.00 N ATOM 630 CA GLY B 34 85.352 6.042 -12.700 1.00 0.00 C ATOM 631 C GLY B 34 84.314 5.820 -13.796 1.00 0.00 C ATOM 632 O GLY B 34 84.666 5.413 -14.903 1.00 0.00 O ATOM 0 H GLY B 34 85.272 7.339 -11.046 1.00 0.00 H new ATOM 0 HA2 GLY B 34 86.348 5.920 -13.125 1.00 0.00 H new ATOM 0 HA3 GLY B 34 85.234 5.272 -11.938 1.00 0.00 H new ATOM 636 N ILE B 35 83.069 6.067 -13.514 1.00 0.00 N ATOM 637 CA ILE B 35 82.040 5.861 -14.528 1.00 0.00 C ATOM 638 C ILE B 35 82.426 6.589 -15.820 1.00 0.00 C ATOM 639 O ILE B 35 82.071 6.152 -16.915 1.00 0.00 O ATOM 640 CB ILE B 35 80.676 6.329 -13.996 1.00 0.00 C ATOM 641 CG1 ILE B 35 79.702 6.581 -15.156 1.00 0.00 C ATOM 642 CG2 ILE B 35 80.863 7.605 -13.186 1.00 0.00 C ATOM 643 CD1 ILE B 35 78.272 6.674 -14.617 1.00 0.00 C ATOM 0 H ILE B 35 82.731 6.405 -12.613 1.00 0.00 H new ATOM 0 HA ILE B 35 81.960 4.798 -14.756 1.00 0.00 H new ATOM 0 HB ILE B 35 80.256 5.550 -13.360 1.00 0.00 H new ATOM 0 HG12 ILE B 35 79.967 7.504 -15.672 1.00 0.00 H new ATOM 0 HG13 ILE B 35 79.774 5.775 -15.886 1.00 0.00 H new ATOM 0 HG21 ILE B 35 79.898 7.940 -12.807 1.00 0.00 H new ATOM 0 HG22 ILE B 35 81.533 7.410 -12.349 1.00 0.00 H new ATOM 0 HG23 ILE B 35 81.292 8.380 -13.821 1.00 0.00 H new ATOM 0 HD11 ILE B 35 77.583 6.853 -15.442 1.00 0.00 H new ATOM 0 HD12 ILE B 35 78.009 5.740 -14.121 1.00 0.00 H new ATOM 0 HD13 ILE B 35 78.205 7.495 -13.904 1.00 0.00 H new ATOM 655 N LEU B 36 83.155 7.666 -15.693 1.00 0.00 N ATOM 656 CA LEU B 36 83.589 8.417 -16.868 1.00 0.00 C ATOM 657 C LEU B 36 84.533 7.555 -17.706 1.00 0.00 C ATOM 658 O LEU B 36 84.353 7.395 -18.914 1.00 0.00 O ATOM 659 CB LEU B 36 84.329 9.687 -16.416 1.00 0.00 C ATOM 660 CG LEU B 36 84.407 10.709 -17.569 1.00 0.00 C ATOM 661 CD1 LEU B 36 83.130 11.558 -17.611 1.00 0.00 C ATOM 662 CD2 LEU B 36 85.613 11.637 -17.355 1.00 0.00 C ATOM 0 H LEU B 36 83.465 8.050 -14.800 1.00 0.00 H new ATOM 0 HA LEU B 36 82.719 8.691 -17.465 1.00 0.00 H new ATOM 0 HB2 LEU B 36 83.814 10.131 -15.564 1.00 0.00 H new ATOM 0 HB3 LEU B 36 85.334 9.429 -16.082 1.00 0.00 H new ATOM 0 HG LEU B 36 84.514 10.168 -18.509 1.00 0.00 H new ATOM 0 HD11 LEU B 36 83.197 12.276 -18.429 1.00 0.00 H new ATOM 0 HD12 LEU B 36 82.267 10.910 -17.766 1.00 0.00 H new ATOM 0 HD13 LEU B 36 83.017 12.092 -16.668 1.00 0.00 H new ATOM 0 HD21 LEU B 36 85.666 12.358 -18.171 1.00 0.00 H new ATOM 0 HD22 LEU B 36 85.501 12.167 -16.409 1.00 0.00 H new ATOM 0 HD23 LEU B 36 86.528 11.045 -17.334 1.00 0.00 H new ATOM 674 N HIS B 37 85.532 7.036 -17.050 1.00 0.00 N ATOM 675 CA HIS B 37 86.529 6.210 -17.720 1.00 0.00 C ATOM 676 C HIS B 37 85.882 4.980 -18.355 1.00 0.00 C ATOM 677 O HIS B 37 86.377 4.457 -19.353 1.00 0.00 O ATOM 678 CB HIS B 37 87.665 5.820 -16.736 1.00 0.00 C ATOM 679 CG HIS B 37 87.378 4.541 -15.965 1.00 0.00 C ATOM 680 ND1 HIS B 37 86.768 3.423 -16.526 1.00 0.00 N ATOM 681 CD2 HIS B 37 87.647 4.193 -14.662 1.00 0.00 C ATOM 682 CE1 HIS B 37 86.687 2.479 -15.572 1.00 0.00 C ATOM 683 NE2 HIS B 37 87.207 2.895 -14.419 1.00 0.00 N ATOM 0 H HIS B 37 85.688 7.163 -16.050 1.00 0.00 H new ATOM 0 HA HIS B 37 86.976 6.792 -18.526 1.00 0.00 H new ATOM 0 HB2 HIS B 37 88.594 5.700 -17.293 1.00 0.00 H new ATOM 0 HB3 HIS B 37 87.820 6.635 -16.029 1.00 0.00 H new ATOM 0 HD2 HIS B 37 88.128 4.832 -13.936 1.00 0.00 H new ATOM 0 HE1 HIS B 37 86.253 1.502 -15.723 1.00 0.00 H new ATOM 0 HE2 HIS B 37 87.270 2.374 -13.544 1.00 0.00 H new ATOM 692 N PHE B 38 84.812 4.514 -17.765 1.00 0.00 N ATOM 693 CA PHE B 38 84.125 3.321 -18.266 1.00 0.00 C ATOM 694 C PHE B 38 83.466 3.551 -19.630 1.00 0.00 C ATOM 695 O PHE B 38 83.574 2.712 -20.519 1.00 0.00 O ATOM 696 CB PHE B 38 83.062 2.865 -17.262 1.00 0.00 C ATOM 697 CG PHE B 38 82.412 1.596 -17.765 1.00 0.00 C ATOM 698 CD1 PHE B 38 81.358 1.666 -18.686 1.00 0.00 C ATOM 699 CD2 PHE B 38 82.864 0.347 -17.315 1.00 0.00 C ATOM 700 CE1 PHE B 38 80.757 0.491 -19.155 1.00 0.00 C ATOM 701 CE2 PHE B 38 82.261 -0.827 -17.785 1.00 0.00 C ATOM 702 CZ PHE B 38 81.210 -0.755 -18.705 1.00 0.00 C ATOM 0 H PHE B 38 84.387 4.932 -16.937 1.00 0.00 H new ATOM 0 HA PHE B 38 84.884 2.549 -18.390 1.00 0.00 H new ATOM 0 HB2 PHE B 38 83.517 2.692 -16.287 1.00 0.00 H new ATOM 0 HB3 PHE B 38 82.311 3.644 -17.130 1.00 0.00 H new ATOM 0 HD1 PHE B 38 81.009 2.627 -19.034 1.00 0.00 H new ATOM 0 HD2 PHE B 38 83.677 0.290 -16.606 1.00 0.00 H new ATOM 0 HE1 PHE B 38 79.944 0.546 -19.864 1.00 0.00 H new ATOM 0 HE2 PHE B 38 82.608 -1.789 -17.437 1.00 0.00 H new ATOM 0 HZ PHE B 38 80.748 -1.661 -19.068 1.00 0.00 H new ATOM 712 N ILE B 39 82.772 4.646 -19.785 1.00 0.00 N ATOM 713 CA ILE B 39 82.087 4.922 -21.050 1.00 0.00 C ATOM 714 C ILE B 39 83.067 5.250 -22.179 1.00 0.00 C ATOM 715 O ILE B 39 82.837 4.881 -23.327 1.00 0.00 O ATOM 716 CB ILE B 39 81.082 6.061 -20.875 1.00 0.00 C ATOM 717 CG1 ILE B 39 81.768 7.269 -20.236 1.00 0.00 C ATOM 718 CG2 ILE B 39 79.937 5.594 -19.974 1.00 0.00 C ATOM 719 CD1 ILE B 39 80.821 8.470 -20.282 1.00 0.00 C ATOM 0 H ILE B 39 82.657 5.363 -19.069 1.00 0.00 H new ATOM 0 HA ILE B 39 81.556 4.013 -21.333 1.00 0.00 H new ATOM 0 HB ILE B 39 80.691 6.346 -21.852 1.00 0.00 H new ATOM 0 HG12 ILE B 39 82.039 7.044 -19.204 1.00 0.00 H new ATOM 0 HG13 ILE B 39 82.692 7.499 -20.766 1.00 0.00 H new ATOM 0 HG21 ILE B 39 79.219 6.405 -19.848 1.00 0.00 H new ATOM 0 HG22 ILE B 39 79.441 4.738 -20.431 1.00 0.00 H new ATOM 0 HG23 ILE B 39 80.334 5.306 -19.001 1.00 0.00 H new ATOM 0 HD11 ILE B 39 81.306 9.334 -19.827 1.00 0.00 H new ATOM 0 HD12 ILE B 39 80.572 8.698 -21.319 1.00 0.00 H new ATOM 0 HD13 ILE B 39 79.909 8.235 -19.733 1.00 0.00 H new ATOM 731 N ALA B 40 84.138 5.923 -21.857 1.00 0.00 N ATOM 732 CA ALA B 40 85.142 6.281 -22.860 1.00 0.00 C ATOM 733 C ALA B 40 85.868 5.034 -23.355 1.00 0.00 C ATOM 734 O ALA B 40 86.387 4.994 -24.469 1.00 0.00 O ATOM 735 CB ALA B 40 86.151 7.264 -22.265 1.00 0.00 C ATOM 0 H ALA B 40 84.351 6.241 -20.912 1.00 0.00 H new ATOM 0 HA ALA B 40 84.636 6.752 -23.703 1.00 0.00 H new ATOM 0 HB1 ALA B 40 86.894 7.524 -23.019 1.00 0.00 H new ATOM 0 HB2 ALA B 40 85.632 8.166 -21.940 1.00 0.00 H new ATOM 0 HB3 ALA B 40 86.647 6.804 -21.411 1.00 0.00 H new ATOM 741 N TRP B 41 85.913 4.050 -22.509 1.00 0.00 N ATOM 742 CA TRP B 41 86.587 2.791 -22.800 1.00 0.00 C ATOM 743 C TRP B 41 86.192 2.212 -24.155 1.00 0.00 C ATOM 744 O TRP B 41 87.039 1.698 -24.887 1.00 0.00 O ATOM 745 CB TRP B 41 86.206 1.795 -21.708 1.00 0.00 C ATOM 746 CG TRP B 41 86.972 0.535 -21.869 1.00 0.00 C ATOM 747 CD1 TRP B 41 86.828 -0.337 -22.892 1.00 0.00 C ATOM 748 CD2 TRP B 41 87.980 -0.025 -20.983 1.00 0.00 C ATOM 749 NE1 TRP B 41 87.704 -1.389 -22.702 1.00 0.00 N ATOM 750 CE2 TRP B 41 88.435 -1.240 -21.536 1.00 0.00 C ATOM 751 CE3 TRP B 41 88.544 0.405 -19.766 1.00 0.00 C ATOM 752 CZ2 TRP B 41 89.413 -2.003 -20.908 1.00 0.00 C ATOM 753 CZ3 TRP B 41 89.526 -0.370 -19.127 1.00 0.00 C ATOM 754 CH2 TRP B 41 89.962 -1.571 -19.701 1.00 0.00 C ATOM 0 H TRP B 41 85.483 4.084 -21.585 1.00 0.00 H new ATOM 0 HA TRP B 41 87.661 2.977 -22.830 1.00 0.00 H new ATOM 0 HB2 TRP B 41 86.405 2.227 -20.727 1.00 0.00 H new ATOM 0 HB3 TRP B 41 85.137 1.587 -21.753 1.00 0.00 H new ATOM 0 HD1 TRP B 41 86.143 -0.229 -23.720 1.00 0.00 H new ATOM 0 HE1 TRP B 41 87.800 -2.178 -23.342 1.00 0.00 H new ATOM 0 HE3 TRP B 41 88.220 1.335 -19.322 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 89.747 -2.928 -21.354 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 89.947 -0.038 -18.189 1.00 0.00 H new ATOM 0 HH2 TRP B 41 90.722 -2.161 -19.210 1.00 0.00 H new ATOM 765 N THR B 42 84.931 2.249 -24.463 1.00 0.00 N ATOM 766 CA THR B 42 84.441 1.672 -25.713 1.00 0.00 C ATOM 767 C THR B 42 85.288 2.104 -26.911 1.00 0.00 C ATOM 768 O THR B 42 85.513 1.318 -27.826 1.00 0.00 O ATOM 769 CB THR B 42 82.989 2.096 -25.932 1.00 0.00 C ATOM 770 OG1 THR B 42 82.520 1.550 -27.156 1.00 0.00 O ATOM 771 CG2 THR B 42 82.898 3.625 -25.981 1.00 0.00 C ATOM 0 H THR B 42 84.210 2.669 -23.877 1.00 0.00 H new ATOM 0 HA THR B 42 84.510 0.587 -25.632 1.00 0.00 H new ATOM 0 HB THR B 42 82.375 1.728 -25.110 1.00 0.00 H new ATOM 0 HG1 THR B 42 81.588 1.819 -27.299 1.00 0.00 H new ATOM 0 HG21 THR B 42 81.861 3.923 -26.137 1.00 0.00 H new ATOM 0 HG22 THR B 42 83.257 4.041 -25.040 1.00 0.00 H new ATOM 0 HG23 THR B 42 83.511 4.000 -26.801 1.00 0.00 H new ATOM 779 N ILE B 43 85.735 3.326 -26.930 1.00 0.00 N ATOM 780 CA ILE B 43 86.537 3.787 -28.060 1.00 0.00 C ATOM 781 C ILE B 43 87.674 2.799 -28.357 1.00 0.00 C ATOM 782 O ILE B 43 87.912 2.452 -29.512 1.00 0.00 O ATOM 783 CB ILE B 43 87.111 5.177 -27.773 1.00 0.00 C ATOM 784 CG1 ILE B 43 85.974 6.118 -27.362 1.00 0.00 C ATOM 785 CG2 ILE B 43 87.785 5.723 -29.036 1.00 0.00 C ATOM 786 CD1 ILE B 43 86.546 7.495 -27.022 1.00 0.00 C ATOM 0 H ILE B 43 85.571 4.019 -26.200 1.00 0.00 H new ATOM 0 HA ILE