USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 993 hydrogens (21 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 47 ASN :FLIP amide:sc= -0.532 F(o=-11!,f=-7.3) USER MOD Set 1.2: B 48 GLN : amide:sc= -6.74! C(o=-7.3!,f=-14!) USER MOD Single : A 23 SER OG : rot -42:sc= 0.964 USER MOD Single : A 31 SER OG : rot 180:sc= -0.399 USER MOD Single : A 37 HIS : no HD1:sc= -9.11! C(o=-9.1!,f=-13!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc= -0.505 X(o=-0.5,f=-0.038) USER MOD Single : A 48 GLN : amide:sc= -3.33! C(o=-3.3!,f=-6.1!) USER MOD Single : A 50 LYS NZ :NH3+ 158:sc= -0.0365 (180deg=-0.311) USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 37 HIS : no HD1:sc= -4.86! C(o=-4.9!,f=-8.2!) USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 HIS : no HD1:sc= -0.056 X(o=-0.056,f=0) USER MOD Single : B 47 ASN : amide:sc= 0.0937 X(o=0.094,f=-0.066) USER MOD Single : B 50 LYS NZ :NH3+ 156:sc= -0.161 (180deg=-0.936) USER MOD Single : C 23 SER OG : rot -49:sc= 0.878 USER MOD Single : C 31 SER OG : rot 180:sc= 0 USER MOD Single : C 37 HIS : no HD1:sc= -8.62! C(o=-8.6!,f=-12!) USER MOD Single : C 42 THR OG1 : rot 180:sc= 0 USER MOD Single : C 45 HIS : no HD1:sc= -0.113 K(o=-0.11,f=-0.85) USER MOD Single : C 47 ASN : amide:sc= -0.189 K(o=-0.19,f=-0.91) USER MOD Single : C 48 GLN : amide:sc= -3.69! C(o=-3.7!,f=-9.5!) USER MOD Single : C 50 LYS NZ :NH3+ -129:sc= -8.8! (180deg=-11.8!) USER MOD Single : D 23 SER OG : rot 180:sc= 0 USER MOD Single : D 31 SER OG : rot 180:sc= -0.104 USER MOD Single : D 37 HIS : no HD1:sc= -6.91! C(o=-6.9!,f=-11!) USER MOD Single : D 42 THR OG1 : rot -76:sc= 1.19 USER MOD Single : D 45 HIS : no HE2:sc= -0.14 K(o=-0.14,f=-2.8!) USER MOD Single : D 47 ASN : amide:sc= -0.646 X(o=-0.65,f=-0.5) USER MOD Single : D 48 GLN : amide:sc= -8.46! C(o=-8.5!,f=-16!) USER MOD Single : D 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 23 76.544 2.284 5.800 1.00 0.00 N ATOM 2 CA SER A 23 77.779 1.452 5.760 1.00 0.00 C ATOM 3 C SER A 23 78.805 2.114 4.845 1.00 0.00 C ATOM 4 O SER A 23 79.730 1.463 4.359 1.00 0.00 O ATOM 5 CB SER A 23 77.433 0.057 5.239 1.00 0.00 C ATOM 6 OG SER A 23 78.596 -0.761 5.278 1.00 0.00 O ATOM 0 HA SER A 23 78.199 1.364 6.762 1.00 0.00 H new ATOM 0 HB2 SER A 23 76.643 -0.385 5.846 1.00 0.00 H new ATOM 0 HB3 SER A 23 77.053 0.121 4.219 1.00 0.00 H new ATOM 0 HG SER A 23 79.369 -0.245 4.967 1.00 0.00 H new ATOM 11 N ASP A 24 78.639 3.390 4.625 1.00 0.00 N ATOM 12 CA ASP A 24 79.558 4.128 3.775 1.00 0.00 C ATOM 13 C ASP A 24 79.702 3.428 2.430 1.00 0.00 C ATOM 14 O ASP A 24 80.813 3.132 1.992 1.00 0.00 O ATOM 15 CB ASP A 24 80.926 4.219 4.454 1.00 0.00 C ATOM 16 CG ASP A 24 80.762 4.714 5.887 1.00 0.00 C ATOM 17 OD1 ASP A 24 80.493 5.892 6.060 1.00 0.00 O ATOM 18 OD2 ASP A 24 80.906 3.908 6.791 1.00 0.00 O ATOM 0 H ASP A 24 77.880 3.947 5.018 1.00 0.00 H new ATOM 0 HA ASP A 24 79.164 5.132 3.614 1.00 0.00 H new ATOM 0 HB2 ASP A 24 81.409 3.242 4.451 1.00 0.00 H new ATOM 0 HB3 ASP A 24 81.574 4.897 3.898 1.00 0.00 H new ATOM 23 N PRO A 25 78.605 3.156 1.773 1.00 0.00 N ATOM 24 CA PRO A 25 78.616 2.471 0.449 1.00 0.00 C ATOM 25 C PRO A 25 79.517 3.202 -0.545 1.00 0.00 C ATOM 26 O PRO A 25 79.812 2.699 -1.623 1.00 0.00 O ATOM 27 CB PRO A 25 77.133 2.484 0.004 1.00 0.00 C ATOM 28 CG PRO A 25 76.456 3.482 0.896 1.00 0.00 C ATOM 29 CD PRO A 25 77.235 3.472 2.207 1.00 0.00 C ATOM 0 HA PRO A 25 79.017 1.459 0.502 1.00 0.00 H new ATOM 0 HB2 PRO A 25 77.040 2.768 -1.044 1.00 0.00 H new ATOM 0 HB3 PRO A 25 76.683 1.496 0.108 1.00 0.00 H new ATOM 0 HG2 PRO A 25 76.463 4.475 0.446 1.00 0.00 H new ATOM 0 HG3 PRO A 25 75.412 3.213 1.060 1.00 0.00 H new ATOM 0 HD2 PRO A 25 77.184 4.435 2.715 1.00 0.00 H new ATOM 0 HD3 PRO A 25 76.849 2.725 2.901 1.00 0.00 H new ATOM 37 N LEU A 26 79.921 4.384 -0.194 1.00 0.00 N ATOM 38 CA LEU A 26 80.768 5.180 -1.081 1.00 0.00 C ATOM 39 C LEU A 26 82.101 4.481 -1.368 1.00 0.00 C ATOM 40 O LEU A 26 82.587 4.504 -2.498 1.00 0.00 O ATOM 41 CB LEU A 26 81.029 6.552 -0.442 1.00 0.00 C ATOM 42 CG LEU A 26 79.803 7.454 -0.617 1.00 0.00 C ATOM 43 CD1 LEU A 26 78.568 6.780 -0.013 1.00 0.00 C ATOM 44 CD2 LEU A 26 80.054 8.787 0.091 1.00 0.00 C ATOM 0 H LEU A 26 79.689 4.832 0.692 1.00 0.00 H new ATOM 0 HA LEU A 26 80.245 5.302 -2.030 1.00 0.00 H new ATOM 0 HB2 LEU A 26 81.254 6.432 0.618 1.00 0.00 H new ATOM 0 HB3 LEU A 26 81.901 7.017 -0.902 1.00 0.00 H new ATOM 0 HG LEU A 26 79.631 7.627 -1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 26 77.701 7.428 -0.141 1.00 0.00 H new ATOM 0 HD12 LEU A 26 78.389 5.830 -0.516 1.00 0.00 H new ATOM 0 HD13 LEU A 26 78.734 6.602 1.050 1.00 0.00 H new ATOM 0 HD21 LEU A 26 79.184 9.433 -0.030 1.00 0.00 H new ATOM 0 HD22 LEU A 26 80.228 8.608 1.152 1.00 0.00 H new ATOM 0 HD23 LEU A 26 80.929 9.271 -0.344 1.00 0.00 H new ATOM 56 N VAL A 27 82.686 3.893 -0.362 1.00 0.00 N ATOM 57 CA VAL A 27 83.973 3.219 -0.527 1.00 0.00 C ATOM 58 C VAL A 27 83.851 1.969 -1.392 1.00 0.00 C ATOM 59 O VAL A 27 84.737 1.674 -2.193 1.00 0.00 O ATOM 60 CB VAL A 27 84.544 2.820 0.839 1.00 0.00 C ATOM 61 CG1 VAL A 27 85.983 2.330 0.664 1.00 0.00 C ATOM 62 CG2 VAL A 27 84.534 4.020 1.790 1.00 0.00 C ATOM 0 H VAL A 27 82.305 3.859 0.584 1.00 0.00 H new ATOM 0 HA VAL A 27 84.641 3.923 -1.023 1.00 0.00 H new ATOM 0 HB VAL A 27 83.928 2.026 1.261 1.00 0.00 H new ATOM 0 HG11 VAL A 27 86.391 2.046 1.634 1.00 0.00 H new ATOM 0 HG12 VAL A 27 85.995 1.467 -0.002 1.00 0.00 H new ATOM 0 HG13 VAL A 27 86.589 3.128 0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 27 84.942 3.722 2.756 1.00 0.00 H new ATOM 0 HG22 VAL A 27 85.142 4.822 1.371 1.00 0.00 H new ATOM 0 HG23 VAL A 27 83.511 4.372 1.921 1.00 0.00 H new ATOM 72 N VAL A 28 82.778 1.249 -1.233 1.00 0.00 N ATOM 73 CA VAL A 28 82.577 0.033 -2.015 1.00 0.00 C ATOM 74 C VAL A 28 82.241 0.354 -3.478 1.00 0.00 C ATOM 75 O VAL A 28 82.531 -0.443 -4.368 1.00 0.00 O ATOM 76 CB VAL A 28 81.483 -0.857 -1.365 1.00 0.00 C ATOM 77 CG1 VAL A 28 80.094 -0.542 -1.944 1.00 0.00 C ATOM 78 CG2 VAL A 28 81.800 -2.342 -1.609 1.00 0.00 C ATOM 0 H VAL A 28 82.027 1.468 -0.579 1.00 0.00 H new ATOM 0 HA VAL A 28 83.513 -0.526 -2.016 1.00 0.00 H new ATOM 0 HB VAL A 28 81.475 -0.647 -0.296 1.00 0.00 H new ATOM 0 HG11 VAL A 28 79.349 -1.181 -1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 28 79.849 0.503 -1.755 1.00 0.00 H new ATOM 0 HG13 VAL A 28 80.098 -0.725 -3.019 1.00 0.00 H new ATOM 0 HG21 VAL A 28 81.028 -2.959 -1.150 1.00 0.00 H new ATOM 0 HG22 VAL A 28 81.830 -2.536 -2.681 1.00 0.00 H new ATOM 0 HG23 VAL A 28 82.767 -2.585 -1.169 1.00 0.00 H new ATOM 88 N ALA A 29 81.607 1.480 -3.722 1.00 0.00 N ATOM 89 CA ALA A 29 81.213 1.830 -5.088 1.00 0.00 C ATOM 90 C ALA A 29 82.408 1.991 -6.026 1.00 0.00 C ATOM 91 O ALA A 29 82.448 1.353 -7.077 1.00 0.00 O ATOM 92 CB ALA A 29 80.408 3.129 -5.068 1.00 0.00 C ATOM 0 H ALA A 29 81.352 2.166 -3.011 1.00 0.00 H new ATOM 0 HA ALA A 29 80.610 1.006 -5.470 1.00 0.00 H new ATOM 0 HB1 ALA A 29 80.114 3.391 -6.085 1.00 0.00 H new ATOM 0 HB2 ALA A 29 79.516 2.995 -4.456 1.00 0.00 H new ATOM 0 HB3 ALA A 29 81.019 3.929 -4.650 1.00 0.00 H new ATOM 98 N ALA A 30 83.370 2.810 -5.680 1.00 0.00 N ATOM 99 CA ALA A 30 84.515 2.973 -6.559 1.00 0.00 C ATOM 100 C ALA A 30 85.169 1.621 -6.770 1.00 0.00 C ATOM 101 O ALA A 30 85.421 1.193 -7.896 1.00 0.00 O ATOM 102 CB ALA A 30 85.504 3.915 -5.910 1.00 0.00 C ATOM 0 H ALA A 30 83.391 3.362 -4.823 1.00 0.00 H new ATOM 0 HA ALA A 30 84.197 3.381 -7.518 1.00 0.00 H new ATOM 0 HB1 ALA A 30 86.367 4.043 -6.563 1.00 0.00 H new ATOM 0 HB2 ALA A 30 85.029 4.882 -5.742 1.00 0.00 H new ATOM 0 HB3 ALA A 30 85.830 3.500 -4.956 1.00 0.00 H new ATOM 108 N SER A 31 85.415 0.972 -5.674 1.00 0.00 N ATOM 109 CA SER A 31 86.026 -0.348 -5.695 1.00 0.00 C ATOM 110 C SER A 31 85.303 -1.241 -6.709 1.00 0.00 C ATOM 111 O SER A 31 85.936 -1.866 -7.561 1.00 0.00 O ATOM 112 CB SER A 31 85.921 -0.963 -4.304 1.00 0.00 C ATOM 113 OG SER A 31 86.551 -2.236 -4.300 1.00 0.00 O ATOM 0 H SER A 31 85.205 1.326 -4.741 1.00 0.00 H new ATOM 0 HA SER A 31 87.073 -0.262 -5.984 1.00 0.00 H new ATOM 0 HB2 SER A 31 86.392 -0.310 -3.570 1.00 0.00 H new ATOM 0 HB3 SER A 31 84.874 -1.063 -4.017 1.00 0.00 H new ATOM 0 HG SER A 31 86.485 -2.631 -3.406 1.00 0.00 H new ATOM 119 N ILE A 32 84.000 -1.300 -6.604 1.00 0.00 N ATOM 120 CA ILE A 32 83.198 -2.126 -7.509 1.00 0.00 C ATOM 121 C ILE A 32 83.561 -1.854 -8.977 1.00 0.00 C ATOM 122 O ILE A 32 83.769 -2.792 -9.747 1.00 0.00 O ATOM 123 CB ILE A 32 81.696 -1.864 -7.250 1.00 0.00 C ATOM 124 CG1 ILE A 32 81.238 -2.680 -6.030 1.00 0.00 C ATOM 125 CG2 ILE A 32 80.854 -2.268 -8.468 1.00 0.00 C ATOM 126 CD1 ILE A 32 79.842 -2.227 -5.592 1.00 0.00 C ATOM 0 H ILE A 32 83.459 -0.791 -5.905 1.00 0.00 H new ATOM 0 HA ILE A 32 83.414 -3.176 -7.313 1.00 0.00 H new ATOM 0 HB ILE A 32 81.558 -0.799 -7.065 1.00 0.00 H new ATOM 0 HG12 ILE A 32 81.224 -3.742 -6.276 1.00 0.00 H new ATOM 0 HG13 ILE A 32 81.945 -2.552 -5.210 1.00 0.00 H new ATOM 0 HG21 ILE A 32 79.801 -2.075 -8.263 1.00 0.00 H new ATOM 0 HG22 ILE A 32 81.167 -1.687 -9.336 1.00 0.00 H new ATOM 0 HG23 ILE A 32 80.995 -3.329 -8.672 1.00 0.00 H new ATOM 0 HD11 ILE A 32 79.525 -2.810 -4.727 1.00 0.00 H new ATOM 0 HD12 ILE A 32 79.869 -1.170 -5.327 1.00 0.00 H new ATOM 0 HD13 ILE A 32 79.137 -2.378 -6.410 1.00 0.00 H new ATOM 138 N ILE A 33 83.646 -0.606 -9.358 1.00 0.00 N ATOM 139 CA ILE A 33 83.999 -0.283 -10.741 1.00 0.00 C ATOM 140 C ILE A 33 85.408 -0.789 -11.039 1.00 0.00 C ATOM 141 O ILE A 33 85.678 -1.332 -12.111 1.00 0.00 O ATOM 142 CB ILE A 33 83.928 1.232 -10.985 1.00 0.00 C ATOM 143 CG1 ILE A 33 82.495 1.728 -10.740 1.00 0.00 C ATOM 144 CG2 ILE A 33 84.330 1.530 -12.434 1.00 0.00 C ATOM 145 CD1 ILE A 33 82.449 3.260 -10.830 1.00 0.00 C ATOM 0 H ILE A 33 83.482 0.199 -8.753 1.00 0.00 H new ATOM 0 HA ILE A 33 83.285 -0.771 -11.405 1.00 0.00 H new ATOM 0 HB ILE A 33 84.608 1.742 -10.303 1.00 0.00 H new ATOM 0 HG12 ILE A 33 81.819 1.291 -11.475 1.00 0.00 H new ATOM 0 HG13 ILE A 33 82.151 1.402 -9.758 1.00 0.00 H new ATOM 0 HG21 ILE A 33 84.281 2.604 -12.612 1.00 0.00 H new ATOM 0 HG22 ILE A 33 85.347 1.179 -12.609 1.00 0.00 H new ATOM 0 HG23 ILE A 33 83.648 1.019 -13.113 1.00 0.00 H new ATOM 0 HD11 ILE A 33 81.430 3.604 -10.655 1.00 0.00 H new ATOM 0 HD12 ILE A 33 83.111 3.689 -10.078 1.00 0.00 H new ATOM 0 HD13 ILE A 33 82.774 3.576 -11.821 1.00 0.00 H new ATOM 157 N GLY A 34 86.290 -0.564 -10.108 1.00 0.00 N ATOM 158 CA GLY A 34 87.688 -0.950 -10.271 1.00 0.00 C ATOM 159 C GLY A 34 87.834 -2.381 -10.791 1.00 0.00 C ATOM 160 O GLY A 34 88.559 -2.618 -11.757 1.00 0.00 O ATOM 0 H GLY A 34 86.077 -0.113 -9.218 1.00 0.00 H new ATOM 0 HA2 GLY A 34 88.175 -0.262 -10.962 1.00 0.00 H new ATOM 0 HA3 GLY A 34 88.203 -0.858 -9.315 1.00 0.00 H new ATOM 164 N ILE A 35 87.169 -3.314 -10.169 1.00 0.00 N ATOM 165 CA ILE A 35 87.256 -4.710 -10.602 1.00 0.00 C ATOM 166 C ILE A 35 86.544 -4.923 -11.937 1.00 0.00 C ATOM 167 O ILE A 35 86.910 -5.807 -12.712 1.00 0.00 O ATOM 168 CB ILE A 35 86.646 -5.631 -9.543 1.00 0.00 C ATOM 169 CG1 ILE A 35 85.226 -5.165 -9.210 1.00 0.00 C ATOM 170 CG2 ILE A 35 87.503 -5.590 -8.278 1.00 0.00 C ATOM 171 CD1 ILE A 35 84.528 -6.227 -8.360 1.00 0.00 C ATOM 0 H ILE A 35 86.562 -3.151 -9.366 1.00 0.00 H new ATOM 0 HA ILE A 35 88.311 -4.952 -10.732 1.00 0.00 H new ATOM 0 HB ILE A 35 86.611 -6.650 -9.929 1.00 0.00 H new ATOM 0 HG12 ILE A 35 85.259 -4.217 -8.672 1.00 0.00 H new ATOM 0 HG13 ILE A 35 84.664 -4.991 -10.128 1.00 0.00 H new ATOM 0 HG21 ILE A 35 87.069 -6.246 -7.523 1.00 0.00 H new ATOM 0 HG22 ILE A 35 88.514 -5.925 -8.512 1.00 0.00 H new ATOM 0 HG23 ILE A 35 87.538 -4.570 -7.895 1.00 0.00 H new ATOM 0 HD11 ILE A 35 83.517 -5.896 -8.122 1.00 0.00 H new ATOM 0 HD12 ILE A 35 84.482 -7.164 -8.914 1.00 0.00 H new ATOM 0 HD13 ILE A 35 85.087 -6.379 -7.436 1.00 0.00 H new ATOM 183 N LEU A 36 85.534 -4.137 -12.184 1.00 0.00 N ATOM 184 CA LEU A 36 84.757 -4.253 -13.416 1.00 0.00 C ATOM 185 C LEU A 36 85.612 -3.969 -14.653 1.00 0.00 C ATOM 186 O LEU A 36 85.418 -4.583 -15.702 1.00 0.00 O ATOM 187 CB LEU A 36 83.585 -3.260 -13.369 1.00 0.00 C ATOM 188 CG LEU A 36 82.601 -3.522 -14.530 1.00 0.00 C ATOM 189 CD1 LEU A 36 81.623 -4.645 -14.161 1.00 0.00 C ATOM 190 CD2 LEU A 36 81.803 -2.244 -14.822 1.00 0.00 C ATOM 0 H LEU A 36 85.217 -3.401 -11.553 1.00 0.00 H new ATOM 0 HA LEU A 36 84.389 -5.276 -13.489 1.00 0.00 H new ATOM 0 HB2 LEU A 36 83.063 -3.350 -12.416 1.00 0.00 H new ATOM 0 HB3 LEU A 36 83.964 -2.240 -13.430 1.00 0.00 H new ATOM 0 HG LEU A 36 83.172 -3.819 -15.410 1.00 0.00 H new ATOM 0 HD11 LEU A 36 80.937 -4.817 -14.990 1.00 0.00 H new ATOM 0 HD12 LEU A 36 82.180 -5.559 -13.955 1.00 0.00 H new ATOM 0 HD13 LEU A 36 81.057 -4.358 -13.275 1.00 0.00 H new ATOM 0 HD21 LEU A 36 81.108 -2.428 -15.641 1.00 0.00 H new ATOM 0 HD22 LEU A 36 81.245 -1.952 -13.932 1.00 0.00 H new ATOM 0 HD23 LEU A 36 82.488 -1.443 -15.100 1.00 0.00 H new ATOM 202 N HIS A 37 86.535 -3.054 -14.530 1.00 0.00 N ATOM 203 CA HIS A 37 87.404 -2.703 -15.653 1.00 0.00 C ATOM 204 C HIS A 37 88.442 -3.786 -15.952 1.00 0.00 C ATOM 205 O HIS A 37 88.898 -3.921 -17.087 1.00 0.00 O ATOM 206 CB HIS A 37 88.094 -1.356 -15.405 1.00 0.00 C ATOM 207 CG HIS A 37 89.166 -1.463 -14.348 1.00 0.00 C ATOM 208 ND1 HIS A 37 90.095 -2.494 -14.314 1.00 0.00 N ATOM 209 CD2 HIS A 37 89.479 -0.647 -13.291 1.00 0.00 C ATOM 210 CE1 HIS A 37 90.910 -2.272 -13.267 1.00 0.00 C ATOM 211 NE2 HIS A 37 90.578 -1.159 -12.609 1.00 0.00 N ATOM 0 H HIS A 37 86.715 -2.532 -13.672 1.00 0.00 H new ATOM 0 HA HIS A 37 86.764 -2.620 -16.532 1.00 0.00 H new ATOM 0 HB2 HIS A 37 88.535 -0.996 -16.335 1.00 0.00 H new