USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1198 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 37 MET CE :methyl -161:sc= -5.19! (180deg=-6.19!) USER MOD Set 1.2: B 42 GLN : amide:sc= -0.2 K(o=-5.4,f=-9.1!) USER MOD Set 2.1: A 37 MET CE :methyl -171:sc= -3.67! (180deg=-4.3!) USER MOD Set 2.2: A 42 GLN : amide:sc= -0.148 K(o=-3.8,f=-6.2!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 HIS : no HE2:sc= -6.29! C(o=-6.3!,f=-6.7!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.229 F(o=-3.4!,f=-0.23) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.00242 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -0.653 K(o=-0.65,f=-1.6) USER MOD Single : A 58 GLN : amide:sc= -0.517 K(o=-0.52,f=-2.1!) USER MOD Single : A 60 GLN : amide:sc= -1.3 K(o=-1.3,f=-6.2!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot -100:sc= -0.429 USER MOD Single : A 64 GLN : amide:sc= 1.03 K(o=1,f=-0.094) USER MOD Single : A 67 SER OG : rot 160:sc= -0.427 USER MOD Single : A 75 ASN : amide:sc= 1.16 K(o=1.2,f=-0.0088) USER MOD Single : B 1 GLY N :NH3+ -114:sc= 0.101 (180deg=0) USER MOD Single : B 5 SER OG : rot -178:sc= 0.899 USER MOD Single : B 6 SER OG : rot 180:sc= 0 USER MOD Single : B 13 HIS :FLIP no HD1:sc= -3.17! C(o=-3.9!,f=-3.2!) USER MOD Single : B 16 SER OG : rot 180:sc= 0 USER MOD Single : B 31 GLN :FLIP amide:sc= -0.0463 F(o=-1.2,f=-0.046) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0.00359 USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 50 HIS : no HE2:sc= -0.152 K(o=-0.15,f=-1.3) USER MOD Single : B 58 GLN : amide:sc= -0.378 K(o=-0.38,f=-2.1!) USER MOD Single : B 60 GLN : amide:sc= -0.92 K(o=-0.92,f=-5.2!) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 63 SER OG : rot -110:sc= -0.329 USER MOD Single : B 64 GLN : amide:sc= 1.03 K(o=1,f=-0.13) USER MOD Single : B 67 SER OG : rot 160:sc= -0.167 USER MOD Single : B 75 ASN : amide:sc= 0 X(o=0,f=-0.0025) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.030 -1.645 6.721 1.00 11.48 N ATOM 2 CA GLY A 1 24.247 -0.431 7.055 1.00 10.92 C ATOM 3 C GLY A 1 24.802 0.280 8.274 1.00 10.31 C ATOM 4 O GLY A 1 25.849 0.924 8.193 1.00 10.34 O ATOM 0 H1 GLY A 1 24.620 -2.103 5.882 1.00 11.48 H new ATOM 0 H2 GLY A 1 26.016 -1.379 6.523 1.00 11.48 H new ATOM 0 H3 GLY A 1 25.005 -2.306 7.524 1.00 11.48 H new ATOM 0 HA2 GLY A 1 24.251 0.250 6.204 1.00 10.92 H new ATOM 0 HA3 GLY A 1 23.208 -0.707 7.237 1.00 10.92 H new ATOM 10 N PRO A 2 24.118 0.182 9.424 1.00 9.98 N ATOM 11 CA PRO A 2 24.587 0.757 10.681 1.00 9.63 C ATOM 12 C PRO A 2 25.676 -0.101 11.321 1.00 9.06 C ATOM 13 O PRO A 2 26.079 -1.128 10.765 1.00 9.12 O ATOM 14 CB PRO A 2 23.330 0.772 11.571 1.00 9.81 C ATOM 15 CG PRO A 2 22.204 0.297 10.710 1.00 10.08 C ATOM 16 CD PRO A 2 22.826 -0.486 9.593 1.00 10.23 C ATOM 0 HA PRO A 2 25.029 1.743 10.539 1.00 9.63 H new ATOM 0 HB2 PRO A 2 23.458 0.123 12.437 1.00 9.81 H new ATOM 0 HB3 PRO A 2 23.134 1.775 11.951 1.00 9.81 H new ATOM 0 HG2 PRO A 2 21.513 -0.323 11.281 1.00 10.08 H new ATOM 0 HG3 PRO A 2 21.630 1.139 10.322 1.00 10.08 H new ATOM 0 HD2 PRO A 2 22.943 -1.539 9.851 1.00 10.23 H new ATOM 0 HD3 PRO A 2 22.225 -0.445 8.684 1.00 10.23 H new ATOM 24 N LEU A 3 26.148 0.317 12.486 1.00 8.75 N ATOM 25 CA LEU A 3 27.160 -0.437 13.213 1.00 8.46 C ATOM 26 C LEU A 3 26.522 -1.613 13.946 1.00 7.59 C ATOM 27 O LEU A 3 27.217 -2.491 14.464 1.00 7.78 O ATOM 28 CB LEU A 3 27.896 0.470 14.201 1.00 8.92 C ATOM 29 CG LEU A 3 28.673 1.629 13.568 1.00 9.48 C ATOM 30 CD1 LEU A 3 29.327 2.483 14.644 1.00 9.89 C ATOM 31 CD2 LEU A 3 29.720 1.103 12.597 1.00 10.02 C ATOM 0 H LEU A 3 25.847 1.175 12.949 1.00 8.75 H new ATOM 0 HA LEU A 3 27.883 -0.826 12.496 1.00 8.46 H new ATOM 0 HB2 LEU A 3 27.170 0.881 14.903 1.00 8.92 H new ATOM 0 HB3 LEU A 3 28.590 -0.138 14.780 1.00 8.92 H new ATOM 0 HG LEU A 3 27.970 2.251 13.013 1.00 9.48 H new ATOM 0 HD11 LEU A 3 29.875 3.301 14.176 1.00 9.89 H new ATOM 0 HD12 LEU A 3 28.559 2.890 15.302 1.00 9.89 H new ATOM 0 HD13 LEU A 3 30.016 1.871 15.225 1.00 9.89 H new ATOM 0 HD21 LEU A 3 30.262 1.940 12.157 1.00 10.02 H new ATOM 0 HD22 LEU A 3 30.419 0.458 13.130 1.00 10.02 H new ATOM 0 HD23 LEU A 3 29.230 0.533 11.807 1.00 10.02 H new ATOM 43 N GLY A 4 25.197 -1.619 13.988 1.00 6.89 N ATOM 44 CA GLY A 4 24.473 -2.712 14.599 1.00 6.24 C ATOM 45 C GLY A 4 23.667 -3.488 13.578 1.00 5.46 C ATOM 46 O GLY A 4 23.266 -2.929 12.553 1.00 5.49 O ATOM 0 H GLY A 4 24.608 -0.879 13.606 1.00 6.89 H new ATOM 0 HA2 GLY A 4 25.175 -3.382 15.094 1.00 6.24 H new ATOM 0 HA3 GLY A 4 23.807 -2.322 15.369 1.00 6.24 H new ATOM 50 N SER A 5 23.426 -4.765 13.852 1.00 5.14 N ATOM 51 CA SER A 5 22.677 -5.622 12.942 1.00 4.77 C ATOM 52 C SER A 5 21.219 -5.180 12.856 1.00 3.88 C ATOM 53 O SER A 5 20.394 -5.549 13.691 1.00 4.02 O ATOM 54 CB SER A 5 22.762 -7.079 13.406 1.00 5.46 C ATOM 55 OG SER A 5 24.114 -7.493 13.532 1.00 6.02 O ATOM 0 H SER A 5 23.741 -5.231 14.703 1.00 5.14 H new ATOM 0 HA SER A 5 23.117 -5.538 11.948 1.00 4.77 H new ATOM 0 HB2 SER A 5 22.253 -7.190 14.363 1.00 5.46 H new ATOM 0 HB3 SER A 5 22.245 -7.722 12.694 1.00 5.46 H new ATOM 0 HG SER A 5 24.144 -8.426 13.831 1.00 6.02 H new ATOM 61 N SER A 6 20.921 -4.376 11.845 1.00 3.43 N ATOM 62 CA SER A 6 19.592 -3.822 11.656 1.00 2.89 C ATOM 63 C SER A 6 19.508 -3.125 10.303 1.00 2.66 C ATOM 64 O SER A 6 20.542 -2.847 9.690 1.00 2.87 O ATOM 65 CB SER A 6 19.269 -2.839 12.785 1.00 3.04 C ATOM 66 OG SER A 6 20.378 -1.993 13.054 1.00 3.51 O ATOM 0 H SER A 6 21.595 -4.091 11.134 1.00 3.43 H new ATOM 0 HA SER A 6 18.861 -4.630 11.679 1.00 2.89 H new ATOM 0 HB2 SER A 6 18.404 -2.235 12.510 1.00 3.04 H new ATOM 0 HB3 SER A 6 19.000 -3.390 13.686 1.00 3.04 H new ATOM 0 HG SER A 6 20.148 -1.373 13.777 1.00 3.51 H new ATOM 72 N ALA A 7 18.277 -2.873 9.844 1.00 2.47 N ATOM 73 CA ALA A 7 18.010 -2.189 8.572 1.00 2.28 C ATOM 74 C ALA A 7 18.292 -3.096 7.376 1.00 2.05 C ATOM 75 O ALA A 7 17.416 -3.316 6.542 1.00 1.85 O ATOM 76 CB ALA A 7 18.795 -0.886 8.465 1.00 2.50 C ATOM 0 H ALA A 7 17.431 -3.140 10.348 1.00 2.47 H new ATOM 0 HA ALA A 7 16.948 -1.942 8.557 1.00 2.28 H new ATOM 0 HB1 ALA A 7 18.574 -0.405 7.512 1.00 2.50 H new ATOM 0 HB2 ALA A 7 18.510 -0.222 9.281 1.00 2.50 H new ATOM 0 HB3 ALA A 7 19.862 -1.098 8.526 1.00 2.50 H new ATOM 82 N GLY A 8 19.507 -3.626 7.309 1.00 2.13 N ATOM 83 CA GLY A 8 19.885 -4.516 6.233 1.00 2.02 C ATOM 84 C GLY A 8 19.010 -5.749 6.172 1.00 1.90 C ATOM 85 O GLY A 8 18.564 -6.141 5.100 1.00 1.76 O ATOM 0 H GLY A 8 20.245 -3.451 7.991 1.00 2.13 H new ATOM 0 HA2 GLY A 8 19.823 -3.982 5.285 1.00 2.02 H new ATOM 0 HA3 GLY A 8 20.925 -4.817 6.362 1.00 2.02 H new ATOM 89 N ALA A 9 18.755 -6.354 7.327 1.00 2.01 N ATOM 90 CA ALA A 9 17.887 -7.523 7.411 1.00 1.97 C ATOM 91 C ALA A 9 16.480 -7.200 6.911 1.00 1.73 C ATOM 92 O ALA A 9 15.854 -8.000 6.211 1.00 1.64 O ATOM 93 CB ALA A 9 17.833 -8.035 8.842 1.00 2.19 C ATOM 0 H ALA A 9 19.139 -6.052 8.222 1.00 2.01 H new ATOM 0 HA ALA A 9 18.303 -8.301 6.771 1.00 1.97 H new ATOM 0 HB1 ALA A 9 17.182 -8.908 8.892 1.00 2.19 H new ATOM 0 HB2 ALA A 9 18.836 -8.311 9.168 1.00 2.19 H new ATOM 0 HB3 ALA A 9 17.442 -7.253 9.494 1.00 2.19 H new ATOM 99 N LEU A 10 15.992 -6.019 7.270 1.00 1.68 N ATOM 100 CA LEU A 10 14.672 -5.573 6.847 1.00 1.51 C ATOM 101 C LEU A 10 14.650 -5.322 5.345 1.00 1.33 C ATOM 102 O LEU A 10 13.747 -5.774 4.642 1.00 1.21 O ATOM 103 CB LEU A 10 14.283 -4.305 7.604 1.00 1.62 C ATOM 104 CG LEU A 10 12.971 -3.648 7.166 1.00 1.49 C ATOM 105 CD1 LEU A 10 11.794 -4.561 7.450 1.00 1.55 C ATOM 106 CD2 LEU A 10 12.784 -2.313 7.865 1.00 1.60 C ATOM 0 H LEU A 10 16.494 -5.351 7.855 1.00 1.68 H new ATOM 0 HA LEU A 10 13.948 -6.355 7.074 1.00 1.51 H new ATOM 0 HB2 LEU A 10 14.212 -4.544 8.665 1.00 1.62 H new ATOM 0 HB3 LEU A 10 15.087 -3.577 7.495 1.00 1.62 H new ATOM 0 HG LEU A 10 13.020 -3.473 6.091 1.00 1.49 H new ATOM 0 HD11 LEU A 10 10.872 -4.075 7.131 1.00 1.55 H new ATOM 0 HD12 LEU A 10 11.919 -5.496 6.904 1.00 1.55 H new ATOM 0 HD13 LEU A 10 11.744 -4.769 8.519 1.00 1.55 H new ATOM 0 HD21 LEU A 10 11.846 -1.861 7.541 1.00 1.60 H new ATOM 0 HD22 LEU A 10 12.759 -2.467 8.944 1.00 1.60 H new ATOM 0 HD23 LEU A 10 13.612 -1.651 7.612 1.00 1.60 H new ATOM 118 N LEU A 11 15.660 -4.620 4.868 1.00 1.38 N ATOM 119 CA LEU A 11 15.807 -4.334 3.450 1.00 1.31 C ATOM 120 C LEU A 11 15.939 -5.640 2.662 1.00 1.29 C ATOM 121 O LEU A 11 15.288 -5.828 1.635 1.00 1.22 O ATOM 122 CB LEU A 11 17.031 -3.419 3.255 1.00 1.44 C ATOM 123 CG LEU A 11 17.291 -2.881 1.840 1.00 1.48 C ATOM 124 CD1 LEU A 11 17.987 -3.925 0.981 1.00 1.71 C ATOM 125 CD2 LEU A 11 15.992 -2.419 1.189 1.00 1.43 C ATOM 0 H LEU A 11 16.402 -4.231 5.450 1.00 1.38 H new ATOM 0 HA LEU A 11 14.924 -3.818 3.072 1.00 1.31 H new ATOM 0 HB2 LEU A 11 16.925 -2.566 3.926 1.00 1.44 H new ATOM 0 HB3 LEU A 11 17.917 -3.968 3.575 1.00 1.44 H new ATOM 0 HG LEU A 11 17.953 -2.019 1.923 1.00 1.48 H new ATOM 0 HD11 LEU A 11 18.160 -3.520 -0.016 1.00 1.71 H new ATOM 0 HD12 LEU A 11 18.942 -4.192 1.435 1.00 1.71 H new ATOM 0 HD13 LEU A 11 17.359 -4.813 0.908 1.00 1.71 H new ATOM 0 HD21 LEU A 11 16.201 -2.042 0.188 1.00 1.43 H new ATOM 0 HD22 LEU A 11 15.299 -3.258 1.124 1.00 1.43 H new ATOM 0 HD23 LEU A 11 15.546 -1.626 1.789 1.00 1.43 H new ATOM 137 N ALA A 12 16.757 -6.551 3.177 1.00 1.43 N ATOM 138 CA ALA A 12 17.010 -7.830 2.523 1.00 1.53 C ATOM 139 C ALA A 12 15.732 -8.643 2.346 1.00 1.49 C ATOM 140 O ALA A 12 15.436 -9.103 1.244 1.00 1.51 O ATOM 141 CB ALA A 12 18.036 -8.632 3.306 1.00 1.75 C ATOM 0 H ALA A 12 17.261 -6.425 4.055 1.00 1.43 H new ATOM 0 HA ALA A 12 17.404 -7.614 1.530 1.00 1.53 H new ATOM 0 HB1 ALA A 12 18.214 -9.584 2.805 1.00 1.75 H new ATOM 0 HB2 ALA A 12 18.969 -8.072 3.363 1.00 1.75 H new ATOM 0 HB3 ALA A 12 17.662 -8.817 4.313 1.00 1.75 H new ATOM 147 N HIS A 13 14.958 -8.808 3.418 1.00 1.46 N ATOM 148 CA HIS A 13 13.776 -9.655 3.353 1.00 1.48 C ATOM 149 C HIS A 13 12.683 -8.975 2.528 1.00 1.27 C ATOM 150 O HIS A 13 11.854 -9.641 1.908 1.00 1.32 O ATOM 151 CB HIS A 13 13.284 -10.038 4.765 1.00 1.57 C ATOM 152 CG HIS A 13 12.304 -9.093 5.377 1.00 1.44 C ATOM 153 ND1 HIS A 13 10.948 -9.210 5.198 1.00 1.26 N ATOM 154 CD2 HIS A 13 12.485 -8.012 6.164 1.00 1.78 C ATOM 155 CE1 HIS A 13 10.337 -8.240 5.840 1.00 1.21 C ATOM 156 NE2 HIS A 13 11.244 -7.498 6.439 1.00 1.66 N ATOM 0 H HIS A 13 15.126 -8.373 4.325 1.00 1.46 H new ATOM 0 HA HIS A 13 14.041 -10.586 2.851 1.00 1.48 H new ATOM 0 HB2 HIS A 13 12.829 -11.027 4.717 1.00 1.57 H new ATOM 0 HB3 HIS A 13 14.149 -10.116 5.424 1.00 1.57 H new ATOM 0 HD1 HIS A 13 10.486 -9.937 4.651 1.00 1.26 H new ATOM 0 HD2 HIS A 13 13.431 -7.624 6.512 1.00 1.78 H new ATOM 0 HE1 HIS A 13 9.270 -8.079 5.871 1.00 1.21 H new ATOM 165 N ALA A 14 12.695 -7.647 2.508 1.00 1.09 N ATOM 166 CA ALA A 14 11.743 -6.890 1.708 1.00 0.94 C ATOM 167 C ALA A 14 12.051 -7.053 0.224 1.00 1.00 C ATOM 168 O ALA A 14 11.154 -7.313 -0.580 1.00 1.04 O ATOM 169 CB ALA A 14 11.768 -5.422 2.105 1.00 0.84 C ATOM 0 H ALA A 14 13.353 -7.074 3.036 1.00 1.09 H new ATOM 0 HA ALA A 14 10.742 -7.278 1.895 1.00 0.94 H new ATOM 0 HB1 ALA A 14 11.051 -4.869 1.498 1.00 0.84 H new ATOM 0 HB2 ALA A 14 11.503 -5.325 3.158 1.00 0.84 H new ATOM 0 HB3 ALA A 14 12.768 -5.018 1.944 1.00 0.84 H new ATOM 175 N ALA A 15 13.328 -6.920 -0.124 1.00 1.08 N ATOM 176 CA ALA A 15 13.772 -7.096 -1.502 1.00 1.19 C ATOM 177 C ALA A 15 13.579 -8.535 -1.952 1.00 1.37 C ATOM 178 O ALA A 15 13.223 -8.794 -3.102 1.00 1.46 O ATOM 179 CB ALA A 15 15.233 -6.689 -1.647 1.00 1.27 C ATOM 0 H ALA A 15 14.075 -6.690 0.532 1.00 1.08 H new ATOM 0 HA ALA A 15 13.165 -6.453 -2.139 1.00 1.19 H new ATOM 0 HB1 ALA A 15 15.548 -6.827 -2.681 1.00 1.27 H new ATOM 0 HB2 ALA A 15 15.348 -5.641 -1.369 1.00 1.27 H new ATOM 0 HB3 ALA A 15 15.849 -7.307 -0.995 1.00 1.27 H new ATOM 185 N SER A 16 13.813 -9.468 -1.035 1.00 1.47 N ATOM 186 CA SER A 16 13.648 -10.887 -1.317 1.00 1.68 C ATOM 187 C SER A 16 12.208 -11.194 -1.728 1.00 1.68 C ATOM 188 O SER A 16 11.973 -11.923 -2.691 1.00 1.89 O ATOM 189 CB SER A 16 14.042 -11.714 -0.088 1.00 1.83 C ATOM 190 OG SER A 16 14.024 -13.103 -0.369 1.00 2.28 O ATOM 0 H SER A 16 14.120 -9.263 -0.084 1.00 1.47 H new ATOM 0 HA SER A 16 14.301 -11.155 -2.147 1.00 1.68 H new ATOM 0 HB2 SER A 16 15.038 -11.422 0.244 1.00 1.83 H new ATOM 0 HB3 SER A 16 13.357 -11.499 0.732 1.00 1.83 H new ATOM 0 HG SER A 16 14.281 -13.603 0.434 1.00 2.28 H new ATOM 196 N LEU A 17 11.248 -10.622 -1.010 1.00 1.47 N ATOM 197 CA LEU A 17 9.841 -10.848 -1.315 1.00 1.48 C ATOM 198 C LEU A 17 9.388 -9.959 -2.465 1.00 1.43 C ATOM 199 O LEU A 17 8.451 -10.293 -3.187 1.00 1.55 O ATOM 200 CB LEU A 17 8.975 -10.572 -0.088 1.00 1.34 C ATOM 201 CG LEU A 17 9.305 -11.405 1.148 1.00 1.42 C ATOM 202 CD1 LEU A 17 8.388 -11.023 2.290 1.00 1.31 C ATOM 203 CD2 LEU A 17 9.194 -12.889 0.852 1.00 1.65 C ATOM 0 H LEU A 17 11.417 -10.002 -0.218 1.00 1.47 H new ATOM 0 HA LEU A 17 9.727 -11.892 -1.607 1.00 1.48 H new ATOM 0 HB2 LEU A 17 9.067 -9.517 0.171 1.00 1.34 H new ATOM 0 HB3 LEU A 17 7.932 -10.745 -0.354 1.00 1.34 H new ATOM 0 HG LEU A 17 10.336 -11.198 1.436 1.00 1.42 H new ATOM 0 HD11 LEU A 17 8.631 -11.622 3.168 1.00 1.31 H new ATOM 0 HD12 LEU A 17 8.519 -9.967 2.524 1.00 1.31 H new ATOM 0 HD13 LEU A 17 7.353 -11.205 2.002 1.00 1.31 H new ATOM 0 HD21 LEU A 17 9.434 -13.458 1.750 1.00 1.65 H new ATOM 0 HD22 LEU A 17 8.177 -13.122 0.536 1.00 1.65 H new ATOM 0 HD23 LEU A 17 9.891 -13.155 0.057 1.00 1.65 H new ATOM 215 N GLY A 18 10.064 -8.839 -2.640 1.00 1.28 N ATOM 216 CA GLY A 18 9.738 -7.945 -3.728 1.00 1.27 C ATOM 217 C GLY A 18 8.728 -6.885 -3.340 1.00 1.15 C ATOM 218 O GLY A 18 7.937 -6.445 -4.178 1.00 1.27 O ATOM 0 H GLY A 18 10.835 -8.531 -2.047 1.00 1.28 H new ATOM 0 HA2 GLY A 18 10.649 -7.460 -4.078 1.00 1.27 H new ATOM 0 HA3 GLY A 18 9.345 -8.525 -4.563 1.00 1.27 H new ATOM 222 N VAL A 19 8.745 -6.473 -2.075 1.00 0.99 N ATOM 223 CA VAL A 19 7.885 -5.390 -1.621 1.00 0.89 C ATOM 224 C VAL A 19 8.439 -4.059 -2.114 1.00 0.86 C ATOM 225 O VAL A 19 9.520 -3.643 -1.710 1.00 0.84 O ATOM 226 CB VAL A 19 7.754 -5.339 -0.079 1.00 0.76 C ATOM 227 CG1 VAL A 19 6.837 -4.205 0.346 1.00 0.74 C ATOM 228 CG2 VAL A 19 7.243 -6.656 0.479 1.00 0.87 C ATOM 0 H VAL A 19 9.343 -6.872 -1.351 1.00 0.99 H new ATOM 0 HA VAL A 19 6.893 -5.575 -2.032 1.00 0.89 H new ATOM 0 HB VAL A 19 8.750 -5.160 0.327 1.00 0.76 H new ATOM 0 HG11 VAL A 19 6.759 -4.188 1.433 1.00 0.74 H new ATOM 0 HG12 VAL A 19 7.245 -3.257 -0.004 1.00 0.74 H new ATOM 0 HG13 VAL A 19 5.848 -4.356 -0.086 1.00 0.74 H new ATOM 0 HG21 VAL A 19 7.163 -6.585 1.564 1.00 0.87 H new ATOM 0 HG22 VAL A 19 6.262 -6.874 0.056 1.00 0.87 H new ATOM 0 HG23 VAL A 19 7.937 -7.455 0.218 1.00 0.87 H new ATOM 238 N ARG A 20 7.708 -3.419 -3.008 1.00 0.95 N ATOM 239 CA ARG A 20 8.149 -2.171 -3.617 1.00 1.00 C ATOM 240 C ARG A 20 7.116 -1.069 -3.389 1.00 1.04 C ATOM 241 O ARG A 20 5.916 -1.290 -3.570 1.00 1.14 O ATOM 242 CB ARG A 20 8.367 -2.379 -5.116 1.00 1.23 C ATOM 243 CG ARG A 20 9.455 -3.390 -5.435 1.00 1.42 C ATOM 244 CD ARG A 20 9.360 -3.880 -6.869 1.00 1.62 C ATOM 245 NE ARG A 20 9.364 -2.784 -7.835 1.00 1.83 N ATOM 246 CZ ARG A 20 9.175 -2.950 -9.143 1.00 2.15 C ATOM 247 NH1 ARG A 20 8.977 -4.165 -9.646 1.00 2.44 N ATOM 248 NH2 ARG A 20 9.178 -1.899 -9.952 1.00 2.67 N ATOM 0 H ARG A 20 6.797 -3.744 -3.333 1.00 0.95 H new ATOM 0 HA ARG A 20 9.087 -1.867 -3.153 1.00 1.00 H new ATOM 0 HB2 ARG A 20 7.432 -2.708 -5.569 1.00 1.23 H new ATOM 0 HB3 ARG A 20 8.624 -1.424 -5.574 1.00 1.23 H new ATOM 0 HG2 ARG A 20 10.433 -2.938 -5.268 1.00 1.42 H new ATOM 0 HG3 ARG A 20 9.376 -4.238 -4.754 1.00 1.42 H new ATOM 0 HD2 ARG A 20 10.196 -4.547 -7.078 1.00 1.62 H new ATOM 0 HD3 ARG A 20 8.448 -4.464 -6.991 1.00 1.62 H new ATOM 0 HE ARG A 20 9.520 -1.838 -7.488 1.00 1.83 H new ATOM 0 HH11 ARG A 20 8.969 -4.977 -9.029 1.00 2.44 H new ATOM 0 HH12 ARG A 20 8.833 -4.285 -10.649 1.00 2.44 H new ATOM 0 HH21 ARG A 20 9.325 -0.964 -9.572 1.00 2.67 H new ATOM 0 HH22 ARG A 20 9.033 -2.026 -10.954 1.00 2.67 H new ATOM 262 N LEU A 21 7.583 0.104 -2.977 1.00 1.06 N ATOM 263 CA LEU A 21 6.706 1.253 -2.768 1.00 1.22 C ATOM 264 C LEU A 21 7.289 2.499 -3.418 1.00 1.41 C ATOM 265 O LEU A 21 8.442 2.851 -3.179 1.00 1.45 O ATOM 266 CB LEU A 21 6.477 1.535 -1.277 1.00 1.18 C ATOM 267 CG LEU A 21 5.651 0.501 -0.505 1.00 1.09 C ATOM 268 CD1 LEU A 21 6.517 -0.666 -0.065 