B 43 85.891 3.846 -28.936 1.00 0.00 H new ATOM 0 HB ILE B 43 87.844 5.109 -26.969 1.00 0.00 H new ATOM 0 HG12 ILE B 43 85.249 6.204 -28.171 1.00 0.00 H new ATOM 0 HG13 ILE B 43 85.444 5.710 -26.501 1.00 0.00 H new ATOM 0 HG21 ILE B 43 88.194 6.713 -28.832 1.00 0.00 H new ATOM 0 HG22 ILE B 43 88.590 5.053 -29.337 1.00 0.00 H new ATOM 0 HG23 ILE B 43 87.051 5.792 -29.839 1.00 0.00 H new ATOM 0 HD11 ILE B 43 85.736 8.163 -26.730 1.00 0.00 H new ATOM 0 HD12 ILE B 43 87.254 7.402 -26.199 1.00 0.00 H new ATOM 0 HD13 ILE B 43 87.056 7.903 -27.895 1.00 0.00 H new ATOM 798 N GLY B 44 88.362 2.360 -27.333 1.00 0.00 N ATOM 799 CA GLY B 44 89.472 1.420 -27.518 1.00 0.00 C ATOM 800 C GLY B 44 89.040 0.195 -28.331 1.00 0.00 C ATOM 801 O GLY B 44 89.710 -0.194 -29.286 1.00 0.00 O ATOM 0 H GLY B 44 88.186 2.628 -26.365 1.00 0.00 H new ATOM 0 HA2 GLY B 44 90.295 1.923 -28.025 1.00 0.00 H new ATOM 0 HA3 GLY B 44 89.845 1.100 -26.545 1.00 0.00 H new ATOM 805 N HIS B 45 87.974 -0.428 -27.913 1.00 0.00 N ATOM 806 CA HIS B 45 87.472 -1.633 -28.521 1.00 0.00 C ATOM 807 C HIS B 45 87.497 -1.580 -30.053 1.00 0.00 C ATOM 808 O HIS B 45 87.543 -2.626 -30.698 1.00 0.00 O ATOM 809 CB HIS B 45 86.044 -1.850 -27.983 1.00 0.00 C ATOM 810 CG HIS B 45 86.016 -2.890 -26.888 1.00 0.00 C ATOM 811 ND1 HIS B 45 85.773 -2.551 -25.566 1.00 0.00 N ATOM 812 CD2 HIS B 45 86.182 -4.252 -26.902 1.00 0.00 C ATOM 813 CE1 HIS B 45 85.799 -3.686 -24.845 1.00 0.00 C ATOM 814 NE2 HIS B 45 86.045 -4.752 -25.610 1.00 0.00 N ATOM 0 H HIS B 45 87.416 -0.107 -27.122 1.00 0.00 H new ATOM 0 HA HIS B 45 88.117 -2.472 -28.259 1.00 0.00 H new ATOM 0 HB2 HIS B 45 85.651 -0.908 -27.601 1.00 0.00 H new ATOM 0 HB3 HIS B 45 85.391 -2.161 -28.798 1.00 0.00 H new ATOM 0 HD1 HIS B 45 85.605 -1.612 -25.206 1.00 0.00 H new ATOM 0 HD2 HIS B 45 86.387 -4.845 -27.781 1.00 0.00 H new ATOM 0 HE1 HIS B 45 85.640 -3.730 -23.778 1.00 0.00 H new ATOM 823 N LEU B 46 87.508 -0.410 -30.627 1.00 0.00 N ATOM 824 CA LEU B 46 87.578 -0.342 -32.090 1.00 0.00 C ATOM 825 C LEU B 46 88.740 -1.253 -32.558 1.00 0.00 C ATOM 826 O LEU B 46 88.574 -2.100 -33.435 1.00 0.00 O ATOM 827 CB LEU B 46 87.734 1.130 -32.566 1.00 0.00 C ATOM 828 CG LEU B 46 89.194 1.647 -32.443 1.00 0.00 C ATOM 829 CD1 LEU B 46 90.051 1.202 -33.659 1.00 0.00 C ATOM 830 CD2 LEU B 46 89.188 3.188 -32.354 1.00 0.00 C ATOM 0 H LEU B 46 87.472 0.487 -30.142 1.00 0.00 H new ATOM 0 HA LEU B 46 86.652 -0.702 -32.539 1.00 0.00 H new ATOM 0 HB2 LEU B 46 87.411 1.208 -33.604 1.00 0.00 H new ATOM 0 HB3 LEU B 46 87.075 1.770 -31.978 1.00 0.00 H new ATOM 0 HG LEU B 46 89.633 1.222 -31.541 1.00 0.00 H new ATOM 0 HD11 LEU B 46 91.068 1.578 -33.545 1.00 0.00 H new ATOM 0 HD12 LEU B 46 90.071 0.113 -33.711 1.00 0.00 H new ATOM 0 HD13 LEU B 46 89.617 1.601 -34.576 1.00 0.00 H new ATOM 0 HD21 LEU B 46 90.212 3.551 -32.268 1.00 0.00 H new ATOM 0 HD22 LEU B 46 88.730 3.603 -33.252 1.00 0.00 H new ATOM 0 HD23 LEU B 46 88.617 3.500 -31.479 1.00 0.00 H new ATOM 842 N ASN B 47 89.883 -1.041 -31.964 1.00 0.00 N ATOM 843 CA ASN B 47 91.094 -1.804 -32.287 1.00 0.00 C ATOM 844 C ASN B 47 90.839 -3.316 -32.240 1.00 0.00 C ATOM 845 O ASN B 47 91.191 -4.043 -33.168 1.00 0.00 O ATOM 846 CB ASN B 47 92.211 -1.456 -31.300 1.00 0.00 C ATOM 847 CG ASN B 47 92.710 -0.038 -31.547 1.00 0.00 C ATOM 848 OD1 ASN B 47 93.546 0.183 -32.423 1.00 0.00 O ATOM 849 ND2 ASN B 47 92.242 0.943 -30.825 1.00 0.00 N ATOM 0 H ASN B 47 90.018 -0.337 -31.239 1.00 0.00 H new ATOM 0 HA ASN B 47 91.390 -1.534 -33.301 1.00 0.00 H new ATOM 0 HB2 ASN B 47 91.844 -1.547 -30.278 1.00 0.00 H new ATOM 0 HB3 ASN B 47 93.034 -2.163 -31.407 1.00 0.00 H new ATOM 0 HD21 ASN B 47 92.569 1.896 -30.986 1.00 0.00 H new ATOM 0 HD22 ASN B 47 91.549 0.757 -30.100 1.00 0.00 H new ATOM 856 N GLN B 48 90.251 -3.770 -31.167 1.00 0.00 N ATOM 857 CA GLN B 48 89.966 -5.187 -30.987 1.00 0.00 C ATOM 858 C GLN B 48 89.456 -5.847 -32.269 1.00 0.00 C ATOM 859 O GLN B 48 90.249 -6.312 -33.090 1.00 0.00 O ATOM 860 CB GLN B 48 88.941 -5.362 -29.865 1.00 0.00 C ATOM 861 CG GLN B 48 89.510 -4.768 -28.576 1.00 0.00 C ATOM 862 CD GLN B 48 90.639 -5.643 -28.051 1.00 0.00 C ATOM 863 OE1 GLN B 48 91.803 -5.411 -28.374 1.00 0.00 O ATOM 864 NE2 GLN B 48 90.363 -6.640 -27.257 1.00 0.00 N ATOM 0 H GLN B 48 89.953 -3.180 -30.390 1.00 0.00 H new ATOM 0 HA GLN B 48 90.901 -5.681 -30.723 1.00 0.00 H new ATOM 0 HB2 GLN B 48 88.006 -4.866 -30.128 1.00 0.00 H new ATOM 0 HB3 GLN B 48 88.713 -6.419 -29.724 1.00 0.00 H new ATOM 0 HG2 GLN B 48 89.878 -3.759 -28.763 1.00 0.00 H new ATOM 0 HG3 GLN B 48 88.724 -4.687 -27.826 1.00 0.00 H new ATOM 0 HE21 GLN B 48 89.396 -6.828 -26.992 1.00 0.00 H new ATOM 0 HE22 GLN B 48 91.114 -7.231 -26.901 1.00 0.00 H new ATOM 873 N ILE B 49 88.156 -5.914 -32.415 1.00 0.00 N ATOM 874 CA ILE B 49 87.546 -6.554 -33.587 1.00 0.00 C ATOM 875 C ILE B 49 88.350 -6.287 -34.861 1.00 0.00 C ATOM 876 O ILE B 49 88.827 -7.224 -35.501 1.00 0.00 O ATOM 877 CB ILE B 49 86.096 -6.078 -33.762 1.00 0.00 C ATOM 878 CG1 ILE B 49 85.518 -6.675 -35.052 1.00 0.00 C ATOM 879 CG2 ILE B 49 86.038 -4.546 -33.831 1.00 0.00 C ATOM 880 CD1 ILE B 49 83.998 -6.505 -35.057 1.00 0.00 C ATOM 0 H ILE B 49 87.487 -5.537 -31.744 1.00 0.00 H new ATOM 0 HA ILE B 49 87.549 -7.630 -33.414 1.00 0.00 H new ATOM 0 HB ILE B 49 85.509 -6.410 -32.906 1.00 0.00 H new ATOM 0 HG12 ILE B 49 85.953 -6.180 -35.921 1.00 0.00 H new ATOM 0 HG13 ILE B 49 85.777 -7.731 -35.124 1.00 0.00 H new ATOM 0 HG21 ILE B 49 85.003 -4.226 -33.955 1.00 0.00 H new ATOM 0 HG22 ILE B 49 86.440 -4.125 -32.910 1.00 0.00 H new ATOM 0 HG23 ILE B 49 86.629 -4.197 -34.678 1.00 0.00 H new ATOM 0 HD11 ILE B 49 83.587 -6.929 -35.973 1.00 0.00 H new ATOM 0 HD12 ILE B 49 83.571 -7.020 -34.196 1.00 0.00 H new ATOM 0 HD13 ILE B 49 83.750 -5.445 -35.005 1.00 0.00 H new ATOM 892 N LYS B 50 88.494 -5.041 -35.225 1.00 0.00 N ATOM 893 CA LYS B 50 89.242 -4.688 -36.432 1.00 0.00 C ATOM 894 C LYS B 50 90.520 -5.519 -36.546 1.00 0.00 C ATOM 895 O LYS B 50 90.788 -6.123 -37.584 1.00 0.00 O ATOM 896 CB LYS B 50 89.604 -3.197 -36.402 1.00 0.00 C ATOM 897 CG LYS B 50 88.352 -2.340 -36.682 1.00 0.00 C ATOM 898 CD LYS B 50 88.141 -2.168 -38.203 1.00 0.00 C ATOM 899 CE LYS B 50 88.872 -0.914 -38.706 1.00 0.00 C ATOM 900 NZ LYS B 50 90.166 -0.762 -37.981 1.00 0.00 N ATOM 0 H LYS B 50 88.110 -4.246 -34.714 1.00 0.00 H new ATOM 0 HA LYS B 50 88.612 -4.898 -37.297 1.00 0.00 H new ATOM 0 HB2 LYS B 50 90.022 -2.936 -35.430 1.00 0.00 H new ATOM 0 HB3 LYS B 50 90.372 -2.986 -37.146 1.00 0.00 H new ATOM 0 HG2 LYS B 50 87.475 -2.812 -36.239 1.00 0.00 H new ATOM 0 HG3 LYS B 50 88.461 -1.363 -36.211 1.00 0.00 H new ATOM 0 HD2 LYS B 50 88.510 -3.048 -38.730 1.00 0.00 H new ATOM 0 HD3 LYS B 50 87.076 -2.089 -38.422 1.00 0.00 H new ATOM 0 HE2 LYS B 50 89.052 -0.992 -39.778 1.00 0.00 H new ATOM 0 HE3 LYS B 50 88.251 -0.032 -38.550 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 90.650 0.097 -38.312 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 89.985 -0.686 -36.960 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 90.767 -1.591 -38.165 1.00 0.00 H new ATOM 914 N ARG B 51 91.291 -5.542 -35.491 1.00 0.00 N ATOM 915 CA ARG B 51 92.539 -6.303 -35.478 1.00 0.00 C ATOM 916 C ARG B 51 92.275 -7.761 -35.113 1.00 0.00 C ATOM 917 O ARG B 51 92.971 -8.337 -34.276 1.00 0.00 O ATOM 918 CB ARG B 51 93.510 -5.691 -34.467 1.00 0.00 C ATOM 919 CG ARG B 51 94.003 -4.340 -34.989 1.00 0.00 C ATOM 920 CD ARG B 51 94.952 -3.712 -33.967 1.00 0.00 C ATOM 921 NE ARG B 51 95.429 -2.422 -34.449 1.00 0.00 N ATOM 922 CZ ARG B 51 96.344 -2.345 -35.377 1.00 0.00 C ATOM 923 NH1 ARG B 51 96.849 -3.434 -35.888 1.00 0.00 N ATOM 924 NH2 ARG B 51 96.754 -1.178 -35.795 1.00 0.00 N ATOM 0 H ARG B 51 91.088 -5.046 -34.623 1.00 0.00 H new ATOM 0 HA ARG B 51 92.977 -6.264 -36.475 1.00 0.00 H new ATOM 0 HB2 ARG B 51 93.016 -5.563 -33.504 1.00 0.00 H new ATOM 0 HB3 ARG B 51 94.354 -6.361 -34.306 1.00 0.00 H new ATOM 0 HG2 ARG B 51 94.514 -4.472 -35.943 1.00 0.00 H new ATOM 0 HG3 ARG B 51 93.157 -3.677 -35.170 1.00 0.00 H new ATOM 0 HD2 ARG B 51 94.439 -3.585 -33.014 1.00 0.00 H new ATOM 0 HD3 ARG B 51 95.797 -4.377 -33.788 1.00 0.00 H new ATOM 0 HE ARG B 51 95.041 -1.565 -34.055 1.00 0.00 H new ATOM 0 HH11 ARG B 51 96.529 -4.346 -35.562 1.00 0.00 H new ATOM 0 HH12 ARG B 51 97.564 -3.373 -36.613 1.00 0.00 H new ATOM 0 HH21 ARG B 51 96.359 -0.326 -35.396 1.00 0.00 H new ATOM 0 HH22 ARG B 51 97.469 -1.118 -36.520 1.00 0.00 H new ATOM 938 N GLY B 52 91.285 -8.340 -35.734 1.00 0.00 N ATOM 939 CA GLY B 52 90.938 -9.731 -35.468 1.00 0.00 C ATOM 940 C GLY B 52 89.846 -10.211 -36.417 1.00 0.00 C ATOM 0 H GLY B 52 90.697 -7.881 -36.430 1.00 0.00 H new ATOM 0 HA2 GLY B 52 91.823 -10.358 -35.579 1.00 0.00 H new ATOM 0 HA3 GLY B 52 90.600 -9.835 -34.437 1.00 0.00 H new ATOM 