ATOM 0 HB3 HIS A 37 87.352 -0.619 -15.098 1.00 0.00 H new ATOM 0 HD2 HIS A 37 88.951 0.258 -13.028 1.00 0.00 H new ATOM 0 HE1 HIS A 37 91.733 -2.916 -12.992 1.00 0.00 H new ATOM 0 HE2 HIS A 37 91.032 -0.768 -11.784 1.00 0.00 H new ATOM 220 N PHE A 38 88.837 -4.511 -14.942 1.00 0.00 N ATOM 221 CA PHE A 38 89.862 -5.541 -15.106 1.00 0.00 C ATOM 222 C PHE A 38 89.531 -6.524 -16.235 1.00 0.00 C ATOM 223 O PHE A 38 90.388 -6.823 -17.066 1.00 0.00 O ATOM 224 CB PHE A 38 90.048 -6.305 -13.792 1.00 0.00 C ATOM 225 CG PHE A 38 91.081 -7.389 -13.987 1.00 0.00 C ATOM 226 CD1 PHE A 38 90.698 -8.628 -14.514 1.00 0.00 C ATOM 227 CD2 PHE A 38 92.421 -7.157 -13.648 1.00 0.00 C ATOM 228 CE1 PHE A 38 91.652 -9.634 -14.703 1.00 0.00 C ATOM 229 CE2 PHE A 38 93.374 -8.165 -13.836 1.00 0.00 C ATOM 230 CZ PHE A 38 92.990 -9.403 -14.363 1.00 0.00 C ATOM 0 H PHE A 38 88.474 -4.419 -13.993 1.00 0.00 H new ATOM 0 HA PHE A 38 90.788 -5.034 -15.378 1.00 0.00 H new ATOM 0 HB2 PHE A 38 90.365 -5.623 -13.003 1.00 0.00 H new ATOM 0 HB3 PHE A 38 89.101 -6.742 -13.475 1.00 0.00 H new ATOM 0 HD1 PHE A 38 89.665 -8.808 -14.775 1.00 0.00 H new ATOM 0 HD2 PHE A 38 92.718 -6.201 -13.242 1.00 0.00 H new ATOM 0 HE1 PHE A 38 91.356 -10.589 -15.111 1.00 0.00 H new ATOM 0 HE2 PHE A 38 94.407 -7.987 -13.574 1.00 0.00 H new ATOM 0 HZ PHE A 38 93.726 -10.180 -14.507 1.00 0.00 H new ATOM 240 N ILE A 39 88.326 -7.026 -16.262 1.00 0.00 N ATOM 241 CA ILE A 39 87.941 -7.982 -17.301 1.00 0.00 C ATOM 242 C ILE A 39 88.055 -7.350 -18.689 1.00 0.00 C ATOM 243 O ILE A 39 88.317 -8.036 -19.673 1.00 0.00 O ATOM 244 CB ILE A 39 86.500 -8.475 -17.076 1.00 0.00 C ATOM 245 CG1 ILE A 39 86.423 -9.335 -15.799 1.00 0.00 C ATOM 246 CG2 ILE A 39 86.057 -9.326 -18.275 1.00 0.00 C ATOM 247 CD1 ILE A 39 86.422 -8.449 -14.547 1.00 0.00 C ATOM 0 H ILE A 39 87.591 -6.801 -15.591 1.00 0.00 H new ATOM 0 HA ILE A 39 88.622 -8.831 -17.242 1.00 0.00 H new ATOM 0 HB ILE A 39 85.847 -7.609 -16.968 1.00 0.00 H new ATOM 0 HG12 ILE A 39 85.520 -9.945 -15.819 1.00 0.00 H new ATOM 0 HG13 ILE A 39 87.270 -10.020 -15.765 1.00 0.00 H new ATOM 0 HG21 ILE A 39 85.037 -9.675 -18.116 1.00 0.00 H new ATOM 0 HG22 ILE A 39 86.097 -8.724 -19.183 1.00 0.00 H new ATOM 0 HG23 ILE A 39 86.722 -10.183 -18.378 1.00 0.00 H new ATOM 0 HD11 ILE A 39 86.367 -9.076 -13.657 1.00 0.00 H new ATOM 0 HD12 ILE A 39 87.338 -7.858 -14.519 1.00 0.00 H new ATOM 0 HD13 ILE A 39 85.561 -7.782 -14.574 1.00 0.00 H new ATOM 259 N ALA A 40 87.858 -6.066 -18.761 1.00 0.00 N ATOM 260 CA ALA A 40 87.953 -5.366 -20.035 1.00 0.00 C ATOM 261 C ALA A 40 89.408 -5.224 -20.479 1.00 0.00 C ATOM 262 O ALA A 40 89.701 -5.124 -21.666 1.00 0.00 O ATOM 263 CB ALA A 40 87.289 -3.994 -19.926 1.00 0.00 C ATOM 0 H ALA A 40 87.631 -5.473 -17.963 1.00 0.00 H new ATOM 0 HA ALA A 40 87.431 -5.954 -20.790 1.00 0.00 H new ATOM 0 HB1 ALA A 40 87.364 -3.476 -20.882 1.00 0.00 H new ATOM 0 HB2 ALA A 40 86.239 -4.118 -19.662 1.00 0.00 H new ATOM 0 HB3 ALA A 40 87.790 -3.407 -19.156 1.00 0.00 H new ATOM 269 N TRP A 41 90.291 -5.157 -19.525 1.00 0.00 N ATOM 270 CA TRP A 41 91.711 -4.966 -19.798 1.00 0.00 C ATOM 271 C TRP A 41 92.309 -6.082 -20.657 1.00 0.00 C ATOM 272 O TRP A 41 93.052 -5.815 -21.601 1.00 0.00 O ATOM 273 CB TRP A 41 92.453 -4.897 -18.464 1.00 0.00 C ATOM 274 CG TRP A 41 93.854 -4.445 -18.693 1.00 0.00 C ATOM 275 CD1 TRP A 41 94.810 -5.173 -19.308 1.00 0.00 C ATOM 276 CD2 TRP A 41 94.473 -3.183 -18.313 1.00 0.00 C ATOM 277 NE1 TRP A 41 95.978 -4.430 -19.346 1.00 0.00 N ATOM 278 CE2 TRP A 41 95.819 -3.197 -18.741 1.00 0.00 C ATOM 279 CE3 TRP A 41 94.000 -2.036 -17.648 1.00 0.00 C ATOM 280 CZ2 TRP A 41 96.667 -2.111 -18.518 1.00 0.00 C ATOM 281 CZ3 TRP A 41 94.853 -0.944 -17.418 1.00 0.00 C ATOM 282 CH2 TRP A 41 96.185 -0.983 -17.854 1.00 0.00 C ATOM 0 H TRP A 41 90.061 -5.231 -18.534 1.00 0.00 H new ATOM 0 HA TRP A 41 91.821 -4.041 -20.364 1.00 0.00 H new ATOM 0 HB2 TRP A 41 91.944 -4.209 -17.789 1.00 0.00 H new ATOM 0 HB3 TRP A 41 92.450 -5.876 -17.984 1.00 0.00 H new ATOM 0 HD1 TRP A 41 94.685 -6.170 -19.705 1.00 0.00 H new ATOM 0 HE1 TRP A 41 96.849 -4.753 -19.768 1.00 0.00 H new ATOM 0 HE3 TRP A 41 92.974 -1.995 -17.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 97.692 -2.144 -18.858 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 94.481 -0.070 -16.903 1.00 0.00 H new ATOM 0 HH2 TRP A 41 96.837 -0.141 -17.676 1.00 0.00 H new ATOM 293 N THR A 42 92.035 -7.301 -20.302 1.00 0.00 N ATOM 294 CA THR A 42 92.602 -8.447 -21.011 1.00 0.00 C ATOM 295 C THR A 42 92.464 -8.346 -22.534 1.00 0.00 C ATOM 296 O THR A 42 93.386 -8.737 -23.250 1.00 0.00 O ATOM 297 CB THR A 42 91.945 -9.745 -20.524 1.00 0.00 C ATOM 298 OG1 THR A 42 92.021 -10.729 -21.546 1.00 0.00 O ATOM 299 CG2 THR A 42 90.484 -9.475 -20.187 1.00 0.00 C ATOM 0 H THR A 42 91.422 -7.545 -19.525 1.00 0.00 H new ATOM 0 HA THR A 42 93.668 -8.451 -20.786 1.00 0.00 H new ATOM 0 HB THR A 42 92.465 -10.105 -19.636 1.00 0.00 H new ATOM 0 HG1 THR A 42 91.602 -11.558 -21.234 1.00 0.00 H new ATOM 0 HG21 THR A 42 90.014 -10.396 -19.841 1.00 0.00 H new ATOM 0 HG22 THR A 42 90.425 -8.720 -19.403 1.00 0.00 H new ATOM 0 HG23 THR A 42 89.966 -9.116 -21.076 1.00 0.00 H new ATOM 307 N ILE A 43 91.358 -7.859 -23.046 1.00 0.00 N ATOM 308 CA ILE A 43 91.233 -7.785 -24.506 1.00 0.00 C ATOM 309 C ILE A 43 92.237 -6.789 -25.091 1.00 0.00 C ATOM 310 O ILE A 43 92.882 -7.079 -26.093 1.00 0.00 O ATOM 311 CB ILE A 43 89.803 -7.427 -24.953 1.00 0.00 C ATOM 312 CG1 ILE A 43 89.254 -6.241 -24.144 1.00 0.00 C ATOM 313 CG2 ILE A 43 88.890 -8.644 -24.758 1.00 0.00 C ATOM 314 CD1 ILE A 43 88.134 -5.549 -24.933 1.00 0.00 C ATOM 0 H ILE A 43 90.558 -7.519 -22.513 1.00 0.00 H new ATOM 0 HA ILE A 43 91.457 -8.780 -24.891 1.00 0.00 H new ATOM 0 HB ILE A 43 89.830 -7.144 -26.005 1.00 0.00 H new ATOM 0 HG12 ILE A 43 88.874 -6.589 -23.184 1.00 0.00 H new ATOM 0 HG13 ILE A 43 90.054 -5.532 -23.932 1.00 0.00 H new ATOM 0 HG21 ILE A 43 87.877 -8.393 -25.074 1.00 0.00 H new ATOM 0 HG22 ILE A 43 89.261 -9.477 -25.356 1.00 0.00 H new ATOM 0 HG23 ILE A 43 88.882 -8.928 -23.706 1.00 0.00 H new ATOM 0 HD11 ILE A 43 87.748 -4.709 -24.356 1.00 0.00 H new ATOM 0 HD12 ILE A 43 88.528 -5.186 -25.882 1.00 0.00 H new ATOM 0 HD13 ILE A 43 87.329 -6.260 -25.122 1.00 0.00 H new ATOM 326 N GLY A 44 92.370 -5.645 -24.482 1.00 0.00 N ATOM 327 CA GLY A 44 93.306 -4.636 -24.977 1.00 0.00 C ATOM 328 C GLY A 44 94.740 -5.165 -25.006 1.00 0.00 C ATOM 329 O GLY A 44 95.491 -4.908 -25.947 1.00 0.00 O ATOM 0 H GLY A 44 91.852 -5.374 -23.646 1.00 0.00 H new ATOM 0 HA2 GLY A 44 93.011 -4.326 -25.980 1.00 0.00 H new ATOM 0 HA3 GLY A 44 93.257 -3.751 -24.343 1.00 0.00 H new ATOM 333 N HIS A 45 95.102 -5.880 -23.979 1.00 0.00 N ATOM 334 CA HIS A 45 96.443 -6.436 -23.861 1.00 0.00 C ATOM 335 C HIS A 45 96.865 -7.179 -25.134 1.00 0.00 C ATOM 336 O HIS A 45 98.057 -7.307 -25.414 1.00 0.00 O ATOM 337 CB HIS A 45 96.505 -7.374 -22.657 1.00 0.00 C ATOM 338 CG HIS A 45 97.945 -7.650 -22.307 1.00 0.00 C ATOM 339 ND1 HIS A 45 98.458 -8.934 -22.218 1.00 0.00 N ATOM 340 CD2 HIS A 45 98.993 -6.808 -22.022 1.00 0.00 C ATOM 341 CE1 HIS A 45 99.760 -8.829 -21.891 1.00 0.00 C ATOM 342 NE2 HIS A 45 100.137 -7.555 -21.760 1.00 0.00 N ATOM 0 H HIS A 45 94.487 -6.100 -23.196 1.00 0.00 H new ATOM 0 HA HIS A 45 97.140 -5.610 -23.719 1.00 0.00 H new ATOM 0 HB2 HIS A 45 95.993 -6.925 -21.806 1.00 0.00 H new ATOM 0 HB3 HIS A 45 95.989 -8.307 -22.883 1.00 0.00 H new ATOM 0 HD2 HIS A 45 98.937 -5.730 -22.004 1.00 0.00 H new ATOM 0 HE1 HIS A 45 100.419 -9.673 -21.752 1.00 0.00 H new ATOM 0 HE2 HIS A 45 101.064 -7.205 -21.520 1.00 0.00 H new ATOM 351 N LEU A 46 95.911 -7.696 -25.864 1.00 0.00 N ATOM 352 CA LEU A 46 96.218 -8.465 -27.074 1.00 0.00 C ATOM 353 C LEU A 46 97.267 -7.757 -27.936 1.00 0.00 C ATOM 354 O LEU A 46 98.029 -8.410 -28.649 1.00 0.00 O ATOM 355 CB LEU A 46 94.918 -8.704 -27.891 1.00 0.00 C ATOM 356 CG LEU A 46 94.669 -7.556 -28.908 1.00 0.00 C ATOM 357 CD1 LEU A 46 95.452 -7.800 -30.229 1.00 0.00 C ATOM 358 CD2 LEU A 46 93.163 -7.441 -29.210 1.00 0.00 C ATOM 0 H LEU A 46 94.916 -7.608 -25.656 1.00 0.00 H new ATOM 0 HA LEU A 46 96.634 -9.426 -26.770 1.00 0.00 H new ATOM 0 HB2 LEU A 46 94.989 -9.653 -28.422 1.00 0.00 H new ATOM 0 HB3 LEU A 46 94.069 -8.781 -27.212 1.00 0.00 H new ATOM 0 HG LEU A 46 95.025 -6.626 -28.465 1.00 0.00 H new ATOM 0 HD11 LEU A 46 95.259 -6.981 -30.923 1.00 0.00 H new ATOM 0 HD12 LEU A 46 96.520 -7.851 -30.015 1.00 0.00 H new ATOM 0 HD13 LEU A 46 95.127 -8.739 -30.677 1.00 0.00 H new ATOM 0 HD21 LEU A 46 92.996 -6.634 -29.924 1.00 0.00 H new ATOM 0 HD22 LEU A 46 92.804 -8.379 -29.632 1.00 0.00 H new ATOM 0 HD23 LEU A 46 92.622 -7.228 -28.288 1.00 0.00 H new ATOM 370 N ASN A 47 97.304 -6.456 -27.878 1.00 0.00 N ATOM 371 CA ASN A 47 98.275 -5.715 -28.678 1.00 0.00 C ATOM 372 C ASN A 47 99.702 -6.098 -28.278 1.00 0.00 C ATOM 373 O ASN A 47 100.521 -6.446 -29.129 1.00 0.00 O ATOM 374 CB ASN A 47 98.069 -4.211 -28.486 1.00 0.00 C ATOM 375 CG ASN A 47 96.730 -3.790 -29.080 1.00 0.00 C ATOM 376 OD1 ASN A 47 95.912 -3.061 -28.372 1.00 0.00 O flip ATOM 377 ND2 ASN A 47 96.419 -4.137 -30.220 1.00 0.00 N flip ATOM 0 H ASN A 47 96.690 -5.882 -27.300 1.00 0.00 H new ATOM 0 HA ASN A 47 98.126 -5.968 -29.728 1.00 0.00 H new ATOM 0 HB2 ASN A 47 98.100 -3.964 -27.425 1.00 0.00 H new ATOM 0 HB3 ASN A 47 98.878 -3.660 -28.965 1.00 0.00 H new ATOM 0 HD21 ASN A 47 97.060 -4.707 -30.772 1.00 0.00 H new ATOM 0 HD22 ASN A 47 95.521 -3.854 -30.612 1.00 0.00 H new ATOM 384 N GLN A 48 99.988 -6.024 -27.006 1.00 0.00 N ATOM 385 CA GLN A 48 101.320 -6.356 -26.511 1.00 0.00 C ATOM 386 C GLN A 48 101.749 -7.741 -26.991 1.00 0.00 C ATOM 387 O GLN A 48 102.830 -7.900 -27.558 1.00 0.00 O ATOM 388 CB GLN A 48 101.336 -6.307 -24.977 1.00 0.00 C ATOM 389 CG GLN A 48 102.775 -6.150 -24.471 1.00 0.00 C ATOM 390 CD GLN A 48 103.594 -7.387 -24.824 1.00 0.00 C ATOM 391 OE1 GLN A 48 103.103 -8.510 -24.713 1.00 0.00 O ATOM 392 NE2 GLN A 48 104.821 -7.247 -25.248 1.00 0.00 N ATOM 0 H GLN A 48 99.325 -5.738 -26.285 1.00 0.00 H new ATOM 0 HA GLN A 48 102.024 -5.622 -26.903 1.00 0.00 H new ATOM 0 HB2 GLN A 48 100.726 -5.475 -24.625 1.00 0.00 H new ATOM 0 HB3 GLN A 48 100.897 -7.218 -24.571 1.00 0.00 H new ATOM 0 HG2 GLN A 48 103.230 -5.265 -24.915 1.00 0.00 H new ATOM 0 HG3 GLN A 48 102.775 -6.001 -23.391 1.00 0.00 H new ATOM 0 HE21 GLN A 48 105.226 -6.315 -25.339 1.00 0.00 H new ATOM 0 HE22 GLN A 48 105.375 -8.069 -25.488 1.00 0.00 H new ATOM 401 N ILE A 49 100.922 -8.724 -26.757 1.00 0.00 N ATOM 402 CA ILE A 49 101.243 -10.089 -27.164 1.00 0.00 C ATOM 403 C ILE A 49 101.552 -10.151 -28.655 1.00 0.00 C ATOM 404 O ILE A 49 102.558 -10.730 -29.065 1.00 0.00 O ATOM 405 CB ILE A 49 100.064 -11.016 -26.857 1.00 0.00 C ATOM 406 CG1 ILE A 49 99.624 -10.838 -25.396 1.00 0.00 C ATOM 407 CG2 ILE A 49 100.476 -12.471 -27.098 1.00 0.00 C ATOM 408 CD1 ILE A 49 100.818 -11.007 -24.449 1.00 0.00 C ATOM 0 H ILE A 49 100.022 -8.619 -26.289 1.00 0.00 H new ATOM 0 HA ILE A 49 102.122 -10.411 -26.606 1.00 0.00 H new ATOM 0 HB ILE A 49 99.231 -10.763 -27.513 1.00 0.00 H new ATOM 0 HG12 ILE A 49 99.183 -9.850 -25.261 1.00 0.00 H new ATOM 0 HG13 ILE A 49 98.852 -11.568 -25.151 1.00 0.00 H new ATOM 0 HG21 ILE A 49 99.635 -13.128 -26.879 1.00 0.00 H new ATOM 0 HG22 ILE A 49 100.773 -12.597 -28.139 1.00 0.00 H new ATOM 0 HG23 ILE A 49 101.314 -12.724 -26.448 1.00 0.00 H new ATOM 0 HD11 ILE A 49 100.486 -10.877 -23.419 1.00 0.00 H new ATOM 0 HD12 ILE A 49 101.241 -12.004 -24.571 1.00 0.00 H new ATOM 0 HD13 ILE A 49 101.576 -10.260 -24.683 1.00 0.00 H new ATOM 420 N LYS A 50 100.696 -9.568 -29.450 1.00 0.00 N ATOM 421 CA LYS A 50 100.886 -9.570 -30.899 1.00 0.00 C ATOM 422 C LYS A 50 101.874 -8.477 -31.311 1.00 0.00 C ATOM 423 O LYS A 50 103.007 -8.766 -31.694 1.00 0.00 O ATOM 424 CB LYS A 50 99.530 -9.355 -31.599 1.00 0.00 C ATOM 425 CG LYS A 50 99.531 -10.016 -32.984 1.00 0.00 C ATOM 426 CD LYS A 50 100.599 -9.367 -33.869 1.00 0.00 C ATOM 427 CE LYS A 50 100.353 -9.746 -35.331 1.00 0.00 C ATOM 428 NZ LYS A 50 99.178 -8.989 -35.849 1.00 0.00 N ATOM 0 H LYS A 50 99.857 -9.083 -29.132 1.00 0.00 H new ATOM 0 HA LYS A 50 101.296 -10.534 -31.201 1.00 0.00 H new ATOM 0 HB2 LYS A 50 98.729 -9.774 -30.990 1.00 0.00 H new ATOM 0 HB3 LYS A 50 99.330 -8.288 -31.699 1.00 0.00 H new ATOM 0 HG2 LYS A 50 99.726 -11.084 -32.887 1.00 0.00 H new ATOM 0 HG3 LYS A 50 98.550 -9.912 -33.447 1.00 0.00 H new ATOM 0 HD2 LYS A 50 100.572 -8.283 -33.754 1.00 0.00 H new ATOM 0 HD3 LYS A 50 101.591 -9.696 -33.559 1.00 0.00 H new ATOM 0 HE2 LYS A 50 101.236 -9.522 -35.929 1.00 0.00 H new ATOM 0 HE3 LYS A 50 100.174 -10.818 -35.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 99.225 -8.943 -36.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 98.301 -9.470 -35.