1.00 0.89 C ATOM 269 CD2 LEU A 21 4.982 1.151 0.694 1.00 1.23 C ATOM 0 H LEU A 21 8.567 0.286 -2.780 1.00 1.06 H new ATOM 0 HA LEU A 21 5.749 1.005 -3.228 1.00 1.22 H new ATOM 0 HB2 LEU A 21 7.450 1.625 -0.793 1.00 1.18 H new ATOM 0 HB3 LEU A 21 5.985 2.503 -1.184 1.00 1.18 H new ATOM 0 HG LEU A 21 4.878 0.115 -1.170 1.00 1.09 H new ATOM 0 HD11 LEU A 21 5.907 -1.386 0.481 1.00 0.89 H new ATOM 0 HD12 LEU A 21 6.951 -1.148 -0.941 1.00 0.89 H new ATOM 0 HD13 LEU A 21 7.316 -0.303 0.582 1.00 0.89 H new ATOM 0 HD21 LEU A 21 4.398 0.405 1.234 1.00 1.23 H new ATOM 0 HD22 LEU A 21 5.743 1.564 1.356 1.00 1.23 H new ATOM 0 HD23 LEU A 21 4.324 1.951 0.354 1.00 1.23 H new ATOM 281 N TRP A 22 6.487 3.154 -4.239 1.00 1.61 N ATOM 282 CA TRP A 22 6.886 4.397 -4.880 1.00 1.82 C ATOM 283 C TRP A 22 5.653 5.247 -5.133 1.00 2.04 C ATOM 284 O TRP A 22 4.578 4.722 -5.403 1.00 2.09 O ATOM 285 CB TRP A 22 7.643 4.125 -6.193 1.00 1.87 C ATOM 286 CG TRP A 22 6.812 3.477 -7.264 1.00 1.96 C ATOM 287 CD1 TRP A 22 6.297 4.081 -8.376 1.00 2.19 C ATOM 288 CD2 TRP A 22 6.398 2.106 -7.326 1.00 1.86 C ATOM 289 NE1 TRP A 22 5.590 3.172 -9.125 1.00 2.26 N ATOM 290 CE2 TRP A 22 5.639 1.952 -8.501 1.00 2.06 C ATOM 291 CE3 TRP A 22 6.599 0.996 -6.505 1.00 1.64 C ATOM 292 CZ2 TRP A 22 5.076 0.731 -8.865 1.00 2.08 C ATOM 293 CZ3 TRP A 22 6.038 -0.213 -6.867 1.00 1.66 C ATOM 294 CH2 TRP A 22 5.287 -0.337 -8.037 1.00 1.88 C ATOM 0 H TRP A 22 5.546 2.843 -4.480 1.00 1.61 H new ATOM 0 HA TRP A 22 7.565 4.936 -4.219 1.00 1.82 H new ATOM 0 HB2 TRP A 22 8.035 5.068 -6.575 1.00 1.87 H new ATOM 0 HB3 TRP A 22 8.500 3.487 -5.979 1.00 1.87 H new ATOM 0 HD1 TRP A 22 6.427 5.123 -8.630 1.00 2.19 H new ATOM 0 HE1 TRP A 22 5.108 3.372 -10.001 1.00 2.26 H new ATOM 0 HE3 TRP A 22 7.184 1.081 -5.601 1.00 1.64 H new ATOM 0 HZ2 TRP A 22 4.494 0.631 -9.769 1.00 2.08 H new ATOM 0 HZ3 TRP A 22 6.183 -1.076 -6.235 1.00 1.66 H new ATOM 0 HH2 TRP A 22 4.864 -1.297 -8.294 1.00 1.88 H new ATOM 305 N VAL A 23 5.791 6.555 -5.029 1.00 2.21 N ATOM 306 CA VAL A 23 4.644 7.433 -5.176 1.00 2.44 C ATOM 307 C VAL A 23 4.503 7.913 -6.617 1.00 2.71 C ATOM 308 O VAL A 23 5.461 8.388 -7.228 1.00 2.81 O ATOM 309 CB VAL A 23 4.710 8.640 -4.208 1.00 2.66 C ATOM 310 CG1 VAL A 23 5.971 9.463 -4.432 1.00 2.85 C ATOM 311 CG2 VAL A 23 3.466 9.512 -4.339 1.00 2.92 C ATOM 0 H VAL A 23 6.675 7.030 -4.845 1.00 2.21 H new ATOM 0 HA VAL A 23 3.761 6.849 -4.916 1.00 2.44 H new ATOM 0 HB VAL A 23 4.746 8.246 -3.192 1.00 2.66 H new ATOM 0 HG11 VAL A 23 5.986 10.302 -3.737 1.00 2.85 H new ATOM 0 HG12 VAL A 23 6.848 8.838 -4.265 1.00 2.85 H new ATOM 0 HG13 VAL A 23 5.983 9.839 -5.455 1.00 2.85 H new ATOM 0 HG21 VAL A 23 3.537 10.353 -3.649 1.00 2.92 H new ATOM 0 HG22 VAL A 23 3.390 9.886 -5.360 1.00 2.92 H new ATOM 0 HG23 VAL A 23 2.581 8.921 -4.102 1.00 2.92 H new ATOM 321 N GLU A 24 3.305 7.755 -7.159 1.00 2.84 N ATOM 322 CA GLU A 24 3.016 8.188 -8.513 1.00 3.15 C ATOM 323 C GLU A 24 1.844 9.157 -8.489 1.00 3.47 C ATOM 324 O GLU A 24 0.694 8.758 -8.269 1.00 3.45 O ATOM 325 CB GLU A 24 2.692 6.979 -9.399 1.00 3.09 C ATOM 326 CG GLU A 24 2.730 7.280 -10.890 1.00 3.44 C ATOM 327 CD GLU A 24 4.119 7.657 -11.365 1.00 3.75 C ATOM 328 OE1 GLU A 24 4.949 6.744 -11.573 1.00 4.20 O ATOM 329 OE2 GLU A 24 4.392 8.861 -11.539 1.00 4.16 O ATOM 0 H GLU A 24 2.515 7.327 -6.677 1.00 2.84 H new ATOM 0 HA GLU A 24 3.890 8.690 -8.928 1.00 3.15 H new ATOM 0 HB2 GLU A 24 3.401 6.181 -9.181 1.00 3.09 H new ATOM 0 HB3 GLU A 24 1.702 6.605 -9.139 1.00 3.09 H new ATOM 0 HG2 GLU A 24 2.383 6.407 -11.444 1.00 3.44 H new ATOM 0 HG3 GLU A 24 2.039 8.093 -11.112 1.00 3.44 H new ATOM 336 N GLY A 25 2.138 10.430 -8.697 1.00 3.78 N ATOM 337 CA GLY A 25 1.124 11.452 -8.585 1.00 4.13 C ATOM 338 C GLY A 25 0.728 11.670 -7.144 1.00 4.12 C ATOM 339 O GLY A 25 1.497 12.230 -6.361 1.00 4.20 O ATOM 0 H GLY A 25 3.066 10.774 -8.943 1.00 3.78 H new ATOM 0 HA2 GLY A 25 1.496 12.385 -9.008 1.00 4.13 H new ATOM 0 HA3 GLY A 25 0.248 11.165 -9.167 1.00 4.13 H new ATOM 343 N GLU A 26 -0.458 11.216 -6.786 1.00 4.08 N ATOM 344 CA GLU A 26 -0.937 11.319 -5.416 1.00 4.12 C ATOM 345 C GLU A 26 -1.128 9.926 -4.821 1.00 3.62 C ATOM 346 O GLU A 26 -1.402 9.773 -3.631 1.00 3.64 O ATOM 347 CB GLU A 26 -2.251 12.108 -5.356 1.00 4.51 C ATOM 348 CG GLU A 26 -3.418 11.416 -6.037 1.00 5.05 C ATOM 349 CD GLU A 26 -3.278 11.350 -7.543 1.00 4.66 C ATOM 350 OE1 GLU A 26 -3.720 12.287 -8.229 1.00 5.15 O ATOM 351 OE2 GLU A 26 -2.723 10.354 -8.053 1.00 4.88 O ATOM 0 H GLU A 26 -1.113 10.769 -7.428 1.00 4.08 H new ATOM 0 HA GLU A 26 -0.191 11.855 -4.830 1.00 4.12 H new ATOM 0 HB2 GLU A 26 -2.508 12.288 -4.312 1.00 4.51 H new ATOM 0 HB3 GLU A 26 -2.099 13.083 -5.820 1.00 4.51 H new ATOM 0 HG2 GLU A 26 -3.512 10.404 -5.643 1.00 5.05 H new ATOM 0 HG3 GLU A 26 -4.339 11.942 -5.787 1.00 5.05 H new ATOM 358 N ARG A 27 -0.972 8.911 -5.662 1.00 3.25 N ATOM 359 CA ARG A 27 -1.171 7.533 -5.243 1.00 2.79 C ATOM 360 C ARG A 27 0.163 6.841 -5.016 1.00 2.64 C ATOM 361 O ARG A 27 0.976 6.715 -5.931 1.00 2.74 O ATOM 362 CB ARG A 27 -1.980 6.764 -6.296 1.00 2.61 C ATOM 363 CG ARG A 27 -2.090 5.259 -6.042 1.00 2.49 C ATOM 364 CD ARG A 27 -2.809 4.949 -4.742 1.00 3.08 C ATOM 365 NE ARG A 27 -3.677 3.770 -4.866 1.00 3.76 N ATOM 366 CZ ARG A 27 -3.265 2.505 -4.722 1.00 4.65 C ATOM 367 NH1 ARG A 27 -2.006 2.231 -4.405 1.00 5.01 N ATOM 368 NH2 ARG A 27 -4.125 1.506 -4.886 1.00 5.38 N ATOM 0 H ARG A 27 -0.707 9.019 -6.641 1.00 3.25 H new ATOM 0 HA ARG A 27 -1.725 7.543 -4.305 1.00 2.79 H new ATOM 0 HB2 ARG A 27 -2.984 7.185 -6.342 1.00 2.61 H new ATOM 0 HB3 ARG A 27 -1.523 6.922 -7.273 1.00 2.61 H new ATOM 0 HG2 ARG A 27 -2.622 4.790 -6.870 1.00 2.49 H new ATOM 0 HG3 ARG A 27 -1.092 4.822 -6.016 1.00 2.49 H new ATOM 0 HD2 ARG A 27 -2.076 4.780 -3.953 1.00 3.08 H new ATOM 0 HD3 ARG A 27 -3.406 5.810 -4.443 1.00 3.08 H new ATOM 0 HE ARG A 27 -4.663 3.927 -5.077 1.00 3.76 H new ATOM 0 HH11 ARG A 27 -1.338 2.990 -4.268 1.00 5.01 H new ATOM 0 HH12 ARG A 27 -1.706 1.262 -4.299 1.00 5.01 H new ATOM 0 HH21 ARG A 27 -5.098 1.704 -5.121 1.00 5.38 H new ATOM 0 HH22 ARG A 27 -3.813 0.541 -4.777 1.00 5.38 H new ATOM 382 N LEU A 28 0.389 6.413 -3.788 1.00 2.44 N ATOM 383 CA LEU A 28 1.525 5.570 -3.490 1.00 2.27 C ATOM 384 C LEU A 28 1.278 4.199 -4.104 1.00 2.10 C ATOM 385 O LEU A 28 0.290 3.534 -3.785 1.00 2.02 O ATOM 386 CB LEU A 28 1.740 5.480 -1.971 1.00 2.25 C ATOM 387 CG LEU A 28 3.065 4.850 -1.518 1.00 2.00 C ATOM 388 CD1 LEU A 28 3.387 5.266 -0.093 1.00 2.23 C ATOM 389 CD2 LEU A 28 3.013 3.334 -1.616 1.00 2.15 C ATOM 0 H LEU A 28 -0.199 6.636 -2.985 1.00 2.44 H new ATOM 0 HA LEU A 28 2.434 5.993 -3.917 1.00 2.27 H new ATOM 0 HB2 LEU A 28 1.677 6.485 -1.554 1.00 2.25 H new ATOM 0 HB3 LEU A 28 0.920 4.904 -1.541 1.00 2.25 H new ATOM 0 HG LEU A 28 3.851 5.209 -2.182 1.00 2.00 H new ATOM 0 HD11 LEU A 28 4.329 4.812 0.215 1.00 2.23 H new ATOM 0 HD12 LEU A 28 3.474 6.351 -0.042 1.00 2.23 H new ATOM 0 HD13 LEU A 28 2.590 4.934 0.572 1.00 2.23 H new ATOM 0 HD21 LEU A 28 3.965 2.915 -1.289 1.00 2.15 H new ATOM 0 HD22 LEU A 28 2.212 2.956 -0.980 1.00 2.15 H new ATOM 0 HD23 LEU A 28 2.824 3.042 -2.649 1.00 2.15 H new ATOM 401 N ARG A 29 2.145 3.807 -5.019 1.00 2.11 N ATOM 402 CA ARG A 29 2.010 2.538 -5.707 1.00 2.02 C ATOM 403 C ARG A 29 2.657 1.439 -4.881 1.00 1.76 C ATOM 404 O ARG A 29 3.805 1.569 -4.451 1.00 1.70 O ATOM 405 CB ARG A 29 2.666 2.609 -7.086 1.00 2.24 C ATOM 406 CG ARG A 29 2.188 3.766 -7.951 1.00 2.78 C ATOM 407 CD ARG A 29 0.733 3.612 -8.358 1.00 2.72 C ATOM 408 NE ARG A 29 0.505 2.368 -9.099 1.00 3.29 N ATOM 409 CZ ARG A 29 -0.522 2.148 -9.922 1.00 3.54 C ATOM 410 NH1 ARG A 29 -1.432 3.091 -10.140 1.00 3.42 N ATOM 411 NH2 ARG A 29 -0.627 0.976 -10.537 1.00 4.22 N ATOM 0 H ARG A 29 2.957 4.355 -5.304 1.00 2.11 H new ATOM 0 HA ARG A 29 0.951 2.316 -5.837 1.00 2.02 H new ATOM 0 HB2 ARG A 29 3.745 2.689 -6.958 1.00 2.24 H new ATOM 0 HB3 ARG A 29 2.476 1.674 -7.614 1.00 2.24 H new ATOM 0 HG2 ARG A 29 2.315 4.702 -7.406 1.00 2.78 H new ATOM 0 HG3 ARG A 29 2.809 3.831 -8.844 1.00 2.78 H new ATOM 0 HD2 ARG A 29 0.103 3.626 -7.469 1.00 2.72 H new ATOM 0 HD3 ARG A 29 0.435 4.461 -8.973 1.00 2.72 H new ATOM 0 HE ARG A 29 1.182 1.615 -8.976 1.00 3.29 H new ATOM 0 HH11 ARG A 29 -1.350 3.996 -9.676 1.00 3.42 H new ATOM 0 HH12 ARG A 29 -2.212 2.910 -10.771 1.00 3.42 H new ATOM 0 HH21 ARG A 29 0.074 0.252 -10.379 1.00 4.22 H new ATOM 0 HH22 ARG A 29 -1.409 0.799 -11.168 1.00 4.22 H new ATOM 425 N PHE A 30 1.918 0.367 -4.659 1.00 1.65 N ATOM 426 CA PHE A 30 2.399 -0.724 -3.836 1.00 1.43 C ATOM 427 C PHE A 30 2.566 -1.977 -4.684 1.00 1.49 C ATOM 428 O PHE A 30 1.667 -2.355 -5.437 1.00 1.69 O ATOM 429 CB PHE A 30 1.404 -0.986 -2.706 1.00 1.35 C ATOM 430 CG PHE A 30 2.038 -1.368 -1.392 1.00 1.14 C ATOM 431 CD1 PHE A 30 2.990 -2.373 -1.324 1.00 1.50 C ATOM 432 CD2 PHE A 30 1.670 -0.722 -0.216 1.00 1.69 C ATOM 433 CE1 PHE A 30 3.559 -2.729 -0.120 1.00 1.47 C ATOM 434 CE2 PHE A 30 2.240 -1.078 0.992 1.00 1.62 C ATOM 435 CZ PHE A 30 3.187 -2.081 1.038 1.00 0.99 C ATOM 0 H PHE A 30 0.981 0.230 -5.039 1.00 1.65 H new ATOM 0 HA PHE A 30 3.366 -0.457 -3.409 1.00 1.43 H new ATOM 0 HB2 PHE A 30 0.799 -0.092 -2.557 1.00 1.35 H new ATOM 0 HB3 PHE A 30 0.726 -1.782 -3.013 1.00 1.35 H new ATOM 0 HD1 PHE A 30 3.290 -2.884 -2.227 1.00 1.50 H new ATOM 0 HD2 PHE A 30 0.932 0.066 -0.247 1.00 1.69 H new ATOM 0 HE1 PHE A 30 4.297 -3.517 -0.084 1.00 1.47 H new ATOM 0 HE2 PHE A 30 1.945 -0.572 1.899 1.00 1.62 H new ATOM 0 HZ PHE A 30 3.636 -2.358 1.980 1.00 0.99 H new ATOM 445 N GLN A 31 3.717 -2.610 -4.569 1.00 1.37 N ATOM 446 CA GLN A 31 3.983 -3.846 -5.276 1.00 1.46 C ATOM 447 C GLN A 31 4.360 -4.927 -4.280 1.00 1.31 C ATOM 448 O GLN A 31 5.422 -4.863 -3.659 1.00 1.14 O ATOM 449 CB GLN A 31 5.107 -3.652 -6.299 1.00 1.58 C ATOM 450 CG GLN A 31 5.445 -4.908 -7.090 1.00 1.74 C ATOM 451 CD GLN A 31 4.498 -5.172 -8.251 1.00 2.14 C ATOM 452 OE1 GLN A 31 3.269 -4.681 -8.158 1.00 2.68 O flip ATOM 453 NE2 GLN A 31 4.878 -5.800 -9.237 1.00 2.52 N flip ATOM 0 H GLN A 31 4.489 -2.284 -3.987 1.00 1.37 H new ATOM 0 HA GLN A 31 3.084 -4.147 -5.813 1.00 1.46 H new ATOM 0 HB2 GLN A 31 4.820 -2.863 -6.994 1.00 1.58 H new ATOM 0 HB3 GLN A 31 6.002 -3.309 -5.780 1.00 1.58 H new ATOM 0 HG2 GLN A 31 6.462 -4.822 -7.474 1.00 1.74 H new ATOM 0 HG3 GLN A 31 5.429 -5.766 -6.417 1.00 1.74 H new ATOM 0 HE21 GLN A 31 5.830 -6.163 -9.274 1.00 2.52 H new ATOM 0 HE22 GLN A 31 4.241 -5.958 -10.018 1.00 2.52 H new ATOM 462 N ALA A 32 3.480 -5.898 -4.106 1.00 1.43 N ATOM 463 CA ALA A 32 3.726 -6.993 -3.186 1.00 1.36 C ATOM 464 C ALA A 32 3.017 -8.258 -3.656 1.00 1.55 C ATOM 465 O ALA A 32 1.830 -8.229 -3.978 1.00 1.69 O ATOM 466 CB ALA A 32 3.266 -6.622 -1.784 1.00 1.25 C ATOM 0 H ALA A 32 2.585 -5.949 -4.593 1.00 1.43 H new ATOM 0 HA ALA A 32 4.799 -7.186 -3.162 1.00 1.36 H new ATOM 0 HB1 ALA A 32 3.457 -7.454 -1.106 1.00 1.25 H new ATOM 0 HB2 ALA A 32 3.812 -5.743 -1.443 1.00 1.25 H new ATOM 0 HB3 ALA A 32 2.198 -6.403 -1.797 1.00 1.25 H new ATOM 472 N PRO A 33 3.745 -9.379 -3.708 1.00 1.60 N ATOM 473 CA PRO A 33 3.177 -10.669 -4.080 1.00 1.79 C ATOM 474 C PRO A 33 2.222 -11.193 -3.004 1.00 1.78 C ATOM 475 O PRO A 33 2.282 -10.785 -1.840 1.00 1.62 O ATOM 476 CB PRO A 33 4.401 -11.583 -4.229 1.00 1.82 C ATOM 477 CG PRO A 33 5.479 -10.938 -3.428 1.00 1.84 C ATOM 478 CD PRO A 33 5.178 -9.466 -3.397 1.00 1.52 C ATOM 0 HA PRO A 33 2.581 -10.613 -4.991 1.00 1.79 H new ATOM 0 HB2 PRO A 33 4.188 -12.587 -3.863 1.00 1.82 H new ATOM 0 HB3 PRO A 33 4.693 -11.680 -5.275 1.00 1.82 H new ATOM 0 HG2 PRO A 33 5.508 -11.348 -2.418 1.00 1.84 H new ATOM 0 HG3 PRO A 33 6.456 -11.123 -3.875 1.00 1.84 H new ATOM 0 HD2 PRO A 33 5.399 -9.036 -2.420 1.00 1.52 H new ATOM 0 HD3 PRO A 33 5.777 -8.923 -4.128 1.00 1.52 H new ATOM 486 N PRO A 34 1.312 -12.091 -3.383 1.00 1.96 N ATOM 487 CA PRO A 34 0.304 -12.620 -2.471 1.00 1.97 C ATOM 488 C PRO A 34 0.921 -13.425 -1.327 1.00 1.88 C ATOM 489 O PRO A 34 1.663 -14.381 -1.551 1.00 1.95 O ATOM 490 CB PRO A 34 -0.569 -13.513 -3.359 1.00 2.20 C ATOM 491 CG PRO A 34 0.251 -13.803 -4.571 1.00 2.31 C ATOM 492 CD PRO A 34 1.203 -12.650 -4.734 1.00 2.19 C ATOM 0 HA PRO A 34 -0.257 -11.822 -1.983 1.00 1.97 H new ATOM 0 HB2 PRO A 34 -0.842 -14.433 -2.842 1.00 2.20 H new ATOM 0 HB3 PRO A 34 -1.498 -13.010 -3.626 1.00 2.20 H new ATOM 0 HG2 PRO A 34 0.795 -14.741 -4.455 1.00 2.31 H new ATOM 0 HG3 PRO A 34 -0.383 -13.909 -5.451 1.00 2.31 H new ATOM 0 HD2 PRO A 34 2.171 -12.981 -5.109 1.00 2.19 H new ATOM 0 HD3 PRO A 34 0.822 -11.914 -5.442 1.00 2.19 H new ATOM 500 N GLY A 35 0.624 -13.009 -0.099 1.00 1.76 N ATOM 501 CA GLY A 35 1.072 -13.745 1.066 1.00 1.72 C ATOM 502 C GLY A 35 2.123 -13.003 1.874 1.00 1.60 C ATOM 503 O GLY A 35 2.388 -13.356 3.021 1.00 1.71 O ATOM 0 H GLY A 35 0.079 -12.172 0.108 1.00 1.76 H new ATOM 0 HA2 GLY A 35 0.215 -13.958 1.705 1.00 1.72 H new ATOM 0 HA3 GLY A 35 1.478 -14.705 0.747 1.00 1.72 H new ATOM 507 N VAL A 36 2.725 -11.972 1.293 1.00 1.46 N ATOM 508 CA VAL A 36 3.789 -11.244 1.983 1.00 1.34 C ATOM 509 C VAL A 36 3.289 -9.947 2.602 1.00 1.22 C ATOM 510 O VAL A 36 4.001 -9.286 3.346 1.00 1.22 O ATOM 511 CB VAL A 36 4.957 -10.913 1.045 1.00 1.31 C ATOM 512 CG1 VAL A 36 5.491 -12.179 0.405 1.00 1.49 C ATOM 513 CG2 VAL A 36 4.546 -9.897 -0.003 1.00 1.25 C ATOM 0 H VAL A 36 2.501 -11.623 0.361 1.00 1.46 H new ATOM 0 HA VAL A 36 4.134 -11.910 2.774 1.00 1.34 H new ATOM 0 HB VAL A 36 5.757 -10.465 1.635 1.00 1.31 H new ATOM 0 HG11 VAL A 36 6.319 -11.930 -0.258 1.00 1.49 H new ATOM 0 HG12 VAL A 36 5.840 -12.860 1.181 1.00 1.49 H new ATOM 0 HG13 VAL A 36 4.698 -12.659 -0.169 1.00 1.49 H new ATOM 0 HG21 VAL A 36 5.394 -9.682 -0.653 1.00 1.25 H new ATOM 0 HG22 VAL A 36 3.726 -10.299 -0.597 1.00 1.25 H new ATOM 0 HG23 VAL A 36 4.223 -8.979 0.487 1.00 1.25 H new ATOM 523 N MET A 37 2.059 -9.592 2.293 1.00 1.18 N ATOM 524 CA MET A 37 1.495 -8.316 2.731 1.00 1.11 C ATOM 525 C MET A 37 0.876 -8.427 4.124 1.00 1.14 C ATOM 526 O MET A 37 0.039 -7.613 4.510 1.00 1.18 O ATOM 527 CB MET A 37 0.461 -7.813 1.715 1.00 1.19 C ATOM 528 CG MET A 37 0.139 -6.325 1.838 1.00 1.18 C ATOM 529 SD MET A 37 1.288 -5.254 0.934 1.00 1.41 S ATOM 530 CE MET A 37 2.871 -5.606 1.708 1.00 0.92 C ATOM 0 H MET A 37 1.423 -10.166 1.739 1.00 1.18 H new ATOM 0 HA MET A 37 2.308 -7.592 2.790 1.00 1.11 H new ATOM 0 HB2 MET A 37 0.830 -8.012 0.709 1.00 1.19 H new ATOM 0 HB3 MET A 37 -0.459 -8.384 1.836 1.00 1.19 H new ATOM 0 HG2 MET A 37 -0.872 -6.150 1.471 1.00 1.18 H new ATOM 0 HG3 MET A 37 0.149 -6.046 2.892 1.00 1.18 H new ATOM 0 HE1 MET A 37 3.617 -4.897 1.349 1.00 0.92 H new ATOM 0 HE2 MET A 37 2.775 -5.515 2.790 1.00 0.92 H new ATOM 0 HE3 MET A 37 3.182 -6.620 1.455 1.00 0.92 H new ATOM 540 N THR A 38 1.295 -9.441 4.871 1.00 1.18 N ATOM 541 CA THR A 38 0.769 -9.682 6.204 1.00 1.27 C ATOM 542 C THR A 38 0.946 -8.451 7.099 1.00 1.26 C ATOM 543 O THR A 38 1.926 -7.710 6.959 1.00 1.16 O ATOM 544 CB THR A 38 1.461 -10.899 6.845 1.00 1.37 C ATOM 545 OG1 THR A 38 2.880 -10.809 6.651 1.00 1.35 O ATOM 546 CG2 THR A 38 0.944 -12.193 6.237 1.00 1.45 C ATOM 0 H THR A 38 2.002 -10.112 4.572 1.00 1.18 H new ATOM 0 HA THR A 38 -0.297 -9.888 6.108 1.00 1.27 H new ATOM 0 HB THR A 38 1.237 -10.901 7.912 1.00 1.37 H new ATOM 0 HG1 THR A 38 3.316 -11.584 7.062 1.00 1.35 H new ATOM 0 HG21 THR A 38 1.446 -13.040 6.704 1.00 1.45 H new ATOM 0 HG22 THR A 38 -0.130 -12.270 6.405 1.00 1.45 H new ATOM 0 HG23 THR A 38 1.145 -12.198 5.166 1.00 1.45 H new ATOM 554 N PRO A 39 -0.011 -8.204 8.012 1.00 1.41 N ATOM 555 CA PRO A 39 0.018 -7.038 8.904 1.00 1.46 C ATOM 556 C PRO A 39 1.345 -6.886 9.647 1.00 1.43 C ATOM 557 O PRO A 39 1.832 -5.768 9.828 1.00 1.40 O ATOM 558 CB PRO A 39 -1.118 -7.314 9.887 1.00 1.69 C ATOM 559 CG PRO A 39 -2.063 -8.180 9.132 1.00 1.72 C ATOM 560 CD PRO A 39 -1.209 -9.036 8.239 1.00 1.56 C ATOM 0 HA PRO A 39 -0.093 -6.107 8.348 1.00 1.46 H new ATOM 0 HB2 PRO A 39 -0.753 -7.813 10.785 1.00 1.69 H new ATOM 0 HB3 PRO A 39 -1.598 -6.390 10.209 1.00 1.69 H new ATOM 0 HG2 PRO A 39 -2.658 -8.793 9.809 1.00 1.72 H new ATOM 0 HG3 PRO A 39 -2.761 -7.581 8.548 1.00 1.72 H new ATOM 0 HD2 PRO A 39 -0.956 -9.984 8.713 1.00 1.56 H new ATOM 0 HD3 PRO A 39 -1.717 -9.273 7.304 1.00 1.56 H new ATOM 568 N GLU A 40 1.925 -8.007 10.067 1.00 1.49 N ATOM 569 CA GLU A 40 3.221 -7.990 10.735 1.00 1.53 C ATOM 570 C GLU A 40 4.279 -7.382 9.825 1.00 1.32 C ATOM 571 O GLU A 40 5.029 -6.498 10.238 1.00 1.29 O ATOM 572 CB GLU A 40 3.644 -9.400 11.152 1.00 1.71 C ATOM 573 CG GLU A 40 4.984 -9.437 11.868 1.00 1.94 C ATOM 574 CD GLU A 40 5.450 -10.841 12.180 1.00 2.17 C ATOM 575 OE1 GLU A 40 6.043 -11.485 11.289 1.00 2.76 O ATOM 576 OE2 GLU A 40 5.244 -11.300 13.327 1.00 2.48 O ATOM 0 H GLU A 40 1.519 -8.936 9.957 1.00 1.49 H new ATOM 0 HA GLU A 40 3.126 -7.379 11.632 1.00 1.53 H new ATOM 0 HB2 GLU A 40 2.880 -9.824 11.803 1.00 1.71 H new ATOM 0 HB3 GLU A 40 3.695 -10.034 10.267 1.00 1.71 H new ATOM 0 HG2 GLU A 40 5.733 -8.941 11.251 1.00 1.94 H new ATOM 0 HG3 GLU A 40 4.909 -8.870 12.796 1.00 1.94 H new ATOM 583 N LEU A 41 4.318 -7.840 8.576 1.00 1.20 N ATOM 584 CA LEU A 41 5.300 -7.357 7.614 1.00 1.02 C ATOM 585 C LEU A 41 5.097 -5.885 7.338 1.00 0.89 C ATOM 586 O LEU A 41 6.054 -5.116 7.250 1.00 0.81 O ATOM 587 CB LEU A 41 5.198 -8.110 6.299 1.00 0.97 C ATOM 588 CG LEU A 41 6.341 -7.831 5.321 1.00 0.87 C ATOM 589 CD1 LEU A 41 6.845 -9.126 4.717 1.00 1.11 C ATOM 590 CD2 LEU A 41 5.889 -6.872 4.231 1.00 0.83 C ATOM 0 H LEU A 41 3.680 -8.545 8.208 1.00 1.20 H new ATOM 0 HA LEU A 41 6.285 -7.522 8.051 1.00 1.02 H new ATOM 0 HB2 LEU A 41 5.168 -9.179 6.508 1.00 0.97 H new ATOM 0 HB3 LEU A 41 4.254 -7.852 5.819 1.00 0.97 H new ATOM 0 HG LEU A 41 7.159 -7.364 5.869 1.00 0.87 H new ATOM 0 HD11 LEU A 41 7.658 -8.912 4.023 1.00 1.11 H new ATOM 0 HD12 LEU A 41 7.207 -9.780 5.510 1.00 1.11 H new ATOM 0 HD13 LEU A 41 6.033 -9.619 4.183 1.00 1.11 H new ATOM 0 HD21 LEU A 41 6.715 -6.685 3.545 1.00 0.83 H new ATOM 0 HD22 LEU A 41 5.055 -7.311 3.684 1.00 0.83 H new ATOM 0 HD23 LEU A 41 5.573 -5.932 4.682 1.00 0.83 H new ATOM 602 N GLN A 42 3.841 -5.503 7.184 1.00 0.95 N ATOM 603 CA GLN A 42 3.491 -4.119 6.937 1.00 0.95 C ATOM 604 C GLN A 42 4.035 -3.233 8.056 1.00 0.97 C ATOM 605 O GLN A 42 4.546 -2.139 7.811 1.00 0.97 O ATOM 606 CB GLN A 42 1.977 -3.975 6.841 1.00 1.13 C ATOM 607 CG GLN A 42 1.532 -2.590 6.406 1.00 1.33 C ATOM 608 CD GLN A 42 1.936 -2.228 4.980 1.00 1.41 C ATOM 609 OE1 GLN A 42 2.232 -1.065 4.685 1.00 2.06 O ATOM 610 NE2 GLN A 42 1.915 -3.197 4.078 1.00 1.57 N ATOM 0 H GLN A 42 3.044 -6.138 7.226 1.00 0.95 H new ATOM 0 HA GLN A 42 3.936 -3.804 5.993 1.00 0.95 H new ATOM 0 HB2 GLN A 42 1.593 -4.711 6.135 1.00 1.13 H new ATOM 0 HB3 GLN A 42 1.535 -4.203 7.811 1.00 1.13 H new ATOM 0 HG2 GLN A 42 0.448 -2.524 6.493 1.00 1.33 H new ATOM 0 HG3 GLN A 42 1.952 -1.853 7.090 1.00 1.33 H new ATOM 0 HE21 GLN A 42 1.666 -4.147 4.355 1.00 1.57 H new ATOM 0 HE22 GLN A 42 2.148 -2.994 3.106 1.00 1.57 H new ATOM 619 N SER A 43 3.935 -3.728 9.283 1.00 1.06 N ATOM 620 CA SER A 43 4.449 -3.017 10.443 1.00 1.12 C ATOM 621 C SER A 43 5.981 -3.063 10.461 1.00 1.02 C ATOM 622 O SER A 43 6.628 -2.149 10.970 1.00 1.08 O ATOM 623 CB SER A 43 3.873 -3.622 11.724 1.00 1.29 C ATOM 624 OG SER A 43 3.958 -2.709 12.810 1.00 1.57 O ATOM 0 H SER A 43 3.500 -4.625 9.500 1.00 1.06 H new ATOM 0 HA SER A 43 4.141 -1.973 10.384 1.00 1.12 H new ATOM 0 HB2 SER A 43 2.832 -3.901 11.561 1.00 1.29 H new ATOM 0 HB3 SER A 43 4.413 -4.536 11.972 1.00 1.29 H new ATOM 0 HG SER A 43 3.581 -3.122 13.615 1.00 1.57 H new ATOM 630 N ARG A 44 6.552 -4.133 9.901 1.00 0.97 N ATOM 631 CA ARG A 44 8.006 -4.266 9.797 1.00 0.98 C ATOM 632 C ARG A 44 8.573 -3.212 8.866 1.00 0.90 C ATOM 633 O ARG A 44 9.646 -2.666 9.108 1.00 1.04 O ATOM 634 CB ARG A 44 8.386 -5.657 9.291 1.00 1.09 C ATOM 635 CG ARG A 44 8.072 -6.755 10.279 1.00 1.26 C ATOM 636 CD ARG A 44 8.882 -6.588 11.549 1.00 1.51 C ATOM 637 NE ARG A 44 10.320 -6.760 11.317 1.00 1.90 N ATOM 638 CZ ARG A 44 11.240 -5.834 11.606 1.00 2.59 C ATOM 639 NH1 ARG A 44 10.880 -4.685 12.164 1.00 3.00 N ATOM 640 NH2 ARG A 44 12.520 -6.061 11.339 1.00 3.34 N ATOM 0 H ARG A 44 6.029 -4.918 9.513 1.00 0.97 H new ATOM 0 HA ARG A 44 8.428 -4.125 10.792 1.00 0.98 H new ATOM 0 HB2 ARG A 44 7.858 -5.854 8.358 1.00 1.09 H new ATOM 0 HB3 ARG A 44 9.452 -5.675 9.064 1.00 1.09 H new ATOM 0 HG2 ARG A 44 7.008 -6.742 10.517 1.00 1.26 H new ATOM 0 HG3 ARG A 44 8.287 -7.725 9.831 1.00 1.26 H new ATOM 0 HD2 ARG A 44 8.699 -5.598 11.967 1.00 1.51 H new ATOM 0 HD3 ARG A 44 8.546 -7.313 12.290 1.00 1.51 H new ATOM 0 HE ARG A 44 10.638 -7.640 10.910 1.00 1.90 H new ATOM 0 HH11 ARG A 44 9.898 -4.506 12.374 1.00 3.00 H new ATOM 0 HH12 ARG A 44 11.585 -3.981 12.383 1.00 3.00 H new ATOM 0 HH21 ARG A 44 12.803 -6.943 10.913 1.00 3.34 H new ATOM 0 HH22 ARG A 44 13.220 -5.353 11.560 1.00 3.34 H new ATOM 654 N LEU A 45 7.833 -2.941 7.798 1.00 0.78 N ATOM 655 CA LEU A 45 8.170 -1.868 6.858 1.00 0.80 C ATOM 656 C LEU A 45 8.261 -0.532 7.598 1.00 1.06 C ATOM 657 O LEU A 45 8.914 0.406 7.143 1.00 1.25 O ATOM 658 CB LEU A 45 7.117 -1.785 5.738 1.00 0.77 C ATOM 659 CG LEU A 45 6.931 -3.062 4.902 1.00 0.64 C ATOM 660 CD1 LEU A 45 5.708 -2.951 4.006 1.00 0.78 C ATOM 661 CD2 LEU A 45 8.153 -3.337 4.045 1.00 0.54 C ATOM 0 H LEU A 45 6.985 -3.454 7.556 1.00 0.78 H new ATOM 0 HA LEU A 45 9.138 -2.089 6.408 1.00 0.80 H new ATOM 0 HB2 LEU A 45 6.158 -1.522 6.185 1.00 0.77 H new ATOM 0 HB3 LEU A 45 7.390 -0.970 5.067 1.00 0.77 H new ATOM 0 HG LEU A 45 6.792 -3.888 5.600 1.00 0.64 H new ATOM 0 HD11 LEU A 45 5.598 -3.867 3.425 1.00 0.78 H new ATOM 0 HD12 LEU A 45 4.820 -2.802 4.620 1.00 0.78 H new ATOM 0 HD13 LEU A 45 5.828 -2.105 3.330 1.00 0.78 H new ATOM 0 HD21 LEU A 45 7.993 -4.246 3.465 1.00 0.54 H new ATOM 0 HD22 LEU A 45 8.319 -2.499 3.368 1.00 0.54 H new ATOM 0 HD23 LEU A 45 9.026 -3.464 4.686 1.00 0.54 H new ATOM 673 N GLY A 46 7.552 -0.448 8.717 1.00 1.20 N ATOM 674 CA GLY A 46 7.690 0.679 9.619 1.00 1.56 C ATOM 675 C GLY A 46 6.827 1.854 9.230 1.00 1.89 C ATOM 676 O GLY A 46 6.501 2.697 10.067 1.00 2.30 O ATOM 0 H GLY A 46 6.876 -1.150 9.018 1.00 1.20 H new ATOM 0 HA2 GLY A 46 7.430 0.363 10.629 1.00 1.56 H new ATOM 0 HA3 GLY A 46 8.733 0.993 9.642 1.00 1.56 H new ATOM 680 N GLY A 47 6.456 1.914 7.957 1.00 1.84 N ATOM 681 CA GLY A 47 5.636 3.005 7.477 1.00 2.25 C ATOM 682 C GLY A 47 6.376 4.326 7.511 1.00 2.18 C ATOM 683 O GLY A 47 5.763 5.387 7.601 1.00 2.57 O ATOM 0 H GLY A 47 6.710 1.225 7.249 1.00 1.84 H new ATOM 0 HA2 GLY A 47 5.314 2.796 6.457 1.00 2.25 H new ATOM 0 HA3 GLY A 47 4.735 3.078 8.087 1.00 2.25 H new ATOM 687 N ALA A 48 7.696 4.259 7.435 1.00 1.86 N ATOM 688 CA ALA A 48 8.517 5.443 7.520 1.00 2.02 C ATOM 689 C ALA A 48 8.920 5.918 6.134 1.00 2.08 C ATOM 690 O ALA A 48 9.099 5.117 5.217 1.00 1.94 O ATOM 691 CB ALA A 48 9.745 5.148 8.361 1.00 1.99 C ATOM 0 H ALA A 48 8.217 3.391 7.314 1.00 1.86 H new ATOM 0 HA ALA A 48 7.943 6.240 7.993 1.00 2.02 H new ATOM 0 HB1 ALA A 48 10.365 6.042 8.425 1.00 1.99 H new ATOM 0 HB2 ALA A 48 9.437 4.847 9.362 1.00 1.99 H new ATOM 0 HB3 ALA A 48 10.317 4.342 7.900 1.00 1.99 H new ATOM 697 N ARG A 49 9.090 7.223 6.008 1.00 2.37 N ATOM 698 CA ARG A 49 9.456 7.845 4.741 1.00 2.47 C ATOM 699 C ARG A 49 10.876 7.474 4.335 1.00 2.33 C ATOM 700 O ARG A 49 11.116 7.082 3.197 1.00 2.17 O ATOM 701 CB ARG A 49 9.324 9.368 4.831 1.00 2.87 C ATOM 702 CG ARG A 49 10.023 9.962 6.040 1.00 3.30 C ATOM 703 CD ARG A 49 9.036 10.357 7.114 1.00 3.76 C ATOM 704 NE ARG A 49 9.703 10.825 8.325 1.00 4.15 N ATOM 705 CZ ARG A 49 9.072 11.027 9.481 1.00 4.69 C ATOM 706 NH1 ARG A 49 7.762 10.838 9.565 1.00 4.89 N ATOM 707 NH2 ARG A 49 9.744 11.438 10.547 1.00 5.36 N ATOM 0 H ARG A 49 8.979 7.883 6.778 1.00 2.37 H new ATOM 0 HA ARG A 49 8.771 7.472 3.980 1.00 2.47 H new ATOM 0 HB2 ARG A 49 9.736 9.815 3.926 1.00 2.87 H new ATOM 0 HB3 ARG A 49 8.267 9.633 4.865 1.00 2.87 H new ATOM 0 HG2 ARG A 49 10.731 9.238 6.444 1.00 3.30 H new ATOM 0 HG3 ARG A 49 10.599 10.836 5.735 1.00 3.30 H new ATOM 0 HD2 ARG A 49 8.382 11.142 6.734 1.00 3.76 H new ATOM 0 HD3 ARG A 49 8.403 9.503 7.356 1.00 3.76 H new ATOM 0 HE ARG A 49 10.706 11.007 8.284 1.00 4.15 H new ATOM 0 HH11 ARG A 49 7.236 10.538 8.744 1.00 4.89 H new ATOM 0 HH12 ARG A 49 7.280 10.993 10.451 1.00 4.89 H new ATOM 0 HH21 ARG A 49 10.749 11.601 10.485 1.00 5.36 H new ATOM 0 HH22 ARG A 49 9.256 11.591 11.430 1.00 5.36 H new ATOM 721 N HIS A 50 11.809 7.570 5.279 1.00 2.45 N ATOM 722 CA HIS A 50 13.214 7.327 4.982 1.00 2.44 C ATOM 723 C HIS A 50 13.422 5.866 4.610 1.00 2.06 C ATOM 724 O HIS A 50 14.255 5.531 3.767 1.00 1.95 O ATOM 725 CB HIS A 50 14.115 7.718 6.167 1.00 2.74 C ATOM 726 CG HIS A 50 13.705 7.104 7.470 1.00 2.77 C ATOM 727 ND1 HIS A 50 13.898 5.778 7.769 1.00 2.59 N ATOM 728 CD2 HIS A 50 13.044 7.633 8.525 1.00 2.99 C ATOM 729 CE1 HIS A 50 13.362 5.511 8.939 1.00 2.68 C ATOM 730 NE2 HIS A 50 12.843 6.621 9.427 1.00 2.91 N ATOM 0 H HIS A 50 11.617 7.813 6.251 1.00 2.45 H new ATOM 0 HA HIS A 50 13.496 7.953 4.135 1.00 2.44 H new ATOM 0 HB2 HIS A 50 15.140 7.423 5.944 1.00 2.74 H new ATOM 0 HB3 HIS A 50 14.111 8.803 6.271 1.00 2.74 H new ATOM 0 HD2 HIS A 50 12.733 8.661 8.636 1.00 2.99 H new ATOM 0 HE1 HIS A 50 13.349 4.544 9.420 1.00 2.68 H new ATOM 0 HE2 HIS A 50 12.370 6.711 10.326 1.00 2.91 H new ATOM 739 N GLU A 51 12.628 5.005 5.233 1.00 1.91 N ATOM 740 CA GLU A 51 12.703 3.581 4.989 1.00 1.65 C ATOM 741 C GLU A 51 12.262 3.288 3.571 1.00 1.36 C ATOM 742 O GLU A 51 12.882 2.502 2.860 1.00 1.19 O ATOM 743 CB GLU A 51 11.812 2.834 5.973 1.00 1.68 C ATOM 744 CG GLU A 51 12.489 1.639 6.598 1.00 1.72 C ATOM 745 CD GLU A 51 13.719 2.040 7.385 1.00 2.19 C ATOM 746 OE1 GLU A 51 13.562 2.506 8.532 1.00 2.75 O ATOM 747 OE2 GLU A 51 14.844 1.933 6.845 1.00 2.54 O ATOM 0 H GLU A 51 11.921 5.277 5.916 1.00 1.91 H new ATOM 0 HA GLU A 51 13.732 3.248 5.124 1.00 1.65 H new ATOM 0 HB2 GLU A 51 11.498 3.519 6.761 1.00 1.68 H new ATOM 0 HB3 GLU A 51 10.910 2.504 5.458 1.00 1.68 H new ATOM 0 HG2 GLU A 51 11.787 1.126 7.256 1.00 1.72 H new ATOM 0 HG3 GLU A 51 12.771 0.931 5.818 1.00 1.72 H new ATOM 754 N LEU A 52 11.193 3.952 3.163 1.00 1.41 N ATOM 755 CA LEU A 52 10.653 3.774 1.824 1.00 1.31 C ATOM 756 C LEU A 52 11.605 4.323 0.772 1.00 1.37 C ATOM 757 O LEU A 52 11.630 3.842 -0.360 1.00 1.27 O ATOM 758 CB LEU A 52 9.287 4.442 1.683 1.00 1.57 C ATOM 759 CG LEU A 52 8.179 3.850 2.550 1.00 1.56 C ATOM 760 CD1 LEU A 52 6.859 4.537 2.254 1.00 1.90 C ATOM 761 CD2 LEU A 52 8.070 2.347 2.328 1.00 1.33 C ATOM 0 H LEU A 52 10.681 4.620 3.740 1.00 1.41 H new ATOM 0 HA LEU A 52 10.534 2.702 1.665 1.00 1.31 H new ATOM 0 HB2 LEU A 52 9.391 5.499 1.927 1.00 1.57 H new ATOM 0 HB3 LEU A 52 8.979 4.385 0.639 1.00 1.57 H new ATOM 0 HG LEU A 52 8.428 4.018 3.598 1.00 1.56 H new ATOM 0 HD11 LEU A 52 6.076 4.106 2.879 1.00 1.90 H new ATOM 0 HD12 LEU A 52 6.948 5.602 2.467 1.00 1.90 H new ATOM 0 HD13 LEU A 52 6.603 4.397 1.204 1.00 1.90 H new ATOM 0 HD21 LEU A 52 7.275 1.943 2.955 1.00 1.33 H new ATOM 0 HD22 LEU A 52 7.842 2.150 1.281 1.00 1.33 H new ATOM 0 HD23 LEU A 52 9.015 1.871 2.590 1.00 1.33 H new ATOM 773 N ILE A 53 12.383 5.332 1.143 1.00 1.59 N ATOM 774 CA ILE A 53 13.404 5.869 0.254 1.00 1.69 C ATOM 775 C ILE A 53 14.387 4.767 -0.132 1.00 1.43 C ATOM 776 O ILE A 53 14.646 4.530 -1.314 1.00 1.32 O ATOM 777 CB ILE A 53 14.172 7.041 0.908 1.00 2.06 C ATOM 778 CG1 ILE A 53 13.222 8.202 1.210 1.00 2.36 C ATOM 779 CG2 ILE A 53 15.305 7.506 0.004 1.00 2.17 C ATOM 780 CD1 ILE A 53 13.877 9.356 1.942 1.00 2.74 C ATOM 0 H ILE A 53 12.327 5.794 2.051 1.00 1.59 H new ATOM 0 HA ILE A 53 12.903 6.249 -0.636 1.00 1.69 H new ATOM 0 HB ILE A 53 14.600 6.690 1.847 1.00 2.06 H new ATOM 0 HG12 ILE A 53 12.803 8.569 0.273 1.00 2.36 H new ATOM 0 HG13 ILE A 53 12.389 7.831 1.807 1.00 2.36 H new ATOM 0 HG21 ILE A 53 15.835 8.331 0.480 1.00 2.17 H new ATOM 0 HG22 ILE A 53 15.997 6.681 -0.166 1.00 2.17 H new ATOM 0 HG23 ILE A 53 14.896 7.839 -0.950 1.00 2.17 H new ATOM 0 HD11 ILE A 53 13.140 10.139 2.120 1.00 2.74 H new ATOM 0 HD12 ILE A 53 14.271 9.005 2.896 1.00 2.74 H new ATOM 0 HD13 ILE A 53 14.692 9.755 1.338 1.00 2.74 H new ATOM 792 N ALA A 54 14.908 4.081 0.876 1.00 1.41 N ATOM 793 CA ALA A 54 15.825 2.965 0.660 1.00 1.31 C ATOM 794 C ALA A 54 15.098 1.779 0.038 1.00 1.00 C ATOM 795 O ALA A 54 15.677 1.012 -0.732 1.00 0.95 O ATOM 796 CB ALA A 54 16.472 2.562 1.975 1.00 1.50 C ATOM 0 H ALA A 54 14.711 4.278 1.857 1.00 1.41 H new ATOM 0 HA ALA A 54 16.603 3.285 -0.033 1.00 1.31 H new ATOM 0 HB1 ALA A 54 17.154 1.729 1.805 1.00 1.50 H new ATOM 0 HB2 ALA A 54 17.026 3.408 2.382 1.00 1.50 H new ATOM 0 HB3 ALA A 54 15.700 2.260 2.683 1.00 1.50 H new ATOM 802 N LEU A 55 13.818 1.659 0.355 1.00 0.89 N ATOM 803 CA LEU A 55 12.999 0.543 -0.096 1.00 0.74 C ATOM 804 C LEU A 55 12.770 0.649 -1.598 1.00 0.70 C ATOM 805 O LEU A 55 12.825 -0.338 -2.320 1.00 0.73 O ATOM 806 CB LEU A 55 11.666 0.547 0.675 1.00 0.84 C ATOM 807 CG LEU A 55 10.770 -0.693 0.530 1.00 0.76 C ATOM 808 CD1 LEU A 55 10.077 -0.720 -0.822 1.00 1.32 C ATOM 809 CD2 LEU A 55 11.580 -1.963 0.743 1.00 1.01 C ATOM 0 H LEU A 55 13.317 2.333 0.933 1.00 0.89 H new ATOM 0 HA LEU A 55 13.509 -0.400 0.102 1.00 0.74 H new ATOM 0 HB2 LEU A 55 11.888 0.682 1.734 1.00 0.84 H new ATOM 0 HB3 LEU A 55 11.093 1.418 0.356 1.00 0.84 H new ATOM 0 HG LEU A 55 9.998 -0.640 1.297 1.00 0.76 H new ATOM 0 HD11 LEU A 55 9.451 -1.610 -0.892 1.00 1.32 H new ATOM 0 HD12 LEU A 55 9.457 0.170 -0.931 1.00 1.32 H new ATOM 0 HD13 LEU A 55 10.825 -0.739 -1.614 1.00 1.32 H new ATOM 0 HD21 LEU A 55 10.930 -2.831 0.637 1.00 1.01 H new ATOM 0 HD22 LEU A 55 12.378 -2.014 0.002 1.00 1.01 H new ATOM 0 HD23 LEU A 55 12.014 -1.955 1.743 1.00 1.01 H new ATOM 821 N LEU A 56 12.532 1.856 -2.065 1.00 0.81 N ATOM 822 CA LEU A 56 12.320 2.096 -3.467 1.00 0.89 C ATOM 823 C LEU A 56 13.661 2.124 -4.191 1.00 0.83 C ATOM 824 O LEU A 56 13.765 1.726 -5.349 1.00 0.90 O ATOM 825 CB LEU A 56 11.555 3.405 -3.615 1.00 1.13 C ATOM 826 CG LEU A 56 11.889 4.232 -4.836 1.00 1.15 C ATOM 827 CD1 LEU A 56 11.378 3.570 -6.107 1.00 1.28 C ATOM 828 CD2 LEU A 56 11.321 5.633 -4.693 1.00 1.68 C ATOM 0 H LEU A 56 12.481 2.692 -1.482 1.00 0.81 H new ATOM 0 HA LEU A 56 11.731 1.298 -3.919 1.00 0.89 H new ATOM 0 HB2 LEU A 56 10.489 3.180 -3.633 1.00 1.13 H new ATOM 0 HB3 LEU A 56 11.737 4.012 -2.728 1.00 1.13 H new ATOM 0 HG LEU A 56 12.974 4.301 -4.913 1.00 1.15 H new ATOM 0 HD11 LEU A 56 11.633 4.189 -6.967 1.00 1.28 H new ATOM 0 HD12 LEU A 56 11.839 2.588 -6.216 1.00 1.28 H new ATOM 0 HD13 LEU A 56 10.295 3.458 -6.049 1.00 1.28 H new ATOM 0 HD21 LEU A 56 11.569 6.218 -5.579 1.00 1.68 H new ATOM 0 HD22 LEU A 56 10.238 5.577 -4.586 1.00 1.68 H new ATOM 0 HD23 LEU A 56 11.749 6.111 -3.811 1.00 1.68 H new ATOM 840 N ARG A 57 14.699 2.554 -3.487 1.00 0.82 N ATOM 841 CA ARG A 57 16.042 2.570 -4.049 1.00 0.88 C ATOM 842 C ARG A 57 16.538 1.144 -4.282 1.00 0.87 C ATOM 843 O ARG A 57 17.426 0.911 -5.102 1.00 0.98 O ATOM 844 CB ARG A 57 16.996 3.330 -3.122 1.00 1.09 C ATOM 845 CG ARG A 57 18.402 3.476 -3.681 1.00 1.53 C ATOM 846 CD ARG A 57 19.249 4.399 -2.824 1.00 1.95 C ATOM 847 NE ARG A 57 18.712 5.761 -2.802 1.00 2.59 N ATOM 848 CZ ARG A 57 19.263 6.775 -2.135 1.00 3.23 C ATOM 849 NH1 ARG A 57 20.387 6.599 -1.455 1.00 3.41 N ATOM 850 NH2 ARG A 57 18.694 7.972 -2.176 1.00 4.07 N ATOM 0 H ARG A 57 14.637 2.896 -2.528 1.00 0.82 H new ATOM 0 HA ARG A 57 16.013 3.084 -5.010 1.00 0.88 H new ATOM 0 HB2 ARG A 57 16.587 4.321 -2.927 1.00 1.09 H new ATOM 0 HB3 ARG A 57 17.047 2.813 -2.164 1.00 1.09 H new ATOM 0 HG2 ARG A 57 18.875 2.496 -3.739 1.00 1.53 H new ATOM 0 HG3 ARG A 57 18.352 3.866 -4.698 1.00 1.53 H new ATOM 0 HD2 ARG A 57 19.296 4.010 -1.807 1.00 1.95 H new ATOM 0 HD3 ARG A 57 20.270 4.416 -3.206 1.00 1.95 H new ATOM 0 HE ARG A 57 17.860 5.946 -3.332 1.00 2.59 H new ATOM 0 HH11 ARG A 57 20.836 5.683 -1.440 1.00 3.41 H new ATOM 0 HH12 ARG A 57 20.803 7.379 -0.947 1.00 3.41 H new ATOM 0 HH21 ARG A 57 17.840 8.112 -2.716 1.00 4.07 H new ATOM 0 HH22 ARG A 57 19.110 8.752 -1.668 1.00 4.07 H new ATOM 864 N GLN A 58 15.938 0.188 -3.576 1.00 0.86 N ATOM 865 CA GLN A 58 16.321 -1.212 -3.705 1.00 1.07 C ATOM 866 C GLN A 58 16.084 -1.712 -5.131 1.00 1.15 C ATOM 867 O GLN A 58 16.784 -2.611 -5.599 1.00 1.40 O ATOM 868 CB GLN A 58 15.557 -2.086 -2.701 1.00 1.15 C ATOM 869 CG GLN A 58 14.303 -2.737 -3.268 1.00 0.96 C ATOM 870 CD GLN A 58 13.449 -3.398 -2.206 1.00 1.15 C ATOM 871 OE1 GLN A 58 13.945 -3.836 -1.174 1.00 1.75 O ATOM 872 NE2 GLN A 58 12.155 -3.496 -2.470 1.00 0.91 N ATOM 0 H GLN A 58 15.185 0.359 -2.910 1.00 0.86 H new ATOM 0 HA GLN A 58 17.386 -1.287 -3.485 1.00 1.07 H new ATOM 0 HB2 GLN A 58 16.224 -2.866 -2.334 