945 N SER C 23 94.547 10.100 10.177 1.00 0.00 N ATOM 946 CA SER C 23 93.557 10.917 9.419 1.00 0.00 C ATOM 947 C SER C 23 93.173 10.187 8.136 1.00 0.00 C ATOM 948 O SER C 23 93.153 10.779 7.057 1.00 0.00 O ATOM 949 CB SER C 23 94.174 12.275 9.081 1.00 0.00 C ATOM 950 OG SER C 23 93.170 13.127 8.544 1.00 0.00 O ATOM 0 HA SER C 23 92.664 11.069 10.025 1.00 0.00 H new ATOM 0 HB2 SER C 23 94.607 12.723 9.975 1.00 0.00 H new ATOM 0 HB3 SER C 23 94.984 12.151 8.362 1.00 0.00 H new ATOM 0 HG SER C 23 92.740 12.686 7.782 1.00 0.00 H new ATOM 955 N ASP C 24 92.866 8.919 8.263 1.00 0.00 N ATOM 956 CA ASP C 24 92.475 8.108 7.117 1.00 0.00 C ATOM 957 C ASP C 24 93.334 8.437 5.904 1.00 0.00 C ATOM 958 O ASP C 24 92.815 8.757 4.834 1.00 0.00 O ATOM 959 CB ASP C 24 91.000 8.355 6.785 1.00 0.00 C ATOM 960 CG ASP C 24 90.740 9.850 6.637 1.00 0.00 C ATOM 961 OD1 ASP C 24 91.031 10.380 5.577 1.00 0.00 O ATOM 962 OD2 ASP C 24 90.254 10.445 7.584 1.00 0.00 O ATOM 0 H ASP C 24 92.877 8.417 9.151 1.00 0.00 H new ATOM 0 HA ASP C 24 92.621 7.058 7.372 1.00 0.00 H new ATOM 0 HB2 ASP C 24 90.735 7.839 5.862 1.00 0.00 H new ATOM 0 HB3 ASP C 24 90.368 7.944 7.572 1.00 0.00 H new ATOM 967 N PRO C 25 94.631 8.364 6.048 1.00 0.00 N ATOM 968 CA PRO C 25 95.570 8.661 4.934 1.00 0.00 C ATOM 969 C PRO C 25 95.392 7.657 3.802 1.00 0.00 C ATOM 970 O PRO C 25 95.807 7.894 2.667 1.00 0.00 O ATOM 971 CB PRO C 25 96.963 8.552 5.586 1.00 0.00 C ATOM 972 CG PRO C 25 96.763 7.695 6.797 1.00 0.00 C ATOM 973 CD PRO C 25 95.343 7.983 7.282 1.00 0.00 C ATOM 0 HA PRO C 25 95.407 9.639 4.482 1.00 0.00 H new ATOM 0 HB2 PRO C 25 97.684 8.105 4.902 1.00 0.00 H new ATOM 0 HB3 PRO C 25 97.349 9.535 5.858 1.00 0.00 H new ATOM 0 HG2 PRO C 25 96.886 6.640 6.554 1.00 0.00 H new ATOM 0 HG3 PRO C 25 97.495 7.932 7.569 1.00 0.00 H new ATOM 0 HD2 PRO C 25 94.893 7.108 7.751 1.00 0.00 H new ATOM 0 HD3 PRO C 25 95.325 8.785 8.020 1.00 0.00 H new ATOM 981 N LEU C 26 94.793 6.545 4.128 1.00 0.00 N ATOM 982 CA LEU C 26 94.570 5.486 3.146 1.00 0.00 C ATOM 983 C LEU C 26 93.667 5.960 2.004 1.00 0.00 C ATOM 984 O LEU C 26 93.889 5.619 0.842 1.00 0.00 O ATOM 985 CB LEU C 26 93.919 4.272 3.835 1.00 0.00 C ATOM 986 CG LEU C 26 94.979 3.459 4.585 1.00 0.00 C ATOM 987 CD1 LEU C 26 95.745 4.373 5.542 1.00 0.00 C ATOM 988 CD2 LEU C 26 94.293 2.345 5.381 1.00 0.00 C ATOM 0 H LEU C 26 94.445 6.336 5.064 1.00 0.00 H new ATOM 0 HA LEU C 26 95.537 5.209 2.726 1.00 0.00 H new ATOM 0 HB2 LEU C 26 93.149 4.608 4.530 1.00 0.00 H new ATOM 0 HB3 LEU C 26 93.426 3.644 3.093 1.00 0.00 H new ATOM 0 HG LEU C 26 95.676 3.022 3.870 1.00 0.00 H new ATOM 0 HD11 LEU C 26 96.498 3.793 6.074 1.00 0.00 H new ATOM 0 HD12 LEU C 26 96.232 5.167 4.976 1.00 0.00 H new ATOM 0 HD13 LEU C 26 95.051 4.812 6.259 1.00 0.00 H new ATOM 0 HD21 LEU C 26 95.044 1.764 5.916 1.00 0.00 H new ATOM 0 HD22 LEU C 26 93.597 2.784 6.096 1.00 0.00 H new ATOM 0 HD23 LEU C 26 93.748 1.692 4.699 1.00 0.00 H new ATOM 1000 N VAL C 27 92.652 6.704 2.341 1.00 0.00 N ATOM 1001 CA VAL C 27 91.695 7.190 1.347 1.00 0.00 C ATOM 1002 C VAL C 27 92.287 8.251 0.418 1.00 0.00 C ATOM 1003 O VAL C 27 92.085 8.203 -0.796 1.00 0.00 O ATOM 1004 CB VAL C 27 90.483 7.791 2.069 1.00 0.00 C ATOM 1005 CG1 VAL C 27 89.484 8.341 1.049 1.00 0.00 C ATOM 1006 CG2 VAL C 27 89.797 6.716 2.912 1.00 0.00 C ATOM 0 H VAL C 27 92.452 6.997 3.297 1.00 0.00 H new ATOM 0 HA VAL C 27 91.411 6.336 0.732 1.00 0.00 H new ATOM 0 HB VAL C 27 90.825 8.600 2.714 1.00 0.00 H new ATOM 0 HG11 VAL C 27 88.627 8.766 1.572 1.00 0.00 H new ATOM 0 HG12 VAL C 27 89.964 9.115 0.451 1.00 0.00 H new ATOM 0 HG13 VAL C 27 89.148 7.534 0.397 1.00 0.00 H new ATOM 0 HG21 VAL C 27 88.937 7.148 3.423 1.00 0.00 H new ATOM 0 HG22 VAL C 27 89.465 5.904 2.266 1.00 0.00 H new ATOM 0 HG23 VAL C 27 90.500 6.328 3.650 1.00 0.00 H new ATOM 1016 N VAL C 28 92.981 9.199 0.979 1.00 0.00 N ATOM 1017 CA VAL C 28 93.565 10.276 0.181 1.00 0.00 C ATOM 1018 C VAL C 28 94.749 9.795 -0.656 1.00 0.00 C ATOM 1019 O VAL C 28 95.040 10.359 -1.711 1.00 0.00 O ATOM 1020 CB VAL C 28 93.983 11.449 1.091 1.00 0.00 C ATOM 1021 CG1 VAL C 28 95.351 11.174 1.725 1.00 0.00 C ATOM 1022 CG2 VAL C 28 94.054 12.744 0.265 1.00 0.00 C ATOM 0 H VAL C 28 93.164 9.262 1.980 1.00 0.00 H new ATOM 0 HA VAL C 28 92.800 10.620 -0.515 1.00 0.00 H new ATOM 0 HB VAL C 28 93.242 11.558 1.883 1.00 0.00 H new ATOM 0 HG11 VAL C 28 95.631 12.012 2.364 1.00 0.00 H new ATOM 0 HG12 VAL C 28 95.299 10.264 2.322 1.00 0.00 H new ATOM 0 HG13 VAL C 28 96.098 11.051 0.940 1.00 0.00 H new ATOM 0 HG21 VAL C 28 94.350 13.571 0.910 1.00 0.00 H new ATOM 0 HG22 VAL C 28 94.787 12.627 -0.533 1.00 0.00 H new ATOM 0 HG23 VAL C 28 93.076 12.953 -0.168 1.00 0.00 H new ATOM 1032 N ALA C 29 95.441 8.804 -0.172 1.00 0.00 N ATOM 1033 CA ALA C 29 96.618 8.307 -0.875 1.00 0.00 C ATOM 1034 C ALA C 29 96.276 7.604 -2.186 1.00 0.00 C ATOM 1035 O ALA C 29 96.860 7.918 -3.220 1.00 0.00 O ATOM 1036 CB ALA C 29 97.387 7.341 0.027 1.00 0.00 C ATOM 0 H ALA C 29 95.224 8.319 0.699 1.00 0.00 H new ATOM 0 HA ALA C 29 97.229 9.176 -1.121 1.00 0.00 H new ATOM 0 HB1 ALA C 29 98.266 6.971 -0.501 1.00 0.00 H new ATOM 0 HB2 ALA C 29 97.700 7.860 0.933 1.00 0.00 H new ATOM 0 HB3 ALA C 29 96.744 6.502 0.293 1.00 0.00 H new ATOM 1042 N ALA C 30 95.375 6.658 -2.158 1.00 0.00 N ATOM 1043 CA ALA C 30 95.034 5.941 -3.369 1.00 0.00 C ATOM 1044 C ALA C 30 94.239 6.837 -4.315 1.00 0.00 C ATOM 1045 O ALA C 30 94.284 6.676 -5.536 1.00 0.00 O ATOM 1046 CB ALA C 30 94.251 4.691 -2.993 1.00 0.00 C ATOM 0 H ALA C 30 94.867 6.365 -1.324 1.00 0.00 H new ATOM 0 HA ALA C 30 95.942 5.645 -3.895 1.00 0.00 H new ATOM 0 HB1 ALA C 30 93.988 4.141 -3.897 1.00 0.00 H new ATOM 0 HB2 ALA C 30 94.862 4.059 -2.349 1.00 0.00 H new ATOM 0 HB3 ALA C 30 93.342 4.977 -2.464 1.00 0.00 H new ATOM 1052 N SER C 31 93.521 7.757 -3.740 1.00 0.00 N ATOM 1053 CA SER C 31 92.705 8.683 -4.512 1.00 0.00 C ATOM 1054 C SER C 31 93.527 9.359 -5.611 1.00 0.00 C ATOM 1055 O SER C 31 93.108 9.403 -6.767 1.00 0.00 O ATOM 1056 CB SER C 31 92.128 9.746 -3.583 1.00 0.00 C ATOM 1057 OG SER C 31 91.374 10.679 -4.347 1.00 0.00 O ATOM 0 H SER C 31 93.476 7.896 -2.731 1.00 0.00 H new ATOM 0 HA SER C 31 91.899 8.120 -4.983 1.00 0.00 H new ATOM 0 HB2 SER C 31 91.494 9.280 -2.828 1.00 0.00 H new ATOM 0 HB3 SER C 31 92.932 10.257 -3.053 1.00 0.00 H new ATOM 0 HG SER C 31 90.649 11.042 -3.797 1.00 0.00 H new ATOM 1063 N ILE C 32 94.654 9.912 -5.247 1.00 0.00 N ATOM 1064 CA ILE C 32 95.491 10.625 -6.211 1.00 0.00 C ATOM 1065 C ILE C 32 95.683 9.820 -7.499 1.00 0.00 C ATOM 1066 O ILE C 32 95.860 10.393 -8.573 1.00 0.00 O ATOM 1067 CB ILE C 32 96.860 10.939 -5.581 1.00 0.00 C ATOM 1068 CG1 ILE C 32 97.568 12.044 -6.394 1.00 0.00 C ATOM 1069 CG2 ILE C 32 97.736 9.672 -5.569 1.00 0.00 C ATOM 1070 CD1 ILE C 32 96.987 13.428 -6.060 1.00 0.00 C ATOM 0 H ILE C 32 95.024 9.890 -4.297 1.00 0.00 H new ATOM 0 HA ILE C 32 94.983 11.554 -6.472 1.00 0.00 H new ATOM 0 HB ILE C 32 96.708 11.282 -4.558 1.00 0.00 H new ATOM 0 HG12 ILE C 32 98.636 12.032 -6.178 1.00 0.00 H new ATOM 0 HG13 ILE C 32 97.456 11.846 -7.460 1.00 0.00 H new ATOM 0 HG21 ILE C 32 98.703 9.902 -5.122 1.00 0.00 H new ATOM 0 HG22 ILE C 32 97.243 8.894 -4.986 1.00 0.00 H new ATOM 0 HG23 ILE C 32 97.883 9.322 -6.591 1.00 0.00 H new ATOM 0 HD11 ILE C 32 97.502 14.190 -6.645 1.00 0.00 H new ATOM 0 HD12 ILE C 32 95.924 13.444 -6.299 1.00 0.00 H new ATOM 0 HD13 ILE C 32 97.123 13.633 -4.998 1.00 0.00 H new ATOM 1082 N ILE C 33 95.640 8.523 -7.391 1.00 0.00 N ATOM 1083 CA ILE C 33 95.806 7.672 -8.566 1.00 0.00 C ATOM 1084 C ILE C 33 94.653 7.885 -9.551 1.00 0.00 C ATOM 1085 O ILE C 33 94.856 7.929 -10.765 1.00 0.00 O ATOM 1086 CB ILE C 33 95.865 6.196 -8.151 1.00 0.00 C ATOM 1087 CG1 ILE C 33 96.994 5.992 -7.134 1.00 0.00 C ATOM 1088 CG2 ILE C 33 96.131 5.328 -9.383 1.00 0.00 C ATOM 1089 CD1 ILE C 33 96.940 4.563 -6.584 1.00 0.00 C ATOM 0 H ILE C 33 95.493 8.021 -6.515 1.00 0.00 H new ATOM 0 HA ILE C 33 96.742 7.943 -9.054 1.00 0.00 H new ATOM 0 HB ILE C 33 94.914 5.910 -7.701 1.00 0.00 H new ATOM 0 HG12 ILE C 33 97.959 6.174 -7.606 1.00 0.00 H new ATOM 0 HG13 ILE C 33 96.897 6.710 -6.319 1.00 0.00 H new ATOM 0 HG21 ILE C 33 96.173 4.280 -9.087 1.00 0.00 H new ATOM 0 HG22 ILE C 33 95.329 5.469 -10.107 1.00 0.00 H new ATOM 0 HG23 ILE C 33 97.081 5.616 -9.833 1.00 0.00 H new ATOM 0 HD11 ILE C 33 97.744 4.421 -5.861 1.00 0.00 H new ATOM 0 HD12 ILE C 33 95.980 4.397 -6.096 1.00 0.00 H new ATOM 0 HD13 ILE C 33 97.058 3.853 -7.403 1.00 0.00 H new ATOM 1101 N GLY C 34 93.463 7.971 -9.024 1.00 0.00 N ATOM 1102 CA GLY C 34 92.266 8.127 -9.851 1.00 0.00 C ATOM 1103 C GLY C 34 92.411 9.220 -10.915 1.00 0.00 C ATOM 1104 O GLY C 34 92.132 8.978 -12.088 1.00 0.00 O ATOM 0 H GLY C 34 93.281 7.937 -8.021 1.00 0.00 H new ATOM 0 HA2 GLY C 34 