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 99.187 -8.025 -35.459 1.00 0.00 H new ATOM 442 N ARG A 51 101.442 -7.247 -31.237 1.00 0.00 N ATOM 443 CA ARG A 51 102.295 -6.124 -31.610 1.00 0.00 C ATOM 444 C ARG A 51 103.297 -5.821 -30.501 1.00 0.00 C ATOM 445 O ARG A 51 102.943 -5.788 -29.323 1.00 0.00 O ATOM 446 CB ARG A 51 101.435 -4.888 -31.879 1.00 0.00 C ATOM 447 CG ARG A 51 102.313 -3.758 -32.420 1.00 0.00 C ATOM 448 CD ARG A 51 101.430 -2.568 -32.801 1.00 0.00 C ATOM 449 NE ARG A 51 102.206 -1.576 -33.535 1.00 0.00 N ATOM 450 CZ ARG A 51 101.643 -0.502 -34.016 1.00 0.00 C ATOM 451 NH1 ARG A 51 100.366 -0.298 -33.837 1.00 0.00 N ATOM 452 NH2 ARG A 51 102.355 0.369 -34.677 1.00 0.00 N ATOM 0 H ARG A 51 100.507 -6.985 -30.924 1.00 0.00 H new ATOM 0 HA ARG A 51 102.844 -6.389 -32.514 1.00 0.00 H new ATOM 0 HB2 ARG A 51 100.651 -5.128 -32.597 1.00 0.00 H new ATOM 0 HB3 ARG A 51 100.941 -4.570 -30.961 1.00 0.00 H new ATOM 0 HG2 ARG A 51 103.043 -3.458 -31.668 1.00 0.00 H new ATOM 0 HG3 ARG A 51 102.874 -4.102 -33.289 1.00 0.00 H new ATOM 0 HD2 ARG A 51 100.593 -2.908 -33.410 1.00 0.00 H new ATOM 0 HD3 ARG A 51 101.008 -2.117 -31.903 1.00 0.00 H new ATOM 0 HE ARG A 51 103.205 -1.724 -33.675 1.00 0.00 H new ATOM 0 HH11 ARG A 51 99.808 -0.978 -33.321 1.00 0.00 H new ATOM 0 HH12 ARG A 51 99.926 0.542 -34.213 1.00 0.00 H new ATOM 0 HH21 ARG A 51 103.353 0.210 -34.818 1.00 0.00 H new ATOM 0 HH22 ARG A 51 101.914 1.208 -35.053 1.00 0.00 H new ATOM 466 N GLY A 52 104.527 -5.604 -30.880 1.00 0.00 N ATOM 467 CA GLY A 52 105.574 -5.303 -29.909 1.00 0.00 C ATOM 468 C GLY A 52 105.113 -4.232 -28.926 1.00 0.00 C ATOM 0 H GLY A 52 104.841 -5.627 -31.850 1.00 0.00 H new ATOM 0 HA2 GLY A 52 105.843 -6.209 -29.366 1.00 0.00 H new ATOM 0 HA3 GLY A 52 106.471 -4.964 -30.428 1.00 0.00 H new TER 472 GLY A 52 ATOM 473 N SER B 23 85.599 17.218 4.585 1.00 0.00 N ATOM 474 CA SER B 23 84.897 18.337 3.895 1.00 0.00 C ATOM 475 C SER B 23 84.643 17.956 2.442 1.00 0.00 C ATOM 476 O SER B 23 83.561 18.200 1.909 1.00 0.00 O ATOM 477 CB SER B 23 85.762 19.597 3.963 1.00 0.00 C ATOM 478 OG SER B 23 85.675 20.154 5.267 1.00 0.00 O ATOM 0 HA SER B 23 83.943 18.532 4.385 1.00 0.00 H new ATOM 0 HB2 SER B 23 86.798 19.354 3.727 1.00 0.00 H new ATOM 0 HB3 SER B 23 85.427 20.323 3.222 1.00 0.00 H new ATOM 0 HG SER B 23 86.229 20.961 5.316 1.00 0.00 H new ATOM 483 N ASP B 24 85.642 17.392 1.808 1.00 0.00 N ATOM 484 CA ASP B 24 85.543 16.997 0.405 1.00 0.00 C ATOM 485 C ASP B 24 85.526 15.478 0.285 1.00 0.00 C ATOM 486 O ASP B 24 86.577 14.868 0.099 1.00 0.00 O ATOM 487 CB ASP B 24 86.749 17.542 -0.362 1.00 0.00 C ATOM 488 CG ASP B 24 86.891 19.040 -0.115 1.00 0.00 C ATOM 489 OD1 ASP B 24 86.569 19.473 0.979 1.00 0.00 O ATOM 490 OD2 ASP B 24 87.319 19.732 -1.024 1.00 0.00 O ATOM 0 H ASP B 24 86.545 17.191 2.237 1.00 0.00 H new ATOM 0 HA ASP B 24 84.620 17.401 -0.010 1.00 0.00 H new ATOM 0 HB2 ASP B 24 87.655 17.025 -0.046 1.00 0.00 H new ATOM 0 HB3 ASP B 24 86.629 17.351 -1.428 1.00 0.00 H new ATOM 495 N PRO B 25 84.376 14.850 0.389 1.00 0.00 N ATOM 496 CA PRO B 25 84.274 13.371 0.288 1.00 0.00 C ATOM 497 C PRO B 25 85.204 12.808 -0.775 1.00 0.00 C ATOM 498 O PRO B 25 84.814 12.613 -1.923 1.00 0.00 O ATOM 499 CB PRO B 25 82.805 13.150 -0.062 1.00 0.00 C ATOM 500 CG PRO B 25 82.089 14.262 0.634 1.00 0.00 C ATOM 501 CD PRO B 25 83.047 15.463 0.611 1.00 0.00 C ATOM 0 HA PRO B 25 84.574 12.860 1.203 1.00 0.00 H new ATOM 0 HB2 PRO B 25 82.643 13.185 -1.139 1.00 0.00 H new ATOM 0 HB3 PRO B 25 82.456 12.176 0.281 1.00 0.00 H new ATOM 0 HG2 PRO B 25 81.153 14.500 0.129 1.00 0.00 H new ATOM 0 HG3 PRO B 25 81.837 13.984 1.657 1.00 0.00 H new ATOM 0 HD2 PRO B 25 82.792 16.163 -0.184 1.00 0.00 H new ATOM 0 HD3 PRO B 25 83.014 16.019 1.548 1.00 0.00 H new ATOM 509 N LEU B 26 86.412 12.532 -0.378 1.00 0.00 N ATOM 510 CA LEU B 26 87.393 11.963 -1.292 1.00 0.00 C ATOM 511 C LEU B 26 86.859 10.651 -1.849 1.00 0.00 C ATOM 512 O LEU B 26 87.066 10.323 -3.017 1.00 0.00 O ATOM 513 CB LEU B 26 88.701 11.703 -0.529 1.00 0.00 C ATOM 514 CG LEU B 26 89.483 13.022 -0.325 1.00 0.00 C ATOM 515 CD1 LEU B 26 90.285 12.952 0.978 1.00 0.00 C ATOM 516 CD2 LEU B 26 90.438 13.250 -1.504 1.00 0.00 C ATOM 0 H LEU B 26 86.754 12.687 0.570 1.00 0.00 H new ATOM 0 HA LEU B 26 87.580 12.656 -2.112 1.00 0.00 H new ATOM 0 HB2 LEU B 26 88.481 11.251 0.438 1.00 0.00 H new ATOM 0 HB3 LEU B 26 89.315 10.991 -1.081 1.00 0.00 H new ATOM 0 HG LEU B 26 88.776 13.850 -0.270 1.00 0.00 H new ATOM 0 HD11 LEU B 26 90.834 13.883 1.118 1.00 0.00 H new ATOM 0 HD12 LEU B 26 89.605 12.803 1.816 1.00 0.00 H new ATOM 0 HD13 LEU B 26 90.988 12.120 0.929 1.00 0.00 H new ATOM 0 HD21 LEU B 26 90.986 14.180 -1.354 1.00 0.00 H new ATOM 0 HD22 LEU B 26 91.142 12.421 -1.567 1.00 0.00 H new ATOM 0 HD23 LEU B 26 89.865 13.311 -2.429 1.00 0.00 H new ATOM 528 N VAL B 27 86.190 9.916 -1.006 1.00 0.00 N ATOM 529 CA VAL B 27 85.632 8.629 -1.391 1.00 0.00 C ATOM 530 C VAL B 27 84.654 8.765 -2.555 1.00 0.00 C ATOM 531 O VAL B 27 84.709 7.984 -3.504 1.00 0.00 O ATOM 532 CB VAL B 27 84.908 8.004 -0.198 1.00 0.00 C ATOM 533 CG1 VAL B 27 84.569 6.550 -0.515 1.00 0.00 C ATOM 534 CG2 VAL B 27 85.810 8.042 1.037 1.00 0.00 C ATOM 0 H VAL B 27 86.011 10.180 -0.037 1.00 0.00 H new ATOM 0 HA VAL B 27 86.457 7.991 -1.710 1.00 0.00 H new ATOM 0 HB VAL B 27 83.996 8.567 -0.002 1.00 0.00 H new ATOM 0 HG11 VAL B 27 84.053 6.103 0.335 1.00 0.00 H new ATOM 0 HG12 VAL B 27 83.925 6.510 -1.393 1.00 0.00 H new ATOM 0 HG13 VAL B 27 85.487 5.997 -0.713 1.00 0.00 H new ATOM 0 HG21 VAL B 27 85.288 7.595 1.883 1.00 0.00 H new ATOM 0 HG22 VAL B 27 86.724 7.482 0.838 1.00 0.00 H new ATOM 0 HG23 VAL B 27 86.062 9.076 1.272 1.00 0.00 H new ATOM 544 N VAL B 28 83.782 9.737 -2.498 1.00 0.00 N ATOM 545 CA VAL B 28 82.813 9.948 -3.575 1.00 0.00 C ATOM 546 C VAL B 28 83.513 10.487 -4.823 1.00 0.00 C ATOM 547 O VAL B 28 83.012 10.356 -5.939 1.00 0.00 O ATOM 548 CB VAL B 28 81.677 10.903 -3.111 1.00 0.00 C ATOM 549 CG1 VAL B 28 81.949 12.352 -3.548 1.00 0.00 C ATOM 550 CG2 VAL B 28 80.335 10.459 -3.712 1.00 0.00 C ATOM 0 H VAL B 28 83.712 10.400 -1.726 1.00 0.00 H new ATOM 0 HA VAL B 28 82.360 8.990 -3.829 1.00 0.00 H new ATOM 0 HB VAL B 28 81.639 10.859 -2.023 1.00 0.00 H new ATOM 0 HG11 VAL B 28 81.136 12.993 -3.208 1.00 0.00 H new ATOM 0 HG12 VAL B 28 82.888 12.694 -3.112 1.00 0.00 H new ATOM 0 HG13 VAL B 28 82.017 12.398 -4.635 1.00 0.00 H new ATOM 0 HG21 VAL B 28 79.547 11.135 -3.381 1.00 0.00 H new ATOM 0 HG22 VAL B 28 80.398 10.481 -4.800 1.00 0.00 H new ATOM 0 HG23 VAL B 28 80.106 9.445 -3.383 1.00 0.00 H new ATOM 560 N ALA B 29 84.645 11.097 -4.612 1.00 0.00 N ATOM 561 CA ALA B 29 85.410 11.678 -5.704 1.00 0.00 C ATOM 562 C ALA B 29 85.887 10.619 -6.695 1.00 0.00 C ATOM 563 O ALA B 29 85.791 10.816 -7.906 1.00 0.00 O ATOM 564 CB ALA B 29 86.616 12.437 -5.150 1.00 0.00 C ATOM 0 H ALA B 29 85.069 11.211 -3.691 1.00 0.00 H new ATOM 0 HA ALA B 29 84.750 12.363 -6.237 1.00 0.00 H new ATOM 0 HB1 ALA B 29 87.184 12.869 -5.974 1.00 0.00 H new ATOM 0 HB2 ALA B 29 86.273 13.233 -4.489 1.00 0.00 H new ATOM 0 HB3 ALA B 29 87.252 11.751 -4.591 1.00 0.00 H new ATOM 570 N ALA B 30 86.400 9.518 -6.205 1.00 0.00 N ATOM 571 CA ALA B 30 86.867 8.496 -7.119 1.00 0.00 C ATOM 572 C ALA B 30 85.691 7.805 -7.799 1.00 0.00 C ATOM 573 O ALA B 30 85.675 7.646 -9.020 1.00 0.00 O ATOM 574 CB ALA B 30 87.720 7.489 -6.385 1.00 0.00 C ATOM 0 H ALA B 30 86.505 9.306 -5.213 1.00 0.00 H new ATOM 0 HA ALA B 30 87.474 8.972 -7.889 1.00 0.00 H new ATOM 0 HB1 ALA B 30 88.065 6.726 -7.083 1.00 0.00 H new ATOM 0 HB2 ALA B 30 88.580 7.993 -5.945 1.00 0.00 H new ATOM 0 HB3 ALA B 30 87.132 7.020 -5.596 1.00 0.00 H new ATOM 580 N SER B 31 84.752 7.360 -7.012 1.00 0.00 N ATOM 581 CA SER B 31 83.604 6.634 -7.539 1.00 0.00 C ATOM 582 C SER B 31 82.977 7.322 -8.750 1.00 0.00 C ATOM 583 O SER B 31 82.704 6.661 -9.753 1.00 0.00 O ATOM 584 CB SER B 31 82.545 6.489 -6.447 1.00 0.00 C ATOM 585 OG SER B 31 81.358 5.949 -7.014 1.00 0.00 O ATOM 0 H SER B 31 84.749 7.482 -5.999 1.00 0.00 H new ATOM 0 HA SER B 31 83.965 5.658 -7.863 1.00 0.00 H new ATOM 0 HB2 SER B 31 82.911 5.838 -5.653 1.00 0.00 H new ATOM 0 HB3 SER B 31 82.337 7.459 -5.994 1.00 0.00 H new ATOM 0 HG SER B 31 80.677 5.853 -6.316 1.00 0.00 H new ATOM 591 N ILE B 32 82.728 8.603 -8.682 1.00 0.00 N ATOM 592 CA ILE B 32 82.110 9.296 -9.812 1.00 0.00 C ATOM 593 C ILE B 32 83.061 9.414 -10.999 1.00 0.00 C ATOM 594 O ILE B 32 82.619 9.500 -12.142 1.00 0.00 O ATOM 595 CB ILE B 32 81.651 10.693 -9.395 1.00 0.00 C ATOM 596 CG1 ILE B 32 80.874 11.342 -10.545 1.00 0.00 C ATOM 597 CG2 ILE B 32 82.871 11.545 -9.066 1.00 0.00 C ATOM 598 CD1 ILE B 32 80.243 12.650 -10.063 1.00 0.00 C ATOM 0 H ILE B 32 82.935 9.192 -7.875 1.00 0.00 H new ATOM 0 HA ILE B 32 81.251 8.700 -10.120 1.00 0.00 H new ATOM 0 HB ILE B 32 81.007 10.619 -8.519 1.00 0.00 H new ATOM 0 HG12 ILE B 32 81.541 11.536 -11.385 1.00 0.00 H new ATOM 0 HG13 ILE B 32 80.100 10.663 -10.903 1.00 0.00 H new ATOM 0 HG21 ILE B 32 82.548 12.543 -8.768 1.00 0.00 H new ATOM 0 HG22 ILE B 32 83.427 11.084 -8.249 1.00 0.00 H new ATOM 0 HG23 ILE B 32 83.511 11.618 -9.945 1.00 0.00 H new ATOM 0 HD11 ILE B 32 79.691 13.111 -10.882 1.00 0.00 H new ATOM 0 HD12 ILE B 32 79.562 12.443 -9.237 1.00 0.00 H new ATOM 0 HD13 ILE B 32 81.026 13.329 -9.726 1.00 0.00 H new ATOM 610 N ILE B 33 84.340 9.428 -10.740 1.00 0.00 N ATOM 611 CA ILE B 33 85.315 9.543 -11.820 1.00 0.00 C ATOM 612 C ILE B 33 85.374 8.258 -12.653 1.00 0.00 C ATOM 613 O ILE B 33 85.359 8.315 -13.880 1.00 0.00 O ATOM 614 CB ILE B 33 86.711 9.877 -11.249 1.00 0.00 C ATOM 615 CG1 ILE B 33 86.756 11.361 -10.857 1.00 0.00 C ATOM 616 CG2 ILE B 33 87.801 9.599 -12.300 1.00 0.00 C ATOM 617 CD1 ILE B 33 88.060 11.667 -10.114 1.00 0.00 C ATOM 0 H ILE B 33 84.741 9.363 -9.804 1.00 0.00 H new ATOM 0 HA ILE B 33 84.998 10.354 -12.475 1.00 0.00 H new ATOM 0 HB ILE B 33 86.893 9.252 -10.375 1.00 0.00 H new ATOM 0 HG12 ILE B 33 86.681 11.984 -11.749 1.00 0.00 H new ATOM 0 HG13 ILE B 33 85.902 11.605 -10.225 1.00 0.00 H new ATOM 0 HG21 ILE B 33 88.779 9.839 -11.882 1.00 0.00 H new ATOM 0 HG22 ILE B 33 87.775 8.546 -12.581 1.00 0.00 H new ATOM 0 HG23 ILE B 33 87.622 10.214 -13.182 1.00 0.00 H new ATOM 0 HD11 ILE B 33 88.084 12.722 -9.840 1.00 0.00 H new ATOM 0 HD12 ILE B 33 88.117 11.056 -9.213 1.00 0.00 H new ATOM 0 HD13 ILE B 33 88.908 11.441 -10.760 1.00 0.00 H new ATOM 629 N GLY B 34 85.498 7.129 -12.007 1.00 0.00 N ATOM 630 CA GLY B 34 85.628 5.861 -12.719 1.00 0.00 C ATOM 631 C GLY B 34 84.585 5.668 -13.815 1.00 0.00 C ATOM 632 O GLY B 34 84.929 5.308 -14.941 1.00 0.00 O ATOM 0 H GLY B 34 85.513 7.049 -10.990 1.00 0.00 H new ATOM 0 HA2 GLY B 34 86.623 5.802 -13.161 1.00 0.00 H new ATOM 0 HA3 GLY B 34 85.548 5.042 -12.004 1.00 0.00 H new ATOM 636 N ILE B 35 83.342 5.879 -13.500 1.00 0.00 N ATOM 637 CA ILE B 35 82.288 5.697 -14.494 1.00 0.00 C ATOM 638 C ILE B 35 82.640 6.437 -15.790 1.00 0.00 C ATOM 639 O ILE B 35 82.255 6.008 -16.878 1.00 0.00 O ATOM 640 CB ILE B 35 80.942 6.168 -13.921 1.00 0.00 C ATOM 641 CG1 ILE B 35 79.925 6.381 -15.050 1.00 0.00 C ATOM 642 CG2 ILE B 35 81.142 7.470 -13.156 1.00 0.00 C ATOM 643 CD1 ILE B 35 78.517 6.471 -14.459 1.00 0.00 C ATOM 0 H ILE B 35 83.020 6.174 -12.578 1.00 0.00 H new ATOM 0 HA ILE B 35 82.200 4.638 -14.736 1.00 0.00 H new ATOM 0 HB ILE B 35 80.559 5.403 -13.246 1.00 0.00 H new ATOM 0 HG12 ILE B 35 80.160 7.294 -15.598 1.00 0.00 H new ATOM 0 HG13 ILE B 35 79.980 5.558 -15.763 1.00 0.00 H new ATOM 0 HG21 ILE B 35 80.187 7.804 -12.750 1.00 0.00 H new ATOM 0 HG22 ILE B 35 81.847 7.308 -12.340 1.00 0.00 H new ATOM 0 HG23 ILE B 35 81.536 8.231 -13.830 1.00 0.00 H new ATOM 0 HD11 ILE B 35 77.795 6.622 -15.261 1.00 0.00 H new ATOM 0 HD12 ILE B 35 78.284 5.546 -13.931 1.00 0.00 H new ATOM 0 HD13 ILE B 35 78.467 7.309 -13.763 1.00 0.00 H new ATOM 655 N LEU B 36 83.373 7.514 -15.676 1.00 0.00 N ATOM 656 CA LEU B 36 83.776 8.272 -16.860 1.00 0.00 C ATOM 657 C LEU B 36 84.687 7.406 -17.731 1.00 0.00 C ATOM 658 O LEU B 36 84.480 7.269 -18.933 1.00 0.00 O ATOM 659 CB LEU B 36 84.536 9.536 -16.426 1.00 0.00 C ATOM 660 CG LEU B 36 84.770 10.471 -17.630 1.00 0.00 C ATOM 661 CD1 LEU B 36 83.536 11.351 -17.866 1.00 0.00 C ATOM 662 CD2 LEU B 36 85.980 11.376 -17.352 1.00 0.00 C ATOM 0 H LEU B 36 83.707 7.893 -14.790 1.00 0.00 H new ATOM 0 HA LEU B 36 82.890 8.557 -17.428 1.00 0.00 H new ATOM 0 HB2 LEU B 36 83.970 10.061 -15.656 1.00 0.00 H new ATOM 0 HB3 LEU B 36 85.493 9.258 -15.984 1.00 0.00 H new ATOM 0 HG LEU B 36 84.955 9.862 -18.515 1.00 0.00 H new ATOM 0 HD11 LEU B 36 83.714 12.006 -18.719 1.00 0.00 H new ATOM 0 HD12 LEU B 36 82.672 10.719 -18.069 1.00 0.00 H new ATOM 0 HD13 LEU B 36 83.344 11.954 -16.979 1.00 0.00 H new ATOM 0 HD21 LEU B 36 86.144 12.036 -18.204 1.00 0.00 H new ATOM 0 HD22 LEU B 36 85.790 11.974 -16.461 1.00 0.00 H new ATOM 0 HD23 LEU B 36 86.866 10.761 -17.194 1.00 0.00 H new ATOM 674 N HIS B 37 85.690 6.857 -17.113 1.00 0.00 N ATOM 675 CA HIS B 37 86.649 6.022 -17.828 1.00 0.00 C ATOM 676 C HIS B 37 85.938 4.887 -18.568 1.00 0.00 C ATOM 677 O HIS B 37 86.420 4.407 -19.592 1.00 0.00 O ATOM 678 CB HIS B 37 87.729 5.481 -16.851 1.00 0.00 C ATOM 679 CG HIS B 37 87.374 4.127 -16.258 1.00 0.00 C ATOM 680 ND1 HIS B 37 86.872 3.070 -17.009 1.00 0.00 N ATOM 681 CD2 HIS B 37 87.489 3.641 -14.977 1.00 0.00 C ATOM 682 CE1 HIS B 37 86.705 2.023 -16.182 1.00 0.00 C ATOM 683 NE2 HIS B 37 87.065 2.318 -14.933 1.00 0.00 N ATOM 0 H HIS B 37 85.878 6.963 -16.116 1.00 0.00 H new ATOM 0 HA HIS B 37 87.153 6.633 -18.577 1.00 0.00 H new ATOM 0 HB2 HIS B 37 88.680 5.402 -17.378 1.00 0.00 H new ATOM 0 HB3 HIS B 37 87.871 6.199 -16.043 1.00 0.00 H new ATOM 0 HD2 HIS B 37 87.854 4.204 -14.131 1.00 0.00 H new ATOM 0 HE1 HIS B 37 86.326 1.061 -16.492 1.00 0.00 H new ATOM 0 HE2 HIS B 37 87.036 1.704 -14.119 1.00 0.00 H new ATOM 692 N PHE B 38 84.828 4.456 -18.034 1.00 0.00 N ATOM 693 CA PHE B 38 84.067 3.353 -18.624 1.00 0.00 C ATOM 694 C PHE B 38 83.483 3.689 -20.003 1.00 0.00 C ATOM 695 O PHE B 38 83.540 2.867 -20.915 1.00 0.00 O ATOM 696 CB PHE B 38 82.932 2.954 -17.680 1.00 0.00 C ATOM 697 CG PHE B 38 82.306 1.669 -18.164 1.00 0.00 C ATOM 698 CD1 PHE B 38 81.379 1.697 -19.213 1.00 0.00 C ATOM 699 CD2 PHE B 38 82.651 0.448 -17.568 1.00 0.00 C ATOM 700 CE1 PHE B 38 80.798 0.507 -19.666 1.00 0.00 C ATOM 701 CE2 PHE B 38 82.069 -0.741 -18.022 1.00 0.00 C ATOM 702 CZ PHE B 38 81.143 -0.712 -19.071 1.00 0.00 C ATOM 0 H PHE B 38 84.416 4.845 -17.186 