1.00 1.15 H new ATOM 0 HB3 GLN A 58 15.279 -1.475 -1.842 1.00 1.15 H new ATOM 0 HG2 GLN A 58 13.711 -1.982 -3.785 1.00 0.96 H new ATOM 0 HG3 GLN A 58 14.590 -3.481 -4.011 1.00 0.96 H new ATOM 0 HE21 GLN A 58 11.782 -3.118 -3.341 1.00 0.91 H new ATOM 0 HE22 GLN A 58 11.531 -3.949 -1.802 1.00 0.91 H new ATOM 881 N LEU A 59 15.105 -1.137 -5.833 1.00 1.05 N ATOM 882 CA LEU A 59 14.853 -1.558 -7.208 1.00 1.27 C ATOM 883 C LEU A 59 15.323 -0.507 -8.215 1.00 1.30 C ATOM 884 O LEU A 59 15.011 -0.588 -9.402 1.00 1.61 O ATOM 885 CB LEU A 59 13.376 -1.985 -7.457 1.00 1.40 C ATOM 886 CG LEU A 59 12.215 -1.017 -7.105 1.00 1.61 C ATOM 887 CD1 LEU A 59 12.028 -0.866 -5.602 1.00 1.94 C ATOM 888 CD2 LEU A 59 12.389 0.342 -7.766 1.00 2.47 C ATOM 0 H LEU A 59 14.492 -0.401 -5.484 1.00 1.05 H new ATOM 0 HA LEU A 59 15.452 -2.455 -7.366 1.00 1.27 H new ATOM 0 HB2 LEU A 59 13.284 -2.229 -8.515 1.00 1.40 H new ATOM 0 HB3 LEU A 59 13.208 -2.907 -6.901 1.00 1.40 H new ATOM 0 HG LEU A 59 11.308 -1.470 -7.505 1.00 1.61 H new ATOM 0 HD11 LEU A 59 11.205 -0.179 -5.405 1.00 1.94 H new ATOM 0 HD12 LEU A 59 11.802 -1.838 -5.164 1.00 1.94 H new ATOM 0 HD13 LEU A 59 12.943 -0.472 -5.159 1.00 1.94 H new ATOM 0 HD21 LEU A 59 11.555 0.989 -7.493 1.00 2.47 H new ATOM 0 HD22 LEU A 59 13.323 0.793 -7.430 1.00 2.47 H new ATOM 0 HD23 LEU A 59 12.414 0.219 -8.849 1.00 2.47 H new ATOM 900 N GLN A 60 16.097 0.463 -7.740 1.00 1.09 N ATOM 901 CA GLN A 60 16.664 1.484 -8.612 1.00 1.19 C ATOM 902 C GLN A 60 18.096 1.118 -8.997 1.00 1.31 C ATOM 903 O GLN A 60 18.926 0.858 -8.126 1.00 1.42 O ATOM 904 CB GLN A 60 16.649 2.853 -7.931 1.00 1.31 C ATOM 905 CG GLN A 60 15.256 3.367 -7.623 1.00 1.43 C ATOM 906 CD GLN A 60 15.273 4.776 -7.069 1.00 1.79 C ATOM 907 OE1 GLN A 60 15.360 4.984 -5.859 1.00 2.58 O ATOM 908 NE2 GLN A 60 15.191 5.754 -7.954 1.00 1.95 N ATOM 0 H GLN A 60 16.346 0.563 -6.756 1.00 1.09 H new ATOM 0 HA GLN A 60 16.051 1.535 -9.512 1.00 1.19 H new ATOM 0 HB2 GLN A 60 17.218 2.793 -7.003 1.00 1.31 H new ATOM 0 HB3 GLN A 60 17.159 3.573 -8.571 1.00 1.31 H new ATOM 0 HG2 GLN A 60 14.653 3.343 -8.531 1.00 1.43 H new ATOM 0 HG3 GLN A 60 14.776 2.702 -6.905 1.00 1.43 H new ATOM 0 HE21 GLN A 60 15.120 5.537 -8.948 1.00 1.95 H new ATOM 0 HE22 GLN A 60 15.198 6.725 -7.643 1.00 1.95 H new ATOM 917 N PRO A 61 18.413 1.102 -10.304 1.00 1.63 N ATOM 918 CA PRO A 61 19.752 0.744 -10.798 1.00 2.01 C ATOM 919 C PRO A 61 20.813 1.805 -10.482 1.00 2.08 C ATOM 920 O PRO A 61 21.945 1.725 -10.959 1.00 2.36 O ATOM 921 CB PRO A 61 19.568 0.629 -12.321 1.00 2.48 C ATOM 922 CG PRO A 61 18.093 0.650 -12.554 1.00 2.40 C ATOM 923 CD PRO A 61 17.495 1.409 -11.409 1.00 1.92 C ATOM 0 HA PRO A 61 20.110 -0.169 -10.322 1.00 2.01 H new ATOM 0 HB2 PRO A 61 20.058 1.455 -12.838 1.00 2.48 H new ATOM 0 HB3 PRO A 61 20.011 -0.292 -12.700 1.00 2.48 H new ATOM 0 HG2 PRO A 61 17.857 1.130 -13.504 1.00 2.40 H new ATOM 0 HG3 PRO A 61 17.693 -0.363 -12.600 1.00 2.40 H new ATOM 0 HD2 PRO A 61 17.449 2.479 -11.612 1.00 1.92 H new ATOM 0 HD3 PRO A 61 16.478 1.082 -11.193 1.00 1.92 H new ATOM 931 N SER A 62 20.444 2.794 -9.680 1.00 2.35 N ATOM 932 CA SER A 62 21.357 3.866 -9.319 1.00 2.77 C ATOM 933 C SER A 62 22.350 3.403 -8.257 1.00 3.39 C ATOM 934 O SER A 62 23.464 3.917 -8.167 1.00 4.06 O ATOM 935 CB SER A 62 20.562 5.072 -8.812 1.00 3.36 C ATOM 936 OG SER A 62 19.567 5.454 -9.753 1.00 3.97 O ATOM 0 H SER A 62 19.515 2.875 -9.266 1.00 2.35 H new ATOM 0 HA SER A 62 21.922 4.154 -10.205 1.00 2.77 H new ATOM 0 HB2 SER A 62 20.093 4.829 -7.859 1.00 3.36 H new ATOM 0 HB3 SER A 62 21.237 5.908 -8.631 1.00 3.36 H new ATOM 0 HG SER A 62 19.070 6.225 -9.409 1.00 3.97 H new ATOM 942 N SER A 63 21.947 2.414 -7.474 1.00 3.76 N ATOM 943 CA SER A 63 22.771 1.935 -6.379 1.00 4.80 C ATOM 944 C SER A 63 23.157 0.475 -6.580 1.00 5.45 C ATOM 945 O SER A 63 22.296 -0.398 -6.703 1.00 5.86 O ATOM 946 CB SER A 63 22.020 2.105 -5.059 1.00 5.50 C ATOM 947 OG SER A 63 21.550 3.436 -4.918 1.00 5.62 O ATOM 0 H SER A 63 21.056 1.929 -7.578 1.00 3.76 H new ATOM 0 HA SER A 63 23.688 2.524 -6.353 1.00 4.80 H new ATOM 0 HB2 SER A 63 21.180 1.411 -5.021 1.00 5.50 H new ATOM 0 HB3 SER A 63 22.677 1.856 -4.226 1.00 5.50 H new ATOM 0 HG SER A 63 22.154 3.936 -4.329 1.00 5.62 H new ATOM 953 N GLN A 64 24.456 0.226 -6.646 1.00 5.91 N ATOM 954 CA GLN A 64 24.973 -1.133 -6.723 1.00 6.83 C ATOM 955 C GLN A 64 25.486 -1.564 -5.352 1.00 7.75 C ATOM 956 O GLN A 64 25.870 -0.726 -4.535 1.00 8.21 O ATOM 957 CB GLN A 64 26.101 -1.247 -7.757 1.00 7.25 C ATOM 958 CG GLN A 64 25.641 -1.341 -9.211 1.00 7.02 C ATOM 959 CD GLN A 64 25.007 -0.068 -9.739 1.00 6.57 C ATOM 960 OE1 GLN A 64 25.693 0.829 -10.230 1.00 6.94 O ATOM 961 NE2 GLN A 64 23.690 0.001 -9.681 1.00 6.12 N ATOM 0 H GLN A 64 25.174 0.950 -6.648 1.00 5.91 H new ATOM 0 HA GLN A 64 24.160 -1.787 -7.038 1.00 6.83 H new ATOM 0 HB2 GLN A 64 26.755 -0.381 -7.655 1.00 7.25 H new ATOM 0 HB3 GLN A 64 26.699 -2.128 -7.524 1.00 7.25 H new ATOM 0 HG2 GLN A 64 26.496 -1.596 -9.837 1.00 7.02 H new ATOM 0 HG3 GLN A 64 24.925 -2.157 -9.303 1.00 7.02 H new ATOM 0 HE21 GLN A 64 23.157 -0.763 -9.266 1.00 6.12 H new ATOM 0 HE22 GLN A 64 23.205 0.819 -10.051 1.00 6.12 H new ATOM 970 N GLY A 65 25.489 -2.865 -5.100 1.00 8.24 N ATOM 971 CA GLY A 65 25.943 -3.369 -3.820 1.00 9.27 C ATOM 972 C GLY A 65 27.435 -3.623 -3.805 1.00 9.91 C ATOM 973 O GLY A 65 28.110 -3.353 -2.811 1.00 10.39 O ATOM 0 H GLY A 65 25.185 -3.581 -5.760 1.00 8.24 H new ATOM 0 HA2 GLY A 65 25.690 -2.653 -3.038 1.00 9.27 H new ATOM 0 HA3 GLY A 65 25.416 -4.294 -3.587 1.00 9.27 H new ATOM 977 N GLY A 66 27.950 -4.144 -4.910 1.00 10.11 N ATOM 978 CA GLY A 66 29.369 -4.418 -5.006 1.00 10.90 C ATOM 979 C GLY A 66 30.021 -3.668 -6.148 1.00 11.22 C ATOM 980 O GLY A 66 30.573 -4.274 -7.064 1.00 11.32 O ATOM 0 H GLY A 66 27.410 -4.382 -5.742 1.00 10.11 H new ATOM 0 HA2 GLY A 66 29.854 -4.143 -4.069 1.00 10.90 H new ATOM 0 HA3 GLY A 66 29.522 -5.489 -5.142 1.00 10.90 H new ATOM 984 N SER A 67 29.951 -2.348 -6.100 1.00 11.60 N ATOM 985 CA SER A 67 30.530 -1.515 -7.143 1.00 12.12 C ATOM 986 C SER A 67 31.761 -0.768 -6.643 1.00 12.78 C ATOM 987 O SER A 67 32.575 -0.287 -7.436 1.00 13.15 O ATOM 988 CB SER A 67 29.483 -0.524 -7.640 1.00 12.22 C ATOM 989 OG SER A 67 28.780 0.043 -6.546 1.00 12.13 O ATOM 0 H SER A 67 29.498 -1.828 -5.348 1.00 11.60 H new ATOM 0 HA SER A 67 30.845 -2.161 -7.962 1.00 12.12 H new ATOM 0 HB2 SER A 67 29.965 0.264 -8.219 1.00 12.22 H new ATOM 0 HB3 SER A 67 28.784 -1.028 -8.308 1.00 12.22 H new ATOM 0 HG SER A 67 28.356 0.880 -6.828 1.00 12.13 H new ATOM 995 N LEU A 68 31.899 -0.672 -5.328 1.00 13.08 N ATOM 996 CA LEU A 68 32.996 0.072 -4.738 1.00 13.85 C ATOM 997 C LEU A 68 33.999 -0.865 -4.074 1.00 14.29 C ATOM 998 O LEU A 68 33.660 -1.600 -3.145 1.00 14.49 O ATOM 999 CB LEU A 68 32.467 1.080 -3.715 1.00 14.25 C ATOM 1000 CG LEU A 68 33.538 1.938 -3.032 1.00 14.75 C ATOM 1001 CD1 LEU A 68 34.275 2.792 -4.054 1.00 14.76 C ATOM 1002 CD2 LEU A 68 32.916 2.816 -1.959 1.00 15.00 C ATOM 0 H LEU A 68 31.265 -1.100 -4.653 1.00 13.08 H new ATOM 0 HA LEU A 68 33.505 0.610 -5.538 1.00 13.85 H new ATOM 0 HB2 LEU A 68 31.758 1.741 -4.213 1.00 14.25 H new ATOM 0 HB3 LEU A 68 31.914 0.539 -2.948 1.00 14.25 H new ATOM 0 HG LEU A 68 34.257 1.270 -2.558 1.00 14.75 H new ATOM 0 HD11 LEU A 68 35.031 3.393 -3.549 1.00 14.76 H new ATOM 0 HD12 LEU A 68 34.757 2.146 -4.788 1.00 14.76 H new ATOM 0 HD13 LEU A 68 33.566 3.449 -4.558 1.00 14.76 H new ATOM 0 HD21 LEU A 68 33.692 3.417 -1.486 1.00 15.00 H new ATOM 0 HD22 LEU A 68 32.173 3.473 -2.412 1.00 15.00 H new ATOM 0 HD23 LEU A 68 32.435 2.188 -1.209 1.00 15.00 H new ATOM 1014 N LEU A 69 35.226 -0.843 -4.568 1.00 14.58 N ATOM 1015 CA LEU A 69 36.306 -1.610 -3.975 1.00 15.13 C ATOM 1016 C LEU A 69 37.591 -0.799 -4.024 1.00 15.66 C ATOM 1017 O LEU A 69 37.902 -0.172 -5.040 1.00 15.98 O ATOM 1018 CB LEU A 69 36.464 -2.973 -4.678 1.00 15.32 C ATOM 1019 CG LEU A 69 36.728 -2.944 -6.191 1.00 15.69 C ATOM 1020 CD1 LEU A 69 38.219 -2.842 -6.487 1.00 16.24 C ATOM 1021 CD2 LEU A 69 36.140 -4.181 -6.853 1.00 15.39 C ATOM 0 H LEU A 69 35.499 -0.297 -5.385 1.00 14.58 H new ATOM 0 HA LEU A 69 36.069 -1.817 -2.931 1.00 15.13 H new ATOM 0 HB2 LEU A 69 37.284 -3.509 -4.200 1.00 15.32 H new ATOM 0 HB3 LEU A 69 35.558 -3.553 -4.502 1.00 15.32 H new ATOM 0 HG LEU A 69 36.242 -2.059 -6.602 1.00 15.69 H new ATOM 0 HD11 LEU A 69 38.375 -2.823 -7.566 1.00 16.24 H new ATOM 0 HD12 LEU A 69 38.616 -1.927 -6.047 1.00 16.24 H new ATOM 0 HD13 LEU A 69 38.734 -3.703 -6.060 1.00 16.24 H new ATOM 0 HD21 LEU A 69 36.334 -4.147 -7.925 1.00 15.39 H new ATOM 0 HD22 LEU A 69 36.599 -5.074 -6.429 1.00 15.39 H new ATOM 0 HD23 LEU A 69 35.064 -4.210 -6.680 1.00 15.39 H new ATOM 1033 N ALA A 70 38.305 -0.765 -2.913 1.00 15.87 N ATOM 1034 CA ALA A 70 39.543 -0.017 -2.837 1.00 16.47 C ATOM 1035 C ALA A 70 40.557 -0.712 -1.942 1.00 16.76 C ATOM 1036 O ALA A 70 40.544 -0.543 -0.721 1.00 16.70 O ATOM 1037 CB ALA A 70 39.282 1.396 -2.339 1.00 16.62 C ATOM 0 H ALA A 70 38.047 -1.247 -2.052 1.00 15.87 H new ATOM 0 HA ALA A 70 39.961 0.035 -3.842 1.00 16.47 H new ATOM 0 HB1 ALA A 70 40.223 1.943 -2.288 1.00 16.62 H new ATOM 0 HB2 ALA A 70 38.603 1.904 -3.024 1.00 16.62 H new ATOM 0 HB3 ALA A 70 38.832 1.355 -1.347 1.00 16.62 H new ATOM 1043 N PRO A 71 41.439 -1.522 -2.538 1.00 17.21 N ATOM 1044 CA PRO A 71 42.559 -2.123 -1.837 1.00 17.64 C ATOM 1045 C PRO A 71 43.708 -1.134 -1.757 1.00 18.20 C ATOM 1046 O PRO A 71 44.711 -1.252 -2.466 1.00 18.72 O ATOM 1047 CB PRO A 71 42.935 -3.335 -2.705 1.00 18.02 C ATOM 1048 CG PRO A 71 41.989 -3.315 -3.874 1.00 17.97 C ATOM 1049 CD PRO A 71 41.425 -1.926 -3.940 1.00 17.47 C ATOM 0 HA PRO A 71 42.322 -2.409 -0.812 1.00 17.64 H new ATOM 0 HB2 PRO A 71 43.970 -3.270 -3.039 1.00 18.02 H new ATOM 0 HB3 PRO A 71 42.840 -4.263 -2.142 1.00 18.02 H new ATOM 0 HG2 PRO A 71 42.509 -3.567 -4.798 1.00 17.97 H new ATOM 0 HG3 PRO A 71 41.195 -4.051 -3.744 1.00 17.97 H new ATOM 0 HD2 PRO A 71 42.034 -1.268 -4.560 1.00 17.47 H new ATOM 0 HD3 PRO A 71 40.418 -1.915 -4.357 1.00 17.47 H new ATOM 1057 N VAL A 72 43.532 -0.133 -0.915 1.00 18.18 N ATOM 1058 CA VAL A 72 44.468 0.973 -0.829 1.00 18.79 C ATOM 1059 C VAL A 72 45.703 0.568 -0.028 1.00 19.11 C ATOM 1060 O VAL A 72 46.747 1.225 -0.092 1.00 19.16 O ATOM 1061 CB VAL A 72 43.783 2.215 -0.215 1.00 18.80 C ATOM 1062 CG1 VAL A 72 43.461 2.000 1.259 1.00 18.44 C ATOM 1063 CG2 VAL A 72 44.627 3.464 -0.418 1.00 19.52 C ATOM 0 H VAL A 72 42.741 -0.063 -0.275 1.00 18.18 H new ATOM 0 HA VAL A 72 44.794 1.234 -1.836 1.00 18.79 H new ATOM 0 HB VAL A 72 42.839 2.363 -0.739 1.00 18.80 H new ATOM 0 HG11 VAL A 72 42.980 2.892 1.660 1.00 18.44 H new ATOM 0 HG12 VAL A 72 42.790 1.148 1.364 1.00 18.44 H new ATOM 0 HG13 VAL A 72 44.382 1.806 1.808 1.00 18.44 H new ATOM 0 HG21 VAL A 72 44.120 4.322 0.024 1.00 19.52 H new ATOM 0 HG22 VAL A 72 45.597 3.329 0.061 1.00 19.52 H new ATOM 0 HG23 VAL A 72 44.770 3.637 -1.485 1.00 19.52 H new ATOM 1073 N ALA A 73 45.581 -0.531 0.709 1.00 19.45 N ATOM 1074 CA ALA A 73 46.716 -1.097 1.413 1.00 19.89 C ATOM 1075 C ALA A 73 47.689 -1.693 0.404 1.00 20.36 C ATOM 1076 O ALA A 73 48.883 -1.398 0.434 1.00 20.52 O ATOM 1077 CB ALA A 73 46.267 -2.143 2.421 1.00 20.18 C ATOM 0 H ALA A 73 44.708 -1.043 0.832 1.00 19.45 H new ATOM 0 HA ALA A 73 47.220 -0.306 1.969 1.00 19.89 H new ATOM 0 HB1 ALA A 73 47.138 -2.551 2.934 1.00 20.18 H new ATOM 0 HB2 ALA A 73 45.599 -1.683 3.149 1.00 20.18 H new ATOM 0 HB3 ALA A 73 45.742 -2.946 1.903 1.00 20.18 H new ATOM 1083 N ARG A 74 47.161 -2.522 -0.494 1.00 20.70 N ATOM 1084 CA ARG A 74 47.939 -3.046 -1.608 1.00 21.28 C ATOM 1085 C ARG A 74 47.043 -3.752 -2.620 1.00 21.56 C ATOM 1086 O ARG A 74 46.314 -4.685 -2.283 1.00 22.00 O ATOM 1087 CB ARG A 74 49.036 -4.004 -1.131 1.00 21.90 C ATOM 1088 CG ARG A 74 49.883 -4.541 -2.273 1.00 22.10 C ATOM 1089 CD ARG A 74 51.016 -5.422 -1.781 1.00 22.67 C ATOM 1090 NE ARG A 74 51.762 -6.004 -2.895 1.00 22.78 N ATOM 1091 CZ ARG A 74 53.016 -6.446 -2.814 1.00 23.30 C ATOM 1092 NH1 ARG A 74 53.693 -6.355 -1.676 1.00 23.78 N ATOM 1093 NH2 ARG A 74 53.591 -6.978 -3.882 1.00 23.45 N ATOM 0 H ARG A 74 46.194 -2.845 -0.469 1.00 20.70 H new ATOM 0 HA ARG A 74 48.415 -2.193 -2.091 1.00 21.28 H new ATOM 0 HB2 ARG A 74 49.679 -3.487 -0.419 1.00 21.90 H new ATOM 0 HB3 ARG A 74 48.578 -4.839 -0.600 1.00 21.90 H new ATOM 0 HG2 ARG A 74 49.252 -5.111 -2.955 1.00 22.10 H new ATOM 0 HG3 ARG A 74 50.294 -3.707 -2.842 1.00 22.10 H new ATOM 0 HD2 ARG A 74 51.690 -4.835 -1.157 1.00 22.67 H new ATOM 0 HD3 ARG A 74 50.614 -6.219 -1.155 1.00 22.67 H new ATOM 0 HE ARG A 74 51.290 -6.077 -3.796 1.00 22.78 H new ATOM 0 HH11 ARG A 74 53.254 -5.944 -0.853 1.00 23.78 H new ATOM 0 HH12 ARG A 74 54.653 -6.697 -1.625 1.00 23.78 H new ATOM 0 HH21 ARG A 74 53.074 -7.047 -4.759 1.00 23.45 H new ATOM 0 HH22 ARG A 74 54.551 -7.319 -3.828 1.00 23.45 H new ATOM 1107 N ASN A 75 47.099 -3.289 -3.858 1.00 21.40 N ATOM 1108 CA ASN A 75 46.410 -3.944 -4.958 1.00 21.77 C ATOM 1109 C ASN A 75 47.404 -4.231 -6.075 1.00 22.10 C ATOM 1110 O ASN A 75 48.549 -3.772 -6.020 1.00 22.18 O ATOM 1111 CB ASN A 75 45.230 -3.103 -5.468 1.00 21.80 C ATOM 1112 CG ASN A 75 45.631 -1.722 -5.950 1.00 21.92 C ATOM 1113 OD1 ASN A 75 45.970 -1.530 -7.118 1.00 21.95 O ATOM 1114 ND2 ASN A 75 45.583 -0.747 -5.054 1.00 22.10 N ATOM 0 H ASN A 75 47.620 -2.454 -4.128 1.00 21.40 H new ATOM 0 HA ASN A 75 45.993 -4.885 -4.599 1.00 21.77 H new ATOM 0 HB2 ASN A 75 44.741 -3.635 -6.284 1.00 21.80 H new ATOM 0 HB3 ASN A 75 44.496 -3.001 -4.669 1.00 21.80 H new ATOM 0 HD21 ASN A 75 45.832 0.205 -5.322 1.00 22.10 H new ATOM 0 HD22 ASN A 75 45.297 -0.948 -4.096 1.00 22.10 H new ATOM 1121 N GLY A 76 46.979 -4.980 -7.080 1.00 22.40 N ATOM 1122 CA GLY A 76 47.898 -5.418 -8.109 1.00 22.84 C ATOM 1123 C GLY A 76 47.632 -4.792 -9.461 1.00 23.17 C ATOM 1124 O GLY A 76 46.724 -5.211 -10.184 1.00 22.82 O ATOM 0 H GLY A 76 46.016 -5.292 -7.202 1.00 22.40 H new ATOM 0 HA2 GLY A 76 48.916 -5.180 -7.801 1.00 22.84 H new ATOM 0 HA3 GLY A 76 47.838 -6.502 -8.201 1.00 22.84 H new ATOM 1128 N ARG A 77 48.429 -3.789 -9.807 1.00 23.94 N ATOM 1129 CA ARG A 77 48.376 -3.194 -11.137 1.00 24.42 C ATOM 1130 C ARG A 77 49.514 -3.755 -11.976 1.00 24.95 C ATOM 1131 O ARG A 77 49.585 -3.534 -13.186 1.00 25.38 O ATOM 1132 CB ARG A 77 48.485 -1.668 -11.071 1.00 24.81 C ATOM 1133 CG ARG A 77 47.521 -1.025 -10.091 1.00 25.30 C ATOM 1134 CD ARG A 77 47.493 0.487 -10.251 1.00 25.65 C ATOM 1135 NE ARG A 77 46.909 0.883 -11.534 1.00 25.77 N ATOM 1136 CZ ARG A 77 47.021 2.102 -12.068 1.00 26.12 C ATOM 1137 NH1 ARG A 77 47.714 3.056 -11.455 1.00 26.36 N ATOM 1138 NH2 ARG A 77 46.438 2.364 -13.229 1.00 26.31 N ATOM 0 H ARG A 77 49.120 -3.370 -9.185 1.00 23.94 H new ATOM 0 HA ARG A 77 47.416 -3.440 -11.590 1.00 24.42 H new ATOM 0 HB2 ARG A 77 49.504 -1.398 -10.794 1.00 24.81 H new ATOM 0 HB3 ARG A 77 48.306 -1.257 -12.065 1.00 24.81 H new ATOM 0 HG2 ARG A 77 46.520 -1.427 -10.246 1.00 25.30 H new ATOM 0 HG3 ARG A 77 47.812 -1.279 -9.072 1.00 25.30 H new ATOM 0 HD2 ARG A 77 46.918 0.929 -9.437 1.00 25.65 H new ATOM 0 HD3 ARG A 77 48.507 0.880 -10.175 1.00 25.65 H new ATOM 0 HE ARG A 77 46.382 0.182 -12.054 1.00 25.77 H new ATOM 0 HH11 ARG A 77 48.170 2.862 -10.563 1.00 26.36 H new ATOM 0 HH12 ARG A 77 47.790 3.982 -11.876 1.00 26.36 H new ATOM 0 HH21 ARG A 77 45.908 1.637 -13.709 1.00 26.31 H new ATOM 0 HH22 ARG A 77 46.519 3.293 -13.642 1.00 26.31 H new ATOM 1152 N LEU A 78 50.395 -4.486 -11.295 1.00 25.00 N ATOM 1153 CA LEU A 78 51.565 -5.109 -11.908 1.00 25.59 C ATOM 1154 C LEU A 78 52.500 -4.048 -12.469 1.00 25.89 C ATOM 1155 O LEU A 78 52.733 -4.039 -13.696 1.00 26.21 O ATOM 1156 CB LEU A 78 51.172 -6.110 -13.009 1.00 25.84 C ATOM 1157 CG LEU A 78 50.586 -7.446 -12.525 1.00 25.87 C ATOM 1158 CD1 LEU A 78 49.189 -7.267 -11.947 1.00 25.93 C ATOM 1159 CD2 LEU A 78 50.570 -8.460 -13.659 1.00 25.99 C ATOM 1160 OXT LEU A 78 52.982 -3.209 -11.681 1.00 25.87 O ATOM 0 H LEU A 78 50.315 -4.664 -10.294 1.00 25.00 H new ATOM 0 HA LEU A 78 52.084 -5.665 -11.128 1.00 25.59 H new ATOM 0 HB2 LEU A 78 50.443 -5.632 -13.664 1.00 25.84 H new ATOM 0 HB3 LEU A 78 52.054 -6.320 -13.613 1.00 25.84 H new ATOM 0 HG LEU A 78 51.227 -7.821 -11.727 1.00 25.87 H new ATOM 0 HD11 LEU A 78 48.806 -8.232 -11.615 1.00 25.93 H new ATOM 0 HD12 LEU A 78 49.231 -6.582 -11.100 1.00 25.93 H new ATOM 0 HD13 LEU A 78 48.528 -6.858 -12.712 1.00 25.93 H new ATOM 0 HD21 LEU A 78 50.152 -9.401 -13.300 1.00 25.99 H new ATOM 0 HD22 LEU A 78 49.959 -8.080 -14.478 1.00 25.99 H new ATOM 0 HD23 LEU A 78 51.588 -8.626 -14.013 1.00 25.99 H new TER 1172 LEU A 78 ATOM 1173 N GLY B 1 -13.472 -9.172 -20.862 1.00 14.86 N ATOM 1174 CA GLY B 1 -13.710 -9.105 -19.402 1.00 14.51 C ATOM 1175 C GLY B 1 -14.061 -7.705 -18.953 1.00 13.80 C ATOM 1176 O GLY B 1 -13.993 -6.764 -19.747 1.00 13.50 O ATOM 0 H1 GLY B 1 -14.210 -9.753 -21.308 1.00 14.86 H new ATOM 0 H2 GLY B 1 -13.498 -8.212 -21.262 1.00 14.86 H new ATOM 0 H3 GLY B 1 -12.540 -9.598 -21.043 1.00 14.86 H new ATOM 0 HA2 GLY B 1 -14.518 -9.786 -19.134 1.00 14.51 H new ATOM 0 HA3 GLY B 1 -12.819 -9.444 -18.873 1.00 14.51 H new ATOM 1182 N PRO B 2 -14.449 -7.532 -17.684 1.00 13.67 N ATOM 1183 CA PRO B 2 -14.751 -6.216 -17.125 1.00 13.18 C ATOM 1184 C PRO B 2 -13.521 -5.315 -17.131 1.00 12.84 C ATOM 1185 O PRO B 2 -12.523 -5.601 -16.464 1.00 13.20 O ATOM 1186 CB PRO B 2 -15.196 -6.515 -15.689 1.00 13.45 C ATOM 1187 CG PRO B 2 -14.650 -7.869 -15.388 1.00 14.08 C ATOM 1188 CD PRO B 2 -14.627 -8.606 -16.696 1.00 14.18 C ATOM 0 HA PRO B 2 -15.509 -5.687 -17.702 1.00 13.18 H new ATOM 0 HB2 PRO B 2 -14.809 -5.770 -14.993 1.00 13.45 H new ATOM 0 HB3 PRO B 2 -16.282 -6.499 -15.601 1.00 13.45 H new ATOM 0 HG2 PRO B 2 -13.649 -7.800 -14.961 1.00 14.08 H new ATOM 0 HG3 PRO B 2 -15.273 -8.388 -14.659 1.00 14.08 H new ATOM 0 HD2 PRO B 2 -13.812 -9.329 -16.736 1.00 14.18 H new ATOM 0 HD3 PRO B 2 -15.552 -9.158 -16.863 1.00 14.18 H new ATOM 1196 N LEU B 3 -13.590 -4.244 -17.902 1.00 12.32 N ATOM 1197 CA LEU B 3 -12.476 -3.316 -18.026 1.00 12.14 C ATOM 1198 C LEU B 3 -12.910 -1.918 -17.603 1.00 11.47 C ATOM 1199 O LEU B 3 -12.153 -1.184 -16.971 1.00 11.48 O ATOM 1200 CB LEU B 3 -11.956 -3.299 -19.464 1.00 12.27 C ATOM 1201 CG LEU B 3 -10.738 -2.404 -19.707 1.00 13.01 C ATOM 1202 CD1 LEU B 3 -9.532 -2.922 -18.939 1.00 13.34 C ATOM 1203 CD2 LEU B 3 -10.432 -2.316 -21.193 1.00 13.74 C ATOM 0 H LEU B 3 -14.410 -3.993 -18.455 1.00 12.32 H new ATOM 0 HA LEU B 3 -11.670 -3.646 -17.371 1.00 12.14 H new ATOM 0 HB2 LEU B 3 -11.701 -4.319 -19.753 1.00 12.27 H new ATOM 0 HB3 LEU B 3 -12.763 -2.974 -20.121 1.00 12.27 H new ATOM 0 HG LEU B 3 -10.968 -1.402 -19.344 1.00 13.01 H new ATOM 0 HD11 LEU B 3 -8.676 -2.273 -19.124 1.00 13.34 H new ATOM 0 HD12 LEU B 3 -9.756 -2.931 -17.872 1.00 13.34 H new ATOM 0 HD13 LEU B 3 -9.298 -3.934 -19.269 1.00 13.34 H new ATOM 0 HD21 LEU B 3 -9.563 -1.676 -21.348 1.00 13.74 H new ATOM 0 HD22 LEU B 3 -10.222 -3.313 -21.581 1.00 13.74 H new ATOM 0 HD23 LEU B 3 -11.291 -1.896 -21.717 1.00 13.74 H new ATOM 1215 N GLY B 4 -14.148 -1.566 -17.940 1.00 11.08 N ATOM 1216 CA GLY B 4 -14.687 -0.283 -17.538 1.00 10.64 C ATOM 1217 C GLY B 4 -15.020 -0.275 -16.064 1.00 9.87 C ATOM 1218 O GLY B 4 -14.856 0.741 -15.391 1.00 9.79 O ATOM 0 H GLY B 4 -14.785 -2.148 -18.484 1.00 11.08 H new ATOM 0 HA2 GLY B 4 -13.965 0.504 -17.756 1.00 10.64 H new ATOM 0 HA3 GLY B 4 -15.583 -0.063 -18.118 1.00 10.64 H new ATOM 1222 N SER B 5 -15.509 -1.420 -15.586 1.00 9.53 N ATOM 1223 CA SER B 5 -15.724 -1.666 -14.162 1.00 9.04 C ATOM 1224 C SER B 5 -16.898 -0.867 -13.596 1.00 8.12 C ATOM 1225 O SER B 5 -17.069 0.319 -13.883 1.00 7.94 O ATOM 1226 CB SER B 5 -14.445 -1.350 -13.375 1.00 9.39 C ATOM 1227 OG SER B 5 -14.592 -1.661 -12.001 1.00 9.78 O ATOM 0 H SER B 5 -15.768 -2.207 -16.181 1.00 9.53 H new ATOM 0 HA SER B 5 -15.974 -2.721 -14.054 1.00 9.04 H new ATOM 0 HB2 SER B 5 -13.611 -1.916 -13.790 1.00 9.39 H new ATOM 0 HB3 SER B 5 -14.200 -0.294 -13.486 1.00 9.39 H new ATOM 0 HG SER B 5 -13.772 -1.421 -11.522 1.00 9.78 H new ATOM 1233 N SER B 6 -17.718 -1.535 -12.796 1.00 7.78 N ATOM 1234 CA SER B 6 -18.761 -0.869 -12.040 1.00 7.11 C ATOM 1235 C SER B 6 -18.214 -0.503 -10.663 1.00 6.30 C ATOM 1236 O SER B 6 -17.550 -1.321 -10.019 1.00 6.44 O ATOM 1237 CB SER B 6 -19.980 -1.782 -11.903 1.00 7.65 C ATOM 1238 OG SER B 6 -20.444 -2.218 -13.175 1.00 8.38 O ATOM 0 H SER B 6 -17.677 -2.544 -12.656 1.00 7.78 H new ATOM 0 HA SER B 6 -19.072 0.036 -12.562 1.00 7.11 H new ATOM 0 HB2 SER B 6 -19.723 -2.647 -11.291 1.00 7.65 H new ATOM 0 HB3 SER B 6 -20.778 -1.251 -11.385 1.00 7.65 H new ATOM 0 HG SER B 6 -21.223 -2.801 -13.057 1.00 8.38 H new ATOM 1244 N ALA B 7 -18.472 0.721 -10.223 1.00 5.78 N ATOM 1245 CA ALA B 7 -17.927 1.208 -8.961 1.00 5.35 C ATOM 1246 C ALA B 7 -18.475 0.419 -7.776 1.00 4.62 C ATOM 1247 O ALA B 7 -17.738 0.105 -6.839 1.00 4.08 O ATOM 1248 CB ALA B 7 -18.220 2.688 -8.794 1.00 5.50 C ATOM 0 H ALA B 7 -19.054 1.395 -10.720 1.00 5.78 H new ATOM 0 HA ALA B 7 -16.847 1.064 -8.986 1.00 5.35 H new ATOM 0 HB1 ALA B 7 -17.807 3.036 -7.847 1.00 5.50 H new ATOM 0 HB2 ALA B 7 -17.766 3.244 -9.614 1.00 5.50 H new ATOM 0 HB3 ALA B 7 -19.298 2.848 -8.800 1.00 5.50 H new ATOM 1254 N GLY B 8 -19.763 0.091 -7.826 1.00 4.66 N ATOM 1255 CA GLY B 8 -20.379 -0.677 -6.760 1.00 4.09 C ATOM 1256 C GLY B 8 -19.721 -2.028 -6.568 1.00 4.04 C ATOM 1257 O GLY B 8 -19.347 -2.386 -5.452 1.00 3.54 O ATOM 0 H GLY B 8 -20.392 0.344 -8.588 1.00 4.66 H new ATOM 0 HA2 GLY B 8 -20.322 -0.112 -5.829 1.00 4.09 H new ATOM 0 HA3 GLY B 8 -21.437 -0.819 -6.982 1.00 4.09 H new ATOM 1261 N ALA B 9 -19.566 -2.770 -7.658 1.00 4.69 N ATOM 1262 CA ALA B 9 -18.916 -4.076 -7.620 1.00 4.91 C ATOM 1263 C ALA B 9 -17.474 -3.963 -7.129 1.00 4.50 C ATOM 1264 O ALA B 9 -16.994 -4.806 -6.368 1.00 4.40 O ATOM 1265 CB ALA B 9 -18.960 -4.722 -8.997 1.00 5.78 C ATOM 0 H ALA B 9 -19.884 -2.488 -8.585 1.00 4.69 H new ATOM 0 HA ALA B 9 -19.459 -4.706 -6.915 1.00 4.91 H new ATOM 0 HB1 ALA B 9 -18.472 -5.696 -8.958 1.00 5.78 H new ATOM 0 HB2 ALA B 9 -19.997 -4.848 -9.307 1.00 5.78 H new ATOM 0 HB3 ALA B 9 -18.442 -4.085 -9.714 1.00 5.78 H new ATOM 1271 N LEU B 10 -16.787 -2.911 -7.563 1.00 4.38 N ATOM 1272 CA LEU B 10 -15.413 -2.671 -7.149 1.00 3.97 C ATOM 1273 C LEU B 10 -15.347 -2.397 -5.651 1.00 3.17 C ATOM 1274 O LEU B 10 -14.526 -2.975 -4.940 1.00 2.96 O ATOM 1275 CB LEU B 10 -14.822 -1.495 -7.932 1.00 4.13 C ATOM 1276 CG LEU B 10 -13.388 -1.114 -7.555 1.00 3.77 C ATOM 1277 CD1 LEU B 10 -12.433 -2.265 -7.836 1.00 3.68 C ATOM 1278 CD2 LEU B 10 -12.958 0.140 -8.302 1.00 4.12 C ATOM 0 H LEU B 10 -17.162 -2.211 -8.203 1.00 4.38 H new ATOM 0 HA LEU B 10 -14.825 -3.564 -7.362 1.00 3.97 H new ATOM 0 HB2 LEU B 10 -14.849 -1.737 -8.994 1.00 4.13 H new ATOM 0 HB3 LEU B 10 -15.462 -0.625 -7.787 1.00 4.13 H new ATOM 0 HG LEU B 10 -13.357 -0.904 -6.486 1.00 3.77 H new ATOM 0 HD11 LEU B 10 -11.420 -1.972 -7.561 1.00 3.68 H new ATOM 0 HD12 LEU B 10 -12.731 -3.136 -7.252 1.00 3.68 H new ATOM 0 HD13 LEU B 10 -12.464 -2.512 -8.897 1.00 3.68 H new ATOM 0 HD21 LEU B 10 -11.936 0.397 -8.023 1.00 4.12 H new ATOM 0 HD22 LEU B 10 -13.006 -0.042 -9.376 1.00 4.12 H new ATOM 0 HD23 LEU B 10 -13.623 0.964 -8.043 1.00 4.12 H new ATOM 1290 N LEU B 11 -16.233 -1.534 -5.182 1.00 2.86 N ATOM 1291 CA LEU B 11 -16.308 -1.192 -3.769 1.00 2.18 C ATOM 1292 C LEU B 11 -16.697 -2.424 -2.958 1.00 2.26 C ATOM 1293 O LEU B 11 -16.072 -2.733 -1.944 1.00 2.13 O ATOM 1294 CB LEU B 11 -17.320 -0.046 -3.575 1.00 2.17 C ATOM 1295 CG LEU B 11 -17.375 0.607 -2.180 1.00 1.84 C ATOM 1296 CD1 LEU B 11 -18.138 -0.262 -1.186 1.00 1.83 C ATOM 1297 CD2 LEU B 11 -15.972 0.898 -1.669 1.00 1.71 C ATOM 0 H LEU B 11 -16.917 -1.052 -5.765 1.00 2.86 H new ATOM 0 HA LEU B 11 -15.334 -0.854 -3.415 1.00 2.18 H new ATOM 0 HB2 LEU B 11 -17.096 0.732 -4.305 1.00 2.17 H new ATOM 0 HB3 LEU B 11 -18.314 -0.427 -3.810 1.00 2.17 H new ATOM 0 HG LEU B 11 -17.913 1.550 -2.277 1.00 1.84 H new ATOM 0 HD11 LEU B 11 -18.157 0.229 -0.213 1.00 1.83 H new ATOM 0 HD12 LEU B 11 -19.159 -0.408 -1.539 1.00 1.83 H new ATOM 0 HD13 LEU B 11 -17.644 -1.229 -1.095 1.00 1.83 H new ATOM 0 HD21 LEU B 11 -16.032 1.359 -0.683 1.00 1.71 H new ATOM 0 HD22 LEU B 11 -15.409 -0.033 -1.601 1.00 1.71 H new ATOM 0 HD23 LEU B 11 -15.468 1.577 -2.357 1.00 1.71 H new ATOM 1309 N ALA B 12 -17.710 -3.137 -3.433 1.00 2.76 N ATOM 1310 CA ALA B 12 -18.223 -4.312 -2.740 1.00 3.14 C ATOM 1311 C ALA B 12 -17.138 -5.359 -2.520 1.00 3.58 C ATOM 1312 O ALA B 12 -16.958 -5.847 -1.407 1.00 3.74 O ATOM 1313 CB ALA B 12 -19.387 -4.917 -3.508 1.00 3.68 C ATOM 0 H ALA B 12 -18.196 -2.920 -4.303 1.00 2.76 H new ATOM 0 HA ALA B 12 -18.572 -3.985 -1.761 1.00 3.14 H new ATOM 0 HB1 ALA B 12 -19.758 -5.793 -2.976 1.00 3.68 H new ATOM 0 HB2 ALA B 12 -20.186 -4.181 -3.596 1.00 3.68 H new ATOM 0 HB3 ALA B 12 -19.053 -5.211 -4.503 1.00 3.68 H new ATOM 1319 N HIS B 13 -16.400 -5.696 -3.576 1.00 3.94 N ATOM 1320 CA HIS B 13 -15.403 -6.755 -3.478 1.00 4.46 C ATOM 1321 C HIS B 13 -14.185 -6.278 -2.687 1.00 4.06 C ATOM 1322 O HIS B 13 -13.493 -7.077 -2.060 1.00 4.48 O ATOM 1323 CB HIS B 13 -15.010 -7.302 -4.871 1.00 5.05 C ATOM 1324 CG HIS B 13 -13.818 -6.654 -5.522 1.00 4.87 C ATOM 1325 ND1 HIS B 13 -13.707 -5.524 -6.256 1.00 4.94 N flip ATOM 1326 CD2 HIS B 13 -12.552 -7.200 -5.478 1.00 4.82 C flip ATOM 1327 CE1 HIS B 13 -12.391 -5.409 -6.631 1.00 4.81 C flip ATOM 1328 NE2 HIS B 13 -11.715 -6.432 -6.151 1.00 4.82 N flip ATOM 0 H HIS B 13 -16.472 -5.258 -4.494 1.00 3.94 H new ATOM 0 HA HIS B 13 -15.848 -7.586 -2.932 1.00 4.46 H new ATOM 0 HB2 HIS B 13 -14.812 -8.370 -4.777 1.00 5.05 H new ATOM 0 HB3 HIS B 13 -15.866 -7.194 -5.537 1.00 5.05 H new ATOM 0 HD2 HIS B 13 -12.286 -8.116 -4.971 1.00 4.82 H new ATOM 0 HE1 HIS B 13 -11.977 -4.608 -7.225 1.00 4.81 H new ATOM 0 HE2 HIS B 13 -10.717 -6.602 -6.277 1.00 4.82 H new ATOM 1337 N ALA B 14 -13.928 -4.973 -2.713 1.00 3.33 N ATOM 1338 CA ALA B 14 -12.829 -4.400 -1.947 1.00 2.95 C ATOM 1339 C ALA B 14 -13.152 -4.423 -0.457 1.00 2.97 C ATOM 1340 O ALA B 14 -12.319 -4.822 0.362 1.00 3.30 O ATOM 1341 CB ALA B 14 -12.534 -2.983 -2.409 1.00 2.26 C ATOM 0 H ALA B 14 -14.465 -4.296 -3.255 1.00 3.33 H new ATOM 0 HA ALA B 14 -11.938 -5.005 -2.117 1.00 2.95 H new ATOM 0 HB1 ALA B 14 -11.710 -2.574 -1.824 1.00 2.26 H new ATOM 0 HB2 ALA B 14 -12.260 -2.994 -3.464 1.00 2.26 H new ATOM 0 HB3 ALA B 14 -13.420 -2.363 -2.271 1.00 2.26 H new ATOM 1347 N ALA B 15 -14.368 -4.006 -0.116 1.00 2.80 N ATOM 1348 CA ALA B 15 -14.835 -4.028 1.265 1.00 3.07 C ATOM 1349 C ALA B 15 -14.949 -5.457 1.774 1.00 3.91 C ATOM 1350 O ALA B 15 -14.675 -5.732 2.940 1.00 4.37 O ATOM 1351 CB ALA B 15 -16.179 -3.323 1.384 1.00 2.79 C ATOM 0 H ALA B 15 -15.051 -3.647 -0.783 1.00 2.80 H new ATOM 0 HA ALA B 15 -14.104 -3.499 1.877 1.00 3.07 H new ATOM 0 HB1 ALA B 15 -16.513 -3.349 2.421 1.00 2.79 H new ATOM 0 HB2 ALA B 15 -16.076 -2.287 1.062 1.00 2.79 H new ATOM 0 HB3 ALA B 15 -16.912 -3.828 0.754 1.00 2.79 H new ATOM 1357 N SER B 16 -15.354 -6.354 0.887 1.00 4.22 N ATOM 1358 CA SER B 16 -15.507 -7.761 1.223 1.00 5.05 C ATOM 1359 C SER B 16 -14.171 -8.365 1.656 1.00 5.46 C ATOM 1360 O SER B 16 -14.105 -9.110 2.632 1.00 6.10 O ATOM 1361 CB SER B 16 -16.073 -8.521 0.019 1.00 5.36 C ATOM 1362 OG SER B 16 -16.426 -9.851 0.354 1.00 5.53 O ATOM 0 H SER B 16 -15.585 -6.128 -0.081 1.00 4.22 H new ATOM 0 HA SER B 16 -16.201 -7.848 2.059 1.00 5.05 H new ATOM 0 HB2 SER B 16 -16.950 -7.997 -0.362 1.00 5.36 H new ATOM 0 HB3 SER B 16 -15.335 -8.532 -0.783 1.00 5.36 H new ATOM 0 HG SER B 16 -16.784 -10.304 -0.438 1.00 5.53 H new ATOM 1368 N LEU B 17 -13.107 -8.031 0.934 1.00 5.11 N ATOM 1369 CA LEU B 17 -11.783 -8.555 1.248 1.00 5.45 C ATOM 1370 C LEU B 17 -11.140 -7.766 2.382 1.00 5.30 C ATOM 1371 O LEU B 17 -10.274 -8.274 3.091 1.00 5.77 O ATOM 1372 CB LEU B 17 -10.890 -8.521 0.009 1.00 5.21 C ATOM 1373 CG LEU B 17 -11.396 -9.347 -1.175 1.00 5.62 C ATOM 1374 CD1 LEU B 17 -10.451 -9.217 -2.354 1.00 5.51 C ATOM 1375 CD2 LEU B 17 -11.561 -10.807 -0.780 1.00 6.49 C ATOM 0 H LEU B 17 -13.135 -7.403 0.131 1.00 5.11 H new ATOM 0 HA LEU B 17 -11.896 -9.589 1.573 1.00 5.45 H new ATOM 0 HB2 LEU B 17 -10.778 -7.485 -0.311 1.00 5.21 H new ATOM 0 HB3 LEU B 17 -9.898 -8.879 0.285 1.00 5.21 H new ATOM 0 HG LEU B 17 -12.372 -8.962 -1.471 1.00 5.62 H new ATOM 0 HD11 LEU B 17 -10.826 -9.811 -3.188 1.00 5.51 H new ATOM 0 HD12 LEU B 17 -10.385 -8.171 -2.654 1.00 5.51 H new ATOM 0 HD13 LEU B 17 -9.462 -9.576 -2.069 1.00 5.51 H new ATOM 0 HD21 LEU B 17 -11.922 -11.377 -1.636 1.00 6.49 H new ATOM 0 HD22 LEU B 17 -10.600 -11.207 -0.456 1.00 6.49 H new ATOM 0 HD23 LEU B 17 -12.280 -10.884 0.036 1.00 6.49 H new ATOM 1387 N GLY B 18 -11.571 -6.528 2.549 1.00 4.72 N ATOM 1388 CA GLY B 18 -11.048 -5.700 3.614 1.00 4.73 C ATOM 1389 C GLY B 18 -9.836 -4.903 3.181 1.00 4.26 C ATOM 1390 O GLY B 18 -8.901 -4.709 3.957 1.00 4.55 O ATOM 0 H GLY B 18 -12.276 -6.079 1.964 1.00 4.72 H new ATOM 0 HA2 GLY B 18 -11.826 -5.017 3.955 1.00 4.73 H new ATOM 0 HA3 GLY B 18 -10.782 -6.330 4.463 1.00 4.73 H new ATOM 1394 N VAL B 19 -9.852 -4.447 1.936 1.00 3.60 N ATOM 1395 CA VAL B 19 -8.775 -3.619 1.414 1.00 3.07 C ATOM 1396 C VAL B 19 -9.006 -2.169 1.818 1.00 2.71 C ATOM 1397 O VAL B 19 -9.970 -1.547 1.384 1.00 2.39 O ATOM 1398 CB VAL B 19 -8.668 -3.716 -0.125 1.00 2.62 C ATOM 1399 CG1 VAL B 19 -7.514 -2.869 -0.644 1.00 2.10 C ATOM 1400 CG2 VAL B 19 -8.507 -5.165 -0.565 1.00 3.34 C ATOM 0 H VAL B 19 -10.600 -4.637 1.269 1.00 3.60 H new ATOM 0 HA VAL B 19 -7.839 -3.984 1.837 1.00 3.07 H new ATOM 0 HB VAL B 19 -9.593 -3.329 -0.551 1.00 2.62 H new ATOM 0 HG11 VAL B 19 -7.460 -2.954 -1.729 1.00 2.10 H new ATOM 0 HG12 VAL B 19 -7.675 -1.827 -0.369 1.00 2.10 H new ATOM 0 HG13 VAL B 19 -6.580 -3.219 -0.205 1.00 2.10 H new ATOM 0 HG21 VAL B 19 -8.434 -5.209 -1.652 1.00 3.34 H new ATOM 0 HG22 VAL B 19 -7.602 -5.581 -0.123 1.00 3.34 H new ATOM 0 HG23 VAL B 19 -9.370 -5.743 -0.236 1.00 3.34 H new ATOM 1410 N ARG B 20 -8.131 -1.648 2.663 1.00 2.95 N ATOM 1411 CA ARG B 20 -8.289 -0.306 3.207 1.00 3.09 C ATOM 1412 C ARG B 20 -7.049 0.541 2.933 1.00 2.88 C ATOM 1413 O ARG B 20 -5.923 0.074 3.106 1.00 2.99 O ATOM 1414 CB ARG B 20 -8.556 -0.390 4.715 1.00 3.99 C ATOM 1415 CG ARG B 20 -9.867 -1.083 5.058 1.00 4.33 C ATOM 1416 CD ARG B 20 -9.863 -1.644 6.473 1.00 5.13 C ATOM 1417 NE ARG B 20 -9.613 -0.622 7.490 1.00 5.49 N ATOM 1418 CZ ARG B 20 -9.296 -0.903 8.757 1.00 6.26 C ATOM 1419 NH1 ARG B 20 -9.182 -2.166 9.154 1.00 6.80 N ATOM 1420 NH2 ARG B 20 -9.089 0.077 9.629 1.00 6.67 N ATOM 0 H ARG B 20 -7.298 -2.137 2.990 1.00 2.95 H new ATOM 0 HA ARG B 20 -9.138 0.173 2.718 1.00 3.09 H new ATOM 0 HB2 ARG B 20 -7.735 -0.925 5.193 1.00 3.99 H new ATOM 0 HB3 ARG B 20 -8.566 0.617 5.132 1.00 3.99 H new ATOM 0 HG2 ARG B 20 -10.690 -0.376 4.951 1.00 4.33 H new ATOM 0 HG3 ARG B 20 -10.046 -1.891 4.348 1.00 4.33 H new ATOM 0 HD2 ARG B 20 -10.823 -2.120 6.672 1.00 5.13 H new ATOM 0 HD3 ARG B 20 -9.100 -2.419 6.549 1.00 5.13 H new ATOM 0 HE ARG B 20 -9.685 0.358 7.217 1.00 5.49 H new ATOM 0 HH11 ARG B 20 -9.337 -2.925 8.490 1.00 6.80 H new ATOM 0 HH12 ARG B 20 -8.940 -2.376 10.122 1.00 6.80 H new ATOM 0 HH21 ARG B 20 -9.172 1.049 9.332 1.00 6.67 H new ATOM 0 HH22 ARG B 20 -8.847 -0.143 10.595 1.00 6.67 H new ATOM 1434 N LEU B 21 -7.263 1.775 2.489 1.00 2.77 N ATOM 1435 CA LEU B 21 -6.165 2.701 2.232 1.00 2.92 C ATOM 1436 C LEU B 21 -6.468 4.072 2.816 1.00 3.68 C ATOM 1437 O LEU B 21 -7.528 4.644 2.559 1.00 3.80 O ATOM 1438 CB LEU B 21 -5.893 2.861 0.728 1.00 2.28 C ATOM 1439 CG LEU B 21 -5.265 1.658 0.017 1.00 1.58 C ATOM 1440 CD1 LEU B 21 -6.324 0.653 -0.402 1.00 1.07 C ATOM 1441 CD2 LEU B 21 -4.462 2.120 -1.186 1.00 1.46 C ATOM 0 H LEU B 21 -8.189 2.158 2.299 1.00 2.77 H new ATOM 0 HA LEU B 21 -5.281 2.278 2.709 1.00 2.92 H new ATOM 0 HB2 LEU B 21 -6.836 3.096 0.234 1.00 2.28 H new ATOM 0 HB3 LEU B 21 -5.237 3.720 0.589 1.00 2.28 H new ATOM 0 HG LEU B 21 -4.594 1.162 0.718 1.00 1.58 H new ATOM 0 HD11 LEU B 21 -5.848 -0.189 -0.904 1.00 1.07 H new ATOM 0 HD12 LEU B 21 -6.856 0.296 0.480 1.00 1.07 H new ATOM 0 HD13 LEU B 21 -7.029 1.130 -1.083 1.00 1.07 H new ATOM 0 HD21 LEU B 21 -4.021 1.256 -1.683 1.00 1.46 H new ATOM 0 HD22 LEU B 21 -5.118 2.643 -1.882 1.00 1.46 H new ATOM 0 HD23 LEU B 21 -3.670 2.793 -0.858 1.00 1.46 H new ATOM 1453 N TRP B 22 -5.534 4.598 3.591 1.00 4.27 N ATOM 1454 CA TRP B 22 -5.661 5.938 4.149 1.00 5.07 C ATOM 1455 C TRP B 22 -4.277 6.536 4.366 1.00 5.46 C ATOM 1456 O TRP B 22 -3.336 5.822 4.705 1.00 5.34 O ATOM 1457 CB TRP B 22 -6.462 5.915 5.462 1.00 5.66 C ATOM 1458 CG TRP B 22 -5.789 5.182 6.588 1.00 5.95 C ATOM 1459 CD1 TRP B 22 -5.108 5.743 7.629 1.00 6.65 