92.043 7.179 -10.340 1.00 0.00 H new ATOM 0 HA3 GLY C 34 91.416 8.362 -9.210 1.00 0.00 H new ATOM 1108 N ILE C 35 92.826 10.395 -10.534 1.00 0.00 N ATOM 1109 CA ILE C 35 92.971 11.476 -11.511 1.00 0.00 C ATOM 1110 C ILE C 35 94.147 11.214 -12.453 1.00 0.00 C ATOM 1111 O ILE C 35 94.147 11.658 -13.601 1.00 0.00 O ATOM 1112 CB ILE C 35 93.162 12.824 -10.807 1.00 0.00 C ATOM 1113 CG1 ILE C 35 94.369 12.760 -9.868 1.00 0.00 C ATOM 1114 CG2 ILE C 35 91.907 13.160 -9.999 1.00 0.00 C ATOM 1115 CD1 ILE C 35 94.703 14.172 -9.380 1.00 0.00 C ATOM 0 H ILE C 35 93.070 10.642 -9.575 1.00 0.00 H new ATOM 0 HA ILE C 35 92.054 11.511 -12.100 1.00 0.00 H new ATOM 0 HB ILE C 35 93.334 13.596 -11.557 1.00 0.00 H new ATOM 0 HG12 ILE C 35 94.151 12.111 -9.020 1.00 0.00 H new ATOM 0 HG13 ILE C 35 95.226 12.329 -10.386 1.00 0.00 H new ATOM 0 HG21 ILE C 35 92.043 14.119 -9.498 1.00 0.00 H new ATOM 0 HG22 ILE C 35 91.048 13.218 -10.668 1.00 0.00 H new ATOM 0 HG23 ILE C 35 91.735 12.383 -9.254 1.00 0.00 H new ATOM 0 HD11 ILE C 35 95.562 14.132 -8.711 1.00 0.00 H new ATOM 0 HD12 ILE C 35 94.938 14.806 -10.235 1.00 0.00 H new ATOM 0 HD13 ILE C 35 93.847 14.585 -8.847 1.00 0.00 H new ATOM 1127 N LEU C 36 95.134 10.522 -11.959 1.00 0.00 N ATOM 1128 CA LEU C 36 96.326 10.219 -12.747 1.00 0.00 C ATOM 1129 C LEU C 36 95.990 9.421 -14.009 1.00 0.00 C ATOM 1130 O LEU C 36 96.674 9.547 -15.026 1.00 0.00 O ATOM 1131 CB LEU C 36 97.317 9.420 -11.886 1.00 0.00 C ATOM 1132 CG LEU C 36 98.742 9.512 -12.478 1.00 0.00 C ATOM 1133 CD1 LEU C 36 99.446 10.783 -11.983 1.00 0.00 C ATOM 1134 CD2 LEU C 36 99.563 8.291 -12.044 1.00 0.00 C ATOM 0 H LEU C 36 95.150 10.149 -11.010 1.00 0.00 H new ATOM 0 HA LEU C 36 96.769 11.165 -13.059 1.00 0.00 H new ATOM 0 HB2 LEU C 36 97.315 9.805 -10.866 1.00 0.00 H new ATOM 0 HB3 LEU C 36 97.005 8.377 -11.834 1.00 0.00 H new ATOM 0 HG LEU C 36 98.663 9.542 -13.565 1.00 0.00 H new ATOM 0 HD11 LEU C 36 100.448 10.833 -12.409 1.00 0.00 H new ATOM 0 HD12 LEU C 36 98.876 11.659 -12.293 1.00 0.00 H new ATOM 0 HD13 LEU C 36 99.515 10.761 -10.895 1.00 0.00 H new ATOM 0 HD21 LEU C 36 100.567 8.360 -12.463 1.00 0.00 H new ATOM 0 HD22 LEU C 36 99.625 8.263 -10.956 1.00 0.00 H new ATOM 0 HD23 LEU C 36 99.081 7.382 -12.404 1.00 0.00 H new ATOM 1146 N HIS C 37 94.969 8.606 -13.945 1.00 0.00 N ATOM 1147 CA HIS C 37 94.587 7.797 -15.103 1.00 0.00 C ATOM 1148 C HIS C 37 93.965 8.647 -16.213 1.00 0.00 C ATOM 1149 O HIS C 37 94.138 8.351 -17.396 1.00 0.00 O ATOM 1150 CB HIS C 37 93.635 6.658 -14.680 1.00 0.00 C ATOM 1151 CG HIS C 37 92.211 7.147 -14.535 1.00 0.00 C ATOM 1152 ND1 HIS C 37 91.562 7.875 -15.522 1.00 0.00 N ATOM 1153 CD2 HIS C 37 91.292 6.993 -13.525 1.00 0.00 C ATOM 1154 CE1 HIS C 37 90.314 8.128 -15.089 1.00 0.00 C ATOM 1155 NE2 HIS C 37 90.097 7.612 -13.877 1.00 0.00 N ATOM 0 H HIS C 37 94.385 8.476 -13.119 1.00 0.00 H new ATOM 0 HA HIS C 37 95.497 7.355 -15.509 1.00 0.00 H new ATOM 0 HB2 HIS C 37 93.672 5.858 -15.420 1.00 0.00 H new ATOM 0 HB3 HIS C 37 93.972 6.233 -13.735 1.00 0.00 H new ATOM 0 HD2 HIS C 37 91.471 6.470 -12.597 1.00 0.00 H new ATOM 0 HE1 HIS C 37 89.577 8.681 -15.653 1.00 0.00 H new ATOM 0 HE2 HIS C 37 89.239 7.661 -13.327 1.00 0.00 H new ATOM 1164 N PHE C 38 93.232 9.664 -15.840 1.00 0.00 N ATOM 1165 CA PHE C 38 92.573 10.515 -16.831 1.00 0.00 C ATOM 1166 C PHE C 38 93.581 11.215 -17.742 1.00 0.00 C ATOM 1167 O PHE C 38 93.445 11.177 -18.964 1.00 0.00 O ATOM 1168 CB PHE C 38 91.699 11.563 -16.140 1.00 0.00 C ATOM 1169 CG PHE C 38 90.945 12.351 -17.189 1.00 0.00 C ATOM 1170 CD1 PHE C 38 91.554 13.451 -17.806 1.00 0.00 C ATOM 1171 CD2 PHE C 38 89.642 11.978 -17.551 1.00 0.00 C ATOM 1172 CE1 PHE C 38 90.863 14.178 -18.782 1.00 0.00 C ATOM 1173 CE2 PHE C 38 88.952 12.708 -18.528 1.00 0.00 C ATOM 1174 CZ PHE C 38 89.562 13.807 -19.144 1.00 0.00 C ATOM 0 H PHE C 38 93.069 9.932 -14.869 1.00 0.00 H new ATOM 0 HA PHE C 38 91.951 9.866 -17.447 1.00 0.00 H new ATOM 0 HB2 PHE C 38 90.999 11.079 -15.459 1.00 0.00 H new ATOM 0 HB3 PHE C 38 92.317 12.231 -15.540 1.00 0.00 H new ATOM 0 HD1 PHE C 38 92.557 13.738 -17.528 1.00 0.00 H new ATOM 0 HD2 PHE C 38 89.171 11.129 -17.077 1.00 0.00 H new ATOM 0 HE1 PHE C 38 91.334 15.026 -19.257 1.00 0.00 H new ATOM 0 HE2 PHE C 38 87.948 12.422 -18.806 1.00 0.00 H new ATOM 0 HZ PHE C 38 89.030 14.368 -19.898 1.00 0.00 H new ATOM 1184 N ILE C 39 94.567 11.851 -17.167 1.00 0.00 N ATOM 1185 CA ILE C 39 95.561 12.554 -17.974 1.00 0.00 C ATOM 1186 C ILE C 39 96.339 11.566 -18.834 1.00 0.00 C ATOM 1187 O ILE C 39 96.777 11.898 -19.932 1.00 0.00 O ATOM 1188 CB ILE C 39 96.523 13.352 -17.078 1.00 0.00 C ATOM 1189 CG1 ILE C 39 97.617 14.020 -17.930 1.00 0.00 C ATOM 1190 CG2 ILE C 39 97.180 12.414 -16.064 1.00 0.00 C ATOM 1191 CD1 ILE C 39 96.986 14.880 -19.032 1.00 0.00 C ATOM 0 H ILE C 39 94.713 11.904 -16.159 1.00 0.00 H new ATOM 0 HA ILE C 39 95.039 13.253 -18.627 1.00 0.00 H new ATOM 0 HB ILE C 39 95.955 14.122 -16.556 1.00 0.00 H new ATOM 0 HG12 ILE C 39 98.253 14.638 -17.297 1.00 0.00 H new ATOM 0 HG13 ILE C 39 98.256 13.258 -18.376 1.00 0.00 H new ATOM 0 HG21 ILE C 39 97.861 12.982 -15.431 1.00 0.00 H new ATOM 0 HG22 ILE C 39 96.411 11.950 -15.446 1.00 0.00 H new ATOM 0 HG23 ILE C 39 97.737 11.640 -16.592 1.00 0.00 H new ATOM 0 HD11 ILE C 39 97.773 15.345 -19.626 1.00 0.00 H new ATOM 0 HD12 ILE C 39 96.369 14.252 -19.675 1.00 0.00 H new ATOM 0 HD13 ILE C 39 96.367 15.654 -18.579 1.00 0.00 H new ATOM 1203 N ALA C 40 96.492 10.371 -18.347 1.00 0.00 N ATOM 1204 CA ALA C 40 97.196 9.347 -19.101 1.00 0.00 C ATOM 1205 C ALA C 40 96.334 8.871 -20.270 1.00 0.00 C ATOM 1206 O ALA C 40 96.843 8.539 -21.335 1.00 0.00 O ATOM 1207 CB ALA C 40 97.535 8.165 -18.191 1.00 0.00 C ATOM 0 H ALA C 40 96.145 10.070 -17.436 1.00 0.00 H new ATOM 0 HA ALA C 40 98.121 9.772 -19.491 1.00 0.00 H new ATOM 0 HB1 ALA C 40 98.062 7.403 -18.765 1.00 0.00 H new ATOM 0 HB2 ALA C 40 98.169 8.506 -17.373 1.00 0.00 H new ATOM 0 HB3 ALA C 40 96.616 7.742 -17.786 1.00 0.00 H new ATOM 1213 N TRP C 41 95.049 8.810 -20.039 1.00 0.00 N ATOM 1214 CA TRP C 41 94.089 8.332 -21.035 1.00 0.00 C ATOM 1215 C TRP C 41 94.281 8.994 -22.399 1.00 0.00 C ATOM 1216 O TRP C 41 94.367 8.311 -23.420 1.00 0.00 O ATOM 1217 CB TRP C 41 92.690 8.633 -20.510 1.00 0.00 C ATOM 1218 CG TRP C 41 91.666 7.940 -21.337 1.00 0.00 C ATOM 1219 CD1 TRP C 41 91.339 8.273 -22.601 1.00 0.00 C ATOM 1220 CD2 TRP C 41 90.827 6.811 -20.971 1.00 0.00 C ATOM 1221 NE1 TRP C 41 90.336 7.422 -23.038 1.00 0.00 N ATOM 1222 CE2 TRP C 41 89.991 6.500 -22.067 1.00 0.00 C ATOM 1223 CE3 TRP C 41 90.714 6.038 -19.803 1.00 0.00 C ATOM 1224 CZ2 TRP C 41 89.069 5.452 -22.003 1.00 0.00 C ATOM 1225 CZ3 TRP C 41 89.790 4.985 -19.736 1.00 0.00 C ATOM 1226 CH2 TRP C 41 88.971 4.693 -20.831 1.00 0.00 C ATOM 0 H TRP C 41 94.623 9.089 -19.155 1.00 0.00 H new ATOM 0 HA TRP C 41 94.241 7.263 -21.183 1.00 0.00 H new ATOM 0 HB2 TRP C 41 92.607 8.311 -19.472 1.00 0.00 H new ATOM 0 HB3 TRP C 41 92.512 9.708 -20.525 1.00 0.00 H new ATOM 0 HD1 TRP C 41 91.784 9.070 -23.178 1.00 0.00 H new ATOM 0 HE1 TRP C 41 89.906 7.470 -23.962 1.00 0.00 H new ATOM 0 HE3 TRP C 41 91.342 6.256 -18.952 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 88.437 5.230 -22.850 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 89.711 4.397 -18.834 1.00 0.00 H new ATOM 0 HH2 TRP C 41 88.262 3.881 -20.772 1.00 0.00 H new ATOM 1237 N THR C 42 94.336 10.291 -22.414 1.00 0.00 N ATOM 1238 CA THR C 42 94.505 11.028 -23.662 1.00 0.00 C ATOM 1239 C THR C 42 95.700 10.513 -24.473 1.00 0.00 C ATOM 1240 O THR C 42 95.720 10.652 -25.695 1.00 0.00 O ATOM 1241 CB THR C 42 94.678 12.525 -23.384 1.00 0.00 C ATOM 1242 OG1 THR C 42 95.321 13.138 -24.493 1.00 0.00 O ATOM 1243 CG2 THR C 42 95.527 12.714 -22.135 1.00 0.00 C ATOM 0 H THR C 42 94.268 10.876 -21.582 1.00 0.00 H new ATOM 0 HA THR C 42 93.602 10.870 -24.252 1.00 0.00 H new ATOM 0 HB THR C 42 93.701 12.984 -23.230 1.00 0.00 H new ATOM 0 HG1 THR C 42 95.432 14.096 -24.319 1.00 0.00 H new ATOM 0 HG21 THR C 42 95.650 13.779 -21.937 1.00 0.00 H new ATOM 0 HG22 THR C 42 95.034 12.241 -21.285 1.00 0.00 H new ATOM 0 HG23 THR C 42 96.505 12.258 -22.287 1.00 0.00 H new ATOM 1251 N ILE C 43 96.685 9.948 -23.816 1.00 0.00 N ATOM 1252 CA ILE C 43 97.870 9.451 -24.523 1.00 0.00 C ATOM 1253 C ILE C 43 97.529 8.234 -25.399 1.00 0.00 C ATOM 1254 O ILE C 43 98.057 8.090 -26.499 1.00 0.00 O ATOM 1255 CB ILE C 43 98.985 9.112 -23.490 1.00 0.00 C ATOM 1256 CG1 ILE C 43 100.369 9.449 -24.069 1.00 0.00 C ATOM 1257 CG2 ILE C 43 98.968 7.625 -23.098 1.00 0.00 C ATOM 1258 CD1 ILE C 43 101.457 9.123 -23.035 1.00 0.00 C ATOM 0 H ILE C 43 96.703 9.816 -22.805 1.00 0.00 H new ATOM 0 HA ILE C 43 98.235 10.230 -25.192 1.00 0.00 H new ATOM 0 HB ILE C 43 98.789 9.712 -22.601 1.00 0.00 H new ATOM 0 HG12 ILE