1.00 0.00 H new ATOM 0 HA PHE B 38 84.766 2.529 -18.765 1.00 0.00 H new ATOM 0 HB2 PHE B 38 83.314 2.826 -16.667 1.00 0.00 H new ATOM 0 HB3 PHE B 38 82.182 3.744 -17.640 1.00 0.00 H new ATOM 0 HD1 PHE B 38 81.112 2.637 -19.673 1.00 0.00 H new ATOM 0 HD2 PHE B 38 83.366 0.425 -16.759 1.00 0.00 H new ATOM 0 HE1 PHE B 38 80.083 0.529 -20.475 1.00 0.00 H new ATOM 0 HE2 PHE B 38 82.335 -1.682 -17.563 1.00 0.00 H new ATOM 0 HZ PHE B 38 80.695 -1.630 -19.421 1.00 0.00 H new ATOM 712 N ILE B 39 82.900 4.848 -20.148 1.00 0.00 N ATOM 713 CA ILE B 39 82.288 5.214 -21.429 1.00 0.00 C ATOM 714 C ILE B 39 83.334 5.407 -22.527 1.00 0.00 C ATOM 715 O ILE B 39 83.117 5.002 -23.668 1.00 0.00 O ATOM 716 CB ILE B 39 81.432 6.479 -21.280 1.00 0.00 C ATOM 717 CG1 ILE B 39 82.209 7.545 -20.503 1.00 0.00 C ATOM 718 CG2 ILE B 39 80.144 6.139 -20.523 1.00 0.00 C ATOM 719 CD1 ILE B 39 81.535 8.906 -20.689 1.00 0.00 C ATOM 0 H ILE B 39 82.828 5.556 -19.417 1.00 0.00 H new ATOM 0 HA ILE B 39 81.645 4.386 -21.727 1.00 0.00 H new ATOM 0 HB ILE B 39 81.186 6.862 -22.270 1.00 0.00 H new ATOM 0 HG12 ILE B 39 82.243 7.286 -19.445 1.00 0.00 H new ATOM 0 HG13 ILE B 39 83.240 7.587 -20.854 1.00 0.00 H new ATOM 0 HG21 ILE B 39 79.536 7.038 -20.417 1.00 0.00 H new ATOM 0 HG22 ILE B 39 79.584 5.385 -21.077 1.00 0.00 H new ATOM 0 HG23 ILE B 39 80.394 5.752 -19.535 1.00 0.00 H new ATOM 0 HD11 ILE B 39 82.088 9.665 -20.136 1.00 0.00 H new ATOM 0 HD12 ILE B 39 81.524 9.165 -21.748 1.00 0.00 H new ATOM 0 HD13 ILE B 39 80.512 8.859 -20.316 1.00 0.00 H new ATOM 731 N ALA B 40 84.446 5.995 -22.197 1.00 0.00 N ATOM 732 CA ALA B 40 85.504 6.199 -23.183 1.00 0.00 C ATOM 733 C ALA B 40 86.158 4.864 -23.537 1.00 0.00 C ATOM 734 O ALA B 40 86.688 4.688 -24.632 1.00 0.00 O ATOM 735 CB ALA B 40 86.559 7.158 -22.629 1.00 0.00 C ATOM 0 H ALA B 40 84.658 6.345 -21.263 1.00 0.00 H new ATOM 0 HA ALA B 40 85.065 6.630 -24.083 1.00 0.00 H new ATOM 0 HB1 ALA B 40 87.344 7.304 -23.371 1.00 0.00 H new ATOM 0 HB2 ALA B 40 86.094 8.117 -22.399 1.00 0.00 H new ATOM 0 HB3 ALA B 40 86.992 6.738 -21.721 1.00 0.00 H new ATOM 741 N TRP B 41 86.139 3.961 -22.596 1.00 0.00 N ATOM 742 CA TRP B 41 86.753 2.648 -22.756 1.00 0.00 C ATOM 743 C TRP B 41 86.341 1.950 -24.047 1.00 0.00 C ATOM 744 O TRP B 41 87.193 1.459 -24.787 1.00 0.00 O ATOM 745 CB TRP B 41 86.333 1.783 -21.569 1.00 0.00 C ATOM 746 CG TRP B 41 87.135 0.530 -21.528 1.00 0.00 C ATOM 747 CD1 TRP B 41 87.096 -0.456 -22.455 1.00 0.00 C ATOM 748 CD2 TRP B 41 88.075 0.098 -20.507 1.00 0.00 C ATOM 749 NE1 TRP B 41 87.971 -1.453 -22.076 1.00 0.00 N ATOM 750 CE2 TRP B 41 88.593 -1.157 -20.882 1.00 0.00 C ATOM 751 CE3 TRP B 41 88.529 0.671 -19.306 1.00 0.00 C ATOM 752 CZ2 TRP B 41 89.523 -1.823 -20.098 1.00 0.00 C ATOM 753 CZ3 TRP B 41 89.466 -0.005 -18.508 1.00 0.00 C ATOM 754 CH2 TRP B 41 89.962 -1.255 -18.908 1.00 0.00 C ATOM 0 H TRP B 41 85.698 4.104 -21.688 1.00 0.00 H new ATOM 0 HA TRP B 41 87.833 2.786 -22.801 1.00 0.00 H new ATOM 0 HB2 TRP B 41 86.468 2.339 -20.641 1.00 0.00 H new ATOM 0 HB3 TRP B 41 85.273 1.541 -21.645 1.00 0.00 H new ATOM 0 HD1 TRP B 41 86.482 -0.461 -23.343 1.00 0.00 H new ATOM 0 HE1 TRP B 41 88.137 -2.304 -22.613 1.00 0.00 H new ATOM 0 HE3 TRP B 41 88.155 1.636 -18.996 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 89.906 -2.783 -20.412 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 89.806 0.439 -17.584 1.00 0.00 H new ATOM 0 HH2 TRP B 41 90.682 -1.774 -18.293 1.00 0.00 H new ATOM 765 N THR B 42 85.067 1.868 -24.296 1.00 0.00 N ATOM 766 CA THR B 42 84.593 1.171 -25.490 1.00 0.00 C ATOM 767 C THR B 42 85.347 1.632 -26.735 1.00 0.00 C ATOM 768 O THR B 42 85.569 0.847 -27.655 1.00 0.00 O ATOM 769 CB THR B 42 83.086 1.400 -25.678 1.00 0.00 C ATOM 770 OG1 THR B 42 82.767 1.334 -27.062 1.00 0.00 O ATOM 771 CG2 THR B 42 82.699 2.773 -25.132 1.00 0.00 C ATOM 0 H THR B 42 84.334 2.264 -23.707 1.00 0.00 H new ATOM 0 HA THR B 42 84.780 0.106 -25.351 1.00 0.00 H new ATOM 0 HB THR B 42 82.535 0.630 -25.138 1.00 0.00 H new ATOM 0 HG1 THR B 42 81.805 1.478 -27.183 1.00 0.00 H new ATOM 0 HG21 THR B 42 81.629 2.930 -25.268 1.00 0.00 H new ATOM 0 HG22 THR B 42 82.941 2.824 -24.070 1.00 0.00 H new ATOM 0 HG23 THR B 42 83.250 3.546 -25.667 1.00 0.00 H new ATOM 779 N ILE B 43 85.716 2.880 -26.773 1.00 0.00 N ATOM 780 CA ILE B 43 86.425 3.420 -27.929 1.00 0.00 C ATOM 781 C ILE B 43 87.628 2.539 -28.310 1.00 0.00 C ATOM 782 O ILE B 43 87.874 2.298 -29.490 1.00 0.00 O ATOM 783 CB ILE B 43 86.858 4.878 -27.624 1.00 0.00 C ATOM 784 CG1 ILE B 43 86.856 5.725 -28.906 1.00 0.00 C ATOM 785 CG2 ILE B 43 88.263 4.921 -27.009 1.00 0.00 C ATOM 786 CD1 ILE B 43 87.089 7.195 -28.546 1.00 0.00 C ATOM 0 H ILE B 43 85.545 3.553 -26.026 1.00 0.00 H new ATOM 0 HA ILE B 43 85.757 3.423 -28.790 1.00 0.00 H new ATOM 0 HB ILE B 43 86.140 5.285 -26.912 1.00 0.00 H new ATOM 0 HG12 ILE B 43 87.635 5.378 -29.585 1.00 0.00 H new ATOM 0 HG13 ILE B 43 85.905 5.613 -29.427 1.00 0.00 H new ATOM 0 HG21 ILE B 43 88.540 5.956 -26.806 1.00 0.00 H new ATOM 0 HG22 ILE B 43 88.270 4.354 -26.078 1.00 0.00 H new ATOM 0 HG23 ILE B 43 88.979 4.484 -27.706 1.00 0.00 H new ATOM 0 HD11 ILE B 43 87.088 7.797 -29.455 1.00 0.00 H new ATOM 0 HD12 ILE B 43 86.295 7.538 -27.883 1.00 0.00 H new ATOM 0 HD13 ILE B 43 88.051 7.299 -28.044 1.00 0.00 H new ATOM 798 N GLY B 44 88.359 2.075 -27.328 1.00 0.00 N ATOM 799 CA GLY B 44 89.527 1.228 -27.592 1.00 0.00 C ATOM 800 C GLY B 44 89.137 0.041 -28.466 1.00 0.00 C ATOM 801 O GLY B 44 89.819 -0.291 -29.435 1.00 0.00 O ATOM 0 H GLY B 44 88.180 2.259 -26.341 1.00 0.00 H new ATOM 0 HA2 GLY B 44 90.303 1.812 -28.086 1.00 0.00 H new ATOM 0 HA3 GLY B 44 89.946 0.872 -26.651 1.00 0.00 H new ATOM 805 N HIS B 45 88.083 -0.613 -28.076 1.00 0.00 N ATOM 806 CA HIS B 45 87.592 -1.805 -28.740 1.00 0.00 C ATOM 807 C HIS B 45 87.644 -1.675 -30.265 1.00 0.00 C ATOM 808 O HIS B 45 87.734 -2.678 -30.973 1.00 0.00 O ATOM 809 CB HIS B 45 86.156 -2.023 -28.244 1.00 0.00 C ATOM 810 CG HIS B 45 85.725 -3.472 -28.300 1.00 0.00 C ATOM 811 ND1 HIS B 45 84.428 -3.848 -27.977 1.00 0.00 N ATOM 812 CD2 HIS B 45 86.385 -4.642 -28.595 1.00 0.00 C ATOM 813 CE1 HIS B 45 84.351 -5.186 -28.082 1.00 0.00 C ATOM 814 NE2 HIS B 45 85.514 -5.720 -28.455 1.00 0.00 N ATOM 0 H HIS B 45 87.522 -0.334 -27.271 1.00 0.00 H new ATOM 0 HA HIS B 45 88.222 -2.661 -28.500 1.00 0.00 H new ATOM 0 HB2 HIS B 45 86.074 -1.665 -27.218 1.00 0.00 H new ATOM 0 HB3 HIS B 45 85.474 -1.423 -28.847 1.00 0.00 H new ATOM 0 HD2 HIS B 45 87.421 -4.714 -28.890 1.00 0.00 H new ATOM 0 HE1 HIS B 45 83.456 -5.758 -27.888 1.00 0.00 H new ATOM 0 HE2 HIS B 45 85.722 -6.707 -28.606 1.00 0.00 H new ATOM 823 N LEU B 46 87.649 -0.470 -30.756 1.00 0.00 N ATOM 824 CA LEU B 46 87.767 -0.290 -32.202 1.00 0.00 C ATOM 825 C LEU B 46 89.071 -0.971 -32.663 1.00 0.00 C ATOM 826 O LEU B 46 89.092 -1.712 -33.644 1.00 0.00 O ATOM 827 CB LEU B 46 87.707 1.213 -32.592 1.00 0.00 C ATOM 828 CG LEU B 46 89.074 1.926 -32.431 1.00 0.00 C ATOM 829 CD1 LEU B 46 89.985 1.680 -33.666 1.00 0.00 C ATOM 830 CD2 LEU B 46 88.842 3.440 -32.264 1.00 0.00 C ATOM 0 H LEU B 46 87.576 0.388 -30.210 1.00 0.00 H new ATOM 0 HA LEU B 46 86.924 -0.757 -32.711 1.00 0.00 H new ATOM 0 HB2 LEU B 46 87.374 1.303 -33.626 1.00 0.00 H new ATOM 0 HB3 LEU B 46 86.964 1.716 -31.973 1.00 0.00 H new ATOM 0 HG LEU B 46 89.571 1.520 -31.550 1.00 0.00 H new ATOM 0 HD11 LEU B 46 90.937 2.192 -33.524 1.00 0.00 H new ATOM 0 HD12 LEU B 46 90.162 0.611 -33.780 1.00 0.00 H new ATOM 0 HD13 LEU B 46 89.496 2.064 -34.561 1.00 0.00 H new ATOM 0 HD21 LEU B 46 89.801 3.945 -32.150 1.00 0.00 H new ATOM 0 HD22 LEU B 46 88.329 3.829 -33.144 1.00 0.00 H new ATOM 0 HD23 LEU B 46 88.231 3.619 -31.379 1.00 0.00 H new ATOM 842 N ASN B 47 90.134 -0.666 -31.974 1.00 0.00 N ATOM 843 CA ASN B 47 91.463 -1.191 -32.308 1.00 0.00 C ATOM 844 C ASN B 47 91.510 -2.724 -32.312 1.00 0.00 C ATOM 845 O ASN B 47 92.038 -3.330 -33.245 1.00 0.00 O ATOM 846 CB ASN B 47 92.496 -0.667 -31.308 1.00 0.00 C ATOM 847 CG ASN B 47 92.503 0.857 -31.311 1.00 0.00 C ATOM 848 OD1 ASN B 47 93.114 1.474 -32.184 1.00 0.00 O ATOM 849 ND2 ASN B 47 91.855 1.506 -30.383 1.00 0.00 N ATOM 0 H ASN B 47 90.122 -0.048 -31.162 1.00 0.00 H new ATOM 0 HA ASN B 47 91.693 -0.847 -33.317 1.00 0.00 H new ATOM 0 HB2 ASN B 47 92.265 -1.035 -30.308 1.00 0.00 H new ATOM 0 HB3 ASN B 47 93.486 -1.043 -31.565 1.00 0.00 H new ATOM 0 HD21 ASN B 47 91.854 2.526 -30.380 1.00 0.00 H new ATOM 0 HD22 ASN B 47 91.349 0.993 -29.661 1.00 0.00 H new ATOM 856 N GLN B 48 90.998 -3.333 -31.279 1.00 0.00 N ATOM 857 CA GLN B 48 91.024 -4.787 -31.169 1.00 0.00 C ATOM 858 C GLN B 48 90.150 -5.475 -32.217 1.00 0.00 C ATOM 859 O GLN B 48 90.670 -6.137 -33.116 1.00 0.00 O ATOM 860 CB GLN B 48 90.562 -5.199 -29.773 1.00 0.00 C ATOM 861 CG GLN B 48 91.206 -4.293 -28.713 1.00 0.00 C ATOM 862 CD GLN B 48 92.695 -4.101 -28.997 1.00 0.00 C ATOM 863 OE1 GLN B 48 93.063 -3.370 -29.916 1.00 0.00 O ATOM 864 NE2 GLN B 48 93.576 -4.719 -28.262 1.00 0.00 N ATOM 0 H GLN B 48 90.555 -2.856 -30.494 1.00 0.00 H new ATOM 0 HA GLN B 48 92.051 -5.106 -31.345 1.00 0.00 H new ATOM 0 HB2 GLN B 48 89.476 -5.133 -29.707 1.00 0.00 H new ATOM 0 HB3 GLN B 48 90.830 -6.239 -29.585 1.00 0.00 H new ATOM 0 HG2 GLN B 48 90.705 -3.325 -28.702 1.00 0.00 H new ATOM 0 HG3 GLN B 48 91.073 -4.731 -27.724 1.00 0.00 H new ATOM 0 HE21 GLN B 48 93.270 -5.325 -27.500 1.00 0.00 H new ATOM 0 HE22 GLN B 48 94.571 -4.597 -28.448 1.00 0.00 H new ATOM 873 N ILE B 49 88.850 -5.351 -32.076 1.00 0.00 N ATOM 874 CA ILE B 49 87.908 -6.002 -32.998 1.00 0.00 C ATOM 875 C ILE B 49 88.464 -6.070 -34.424 1.00 0.00 C ATOM 876 O ILE B 49 88.521 -7.148 -35.018 1.00 0.00 O ATOM 877 CB ILE B 49 86.552 -5.282 -32.982 1.00 0.00 C ATOM 878 CG1 ILE B 49 85.512 -6.141 -33.707 1.00 0.00 C ATOM 879 CG2 ILE B 49 86.661 -3.923 -33.674 1.00 0.00 C ATOM 880 CD1 ILE B 49 84.140 -5.472 -33.607 1.00 0.00 C ATOM 0 H ILE B 49 88.407 -4.808 -31.335 1.00 0.00 H new ATOM 0 HA ILE B 49 87.766 -7.026 -32.652 1.00 0.00 H new ATOM 0 HB ILE B 49 86.248 -5.126 -31.947 1.00 0.00 H new ATOM 0 HG12 ILE B 49 85.793 -6.265 -34.753 1.00 0.00 H new ATOM 0 HG13 ILE B 49 85.476 -7.137 -33.266 1.00 0.00 H new ATOM 0 HG21 ILE B 49 85.691 -3.426 -33.654 1.00 0.00 H new ATOM 0 HG22 ILE B 49 87.395 -3.308 -33.154 1.00 0.00 H new ATOM 0 HG23 ILE B 49 86.974 -4.065 -34.708 1.00 0.00 H new ATOM 0 HD11 ILE B 49 83.399 -6.083 -34.123 1.00 0.00 H new ATOM 0 HD12 ILE B 49 83.860 -5.371 -32.558 1.00 0.00 H new ATOM 0 HD13 ILE B 49 84.182 -4.485 -34.068 1.00 0.00 H new ATOM 892 N LYS B 50 88.868 -4.952 -34.964 1.00 0.00 N ATOM 893 CA LYS B 50 89.414 -4.931 -36.317 1.00 0.00 C ATOM 894 C LYS B 50 90.476 -6.014 -36.478 1.00 0.00 C ATOM 895 O LYS B 50 90.436 -6.801 -37.424 1.00 0.00 O ATOM 896 CB LYS B 50 90.040 -3.561 -36.610 1.00 0.00 C ATOM 897 CG LYS B 50 88.972 -2.456 -36.535 1.00 0.00 C ATOM 898 CD LYS B 50 88.220 -2.351 -37.869 1.00 0.00 C ATOM 899 CE LYS B 50 87.232 -1.186 -37.803 1.00 0.00 C ATOM 900 NZ LYS B 50 87.970 0.076 -37.517 1.00 0.00 N ATOM 0 H LYS B 50 88.835 -4.044 -34.501 1.00 0.00 H new ATOM 0 HA LYS B 50 88.602 -5.118 -37.019 1.00 0.00 H new ATOM 0 HB2 LYS B 50 90.835 -3.356 -35.893 1.00 0.00 H new ATOM 0 HB3 LYS B 50 90.497 -3.567 -37.599 1.00 0.00 H new ATOM 0 HG2 LYS B 50 88.270 -2.673 -35.730 1.00 0.00 H new ATOM 0 HG3 LYS B 50 89.442 -1.502 -36.299 1.00 0.00 H new ATOM 0 HD2 LYS B 50 88.925 -2.199 -38.686 1.00 0.00 H new ATOM 0 HD3 LYS B 50 87.690 -3.281 -38.075 1.00 0.00 H new ATOM 0 HE2 LYS B 50 86.693 -1.099 -38.746 1.00 0.00 H new ATOM 0 HE3 LYS B 50 86.489 -1.369 -37.027 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 87.417 0.887 -37.861 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 88.117 0.168 -36.491 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 88.892 0.056 -37.998 1.00 0.00 H new ATOM 914 N ARG B 51 91.409 -6.047 -35.565 1.00 0.00 N ATOM 915 CA ARG B 51 92.478 -7.039 -35.614 1.00 0.00 C ATOM 916 C ARG B 51 91.924 -8.436 -35.358 1.00 0.00 C ATOM 917 O ARG B 51 92.288 -9.394 -36.041 1.00 0.00 O ATOM 918 CB ARG B 51 93.541 -6.712 -34.564 1.00 0.00 C ATOM 919 CG ARG B 51 94.318 -5.466 -34.992 1.00 0.00 C ATOM 920 CD ARG B 51 95.361 -5.123 -33.927 1.00 0.00 C ATOM 921 NE ARG B 51 96.119 -3.941 -34.325 1.00 0.00 N ATOM 922 CZ ARG B 51 97.133 -4.030 -35.143 1.00 0.00 C ATOM 923 NH1 ARG B 51 97.487 -5.192 -35.619 1.00 0.00 N ATOM 924 NH2 ARG B 51 97.793 -2.957 -35.484 1.00 0.00 N ATOM 0 H ARG B 51 91.461 -5.404 -34.775 1.00 0.00 H new ATOM 0 HA ARG B 51 92.926 -7.014 -36.607 1.00 0.00 H new ATOM 0 HB2 ARG B 51 93.070 -6.545 -33.595 1.00 0.00 H new ATOM 0 HB3 ARG B 51 94.222 -7.555 -34.446 1.00 0.00 H new ATOM 0 HG2 ARG B 51 94.806 -5.641 -35.951 1.00 0.00 H new ATOM 0 HG3 ARG B 51 93.635 -4.628 -35.130 1.00 0.00 H new ATOM 0 HD2 ARG B 51 94.869 -4.944 -32.971 1.00 0.00 H new ATOM 0 HD3 ARG B 51 96.037 -5.966 -33.785 1.00 0.00 H new ATOM 0 HE ARG B 51 95.852 -3.028 -33.957 1.00 0.00 H new ATOM 0 HH11 ARG B 51 96.972 -6.031 -35.352 1.00 0.00 H new ATOM 0 HH12 ARG B 51 98.279 -5.262 -36.258 1.00 0.00 H new ATOM 0 HH21 ARG B 51 97.517 -2.048 -35.112 1.00 0.00 H new ATOM 0 HH22 ARG B 51 98.585 -3.027 -36.123 1.00 0.00 H new ATOM 938 N GLY B 52 91.059 -8.545 -34.387 1.00 0.00 N ATOM 939 CA GLY B 52 90.460 -9.831 -34.047 1.00 0.00 C ATOM 940 C GLY B 52 89.868 -9.801 -32.642 1.00 0.00 C ATOM 0 H GLY B 52 90.745 -7.765 -33.810 1.00 0.00 H new ATOM 0 HA2 GLY B 52 89.681 -10.076 -34.769 1.00 0.00 H new ATOM 0 HA3 GLY B 52 91.213 -10.616 -34.112 1.00 0.00 H new TER 944 GLY B 52 ATOM 945 N SER C 23 95.112 10.817 10.112 1.00 0.00 N ATOM 946 CA SER C 23 93.891 11.364 9.456 1.00 0.00 C ATOM 