C ATOM 1460 CD2 TRP B 22 -5.735 3.763 6.789 1.00 5.65 C ATOM 1461 NE1 TRP B 22 -4.635 4.764 8.464 1.00 6.80 N ATOM 1462 CE2 TRP B 22 -5.002 3.539 7.972 1.00 6.24 C ATOM 1463 CE3 TRP B 22 -6.228 2.659 6.086 1.00 5.04 C ATOM 1464 CZ2 TRP B 22 -4.757 2.262 8.466 1.00 6.30 C ATOM 1465 CZ3 TRP B 22 -5.983 1.391 6.580 1.00 5.15 C ATOM 1466 CH2 TRP B 22 -5.253 1.200 7.757 1.00 5.80 C ATOM 0 H TRP B 22 -4.674 4.115 3.850 1.00 4.27 H new ATOM 0 HA TRP B 22 -6.208 6.562 3.443 1.00 5.07 H new ATOM 0 HB2 TRP B 22 -6.652 6.942 5.775 1.00 5.66 H new ATOM 0 HB3 TRP B 22 -7.432 5.455 5.274 1.00 5.66 H new ATOM 0 HD1 TRP B 22 -4.963 6.803 7.774 1.00 6.65 H new ATOM 0 HE1 TRP B 22 -4.096 4.922 9.315 1.00 6.80 H new ATOM 0 HE3 TRP B 22 -6.790 2.794 5.174 1.00 5.04 H new ATOM 0 HZ2 TRP B 22 -4.196 2.113 9.376 1.00 6.30 H new ATOM 0 HZ3 TRP B 22 -6.363 0.532 6.047 1.00 5.15 H new ATOM 0 HH2 TRP B 22 -5.077 0.196 8.114 1.00 5.80 H new ATOM 1477 N VAL B 23 -4.140 7.834 4.147 1.00 5.98 N ATOM 1478 CA VAL B 23 -2.846 8.481 4.287 1.00 6.42 C ATOM 1479 C VAL B 23 -2.622 8.964 5.718 1.00 7.21 C ATOM 1480 O VAL B 23 -3.456 9.665 6.292 1.00 7.74 O ATOM 1481 CB VAL B 23 -2.675 9.652 3.287 1.00 6.77 C ATOM 1482 CG1 VAL B 23 -3.762 10.703 3.464 1.00 7.35 C ATOM 1483 CG2 VAL B 23 -1.296 10.281 3.423 1.00 7.25 C ATOM 0 H VAL B 23 -4.902 8.455 3.874 1.00 5.98 H new ATOM 0 HA VAL B 23 -2.089 7.732 4.053 1.00 6.42 H new ATOM 0 HB VAL B 23 -2.772 9.241 2.282 1.00 6.77 H new ATOM 0 HG11 VAL B 23 -3.610 11.509 2.746 1.00 7.35 H new ATOM 0 HG12 VAL B 23 -4.738 10.248 3.297 1.00 7.35 H new ATOM 0 HG13 VAL B 23 -3.717 11.106 4.476 1.00 7.35 H new ATOM 0 HG21 VAL B 23 -1.198 11.101 2.711 1.00 7.25 H new ATOM 0 HG22 VAL B 23 -1.168 10.663 4.436 1.00 7.25 H new ATOM 0 HG23 VAL B 23 -0.532 9.531 3.219 1.00 7.25 H new ATOM 1493 N GLU B 24 -1.499 8.560 6.292 1.00 7.30 N ATOM 1494 CA GLU B 24 -1.125 8.976 7.633 1.00 8.08 C ATOM 1495 C GLU B 24 0.189 9.741 7.564 1.00 8.45 C ATOM 1496 O GLU B 24 1.248 9.152 7.339 1.00 8.09 O ATOM 1497 CB GLU B 24 -0.983 7.753 8.541 1.00 7.99 C ATOM 1498 CG GLU B 24 -0.808 8.082 10.015 1.00 8.87 C ATOM 1499 CD GLU B 24 -2.018 8.769 10.611 1.00 9.06 C ATOM 1500 OE1 GLU B 24 -3.141 8.240 10.461 1.00 9.18 O ATOM 1501 OE2 GLU B 24 -1.852 9.826 11.252 1.00 9.44 O ATOM 0 H GLU B 24 -0.826 7.938 5.844 1.00 7.30 H new ATOM 0 HA GLU B 24 -1.899 9.622 8.048 1.00 8.08 H new ATOM 0 HB2 GLU B 24 -1.866 7.124 8.424 1.00 7.99 H new ATOM 0 HB3 GLU B 24 -0.127 7.166 8.208 1.00 7.99 H new ATOM 0 HG2 GLU B 24 -0.609 7.163 10.566 1.00 8.87 H new ATOM 0 HG3 GLU B 24 0.065 8.723 10.138 1.00 8.87 H new ATOM 1508 N GLY B 25 0.113 11.051 7.724 1.00 9.20 N ATOM 1509 CA GLY B 25 1.284 11.885 7.566 1.00 9.66 C ATOM 1510 C GLY B 25 1.719 11.957 6.119 1.00 9.29 C ATOM 1511 O GLY B 25 1.069 12.607 5.300 1.00 9.46 O ATOM 0 H GLY B 25 -0.742 11.554 7.961 1.00 9.20 H new ATOM 0 HA2 GLY B 25 1.070 12.889 7.934 1.00 9.66 H new ATOM 0 HA3 GLY B 25 2.099 11.490 8.173 1.00 9.66 H new ATOM 1515 N GLU B 26 2.810 11.279 5.798 1.00 8.83 N ATOM 1516 CA GLU B 26 3.302 11.224 4.429 1.00 8.54 C ATOM 1517 C GLU B 26 3.244 9.792 3.902 1.00 7.58 C ATOM 1518 O GLU B 26 3.553 9.528 2.740 1.00 7.39 O ATOM 1519 CB GLU B 26 4.741 11.753 4.345 1.00 8.75 C ATOM 1520 CG GLU B 26 5.777 10.894 5.066 1.00 9.32 C ATOM 1521 CD GLU B 26 5.640 10.931 6.575 1.00 8.94 C ATOM 1522 OE1 GLU B 26 6.250 11.815 7.207 1.00 9.09 O ATOM 1523 OE2 GLU B 26 4.928 10.073 7.140 1.00 9.25 O ATOM 0 H GLU B 26 3.374 10.757 6.469 1.00 8.83 H new ATOM 0 HA GLU B 26 2.663 11.857 3.813 1.00 8.54 H new ATOM 0 HB2 GLU B 26 5.023 11.835 3.295 1.00 8.75 H new ATOM 0 HB3 GLU B 26 4.769 12.760 4.762 1.00 8.75 H new ATOM 0 HG2 GLU B 26 5.685 9.863 4.725 1.00 9.32 H new ATOM 0 HG3 GLU B 26 6.776 11.233 4.790 1.00 9.32 H new ATOM 1530 N ARG B 27 2.848 8.872 4.768 1.00 7.08 N ATOM 1531 CA ARG B 27 2.821 7.457 4.430 1.00 6.17 C ATOM 1532 C ARG B 27 1.392 6.969 4.258 1.00 5.81 C ATOM 1533 O ARG B 27 0.603 6.959 5.204 1.00 6.17 O ATOM 1534 CB ARG B 27 3.540 6.655 5.522 1.00 5.82 C ATOM 1535 CG ARG B 27 3.375 5.140 5.438 1.00 5.05 C ATOM 1536 CD ARG B 27 3.858 4.564 4.114 1.00 5.18 C ATOM 1537 NE ARG B 27 4.469 3.237 4.286 1.00 5.89 N ATOM 1538 CZ ARG B 27 3.816 2.071 4.174 1.00 6.56 C ATOM 1539 NH1 ARG B 27 2.534 2.038 3.837 1.00 6.63 N ATOM 1540 NH2 ARG B 27 4.456 0.925 4.388 1.00 7.34 N ATOM 0 H ARG B 27 2.539 9.082 5.717 1.00 7.08 H new ATOM 0 HA ARG B 27 3.338 7.310 3.482 1.00 6.17 H new ATOM 0 HB2 ARG B 27 4.603 6.890 5.481 1.00 5.82 H new ATOM 0 HB3 ARG B 27 3.177 6.990 6.494 1.00 5.82 H new ATOM 0 HG2 ARG B 27 3.927 4.674 6.254 1.00 5.05 H new ATOM 0 HG3 ARG B 27 2.324 4.886 5.577 1.00 5.05 H new ATOM 0 HD2 ARG B 27 3.019 4.491 3.422 1.00 5.18 H new ATOM 0 HD3 ARG B 27 4.583 5.243 3.665 1.00 5.18 H new ATOM 0 HE ARG B 27 5.464 3.201 4.507 1.00 5.89 H new ATOM 0 HH11 ARG B 27 2.031 2.907 3.659 1.00 6.63 H new ATOM 0 HH12 ARG B 27 2.051 1.143 3.756 1.00 6.63 H new ATOM 0 HH21 ARG B 27 5.445 0.932 4.638 1.00 7.34 H new ATOM 0 HH22 ARG B 27 3.958 0.039 4.302 1.00 7.34 H new ATOM 1554 N LEU B 28 1.059 6.587 3.037 1.00 5.18 N ATOM 1555 CA LEU B 28 -0.220 5.962 2.763 1.00 4.75 C ATOM 1556 C LEU B 28 -0.238 4.589 3.422 1.00 4.35 C ATOM 1557 O LEU B 28 0.601 3.739 3.126 1.00 3.95 O ATOM 1558 CB LEU B 28 -0.447 5.859 1.244 1.00 4.29 C ATOM 1559 CG LEU B 28 -1.869 5.488 0.796 1.00 3.68 C ATOM 1560 CD1 LEU B 28 -2.080 5.888 -0.654 1.00 3.48 C ATOM 1561 CD2 LEU B 28 -2.127 3.997 0.955 1.00 3.83 C ATOM 0 H LEU B 28 1.659 6.700 2.220 1.00 5.18 H new ATOM 0 HA LEU B 28 -1.031 6.565 3.172 1.00 4.75 H new ATOM 0 HB2 LEU B 28 -0.184 6.815 0.792 1.00 4.29 H new ATOM 0 HB3 LEU B 28 0.243 5.117 0.844 1.00 4.29 H new ATOM 0 HG LEU B 28 -2.571 6.028 1.431 1.00 3.68 H new ATOM 0 HD11 LEU B 28 -3.091 5.621 -0.962 1.00 3.48 H new ATOM 0 HD12 LEU B 28 -1.941 6.964 -0.758 1.00 3.48 H new ATOM 0 HD13 LEU B 28 -1.359 5.367 -1.284 1.00 3.48 H new ATOM 0 HD21 LEU B 28 -3.141 3.767 0.630 1.00 3.83 H new ATOM 0 HD22 LEU B 28 -1.415 3.438 0.348 1.00 3.83 H new ATOM 0 HD23 LEU B 28 -2.009 3.717 2.002 1.00 3.83 H new ATOM 1573 N ARG B 29 -1.163 4.396 4.339 1.00 4.62 N ATOM 1574 CA ARG B 29 -1.268 3.148 5.069 1.00 4.54 C ATOM 1575 C ARG B 29 -2.137 2.174 4.294 1.00 3.87 C ATOM 1576 O ARG B 29 -3.263 2.500 3.913 1.00 3.74 O ATOM 1577 CB ARG B 29 -1.870 3.392 6.456 1.00 5.38 C ATOM 1578 CG ARG B 29 -1.172 4.483 7.256 1.00 6.16 C ATOM 1579 CD ARG B 29 0.196 4.042 7.752 1.00 6.30 C ATOM 1580 NE ARG B 29 0.102 2.917 8.681 1.00 6.97 N ATOM 1581 CZ ARG B 29 1.113 2.476 9.430 1.00 7.39 C ATOM 1582 NH1 ARG B 29 2.284 3.099 9.410 1.00 7.29 N ATOM 1583 NH2 ARG B 29 0.943 1.423 10.223 1.00 8.07 N ATOM 0 H ARG B 29 -1.860 5.094 4.599 1.00 4.62 H new ATOM 0 HA ARG B 29 -0.271 2.725 5.190 1.00 4.54 H new ATOM 0 HB2 ARG B 29 -2.921 3.657 6.342 1.00 5.38 H new ATOM 0 HB3 ARG B 29 -1.835 2.462 7.024 1.00 5.38 H new ATOM 0 HG2 ARG B 29 -1.063 5.373 6.636 1.00 6.16 H new ATOM 0 HG3 ARG B 29 -1.793 4.762 8.107 1.00 6.16 H new ATOM 0 HD2 ARG B 29 0.817 3.760 6.902 1.00 6.30 H new ATOM 0 HD3 ARG B 29 0.691 4.879 8.244 1.00 6.30 H new ATOM 0 HE ARG B 29 -0.795 2.438 8.761 1.00 6.97 H new ATOM 0 HH11 ARG B 29 2.415 3.920 8.819 1.00 7.29 H new ATOM 0 HH12 ARG B 29 3.054 2.757 9.985 1.00 7.29 H new ATOM 0 HH21 ARG B 29 0.039 0.952 10.259 1.00 8.07 H new ATOM 0 HH22 ARG B 29 1.717 1.086 10.796 1.00 8.07 H new ATOM 1597 N PHE B 30 -1.607 0.989 4.059 1.00 3.54 N ATOM 1598 CA PHE B 30 -2.308 -0.006 3.277 1.00 3.01 C ATOM 1599 C PHE B 30 -2.721 -1.168 4.173 1.00 3.62 C ATOM 1600 O PHE B 30 -1.911 -1.683 4.946 1.00 4.16 O ATOM 1601 CB PHE B 30 -1.406 -0.500 2.141 1.00 2.37 C ATOM 1602 CG PHE B 30 -2.142 -0.852 0.876 1.00 1.77 C ATOM 1603 CD1 PHE B 30 -3.191 -1.758 0.893 1.00 2.01 C ATOM 1604 CD2 PHE B 30 -1.779 -0.281 -0.337 1.00 1.94 C ATOM 1605 CE1 PHE B 30 -3.863 -2.084 -0.267 1.00 1.96 C ATOM 1606 CE2 PHE B 30 -2.448 -0.606 -1.499 1.00 1.84 C ATOM 1607 CZ PHE B 30 -3.491 -1.507 -1.464 1.00 1.59 C ATOM 0 H PHE B 30 -0.692 0.694 4.400 1.00 3.54 H new ATOM 0 HA PHE B 30 -3.205 0.438 2.844 1.00 3.01 H new ATOM 0 HB2 PHE B 30 -0.669 0.271 1.916 1.00 2.37 H new ATOM 0 HB3 PHE B 30 -0.856 -1.377 2.484 1.00 2.37 H new ATOM 0 HD1 PHE B 30 -3.486 -2.215 1.826 1.00 2.01 H new ATOM 0 HD2 PHE B 30 -0.963 0.426 -0.371 1.00 1.94 H new ATOM 0 HE1 PHE B 30 -4.680 -2.790 -0.238 1.00 1.96 H new ATOM 0 HE2 PHE B 30 -2.155 -0.155 -2.435 1.00 1.84 H new ATOM 0 HZ PHE B 30 -4.016 -1.761 -2.373 1.00 1.59 H new ATOM 1617 N GLN B 31 -3.978 -1.562 4.076 1.00 3.62 N ATOM 1618 CA GLN B 31 -4.497 -2.674 4.855 1.00 4.28 C ATOM 1619 C GLN B 31 -5.120 -3.712 3.933 1.00 4.09 C ATOM 1620 O GLN B 31 -6.181 -3.482 3.357 1.00 3.68 O ATOM 1621 CB GLN B 31 -5.533 -2.173 5.871 1.00 4.83 C ATOM 1622 CG GLN B 31 -6.162 -3.275 6.711 1.00 5.54 C ATOM 1623 CD GLN B 31 -5.147 -4.049 7.533 1.00 6.28 C ATOM 1624 OE1 GLN B 31 -4.057 -3.398 7.910 1.00 6.66 O flip ATOM 1625 NE2 GLN B 31 -5.342 -5.225 7.828 1.00 6.72 N flip ATOM 0 H GLN B 31 -4.664 -1.125 3.460 1.00 3.62 H new ATOM 0 HA GLN B 31 -3.674 -3.137 5.398 1.00 4.28 H new ATOM 0 HB2 GLN B 31 -5.056 -1.452 6.535 1.00 4.83 H new ATOM 0 HB3 GLN B 31 -6.322 -1.642 5.338 1.00 4.83 H new ATOM 0 HG2 GLN B 31 -6.903 -2.836 7.379 1.00 5.54 H new ATOM 0 HG3 GLN B 31 -6.693 -3.966 6.055 1.00 5.54 H new ATOM 0 HE21 GLN B 31 -6.194 -5.694 7.520 1.00 6.72 H new ATOM 0 HE22 GLN B 31 -4.652 -5.733 8.381 1.00 6.72 H new ATOM 1634 N ALA B 32 -4.449 -4.841 3.783 1.00 4.50 N ATOM 1635 CA ALA B 32 -4.942 -5.910 2.935 1.00 4.62 C ATOM 1636 C ALA B 32 -4.479 -7.261 3.457 1.00 5.46 C ATOM 1637 O ALA B 32 -3.296 -7.450 3.744 1.00 5.75 O ATOM 1638 CB ALA B 32 -4.476 -5.704 1.501 1.00 4.15 C ATOM 0 H ALA B 32 -3.559 -5.040 4.239 1.00 4.50 H new ATOM 0 HA ALA B 32 -6.032 -5.891 2.952 1.00 4.62 H new ATOM 0 HB1 ALA B 32 -4.853 -6.513 0.876 1.00 4.15 H new ATOM 0 HB2 ALA B 32 -4.854 -4.752 1.129 1.00 4.15 H new ATOM 0 HB3 ALA B 32 -3.386 -5.699 1.470 1.00 4.15 H new ATOM 1644 N PRO B 33 -5.411 -8.213 3.607 1.00 5.89 N ATOM 1645 CA PRO B 33 -5.086 -9.570 4.043 1.00 6.71 C ATOM 1646 C PRO B 33 -4.258 -10.319 2.997 1.00 6.87 C ATOM 1647 O PRO B 33 -4.278 -9.980 1.808 1.00 6.45 O ATOM 1648 CB PRO B 33 -6.455 -10.232 4.226 1.00 6.98 C ATOM 1649 CG PRO B 33 -7.380 -9.446 3.366 1.00 6.45 C ATOM 1650 CD PRO B 33 -6.855 -8.038 3.371 1.00 5.63 C ATOM 0 HA PRO B 33 -4.481 -9.577 4.950 1.00 6.71 H new ATOM 0 HB2 PRO B 33 -6.430 -11.279 3.925 1.00 6.98 H new ATOM 0 HB3 PRO B 33 -6.769 -10.207 5.269 1.00 6.98 H new ATOM 0 HG2 PRO B 33 -7.408 -9.848 2.353 1.00 6.45 H new ATOM 0 HG3 PRO B 33 -8.399 -9.484 3.752 1.00 6.45 H new ATOM 0 HD2 PRO B 33 -7.049 -7.533 2.425 1.00 5.63 H new ATOM 0 HD3 PRO B 33 -7.320 -7.438 4.153 1.00 5.63 H new ATOM 1658 N PRO B 34 -3.516 -11.349 3.420 1.00 7.55 N ATOM 1659 CA PRO B 34 -2.668 -12.127 2.519 1.00 7.81 C ATOM 1660 C PRO B 34 -3.461 -12.781 1.387 1.00 8.02 C ATOM 1661 O PRO B 34 -4.427 -13.509 1.623 1.00 8.45 O ATOM 1662 CB PRO B 34 -2.044 -13.195 3.427 1.00 8.57 C ATOM 1663 CG PRO B 34 -2.902 -13.229 4.646 1.00 8.85 C ATOM 1664 CD PRO B 34 -3.451 -11.842 4.805 1.00 8.16 C ATOM 0 HA PRO B 34 -1.931 -11.497 2.021 1.00 7.81 H new ATOM 0 HB2 PRO B 34 -2.024 -14.167 2.934 1.00 8.57 H new ATOM 0 HB3 PRO B 34 -1.014 -12.944 3.679 1.00 8.57 H new ATOM 0 HG2 PRO B 34 -3.706 -13.957 4.537 1.00 8.85 H new ATOM 0 HG3 PRO B 34 -2.324 -13.522 5.522 1.00 8.85 H new ATOM 0 HD2 PRO B 34 -4.433 -11.849 5.277 1.00 8.16 H new ATOM 0 HD3 PRO B 34 -2.804 -11.221 5.424 1.00 8.16 H new ATOM 1672 N GLY B 35 -3.058 -12.485 0.155 1.00 7.75 N ATOM 1673 CA GLY B 35 -3.648 -13.136 -1.001 1.00 8.09 C ATOM 1674 C GLY B 35 -4.480 -12.202 -1.859 1.00 7.59 C ATOM 1675 O GLY B 35 -4.643 -12.435 -3.056 1.00 7.78 O ATOM 0 H GLY B 35 -2.331 -11.804 -0.064 1.00 7.75 H new ATOM 0 HA2 GLY B 35 -2.854 -13.567 -1.611 1.00 8.09 H new ATOM 0 HA3 GLY B 35 -4.274 -13.962 -0.663 1.00 8.09 H new ATOM 1679 N VAL B 36 -4.989 -11.133 -1.265 1.00 7.00 N ATOM 1680 CA VAL B 36 -5.864 -10.215 -1.987 1.00 6.54 C ATOM 1681 C VAL B 36 -5.083 -9.034 -2.555 1.00 5.96 C ATOM 1682 O VAL B 36 -5.657 -8.124 -3.139 1.00 5.81 O ATOM 1683 CB VAL B 36 -7.002 -9.685 -1.087 1.00 6.15 C ATOM 1684 CG1 VAL B 36 -7.732 -10.837 -0.410 1.00 6.78 C ATOM 1685 CG2 VAL B 36 -6.470 -8.701 -0.058 1.00 5.59 C ATOM 0 H VAL B 36 -4.815 -10.879 -0.293 1.00 7.00 H new ATOM 0 HA VAL B 36 -6.300 -10.784 -2.808 1.00 6.54 H new ATOM 0 HB VAL B 36 -7.714 -9.155 -1.719 1.00 6.15 H new ATOM 0 HG11 VAL B 36 -8.530 -10.443 0.219 1.00 6.78 H new ATOM 0 HG12 VAL B 36 -8.159 -11.493 -1.169 1.00 6.78 H new ATOM 0 HG13 VAL B 36 -7.031 -11.401 0.204 1.00 6.78 H new ATOM 0 HG21 VAL B 36 -7.292 -8.343 0.562 1.00 5.59 H new ATOM 0 HG22 VAL B 36 -5.730 -9.196 0.570 1.00 5.59 H new ATOM 0 HG23 VAL B 36 -6.006 -7.857 -0.568 1.00 5.59 H new ATOM 1695 N MET B 37 -3.769 -9.063 -2.401 1.00 5.73 N ATOM 1696 CA MET B 37 -2.935 -7.955 -2.847 1.00 5.13 C ATOM 1697 C MET B 37 -2.369 -8.228 -4.239 1.00 5.49 C ATOM 1698 O MET B 37 -1.392 -7.614 -4.660 1.00 5.20 O ATOM 1699 CB MET B 37 -1.806 -7.701 -1.847 1.00 4.75 C ATOM 1700 CG MET B 37 -1.160 -6.325 -1.976 1.00 4.01 C ATOM 1701 SD MET B 37 -2.120 -5.003 -1.194 1.00 3.52 S ATOM 1702 CE MET B 37 -3.642 -5.011 -2.144 1.00 3.19 C ATOM 0 H MET B 37 -3.258 -9.836 -1.974 1.00 5.73 H new ATOM 0 HA MET B 37 -3.555 -7.061 -2.903 1.00 5.13 H new ATOM 0 HB2 MET B 37 -2.198 -7.814 -0.836 1.00 4.75 H new ATOM 0 HB3 MET B 37 -1.039 -8.465 -1.979 1.00 4.75 H new ATOM 0 HG2 MET B 37 -0.166 -6.355 -1.529 1.00 4.01 H new ATOM 0 HG3 MET B 37 -1.028 -6.092 -3.032 1.00 4.01 H new ATOM 0 HE1 MET B 37 -4.162 -4.063 -2.005 1.00 3.19 H new ATOM 0 HE2 MET B 37 -3.411 -5.147 -3.201 1.00 3.19 H new ATOM 0 HE3 MET B 37 -4.279 -5.828 -1.804 1.00 3.19 H new ATOM 1712 N THR B 38 -3.000 -9.158 -4.944 1.00 6.18 N ATOM 1713 CA THR B 38 -2.566 -9.552 -6.279 1.00 6.68 C ATOM 1714 C THR B 38 -2.527 -8.352 -7.234 1.00 6.35 C ATOM 1715 O THR B 38 -3.343 -7.433 -7.122 1.00 5.90 O ATOM 1716 CB THR B 38 -3.493 -10.649 -6.842 1.00 7.43 C ATOM 1717 OG1 THR B 38 -4.864 -10.278 -6.642 1.00 7.27 O ATOM 1718 CG2 THR B 38 -3.223 -11.984 -6.161 1.00 7.96 C ATOM 0 H THR B 38 -3.823 -9.659 -4.609 1.00 6.18 H new ATOM 0 HA THR B 38 -1.554 -9.948 -6.196 1.00 6.68 H new ATOM 0 HB THR B 38 -3.294 -10.753 -7.909 1.00 7.43 H new ATOM 0 HG1 THR B 38 -5.448 -10.977 -7.003 1.00 7.27 H new ATOM 0 HG21 THR B 38 -3.887 -12.744 -6.573 1.00 7.96 H new ATOM 0 HG22 THR B 38 -2.187 -12.277 -6.332 1.00 7.96 H new ATOM 0 HG23 THR B 38 -3.401 -11.889 -5.090 1.00 7.96 H new ATOM 1726 N PRO B 39 -1.563 -8.347 -8.179 1.00 6.65 N ATOM 1727 CA PRO B 39 -1.370 -7.242 -9.130 1.00 6.53 C ATOM 1728 C PRO B 39 -2.656 -6.831 -9.842 1.00 6.66 C ATOM 1729 O PRO B 39 -2.916 -5.637 -10.023 1.00 6.35 O ATOM 1730 CB PRO B 39 -0.363 -7.809 -10.131 1.00 7.19 C ATOM 1731 CG PRO B 39 0.403 -8.819 -9.351 1.00 7.30 C ATOM 1732 CD PRO B 39 -0.572 -9.421 -8.381 1.00 7.21 C ATOM 0 HA PRO B 39 -1.035 -6.336 -8.626 1.00 6.53 H new ATOM 0 HB2 PRO B 39 -0.864 -8.263 -10.986 1.00 7.19 H new ATOM 0 HB3 PRO B 39 0.291 -7.029 -10.522 1.00 7.19 H new ATOM 0 HG2 PRO B 39 0.822 -9.582 -10.007 1.00 7.30 H new ATOM 0 HG3 PRO B 39 1.239 -8.355 -8.827 1.00 7.30 H new ATOM 0 HD2 PRO B 39 -1.034 -10.323 -8.783 1.00 7.21 H new ATOM 0 HD3 PRO B 39 -0.087 -9.701 -7.446 1.00 7.21 H new ATOM 1740 N GLU B 40 -3.461 -7.815 -10.236 1.00 7.16 N ATOM 1741 CA GLU B 40 -4.733 -7.539 -10.890 1.00 7.32 C ATOM 1742 C GLU B 40 -5.614 -6.678 -9.998 1.00 6.59 C ATOM 1743 O GLU B 40 -6.144 -5.664 -10.438 1.00 6.46 O ATOM 1744 CB GLU B 40 -5.473 -8.834 -11.241 1.00 7.95 C ATOM 1745 CG GLU B 40 -6.755 -8.593 -12.027 1.00 8.17 C ATOM 1746 CD GLU B 40 -7.551 -9.857 -12.268 1.00 8.67 C ATOM 1747 OE1 GLU B 40 -7.284 -10.556 -13.270 1.00 9.22 O ATOM 1748 OE2 GLU B 40 -8.462 -10.150 -11.466 1.00 8.70 O ATOM 0 H GLU B 40 -3.254 -8.806 -10.113 1.00 7.16 H new ATOM 0 HA GLU B 40 -4.517 -7.002 -11.814 1.00 7.32 H new ATOM 0 HB2 GLU B 40 -4.812 -9.477 -11.822 1.00 7.95 H new ATOM 0 HB3 GLU B 40 -5.712 -9.370 -10.322 1.00 7.95 H new ATOM 0 HG2 GLU B 40 -7.376 -7.877 -11.488 1.00 8.17 H new ATOM 0 HG3 GLU B 40 -6.506 -8.139 -12.986 1.00 8.17 H new ATOM 1755 N LEU B 41 -5.743 -7.072 -8.735 1.00 6.17 N ATOM 1756 CA LEU B 41 -6.607 -6.369 -7.797 1.00 5.47 C ATOM 1757 C LEU B 41 -6.076 -4.968 -7.525 1.00 4.86 C ATOM 1758 O LEU