C 43 100.540 8.880 -24.983 1.00 0.00 H new ATOM 0 HG13 ILE C 43 100.414 10.504 -24.338 1.00 0.00 H new ATOM 0 HG21 ILE C 43 99.761 7.430 -22.376 1.00 0.00 H new ATOM 0 HG22 ILE C 43 98.004 7.377 -22.654 1.00 0.00 H new ATOM 0 HG23 ILE C 43 99.127 7.013 -23.986 1.00 0.00 H new ATOM 0 HD11 ILE C 43 102.436 9.363 -23.449 1.00 0.00 H new ATOM 0 HD12 ILE C 43 101.290 9.712 -22.133 1.00 0.00 H new ATOM 0 HD13 ILE C 43 101.418 8.062 -22.788 1.00 0.00 H new ATOM 1270 N GLY C 44 96.666 7.382 -24.907 1.00 0.00 N ATOM 1271 CA GLY C 44 96.257 6.180 -25.644 1.00 0.00 C ATOM 1272 C GLY C 44 95.377 6.535 -26.843 1.00 0.00 C ATOM 1273 O GLY C 44 95.351 5.820 -27.846 1.00 0.00 O ATOM 0 H GLY C 44 96.222 7.486 -23.995 1.00 0.00 H new ATOM 0 HA2 GLY C 44 97.141 5.642 -25.986 1.00 0.00 H new ATOM 0 HA3 GLY C 44 95.714 5.510 -24.978 1.00 0.00 H new ATOM 1277 N HIS C 45 94.671 7.616 -26.716 1.00 0.00 N ATOM 1278 CA HIS C 45 93.772 8.080 -27.772 1.00 0.00 C ATOM 1279 C HIS C 45 94.507 8.316 -29.096 1.00 0.00 C ATOM 1280 O HIS C 45 93.904 8.234 -30.165 1.00 0.00 O ATOM 1281 CB HIS C 45 93.078 9.369 -27.352 1.00 0.00 C ATOM 1282 CG HIS C 45 92.077 9.738 -28.410 1.00 0.00 C ATOM 1283 ND1 HIS C 45 92.396 10.573 -29.470 1.00 0.00 N ATOM 1284 CD2 HIS C 45 90.765 9.377 -28.598 1.00 0.00 C ATOM 1285 CE1 HIS C 45 91.298 10.684 -30.243 1.00 0.00 C ATOM 1286 NE2 HIS C 45 90.277 9.976 -29.756 1.00 0.00 N ATOM 0 H HIS C 45 94.689 8.212 -25.888 1.00 0.00 H new ATOM 0 HA HIS C 45 93.035 7.292 -27.927 1.00 0.00 H new ATOM 0 HB2 HIS C 45 92.582 9.236 -26.391 1.00 0.00 H new ATOM 0 HB3 HIS C 45 93.808 10.169 -27.226 1.00 0.00 H new ATOM 0 HD2 HIS C 45 90.199 8.728 -27.947 1.00 0.00 H new ATOM 0 HE1 HIS C 45 91.250 11.274 -31.146 1.00 0.00 H new ATOM 0 HE2 HIS C 45 89.339 9.892 -30.148 1.00 0.00 H new ATOM 1295 N LEU C 46 95.766 8.646 -29.023 1.00 0.00 N ATOM 1296 CA LEU C 46 96.540 8.940 -30.227 1.00 0.00 C ATOM 1297 C LEU C 46 96.309 7.903 -31.327 1.00 0.00 C ATOM 1298 O LEU C 46 96.346 8.247 -32.510 1.00 0.00 O ATOM 1299 CB LEU C 46 98.048 9.105 -29.889 1.00 0.00 C ATOM 1300 CG LEU C 46 98.841 7.767 -29.686 1.00 0.00 C ATOM 1301 CD1 LEU C 46 98.051 6.716 -28.882 1.00 0.00 C ATOM 1302 CD2 LEU C 46 99.301 7.168 -31.032 1.00 0.00 C ATOM 0 H LEU C 46 96.290 8.722 -28.151 1.00 0.00 H new ATOM 0 HA LEU C 46 96.184 9.891 -30.623 1.00 0.00 H new ATOM 0 HB2 LEU C 46 98.523 9.671 -30.690 1.00 0.00 H new ATOM 0 HB3 LEU C 46 98.137 9.702 -28.981 1.00 0.00 H new ATOM 0 HG LEU C 46 99.721 8.032 -29.100 1.00 0.00 H new ATOM 0 HD11 LEU C 46 98.652 5.813 -28.775 1.00 0.00 H new ATOM 0 HD12 LEU C 46 97.816 7.114 -27.895 1.00 0.00 H new ATOM 0 HD13 LEU C 46 97.126 6.476 -29.407 1.00 0.00 H new ATOM 0 HD21 LEU C 46 99.847 6.242 -30.851 1.00 0.00 H new ATOM 0 HD22 LEU C 46 98.431 6.960 -31.654 1.00 0.00 H new ATOM 0 HD23 LEU C 46 99.951 7.878 -31.543 1.00 0.00 H new ATOM 1314 N ASN C 47 96.064 6.673 -30.978 1.00 0.00 N ATOM 1315 CA ASN C 47 95.817 5.667 -32.012 1.00 0.00 C ATOM 1316 C ASN C 47 94.494 5.956 -32.743 1.00 0.00 C ATOM 1317 O ASN C 47 94.453 6.010 -33.968 1.00 0.00 O ATOM 1318 CB ASN C 47 95.762 4.270 -31.387 1.00 0.00 C ATOM 1319 CG ASN C 47 97.156 3.836 -30.941 1.00 0.00 C ATOM 1320 OD1 ASN C 47 98.081 3.785 -31.752 1.00 0.00 O ATOM 1321 ND2 ASN C 47 97.362 3.524 -29.689 1.00 0.00 N ATOM 0 H ASN C 47 96.027 6.333 -30.017 1.00 0.00 H new ATOM 0 HA ASN C 47 96.635 5.709 -32.732 1.00 0.00 H new ATOM 0 HB2 ASN C 47 95.084 4.272 -30.534 1.00 0.00 H new ATOM 0 HB3 ASN C 47 95.365 3.556 -32.109 1.00 0.00 H new ATOM 0 HD21 ASN C 47 98.291 3.237 -29.381 1.00 0.00 H new ATOM 0 HD22 ASN C 47 96.594 3.567 -29.020 1.00 0.00 H new ATOM 1328 N GLN C 48 93.435 6.127 -31.993 1.00 0.00 N ATOM 1329 CA GLN C 48 92.117 6.398 -32.569 1.00 0.00 C ATOM 1330 C GLN C 48 92.190 7.384 -33.741 1.00 0.00 C ATOM 1331 O GLN C 48 91.601 7.144 -34.794 1.00 0.00 O ATOM 1332 CB GLN C 48 91.191 6.964 -31.483 1.00 0.00 C ATOM 1333 CG GLN C 48 89.725 6.832 -31.914 1.00 0.00 C ATOM 1334 CD GLN C 48 89.431 7.773 -33.079 1.00 0.00 C ATOM 1335 OE1 GLN C 48 89.903 8.909 -33.095 1.00 0.00 O ATOM 1336 NE2 GLN C 48 88.674 7.364 -34.062 1.00 0.00 N ATOM 0 H GLN C 48 93.448 6.085 -30.974 1.00 0.00 H new ATOM 0 HA GLN C 48 91.724 5.456 -32.952 1.00 0.00 H new ATOM 0 HB2 GLN C 48 91.351 6.432 -30.545 1.00 0.00 H new ATOM 0 HB3 GLN C 48 91.431 8.011 -31.300 1.00 0.00 H new ATOM 0 HG2 GLN C 48 89.516 5.803 -32.206 1.00 0.00 H new ATOM 0 HG3 GLN C 48 89.069 7.065 -31.075 1.00 0.00 H new ATOM 0 HE21 GLN C 48 88.284 6.422 -34.047 1.00 0.00 H new ATOM 0 HE22 GLN C 48 88.473 7.987 -34.844 1.00 0.00 H new ATOM 1345 N ILE C 49 92.874 8.482 -33.554 1.00 0.00 N ATOM 1346 CA ILE C 49 92.970 9.493 -34.609 1.00 0.00 C ATOM 1347 C ILE C 49 93.762 8.981 -35.812 1.00 0.00 C ATOM 1348 O ILE C 49 93.592 9.476 -36.927 1.00 0.00 O ATOM 1349 CB ILE C 49 93.606 10.778 -34.062 1.00 0.00 C ATOM 1350 CG1 ILE C 49 93.812 11.779 -35.205 1.00 0.00 C ATOM 1351 CG2 ILE C 49 94.954 10.462 -33.418 1.00 0.00 C ATOM 1352 CD1 ILE C 49 94.149 13.156 -34.626 1.00 0.00 C ATOM 0 H ILE C 49 93.373 8.711 -32.695 1.00 0.00 H new ATOM 0 HA ILE C 49 91.957 9.713 -34.948 1.00 0.00 H new ATOM 0 HB ILE C 49 92.942 11.209 -33.313 1.00 0.00 H new ATOM 0 HG12 ILE C 49 94.617 11.441 -35.858 1.00 0.00 H new ATOM 0 HG13 ILE C 49 92.911 11.840 -35.815 1.00 0.00 H new ATOM 0 HG21 ILE C 49 95.397 11.380 -33.033 1.00 0.00 H new ATOM 0 HG22 ILE C 49 94.810 9.757 -32.599 1.00 0.00 H new ATOM 0 HG23 ILE C 49 95.618 10.022 -34.162 1.00 0.00 H new ATOM 0 HD11 ILE C 49 94.295 13.867 -35.439 1.00 0.00 H new ATOM 0 HD12 ILE C 49 93.330 13.494 -33.991 1.00 0.00 H new ATOM 0 HD13 ILE C 49 95.062 13.088 -34.035 1.00 0.00 H new ATOM 1364 N LYS C 50 94.610 8.014 -35.595 1.00 0.00 N ATOM 1365 CA LYS C 50 95.413 7.465 -36.686 1.00 0.00 C ATOM 1366 C LYS C 50 94.515 6.819 -37.740 1.00 0.00 C ATOM 1367 O LYS C 50 94.676 7.062 -38.936 1.00 0.00 O ATOM 1368 CB LYS C 50 96.402 6.426 -36.142 1.00 0.00 C ATOM 1369 CG LYS C 50 97.348 5.938 -37.254 1.00 0.00 C ATOM 1370 CD LYS C 50 98.306 7.061 -37.679 1.00 0.00 C ATOM 1371 CE LYS C 50 99.539 6.457 -38.358 1.00 0.00 C ATOM 1372 NZ LYS C 50 100.373 7.550 -38.930 1.00 0.00 N ATOM 0 H LYS C 50 94.772 7.583 -34.685 1.00 0.00 H new ATOM 0 HA LYS C 50 95.968 8.281 -37.149 1.00 0.00 H new ATOM 0 HB2 LYS C 50 96.983 6.861 -35.329 1.00 0.00 H new ATOM 0 HB3 LYS C 50 95.855 5.580 -35.726 1.00 0.00 H new ATOM 0 HG2 LYS C 50 97.919 5.079 -36.902 1.00 0.00 H new ATOM 0 HG3 LYS C 50 96.766 5.604 -38.113 1.00 0.00 H new ATOM 0 HD2 LYS C 50 97.801 7.744 -38.362 1.00 0.00 H new ATOM 0 HD3 LYS C 50 98.607 7.644 -36.809 1.00 0.00 H new ATOM 0 HE2 LYS C 50 100.119 5.881 -37.637 1.00 0.00 H new ATOM 0 HE3 LYS C 50 99.233 5.768 -39.145 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 101.379 7.298 -38.848 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 100.130 7.684 -39.932 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 100.194 8.432 -38.409 1.00 0.00 H new ATOM 1386 N ARG C 51 93.594 6.007 -37.297 1.00 0.00 N ATOM 1387 CA ARG C 51 92.685 5.328 -38.214 1.00 0.00 C ATOM 1388 C ARG C 51 91.757 6.334 -38.888 1.00 0.00 C ATOM 1389 O ARG C 51 91.272 7.268 -38.251 1.00 0.00 O ATOM 1390 CB ARG C 51 91.858 4.280 -37.451 1.00 0.00 C ATOM 1391 CG ARG C 51 91.020 3.417 -38.432 1.00 0.00 C ATOM 1392 CD ARG C 51 89.570 3.918 -38.490 1.00 0.00 C ATOM 1393 NE ARG C 51 88.914 3.710 -37.204 1.00 0.00 N ATOM 1394 CZ ARG C 51 87.616 3.783 -37.091 1.00 0.00 C ATOM 1395 NH1 ARG C 51 86.884 4.044 -38.138 1.00 0.00 N ATOM 1396 NH2 ARG C 51 87.052 3.594 -35.930 1.00 0.00 N ATOM 0 H ARG C 51 93.444 5.792 -36.311 1.00 0.00 H new ATOM 0 HA ARG C 51 93.274 4.829 -38.983 1.00 0.00 H new ATOM 0 HB2 ARG C 51 92.522 3.638 -36.871 1.00 0.00 H new ATOM 0 HB3 ARG C 51 91.197 4.778 -36.742 1.00 0.00 H new ATOM 0 HG2 ARG C 51 91.463 3.454 -39.427 1.00 0.00 H new ATOM 0 HG3 ARG C 51 91.038 2.375 -38.114 1.00 0.00 H new ATOM 0 HD2 ARG C 51 89.553 4.977 -38.748 1.00 0.00 H new ATOM 0 HD3 ARG C 51 89.026 3.390 -39.274 1.00 0.00 H new ATOM 0 HE ARG C 51 89.479 3.504 -36.380 1.00 0.00 H new ATOM 0 HH11 ARG C 51 87.326 4.191 -39.045 1.00 0.00 H new ATOM 0 HH12 ARG C 51 85.869 4.101 -38.050 1.00 0.00 H new ATOM 0 HH21 ARG C 51 87.625 3.389 -35.112 1.00 0.00 H new ATOM 0 HH22 ARG C 51 86.038 3.651 -35.841 1.00 0.00 H new ATOM 1410 N GLY C 52 91.522 6.139 -40.156 1.00 0.00 N ATOM 1411 CA GLY C 52 90.651 7.036 -40.907 1.00 0.00 C ATOM 1412 C GLY C 52 91.337 8.374 -41.161 1.00 0.00 C ATOM 0 H GLY C 52 91.915 5.372 -40.701 1.00 0.00 H new ATOM 0 HA2 GLY C 52 90.380 6.575 -41.857 1.00 0.00 H new ATOM 0 HA3 GLY C 52 89.725 7.197 -40.355 1.00 0.00 H new ATOM 1417 N SER D 23 86.552 -2.166 11.320 1.00 0.00 N ATOM 1418 CA SER D 23 85.908 -2.766 10.118 1.00 0.00 C ATOM 1419 C SER D 23 86.976 -3.409 