947 C SER C 23 93.490 10.457 8.297 1.00 0.00 C ATOM 948 O SER C 23 93.181 10.931 7.204 1.00 0.00 O ATOM 949 CB SER C 23 94.180 12.775 8.943 1.00 0.00 C ATOM 950 OG SER C 23 93.013 13.297 8.324 1.00 0.00 O ATOM 0 HA SER C 23 93.073 11.407 10.175 1.00 0.00 H new ATOM 0 HB2 SER C 23 94.487 13.418 9.767 1.00 0.00 H new ATOM 0 HB3 SER C 23 95.005 12.754 8.231 1.00 0.00 H new ATOM 0 HG SER C 23 92.652 12.636 7.697 1.00 0.00 H new ATOM 955 N ASP C 24 93.488 9.172 8.548 1.00 0.00 N ATOM 956 CA ASP C 24 93.115 8.193 7.534 1.00 0.00 C ATOM 957 C ASP C 24 93.687 8.581 6.174 1.00 0.00 C ATOM 958 O ASP C 24 92.955 8.672 5.188 1.00 0.00 O ATOM 959 CB ASP C 24 91.590 8.099 7.443 1.00 0.00 C ATOM 960 CG ASP C 24 90.988 9.490 7.276 1.00 0.00 C ATOM 961 OD1 ASP C 24 91.062 10.019 6.180 1.00 0.00 O ATOM 962 OD2 ASP C 24 90.460 10.005 8.248 1.00 0.00 O ATOM 0 H ASP C 24 93.741 8.768 9.450 1.00 0.00 H new ATOM 0 HA ASP C 24 93.525 7.224 7.820 1.00 0.00 H new ATOM 0 HB2 ASP C 24 91.306 7.468 6.601 1.00 0.00 H new ATOM 0 HB3 ASP C 24 91.193 7.628 8.342 1.00 0.00 H new ATOM 967 N PRO C 25 94.971 8.815 6.106 1.00 0.00 N ATOM 968 CA PRO C 25 95.644 9.206 4.835 1.00 0.00 C ATOM 969 C PRO C 25 95.417 8.156 3.754 1.00 0.00 C ATOM 970 O PRO C 25 95.750 8.361 2.588 1.00 0.00 O ATOM 971 CB PRO C 25 97.136 9.325 5.221 1.00 0.00 C ATOM 972 CG PRO C 25 97.269 8.579 6.513 1.00 0.00 C ATOM 973 CD PRO C 25 95.927 8.726 7.222 1.00 0.00 C ATOM 0 HA PRO C 25 95.256 10.135 4.417 1.00 0.00 H new ATOM 0 HB2 PRO C 25 97.777 8.896 4.451 1.00 0.00 H new ATOM 0 HB3 PRO C 25 97.431 10.368 5.337 1.00 0.00 H new ATOM 0 HG2 PRO C 25 97.504 7.530 6.335 1.00 0.00 H new ATOM 0 HG3 PRO C 25 98.077 8.988 7.119 1.00 0.00 H new ATOM 0 HD2 PRO C 25 95.716 7.873 7.867 1.00 0.00 H new ATOM 0 HD3 PRO C 25 95.898 9.616 7.850 1.00 0.00 H new ATOM 981 N LEU C 26 94.873 7.041 4.152 1.00 0.00 N ATOM 982 CA LEU C 26 94.619 5.951 3.213 1.00 0.00 C ATOM 983 C LEU C 26 93.628 6.371 2.121 1.00 0.00 C ATOM 984 O LEU C 26 93.815 6.047 0.948 1.00 0.00 O ATOM 985 CB LEU C 26 94.053 4.737 3.973 1.00 0.00 C ATOM 986 CG LEU C 26 95.183 3.942 4.631 1.00 0.00 C ATOM 987 CD1 LEU C 26 95.941 4.839 5.612 1.00 0.00 C ATOM 988 CD2 LEU C 26 94.582 2.750 5.384 1.00 0.00 C ATOM 0 H LEU C 26 94.593 6.850 5.114 1.00 0.00 H new ATOM 0 HA LEU C 26 95.564 5.690 2.736 1.00 0.00 H new ATOM 0 HB2 LEU C 26 93.347 5.073 4.732 1.00 0.00 H new ATOM 0 HB3 LEU C 26 93.501 4.095 3.286 1.00 0.00 H new ATOM 0 HG LEU C 26 95.874 3.585 3.867 1.00 0.00 H new ATOM 0 HD11 LEU C 26 96.745 4.270 6.079 1.00 0.00 H new ATOM 0 HD12 LEU C 26 96.362 5.690 5.076 1.00 0.00 H new ATOM 0 HD13 LEU C 26 95.256 5.197 6.381 1.00 0.00 H new ATOM 0 HD21 LEU C 26 95.381 2.178 5.856 1.00 0.00 H new ATOM 0 HD22 LEU C 26 93.894 3.112 6.148 1.00 0.00 H new ATOM 0 HD23 LEU C 26 94.043 2.112 4.684 1.00 0.00 H new ATOM 1000 N VAL C 27 92.586 7.050 2.509 1.00 0.00 N ATOM 1001 CA VAL C 27 91.556 7.474 1.561 1.00 0.00 C ATOM 1002 C VAL C 27 92.055 8.554 0.598 1.00 0.00 C ATOM 1003 O VAL C 27 91.779 8.501 -0.601 1.00 0.00 O ATOM 1004 CB VAL C 27 90.346 8.012 2.329 1.00 0.00 C ATOM 1005 CG1 VAL C 27 89.245 8.414 1.345 1.00 0.00 C ATOM 1006 CG2 VAL C 27 89.817 6.926 3.267 1.00 0.00 C ATOM 0 H VAL C 27 92.413 7.330 3.475 1.00 0.00 H new ATOM 0 HA VAL C 27 91.283 6.601 0.968 1.00 0.00 H new ATOM 0 HB VAL C 27 90.646 8.884 2.909 1.00 0.00 H new ATOM 0 HG11 VAL C 27 88.386 8.796 1.896 1.00 0.00 H new ATOM 0 HG12 VAL C 27 89.620 9.188 0.676 1.00 0.00 H new ATOM 0 HG13 VAL C 27 88.944 7.544 0.761 1.00 0.00 H new ATOM 0 HG21 VAL C 27 88.955 7.307 3.815 1.00 0.00 H new ATOM 0 HG22 VAL C 27 89.520 6.054 2.684 1.00 0.00 H new ATOM 0 HG23 VAL C 27 90.598 6.642 3.972 1.00 0.00 H new ATOM 1016 N VAL C 28 92.767 9.515 1.115 1.00 0.00 N ATOM 1017 CA VAL C 28 93.282 10.601 0.280 1.00 0.00 C ATOM 1018 C VAL C 28 94.430 10.133 -0.615 1.00 0.00 C ATOM 1019 O VAL C 28 94.513 10.522 -1.778 1.00 0.00 O ATOM 1020 CB VAL C 28 93.720 11.793 1.157 1.00 0.00 C ATOM 1021 CG1 VAL C 28 95.133 11.568 1.710 1.00 0.00 C ATOM 1022 CG2 VAL C 28 93.706 13.082 0.323 1.00 0.00 C ATOM 0 H VAL C 28 93.011 9.583 2.103 1.00 0.00 H new ATOM 0 HA VAL C 28 92.474 10.927 -0.375 1.00 0.00 H new ATOM 0 HB VAL C 28 93.023 11.881 1.990 1.00 0.00 H new ATOM 0 HG11 VAL C 28 95.423 12.420 2.325 1.00 0.00 H new ATOM 0 HG12 VAL C 28 95.147 10.662 2.315 1.00 0.00 H new ATOM 0 HG13 VAL C 28 95.835 11.463 0.883 1.00 0.00 H new ATOM 0 HG21 VAL C 28 94.016 13.921 0.945 1.00 0.00 H new ATOM 0 HG22 VAL C 28 94.394 12.980 -0.517 1.00 0.00 H new ATOM 0 HG23 VAL C 28 92.699 13.261 -0.053 1.00 0.00 H new ATOM 1032 N ALA C 29 95.302 9.335 -0.064 1.00 0.00 N ATOM 1033 CA ALA C 29 96.466 8.829 -0.791 1.00 0.00 C ATOM 1034 C ALA C 29 96.100 7.803 -1.868 1.00 0.00 C ATOM 1035 O ALA C 29 96.830 7.655 -2.848 1.00 0.00 O ATOM 1036 CB ALA C 29 97.436 8.181 0.197 1.00 0.00 C ATOM 0 H ALA C 29 95.239 9.009 0.900 1.00 0.00 H new ATOM 0 HA ALA C 29 96.923 9.682 -1.293 1.00 0.00 H new ATOM 0 HB1 ALA C 29 98.305 7.803 -0.341 1.00 0.00 H new ATOM 0 HB2 ALA C 29 97.757 8.921 0.930 1.00 0.00 H new ATOM 0 HB3 ALA C 29 96.938 7.357 0.708 1.00 0.00 H new ATOM 1042 N ALA C 30 95.016 7.087 -1.689 1.00 0.00 N ATOM 1043 CA ALA C 30 94.632 6.077 -2.657 1.00 0.00 C ATOM 1044 C ALA C 30 94.062 6.677 -3.948 1.00 0.00 C ATOM 1045 O ALA C 30 94.282 6.138 -5.032 1.00 0.00 O ATOM 1046 CB ALA C 30 93.643 5.122 -2.012 1.00 0.00 C ATOM 0 H ALA C 30 94.387 7.180 -0.892 1.00 0.00 H new ATOM 0 HA ALA C 30 95.530 5.534 -2.953 1.00 0.00 H new ATOM 0 HB1 ALA C 30 93.350 4.360 -2.734 1.00 0.00 H new ATOM 0 HB2 ALA C 30 94.108 4.645 -1.149 1.00 0.00 H new ATOM 0 HB3 ALA C 30 92.761 5.675 -1.689 1.00 0.00 H new ATOM 1052 N SER C 31 93.330 7.762 -3.839 1.00 0.00 N ATOM 1053 CA SER C 31 92.726 8.401 -5.014 1.00 0.00 C ATOM 1054 C SER C 31 93.774 9.055 -5.911 1.00 0.00 C ATOM 1055 O SER C 31 93.566 9.210 -7.114 1.00 0.00 O ATOM 1056 CB SER C 31 91.719 9.459 -4.559 1.00 0.00 C ATOM 1057 OG SER C 31 91.071 10.012 -5.698 1.00 0.00 O ATOM 0 H SER C 31 93.131 8.230 -2.955 1.00 0.00 H new ATOM 0 HA SER C 31 92.227 7.624 -5.593 1.00 0.00 H new ATOM 0 HB2 SER C 31 90.984 9.013 -3.889 1.00 0.00 H new ATOM 0 HB3 SER C 31 92.227 10.244 -3.999 1.00 0.00 H new ATOM 0 HG SER C 31 90.424 10.689 -5.410 1.00 0.00 H new ATOM 1063 N ILE C 32 94.858 9.459 -5.323 1.00 0.00 N ATOM 1064 CA ILE C 32 95.923 10.137 -6.057 1.00 0.00 C ATOM 1065 C ILE C 32 96.232 9.400 -7.359 1.00 0.00 C ATOM 1066 O ILE C 32 96.527 10.026 -8.378 1.00 0.00 O ATOM 1067 CB ILE C 32 97.168 10.178 -5.167 1.00 0.00 C ATOM 1068 CG1 ILE C 32 96.774 10.674 -3.775 1.00 0.00 C ATOM 1069 CG2 ILE C 32 98.227 11.108 -5.745 1.00 0.00 C ATOM 1070 CD1 ILE C 32 96.034 12.014 -3.868 1.00 0.00 C ATOM 0 H ILE C 32 95.045 9.337 -4.328 1.00 0.00 H new ATOM 0 HA ILE C 32 95.608 11.149 -6.312 1.00 0.00 H new ATOM 0 HB ILE C 32 97.584 9.172 -5.111 1.00 0.00 H new ATOM 0 HG12 ILE C 32 96.139 9.935 -3.286 1.00 0.00 H new ATOM 0 HG13 ILE C 32 97.665 10.787 -3.158 1.00 0.00 H new ATOM 0 HG21 ILE C 32 99.099 11.117 -5.092 1.00 0.00 H new ATOM 0 HG22 ILE C 32 98.519 10.757 -6.735 1.00 0.00 H new ATOM 0 HG23 ILE C 32 97.822 12.117 -5.823 1.00 0.00 H new ATOM 0 HD11 ILE C 32 95.762 12.350 -2.867 1.00 0.00 H new ATOM 0 HD12 ILE C 32 96.681 12.755 -4.336 1.00 0.00 H new ATOM 0 HD13 ILE C 32 95.132 11.890 -4.467 1.00 0.00 H new ATOM 1082 N ILE C 33 96.137 8.102 -7.333 1.00 0.00 N ATOM 1083 CA ILE C 33 96.380 7.310 -8.534 1.00 0.00 C ATOM 1084 C ILE C 33 95.243 7.516 -9.537 1.00 0.00 C ATOM 1085 O ILE C 33 95.467 7.630 -10.740 1.00 0.00 O ATOM 1086 CB ILE C 33 96.479 5.828 -8.168 1.00 0.00 C ATOM 1087 CG1 ILE C 33 97.578 5.632 -7.121 1.00 0.00 C ATOM 1088 CG2 ILE C 33 96.816 5.011 -9.416 1.00 0.00 C ATOM 1089 CD1 ILE C 33 97.481 4.221 -6.538 1.00 0.00 C ATOM 0 H ILE C 33 95.895 7.559 -6.504 1.00 0.00 H new ATOM 0 HA ILE C 33 97.318 7.633 -8.986 1.00 0.00 H new ATOM 0 HB ILE C 33 95.524 5.493 -7.762 1.00 0.00 H new ATOM 0 HG12 ILE C 33 98.558 5.783 -7.574 1.00 0.00 H new ATOM 0 HG13 ILE C 33 97.476 6.373 -6.328 1.00 0.00 H new ATOM 0 HG21 ILE C 33 96.886 3.956 -9.152 1.00 0.00 H new ATOM 0 HG22 ILE C 33 96.033 5.147 -10.162 1.00 0.00 H new ATOM 0 HG23 ILE C 33 97.769 5.347 -9.824 1.00 0.00 H new ATOM 0 HD11 ILE C 33 98.264 4.081 -5.792 1.00 0.00 H new ATOM 0 HD12 ILE C 33 96.506 4.087 -6.070 1.00 0.00 H new ATOM 0 HD13 ILE C 33 97.605 3.488 -7.336 1.00 0.00 H new ATOM 1101 N GLY C 34 94.041 7.515 -9.031 1.00 0.00 N ATOM 1102 CA GLY C 34 92.853 7.655 -9.872 1.00 0.00 C ATOM 1103 C GLY C 34 92.964 8.816 -10.864 1.00 0.00 C ATOM 1104 O GLY C 34 92.712 8.641 -12.053 1.00 0.00 O ATOM 0 H GLY C 34 93.843 7.419 -8.035 1.00 0.00 H new ATOM 0 HA2 GLY C 34 92.691 6.728 -10.421 1.00 0.00 H new ATOM 0 HA3 GLY C 34 91.980 7.807 -9.238 1.00 0.00 H new ATOM 1108 N ILE C 35 93.321 9.978 -10.396 1.00 0.00 N ATOM 1109 CA ILE C 35 93.434 11.131 -11.291 1.00 0.00 C ATOM 1110 C ILE C 35 94.600 10.962 -12.266 1.00 0.00 C ATOM 1111 O ILE C 35 94.570 11.488 -13.379 1.00 0.00 O ATOM 1112 CB ILE C 35 93.618 12.417 -10.485 1.00 0.00 C ATOM 1113 CG1 ILE C 35 94.806 12.266 -9.532 1.00 0.00 C ATOM 1114 CG2 ILE C 35 92.350 12.700 -9.678 1.00 0.00 C ATOM 1115 CD1 ILE C 35 95.127 13.625 -8.905 1.00 0.00 C ATOM 0 H ILE C 35 93.539 10.167 -9.418 1.00 0.00 H new ATOM 0 HA ILE C 35 92.510 11.196 -11.866 1.00 0.00 H new ATOM 0 HB ILE C 35 93.808 13.245 -11.168 1.00 0.00 H new ATOM 0 HG12 ILE C 35 94.573 11.539 -8.754 1.00 0.00 H new ATOM 0 HG13 ILE C 35 95.674 11.887 -10.072 1.00 0.00 H new ATOM 0 HG21 ILE C 35 92.481 13.617 -9.103 1.00 0.00 H new ATOM 0 HG22 ILE C 35 91.505 12.815 -10.357 1.00 0.00 H new ATOM 0 HG23 ILE C 35 92.159 11.870 -8.998 1.00 0.00 H new ATOM 0 HD11 ILE C 35 95.973 13.521 -8.225 1.00 0.00 H new ATOM 0 HD12 ILE C 35 95.378 14.338 -9.690 1.00 0.00 H new ATOM 0 HD13 ILE C 35 94.259 13.985 -8.352 1.00 0.00 H new ATOM 1127 N LEU C 36 95.608 10.252 -11.845 1.00 0.00 N ATOM 1128 CA LEU C 36 96.787 10.030 -12.680 1.00 0.00 C ATOM 1129 C LEU C 36 96.445 9.247 -13.953 1.00 0.00 C ATOM 1130 O LEU C 36 97.102 9.415 -14.981 1.00 0.00 O ATOM 1131 CB LEU C 36 97.848 9.263 -11.877 1.00 0.00 C ATOM 1132 CG LEU C 36 99.174 9.187 -12.655 1.00 0.00 C ATOM 1133 CD1 LEU C 36 99.860 10.565 -12.694 1.00 0.00 C ATOM 1134 CD2 LEU C 36 100.094 8.173 -11.965 1.00 0.00 C ATOM 0 H LEU C 36 95.651 9.809 -10.927 1.00 0.00 H new ATOM 0 HA LEU C 36 97.172 11.005 -12.980 1.00 0.00 H new ATOM 0 HB2 LEU C 36 98.011 9.756 -10.918 1.00 0.00 H new ATOM 0 HB3 LEU C 36 97.490 8.256 -11.661 1.00 0.00 H new ATOM 0 HG LEU C 36 98.971 8.875 -13.680 1.00 0.00 H new ATOM 0 HD11 LEU C 36 100.796 10.490 -13.248 1.00 0.00 H new ATOM 0 HD12 LEU C 36 99.204 11.284 -13.185 1.00 0.00 H new ATOM 0 HD13 LEU C 36 100.067 10.897 -11.677 1.00 0.00 H new ATOM 0 HD21 LEU C 36 101.037 8.110 -12.507 1.00 0.00 H new ATOM 0 HD22 LEU C 36 100.285 8.493 -10.941 1.00 0.00 H new ATOM 0 HD23 LEU C 36 99.615 7.194 -11.956 1.00 0.00 H new ATOM 1146 N HIS C 37 95.444 8.406 -13.889 1.00 0.00 N ATOM 1147 CA HIS C 37 95.058 7.616 -15.061 1.00 0.00 C ATOM 1148 C HIS C 37 94.373 8.468 -16.131 1.00 0.00 C ATOM 1149 O HIS C 37 94.469 8.170 -17.321 1.00 0.00 O ATOM 1150 CB HIS C 37 94.165 6.428 -14.659 1.00 0.00 C ATOM 1151 CG HIS C 37 92.757 6.868 -14.335 1.00 0.00 C ATOM 1152 ND1 HIS C 37 92.039 7.753 -15.127 1.00 0.00 N ATOM 1153 CD2 HIS C 37 91.912 6.520 -13.310 1.00 0.00 C ATOM 1154 CE1 HIS C 37 90.825 7.906 -14.569 1.00 0.00 C ATOM 1155 NE2 HIS C 37 90.695 7.177 -13.459 1.00 0.00 N ATOM 0 H HIS C 37 94.880 8.242 -13.055 1.00 0.00 H new ATOM 0 HA HIS C 37 95.978 7.225 -15.496 1.00 0.00 H new ATOM 0 HB2 HIS C 37 94.141 5.701 -15.471 1.00 0.00 H new ATOM 0 HB3 HIS C 37 94.597 5.925 -13.794 1.00 0.00 H new ATOM 0 HD2 HIS C 37 92.156 5.838 -12.508 1.00 0.00 H new ATOM 0 HE1 HIS C 37 90.050 8.542 -14.970 1.00 0.00 H new ATOM 0 HE2 HIS C 37 89.879 7.115 -12.851 1.00 0.00 H new ATOM 1164 N PHE C 38 93.674 9.491 -15.714 1.00 0.00 N ATOM 1165 CA PHE C 38 92.957 10.346 -16.661 1.00 0.00 C ATOM 1166 C PHE C 38 93.911 11.054 -17.627 1.00 0.00 C ATOM 1167 O PHE C 38 93.704 11.024 -18.840 1.00 0.00 O ATOM 1168 CB PHE C 38 92.120 11.385 -15.910 1.00 0.00 C ATOM 1169 CG PHE C 38 91.362 12.227 -16.911 1.00 0.00 C ATOM 1170 CD1 PHE C 38 91.984 13.335 -17.499 1.00 0.00 C ATOM 1171 CD2 PHE C 38 90.042 11.900 -17.258 1.00 0.00 C ATOM 1172 CE1 PHE C 38 91.291 14.116 -18.431 1.00 0.00 C ATOM 1173 CE2 PHE C 38 89.351 12.683 -18.191 1.00 0.00 C ATOM 1174 CZ PHE C 38 89.975 13.790 -18.777 1.00 0.00 C ATOM 0 H PHE C 38 93.578 9.762 -14.735 1.00 0.00 H new ATOM 0 HA PHE C 38 92.302 9.702 -17.247 1.00 0.00 H new ATOM 0 HB2 PHE C 38 91.425 10.889 -15.233 1.00 0.00 H new ATOM 0 HB3 PHE C 38 92.765 12.017 -15.299 1.00 0.00 H new ATOM 0 HD1 PHE C 38 93.000 13.587 -17.233 1.00 0.00 H new ATOM 0 HD2 PHE C 38 89.560 11.046 -16.806 1.00 0.00 H new ATOM 0 HE1 PHE C 38 91.772 14.971 -18.883 1.00 0.00 H new ATOM 0 HE2 PHE C 38 88.335 12.432 -18.459 1.00 0.00 H new ATOM 0 HZ PHE C 38 89.441 14.393 -19.496 1.00 0.00 H new ATOM 1184 N ILE C 39 94.928 11.686 -17.103 1.00 0.00 N ATOM 1185 CA ILE C 39 95.884 12.399 -17.952 1.00 0.00 C ATOM 1186 C ILE C 39 96.629 11.421 -18.855 1.00 0.00 C ATOM 1187 O ILE C 39 97.041 11.767 -19.959 1.00 0.00 O ATOM 1188 CB ILE C 39 96.882 13.180 -17.087 1.00 0.00 C ATOM 1189 CG1 ILE C 39 97.918 13.895 -17.973 1.00 0.00 C ATOM 1190 CG2 ILE C 39 97.608 12.216 -16.148 1.00 0.00 C ATOM 1191 CD1 ILE C 39 97.218 14.809 -18.988 1.00 0.00 C ATOM 0 H ILE C 39 95.127 11.730 -16.103 1.00 0.00 H new ATOM 0 HA ILE C 39 95.333 13.101 -18.578 1.00 0.00 H new ATOM 0 HB ILE C 39 96.334 13.924 -16.508 1.00 0.00 H new ATOM 