B 41 -6.847 -4.015 -7.406 1.00 4.46 O ATOM 1759 CB LEU B 41 -6.743 -7.162 -6.494 1.00 5.29 C ATOM 1760 CG LEU B 41 -7.783 -6.624 -5.506 1.00 4.67 C ATOM 1761 CD1 LEU B 41 -8.429 -7.770 -4.751 1.00 5.06 C ATOM 1762 CD2 LEU B 41 -7.150 -5.650 -4.522 1.00 4.24 C ATOM 0 H LEU B 41 -5.258 -7.877 -8.338 1.00 6.17 H new ATOM 0 HA LEU B 41 -7.597 -6.276 -8.244 1.00 5.47 H new ATOM 0 HB2 LEU B 41 -6.999 -8.193 -6.740 1.00 5.29 H new ATOM 0 HB3 LEU B 41 -5.772 -7.184 -5.998 1.00 5.29 H new ATOM 0 HG LEU B 41 -8.545 -6.092 -6.075 1.00 4.67 H new ATOM 0 HD11 LEU B 41 -9.166 -7.375 -4.052 1.00 5.06 H new ATOM 0 HD12 LEU B 41 -8.920 -8.440 -5.457 1.00 5.06 H new ATOM 0 HD13 LEU B 41 -7.665 -8.320 -4.201 1.00 5.06 H new ATOM 0 HD21 LEU B 41 -7.911 -5.284 -3.832 1.00 4.24 H new ATOM 0 HD22 LEU B 41 -6.366 -6.158 -3.961 1.00 4.24 H new ATOM 0 HD23 LEU B 41 -6.720 -4.810 -5.067 1.00 4.24 H new ATOM 1774 N GLN B 42 -4.759 -4.845 -7.439 1.00 4.84 N ATOM 1775 CA GLN B 42 -4.133 -3.544 -7.256 1.00 4.35 C ATOM 1776 C GLN B 42 -4.490 -2.630 -8.428 1.00 4.69 C ATOM 1777 O GLN B 42 -4.774 -1.445 -8.246 1.00 4.37 O ATOM 1778 CB GLN B 42 -2.610 -3.684 -7.138 1.00 4.43 C ATOM 1779 CG GLN B 42 -1.909 -2.381 -6.772 1.00 4.02 C ATOM 1780 CD GLN B 42 -2.246 -1.907 -5.368 1.00 3.27 C ATOM 1781 OE1 GLN B 42 -2.297 -0.702 -5.100 1.00 3.29 O ATOM 1782 NE2 GLN B 42 -2.458 -2.843 -4.455 1.00 3.09 N ATOM 0 H GLN B 42 -4.106 -5.627 -7.493 1.00 4.84 H new ATOM 0 HA GLN B 42 -4.506 -3.105 -6.331 1.00 4.35 H new ATOM 0 HB2 GLN B 42 -2.379 -4.436 -6.384 1.00 4.43 H new ATOM 0 HB3 GLN B 42 -2.212 -4.049 -8.085 1.00 4.43 H new ATOM 0 HG2 GLN B 42 -0.831 -2.517 -6.856 1.00 4.02 H new ATOM 0 HG3 GLN B 42 -2.189 -1.609 -7.489 1.00 4.02 H new ATOM 0 HE21 GLN B 42 -2.407 -3.828 -4.714 1.00 3.09 H new ATOM 0 HE22 GLN B 42 -2.672 -2.578 -3.493 1.00 3.09 H new ATOM 1791 N SER B 43 -4.490 -3.202 -9.627 1.00 5.44 N ATOM 1792 CA SER B 43 -4.867 -2.474 -10.826 1.00 5.93 C ATOM 1793 C SER B 43 -6.379 -2.230 -10.854 1.00 5.79 C ATOM 1794 O SER B 43 -6.845 -1.239 -11.418 1.00 5.94 O ATOM 1795 CB SER B 43 -4.423 -3.248 -12.073 1.00 6.77 C ATOM 1796 OG SER B 43 -4.508 -2.441 -13.239 1.00 7.35 O ATOM 0 H SER B 43 -4.231 -4.175 -9.791 1.00 5.44 H new ATOM 0 HA SER B 43 -4.366 -1.506 -10.819 1.00 5.93 H new ATOM 0 HB2 SER B 43 -3.398 -3.595 -11.942 1.00 6.77 H new ATOM 0 HB3 SER B 43 -5.046 -4.134 -12.195 1.00 6.77 H new ATOM 0 HG SER B 43 -4.217 -2.960 -14.018 1.00 7.35 H new ATOM 1802 N ARG B 44 -7.139 -3.139 -10.246 1.00 5.57 N ATOM 1803 CA ARG B 44 -8.590 -2.996 -10.149 1.00 5.41 C ATOM 1804 C ARG B 44 -8.955 -1.814 -9.262 1.00 4.69 C ATOM 1805 O ARG B 44 -9.963 -1.155 -9.483 1.00 4.71 O ATOM 1806 CB ARG B 44 -9.232 -4.275 -9.605 1.00 5.44 C ATOM 1807 CG ARG B 44 -9.155 -5.450 -10.568 1.00 6.25 C ATOM 1808 CD ARG B 44 -9.959 -5.186 -11.831 1.00 6.38 C ATOM 1809 NE ARG B 44 -11.389 -5.097 -11.555 1.00 7.03 N ATOM 1810 CZ ARG B 44 -12.135 -4.027 -11.811 1.00 7.53 C ATOM 1811 NH1 ARG B 44 -11.596 -2.942 -12.356 1.00 7.50 N ATOM 1812 NH2 ARG B 44 -13.429 -4.051 -11.520 1.00 8.28 N ATOM 0 H ARG B 44 -6.772 -3.986 -9.812 1.00 5.57 H new ATOM 0 HA ARG B 44 -8.974 -2.815 -11.153 1.00 5.41 H new ATOM 0 HB2 ARG B 44 -8.742 -4.549 -8.671 1.00 5.44 H new ATOM 0 HB3 ARG B 44 -10.278 -4.076 -9.370 1.00 5.44 H new ATOM 0 HG2 ARG B 44 -8.114 -5.640 -10.830 1.00 6.25 H new ATOM 0 HG3 ARG B 44 -9.529 -6.349 -10.078 1.00 6.25 H new ATOM 0 HD2 ARG B 44 -9.619 -4.258 -12.291 1.00 6.38 H new ATOM 0 HD3 ARG B 44 -9.777 -5.984 -12.551 1.00 6.38 H new ATOM 0 HE ARG B 44 -11.846 -5.908 -11.139 1.00 7.03 H new ATOM 0 HH11 ARG B 44 -10.601 -2.925 -12.582 1.00 7.50 H new ATOM 0 HH12 ARG B 44 -12.177 -2.126 -12.549 1.00 7.50 H new ATOM 0 HH21 ARG B 44 -13.843 -4.885 -11.104 1.00 8.28 H new ATOM 0 HH22 ARG B 44 -14.010 -3.235 -11.712 1.00 8.28 H new ATOM 1826 N LEU B 45 -8.120 -1.562 -8.258 1.00 4.13 N ATOM 1827 CA LEU B 45 -8.284 -0.399 -7.390 1.00 3.49 C ATOM 1828 C LEU B 45 -8.144 0.885 -8.204 1.00 3.91 C ATOM 1829 O LEU B 45 -8.634 1.943 -7.812 1.00 3.85 O ATOM 1830 CB LEU B 45 -7.244 -0.427 -6.263 1.00 2.89 C ATOM 1831 CG LEU B 45 -7.318 -1.646 -5.337 1.00 2.68 C ATOM 1832 CD1 LEU B 45 -6.147 -1.649 -4.369 1.00 2.32 C ATOM 1833 CD2 LEU B 45 -8.638 -1.665 -4.576 1.00 2.32 C ATOM 0 H LEU B 45 -7.320 -2.150 -8.024 1.00 4.13 H new ATOM 0 HA LEU B 45 -9.279 -0.429 -6.947 1.00 3.49 H new ATOM 0 HB2 LEU B 45 -6.249 -0.388 -6.707 1.00 2.89 H new ATOM 0 HB3 LEU B 45 -7.360 0.474 -5.661 1.00 2.89 H new ATOM 0 HG LEU B 45 -7.264 -2.546 -5.950 1.00 2.68 H new ATOM 0 HD11 LEU B 45 -6.215 -2.521 -3.719 1.00 2.32 H new ATOM 0 HD12 LEU B 45 -5.212 -1.685 -4.929 1.00 2.32 H new ATOM 0 HD13 LEU B 45 -6.173 -0.743 -3.764 1.00 2.32 H new ATOM 0 HD21 LEU B 45 -8.670 -2.538 -3.925 1.00 2.32 H new ATOM 0 HD22 LEU B 45 -8.724 -0.760 -3.974 1.00 2.32 H new ATOM 0 HD23 LEU B 45 -9.466 -1.710 -5.284 1.00 2.32 H new ATOM 1845 N GLY B 46 -7.421 0.786 -9.314 1.00 4.49 N ATOM 1846 CA GLY B 46 -7.309 1.886 -10.254 1.00 5.11 C ATOM 1847 C GLY B 46 -6.223 2.867 -9.877 1.00 4.95 C ATOM 1848 O GLY B 46 -5.688 3.574 -10.729 1.00 5.58 O ATOM 0 H GLY B 46 -6.903 -0.051 -9.582 1.00 4.49 H new ATOM 0 HA2 GLY B 46 -7.105 1.489 -11.249 1.00 5.11 H new ATOM 0 HA3 GLY B 46 -8.263 2.410 -10.309 1.00 5.11 H new ATOM 1852 N GLY B 47 -5.882 2.898 -8.596 1.00 4.20 N ATOM 1853 CA GLY B 47 -4.865 3.810 -8.121 1.00 4.08 C ATOM 1854 C GLY B 47 -5.306 5.256 -8.214 1.00 4.27 C ATOM 1855 O GLY B 47 -4.476 6.160 -8.291 1.00 4.50 O ATOM 0 H GLY B 47 -6.294 2.305 -7.876 1.00 4.20 H new ATOM 0 HA2 GLY B 47 -4.621 3.572 -7.086 1.00 4.08 H new ATOM 0 HA3 GLY B 47 -3.954 3.671 -8.703 1.00 4.08 H new ATOM 1859 N ALA B 48 -6.615 5.476 -8.212 1.00 4.37 N ATOM 1860 CA ALA B 48 -7.157 6.818 -8.340 1.00 4.85 C ATOM 1861 C ALA B 48 -7.460 7.418 -6.975 1.00 4.49 C ATOM 1862 O ALA B 48 -7.800 6.698 -6.034 1.00 3.88 O ATOM 1863 CB ALA B 48 -8.413 6.797 -9.197 1.00 5.41 C ATOM 0 H ALA B 48 -7.318 4.742 -8.123 1.00 4.37 H new ATOM 0 HA ALA B 48 -6.407 7.443 -8.825 1.00 4.85 H new ATOM 0 HB1 ALA B 48 -8.810 7.808 -9.286 1.00 5.41 H new ATOM 0 HB2 ALA B 48 -8.171 6.414 -10.188 1.00 5.41 H new ATOM 0 HB3 ALA B 48 -9.160 6.154 -8.732 1.00 5.41 H new ATOM 1869 N ARG B 49 -7.355 8.739 -6.876 1.00 5.02 N ATOM 1870 CA ARG B 49 -7.616 9.432 -5.619 1.00 4.98 C ATOM 1871 C ARG B 49 -9.090 9.346 -5.234 1.00 5.00 C ATOM 1872 O ARG B 49 -9.413 9.013 -4.098 1.00 4.59 O ATOM 1873 CB ARG B 49 -7.162 10.902 -5.671 1.00 5.73 C ATOM 1874 CG ARG B 49 -7.690 11.697 -6.858 1.00 6.40 C ATOM 1875 CD ARG B 49 -6.755 11.614 -8.054 1.00 6.81 C ATOM 1876 NE ARG B 49 -7.326 12.226 -9.251 1.00 7.23 N ATOM 1877 CZ ARG B 49 -6.699 12.281 -10.426 1.00 7.61 C ATOM 1878 NH1 ARG B 49 -5.437 11.874 -10.529 1.00 7.61 N ATOM 1879 NH2 ARG B 49 -7.324 12.779 -11.485 1.00 8.22 N ATOM 0 H ARG B 49 -7.092 9.350 -7.649 1.00 5.02 H new ATOM 0 HA ARG B 49 -7.029 8.927 -4.852 1.00 4.98 H new ATOM 0 HB2 ARG B 49 -7.477 11.397 -4.752 1.00 5.73 H new ATOM 0 HB3 ARG B 49 -6.073 10.930 -5.690 1.00 5.73 H new ATOM 0 HG2 ARG B 49 -8.674 11.321 -7.139 1.00 6.40 H new ATOM 0 HG3 ARG B 49 -7.818 12.740 -6.569 1.00 6.40 H new ATOM 0 HD2 ARG B 49 -5.814 12.107 -7.811 1.00 6.81 H new ATOM 0 HD3 ARG B 49 -6.523 10.569 -8.259 1.00 6.81 H new ATOM 0 HE ARG B 49 -8.258 12.635 -9.184 1.00 7.23 H new ATOM 0 HH11 ARG B 49 -4.947 11.519 -9.708 1.00 7.61 H new ATOM 0 HH12 ARG B 49 -4.959 11.917 -11.429 1.00 7.61 H new ATOM 0 HH21 ARG B 49 -8.282 13.119 -11.399 1.00 8.22 H new ATOM 0 HH22 ARG B 49 -6.847 12.822 -12.385 1.00 8.22 H new ATOM 1893 N HIS B 50 -9.985 9.626 -6.184 1.00 5.53 N ATOM 1894 CA HIS B 50 -11.424 9.595 -5.904 1.00 5.65 C ATOM 1895 C HIS B 50 -11.875 8.211 -5.451 1.00 4.90 C ATOM 1896 O HIS B 50 -12.780 8.083 -4.623 1.00 4.73 O ATOM 1897 CB HIS B 50 -12.258 10.055 -7.113 1.00 6.40 C ATOM 1898 CG HIS B 50 -11.982 9.335 -8.402 1.00 6.57 C ATOM 1899 ND1 HIS B 50 -12.543 8.121 -8.736 1.00 6.34 N ATOM 1900 CD2 HIS B 50 -11.217 9.691 -9.460 1.00 7.07 C ATOM 1901 CE1 HIS B 50 -12.135 7.768 -9.940 1.00 6.75 C ATOM 1902 NE2 HIS B 50 -11.332 8.705 -10.405 1.00 7.16 N ATOM 0 H HIS B 50 -9.744 9.874 -7.144 1.00 5.53 H new ATOM 0 HA HIS B 50 -11.596 10.299 -5.090 1.00 5.65 H new ATOM 0 HB2 HIS B 50 -13.314 9.936 -6.870 1.00 6.40 H new ATOM 0 HB3 HIS B 50 -12.084 11.120 -7.268 1.00 6.40 H new ATOM 0 HD1 HIS B 50 -13.175 7.580 -8.145 1.00 6.34 H new ATOM 0 HD2 HIS B 50 -10.623 10.589 -9.544 1.00 7.07 H new ATOM 0 HE1 HIS B 50 -12.413 6.862 -10.459 1.00 6.75 H new ATOM 1911 N GLU B 51 -11.231 7.181 -5.975 1.00 4.52 N ATOM 1912 CA GLU B 51 -11.577 5.821 -5.608 1.00 3.87 C ATOM 1913 C GLU B 51 -11.159 5.539 -4.176 1.00 3.13 C ATOM 1914 O GLU B 51 -11.881 4.886 -3.432 1.00 2.72 O ATOM 1915 CB GLU B 51 -10.931 4.817 -6.560 1.00 3.90 C ATOM 1916 CG GLU B 51 -11.947 4.021 -7.358 1.00 4.40 C ATOM 1917 CD GLU B 51 -12.806 4.900 -8.244 1.00 5.21 C ATOM 1918 OE1 GLU B 51 -13.698 5.607 -7.718 1.00 5.72 O ATOM 1919 OE2 GLU B 51 -12.589 4.903 -9.469 1.00 5.60 O ATOM 0 H GLU B 51 -10.471 7.261 -6.651 1.00 4.52 H new ATOM 0 HA GLU B 51 -12.659 5.712 -5.685 1.00 3.87 H new ATOM 0 HB2 GLU B 51 -10.272 5.348 -7.247 1.00 3.90 H new ATOM 0 HB3 GLU B 51 -10.308 4.130 -5.987 1.00 3.90 H new ATOM 0 HG2 GLU B 51 -11.427 3.288 -7.974 1.00 4.40 H new ATOM 0 HG3 GLU B 51 -12.587 3.465 -6.673 1.00 4.40 H new ATOM 1926 N LEU B 52 -10.000 6.061 -3.783 1.00 3.04 N ATOM 1927 CA LEU B 52 -9.508 5.867 -2.428 1.00 2.56 C ATOM 1928 C LEU B 52 -10.340 6.658 -1.428 1.00 3.06 C ATOM 1929 O LEU B 52 -10.425 6.293 -0.259 1.00 2.94 O ATOM 1930 CB LEU B 52 -8.036 6.258 -2.315 1.00 2.52 C ATOM 1931 CG LEU B 52 -7.076 5.398 -3.134 1.00 2.10 C ATOM 1932 CD1 LEU B 52 -5.643 5.789 -2.834 1.00 2.00 C ATOM 1933 CD2 LEU B 52 -7.298 3.917 -2.856 1.00 1.52 C ATOM 0 H LEU B 52 -9.390 6.618 -4.381 1.00 3.04 H new ATOM 0 HA LEU B 52 -9.600 4.806 -2.194 1.00 2.56 H new ATOM 0 HB2 LEU B 52 -7.926 7.297 -2.627 1.00 2.52 H new ATOM 0 HB3 LEU B 52 -7.741 6.207 -1.267 1.00 2.52 H new ATOM 0 HG LEU B 52 -7.274 5.572 -4.192 1.00 2.10 H new ATOM 0 HD11 LEU B 52 -4.966 5.170 -3.423 1.00 2.00 H new ATOM 0 HD12 LEU B 52 -5.491 6.838 -3.090 1.00 2.00 H new ATOM 0 HD13 LEU B 52 -5.440 5.641 -1.773 1.00 2.00 H new ATOM 0 HD21 LEU B 52 -6.602 3.327 -3.452 1.00 1.52 H new ATOM 0 HD22 LEU B 52 -7.131 3.716 -1.798 1.00 1.52 H new ATOM 0 HD23 LEU B 52 -8.321 3.647 -3.119 1.00 1.52 H new ATOM 1945 N ILE B 53 -10.952 7.740 -1.891 1.00 3.78 N ATOM 1946 CA ILE B 53 -11.867 8.506 -1.061 1.00 4.35 C ATOM 1947 C ILE B 53 -13.047 7.632 -0.653 1.00 4.05 C ATOM 1948 O ILE B 53 -13.368 7.519 0.529 1.00 4.19 O ATOM 1949 CB ILE B 53 -12.384 9.763 -1.794 1.00 5.19 C ATOM 1950 CG1 ILE B 53 -11.215 10.687 -2.154 1.00 5.56 C ATOM 1951 CG2 ILE B 53 -13.407 10.498 -0.937 1.00 5.75 C ATOM 1952 CD1 ILE B 53 -11.621 11.888 -2.980 1.00 6.40 C ATOM 0 H ILE B 53 -10.831 8.105 -2.836 1.00 3.78 H new ATOM 0 HA ILE B 53 -11.321 8.832 -0.176 1.00 4.35 H new ATOM 0 HB ILE B 53 -12.874 9.451 -2.717 1.00 5.19 H new ATOM 0 HG12 ILE B 53 -10.740 11.032 -1.236 1.00 5.56 H new ATOM 0 HG13 ILE B 53 -10.467 10.115 -2.704 1.00 5.56 H new ATOM 0 HG21 ILE B 53 -13.760 11.381 -1.469 1.00 5.75 H new ATOM 0 HG22 ILE B 53 -14.249 9.838 -0.730 1.00 5.75 H new ATOM 0 HG23 ILE B 53 -12.944 10.802 0.002 1.00 5.75 H new ATOM 0 HD11 ILE B 53 -10.742 12.495 -3.196 1.00 6.40 H new ATOM 0 HD12 ILE B 53 -12.068 11.552 -3.915 1.00 6.40 H new ATOM 0 HD13 ILE B 53 -12.346 12.483 -2.425 1.00 6.40 H new ATOM 1964 N ALA B 54 -13.674 7.000 -1.636 1.00 3.73 N ATOM 1965 CA ALA B 54 -14.782 6.093 -1.375 1.00 3.39 C ATOM 1966 C ALA B 54 -14.293 4.837 -0.655 1.00 2.66 C ATOM 1967 O ALA B 54 -14.970 4.303 0.224 1.00 2.59 O ATOM 1968 CB ALA B 54 -15.476 5.730 -2.677 1.00 3.40 C ATOM 0 H ALA B 54 -13.433 7.099 -2.622 1.00 3.73 H new ATOM 0 HA ALA B 54 -15.499 6.596 -0.726 1.00 3.39 H new ATOM 0 HB1 ALA B 54 -16.304 5.051 -2.471 1.00 3.40 H new ATOM 0 HB2 ALA B 54 -15.858 6.635 -3.150 1.00 3.40 H new ATOM 0 HB3 ALA B 54 -14.765 5.244 -3.345 1.00 3.40 H new ATOM 1974 N LEU B 55 -13.106 4.385 -1.038 1.00 2.23 N ATOM 1975 CA LEU B 55 -12.479 3.214 -0.434 1.00 1.71 C ATOM 1976 C LEU B 55 -12.271 3.441 1.064 1.00 2.33 C ATOM 1977 O LEU B 55 -12.601 2.590 1.883 1.00 2.46 O ATOM 1978 CB LEU B 55 -11.143 2.933 -1.145 1.00 1.30 C ATOM 1979 CG LEU B 55 -10.512 1.551 -0.919 1.00 1.02 C ATOM 1980 CD1 LEU B 55 -9.906 1.441 0.468 1.00 1.74 C ATOM 1981 CD2 LEU B 55 -11.537 0.451 -1.143 1.00 1.20 C ATOM 0 H LEU B 55 -12.550 4.818 -1.775 1.00 2.23 H new ATOM 0 HA LEU B 55 -13.128 2.346 -0.551 1.00 1.71 H new ATOM 0 HB2 LEU B 55 -11.295 3.065 -2.216 1.00 1.30 H new ATOM 0 HB3 LEU B 55 -10.425 3.690 -0.829 1.00 1.30 H new ATOM 0 HG LEU B 55 -9.708 1.429 -1.645 1.00 1.02 H new ATOM 0 HD11 LEU B 55 -9.468 0.451 0.596 1.00 1.74 H new ATOM 0 HD12 LEU B 55 -9.132 2.199 0.588 1.00 1.74 H new ATOM 0 HD13 LEU B 55 -10.683 1.594 1.217 1.00 1.74 H new ATOM 0 HD21 LEU B 55 -11.070 -0.520 -0.978 1.00 1.20 H new ATOM 0 HD22 LEU B 55 -12.366 0.578 -0.446 1.00 1.20 H new ATOM 0 HD23 LEU B 55 -11.911 0.505 -2.165 1.00 1.20 H new ATOM 1993 N LEU B 56 -11.727 4.594 1.417 1.00 2.95 N ATOM 1994 CA LEU B 56 -11.519 4.949 2.814 1.00 3.69 C ATOM 1995 C LEU B 56 -12.853 5.165 3.520 1.00 4.03 C ATOM 1996 O LEU B 56 -13.015 4.817 4.687 1.00 4.45 O ATOM 1997 CB LEU B 56 -10.651 6.209 2.907 1.00 4.26 C ATOM 1998 CG LEU B 56 -10.609 6.897 4.275 1.00 5.04 C ATOM 1999 CD1 LEU B 56 -10.012 5.980 5.331 1.00 5.31 C ATOM 2000 CD2 LEU B 56 -9.823 8.196 4.185 1.00 5.56 C ATOM 0 H LEU B 56 -11.420 5.304 0.753 1.00 2.95 H new ATOM 0 HA LEU B 56 -11.004 4.127 3.311 1.00 3.69 H new ATOM 0 HB2 LEU B 56 -9.632 5.946 2.624 1.00 4.26 H new ATOM 0 HB3 LEU B 56 -11.010 6.929 2.172 1.00 4.26 H new ATOM 0 HG LEU B 56 -11.632 7.127 4.574 1.00 5.04 H new ATOM 0 HD11 LEU B 56 -9.995 6.494 6.292 1.00 5.31 H new ATOM 0 HD12 LEU B 56 -10.618 5.077 5.414 1.00 5.31 H new ATOM 0 HD13 LEU B 56 -8.995 5.710 5.046 1.00 5.31 H new ATOM 0 HD21 LEU B 56 -9.800 8.676 5.163 1.00 5.56 H new ATOM 0 HD22 LEU B 56 -8.804 7.983 3.861 1.00 5.56 H new ATOM 0 HD23 LEU B 56 -10.301 8.861 3.466 1.00 5.56 H new ATOM 2012 N ARG B 57 -13.815 5.711 2.798 1.00 3.93 N ATOM 2013 CA ARG B 57 -15.120 6.004 3.370 1.00 4.27 C ATOM 2014 C ARG B 57 -15.889 4.720 3.683 1.00 3.92 C ATOM 2015 O ARG B 57 -16.811 4.722 4.497 1.00 4.30 O ATOM 2016 CB ARG B 57 -15.921 6.893 2.416 1.00 4.32 C ATOM 2017 CG ARG B 57 -17.232 7.398 2.995 1.00 4.80 C ATOM 2018 CD ARG B 57 -17.886 8.424 2.082 1.00 5.19 C ATOM 2019 NE ARG B 57 -17.050 9.613 1.912 1.00 5.85 N ATOM 2020 CZ ARG B 57 -17.404 10.680 1.196 1.00 6.39 C ATOM 2021 NH1 ARG B 57 -18.594 10.731 0.605 1.00 6.40 N ATOM 2022 NH2 ARG B 57 -16.568 11.708 1.085 1.00 7.19 N ATOM 0 H ARG B 57 -13.719 5.961 1.814 1.00 3.93 H new ATOM 0 HA ARG B 57 -14.971 6.536 4.309 1.00 4.27 H new ATOM 0 HB2 ARG B 57 -15.308 7.748 2.132 1.00 4.32 H new ATOM 0 HB3 ARG B 57 -16.130 6.334 1.504 1.00 4.32 H new ATOM 0 HG2 ARG B 57 -17.911 6.559 3.147 1.00 4.80 H new ATOM 0 HG3 ARG B 57 -17.051 7.843 3.974 1.00 4.80 H new ATOM 0 HD2 ARG B 57 -18.079 7.973 1.108 1.00 5.19 H new ATOM 0 HD3 ARG B 57 -18.852 8.715 2.495 1.00 5.19 H new ATOM 0 HE ARG B 57 -16.139 9.626 2.370 1.00 5.85 H new ATOM 0 HH11 ARG B 57 -19.243 9.950 0.698 1.00 6.40 H new ATOM 0 HH12 ARG B 57 -18.857 11.551 0.059 1.00 6.40 H new ATOM 0 HH21 ARG B 57 -15.659 11.678 1.547 1.00 7.19 H new ATOM 0 HH22 ARG B 57 -16.836 12.526 0.538 1.00 7.19 H new ATOM 2036 N GLN B 58 -15.485 3.616 3.056 1.00 3.27 N ATOM 2037 CA GLN B 58 -16.175 2.341 3.227 1.00 3.16 C ATOM 2038 C GLN B 58 -16.079 1.842 4.673 1.00 3.92 C ATOM 2039 O GLN B 58 -16.968 1.128 5.146 1.00 4.23 O ATOM 2040 CB GLN B 58 -15.617 1.285 2.263 1.00 2.58 C ATOM 2041 CG GLN B 58 -14.486 0.448 2.844 1.00 2.73 C ATOM 2042 CD GLN B 58 -13.777 -0.394 1.805 1.00 2.46 C ATOM 2043 OE1 GLN B 58 -14.358 -0.789 0.799 1.00 2.60 O ATOM 2044 NE2 GLN B 58 -12.514 -0.679 2.055 1.00 2.44 N ATOM 0 H GLN B 58 -14.684 3.580 2.426 1.00 3.27 H new ATOM 0 HA GLN B 58 -17.227 2.505 2.995 1.00 3.16 H new ATOM 0 HB2 GLN B 58 -16.427 0.621 1.960 1.00 2.58 H new ATOM 0 HB3 GLN B 58 -15.260 1.784 1.362 1.00 2.58 H new ATOM 0 HG2 GLN B 58 -13.763 1.108 3.324 1.00 2.73 H new ATOM 0 HG3 GLN B 58 -14.886 -0.204 3.620 1.00 2.73 H new ATOM 0 HE21 GLN B 58 -12.071 -0.329 2.904 1.00 2.44 H new ATOM 0 HE22 GLN B 58 -11.980 -1.249 1.399 1.00 2.44 H new ATOM 2053 N LEU B 59 -15.012 2.216 5.380 1.00 4.30 N ATOM 2054 CA LEU B 59 -14.850 1.795 6.768 1.00 5.09 C ATOM 2055 C LEU B 59 -15.091 2.961 7.722 1.00 5.75 C ATOM 2056 O LEU B 59 -14.848 2.854 8.927 1.00 6.46 O ATOM 2057 CB LEU B 59 -13.480 1.107 7.037 1.00 5.21 C ATOM 2058 CG LEU B 59 -12.169 1.818 6.609 1.00 4.98 C ATOM 2059 CD1 LEU B 59 -12.042 1.907 5.096 1.00 5.21 C ATOM 2060 CD2 LEU B 59 -12.034 3.197 7.240 1.00 5.36 C ATOM 0 H LEU B 59 -14.258 2.801 5.019 1.00 4.30 H new ATOM 0 HA LEU B 59 -15.609 1.036 6.958 1.00 5.09 H new ATOM 0 HB2 LEU B 59 -13.414 0.919 8.109 1.00 5.21 H new ATOM 0 HB3 LEU B 59 -13.500 0.135 6.543 1.00 5.21 H new ATOM 0 HG LEU B 59 -11.350 1.202 6.980 1.00 4.98 H new ATOM 0 HD11 LEU B 59 -11.111 2.411 4.838 1.00 5.21 H new ATOM 0 HD12 LEU B 59 -12.041 0.903 4.671 1.00 5.21 H new ATOM 0 HD13 LEU B 59 -12.884 2.470 4.693 1.00 5.21 H new ATOM 0 HD21 LEU B 59 -11.102 3.657 6.912 1.00 5.36 H new ATOM 0 HD22 LEU B 59 -12.874 3.821 6.934 1.00 5.36 H new ATOM 0 HD23 LEU B 59 -12.029 3.101 8.326 1.00 5.36 H new ATOM 2072 N GLN B 60 -15.586 4.070 7.185 1.00 5.62 N ATOM 2073 CA GLN B 60 -15.932 5.218 8.007 1.00 6.33 C ATOM 2074 C GLN B 60 -17.405 5.164 8.388 1.00 6.37 C ATOM 2075 O GLN B 60 -18.275 5.022 7.523 1.00 5.90 O ATOM 2076 CB GLN B 60 -15.630 6.531 7.279 1.00 6.45 C ATOM 2077 CG GLN B 60 -14.153 6.759 7.014 1.00 6.59 C ATOM 2078 CD GLN B 60 -13.873 8.121 6.408 1.00 7.02 C ATOM 2079 OE1 GLN B 60 -13.872 8.285 5.189 1.00 7.28 O ATOM 2080 NE2 GLN B 60 -13.640 9.114 7.253 1.00 7.35 N ATOM 0 H GLN B 60 -15.755 4.196 6.187 1.00 5.62 H new ATOM 0 HA GLN B 60 -15.324 5.181 8.911 1.00 6.33 H new ATOM 0 HB2 GLN B 60 -16.166 6.541 6.330 1.00 6.45 H new ATOM 0 HB3 GLN B 60 -16.016 7.361 7.871 1.00 6.45 H new ATOM 0 HG2 GLN B 60 -13.601 6.661 7.948 1.00 6.59 H new ATOM 0 HG3 GLN B 60 -13.784 5.984 6.342 1.00 6.59 H new ATOM 0 HE21 GLN B 60 -13.649 8.941 8.258 1.00 7.35 H new ATOM 0 HE22 GLN B 60 -13.452 10.052 6.899 1.00 7.35 H new ATOM 2089 N PRO B 61 -17.708 5.288 9.690 1.00 7.01 N ATOM 2090 CA PRO B 61 -19.082 5.227 10.206 1.00 7.20 C ATOM 2091 C PRO B 61 -19.894 6.477 9.867 1.00 7.47 C ATOM 2092 O PRO B 61 -21.009 6.659 10.363 1.00 7.61 O ATOM 2093 CB PRO B 61 -18.902 5.107 11.729 1.00 7.98 C ATOM 2094 CG PRO B 61 -17.444 4.862 11.949 1.00 8.17 C ATOM 2095 CD PRO B 61 -16.739 5.476 10.776 1.00 7.70 C ATOM 0 HA PRO B 61 -19.635 4.398 9.764 1.00 7.20 H new ATOM 0 HB2 PRO B 61 -19.226 6.017 12.234 1.00 7.98 H new ATOM 0 HB3 PRO B 61 -19.501 4.289 12.130 1.00 7.98 H new ATOM 0 HG2 PRO B 61 -17.110 5.312 12.884 1.00 8.17 H new ATOM 0 HG3 PRO B 61 -17.234 3.795 12.015 1.00 8.17 H new ATOM 0 HD2 PRO B 61 -16.516 6.530 10.943 1.00 7.70 H new ATOM 0 HD3 PRO B 61 -15.792 4.979 10.566 1.00 7.70 H new ATOM 2103 N SER B 62 -19.339 7.327 9.017 1.00 7.73 N ATOM 2104 CA SER B 62 -20.013 8.545 8.607 1.00 8.18 C ATOM 2105 C SER B 62 -21.116 8.235 7.598 1.00 8.53 C ATOM 2106 O SER B 62 -22.148 8.903 7.559 1.00 8.89 O ATOM 2107 CB SER B 62 -19.002 9.512 7.991 1.00 8.54 C ATOM 2108 OG SER B 62 -17.843 9.623 8.801 1.00 8.81 O ATOM 0 H SER B 62 -18.419 7.193 8.597 1.00 7.73 H new ATOM 0 HA SER B 62 -20.466 9.005 9.485 1.00 8.18 H new ATOM 0 HB2 SER B 62 -18.722 9.166 6.996 1.00 8.54 H new ATOM 0 HB3 SER B 62 -19.460 10.494 7.870 1.00 8.54 H new ATOM 0 HG SER B 62 -17.211 10.246 8.384 1.00 8.81 H new ATOM 2114 N SER B 63 -20.899 7.204 6.792 1.00 8.68 N ATOM 2115 CA SER B 63 -21.836 6.862 5.738 1.00 9.25 C ATOM 2116 C SER B 63 -22.489 5.509 5.999 1.00 9.52 C ATOM 2117 O SER B 63 -21.804 4.495 6.151 1.00 9.74 O ATOM 2118 CB SER B 63 -21.111 6.843 4.389 1.00 9.75 C ATOM 2119 OG SER B 63 -20.388 8.045 4.186 1.00 9.76 O ATOM 0 H SER B 63 -20.084 6.594 6.850 1.00 8.68 H new ATOM 0 HA SER B 63 -22.622 7.617 5.719 1.00 9.25 H new ATOM 0 HB2 SER B 63 -20.430 5.993 4.350 1.00 9.75 H new ATOM 0 HB3 SER B 63 -21.834 6.709 3.585 1.00 9.75 H new ATOM 0 HG SER B 63 -20.817 8.570 3.478 1.00 9.76 H new ATOM 2125 N GLN B 64 -23.813 5.504 6.084 1.00 9.75 N ATOM 2126 CA GLN B 64 -24.563 4.264 6.212 1.00 10.27 C ATOM 2127 C GLN B 64 -25.177 3.900 4.866 1.00 10.85 C ATOM 2128 O GLN B 64 -25.515 4.785 4.076 1.00 11.21 O ATOM 2129 CB GLN B 64 -25.669 4.385 7.261 1.00 10.46 C ATOM 2130 CG GLN B 64 -25.213 4.250 8.711 1.00 10.35 C ATOM 2131 CD GLN B 64 -24.341 5.400 9.180 1.00 10.30 C ATOM 2132 OE1 GLN B 64 -24.846 6.432 9.614 1.00 10.78 O ATOM 2133 NE2 GLN B 64 -23.034 5.213 9.148 1.00 9.94 N ATOM 0 H GLN B 64 -24.389 6.346 6.066 1.00 9.75 H new ATOM 0 HA GLN B 64 -23.874 3.483 6.534 1.00 10.27 H new ATOM 0 HB2 GLN B 64 -26.157 5.352 7.140 1.00 10.46 H new ATOM 0 HB3 GLN B 64 -26.421 3.621 7.062 1.00 10.46 H new ATOM 0 HG2 GLN B 64 -26.090 4.183 9.355 1.00 10.35 H new ATOM 0 HG3 GLN B 64 -24.662 3.316 8.825 1.00 10.35 H new ATOM 0 HE21 GLN B 64 -22.652 4.342 8.780 1.00 9.94 H new ATOM 0 HE22 GLN B 64 -22.406 5.940 9.491 1.00 9.94 H new ATOM 2142 N GLY B 65 -25.317 2.609 4.609 1.00 11.14 N ATOM 2143 CA GLY B 65 -25.879 2.161 3.350 1.00 11.86 C ATOM 2144 C GLY B 65 -27.387 2.322 3.293 1.00 12.34 C ATOM 2145 O GLY B 65 -27.926 2.859 2.324 1.00 12.71 O ATOM 0 H GLY B 65 -25.051 1.861 5.250 1.00 11.14 H new ATOM 0 HA2 GLY B 65 -25.426 2.724 2.534 1.00 11.86 H new ATOM 0 HA3 GLY B 65 -25.623 1.113 3.195 1.00 11.86 H new ATOM 2149 N GLY B 66 -28.066 1.864 4.334 1.00 12.52 N ATOM 2150 CA GLY B 66 -29.511 1.939 4.373 1.00 13.14 C ATOM 2151 C GLY B 66 -30.004 2.791 5.517 1.00 13.47 C ATOM 2152 O GLY B 66 -30.689 2.301 6.414 1.00 13.61 O ATOM 0 H GLY B 66 -27.639 1.439 5.157 1.00 12.52 H new ATOM 0 HA2 GLY B 66 -29.878 2.349 3.432 1.00 13.14 H new ATOM 0 HA3 GLY B 66 -29.923 0.934 4.466 1.00 13.14 H new ATOM 2156 N SER B 67 -29.648 4.063 5.498 1.00 13.77 N ATOM 2157 CA SER B 67 -30.059 4.985 6.546 1.00 14.24 C ATOM 2158 C SER B 67 -31.153 5.926 6.050 1.00 14.84 C ATOM 2159 O SER B 67 -31.903 6.498 6.840 1.00 15.17 O ATOM 2160 CB SER B 67 -28.850 5.783 7.024 1.00 14.32 C ATOM 2161 OG SER B 67 -28.069 6.217 5.923 1.00 14.28 O ATOM 0 H SER B 67 -29.074 4.483 4.767 1.00 13.77 H new ATOM 0 HA SER B 67 -30.466 4.410 7.378 1.00 14.24 H new ATOM 0 HB2 SER B 67 -29.182 6.645 7.603 1.00 14.32 H new ATOM 0 HB3 SER B 67 -28.242 5.169 7.688 1.00 14.32 H new ATOM 0 HG SER B 67 -27.505 6.969 6.199 1.00 14.28 H new ATOM 2167 N LEU B 68 -31.244 6.077 4.739 1.00 15.11 N ATOM 2168 CA LEU B 68 -32.195 7.000 4.143 1.00 15.82 C ATOM 2169 C LEU B 68 -33.350 6.240 3.509 1.00 16.33 C ATOM 2170 O LEU B 68 -33.140 5.381 2.650 1.00 16.64 O ATOM 2171 CB LEU B 68 -31.493 7.872 3.095 1.00 16.13 C ATOM 2172 CG LEU B 68 -32.377 8.906 2.390 1.00 16.57 C ATOM 2173 CD1 LEU B 68 -32.929 9.913 3.389 1.00 16.53 C ATOM 2174 CD2 LEU B 68 -31.585 9.613 1.301 1.00 16.82 C ATOM 0 H LEU B 68 -30.669 5.571 4.066 1.00 15.11 H new ATOM 0 HA LEU B 68 -32.596 7.643 4.927 1.00 15.82 H new ATOM 0 HB2 LEU B 68 -30.668 8.396 3.579 1.00 16.13 H new ATOM 0 HB3 LEU B 68 -31.057 7.219 2.339 1.00 16.13 H new ATOM 0 HG LEU B 68 -33.219 8.388 1.931 1.00 16.57 H new ATOM 0 HD11 LEU B 68 -33.554 10.638 2.867 1.00 16.53 H new ATOM 0 HD12 LEU B 68 -33.525 9.393 4.138 1.00 16.53 H new ATOM 0 HD13 LEU B 68 -32.104 10.431 3.878 1.00 16.53 H new ATOM 0 HD21 LEU B 68 -32.222 10.346 0.806 1.00 16.82 H new ATOM 0 HD22 LEU B 68 -30.727 10.118 1.745 1.00 16.82 H new ATOM 0 HD23 LEU B 68 -31.238 8.882 0.571 1.00 16.82 H new ATOM 2186 N LEU B 69 -34.563 6.542 3.950 1.00 16.55 N ATOM 2187 CA LEU B 69 -35.757 5.947 3.369 1.00 17.14 C ATOM 2188 C LEU B 69 -36.890 6.970 3.331 1.00 17.67 C ATOM 2189 O LEU B 69 -37.037 7.782 4.247 1.00 17.95 O ATOM 2190 CB LEU B 69 -36.173 4.678 4.141 1.00 17.23 C ATOM 2191 CG LEU B 69 -36.478 4.847 5.640 1.00 17.63 C ATOM 2192 CD1 LEU B 69 -37.930 5.254 5.864 1.00 18.11 C ATOM 2193 CD2 LEU B 69 -36.167 3.564 6.396 1.00 17.40 C ATOM 0 H LEU B 69 -34.746 7.197 4.710 1.00 16.55 H new ATOM 0 HA LEU B 69 -35.533 5.647 2.345 1.00 17.14 H new ATOM 0 HB2 LEU B 69 -37.058 4.262 3.659 1.00 17.23 H new ATOM 0 HB3 LEU B 69 -35.377 3.941 4.037 1.00 17.23 H new ATOM 0 HG LEU B 69 -35.840 5.643 6.023 1.00 17.63 H new ATOM 0 HD11 LEU B 69 -38.116 5.366 6.932 1.00 18.11 H new ATOM 0 HD12 LEU B 69 -38.124 6.201 5.361 1.00 18.11 H new ATOM 0 HD13 LEU B 69 -38.590 4.486 5.459 1.00 18.11 H new ATOM 0 HD21 LEU B 69 -36.389 3.702 7.454 1.00 17.40 H new ATOM 0 HD22 LEU B 69 -36.777 2.752 6.001 1.00 17.40 H new ATOM 0 HD23 LEU B 69 -35.112 3.317 6.276 1.00 17.40 H new ATOM 2205 N ALA B 70 -37.661 6.949 2.253 1.00 17.91 N ATOM 2206 CA ALA B 70 -38.801 7.841 2.101 1.00 18.49 C ATOM 2207 C ALA B 70 -39.865 7.195 1.217 1.00 18.78 C ATOM 2208 O ALA B 70 -39.788 7.263 -0.012 1.00 19.00 O ATOM 2209 CB ALA B 70 -38.355 9.175 1.515 1.00 18.68 C ATOM 0 H ALA B 70 -37.515 6.318 1.465 1.00 17.91 H new ATOM 0 HA ALA B 70 -39.235 8.025 3.084 1.00 18.49 H new ATOM 0 HB1 ALA B 70 -39.218 9.832 1.407 1.00 18.68 H new ATOM 0 HB2 ALA B 70 -37.627 9.639 2.180 1.00 18.68 H new ATOM 0 HB3 ALA B 70 -37.901 9.010 0.538 1.00 18.68 H new ATOM 2215 N PRO B 71 -40.850 6.520 1.829 1.00 18.92 N ATOM 2216 CA PRO B 71 -41.924 5.842 1.104 1.00 19.33 C ATOM 2217 C PRO B 71 -42.949 6.824 0.547 1.00 19.89 C ATOM 2218 O PRO B 71 -43.833 7.300 1.265 1.00 20.29 O ATOM 2219 CB PRO B 71 -42.573 4.930 2.158 1.00 19.41 C ATOM 2220 CG PRO B 71 -41.708 5.030 3.373 1.00 19.06 C ATOM 2221 CD PRO B 71 -40.993 6.345 3.275 1.00 18.82 C ATOM 0 HA PRO B 71 -41.543 5.297 0.240 1.00 19.33 H new ATOM 0 HB2 PRO B 71 -43.592 5.249 2.377 1.00 19.41 H new ATOM 0 HB3 PRO B 71 -42.630 3.901 1.803 1.00 19.41 H new ATOM 0 HG2 PRO B 71 -42.307 4.980 4.282 1.00 19.06 H new ATOM 0 HG3 PRO B 71 -40.998 4.204 3.414 1.00 19.06 H new ATOM 0 HD2 PRO B 71 -41.567 7.154 3.727 1.00 18.82 H new ATOM 0 HD3 PRO B 71 -40.027 6.320 3.778 1.00 18.82 H new ATOM 2229 N VAL B 72 -42.821 7.133 -0.733 1.00 20.01 N ATOM 2230 CA VAL B 72 -43.716 8.075 -1.384 1.00 20.65 C ATOM 2231 C VAL B 72 -44.549 7.381 -2.461 1.00 20.93 C ATOM 2232 O VAL B 72 -45.703 7.743 -2.698 1.00 20.77 O ATOM 2233 CB VAL B 72 -42.939 9.273 -1.988 1.00 20.84 C ATOM 2234 CG1 VAL B 72 -41.956 8.811 -3.056 1.00 21.06 C ATOM 2235 CG2 VAL B 72 -43.895 10.316 -2.547 1.00 21.13 C ATOM 0 H VAL B 72 -42.103 6.743 -1.344 1.00 20.01 H new ATOM 0 HA VAL B 72 -44.391 8.464 -0.621 1.00 20.65 H new ATOM 0 HB VAL B 72 -42.366 9.735 -1.184 1.00 20.84 H new ATOM 0 HG11 VAL B 72 -41.426 9.674 -3.461 1.00 21.06 H new ATOM 0 HG12 VAL B 72 -41.239 8.119 -2.615 1.00 21.06 H new ATOM 0 HG13 VAL B 72 -42.499 8.310 -3.857 1.00 21.06 H new ATOM 0 HG21 VAL B 72 -43.325 11.146 -2.965 1.00 21.13 H new ATOM 0 HG22 VAL B 72 -44.507 9.867 -3.329 1.00 21.13 H new ATOM 0 HG23 VAL B 72 -44.539 10.684 -1.749 1.00 21.13 H new ATOM 2245 N ALA B 73 -43.975 6.366 -3.092 1.00 21.45 N ATOM 2246 CA ALA B 73 -44.675 5.617 -4.123 1.00 21.89 C ATOM 2247 C ALA B 73 -45.739 4.730 -3.501 1.00 22.46 C ATOM 2248 O ALA B 73 -45.422 3.810 -2.747 1.00 22.90 O ATOM 2249 CB ALA B 73 -43.695 4.787 -4.937 1.00 22.12 C ATOM 0 H ALA B 73 -43.025 6.043 -2.907 1.00 21.45 H new ATOM 0 HA ALA B 73 -45.164 6.324 -4.794 1.00 21.89 H new ATOM 0 HB1 ALA B 73 -44.237 4.233 -5.704 1.00 22.12 H new ATOM 0 HB2 ALA B 73 -42.967 5.445 -5.411 1.00 22.12 H new ATOM 0 HB3 ALA B 73 -43.178 4.087 -4.281 1.00 22.12 H new ATOM 2255 N ARG B 74 -47.000 5.052 -3.793 1.00 22.53 N ATOM 2256 CA ARG B 74 -48.171 4.322 -3.286 1.00 23.14 C ATOM 2257 C ARG B 74 -48.379 4.541 -1.786 1.00 23.27 C ATOM 2258 O ARG B 74 -49.458 4.254 -1.258 1.00 23.13 O ATOM 2259 CB ARG B 74 -48.071 2.826 -3.592 1.00 23.41 C ATOM 2260 CG ARG B 74 -47.783 2.524 -5.052 1.00 23.66 C ATOM 2261 CD ARG B 74 -48.062 1.072 -5.384 1.00 24.19 C ATOM 2262 NE ARG B 74 -49.496 0.786 -5.361 1.00 24.31 N ATOM 2263 CZ ARG B 74 -50.045 -0.315 -5.868 1.00 24.74 C ATOM 2264 NH1 ARG B 74 -49.275 -1.289 -6.342 1.00 25.06 N ATOM 2265 NH2 ARG B 74 -51.367 -0.451 -5.871 1.00 24.94 N ATOM 0 H ARG B 74 -47.244 5.837 -4.396 1.00 22.53 H new ATOM 0 HA ARG B 74 -49.039 4.726 -3.807 1.00 23.14 H new ATOM 0 HB2 ARG B 74 -47.284 2.389 -2.977 1.00 23.41 H new ATOM 0 HB3 ARG B 74 -49.005 2.342 -3.306 1.00 23.41 H new ATOM 0 HG2 ARG B 74 -48.394 3.167 -5.685 1.00 23.66 H new ATOM 0 HG3 ARG B 74 -46.741 2.755 -5.274 1.00 23.66 H new ATOM 0 HD2 ARG B 74 -47.659 0.838 -6.369 1.00 24.19 H new ATOM 0 HD3 ARG B 74 -47.549 0.429 -4.669 1.00 24.19 H new ATOM 0 HE ARG B 74 -50.114 1.473 -4.929 1.00 24.31 H new ATOM 0 HH11 ARG B 74 -48.260 -1.194 -6.318 1.00 25.06 H new ATOM 0 HH12 ARG B 74 -49.699 -2.132 -6.730 1.00 25.06 H new ATOM 0 HH21 ARG B 74 -51.956 0.287 -5.486 1.00 24.94 H new ATOM 0 HH22 ARG B 74 -51.792 -1.293 -6.259 1.00 24.94 H new ATOM 2279 N ASN B 75 -47.344 5.054 -1.119 1.00 23.63 N ATOM 2280 CA ASN B 75 -47.372 5.359 0.314 1.00 23.90 C ATOM 2281 C ASN B 75 -47.473 4.087 1.155 1.00 23.94 C ATOM 2282 O ASN B 75 -46.485 3.634 1.737 1.00 23.88 O ATOM 2283 CB ASN B 75 -48.520 6.325 0.648 1.00 24.39 C ATOM 2284 CG ASN B 75 -48.580 6.684 2.122 1.00 24.40 C ATOM 2285 OD1 ASN B 75 -49.304 6.062 2.902 1.00 24.46 O ATOM 2286 ND2 ASN B 75 -47.812 7.685 2.515 1.00 24.45 N ATOM 0 H ASN B 75 -46.452 5.272 -1.563 1.00 23.63 H new ATOM 0 HA ASN B 75 -46.430 5.848 0.563 1.00 23.90 H new ATOM 0 HB2 ASN B 75 -48.403 7.236 0.062 1.00 24.39 H new ATOM 0 HB3 ASN B 75 -49.466 5.873 0.350 1.00 24.39 H new ATOM 0 HD21 ASN B 75 -47.804 7.968 3.495 1.00 24.45 H new ATOM 0 HD22 ASN B 75 -47.227 8.175 1.838 1.00 24.45 H new ATOM 2293 N GLY B 76 -48.663 3.512 1.206 1.00 24.15 N ATOM 2294 CA GLY B 76 -48.878 2.301 1.968 1.00 24.33 C ATOM 2295 C GLY B 76 -50.210 1.667 1.644 1.00 24.59 C ATOM 2296 O GLY B 76 -50.820 1.007 2.485 1.00 24.61 O ATOM 0 H GLY B 76 -49.492 3.866 0.728 1.00 24.15 H new ATOM 0 HA2 GLY B 76 -48.077 1.592 1.759 1.00 24.33 H new ATOM 0 HA3 GLY B 76 -48.832 2.528 3.033 1.00 24.33 H new ATOM 2300 N ARG B 77 -50.671 1.882 0.423 1.00 24.88 N ATOM 2301 CA ARG B 77 -51.949 1.347 -0.004 1.00 25.24 C ATOM 2302 C ARG B 77 -51.749 0.191 -0.977 1.00 25.39 C ATOM 2303 O ARG B 77 -51.496 0.398 -2.166 1.00 25.37 O ATOM 2304 CB ARG B 77 -52.811 2.452 -0.630 1.00 25.59 C ATOM 2305 CG ARG B 77 -54.129 1.964 -1.227 1.00 25.91 C ATOM 2306 CD ARG B 77 -54.899 1.065 -0.269 1.00 26.19 C ATOM 2307 NE ARG B 77 -55.197 1.713 1.006 1.00 26.55 N ATOM 2308 CZ ARG B 77 -55.848 1.115 2.004 1.00 26.88 C ATOM 2309 NH1 ARG B 77 -56.228 -0.153 1.881 1.00 26.92 N ATOM 2310 NH2 ARG B 77 -56.110 1.777 3.124 1.00 27.27 N ATOM 0 H ARG B 77 -50.179 2.423 -0.288 1.00 24.88 H new ATOM 0 HA ARG B 77 -52.474 0.963 0.871 1.00 25.24 H new ATOM 0 HB2 ARG B 77 -53.027 3.202 0.131 1.00 25.59 H new ATOM 0 HB3 ARG B 77 -52.234 2.947 -1.411 1.00 25.59 H new ATOM 0 HG2 ARG B 77 -54.746 2.823 -1.491 1.00 25.91 H new ATOM 0 HG3 ARG B 77 -53.928 1.420 -2.150 1.00 25.91 H new ATOM 0 HD2 ARG B 77 -55.832 0.756 -0.740 1.00 26.19 H new ATOM 0 HD3 ARG B 77 -54.320 0.160 -0.084 1.00 26.19 H new ATOM 0 HE ARG B 77 -54.890 2.676 1.140 1.00 26.55 H new ATOM 0 HH11 ARG B 77 -56.021 -0.667 1.024 1.00 26.92 H new ATOM 0 HH12 ARG B 77 -56.726 -0.612 2.643 1.00 26.92 H new ATOM 0 HH21 ARG B 77 -55.813 2.748 3.224 1.00 27.27 H new ATOM 0 HH22 ARG B 77 -56.608 1.315 3.885 1.00 27.27 H new ATOM 2324 N LEU B 78 -51.825 -1.020 -0.450 1.00 25.64 N ATOM 2325 CA LEU B 78 -51.744 -2.228 -1.255 1.00 25.94 C ATOM 2326 C LEU B 78 -52.254 -3.406 -0.439 1.00 26.00 C ATOM 2327 O LEU B 78 -53.441 -3.764 -0.591 1.00 26.11 O ATOM 2328 CB LEU B 78 -50.307 -2.490 -1.715 1.00 26.18 C ATOM 2329 CG LEU B 78 -50.133 -3.707 -2.628 1.00 26.54 C ATOM 2330 CD1 LEU B 78 -50.912 -3.522 -3.922 1.00 26.96 C ATOM 2331 CD2 LEU B 78 -48.661 -3.950 -2.920 1.00 26.63 C ATOM 2332 OXT LEU B 78 -51.479 -3.940 0.379 1.00 26.03 O ATOM 0 H LEU B 78 -51.945 -1.193 0.548 1.00 25.64 H new ATOM 0 HA LEU B 78 -52.361 -2.099 -2.145 1.00 25.94 H new ATOM 0 HB2 LEU B 78 -49.942 -1.606 -2.239 1.00 26.18 H new ATOM 0 HB3 LEU B 78 -49.678 -2.622 -0.835 1.00 26.18 H new ATOM 0 HG LEU B 78 -50.529 -4.582 -2.112 1.00 26.54 H new ATOM 0 HD11 LEU B 78 -50.776 -4.397 -4.557 1.00 26.96 H new ATOM 0 HD12 LEU B 78 -51.971 -3.400 -3.695 1.00 26.96 H new ATOM 0 HD13 LEU B 78 -50.548 -2.636 -4.442 1.00 26.96 H new ATOM 0 HD21 LEU B 78 -48.558 -4.819 -3.570 1.00 26.63 H new ATOM 0 HD22 LEU B 78 -48.239 -3.075 -3.414 1.00 26.63 H new ATOM 0 HD23 LEU B 78 -48.130 -4.131 -1.986 1.00 26.63 H new TER 2344 LEU B 78