9.240 1.00 0.00 C ATOM 1420 O SER D 23 88.153 -3.445 9.601 1.00 0.00 O ATOM 1421 CB SER D 23 85.179 -1.673 9.336 1.00 0.00 C ATOM 1422 OG SER D 23 84.476 -2.263 8.251 1.00 0.00 O ATOM 0 HA SER D 23 85.191 -3.527 10.425 1.00 0.00 H new ATOM 0 HB2 SER D 23 84.485 -1.143 9.989 1.00 0.00 H new ATOM 0 HB3 SER D 23 85.893 -0.937 8.965 1.00 0.00 H new ATOM 0 HG SER D 23 84.034 -3.083 8.555 1.00 0.00 H new ATOM 1427 N ASP D 24 86.565 -3.911 8.106 1.00 0.00 N ATOM 1428 CA ASP D 24 87.489 -4.557 7.180 1.00 0.00 C ATOM 1429 C ASP D 24 88.167 -3.501 6.297 1.00 0.00 C ATOM 1430 O ASP D 24 87.472 -2.816 5.554 1.00 0.00 O ATOM 1431 CB ASP D 24 86.716 -5.528 6.286 1.00 0.00 C ATOM 1432 CG ASP D 24 87.688 -6.341 5.438 1.00 0.00 C ATOM 1433 OD1 ASP D 24 88.143 -7.368 5.913 1.00 0.00 O ATOM 1434 OD2 ASP D 24 87.963 -5.923 4.325 1.00 0.00 O ATOM 0 H ASP D 24 85.595 -3.890 7.790 1.00 0.00 H new ATOM 0 HA ASP D 24 88.246 -5.096 7.750 1.00 0.00 H new ATOM 0 HB2 ASP D 24 86.109 -6.195 6.898 1.00 0.00 H new ATOM 0 HB3 ASP D 24 86.032 -4.976 5.642 1.00 0.00 H new ATOM 1439 N PRO D 25 89.483 -3.347 6.353 1.00 0.00 N ATOM 1440 CA PRO D 25 90.220 -2.340 5.514 1.00 0.00 C ATOM 1441 C PRO D 25 89.751 -2.312 4.055 1.00 0.00 C ATOM 1442 O PRO D 25 90.458 -2.758 3.151 1.00 0.00 O ATOM 1443 CB PRO D 25 91.679 -2.800 5.615 1.00 0.00 C ATOM 1444 CG PRO D 25 91.782 -3.455 6.952 1.00 0.00 C ATOM 1445 CD PRO D 25 90.417 -4.098 7.221 1.00 0.00 C ATOM 0 HA PRO D 25 90.054 -1.322 5.865 1.00 0.00 H new ATOM 0 HB2 PRO D 25 91.931 -3.495 4.814 1.00 0.00 H new ATOM 0 HB3 PRO D 25 92.366 -1.957 5.534 1.00 0.00 H new ATOM 0 HG2 PRO D 25 92.573 -4.205 6.958 1.00 0.00 H new ATOM 0 HG3 PRO D 25 92.028 -2.726 7.724 1.00 0.00 H new ATOM 0 HD2 PRO D 25 90.422 -5.160 6.975 1.00 0.00 H new ATOM 0 HD3 PRO D 25 90.138 -4.015 8.271 1.00 0.00 H new ATOM 1453 N LEU D 26 88.575 -1.793 3.843 1.00 0.00 N ATOM 1454 CA LEU D 26 88.003 -1.703 2.505 1.00 0.00 C ATOM 1455 C LEU D 26 88.821 -0.737 1.643 1.00 0.00 C ATOM 1456 O LEU D 26 89.064 -0.987 0.463 1.00 0.00 O ATOM 1457 CB LEU D 26 86.540 -1.216 2.622 1.00 0.00 C ATOM 1458 CG LEU D 26 85.640 -1.898 1.569 1.00 0.00 C ATOM 1459 CD1 LEU D 26 85.212 -3.286 2.067 1.00 0.00 C ATOM 1460 CD2 LEU D 26 84.387 -1.041 1.333 1.00 0.00 C ATOM 0 H LEU D 26 87.978 -1.418 4.581 1.00 0.00 H new ATOM 0 HA LEU D 26 88.025 -2.683 2.028 1.00 0.00 H new ATOM 0 HB2 LEU D 26 86.161 -1.430 3.622 1.00 0.00 H new ATOM 0 HB3 LEU D 26 86.502 -0.135 2.491 1.00 0.00 H new ATOM 0 HG LEU D 26 86.198 -2.002 0.639 1.00 0.00 H new ATOM 0 HD11 LEU D 26 84.577 -3.761 1.319 1.00 0.00 H new ATOM 0 HD12 LEU D 26 86.096 -3.901 2.236 1.00 0.00 H new ATOM 0 HD13 LEU D 26 84.658 -3.183 3.000 1.00 0.00 H new ATOM 0 HD21 LEU D 26 83.752 -1.522 0.590 1.00 0.00 H new ATOM 0 HD22 LEU D 26 83.836 -0.936 2.268 1.00 0.00 H new ATOM 0 HD23 LEU D 26 84.683 -0.055 0.974 1.00 0.00 H new ATOM 1472 N VAL D 27 89.209 0.358 2.236 1.00 0.00 N ATOM 1473 CA VAL D 27 89.970 1.389 1.538 1.00 0.00 C ATOM 1474 C VAL D 27 91.294 0.862 0.973 1.00 0.00 C ATOM 1475 O VAL D 27 91.591 1.074 -0.202 1.00 0.00 O ATOM 1476 CB VAL D 27 90.254 2.543 2.511 1.00 0.00 C ATOM 1477 CG1 VAL D 27 91.011 3.675 1.803 1.00 0.00 C ATOM 1478 CG2 VAL D 27 88.926 3.085 3.046 1.00 0.00 C ATOM 0 H VAL D 27 89.014 0.572 3.214 1.00 0.00 H new ATOM 0 HA VAL D 27 89.371 1.729 0.693 1.00 0.00 H new ATOM 0 HB VAL D 27 90.868 2.169 3.330 1.00 0.00 H new ATOM 0 HG11 VAL D 27 91.202 4.482 2.510 1.00 0.00 H new ATOM 0 HG12 VAL D 27 91.959 3.295 1.421 1.00 0.00 H new ATOM 0 HG13 VAL D 27 90.411 4.052 0.975 1.00 0.00 H new ATOM 0 HG21 VAL D 27 89.120 3.905 3.738 1.00 0.00 H new ATOM 0 HG22 VAL D 27 88.320 3.447 2.216 1.00 0.00 H new ATOM 0 HG23 VAL D 27 88.392 2.290 3.566 1.00 0.00 H new ATOM 1488 N VAL D 28 92.080 0.200 1.782 1.00 0.00 N ATOM 1489 CA VAL D 28 93.369 -0.332 1.331 1.00 0.00 C ATOM 1490 C VAL D 28 93.214 -1.555 0.423 1.00 0.00 C ATOM 1491 O VAL D 28 94.093 -1.856 -0.385 1.00 0.00 O ATOM 1492 CB VAL D 28 94.239 -0.690 2.547 1.00 0.00 C ATOM 1493 CG1 VAL D 28 93.755 -2.002 3.167 1.00 0.00 C ATOM 1494 CG2 VAL D 28 95.698 -0.847 2.108 1.00 0.00 C ATOM 0 H VAL D 28 91.862 0.009 2.760 1.00 0.00 H new ATOM 0 HA VAL D 28 93.852 0.447 0.742 1.00 0.00 H new ATOM 0 HB VAL D 28 94.162 0.108 3.285 1.00 0.00 H new ATOM 0 HG11 VAL D 28 94.376 -2.249 4.028 1.00 0.00 H new ATOM 0 HG12 VAL D 28 92.719 -1.893 3.487 1.00 0.00 H new ATOM 0 HG13 VAL D 28 93.824 -2.801 2.429 1.00 0.00 H new ATOM 0 HG21 VAL D 28 96.313 -1.101 2.972 1.00 0.00 H new ATOM 0 HG22 VAL D 28 95.771 -1.641 1.365 1.00 0.00 H new ATOM 0 HG23 VAL D 28 96.050 0.089 1.674 1.00 0.00 H new ATOM 1504 N ALA D 29 92.128 -2.253 0.582 1.00 0.00 N ATOM 1505 CA ALA D 29 91.882 -3.458 -0.204 1.00 0.00 C ATOM 1506 C ALA D 29 91.657 -3.142 -1.680 1.00 0.00 C ATOM 1507 O ALA D 29 92.225 -3.799 -2.553 1.00 0.00 O ATOM 1508 CB ALA D 29 90.666 -4.202 0.349 1.00 0.00 C ATOM 0 H ALA D 29 91.389 -2.020 1.246 1.00 0.00 H new ATOM 0 HA ALA D 29 92.770 -4.085 -0.127 1.00 0.00 H new ATOM 0 HB1 ALA D 29 90.489 -5.100 -0.243 1.00 0.00 H new ATOM 0 HB2 ALA D 29 90.851 -4.482 1.386 1.00 0.00 H new ATOM 0 HB3 ALA D 29 89.790 -3.555 0.298 1.00 0.00 H new ATOM 1514 N ALA D 30 90.833 -2.171 -1.954 1.00 0.00 N ATOM 1515 CA ALA D 30 90.557 -1.829 -3.334 1.00 0.00 C ATOM 1516 C ALA D 30 91.781 -1.180 -3.972 1.00 0.00 C ATOM 1517 O ALA D 30 92.208 -1.565 -5.060 1.00 0.00 O ATOM 1518 CB ALA D 30 89.363 -0.899 -3.384 1.00 0.00 C ATOM 0 H ALA D 30 90.344 -1.606 -1.259 1.00 0.00 H new ATOM 0 HA ALA D 30 90.327 -2.733 -3.898 1.00 0.00 H new ATOM 0 HB1 ALA D 30 89.149 -0.637 -4.420 1.00 0.00 H new ATOM 0 HB2 ALA D 30 88.496 -1.396 -2.949 1.00 0.00 H new ATOM 0 HB3 ALA D 30 89.583 0.007 -2.819 1.00 0.00 H new ATOM 1524 N SER D 31 92.309 -0.186 -3.316 1.00 0.00 N ATOM 1525 CA SER D 31 93.458 0.548 -3.832 1.00 0.00 C ATOM 1526 C SER D 31 94.589 -0.369 -4.309 1.00 0.00 C ATOM 1527 O SER D 31 95.248 -0.058 -5.300 1.00 0.00 O ATOM 1528 CB SER D 31 93.995 1.472 -2.743 1.00 0.00 C ATOM 1529 OG SER D 31 95.220 2.048 -3.176 1.00 0.00 O ATOM 0 H SER D 31 91.967 0.146 -2.414 1.00 0.00 H new ATOM 0 HA SER D 31 93.113 1.115 -4.696 1.00 0.00 H new ATOM 0 HB2 SER D 31 93.269 2.255 -2.524 1.00 0.00 H new ATOM 0 HB3 SER D 31 94.149 0.913 -1.820 1.00 0.00 H new ATOM 0 HG SER D 31 95.802 2.199 -2.402 1.00 0.00 H new ATOM 1535 N ILE D 32 94.838 -1.457 -3.626 1.00 0.00 N ATOM 1536 CA ILE D 32 95.925 -2.358 -4.015 1.00 0.00 C ATOM 1537 C ILE D 32 95.865 -2.714 -5.510 1.00 0.00 C ATOM 1538 O ILE D 32 96.893 -2.939 -6.142 1.00 0.00 O ATOM 1539 CB ILE D 32 95.862 -3.626 -3.122 1.00 0.00 C ATOM 1540 CG1 ILE D 32 97.277 -4.154 -2.818 1.00 0.00 C ATOM 1541 CG2 ILE D 32 95.035 -4.735 -3.787 1.00 0.00 C ATOM 1542 CD1 ILE D 32 98.050 -4.398 -4.117 1.00 0.00 C ATOM 0 H ILE D 32 94.314 -1.751 -2.801 1.00 0.00 H new ATOM 0 HA ILE D 32 96.880 -1.855 -3.863 1.00 0.00 H new ATOM 0 HB ILE D 32 95.378 -3.340 -2.188 1.00 0.00 H new ATOM 0 HG12 ILE D 32 97.814 -3.436 -2.198 1.00 0.00 H new ATOM 0 HG13 ILE D 32 97.211 -5.081 -2.248 1.00 0.00 H new ATOM 0 HG21 ILE D 32 95.010 -5.610 -3.137 1.00 0.00 H new ATOM 0 HG22 ILE D 32 94.019 -4.379 -3.956 1.00 0.00 H new ATOM 0 HG23 ILE D 32 95.488 -5.005 -4.741 1.00 0.00 H new ATOM 0 HD11 ILE D 32 99.047 -4.771 -3.883 1.00 0.00 H new ATOM 0 HD12 ILE D 32 97.521 -5.134 -4.723 1.00 0.00 H new ATOM 0 HD13 ILE D 32 98.133 -3.464 -4.672 1.00 0.00 H new ATOM 1554 N ILE D 33 94.691 -2.718 -6.072 1.00 0.00 N ATOM 1555 CA ILE D 33 94.529 -2.995 -7.500 1.00 0.00 C ATOM 1556 C ILE D 33 95.000 -1.797 -8.329 1.00 0.00 C ATOM 1557 O ILE D 33 95.356 -1.925 -9.501 1.00 0.00 O ATOM 1558 CB ILE D 33 93.069 -3.326 -7.826 1.00 0.00 C ATOM 1559 CG1 ILE D 33 92.705 -4.669 -7.184 1.00 0.00 C ATOM 1560 CG2 ILE D 33 92.891 -3.425 -9.347 1.00 0.00 C ATOM 1561 CD1 ILE D 33 91.201 -4.920 -7.313 1.00 0.00 C ATOM 0 H ILE D 33 93.819 -2.534 -5.575 1.00 0.00 H new ATOM 0 HA ILE D 33 95.141 -3.860 -7.754 1.00 0.00 H new ATOM 0 HB ILE D 33 92.420 -2.541 -7.437 1.00 0.00 H new ATOM 0 HG12 ILE D 33 93.259 -5.474 -7.666 1.00 0.00 H new ATOM 0 HG13 ILE D 33 92.993 -4.669 -6.133 1.00 0.00 H new ATOM 0 HG21 ILE D 33 91.852 -3.661 -9.577 1.00 0.00 H new ATOM 0 HG22 ILE D 33 93.158 -2.474 -9.807 1.00 0.00 H new ATOM 0 HG23 ILE D 33 93.537 -4.211 -9.738 1.00 0.00 H new ATOM 0 HD11 ILE D 33 90.951 -5.877 -6.854 1.00 0.00 H new ATOM 0 HD12 ILE D 33 90.655 -4.122 -6.810 1.00 0.00 H new ATOM 0 HD13 ILE D 33 90.925 -4.940 -8.367 1.00 0.00 H new ATOM 1573 N GLY D 34 94.960 -0.654 -7.707 1.00 0.00 N ATOM 1574 CA GLY D 34 95.339 0.600 -8.357 1.00 0.00 C ATOM 1575 C GLY D 34 96.688 0.504 -9.075 1.00 0.00 C ATOM 1576 O GLY D 34 96.802 0.888 -10.239 1.00 0.00 O ATOM 0 H GLY D 34 94.666 -0.549 -6.736 1.00 0.00 H new ATOM 0 HA2 GLY D 34 94.568 0.881 -9.075 1.00 0.00 