0 HG12 ILE C 39 98.593 14.482 -17.351 1.00 0.00 H new ATOM 0 HG13 ILE C 39 98.527 13.159 -18.497 1.00 0.00 H new ATOM 0 HG21 ILE C 39 98.317 12.771 -15.534 1.00 0.00 H new ATOM 0 HG22 ILE C 39 96.882 11.719 -15.505 1.00 0.00 H new ATOM 0 HG23 ILE C 39 98.143 11.470 -16.735 1.00 0.00 H new ATOM 0 HD11 ILE C 39 97.966 15.306 -19.606 1.00 0.00 H new ATOM 0 HD12 ILE C 39 96.561 14.213 -19.622 1.00 0.00 H new ATOM 0 HD13 ILE C 39 96.629 15.558 -18.458 1.00 0.00 H new ATOM 1203 N ALA C 40 96.787 10.219 -18.386 1.00 0.00 N ATOM 1204 CA ALA C 40 97.465 9.195 -19.165 1.00 0.00 C ATOM 1205 C ALA C 40 96.580 8.748 -20.327 1.00 0.00 C ATOM 1206 O ALA C 40 97.065 8.430 -21.409 1.00 0.00 O ATOM 1207 CB ALA C 40 97.789 7.992 -18.276 1.00 0.00 C ATOM 0 H ALA C 40 96.460 9.912 -17.470 1.00 0.00 H new ATOM 0 HA ALA C 40 98.392 9.611 -19.560 1.00 0.00 H new ATOM 0 HB1 ALA C 40 98.297 7.229 -18.867 1.00 0.00 H new ATOM 0 HB2 ALA C 40 98.436 8.308 -17.458 1.00 0.00 H new ATOM 0 HB3 ALA C 40 96.865 7.581 -17.869 1.00 0.00 H new ATOM 1213 N TRP C 41 95.301 8.692 -20.067 1.00 0.00 N ATOM 1214 CA TRP C 41 94.313 8.239 -21.044 1.00 0.00 C ATOM 1215 C TRP C 41 94.435 8.940 -22.395 1.00 0.00 C ATOM 1216 O TRP C 41 94.481 8.288 -23.438 1.00 0.00 O ATOM 1217 CB TRP C 41 92.931 8.509 -20.460 1.00 0.00 C ATOM 1218 CG TRP C 41 91.884 7.852 -21.288 1.00 0.00 C ATOM 1219 CD1 TRP C 41 91.520 8.231 -22.532 1.00 0.00 C ATOM 1220 CD2 TRP C 41 91.050 6.715 -20.943 1.00 0.00 C ATOM 1221 NE1 TRP C 41 90.513 7.393 -22.975 1.00 0.00 N ATOM 1222 CE2 TRP C 41 90.189 6.442 -22.028 1.00 0.00 C ATOM 1223 CE3 TRP C 41 90.961 5.901 -19.801 1.00 0.00 C ATOM 1224 CZ2 TRP C 41 89.269 5.396 -21.982 1.00 0.00 C ATOM 1225 CZ3 TRP C 41 90.036 4.850 -19.751 1.00 0.00 C ATOM 1226 CH2 TRP C 41 89.192 4.598 -20.839 1.00 0.00 C ATOM 0 H TRP C 41 94.900 8.959 -19.168 1.00 0.00 H new ATOM 0 HA TRP C 41 94.482 7.179 -21.231 1.00 0.00 H new ATOM 0 HB2 TRP C 41 92.882 8.137 -19.437 1.00 0.00 H new ATOM 0 HB3 TRP C 41 92.750 9.583 -20.417 1.00 0.00 H new ATOM 0 HD1 TRP C 41 91.945 9.053 -23.089 1.00 0.00 H new ATOM 0 HE1 TRP C 41 90.065 7.468 -23.888 1.00 0.00 H new ATOM 0 HE3 TRP C 41 91.609 6.087 -18.957 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 88.621 5.204 -22.824 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 89.974 4.231 -18.868 1.00 0.00 H new ATOM 0 HH2 TRP C 41 88.481 3.786 -20.794 1.00 0.00 H new ATOM 1237 N THR C 42 94.464 10.236 -22.375 1.00 0.00 N ATOM 1238 CA THR C 42 94.553 11.009 -23.609 1.00 0.00 C ATOM 1239 C THR C 42 95.677 10.504 -24.513 1.00 0.00 C ATOM 1240 O THR C 42 95.620 10.676 -25.730 1.00 0.00 O ATOM 1241 CB THR C 42 94.779 12.489 -23.297 1.00 0.00 C ATOM 1242 OG1 THR C 42 95.374 13.120 -24.423 1.00 0.00 O ATOM 1243 CG2 THR C 42 95.701 12.617 -22.091 1.00 0.00 C ATOM 0 H THR C 42 94.428 10.797 -21.524 1.00 0.00 H new ATOM 0 HA THR C 42 93.607 10.885 -24.136 1.00 0.00 H new ATOM 0 HB THR C 42 93.825 12.968 -23.074 1.00 0.00 H new ATOM 0 HG1 THR C 42 95.519 14.069 -24.227 1.00 0.00 H new ATOM 0 HG21 THR C 42 95.863 13.671 -21.867 1.00 0.00 H new ATOM 0 HG22 THR C 42 95.244 12.130 -21.230 1.00 0.00 H new ATOM 0 HG23 THR C 42 96.657 12.142 -22.312 1.00 0.00 H new ATOM 1251 N ILE C 43 96.692 9.915 -23.934 1.00 0.00 N ATOM 1252 CA ILE C 43 97.824 9.425 -24.718 1.00 0.00 C ATOM 1253 C ILE C 43 97.409 8.287 -25.663 1.00 0.00 C ATOM 1254 O ILE C 43 97.916 8.196 -26.777 1.00 0.00 O ATOM 1255 CB ILE C 43 98.957 8.973 -23.755 1.00 0.00 C ATOM 1256 CG1 ILE C 43 100.335 9.259 -24.370 1.00 0.00 C ATOM 1257 CG2 ILE C 43 98.862 7.470 -23.446 1.00 0.00 C ATOM 1258 CD1 ILE C 43 101.425 8.931 -23.345 1.00 0.00 C ATOM 0 H ILE C 43 96.769 9.758 -22.929 1.00 0.00 H new ATOM 0 HA ILE C 43 98.191 10.235 -25.348 1.00 0.00 H new ATOM 0 HB ILE C 43 98.837 9.538 -22.831 1.00 0.00 H new ATOM 0 HG12 ILE C 43 100.475 8.661 -25.271 1.00 0.00 H new ATOM 0 HG13 ILE C 43 100.403 10.305 -24.668 1.00 0.00 H new ATOM 0 HG21 ILE C 43 99.668 7.186 -22.770 1.00 0.00 H new ATOM 0 HG22 ILE C 43 97.902 7.255 -22.976 1.00 0.00 H new ATOM 0 HG23 ILE C 43 98.948 6.902 -24.372 1.00 0.00 H new ATOM 0 HD11 ILE C 43 102.405 9.133 -23.778 1.00 0.00 H new ATOM 0 HD12 ILE C 43 101.287 9.548 -22.457 1.00 0.00 H new ATOM 0 HD13 ILE C 43 101.360 7.878 -23.069 1.00 0.00 H new ATOM 1270 N GLY C 44 96.522 7.436 -25.211 1.00 0.00 N ATOM 1271 CA GLY C 44 96.057 6.301 -26.020 1.00 0.00 C ATOM 1272 C GLY C 44 95.177 6.764 -27.183 1.00 0.00 C ATOM 1273 O GLY C 44 95.121 6.123 -28.233 1.00 0.00 O ATOM 0 H GLY C 44 96.097 7.495 -24.286 1.00 0.00 H new ATOM 0 HA2 GLY C 44 96.916 5.753 -26.408 1.00 0.00 H new ATOM 0 HA3 GLY C 44 95.496 5.610 -25.391 1.00 0.00 H new ATOM 1277 N HIS C 45 94.505 7.853 -26.975 1.00 0.00 N ATOM 1278 CA HIS C 45 93.611 8.417 -27.985 1.00 0.00 C ATOM 1279 C HIS C 45 94.324 8.656 -29.326 1.00 0.00 C ATOM 1280 O HIS C 45 93.685 8.647 -30.377 1.00 0.00 O ATOM 1281 CB HIS C 45 93.010 9.726 -27.483 1.00 0.00 C ATOM 1282 CG HIS C 45 92.024 10.230 -28.502 1.00 0.00 C ATOM 1283 ND1 HIS C 45 92.389 11.107 -29.510 1.00 0.00 N ATOM 1284 CD2 HIS C 45 90.688 9.972 -28.693 1.00 0.00 C ATOM 1285 CE1 HIS C 45 91.294 11.343 -30.258 1.00 0.00 C ATOM 1286 NE2 HIS C 45 90.231 10.676 -29.804 1.00 0.00 N ATOM 0 H HIS C 45 94.548 8.389 -26.108 1.00 0.00 H new ATOM 0 HA HIS C 45 92.819 7.688 -28.157 1.00 0.00 H new ATOM 0 HB2 HIS C 45 92.515 9.571 -26.524 1.00 0.00 H new ATOM 0 HB3 HIS C 45 93.795 10.464 -27.321 1.00 0.00 H new ATOM 0 HD2 HIS C 45 90.085 9.323 -28.076 1.00 0.00 H new ATOM 0 HE1 HIS C 45 91.278 11.993 -31.120 1.00 0.00 H new ATOM 0 HE2 HIS C 45 89.286 10.681 -30.188 1.00 0.00 H new ATOM 1295 N LEU C 46 95.609 8.903 -29.286 1.00 0.00 N ATOM 1296 CA LEU C 46 96.365 9.182 -30.515 1.00 0.00 C ATOM 1297 C LEU C 46 96.058 8.184 -31.633 1.00 0.00 C ATOM 1298 O LEU C 46 96.062 8.561 -32.804 1.00 0.00 O ATOM 1299 CB LEU C 46 97.896 9.276 -30.237 1.00 0.00 C ATOM 1300 CG LEU C 46 98.630 7.899 -30.067 1.00 0.00 C ATOM 1301 CD1 LEU C 46 97.825 6.894 -29.220 1.00 0.00 C ATOM 1302 CD2 LEU C 46 98.983 7.268 -31.433 1.00 0.00 C ATOM 0 H LEU C 46 96.164 8.920 -28.431 1.00 0.00 H new ATOM 0 HA LEU C 46 96.032 10.158 -30.869 1.00 0.00 H new ATOM 0 HB2 LEU C 46 98.365 9.821 -31.056 1.00 0.00 H new ATOM 0 HB3 LEU C 46 98.049 9.865 -29.333 1.00 0.00 H new ATOM 0 HG LEU C 46 99.553 8.121 -29.531 1.00 0.00 H new ATOM 0 HD11 LEU C 46 98.382 5.961 -29.137 1.00 0.00 H new ATOM 0 HD12 LEU C 46 97.659 7.308 -28.225 1.00 0.00 H new ATOM 0 HD13 LEU C 46 96.865 6.702 -29.698 1.00 0.00 H new ATOM 0 HD21 LEU C 46 99.490 6.316 -31.274 1.00 0.00 H new ATOM 0 HD22 LEU C 46 98.069 7.102 -32.004 1.00 0.00 H new ATOM 0 HD23 LEU C 46 99.639 7.940 -31.986 1.00 0.00 H new ATOM 1314 N ASN C 47 95.782 6.951 -31.310 1.00 0.00 N ATOM 1315 CA ASN C 47 95.467 5.981 -32.361 1.00 0.00 C ATOM 1316 C ASN C 47 94.170 6.372 -33.086 1.00 0.00 C ATOM 1317 O ASN C 47 94.134 6.454 -34.312 1.00 0.00 O ATOM 1318 CB ASN C 47 95.307 4.588 -31.751 1.00 0.00 C ATOM 1319 CG ASN C 47 96.658 4.066 -31.278 1.00 0.00 C ATOM 1320 OD1 ASN C 47 96.806 3.688 -30.116 1.00 0.00 O ATOM 1321 ND2 ASN C 47 97.660 4.027 -32.112 1.00 0.00 N ATOM 0 H ASN C 47 95.764 6.585 -30.358 1.00 0.00 H new ATOM 0 HA ASN C 47 96.286 5.974 -33.080 1.00 0.00 H new ATOM 0 HB2 ASN C 47 94.610 4.627 -30.914 1.00 0.00 H new ATOM 0 HB3 ASN C 47 94.883 3.906 -32.488 1.00 0.00 H new ATOM 0 HD21 ASN C 47 98.569 3.683 -31.802 1.00 0.00 H new ATOM 0 HD22 ASN C 47 97.535 4.341 -33.074 1.00 0.00 H new ATOM 1328 N GLN C 48 93.128 6.593 -32.326 1.00 0.00 N ATOM 1329 CA GLN C 48 91.827 6.965 -32.882 1.00 0.00 C ATOM 1330 C GLN C 48 91.968 7.927 -34.065 1.00 0.00 C ATOM 1331 O GLN C 48 91.299 7.766 -35.086 1.00 0.00 O ATOM 1332 CB GLN C 48 90.977 7.620 -31.786 1.00 0.00 C ATOM 1333 CG GLN C 48 89.573 7.940 -32.317 1.00 0.00 C ATOM 1334 CD GLN C 48 88.840 6.654 -32.681 1.00 0.00 C ATOM 1335 OE1 GLN C 48 88.337 5.956 -31.801 1.00 0.00 O ATOM 1336 NE2 GLN C 48 88.750 6.296 -33.932 1.00 0.00 N ATOM 0 H GLN C 48 93.144 6.524 -31.308 1.00 0.00 H new ATOM 0 HA GLN C 48 91.344 6.059 -33.246 1.00 0.00 H new ATOM 0 HB2 GLN C 48 90.904 6.954 -30.926 1.00 0.00 H new ATOM 0 HB3 GLN C 48 91.459 8.534 -31.441 1.00 0.00 H new ATOM 0 HG2 GLN C 48 89.008 8.488 -31.563 1.00 0.00 H new ATOM 0 HG3 GLN C 48 89.646 8.585 -33.192 1.00 0.00 H new ATOM 0 HE21 GLN C 48 89.168 6.876 -34.660 1.00 0.00 H new ATOM 0 HE22 GLN C 48 88.262 5.436 -34.183 1.00 0.00 H new ATOM 1345 N ILE C 49 92.809 8.916 -33.922 1.00 0.00 N ATOM 1346 CA ILE C 49 93.002 9.898 -34.987 1.00 0.00 C ATOM 1347 C ILE C 49 93.499 9.233 -36.268 1.00 0.00 C ATOM 1348 O ILE C 49 93.249 9.723 -37.369 1.00 0.00 O ATOM 1349 CB ILE C 49 94.005 10.967 -34.544 1.00 0.00 C ATOM 1350 CG1 ILE C 49 93.502 11.640 -33.263 1.00 0.00 C ATOM 1351 CG2 ILE C 49 94.148 12.017 -35.647 1.00 0.00 C ATOM 1352 CD1 ILE C 49 94.597 12.547 -32.697 1.00 0.00 C ATOM 0 H ILE C 49 93.375 9.074 -33.088 1.00 0.00 H new ATOM 0 HA ILE C 49 92.038 10.363 -35.190 1.00 0.00 H new ATOM 0 HB ILE C 49 94.972 10.502 -34.355 1.00 0.00 H new ATOM 0 HG12 ILE C 49 92.606 12.223 -33.474 1.00 0.00 H new ATOM 0 HG13 ILE C 49 93.225 10.885 -32.528 1.00 0.00 H new ATOM 0 HG21 ILE C 49 94.862 12.779 -35.334 1.00 0.00 H new ATOM 0 HG22 ILE C 49 94.504 11.540 -36.560 1.00 0.00 H new ATOM 0 HG23 ILE C 49 93.180 12.482 -35.835 1.00 0.00 H new ATOM 0 HD11 ILE C 49 94.238 13.025 -31.786 1.00 0.00 H new ATOM 0 HD12 ILE C 49 95.481 11.952 -32.470 1.00 0.00 H new ATOM 0 HD13 ILE C 49 94.852 13.311 -33.431 1.00 0.00 H new ATOM 1364 N LYS C 50 94.196 8.142 -36.122 1.00 0.00 N ATOM 1365 CA LYS C 50 94.729 7.428 -37.277 1.00 0.00 C ATOM 1366 C LYS C 50 93.603 6.945 -38.189 1.00 0.00 C ATOM 1367 O LYS C 50 93.676 7.097 -39.408 1.00 0.00 O ATOM 1368 CB LYS C 50 95.560 6.227 -36.810 1.00 0.00 C ATOM 1369 CG LYS C 50 96.364 5.644 -37.989 1.00 0.00 C ATOM 1370 CD LYS C 50 97.698 6.387 -38.139 1.00 0.00 C ATOM 1371 CE LYS C 50 98.518 5.744 -39.258 1.00 0.00 C ATOM 1372 NZ LYS C 50 99.806 6.477 -39.414 1.00 0.00 N ATOM 0 H LYS C 50 94.415 7.718 -35.221 1.00 0.00 H new ATOM 0 HA LYS C 50 95.361 8.115 -37.840 1.00 0.00 H new ATOM 0 HB2 LYS C 50 96.239 6.533 -36.014 1.00 0.00 H new ATOM 0 HB3 LYS C 50 94.905 5.462 -36.394 1.00 0.00 H new ATOM 0 HG2 LYS C 50 96.547 4.582 -37.824 1.00 0.00 H new ATOM 0 HG3 LYS C 50 95.787 5.729 -38.910 1.00 0.00 H new ATOM 0 HD2 LYS C 50 97.517 7.438 -38.364 1.00 0.00 H new ATOM 0 HD3 LYS C 50 98.253 6.353 -37.201 1.00 0.00 H new ATOM 0 HE2 LYS C 50 98.709 4.696 -39.027 1.00 0.00 H new ATOM 0 HE3 LYS C 50 97.958 5.767 -40.193 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 99.942 6.731 -40.413 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 99.785 7.342 -38.837 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 100.591 5.870 -39.101 1.00 0.00 H new ATOM 1386 N ARG C 51 92.587 6.367 -37.608 1.00 0.00 N ATOM 1387 CA ARG C 51 91.465 5.863 -38.393 1.00 0.00 C ATOM 1388 C ARG C 51 90.841 6.984 -39.216 1.00 0.00 C ATOM 1389 O ARG C 51 90.540 8.058 -38.695 1.00 0.00 O ATOM 1390 CB ARG C 51 90.407 5.246 -37.462 1.00 0.00 C ATOM 1391 CG ARG C 51 89.316 4.503 -38.281 1.00 0.00 C ATOM 1392 CD ARG C 51 88.068 5.383 -38.444 1.00 0.00 C ATOM 1393 NE ARG C 51 87.339 5.462 -37.183 1.00 0.00 N ATOM 1394 CZ ARG C 51 86.113 5.907 -37.140 1.00 0.00 C ATOM 1395 NH1 ARG C 51 85.517 6.288 -38.237 1.00 0.00 N ATOM 1396 NH2 ARG C 51 85.482 5.971 -35.999 1.00 0.00 N ATOM 0 H ARG C 51 92.502 6.228 -36.601 1.00 0.00 H new ATOM 0 HA ARG C 51 91.835 5.096 -39.073 1.00 0.00 H new ATOM 0 HB2 ARG C 51 90.885 4.552 -36.771 1.00 0.00 H new ATOM 0 HB3 ARG C 51 89.946 6.029 -36.860 1.00 0.00 H new ATOM 0 HG2 ARG C 51 89.709 4.235 -39.262 1.00 0.00 H new ATOM 0 HG3 ARG C 51 89.048 3.573 -37.780 1.00 0.00 H new ATOM 0 HD2 ARG C 51 88.359 6.382 -38.768 1.00 0.00 H new ATOM 0 HD3 ARG C 51 87.423 4.972 -39.220 1.00 0.00 H new ATOM 0 HE ARG C 51 87.795 5.164 -36.321 1.00 0.00 H new ATOM 0 HH11 ARG C 51 86.010 6.238 -39.129 1.00 0.00 H new ATOM 0 HH12 ARG C 51 84.559 6.636 -38.202 1.00 0.00 H new ATOM 0 HH21 ARG C 51 85.947 5.673 -35.142 1.00 0.00 H new ATOM 0 HH22 ARG C 51 84.524 6.319 -35.965 1.00 0.00 H new ATOM 1410 N GLY C 52 90.654 6.730 -40.483 1.00 0.00 N ATOM 1411 CA GLY C 52 90.065 7.724 -41.373 1.00 0.00 C ATOM 1412 C GLY C 52 90.855 9.027 -41.333 1.00 0.00 C ATOM 0 H GLY C 52 90.897 5.847 -40.933 1.00 0.00 H new ATOM 0 HA2 GLY C 52 90.044 7.338 -42.392 1.00 0.00 H new ATOM 0 HA3 GLY C 52 89.032 7.912 -41.082 1.00 0.00 H new TER 1416 GLY C 52 ATOM 1417 N SER D 23 84.409 -3.955 10.340 1.00 0.00 N ATOM 1418 CA SER D 23 84.880 -3.097 9.216 1.00 0.00 C ATOM 1419 C SER D 23 86.122 -3.719 8.588 1.00 0.00 C ATOM 1420 O SER D 23 87.170 -3.818 9.227 1.00 0.00 O ATOM 1421 CB SER D 23 85.210 -1.701 9.747 1.00 0.00 C ATOM 1422 OG SER D 23 85.595 -0.865 8.663 1.00 0.00 O ATOM 0 HA SER D 23 84.098 -3.019 8.461 1.00 0.00 H new ATOM 0 HB2 SER D 23 84.344 -1.279 10.257 1.00 0.00 H new ATOM 0 HB3 SER D 23 86.014 -1.759 10.480 1.00 0.00 H new ATOM 0 HG SER D 23 85.806 0.031 9.000 1.00 0.00 H new ATOM 1427 N ASP D 24 86.002 -4.127 7.350 1.00 0.00 N ATOM 1428 CA ASP D 24 87.120 -4.738 6.631 1.00 0.00 C ATOM 1429 C ASP D 24 87.876 -3.664 5.831 1.00 0.00 C ATOM 1430 O ASP D 24 87.239 -2.898 5.117 1.00 0.00 O ATOM 1431 CB ASP D 24 86.586 -5.797 5.663 1.00 0.00 C ATOM 1432 CG ASP D 24 87.745 -6.568 5.040 1.00 0.00 C ATOM 1433 OD1 ASP D 24 88.607 -5.933 4.454 1.00 0.00 O ATOM 1434 OD2 ASP D 24 87.754 -7.782 5.157 1.00 0.00 O ATOM 0 H ASP D 24 85.142 -4.052 6.806 1.00 0.00 H new ATOM 0 HA ASP D 24 87.796 -5.200 7.350 1.00 0.00 H new ATOM 0 HB2 ASP D 24 85.924 -6.483 6.191 1.00 0.00 H new ATOM 0 HB3 ASP