USER MOD reduce.3.24.130724 H: found=0, std=0, add=1354, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1354 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 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 54 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: B 10 GLN : amide:sc= 0.775 K(o=1.6,f=-7.6!) USER MOD Set 2.2: B 13 LYS NZ :NH3+ 171:sc= 0.821 (180deg=-0.0541) USER MOD Set 3.1: A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 54 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 10 GLN : amide:sc= 0.776 K(o=1.6,f=-7.8!) USER MOD Set 4.2: A 13 LYS NZ :NH3+ 172:sc= 0.835 (180deg=-0.0597) USER MOD Single : A 1 MET CE :methyl -167:sc= -0.0162 (180deg=-0.259) USER MOD Single : A 1 MET N :NH3+ -163:sc= 1.22 (180deg=1.18) USER MOD Single : A 2 SER OG : rot 160:sc= -0.529 USER MOD Single : A 11 MET CE :methyl -169:sc= 0 (180deg=-0.111) USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 14 THR OG1 : rot -136:sc= 0.556! USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 28 GLN : amide:sc= 0.472 K(o=0.47,f=-0.28) USER MOD Single : A 32 GLN : amide:sc= -0.0623 X(o=-0.062,f=-0.1) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -120:sc= -0.281 (180deg=-0.6) USER MOD Single : A 52 SER OG : rot -80:sc= 1.1 USER MOD Single : A 56 ASN : amide:sc= -0.358 K(o=-0.36,f=-2.9!) USER MOD Single : A 58 SER OG : rot 180:sc= 0.00234 USER MOD Single : A 61 ASN : amide:sc= -0.0198 K(o=-0.02,f=-1.2) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0.75 K(o=0.75,f=-0.26) USER MOD Single : A 72 MET CE :methyl 153:sc=-0.00385 (180deg=-0.219) USER MOD Single : A 78 ASN : amide:sc= 0.294 K(o=0.29,f=-10!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -166:sc= -0.0166 (180deg=-0.254) USER MOD Single : B 1 MET N :NH3+ -162:sc= 1.3 (180deg=0.957) USER MOD Single : B 2 SER OG : rot 160:sc= -0.529 USER MOD Single : B 11 MET CE :methyl -170:sc= 0 (180deg=-0.115) USER MOD Single : B 12 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : B 14 THR OG1 : rot -137:sc= 0.308! USER MOD Single : B 16 THR OG1 : rot 180:sc= 0 USER MOD Single : B 23 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 28 GLN : amide:sc= 0.48 K(o=0.48,f=-0.28) USER MOD Single : B 32 GLN : amide:sc= -0.0418 X(o=-0.042,f=-0.08) USER MOD Single : B 35 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 MET CE :methyl -116:sc= -0.265 (180deg=-0.605) USER MOD Single : B 52 SER OG : rot -81:sc= 1.1 USER MOD Single : B 56 ASN : amide:sc= -0.393 K(o=-0.39,f=-2.8!) USER MOD Single : B 58 SER OG : rot 180:sc= 0.00266 USER MOD Single : B 61 ASN : amide:sc= -0.0243 K(o=-0.024,f=-1.2!) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 GLN : amide:sc= 0.748 K(o=0.75,f=-0.31) USER MOD Single : B 72 MET CE :methyl 150:sc=-0.00556 (180deg=-0.225) USER MOD Single : B 78 ASN : amide:sc= 0.151 K(o=0.15,f=-9.9!) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.742 7.468 -16.071 1.00 0.00 N ATOM 2 CA MET A 1 3.141 7.466 -15.559 1.00 0.00 C ATOM 3 C MET A 1 3.172 6.806 -14.183 1.00 0.00 C ATOM 4 O MET A 1 4.076 6.030 -13.877 1.00 0.00 O ATOM 5 CB MET A 1 3.703 8.884 -15.485 1.00 0.00 C ATOM 6 CG MET A 1 3.908 9.551 -16.838 1.00 0.00 C ATOM 7 SD MET A 1 5.039 8.634 -17.902 1.00 0.00 S ATOM 8 CE MET A 1 6.585 8.861 -17.027 1.00 0.00 C ATOM 0 H1 MET A 1 1.748 7.642 -17.096 1.00 0.00 H new ATOM 0 H2 MET A 1 1.301 6.546 -15.879 1.00 0.00 H new ATOM 0 H3 MET A 1 1.199 8.217 -15.596 1.00 0.00 H new ATOM 0 HA MET A 1 3.767 6.900 -16.249 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.028 9.499 -14.889 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.657 8.857 -14.959 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.945 9.651 -17.339 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.295 10.559 -16.687 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.413 8.556 -17.667 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.701 9.911 -16.759 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.583 8.254 -16.122 1.00 0.00 H new ATOM 20 N SER A 2 2.178 7.123 -13.358 1.00 0.00 N ATOM 21 CA SER A 2 2.113 6.563 -12.014 1.00 0.00 C ATOM 22 C SER A 2 1.314 5.263 -12.009 1.00 0.00 C ATOM 23 O SER A 2 0.480 5.033 -12.886 1.00 0.00 O ATOM 24 CB SER A 2 1.483 7.562 -11.061 1.00 0.00 C ATOM 25 OG SER A 2 1.258 6.983 -9.805 1.00 0.00 O ATOM 0 H SER A 2 1.415 7.758 -13.594 1.00 0.00 H new ATOM 0 HA SER A 2 3.129 6.346 -11.683 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.135 8.429 -10.954 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.540 7.920 -11.475 1.00 0.00 H new ATOM 0 HG SER A 2 1.162 7.689 -9.132 1.00 0.00 H new ATOM 31 N LEU A 3 1.576 4.419 -11.018 1.00 0.00 N ATOM 32 CA LEU A 3 0.834 3.173 -10.866 1.00 0.00 C ATOM 33 C LEU A 3 -0.647 3.450 -10.628 1.00 0.00 C ATOM 34 O LEU A 3 -1.507 2.671 -11.037 1.00 0.00 O ATOM 35 CB LEU A 3 1.405 2.353 -9.702 1.00 0.00 C ATOM 36 CG LEU A 3 2.815 1.789 -9.913 1.00 0.00 C ATOM 37 CD1 LEU A 3 3.302 1.141 -8.625 1.00 0.00 C ATOM 38 CD2 LEU A 3 2.794 0.785 -11.056 1.00 0.00 C ATOM 0 H LEU A 3 2.294 4.574 -10.310 1.00 0.00 H new ATOM 0 HA LEU A 3 0.936 2.602 -11.789 1.00 0.00 H new ATOM 0 HB2 LEU A 3 1.414 2.980 -8.811 1.00 0.00 H new ATOM 0 HB3 LEU A 3 0.728 1.523 -9.501 1.00 0.00 H new ATOM 0 HG LEU A 3 3.503 2.594 -10.174 1.00 0.00 H new ATOM 0 HD11 LEU A 3 4.304 0.740 -8.776 1.00 0.00 H new ATOM 0 HD12 LEU A 3 3.325 1.885 -7.829 1.00 0.00 H new ATOM 0 HD13 LEU A 3 2.626 0.332 -8.346 1.00 0.00 H new ATOM 0 HD21 LEU A 3 3.796 0.384 -11.206 1.00 0.00 H new ATOM 0 HD22 LEU A 3 2.110 -0.028 -10.813 1.00 0.00 H new ATOM 0 HD23 LEU A 3 2.460 1.279 -11.968 1.00 0.00 H new ATOM 50 N ILE A 4 -0.937 4.563 -9.966 1.00 0.00 N ATOM 51 CA ILE A 4 -2.314 4.922 -9.657 1.00 0.00 C ATOM 52 C ILE A 4 -3.023 5.438 -10.902 1.00 0.00 C ATOM 53 O ILE A 4 -4.231 5.250 -11.067 1.00 0.00 O ATOM 54 CB ILE A 4 -2.373 5.989 -8.548 1.00 0.00 C ATOM 55 CG1 ILE A 4 -3.758 6.004 -7.894 1.00 0.00 C ATOM 56 CG2 ILE A 4 -2.032 7.360 -9.110 1.00 0.00 C ATOM 57 CD1 ILE A 4 -4.102 4.726 -7.164 1.00 0.00 C ATOM 0 H ILE A 4 -0.240 5.230 -9.634 1.00 0.00 H new ATOM 0 HA ILE A 4 -2.819 4.024 -9.303 1.00 0.00 H new ATOM 0 HB ILE A 4 -1.635 5.738 -7.786 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -3.809 6.837 -7.193 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -4.510 6.187 -8.662 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -2.079 8.102 -8.313 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -1.026 7.341 -9.530 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -2.746 7.621 -9.891 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -5.097 4.813 -6.728 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.084 3.891 -7.864 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.373 4.551 -6.373 1.00 0.00 H new ATOM 69 N GLU A 5 -2.263 6.072 -11.788 1.00 0.00 N ATOM 70 CA GLU A 5 -2.806 6.481 -13.074 1.00 0.00 C ATOM 71 C GLU A 5 -3.128 5.271 -13.936 1.00 0.00 C ATOM 72 O GLU A 5 -4.094 5.281 -14.684 1.00 0.00 O ATOM 73 CB GLU A 5 -1.820 7.396 -13.804 1.00 0.00 C ATOM 74 CG GLU A 5 -1.667 8.777 -13.184 1.00 0.00 C ATOM 75 CD GLU A 5 -0.640 9.623 -13.884 1.00 0.00 C ATOM 76 OE1 GLU A 5 0.292 9.070 -14.419 1.00 0.00 O ATOM 77 OE2 GLU A 5 -0.787 10.822 -13.885 1.00 0.00 O ATOM 0 H GLU A 5 -1.282 6.311 -11.641 1.00 0.00 H new ATOM 0 HA GLU A 5 -3.729 7.030 -12.891 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -0.844 6.912 -13.828 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -2.146 7.509 -14.838 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -2.629 9.289 -13.208 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -1.389 8.670 -12.136 1.00 0.00 H new ATOM 84 N LEU A 6 -2.303 4.235 -13.840 1.00 0.00 N ATOM 85 CA LEU A 6 -2.593 2.982 -14.531 1.00 0.00 C ATOM 86 C LEU A 6 -3.881 2.346 -13.994 1.00 0.00 C ATOM 87 O LEU A 6 -4.688 1.821 -14.760 1.00 0.00 O ATOM 88 CB LEU A 6 -1.421 2.006 -14.369 1.00 0.00 C ATOM 89 CG LEU A 6 -0.128 2.388 -15.102 1.00 0.00 C ATOM 90 CD1 LEU A 6 0.988 1.436 -14.697 1.00 0.00 C ATOM 91 CD2 LEU A 6 -0.366 2.345 -16.604 1.00 0.00 C ATOM 0 H LEU A 6 -1.439 4.235 -13.298 1.00 0.00 H new ATOM 0 HA LEU A 6 -2.733 3.202 -15.589 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -1.199 1.908 -13.306 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -1.739 1.024 -14.720 1.00 0.00 H new ATOM 0 HG LEU A 6 0.170 3.400 -14.829 1.00 0.00 H new ATOM 0 HD11 LEU A 6 1.906 1.708 -15.218 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.149 1.501 -13.621 1.00 0.00 H new ATOM 0 HD13 LEU A 6 0.710 0.416 -14.961 1.00 0.00 H new ATOM 0 HD21 LEU A 6 0.552 2.616 -17.126 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -0.666 1.339 -16.896 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.155 3.049 -16.868 1.00 0.00 H new ATOM 103 N LEU A 7 -4.050 2.376 -12.679 1.00 0.00 N ATOM 104 CA LEU A 7 -5.260 1.853 -12.051 1.00 0.00 C ATOM 105 C LEU A 7 -6.497 2.581 -12.565 1.00 0.00 C ATOM 106 O LEU A 7 -7.511 1.957 -12.872 1.00 0.00 O ATOM 107 CB LEU A 7 -5.172 1.993 -10.526 1.00 0.00 C ATOM 108 CG LEU A 7 -6.393 1.497 -9.741 1.00 0.00 C ATOM 109 CD1 LEU A 7 -6.607 0.014 -10.016 1.00 0.00 C ATOM 110 CD2 LEU A 7 -6.180 1.752 -8.256 1.00 0.00 C ATOM 0 H LEU A 7 -3.366 2.756 -12.025 