H new ATOM 0 HA3 GLY D 34 95.384 1.393 -7.611 1.00 0.00 H new ATOM 1580 N ILE D 35 97.692 0.022 -8.394 1.00 0.00 N ATOM 1581 CA ILE D 35 99.022 -0.085 -8.992 1.00 0.00 C ATOM 1582 C ILE D 35 99.049 -1.094 -10.142 1.00 0.00 C ATOM 1583 O ILE D 35 99.838 -0.957 -11.077 1.00 0.00 O ATOM 1584 CB ILE D 35 100.049 -0.477 -7.927 1.00 0.00 C ATOM 1585 CG1 ILE D 35 99.646 -1.803 -7.277 1.00 0.00 C ATOM 1586 CG2 ILE D 35 100.103 0.614 -6.857 1.00 0.00 C ATOM 1587 CD1 ILE D 35 100.764 -2.274 -6.345 1.00 0.00 C ATOM 0 H ILE D 35 97.629 -0.305 -7.430 1.00 0.00 H new ATOM 0 HA ILE D 35 99.278 0.892 -9.402 1.00 0.00 H new ATOM 0 HB ILE D 35 101.028 -0.590 -8.394 1.00 0.00 H new ATOM 0 HG12 ILE D 35 98.719 -1.679 -6.717 1.00 0.00 H new ATOM 0 HG13 ILE D 35 99.457 -2.554 -8.044 1.00 0.00 H new ATOM 0 HG21 ILE D 35 100.833 0.341 -6.095 1.00 0.00 H new ATOM 0 HG22 ILE D 35 100.394 1.559 -7.315 1.00 0.00 H new ATOM 0 HG23 ILE D 35 99.121 0.721 -6.397 1.00 0.00 H new ATOM 0 HD11 ILE D 35 100.478 -3.218 -5.882 1.00 0.00 H new ATOM 0 HD12 ILE D 35 101.681 -2.414 -6.918 1.00 0.00 H new ATOM 0 HD13 ILE D 35 100.931 -1.526 -5.570 1.00 0.00 H new ATOM 1599 N LEU D 36 98.206 -2.086 -10.072 1.00 0.00 N ATOM 1600 CA LEU D 36 98.155 -3.104 -11.120 1.00 0.00 C ATOM 1601 C LEU D 36 97.897 -2.458 -12.479 1.00 0.00 C ATOM 1602 O LEU D 36 98.602 -2.724 -13.453 1.00 0.00 O ATOM 1603 CB LEU D 36 97.029 -4.099 -10.806 1.00 0.00 C ATOM 1604 CG LEU D 36 97.185 -5.376 -11.658 1.00 0.00 C ATOM 1605 CD1 LEU D 36 98.179 -6.342 -10.998 1.00 0.00 C ATOM 1606 CD2 LEU D 36 95.826 -6.075 -11.788 1.00 0.00 C ATOM 0 H LEU D 36 97.542 -2.224 -9.310 1.00 0.00 H new ATOM 0 HA LEU D 36 99.112 -3.624 -11.154 1.00 0.00 H new ATOM 0 HB2 LEU D 36 97.048 -4.356 -9.747 1.00 0.00 H new ATOM 0 HB3 LEU D 36 96.062 -3.638 -11.005 1.00 0.00 H new ATOM 0 HG LEU D 36 97.558 -5.094 -12.643 1.00 0.00 H new ATOM 0 HD11 LEU D 36 98.278 -7.238 -11.611 1.00 0.00 H new ATOM 0 HD12 LEU D 36 99.151 -5.857 -10.905 1.00 0.00 H new ATOM 0 HD13 LEU D 36 97.815 -6.618 -10.008 1.00 0.00 H new ATOM 0 HD21 LEU D 36 95.937 -6.977 -12.390 1.00 0.00 H new ATOM 0 HD22 LEU D 36 95.458 -6.343 -10.797 1.00 0.00 H new ATOM 0 HD23 LEU D 36 95.116 -5.403 -12.269 1.00 0.00 H new ATOM 1618 N HIS D 37 96.890 -1.637 -12.528 1.00 0.00 N ATOM 1619 CA HIS D 37 96.525 -0.965 -13.772 1.00 0.00 C ATOM 1620 C HIS D 37 97.603 0.032 -14.202 1.00 0.00 C ATOM 1621 O HIS D 37 97.783 0.282 -15.393 1.00 0.00 O ATOM 1622 CB HIS D 37 95.167 -0.263 -13.625 1.00 0.00 C ATOM 1623 CG HIS D 37 95.292 0.974 -12.776 1.00 0.00 C ATOM 1624 ND1 HIS D 37 96.244 1.953 -13.016 1.00 0.00 N ATOM 1625 CD2 HIS D 37 94.573 1.413 -11.692 1.00 0.00 C ATOM 1626 CE1 HIS D 37 96.075 2.920 -12.097 1.00 0.00 C ATOM 1627 NE2 HIS D 37 95.069 2.641 -11.265 1.00 0.00 N ATOM 0 H HIS D 37 96.298 -1.407 -11.730 1.00 0.00 H new ATOM 0 HA HIS D 37 96.443 -1.723 -14.551 1.00 0.00 H new ATOM 0 HB2 HIS D 37 94.782 0.004 -14.609 1.00 0.00 H new ATOM 0 HB3 HIS D 37 94.446 -0.946 -13.176 1.00 0.00 H new ATOM 0 HD2 HIS D 37 93.747 0.885 -11.239 1.00 0.00 H new ATOM 0 HE1 HIS D 37 96.679 3.813 -12.039 1.00 0.00 H new ATOM 0 HE2 HIS D 37 94.736 3.206 -10.484 1.00 0.00 H new ATOM 1636 N PHE D 38 98.298 0.595 -13.249 1.00 0.00 N ATOM 1637 CA PHE D 38 99.348 1.571 -13.549 1.00 0.00 C ATOM 1638 C PHE D 38 100.541 0.922 -14.254 1.00 0.00 C ATOM 1639 O PHE D 38 101.017 1.424 -15.272 1.00 0.00 O ATOM 1640 CB PHE D 38 99.829 2.235 -12.255 1.00 0.00 C ATOM 1641 CG PHE D 38 100.932 3.222 -12.570 1.00 0.00 C ATOM 1642 CD1 PHE D 38 100.617 4.545 -12.904 1.00 0.00 C ATOM 1643 CD2 PHE D 38 102.271 2.811 -12.531 1.00 0.00 C ATOM 1644 CE1 PHE D 38 101.640 5.457 -13.196 1.00 0.00 C ATOM 1645 CE2 PHE D 38 103.292 3.723 -12.824 1.00 0.00 C ATOM 1646 CZ PHE D 38 102.977 5.045 -13.158 1.00 0.00 C ATOM 0 H PHE D 38 98.167 0.404 -12.256 1.00 0.00 H new ATOM 0 HA PHE D 38 98.920 2.318 -14.218 1.00 0.00 H new ATOM 0 HB2 PHE D 38 98.999 2.745 -11.766 1.00 0.00 H new ATOM 0 HB3 PHE D 38 100.192 1.478 -11.559 1.00 0.00 H new ATOM 0 HD1 PHE D 38 99.585 4.863 -12.937 1.00 0.00 H new ATOM 0 HD2 PHE D 38 102.515 1.791 -12.275 1.00 0.00 H new ATOM 0 HE1 PHE D 38 101.397 6.478 -13.450 1.00 0.00 H new ATOM 0 HE2 PHE D 38 104.324 3.406 -12.792 1.00 0.00 H new ATOM 0 HZ PHE D 38 103.765 5.747 -13.386 1.00 0.00 H new ATOM 1656 N ILE D 39 101.021 -0.163 -13.710 1.00 0.00 N ATOM 1657 CA ILE D 39 102.173 -0.858 -14.288 1.00 0.00 C ATOM 1658 C ILE D 39 101.848 -1.415 -15.671 1.00 0.00 C ATOM 1659 O ILE D 39 102.678 -1.370 -16.580 1.00 0.00 O ATOM 1660 CB ILE D 39 102.609 -1.998 -13.370 1.00 0.00 C ATOM 1661 CG1 ILE D 39 102.998 -1.430 -12.003 1.00 0.00 C ATOM 1662 CG2 ILE D 39 103.815 -2.713 -13.983 1.00 0.00 C ATOM 1663 CD1 ILE D 39 103.163 -2.574 -11.001 1.00 0.00 C ATOM 0 H ILE D 39 100.643 -0.596 -12.868 1.00 0.00 H new ATOM 0 HA ILE D 39 102.983 -0.136 -14.390 1.00 0.00 H new ATOM 0 HB ILE D 39 101.787 -2.704 -13.252 1.00 0.00 H new ATOM 0 HG12 ILE D 39 103.927 -0.866 -12.083 1.00 0.00 H new ATOM 0 HG13 ILE D 39 102.233 -0.736 -11.655 1.00 0.00 H new ATOM 0 HG21 ILE D 39 104.127 -3.527 -13.328 1.00 0.00 H new ATOM 0 HG22 ILE D 39 103.542 -3.116 -14.958 1.00 0.00 H new ATOM 0 HG23 ILE D 39 104.636 -2.006 -14.100 1.00 0.00 H new ATOM 0 HD11 ILE D 39 103.440 -2.168 -10.028 1.00 0.00 H new ATOM 0 HD12 ILE D 39 102.223 -3.119 -10.913 1.00 0.00 H new ATOM 0 HD13 ILE D 39 103.944 -3.251 -11.347 1.00 0.00 H new ATOM 1675 N ALA D 40 100.661 -1.927 -15.820 1.00 0.00 N ATOM 1676 CA ALA D 40 100.228 -2.490 -17.090 1.00 0.00 C ATOM 1677 C ALA D 40 100.046 -1.387 -18.123 1.00 0.00 C ATOM 1678 O ALA D 40 100.120 -1.622 -19.320 1.00 0.00 O ATOM 1679 CB ALA D 40 98.923 -3.263 -16.897 1.00 0.00 C ATOM 0 H ALA D 40 99.962 -1.972 -15.078 1.00 0.00 H new ATOM 0 HA ALA D 40 100.993 -3.176 -17.453 1.00 0.00 H new ATOM 0 HB1 ALA D 40 98.604 -3.682 -17.851 1.00 0.00 H new ATOM 0 HB2 ALA D 40 99.080 -4.070 -16.181 1.00 0.00 H new ATOM 0 HB3 ALA D 40 98.153 -2.589 -16.521 1.00 0.00 H new ATOM 1685 N TRP D 41 99.765 -0.213 -17.661 1.00 0.00 N ATOM 1686 CA TRP D 41 99.540 0.915 -18.551 1.00 0.00 C ATOM 1687 C TRP D 41 100.771 1.227 -19.408 1.00 0.00 C ATOM 1688 O TRP D 41 100.662 1.438 -20.616 1.00 0.00 O ATOM 1689 CB TRP D 41 99.207 2.140 -17.699 1.00 0.00 C ATOM 1690 CG TRP D 41 98.706 3.247 -18.564 1.00 0.00 C ATOM 1691 CD1 TRP D 41 99.411 3.859 -19.548 1.00 0.00 C ATOM 1692 CD2 TRP D 41 97.410 3.904 -18.521 1.00 0.00 C ATOM 1693 NE1 TRP D 41 98.611 4.816 -20.136 1.00 0.00 N ATOM 1694 CE2 TRP D 41 97.374 4.886 -19.535 1.00 0.00 C ATOM 1695 CE3 TRP D 41 96.267 3.738 -17.717 1.00 0.00 C ATOM 1696 CZ2 TRP D 41 96.252 5.670 -19.747 1.00 0.00 C ATOM 1697 CZ3 TRP D 41 95.133 4.541 -17.922 1.00 0.00 C ATOM 1698 CH2 TRP D 41 95.125 5.505 -18.940 1.00 0.00 C ATOM 0 H TRP D 41 99.682 0.007 -16.668 1.00 0.00 H new ATOM 0 HA TRP D 41 98.722 0.662 -19.225 1.00 0.00 H new ATOM 0 HB2 TRP D 41 98.454 1.881 -16.955 1.00 0.00 H new ATOM 0 HB3 TRP D 41 100.094 2.466 -17.155 1.00 0.00 H new ATOM 0 HD1 TRP D 41 100.430 3.634 -19.825 1.00 0.00 H new ATOM 0 HE1 TRP D 41 98.900 5.401 -20.920 1.00 0.00 H new ATOM 0 HE3 TRP D 41 96.262 2.989 -16.939 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 96.249 6.408 -20.536 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 94.264 4.415 -17.293 1.00 0.00 H new ATOM 0 HH2 TRP D 41 94.250 6.118 -19.099 1.00 0.00 H new ATOM 1709 N THR D 42 101.901 1.320 -18.769 1.00 0.00 N ATOM 1710 CA THR D 42 103.153 1.694 -19.436 1.00 0.00 C ATOM 1711 C THR D 42 103.420 0.931 -20.735 1.00 0.00 C ATOM 1712 O THR D 42 103.888 1.528 -21.704 1.00 0.00 O ATOM 1713 CB THR D 42 104.326 1.471 -18.478 1.00 0.00 C ATOM 1714 OG1 THR D 42 104.337 0.114 -18.056 1.00 0.00 O ATOM 1715 CG2 THR D 42 104.176 2.383 -17.260 1.00 0.00 C ATOM 0 H THR D 42 102.000 1.142 -17.769 1.00 0.00 H new ATOM 0 HA THR D 42 103.051 2.745 -19.706 1.00 0.00 H new ATOM 0 HB THR D 42 105.261 1.703 -18.988 1.00 0.00 H new ATOM 0 HG1 THR D 42 103.566 -0.054 -17.475 1.00 0.00 H new ATOM 0 HG21 THR D 42 105.012 2.222 -16.580 1.00 0.00 H new ATOM 0 HG22 THR D 42 104.167 3.424 -17.584 1.00 0.00 H new ATOM 0 HG23 THR D 42 103.242 2.154 -16.747 1.00 0.00 H new ATOM 1723 N ILE D 43 103.149 -0.344 -20.782 1.00 0.00 N ATOM 1724 CA ILE D 43 103.410 -1.085 -22.019 1.00 0.00 C ATOM 1725 C ILE D 43 102.632 -0.472 -23.190 1.00 0.00 C ATOM 1726 O ILE D 43 103.058 -0.579 -24.336 1.00 0.00 O ATOM 1727 CB ILE D 43 103.073 -2.580 -21.869 1.00 0.00 C ATOM 1728 CG1 ILE D 43 101.786 -2.742 -21.066 1.00 0.00 C ATOM 1729 CG2 ILE D 43 104.216 -3.301 -21.143 1.00 0.00 C ATOM 1730 CD1 ILE D 43 101.205 -4.140 -21.292 1.00 0.00 C ATOM 0 H ILE D 43 102.760 -0.891 -20.014 1.00 0.00 H new ATOM 0 HA ILE D 43 104.477 -1.008 -22.229 1.00 0.00 H new ATOM 0 HB ILE D 43 102.941 -3.014 -22.860 