D 24 85.993 -5.321 4.882 1.00 0.00 H new ATOM 1439 N PRO D 25 89.196 -3.579 5.921 1.00 0.00 N ATOM 1440 CA PRO D 25 89.991 -2.558 5.155 1.00 0.00 C ATOM 1441 C PRO D 25 89.564 -2.426 3.684 1.00 0.00 C ATOM 1442 O PRO D 25 90.260 -2.887 2.780 1.00 0.00 O ATOM 1443 CB PRO D 25 91.431 -3.078 5.261 1.00 0.00 C ATOM 1444 CG PRO D 25 91.479 -3.830 6.550 1.00 0.00 C ATOM 1445 CD PRO D 25 90.079 -4.420 6.762 1.00 0.00 C ATOM 0 HA PRO D 25 89.849 -1.557 5.562 1.00 0.00 H new ATOM 0 HB2 PRO D 25 91.680 -3.723 4.419 1.00 0.00 H new ATOM 0 HB3 PRO D 25 92.148 -2.257 5.257 1.00 0.00 H new ATOM 0 HG2 PRO D 25 92.231 -4.619 6.511 1.00 0.00 H new ATOM 0 HG3 PRO D 25 91.751 -3.170 7.374 1.00 0.00 H new ATOM 0 HD2 PRO D 25 90.038 -5.466 6.459 1.00 0.00 H new ATOM 0 HD3 PRO D 25 89.785 -4.380 7.811 1.00 0.00 H new ATOM 1453 N LEU D 26 88.442 -1.802 3.460 1.00 0.00 N ATOM 1454 CA LEU D 26 87.937 -1.609 2.104 1.00 0.00 C ATOM 1455 C LEU D 26 88.810 -0.597 1.359 1.00 0.00 C ATOM 1456 O LEU D 26 89.116 -0.771 0.180 1.00 0.00 O ATOM 1457 CB LEU D 26 86.470 -1.108 2.165 1.00 0.00 C ATOM 1458 CG LEU D 26 85.486 -2.243 1.839 1.00 0.00 C ATOM 1459 CD1 LEU D 26 85.529 -3.298 2.945 1.00 0.00 C ATOM 1460 CD2 LEU D 26 84.070 -1.671 1.740 1.00 0.00 C ATOM 0 H LEU D 26 87.849 -1.412 4.192 1.00 0.00 H new ATOM 0 HA LEU D 26 87.969 -2.558 1.568 1.00 0.00 H new ATOM 0 HB2 LEU D 26 86.258 -0.712 3.158 1.00 0.00 H new ATOM 0 HB3 LEU D 26 86.332 -0.289 1.460 1.00 0.00 H new ATOM 0 HG LEU D 26 85.766 -2.703 0.891 1.00 0.00 H new ATOM 0 HD11 LEU D 26 84.830 -4.101 2.710 1.00 0.00 H new ATOM 0 HD12 LEU D 26 86.537 -3.705 3.020 1.00 0.00 H new ATOM 0 HD13 LEU D 26 85.251 -2.841 3.895 1.00 0.00 H new ATOM 0 HD21 LEU D 26 83.369 -2.473 1.509 1.00 0.00 H new ATOM 0 HD22 LEU D 26 83.796 -1.212 2.690 1.00 0.00 H new ATOM 0 HD23 LEU D 26 84.035 -0.920 0.951 1.00 0.00 H new ATOM 1472 N VAL D 27 89.171 0.452 2.042 1.00 0.00 N ATOM 1473 CA VAL D 27 89.977 1.512 1.447 1.00 0.00 C ATOM 1474 C VAL D 27 91.318 1.000 0.919 1.00 0.00 C ATOM 1475 O VAL D 27 91.677 1.278 -0.223 1.00 0.00 O ATOM 1476 CB VAL D 27 90.225 2.607 2.491 1.00 0.00 C ATOM 1477 CG1 VAL D 27 91.089 3.722 1.893 1.00 0.00 C ATOM 1478 CG2 VAL D 27 88.883 3.194 2.934 1.00 0.00 C ATOM 0 H VAL D 27 88.924 0.608 3.019 1.00 0.00 H new ATOM 0 HA VAL D 27 89.422 1.909 0.597 1.00 0.00 H new ATOM 0 HB VAL D 27 90.744 2.173 3.346 1.00 0.00 H new ATOM 0 HG11 VAL D 27 91.258 4.494 2.644 1.00 0.00 H new ATOM 0 HG12 VAL D 27 92.046 3.309 1.575 1.00 0.00 H new ATOM 0 HG13 VAL D 27 90.578 4.157 1.034 1.00 0.00 H new ATOM 0 HG21 VAL D 27 89.054 3.973 3.677 1.00 0.00 H new ATOM 0 HG22 VAL D 27 88.370 3.621 2.072 1.00 0.00 H new ATOM 0 HG23 VAL D 27 88.268 2.407 3.369 1.00 0.00 H new ATOM 1488 N VAL D 28 92.049 0.272 1.723 1.00 0.00 N ATOM 1489 CA VAL D 28 93.349 -0.259 1.310 1.00 0.00 C ATOM 1490 C VAL D 28 93.222 -1.414 0.311 1.00 0.00 C ATOM 1491 O VAL D 28 94.147 -1.685 -0.455 1.00 0.00 O ATOM 1492 CB VAL D 28 94.146 -0.708 2.551 1.00 0.00 C ATOM 1493 CG1 VAL D 28 93.699 -2.104 2.999 1.00 0.00 C ATOM 1494 CG2 VAL D 28 95.644 -0.739 2.222 1.00 0.00 C ATOM 0 H VAL D 28 91.776 0.025 2.674 1.00 0.00 H new ATOM 0 HA VAL D 28 93.882 0.542 0.799 1.00 0.00 H new ATOM 0 HB VAL D 28 93.960 0.001 3.357 1.00 0.00 H new ATOM 0 HG11 VAL D 28 94.272 -2.405 3.876 1.00 0.00 H new ATOM 0 HG12 VAL D 28 92.638 -2.084 3.248 1.00 0.00 H new ATOM 0 HG13 VAL D 28 93.869 -2.817 2.192 1.00 0.00 H new ATOM 0 HG21 VAL D 28 96.203 -1.057 3.102 1.00 0.00 H new ATOM 0 HG22 VAL D 28 95.823 -1.439 1.406 1.00 0.00 H new ATOM 0 HG23 VAL D 28 95.972 0.257 1.924 1.00 0.00 H new ATOM 1504 N ALA D 29 92.110 -2.093 0.345 1.00 0.00 N ATOM 1505 CA ALA D 29 91.900 -3.235 -0.544 1.00 0.00 C ATOM 1506 C ALA D 29 91.727 -2.800 -1.999 1.00 0.00 C ATOM 1507 O ALA D 29 92.402 -3.311 -2.892 1.00 0.00 O ATOM 1508 CB ALA D 29 90.661 -4.014 -0.100 1.00 0.00 C ATOM 0 H ALA D 29 91.330 -1.889 0.970 1.00 0.00 H new ATOM 0 HA ALA D 29 92.786 -3.867 -0.483 1.00 0.00 H new ATOM 0 HB1 ALA D 29 90.508 -4.864 -0.765 1.00 0.00 H new ATOM 0 HB2 ALA D 29 90.802 -4.372 0.920 1.00 0.00 H new ATOM 0 HB3 ALA D 29 89.788 -3.362 -0.138 1.00 0.00 H new ATOM 1514 N ALA D 30 90.833 -1.878 -2.228 1.00 0.00 N ATOM 1515 CA ALA D 30 90.581 -1.394 -3.575 1.00 0.00 C ATOM 1516 C ALA D 30 91.739 -0.532 -4.066 1.00 0.00 C ATOM 1517 O ALA D 30 91.992 -0.431 -5.266 1.00 0.00 O ATOM 1518 CB ALA D 30 89.269 -0.624 -3.608 1.00 0.00 C ATOM 0 H ALA D 30 90.262 -1.441 -1.505 1.00 0.00 H new ATOM 0 HA ALA D 30 90.499 -2.247 -4.249 1.00 0.00 H new ATOM 0 HB1 ALA D 30 89.084 -0.263 -4.620 1.00 0.00 H new ATOM 0 HB2 ALA D 30 88.454 -1.280 -3.302 1.00 0.00 H new ATOM 0 HB3 ALA D 30 89.327 0.224 -2.925 1.00 0.00 H new ATOM 1524 N SER D 31 92.429 0.069 -3.137 1.00 0.00 N ATOM 1525 CA SER D 31 93.569 0.919 -3.456 1.00 0.00 C ATOM 1526 C SER D 31 94.731 0.114 -4.048 1.00 0.00 C ATOM 1527 O SER D 31 95.359 0.541 -5.016 1.00 0.00 O ATOM 1528 CB SER D 31 94.048 1.618 -2.187 1.00 0.00 C ATOM 1529 OG SER D 31 95.088 2.529 -2.514 1.00 0.00 O ATOM 0 H SER D 31 92.228 -0.008 -2.140 1.00 0.00 H new ATOM 0 HA SER D 31 93.245 1.647 -4.199 1.00 0.00 H new ATOM 0 HB2 SER D 31 93.220 2.148 -1.716 1.00 0.00 H new ATOM 0 HB3 SER D 31 94.407 0.883 -1.467 1.00 0.00 H new ATOM 0 HG SER D 31 95.396 2.980 -1.700 1.00 0.00 H new ATOM 1535 N ILE D 32 95.025 -1.017 -3.457 1.00 0.00 N ATOM 1536 CA ILE D 32 96.128 -1.876 -3.893 1.00 0.00 C ATOM 1537 C ILE D 32 96.049 -2.252 -5.380 1.00 0.00 C ATOM 1538 O ILE D 32 97.067 -2.546 -5.998 1.00 0.00 O ATOM 1539 CB ILE D 32 96.149 -3.147 -2.996 1.00 0.00 C ATOM 1540 CG1 ILE D 32 97.596 -3.586 -2.689 1.00 0.00 C ATOM 1541 CG2 ILE D 32 95.392 -4.311 -3.655 1.00 0.00 C ATOM 1542 CD1 ILE D 32 98.382 -3.826 -3.982 1.00 0.00 C ATOM 0 H ILE D 32 94.511 -1.381 -2.655 1.00 0.00 H new ATOM 0 HA ILE D 32 97.058 -1.318 -3.783 1.00 0.00 H new ATOM 0 HB ILE D 32 95.649 -2.887 -2.063 1.00 0.00 H new ATOM 0 HG12 ILE D 32 98.094 -2.821 -2.093 1.00 0.00 H new ATOM 0 HG13 ILE D 32 97.584 -4.498 -2.091 1.00 0.00 H new ATOM 0 HG21 ILE D 32 95.426 -5.183 -3.002 1.00 0.00 H new ATOM 0 HG22 ILE D 32 94.354 -4.022 -3.821 1.00 0.00 H new ATOM 0 HG23 ILE D 32 95.858 -4.554 -4.610 1.00 0.00 H new ATOM 0 HD11 ILE D 32 99.399 -4.134 -3.738 1.00 0.00 H new ATOM 0 HD12 ILE D 32 97.895 -4.609 -4.564 1.00 0.00 H new ATOM 0 HD13 ILE D 32 98.412 -2.906 -4.566 1.00 0.00 H new ATOM 1554 N ILE D 33 94.882 -2.250 -5.951 1.00 0.00 N ATOM 1555 CA ILE D 33 94.765 -2.609 -7.360 1.00 0.00 C ATOM 1556 C ILE D 33 95.371 -1.529 -8.253 1.00 0.00 C ATOM 1557 O ILE D 33 95.817 -1.818 -9.364 1.00 0.00 O ATOM 1558 CB ILE D 33 93.295 -2.830 -7.733 1.00 0.00 C ATOM 1559 CG1 ILE D 33 92.699 -3.895 -6.805 1.00 0.00 C ATOM 1560 CG2 ILE D 33 93.201 -3.308 -9.189 1.00 0.00 C ATOM 1561 CD1 ILE D 33 91.220 -4.103 -7.136 1.00 0.00 C ATOM 0 H ILE D 33 94.005 -2.011 -5.487 1.00 0.00 H new ATOM 0 HA ILE D 33 95.317 -3.536 -7.518 1.00 0.00 H new ATOM 0 HB ILE D 33 92.743 -1.896 -7.625 1.00 0.00 H new ATOM 0 HG12 ILE D 33 93.242 -4.834 -6.918 1.00 0.00 H new ATOM 0 HG13 ILE D 33 92.808 -3.587 -5.765 1.00 0.00 H new ATOM 0 HG21 ILE D 33 92.155 -3.465 -9.454 1.00 0.00 H new ATOM 0 HG22 ILE D 33 93.633 -2.555 -9.848 1.00 0.00 H new ATOM 0 HG23 ILE D 33 93.748 -4.244 -9.301 1.00 0.00 H new ATOM 0 HD11 ILE D 33 90.802 -4.861 -6.473 1.00 0.00 H new ATOM 0 HD12 ILE D 33 90.681 -3.165 -7.000 1.00 0.00 H new ATOM 0 HD13 ILE D 33 91.121 -4.431 -8.171 1.00 0.00 H new ATOM 1573 N GLY D 34 95.335 -0.302 -7.807 1.00 0.00 N ATOM 1574 CA GLY D 34 95.826 0.814 -8.609 1.00 0.00 C ATOM 1575 C GLY D 34 97.197 0.565 -9.239 1.00 0.00 C ATOM 1576 O GLY D 34 97.398 0.881 -10.412 1.00 0.00 O ATOM 0 H GLY D 34 94.972 -0.037 -6.891 1.00 0.00 H new ATOM 0 HA2 GLY D 34 95.106 1.025 -9.400 1.00 0.00 H new ATOM 0 HA3 GLY D 34 95.881 1.704 -7.982 1.00 0.00 H new ATOM 1580 N ILE D 35 98.128 0.035 -8.497 1.00 0.00 N ATOM 1581 CA ILE D 35 99.459 -0.201 -9.058 1.00 0.00 C ATOM 1582 C ILE D 35 99.408 -1.239 -10.178 1.00 0.00 C ATOM 1583 O ILE D 35 100.218 -1.201 -11.104 1.00 0.00 O ATOM 1584 CB ILE D 35 100.443 -0.649 -7.970 1.00 0.00 C ATOM 1585 CG1 ILE D 35 99.927 -1.909 -7.269 1.00 0.00 C ATOM 1586 CG2 ILE D 35 100.604 0.470 -6.939 1.00 0.00 C ATOM 1587 CD1 ILE D 35 101.061 -2.534 -6.454 1.00 0.00 C ATOM 0 H ILE D 35 98.011 -0.242 -7.522 1.00 0.00 H new ATOM 0 HA ILE D 35 99.810 0.742 -9.477 1.00 0.00 H new ATOM 0 HB ILE D 35 101.404 -0.870 -8.435 1.00 0.00 H new ATOM 0 HG12 ILE D 35 99.090 -1.659 -6.617 1.00 0.00 H new ATOM 0 HG13 ILE D 35 99.556 -2.623 -8.005 1.00 0.00 H new ATOM 0 HG21 ILE D 35 101.303 0.154 -6.165 1.00 0.00 H new ATOM 0 HG22 ILE D 35 100.987 1.365 -7.430 1.00 0.00 H new ATOM 0 HG23 ILE D 35 99.637 0.690 -6.487 1.00 0.00 H new ATOM 0 HD11 ILE D 35 100.697 -3.431 -5.953 1.00 0.00 H new ATOM 0 HD12 ILE D 35 101.884 -2.797 -7.118 1.00 0.00 H new ATOM 0 HD13 ILE D 35 101.410 -1.819 -5.709 1.00 0.00 H new ATOM 1599 N LEU D 36 98.475 -2.147 -10.091 1.00 0.00 N ATOM 1600 CA LEU D 36 98.341 -3.187 -11.107 1.00 0.00 C ATOM 1601 C LEU D 36 98.063 -2.564 -12.475 1.00 0.00 C ATOM 1602 O LEU D 36 98.725 -2.882 -13.463 1.00 0.00 O ATOM 1603 CB LEU D 36 97.186 -4.123 -10.725 1.00 0.00 C ATOM 1604 CG LEU D 36 97.191 -5.382 -11.618 1.00 0.00 C ATOM 1605 CD1 LEU D 36 98.183 -6.420 -11.072 1.00 0.00 C ATOM 1606 CD2 LEU D 36 95.784 -5.998 -11.645 1.00 0.00 C ATOM 0 H LEU D 36 97.792 -2.199 -9.335 1.00 0.00 H new ATOM 0 HA LEU D 36 99.272 -3.751 -11.162 1.00 0.00 H new ATOM 0 HB2 LEU D 36 97.276 -4.412 -9.678 1.00 0.00 H new ATOM 0 HB3 LEU D 36 96.236 -3.599 -10.830 1.00 0.00 H new ATOM 0 HG LEU D 36 97.492 -5.095 -12.626 1.00 0.00 H new ATOM 0 HD11 LEU D 36 98.175 -7.302 -11.712 1.00 0.00 H new ATOM 0 HD12 LEU D 36 99.185 -5.992 -11.056 1.00 0.00 H new ATOM 0 HD13 LEU D 36 97.893 -6.703 -10.060 1.00 0.00 H new ATOM 0 HD21 LEU D 36 95.788 -6.887 -12.276 1.00 0.00 H new ATOM 0 HD22 LEU D 36 95.488 -6.273 -10.633 1.00 0.00 H new ATOM 0 HD23 LEU D 36 95.077 -5.272 -12.046 1.00 0.00 H new ATOM 1618 N HIS D 37 97.086 -1.701 -12.517 1.00 0.00 N ATOM 1619 CA HIS D 37 96.715 -1.050 -13.771 1.00 0.00 C ATOM 1620 C HIS D 37 97.817 -0.106 -14.248 1.00 0.00 C ATOM 1621 O HIS D 37 97.998 0.088 -15.448 1.00 0.00 O ATOM 1622 CB HIS D 37 95.378 -0.300 -13.633 1.00 0.00 C ATOM 1623 CG HIS D 37 95.541 1.007 -12.891 1.00 0.00 C ATOM 1624 ND1 HIS D 37 96.541 1.926 -13.183 1.00 0.00 N ATOM 1625 CD2 HIS D 37 94.808 1.570 -11.877 1.00 0.00 C ATOM 1626 CE1 HIS D 37 96.381 2.977 -12.359 1.00 0.00 C ATOM 1627 NE2 HIS D 37 95.339 2.812 -11.543 1.00 0.00 N ATOM 0 H HIS D 37 96.527 -1.424 -11.710 1.00 0.00 H new ATOM 0 HA HIS D 37 96.589 -1.830 -14.522 1.00 0.00 H new ATOM 0 HB2 HIS D 37 94.966 -0.107 -14.623 1.00 0.00 H new ATOM 0 HB3 HIS D 37 94.661 -0.930 -13.107 1.00 0.00 H new ATOM 0 HD2 HIS D 37 93.947 1.117 -11.408 1.00 0.00 H new ATOM 0 HE1 HIS D 37 97.019 3.849 -12.358 1.00 0.00 H new ATOM 0 HE2 HIS D 37 95.004 3.457 -10.828 1.00 0.00 H new ATOM 1636 N PHE D 38 98.530 0.475 -13.321 1.00 0.00 N ATOM 1637 CA PHE D 38 99.602 1.409 -13.664 1.00 0.00 C ATOM 1638 C PHE D 38 100.763 0.705 -14.369 1.00 0.00 C ATOM 1639 O PHE D 38 101.229 1.157 -15.414 1.00 0.00 O ATOM 1640 CB PHE D 38 100.116 2.095 -12.398 1.00 0.00 C ATOM 1641 CG PHE D 38 101.218 3.060 -12.761 1.00 0.00 C ATOM 1642 CD1 PHE D 38 102.546 2.619 -12.807 1.00 0.00 C ATOM 1643 CD2 PHE D 38 100.913 4.396 -13.052 1.00 0.00 C ATOM 1644 CE1 PHE D 38 103.569 3.513 -13.145 1.00 0.00 C ATOM 1645 CE2 PHE D 38 101.937 5.290 -13.389 1.00 0.00 C ATOM 1646 CZ PHE D 38 103.264 4.848 -13.436 1.00 0.00 C ATOM 0 H PHE D 38 98.399 0.327 -12.320 1.00 0.00 H new ATOM 0 HA PHE D 38 99.190 2.149 -14.349 1.00 0.00 H new ATOM 0 HB2 PHE D 38 99.302 2.625 -11.903 1.00 0.00 H new ATOM 0 HB3 PHE D 38 100.487 1.351 -11.693 1.00 0.00 H new ATOM 0 HD1 PHE D 38 102.781 1.589 -12.582 1.00 0.00 H new ATOM 0 HD2 PHE D 38 99.889 4.736 -13.016 1.00 0.00 H new ATOM 0 HE1 PHE D 38 104.593 3.173 -13.181 1.00 0.00 H new ATOM 0 HE2 PHE D 38 101.703 6.320 -13.613 1.00 0.00 H new ATOM 0 HZ PHE D 38 104.053 5.537 -13.697 1.00 0.00 H new ATOM 1656 N ILE D 39 101.226 -0.373 -13.799 1.00 0.00 N ATOM 1657 CA ILE D 39 102.343 -1.117 -14.378 1.00 0.00 C ATOM 1658 C ILE D 39 101.975 -1.694 -15.743 1.00 0.00 C ATOM 1659 O ILE D 39 102.788 -1.695 -16.668 1.00 0.00 O ATOM 1660 CB ILE D 39 102.756 -2.251 -13.441 1.00 0.00 C ATOM 1661 CG1 ILE D 39 103.199 -1.666 -12.099 1.00 0.00 C ATOM 1662 CG2 ILE D 39 103.916 -3.029 -14.064 1.00 0.00 C ATOM 1663 CD1 ILE D 39 103.326 -2.790 -11.069 1.00 0.00 C ATOM 0 H ILE D 39 100.857 -0.767 -12.934 1.00 0.00 H new ATOM 0 HA ILE D 39 103.175 -0.425 -14.509 1.00 0.00 H new ATOM 0 HB ILE D 39 101.910 -2.921 -13.285 1.00 0.00 H new ATOM 0 HG12 ILE D 39 104.154 -1.152 -12.212 1.00 0.00 H new ATOM 0 HG13 ILE D 39 102.476 -0.925 -11.757 1.00 0.00 H new ATOM 0 HG21 ILE D 39 104.212 -3.838 -13.396 1.00 0.00 H new ATOM 0 HG22 ILE D 39 103.603 -3.445 -15.022 1.00 0.00 H new ATOM 0 HG23 ILE D 39 104.762 -2.359 -14.219 1.00 0.00 H new ATOM 0 HD11 ILE D 39 103.642 -2.373 -10.113 1.00 0.00 H new ATOM 0 HD12 ILE D 39 102.362 -3.284 -10.949 1.00 0.00 H new ATOM 0 HD13 ILE D 39 104.065 -3.515 -11.411 1.00 0.00 H new ATOM 1675 N ALA D 40 100.769 -2.171 -15.857 1.00 0.00 N ATOM 1676 CA ALA D 40 100.293 -2.747 -17.107 1.00 0.00 C ATOM 1677 C ALA D 40 100.100 -1.665 -18.156 1.00 0.00 C ATOM 1678 O ALA D 40 100.164 -1.931 -19.342 1.00 0.00 O ATOM 1679 CB ALA D 40 98.978 -3.490 -16.870 1.00 0.00 C ATOM 0 H ALA D 40 100.084 -2.178 -15.101 1.00 0.00 H new ATOM 0 HA ALA D 40 101.041 -3.451 -17.473 1.00 0.00 H new ATOM 0 HB1 ALA D 40 98.628 -3.918 -17.809 1.00 0.00 