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.345 0.797 -12.309 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.294 1.448 -10.180 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.010 3.044 -10.285 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.284 2.038 -10.059 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.475 -0.338 -9.458 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.775 -0.138 -11.082 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.724 -0.545 -9.705 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.048 1.400 -7.698 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -5.291 1.219 -7.919 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.049 2.821 -8.085 1.00 0.00 H new ATOM 122 N PHE A 8 -6.408 3.906 -12.639 1.00 0.00 N ATOM 123 CA PHE A 8 -7.523 4.727 -13.120 1.00 0.00 C ATOM 124 C PHE A 8 -7.330 5.135 -14.575 1.00 0.00 C ATOM 125 O PHE A 8 -7.849 6.161 -15.018 1.00 0.00 O ATOM 126 CB PHE A 8 -7.675 5.980 -12.255 1.00 0.00 C ATOM 127 CG PHE A 8 -8.043 5.690 -10.828 1.00 0.00 C ATOM 128 CD1 PHE A 8 -7.151 5.950 -9.800 1.00 0.00 C ATOM 129 CD2 PHE A 8 -9.283 5.156 -10.511 1.00 0.00 C ATOM 130 CE1 PHE A 8 -7.488 5.684 -8.486 1.00 0.00 C ATOM 131 CE2 PHE A 8 -9.624 4.890 -9.199 1.00 0.00 C ATOM 132 CZ PHE A 8 -8.724 5.154 -8.186 1.00 0.00 C ATOM 0 H PHE A 8 -5.578 4.437 -12.373 1.00 0.00 H new ATOM 0 HA PHE A 8 -8.427 4.123 -13.049 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -6.739 6.538 -12.273 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -8.438 6.623 -12.694 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -6.181 6.366 -10.028 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -9.991 4.946 -11.299 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -6.783 5.892 -7.695 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -10.594 4.476 -8.966 1.00 0.00 H new ATOM 0 HZ PHE A 8 -8.988 4.945 -7.160 1.00 0.00 H new ATOM 142 N GLY A 9 -6.576 4.331 -15.309 1.00 0.00 N ATOM 143 CA GLY A 9 -6.385 4.555 -16.743 1.00 0.00 C ATOM 144 C GLY A 9 -7.222 3.589 -17.571 1.00 0.00 C ATOM 145 O GLY A 9 -7.168 3.602 -18.802 1.00 0.00 O ATOM 0 H GLY A 9 -6.085 3.517 -14.940 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -6.657 5.581 -16.992 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.331 4.434 -16.995 1.00 0.00 H new ATOM 149 N GLN A 10 -7.992 2.751 -16.886 1.00 0.00 N ATOM 150 CA GLN A 10 -8.832 1.761 -17.555 1.00 0.00 C ATOM 151 C GLN A 10 -10.071 2.411 -18.122 1.00 0.00 C ATOM 152 O GLN A 10 -11.148 2.359 -17.526 1.00 0.00 O ATOM 153 CB GLN A 10 -9.227 0.639 -16.591 1.00 0.00 C ATOM 154 CG GLN A 10 -8.052 -0.154 -16.044 1.00 0.00 C ATOM 155 CD GLN A 10 -8.474 -1.162 -14.992 1.00 0.00 C ATOM 156 OE1 GLN A 10 -9.310 -0.870 -14.132 1.00 0.00 O ATOM 157 NE2 GLN A 10 -7.897 -2.357 -15.054 1.00 0.00 N ATOM 0 H GLN A 10 -8.053 2.736 -15.868 1.00 0.00 H new ATOM 0 HA GLN A 10 -8.254 1.330 -18.372 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -9.780 1.070 -15.756 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -9.905 -0.044 -17.104 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -7.555 -0.674 -16.863 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -7.323 0.532 -15.614 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -7.211 -2.555 -15.782 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -8.140 -3.077 -14.373 1.00 0.00 H new ATOM 166 N MET A 11 -9.909 3.019 -19.279 1.00 0.00 N ATOM 167 CA MET A 11 -10.993 3.743 -19.903 1.00 0.00 C ATOM 168 C MET A 11 -11.530 4.808 -18.955 1.00 0.00 C ATOM 169 O MET A 11 -10.898 5.137 -17.949 1.00 0.00 O ATOM 170 CB MET A 11 -12.102 2.781 -20.323 1.00 0.00 C ATOM 171 CG MET A 11 -11.696 1.784 -21.399 1.00 0.00 C ATOM 172 SD MET A 11 -13.051 0.699 -21.889 1.00 0.00 S ATOM 173 CE MET A 11 -13.156 -0.377 -20.463 1.00 0.00 C ATOM 0 H MET A 11 -9.035 3.025 -19.806 1.00 0.00 H new ATOM 0 HA MET A 11 -10.616 4.239 -20.797 1.00 0.00 H new ATOM 0 HB2 MET A 11 -12.441 2.231 -19.445 1.00 0.00 H new ATOM 0 HB3 MET A 11 -12.952 3.361 -20.684 1.00 0.00 H new ATOM 0 HG2 MET A 11 -11.335 2.326 -22.273 1.00 0.00 H new ATOM 0 HG3 MET A 11 -10.866 1.180 -21.034 1.00 0.00 H new ATOM 0 HE1 MET A 11 -13.809 -1.220 -20.690 1.00 0.00 H new ATOM 0 HE2 MET A 11 -12.162 -0.746 -20.212 1.00 0.00 H new ATOM 0 HE3 MET A 11 -13.561 0.178 -19.617 1.00 0.00 H new ATOM 183 N GLN A 12 -12.708 5.330 -19.271 1.00 0.00 N ATOM 184 CA GLN A 12 -13.334 6.337 -18.425 1.00 0.00 C ATOM 185 C GLN A 12 -13.953 5.682 -17.198 1.00 0.00 C ATOM 186 O GLN A 12 -14.765 4.763 -17.306 1.00 0.00 O ATOM 187 CB GLN A 12 -14.398 7.115 -19.203 1.00 0.00 C ATOM 188 CG GLN A 12 -15.032 8.254 -18.422 1.00 0.00 C ATOM 189 CD GLN A 12 -16.037 9.034 -19.249 1.00 0.00 C ATOM 190 OE1 GLN A 12 -16.674 8.487 -20.155 1.00 0.00 O ATOM 191 NE2 GLN A 12 -16.185 10.317 -18.943 1.00 0.00 N ATOM 0 H GLN A 12 -13.245 5.075 -20.100 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.565 7.039 -18.101 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -13.947 7.518 -20.110 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -15.181 6.424 -19.516 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -15.527 7.853 -17.537 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -14.251 8.929 -18.072 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -15.638 10.727 -18.186 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -16.846 10.893 -19.464 1.00 0.00 H new ATOM 200 N LYS A 13 -13.561 6.169 -16.035 1.00 0.00 N ATOM 201 CA LYS A 13 -14.109 5.673 -14.789 1.00 0.00 C ATOM 202 C LYS A 13 -15.411 6.393 -14.434 1.00 0.00 C ATOM 203 O LYS A 13 -16.320 5.782 -13.889 1.00 0.00 O ATOM 204 CB LYS A 13 -13.089 5.832 -13.661 1.00 0.00 C ATOM 205 CG LYS A 13 -11.853 4.952 -13.801 1.00 0.00 C ATOM 206 CD LYS A 13 -12.205 3.479 -13.651 1.00 0.00 C ATOM 207 CE LYS A 13 -10.963 2.603 -13.715 1.00 0.00 C ATOM 208 NZ LYS A 13 -11.294 1.158 -13.592 1.00 0.00 N ATOM 0 H LYS A 13 -12.865 6.907 -15.929 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.333 4.614 -14.916 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.774 6.875 -13.616 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -13.576 5.605 -12.713 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -11.392 5.121 -14.774 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -11.117 5.231 -13.047 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -12.716 3.320 -12.701 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -12.899 3.187 -14.439 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -10.445 2.777 -14.658 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -10.277 2.887 -12.