1.00 0.00 H new ATOM 0 HG12 ILE D 43 101.987 -2.589 -20.006 1.00 0.00 H new ATOM 0 HG13 ILE D 43 101.062 -1.985 -21.366 1.00 0.00 H new ATOM 0 HG21 ILE D 43 103.972 -4.358 -21.040 1.00 0.00 H new ATOM 0 HG22 ILE D 43 105.136 -3.195 -21.718 1.00 0.00 H new ATOM 0 HG23 ILE D 43 104.353 -2.862 -20.155 1.00 0.00 H new ATOM 0 HD11 ILE D 43 100.286 -4.250 -20.716 1.00 0.00 H new ATOM 0 HD12 ILE D 43 100.988 -4.277 -22.351 1.00 0.00 H new ATOM 0 HD13 ILE D 43 101.927 -4.890 -20.970 1.00 0.00 H new ATOM 1742 N GLY D 44 101.513 0.150 -22.908 1.00 0.00 N ATOM 1743 CA GLY D 44 100.695 0.754 -23.971 1.00 0.00 C ATOM 1744 C GLY D 44 101.553 1.592 -24.920 1.00 0.00 C ATOM 1745 O GLY D 44 101.449 1.460 -26.139 1.00 0.00 O ATOM 0 H GLY D 44 101.137 0.259 -21.966 1.00 0.00 H new ATOM 0 HA2 GLY D 44 100.187 -0.030 -24.532 1.00 0.00 H new ATOM 0 HA3 GLY D 44 99.921 1.380 -23.527 1.00 0.00 H new ATOM 1749 N HIS D 45 102.350 2.466 -24.373 1.00 0.00 N ATOM 1750 CA HIS D 45 103.184 3.365 -25.168 1.00 0.00 C ATOM 1751 C HIS D 45 103.804 2.645 -26.364 1.00 0.00 C ATOM 1752 O HIS D 45 104.192 3.282 -27.345 1.00 0.00 O ATOM 1753 CB HIS D 45 104.292 3.931 -24.286 1.00 0.00 C ATOM 1754 CG HIS D 45 105.120 4.906 -25.079 1.00 0.00 C ATOM 1755 ND1 HIS D 45 106.292 4.533 -25.719 1.00 0.00 N ATOM 1756 CD2 HIS D 45 104.957 6.243 -25.343 1.00 0.00 C ATOM 1757 CE1 HIS D 45 106.785 5.625 -26.330 1.00 0.00 C ATOM 1758 NE2 HIS D 45 106.009 6.695 -26.134 1.00 0.00 N ATOM 0 H HIS D 45 102.450 2.587 -23.365 1.00 0.00 H new ATOM 0 HA HIS D 45 102.553 4.168 -25.549 1.00 0.00 H new ATOM 0 HB2 HIS D 45 103.861 4.427 -23.417 1.00 0.00 H new ATOM 0 HB3 HIS D 45 104.922 3.123 -23.912 1.00 0.00 H new ATOM 0 HD2 HIS D 45 104.137 6.852 -24.991 1.00 0.00 H new ATOM 0 HE1 HIS D 45 107.697 5.636 -26.909 1.00 0.00 H new ATOM 0 HE2 HIS D 45 106.156 7.640 -26.488 1.00 0.00 H new ATOM 1767 N LEU D 46 103.887 1.351 -26.289 1.00 0.00 N ATOM 1768 CA LEU D 46 104.459 0.577 -27.387 1.00 0.00 C ATOM 1769 C LEU D 46 103.889 1.053 -28.730 1.00 0.00 C ATOM 1770 O LEU D 46 104.550 0.936 -29.762 1.00 0.00 O ATOM 1771 CB LEU D 46 104.169 -0.929 -27.202 1.00 0.00 C ATOM 1772 CG LEU D 46 102.695 -1.269 -27.582 1.00 0.00 C ATOM 1773 CD1 LEU D 46 102.615 -1.776 -29.040 1.00 0.00 C ATOM 1774 CD2 LEU D 46 102.139 -2.357 -26.636 1.00 0.00 C ATOM 0 H LEU D 46 103.573 0.798 -25.492 1.00 0.00 H new ATOM 0 HA LEU D 46 105.538 0.730 -27.383 1.00 0.00 H new ATOM 0 HB2 LEU D 46 104.851 -1.512 -27.821 1.00 0.00 H new ATOM 0 HB3 LEU D 46 104.356 -1.214 -26.167 1.00 0.00 H new ATOM 0 HG LEU D 46 102.100 -0.361 -27.484 1.00 0.00 H new ATOM 0 HD11 LEU D 46 101.579 -2.008 -29.288 1.00 0.00 H new ATOM 0 HD12 LEU D 46 102.985 -1.004 -29.715 1.00 0.00 H new ATOM 0 HD13 LEU D 46 103.224 -2.674 -29.147 1.00 0.00 H new ATOM 0 HD21 LEU D 46 101.109 -2.586 -26.911 1.00 0.00 H new ATOM 0 HD22 LEU D 46 102.747 -3.258 -26.721 1.00 0.00 H new ATOM 0 HD23 LEU D 46 102.168 -1.995 -25.608 1.00 0.00 H new ATOM 1786 N ASN D 47 102.689 1.583 -28.717 1.00 0.00 N ATOM 1787 CA ASN D 47 102.053 2.074 -29.944 1.00 0.00 C ATOM 1788 C ASN D 47 102.793 3.278 -30.556 1.00 0.00 C ATOM 1789 O ASN D 47 102.859 3.408 -31.778 1.00 0.00 O ATOM 1790 CB ASN D 47 100.614 2.488 -29.629 1.00 0.00 C ATOM 1791 CG ASN D 47 99.850 1.312 -29.030 1.00 0.00 C ATOM 1792 OD1 ASN D 47 99.754 0.254 -29.650 1.00 0.00 O ATOM 1793 ND2 ASN D 47 99.299 1.434 -27.852 1.00 0.00 N ATOM 0 H ASN D 47 102.123 1.691 -27.876 1.00 0.00 H new ATOM 0 HA ASN D 47 102.083 1.264 -30.672 1.00 0.00 H new ATOM 0 HB2 ASN D 47 100.613 3.326 -28.932 1.00 0.00 H new ATOM 0 HB3 ASN D 47 100.118 2.829 -30.538 1.00 0.00 H new ATOM 0 HD21 ASN D 47 98.788 0.651 -27.444 1.00 0.00 H new ATOM 0 HD22 ASN D 47 99.380 2.312 -27.340 1.00 0.00 H new ATOM 1800 N GLN D 48 103.337 4.133 -29.724 1.00 0.00 N ATOM 1801 CA GLN D 48 104.064 5.307 -30.203 1.00 0.00 C ATOM 1802 C GLN D 48 105.321 4.904 -30.965 1.00 0.00 C ATOM 1803 O GLN D 48 105.482 5.246 -32.136 1.00 0.00 O ATOM 1804 CB GLN D 48 104.456 6.203 -29.020 1.00 0.00 C ATOM 1805 CG GLN D 48 103.282 6.325 -28.042 1.00 0.00 C ATOM 1806 CD GLN D 48 101.997 6.615 -28.804 1.00 0.00 C ATOM 1807 OE1 GLN D 48 100.959 5.848 -28.621 1.00 0.00 O flip ATOM 1808 NE2 GLN D 48 101.944 7.555 -29.596 1.00 0.00 N flip ATOM 0 H GLN D 48 103.296 4.047 -28.709 1.00 0.00 H new ATOM 0 HA GLN D 48 103.406 5.853 -30.879 1.00 0.00 H new ATOM 0 HB2 GLN D 48 105.324 5.786 -28.509 1.00 0.00 H new ATOM 0 HB3 GLN D 48 104.743 7.191 -29.381 1.00 0.00 H new ATOM 0 HG2 GLN D 48 103.176 5.402 -27.472 1.00 0.00 H new ATOM 0 HG3 GLN D 48 103.477 7.122 -27.325 1.00 0.00 H new ATOM 0 HE21 GLN D 48 102.760 8.152 -29.735 1.00 0.00 H new ATOM 0 HE22 GLN D 48 101.084 7.738 -30.114 1.00 0.00 H new ATOM 1817 N ILE D 49 106.198 4.194 -30.298 1.00 0.00 N ATOM 1818 CA ILE D 49 107.452 3.750 -30.910 1.00 0.00 C ATOM 1819 C ILE D 49 107.234 3.337 -32.363 1.00 0.00 C ATOM 1820 O ILE D 49 107.477 4.123 -33.281 1.00 0.00 O ATOM 1821 CB ILE D 49 108.028 2.577 -30.114 1.00 0.00 C ATOM 1822 CG1 ILE D 49 108.374 3.054 -28.701 1.00 0.00 C ATOM 1823 CG2 ILE D 49 109.294 2.059 -30.802 1.00 0.00 C ATOM 1824 CD1 ILE D 49 108.718 1.854 -27.819 1.00 0.00 C ATOM 0 H ILE D 49 106.077 3.904 -29.328 1.00 0.00 H new ATOM 0 HA ILE D 49 108.157 4.581 -30.894 1.00 0.00 H new ATOM 0 HB ILE D 49 107.293 1.773 -30.063 1.00 0.00 H new ATOM 0 HG12 ILE D 49 109.217 3.744 -28.737 1.00 0.00 H new ATOM 0 HG13 ILE D 49 107.532 3.600 -28.275 1.00 0.00 H new ATOM 0 HG21 ILE D 49 109.702 1.224 -30.233 1.00 0.00 H new ATOM 0 HG22 ILE D 49 109.050 1.726 -31.811 1.00 0.00 H new ATOM 0 HG23 ILE D 49 110.033 2.858 -30.853 1.00 0.00 H new ATOM 0 HD11 ILE D 49 108.963 2.199 -26.815 1.00 0.00 H new ATOM 0 HD12 ILE D 49 107.863 1.180 -27.772 1.00 0.00 H new ATOM 0 HD13 ILE D 49 109.573 1.326 -28.240 1.00 0.00 H new ATOM 1836 N LYS D 50 106.782 2.134 -32.566 1.00 0.00 N ATOM 1837 CA LYS D 50 106.534 1.649 -33.917 1.00 0.00 C ATOM 1838 C LYS D 50 105.654 2.639 -34.677 1.00 0.00 C ATOM 1839 O LYS D 50 105.843 2.862 -35.872 1.00 0.00 O ATOM 1840 CB LYS D 50 105.842 0.281 -33.863 1.00 0.00 C ATOM 1841 CG LYS D 50 105.823 -0.363 -35.263 1.00 0.00 C ATOM 1842 CD LYS D 50 107.133 -1.119 -35.517 1.00 0.00 C ATOM 1843 CE LYS D 50 107.047 -1.849 -36.859 1.00 0.00 C ATOM 1844 NZ LYS D 50 108.291 -2.639 -37.074 1.00 0.00 N ATOM 0 H LYS D 50 106.574 1.464 -31.826 1.00 0.00 H new ATOM 0 HA LYS D 50 107.488 1.549 -34.435 1.00 0.00 H new ATOM 0 HB2 LYS D 50 106.364 -0.371 -33.162 1.00 0.00 H new ATOM 0 HB3 LYS D 50 104.823 0.395 -33.494 1.00 0.00 H new ATOM 0 HG2 LYS D 50 104.978 -1.047 -35.345 1.00 0.00 H new ATOM 0 HG3 LYS D 50 105.685 0.406 -36.023 1.00 0.00 H new ATOM 0 HD2 LYS D 50 107.972 -0.423 -35.522 1.00 0.00 H new ATOM 0 HD3 LYS D 50 107.316 -1.833 -34.713 1.00 0.00 H new ATOM 0 HE2 LYS D 50 106.178 -2.507 -36.872 1.00 0.00 H new ATOM 0 HE3 LYS D 50 106.915 -1.131 -37.668 1.00 0.00 H new ATOM 0 HZ1 LYS D 50 108.234 -3.136 -37.986 1.00 0.00 H new ATOM 0 HZ2 LYS D 50 109.112 -2.000 -37.079 1.00 0.00 H new ATOM 0 HZ3 LYS D 50 108.398 -3.334 -36.308 1.00 0.00 H new ATOM 1858 N ARG D 51 104.712 3.220 -33.983 1.00 0.00 N ATOM 1859 CA ARG D 51 103.807 4.189 -34.595 1.00 0.00 C ATOM 1860 C ARG D 51 102.977 3.524 -35.693 1.00 0.00 C ATOM 1861 O ARG D 51 101.771 3.326 -35.539 1.00 0.00 O ATOM 1862 CB ARG D 51 104.617 5.365 -35.175 1.00 0.00 C ATOM 1863 CG ARG D 51 103.787 6.657 -35.140 1.00 0.00 C ATOM 1864 CD ARG D 51 102.528 6.489 -35.993 1.00 0.00 C ATOM 1865 NE ARG D 51 101.904 7.786 -36.231 1.00 0.00 N ATOM 1866 CZ ARG D 51 102.397 8.622 -37.103 1.00 0.00 C ATOM 1867 NH1 ARG D 51 103.469 8.307 -37.775 1.00 0.00 N ATOM 1868 NH2 ARG D 51 101.816 9.775 -37.301 1.00 0.00 N ATOM 0 H ARG D 51 104.542 3.047 -32.992 1.00 0.00 H new ATOM 0 HA ARG D 51 103.127 4.568 -33.832 1.00 0.00 H new ATOM 0 HB2 ARG D 51 105.535 5.500 -34.603 1.00 0.00 H new ATOM 0 HB3 ARG D 51 104.911 5.142 -36.201 1.00 0.00 H new ATOM 0 HG2 ARG D 51 103.512 6.895 -34.113 1.00 0.00 H new ATOM 0 HG3 ARG D 51 104.381 7.492 -35.513 1.00 0.00 H new ATOM 0 HD2 ARG D 51 102.784 6.020 -36.943 1.00 0.00 H new ATOM 0 HD3 ARG D 51 101.825 5.826 -35.490 1.00 0.00 H new ATOM 0 HE ARG D 51 101.068 8.044 -35.707 1.00 0.00 H new ATOM 0 HH11 ARG D 51 103.922 7.407 -37.619 1.00 0.00 H new ATOM 0 HH12 ARG D 51 103.854 8.961 -38.457 1.00 0.00 H new ATOM 0 HH21 ARG D 51 100.978 10.021 -36.774 1.00 0.00 H new ATOM 0 HH22 ARG D 51 102.200 10.429 -37.982 1.00 0.00 H new ATOM 1882 N GLY D 52 103.618 3.190 -36.779 1.00 0.00 N ATOM 1883 CA GLY D 52 102.930 2.549 -37.894 1.00 0.00 C ATOM 1884 C GLY D 52 101.731 3.376 -38.342 1.00 0.00 C ATOM 0 H GLY D 52 104.615 3.346 -36.927 1.00 0.00 H new ATOM 0 HA2 GLY D 52 103.621 2.422 -38.728 1.00 0.00 H new ATOM 0 HA3 GLY D 52 102.600 1.553 -37.599 1.00 0.00 H new