H new ATOM 0 HB2 ALA D 40 99.136 -4.288 -16.144 1.00 0.00 H new ATOM 0 HB3 ALA D 40 98.231 -2.795 -16.487 1.00 0.00 H new ATOM 1685 N TRP D 41 99.829 -0.478 -17.717 1.00 0.00 N ATOM 1686 CA TRP D 41 99.596 0.637 -18.627 1.00 0.00 C ATOM 1687 C TRP D 41 100.794 0.895 -19.547 1.00 0.00 C ATOM 1688 O TRP D 41 100.632 1.144 -20.742 1.00 0.00 O ATOM 1689 CB TRP D 41 99.328 1.888 -17.790 1.00 0.00 C ATOM 1690 CG TRP D 41 98.867 3.011 -18.658 1.00 0.00 C ATOM 1691 CD1 TRP D 41 99.593 3.601 -19.638 1.00 0.00 C ATOM 1692 CD2 TRP D 41 97.592 3.707 -18.615 1.00 0.00 C ATOM 1693 NE1 TRP D 41 98.825 4.590 -20.222 1.00 0.00 N ATOM 1694 CE2 TRP D 41 97.587 4.696 -19.623 1.00 0.00 C ATOM 1695 CE3 TRP D 41 96.446 3.570 -17.813 1.00 0.00 C ATOM 1696 CZ2 TRP D 41 96.486 5.518 -19.829 1.00 0.00 C ATOM 1697 CZ3 TRP D 41 95.336 4.406 -18.013 1.00 0.00 C ATOM 1698 CH2 TRP D 41 95.356 5.377 -19.022 1.00 0.00 C ATOM 0 H TRP D 41 99.759 -0.238 -16.728 1.00 0.00 H new ATOM 0 HA TRP D 41 98.745 0.391 -19.262 1.00 0.00 H new ATOM 0 HB2 TRP D 41 98.573 1.672 -17.034 1.00 0.00 H new ATOM 0 HB3 TRP D 41 100.235 2.179 -17.260 1.00 0.00 H new ATOM 0 HD1 TRP D 41 100.604 3.341 -19.916 1.00 0.00 H new ATOM 0 HE1 TRP D 41 99.136 5.171 -21.001 1.00 0.00 H new ATOM 0 HE3 TRP D 41 96.419 2.818 -17.039 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 96.504 6.263 -20.611 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 94.463 4.300 -17.386 1.00 0.00 H new ATOM 0 HH2 TRP D 41 94.499 6.016 -19.175 1.00 0.00 H new ATOM 1709 N THR D 42 101.961 0.902 -18.973 1.00 0.00 N ATOM 1710 CA THR D 42 103.191 1.214 -19.705 1.00 0.00 C ATOM 1711 C THR D 42 103.342 0.468 -21.037 1.00 0.00 C ATOM 1712 O THR D 42 103.865 1.038 -21.994 1.00 0.00 O ATOM 1713 CB THR D 42 104.399 0.900 -18.819 1.00 0.00 C ATOM 1714 OG1 THR D 42 104.385 -0.478 -18.477 1.00 0.00 O ATOM 1715 CG2 THR D 42 104.337 1.746 -17.544 1.00 0.00 C ATOM 0 H THR D 42 102.106 0.694 -17.985 1.00 0.00 H new ATOM 0 HA THR D 42 103.135 2.274 -19.952 1.00 0.00 H new ATOM 0 HB THR D 42 105.316 1.133 -19.360 1.00 0.00 H new ATOM 0 HG1 THR D 42 103.705 -0.638 -17.790 1.00 0.00 H new ATOM 0 HG21 THR D 42 105.198 1.520 -16.915 1.00 0.00 H new ATOM 0 HG22 THR D 42 104.348 2.803 -17.808 1.00 0.00 H new ATOM 0 HG23 THR D 42 103.421 1.517 -17.000 1.00 0.00 H new ATOM 1723 N ILE D 43 102.931 -0.767 -21.120 1.00 0.00 N ATOM 1724 CA ILE D 43 103.092 -1.495 -22.384 1.00 0.00 C ATOM 1725 C ILE D 43 102.358 -0.783 -23.534 1.00 0.00 C ATOM 1726 O ILE D 43 102.749 -0.910 -24.692 1.00 0.00 O ATOM 1727 CB ILE D 43 102.660 -2.983 -22.248 1.00 0.00 C ATOM 1728 CG1 ILE D 43 101.213 -3.228 -22.745 1.00 0.00 C ATOM 1729 CG2 ILE D 43 102.779 -3.422 -20.787 1.00 0.00 C ATOM 1730 CD1 ILE D 43 100.197 -2.305 -22.052 1.00 0.00 C ATOM 0 H ILE D 43 102.493 -1.292 -20.363 1.00 0.00 H new ATOM 0 HA ILE D 43 104.154 -1.498 -22.631 1.00 0.00 H new ATOM 0 HB ILE D 43 103.326 -3.572 -22.878 1.00 0.00 H new ATOM 0 HG12 ILE D 43 101.169 -3.070 -23.823 1.00 0.00 H new ATOM 0 HG13 ILE D 43 100.940 -4.267 -22.564 1.00 0.00 H new ATOM 0 HG21 ILE D 43 102.476 -4.465 -20.695 1.00 0.00 H new ATOM 0 HG22 ILE D 43 103.812 -3.314 -20.458 1.00 0.00 H new ATOM 0 HG23 ILE D 43 102.134 -2.800 -20.167 1.00 0.00 H new ATOM 0 HD11 ILE D 43 99.197 -2.514 -22.433 1.00 0.00 H new ATOM 0 HD12 ILE D 43 100.220 -2.481 -20.977 1.00 0.00 H new ATOM 0 HD13 ILE D 43 100.453 -1.265 -22.255 1.00 0.00 H new ATOM 1742 N GLY D 44 101.317 -0.054 -23.219 1.00 0.00 N ATOM 1743 CA GLY D 44 100.547 0.650 -24.249 1.00 0.00 C ATOM 1744 C GLY D 44 101.470 1.407 -25.200 1.00 0.00 C ATOM 1745 O GLY D 44 101.287 1.368 -26.417 1.00 0.00 O ATOM 0 H GLY D 44 100.974 0.076 -22.267 1.00 0.00 H new ATOM 0 HA2 GLY D 44 99.947 -0.065 -24.812 1.00 0.00 H new ATOM 0 HA3 GLY D 44 99.854 1.347 -23.777 1.00 0.00 H new ATOM 1749 N HIS D 45 102.401 2.131 -24.650 1.00 0.00 N ATOM 1750 CA HIS D 45 103.295 2.949 -25.406 1.00 0.00 C ATOM 1751 C HIS D 45 103.786 2.281 -26.695 1.00 0.00 C ATOM 1752 O HIS D 45 104.165 2.969 -27.641 1.00 0.00 O ATOM 1753 CB HIS D 45 104.466 3.267 -24.501 1.00 0.00 C ATOM 1754 CG HIS D 45 103.998 4.101 -23.338 1.00 0.00 C ATOM 1755 ND1 HIS D 45 104.198 3.712 -22.021 1.00 0.00 N ATOM 1756 CD2 HIS D 45 103.346 5.309 -23.275 1.00 0.00 C ATOM 1757 CE1 HIS D 45 103.676 4.669 -21.231 1.00 0.00 C ATOM 1758 NE2 HIS D 45 103.145 5.666 -21.944 1.00 0.00 N ATOM 0 H HIS D 45 102.561 2.168 -23.643 1.00 0.00 H new ATOM 0 HA HIS D 45 102.768 3.847 -25.728 1.00 0.00 H new ATOM 0 HB2 HIS D 45 104.920 2.344 -24.140 1.00 0.00 H new ATOM 0 HB3 HIS D 45 105.234 3.803 -25.059 1.00 0.00 H new ATOM 0 HD1 HIS D 45 104.657 2.856 -21.708 1.00 0.00 H new ATOM 0 HD2 HIS D 45 103.036 5.893 -24.129 1.00 0.00 H new ATOM 0 HE1 HIS D 45 103.685 4.635 -20.152 1.00 0.00 H new ATOM 1767 N LEU D 46 103.738 0.984 -26.759 1.00 0.00 N ATOM 1768 CA LEU D 46 104.148 0.319 -27.996 1.00 0.00 C ATOM 1769 C LEU D 46 103.337 0.915 -29.168 1.00 0.00 C ATOM 1770 O LEU D 46 103.875 1.214 -30.234 1.00 0.00 O ATOM 1771 CB LEU D 46 103.971 -1.217 -27.888 1.00 0.00 C ATOM 1772 CG LEU D 46 102.475 -1.640 -27.923 1.00 0.00 C ATOM 1773 CD1 LEU D 46 102.001 -1.879 -29.380 1.00 0.00 C ATOM 1774 CD2 LEU D 46 102.284 -2.940 -27.107 1.00 0.00 C ATOM 0 H LEU D 46 103.432 0.367 -26.006 1.00 0.00 H new ATOM 0 HA LEU D 46 105.209 0.493 -28.177 1.00 0.00 H new ATOM 0 HB2 LEU D 46 104.503 -1.701 -28.707 1.00 0.00 H new ATOM 0 HB3 LEU D 46 104.425 -1.569 -26.962 1.00 0.00 H new ATOM 0 HG LEU D 46 101.882 -0.835 -27.489 1.00 0.00 H new ATOM 0 HD11 LEU D 46 100.952 -2.174 -29.377 1.00 0.00 H new ATOM 0 HD12 LEU D 46 102.119 -0.961 -29.956 1.00 0.00 H new ATOM 0 HD13 LEU D 46 102.599 -2.670 -29.832 1.00 0.00 H new ATOM 0 HD21 LEU D 46 101.235 -3.235 -27.133 1.00 0.00 H new ATOM 0 HD22 LEU D 46 102.895 -3.733 -27.538 1.00 0.00 H new ATOM 0 HD23 LEU D 46 102.588 -2.769 -26.074 1.00 0.00 H new ATOM 1786 N ASN D 47 102.053 1.015 -28.953 1.00 0.00 N ATOM 1787 CA ASN D 47 101.117 1.504 -29.974 1.00 0.00 C ATOM 1788 C ASN D 47 101.605 2.790 -30.654 1.00 0.00 C ATOM 1789 O ASN D 47 101.508 2.921 -31.873 1.00 0.00 O ATOM 1790 CB ASN D 47 99.753 1.779 -29.339 1.00 0.00 C ATOM 1791 CG ASN D 47 99.199 0.512 -28.699 1.00 0.00 C ATOM 1792 OD1 ASN D 47 98.891 -0.454 -29.396 1.00 0.00 O ATOM 1793 ND2 ASN D 47 99.049 0.460 -27.404 1.00 0.00 N ATOM 0 H ASN D 47 101.609 0.764 -28.070 1.00 0.00 H new ATOM 0 HA ASN D 47 101.045 0.725 -30.733 1.00 0.00 H new ATOM 0 HB2 ASN D 47 99.846 2.563 -28.587 1.00 0.00 H new ATOM 0 HB3 ASN D 47 99.059 2.145 -30.096 1.00 0.00 H new ATOM 0 HD21 ASN D 47 98.676 -0.383 -26.967 1.00 0.00 H new ATOM 0 HD22 ASN D 47 99.305 1.262 -26.828 1.00 0.00 H new ATOM 1800 N GLN D 48 102.107 3.721 -29.891 1.00 0.00 N ATOM 1801 CA GLN D 48 102.588 4.988 -30.456 1.00 0.00 C ATOM 1802 C GLN D 48 103.984 4.809 -31.059 1.00 0.00 C ATOM 1803 O GLN D 48 104.221 5.176 -32.210 1.00 0.00 O ATOM 1804 CB GLN D 48 102.601 6.113 -29.380 1.00 0.00 C ATOM 1805 CG GLN D 48 102.053 5.583 -28.054 1.00 0.00 C ATOM 1806 CD GLN D 48 100.625 5.081 -28.237 1.00 0.00 C ATOM 1807 OE1 GLN D 48 100.123 5.037 -29.360 1.00 0.00 O ATOM 1808 NE2 GLN D 48 99.937 4.691 -27.200 1.00 0.00 N ATOM 0 H GLN D 48 102.201 3.644 -28.878 1.00 0.00 H new ATOM 0 HA GLN D 48 101.901 5.286 -31.247 1.00 0.00 H new ATOM 0 HB2 GLN D 48 103.617 6.481 -29.241 1.00 0.00 H new ATOM 0 HB3 GLN D 48 102.000 6.957 -29.719 1.00 0.00 H new ATOM 0 HG2 GLN D 48 102.686 4.775 -27.688 1.00 0.00 H new ATOM 0 HG3 GLN D 48 102.075 6.372 -27.302 1.00 0.00 H new ATOM 0 HE21 GLN D 48 100.353 4.727 -26.269 1.00 0.00 H new ATOM 0 HE22 GLN D 48 98.983 4.350 -27.320 1.00 0.00 H new ATOM 1817 N ILE D 49 104.890 4.263 -30.288 1.00 0.00 N ATOM 1818 CA ILE D 49 106.258 4.053 -30.760 1.00 0.00 C ATOM 1819 C ILE D 49 106.260 3.521 -32.192 1.00 0.00 C ATOM 1820 O ILE D 49 106.492 4.271 -33.140 1.00 0.00 O ATOM 1821 CB ILE D 49 106.989 3.073 -29.836 1.00 0.00 C ATOM 1822 CG1 ILE D 49 107.139 3.706 -28.448 1.00 0.00 C ATOM 1823 CG2 ILE D 49 108.376 2.764 -30.407 1.00 0.00 C ATOM 1824 CD1 ILE D 49 107.659 2.662 -27.457 1.00 0.00 C ATOM 0 H ILE D 49 104.718 3.953 -29.332 1.00 0.00 H new ATOM 0 HA ILE D 49 106.777 5.011 -30.747 1.00 0.00 H new ATOM 0 HB ILE D 49 106.417 2.148 -29.760 1.00 0.00 H new ATOM 0 HG12 ILE D 49 107.827 4.550 -28.495 1.00 0.00 H new ATOM 0 HG13 ILE D 49 106.179 4.096 -28.110 1.00 0.00 H new ATOM 0 HG21 ILE D 49 108.894 2.067 -29.748 1.00 0.00 H new ATOM 0 HG22 ILE D 49 108.271 2.318 -31.396 1.00 0.00 H new ATOM 0 HG23 ILE D 49 108.952 3.686 -30.484 1.00 0.00 H new ATOM 0 HD11 ILE D 49 107.764 3.116 -26.472 1.00 0.00 H new ATOM 0 HD12 ILE D 49 106.955 1.832 -27.401 1.00 0.00 H new ATOM 0 HD13 ILE D 49 108.629 2.294 -27.792 1.00 0.00 H new ATOM 1836 N LYS D 50 106.007 2.250 -32.340 1.00 0.00 N ATOM 1837 CA LYS D 50 105.985 1.640 -33.664 1.00 0.00 C ATOM 1838 C LYS D 50 105.104 2.458 -34.603 1.00 0.00 C ATOM 1839 O LYS D 50 105.453 2.679 -35.763 1.00 0.00 O ATOM 1840 CB LYS D 50 105.447 0.206 -33.570 1.00 0.00 C ATOM 1841 CG LYS D 50 105.664 -0.537 -34.904 1.00 0.00 C ATOM 1842 CD LYS D 50 107.065 -1.160 -34.944 1.00 0.00 C ATOM 1843 CE LYS D 50 107.212 -2.002 -36.213 1.00 0.00 C ATOM 1844 NZ LYS D 50 108.539 -2.681 -36.208 1.00 0.00 N ATOM 0 H LYS D 50 105.812 1.609 -31.571 1.00 0.00 H new ATOM 0 HA LYS D 50 107.001 1.618 -34.058 1.00 0.00 H new ATOM 0 HB2 LYS D 50 105.951 -0.326 -32.763 1.00 0.00 H new ATOM 0 HB3 LYS D 50 104.385 0.224 -33.325 1.00 0.00 H new ATOM 0 HG2 LYS D 50 104.909 -1.315 -35.022 1.00 0.00 H new ATOM 0 HG3 LYS D 50 105.542 0.155 -35.738 1.00 0.00 H new ATOM 0 HD2 LYS D 50 107.823 -0.377 -34.924 1.00 0.00 H new ATOM 0 HD3 LYS D 50 107.224 -1.781 -34.062 1.00 0.00 H new ATOM 0 HE2 LYS D 50 106.413 -2.742 -36.266 1.00 0.00 H new ATOM 0 HE3 LYS D 50 107.119 -1.369 -37.095 1.00 0.00 H new ATOM 0 HZ1 LYS D 50 108.639 -3.253 -37.070 1.00 0.00 H new ATOM 0 HZ2 LYS D 50 109.294 -1.967 -36.177 1.00 0.00 H new ATOM 0 HZ3 LYS D 50 108.611 -3.297 -35.373 1.00 0.00 H new ATOM 1858 N ARG D 51 103.983 2.900 -34.100 1.00 0.00 N ATOM 1859 CA ARG D 51 103.058 3.698 -34.897 1.00 0.00 C ATOM 1860 C ARG D 51 102.536 2.887 -36.081 1.00 0.00 C ATOM 1861 O ARG D 51 101.369 2.495 -36.111 1.00 0.00 O ATOM 1862 CB ARG D 51 103.768 4.971 -35.395 1.00 0.00 C ATOM 1863 CG ARG D 51 102.748 6.095 -35.631 1.00 0.00 C ATOM 1864 CD ARG D 51 101.769 5.690 -36.736 1.00 0.00 C ATOM 1865 NE ARG D 51 101.084 6.868 -37.256 1.00 0.00 N ATOM 1866 CZ ARG D 51 101.712 7.743 -37.993 1.00 0.00 C ATOM 1867 NH1 ARG D 51 102.974 7.571 -38.279 1.00 0.00 N ATOM 1868 NH2 ARG D 51 101.078 8.791 -38.446 1.00 0.00 N ATOM 0 H ARG D 51 103.678 2.727 -33.142 1.00 0.00 H new ATOM 0 HA ARG D 51 102.209 3.982 -34.275 1.00 0.00 H new ATOM 0 HB2 ARG D 51 104.509 5.292 -34.663 1.00 0.00 H new ATOM 0 HB3 ARG D 51 104.304 4.758 -36.320 1.00 0.00 H new ATOM 0 HG2 ARG D 51 102.204 6.303 -34.710 1.00 0.00 H new ATOM 0 HG3 ARG D 51 103.265 7.013 -35.910 1.00 0.00 H new ATOM 0 HD2 ARG D 51 102.305 5.187 -37.541 1.00 0.00 H new ATOM 0 HD3 ARG D 51 101.041 4.979 -36.345 1.00 0.00 H new ATOM 0 HE ARG D 51 100.097 7.010 -37.040 1.00 0.00 H new ATOM 0 HH11 ARG D 51 103.470 6.752 -37.926 1.00 0.00 H new ATOM 0 HH12 ARG D 51 103.464 8.255 -38.855 1.00 0.00 H new ATOM 0 HH21 ARG D 51 100.092 8.926 -38.224 1.00 0.00 H new ATOM 0 HH22 ARG D 51 101.569 9.475 -39.022 1.00 0.00 H new ATOM 1882 N GLY D 52 103.391 2.643 -37.036 1.00 0.00 N ATOM 1883 CA GLY D 52 103.006 1.879 -38.216 1.00 0.00 C ATOM 1884 C GLY D 52 101.756 2.467 -38.862 1.00 0.00 C ATOM 0 H GLY D 52 104.361 2.957 -37.031 1.00 0.00 H new ATOM 0 HA2 GLY D 52 103.825 1.876 -38.935 1.00 0.00 H new ATOM 0 HA3 GLY D 52 102.823 0.841 -37.938 1.00 0.00 H new TER 1888 GLY D 52 HETATM 1889 CA RIM A 1 90.093 2.894 -7.119 1.00 0.00 C HETATM 1890 CB RIM A 1 90.933 3.675 -6.096 1.00 0.00 C HETATM 1891 NC RIM A 1 91.395 4.942 -6.731 1.00 0.00 N HETATM 1892 CD RIM A 1 90.128 4.008 -4.806 1.00 0.00 C HETATM 1893 CE1 RIM A 1 90.127 2.801 -3.868 1.00 0.00 C HETATM 1894 CE2 RIM A 1 88.677 4.368 -5.126 1.00 0.00 C HETATM 1895 CE3 RIM A 1 90.804 5.198 -4.120 1.00 0.00 C HETATM 1896 CF1 RIM A 1 89.367 3.141 -2.584 1.00 0.00 C HETATM 1897 CF2 RIM A 1 87.939 4.786 -3.841 1.00 0.00 C HETATM 1898 CF3 RIM A 1 90.101 5.522 -2.806 1.00 0.00 C HETATM 1899 CG1 RIM A 1 87.926 3.571 -2.909 1.00 0.00 C HETATM 1900 CG2 RIM A 1 88.673 5.932 -3.136 1.00 0.00 C HETATM 1901 CG3 RIM A 1 90.074 4.295 -1.892 1.00 0.00 C HETATM 0 HNC2 RIM A 1 91.970 5.597 -6.202 1.00 0.00 H new HETATM 0 HNC1 RIM A 1 91.136 5.154 -7.694 1.00 0.00 H new HETATM 0 HG32 RIM A 1 89.563 4.538 -0.960 1.00 0.00 H new HETATM 0 HG31 RIM A 1 91.092 4.004 -1.631 1.00 0.00 H new HETATM 0 HG22 RIM A 1 88.680 6.816 -3.774 1.00 0.00 H new HETATM 0 HG21 RIM A 1 88.145 6.203 -2.222 1.00 0.00 H new HETATM 0 HG12 RIM A 1 87.389 2.747 -3.380 1.00 0.00 H new HETATM 0 HG11 RIM A 1 87.394 3.814 -1.989 1.00 0.00 H new HETATM 0 HE32 RIM A 1 91.853 4.970 -3.932 1.00 0.00 H new HETATM 0 HE31 RIM A 1 90.779 6.067 -4.777 1.00 0.00 H new HETATM 0 HE22 RIM A 1 88.648 5.180 -5.852 1.00 0.00 H new HETATM 0 HE21 RIM A 1 88.175 3.515 -5.582 1.00 0.00 H new HETATM 0 HE12 RIM A 1 89.663 1.947 -4.361 1.00 0.00 H new HETATM 0 HE11 RIM A 1 91.151 2.514 -3.630 1.00 0.00 H new HETATM 0 HF3 RIM A 1 90.632 6.321 -2.290 1.00 0.00 H new HETATM 0 HF2 RIM A 1 86.932 5.122 -4.089 1.00 0.00 H new HETATM 0 HF1 RIM A 1 89.340 2.260 -1.942 1.00 0.00 H new HETATM 0 HB RIM A 1 91.778 3.052 -5.801 1.00 0.00 H new HETATM 0 HA3 RIM A 1 89.234 3.494 -7.418 1.00 0.00 H new HETATM 0 HA2 RIM A 1 90.702 2.670 -7.995 1.00 0.00 H new HETATM 0 HA1 RIM A 1 89.747 1.963 -6.670 1.00 0.00 H new