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -10.442 0.590 -13.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -11.641 0.962 -12.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -12.031 0.911 -14.283 1.00 0.00 H new ATOM 222 N THR A 14 -15.489 7.688 -14.745 1.00 0.00 N ATOM 223 CA THR A 14 -16.670 8.503 -14.418 1.00 0.00 C ATOM 224 C THR A 14 -17.285 8.078 -13.081 1.00 0.00 C ATOM 225 O THR A 14 -16.602 7.550 -12.205 1.00 0.00 O ATOM 226 CB THR A 14 -17.734 8.410 -15.528 1.00 0.00 C ATOM 227 OG1 THR A 14 -18.837 9.269 -15.208 1.00 0.00 O ATOM 228 CG2 THR A 14 -18.234 6.981 -15.669 1.00 0.00 C ATOM 0 H THR A 14 -14.748 8.200 -15.224 1.00 0.00 H new ATOM 0 HA THR A 14 -16.334 9.537 -14.337 1.00 0.00 H new ATOM 0 HB THR A 14 -17.283 8.721 -16.470 1.00 0.00 H new ATOM 0 HG1 THR A 14 -19.679 8.800 -15.384 1.00 0.00 H new ATOM 0 HG21 THR A 14 -18.985 6.934 -16.458 1.00 0.00 H new ATOM 0 HG22 THR A 14 -17.400 6.327 -15.923 1.00 0.00 H new ATOM 0 HG23 THR A 14 -18.676 6.656 -14.727 1.00 0.00 H new ATOM 236 N ALA A 15 -18.581 8.321 -12.923 1.00 0.00 N ATOM 237 CA ALA A 15 -19.251 8.018 -11.664 1.00 0.00 C ATOM 238 C ALA A 15 -18.674 8.859 -10.528 1.00 0.00 C ATOM 239 O ALA A 15 -17.464 8.890 -10.319 1.00 0.00 O ATOM 240 CB ALA A 15 -19.087 6.527 -11.342 1.00 0.00 C ATOM 0 H ALA A 15 -19.183 8.722 -13.642 1.00 0.00 H new ATOM 0 HA ALA A 15 -20.310 8.257 -11.765 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -19.588 6.301 -10.401 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -19.529 5.931 -12.141 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -18.027 6.288 -11.255 1.00 0.00 H new ATOM 246 N THR A 16 -19.553 9.536 -9.794 1.00 0.00 N ATOM 247 CA THR A 16 -19.124 10.348 -8.660 1.00 0.00 C ATOM 248 C THR A 16 -19.266 9.559 -7.364 1.00 0.00 C ATOM 249 O THR A 16 -20.366 9.159 -6.985 1.00 0.00 O ATOM 250 CB THR A 16 -19.931 11.656 -8.566 1.00 0.00 C ATOM 251 OG1 THR A 16 -19.729 12.431 -9.755 1.00 0.00 O ATOM 252 CG2 THR A 16 -19.494 12.467 -7.356 1.00 0.00 C ATOM 0 H THR A 16 -20.559 9.539 -9.962 1.00 0.00 H new ATOM 0 HA THR A 16 -18.076 10.606 -8.814 1.00 0.00 H new ATOM 0 HB THR A 16 -20.987 11.407 -8.461 1.00 0.00 H new ATOM 0 HG1 THR A 16 -20.244 13.262 -9.695 1.00 0.00 H new ATOM 0 HG21 THR A 16 -20.075 13.388 -7.306 1.00 0.00 H new ATOM 0 HG22 THR A 16 -19.658 11.885 -6.449 1.00 0.00 H new ATOM 0 HG23 THR A 16 -18.435 12.711 -7.444 1.00 0.00 H new ATOM 260 N VAL A 17 -18.142 9.338 -6.690 1.00 0.00 N ATOM 261 CA VAL A 17 -18.150 8.600 -5.433 1.00 0.00 C ATOM 262 C VAL A 17 -18.546 9.516 -4.279 1.00 0.00 C ATOM 263 O VAL A 17 -19.424 9.187 -3.483 1.00 0.00 O ATOM 264 CB VAL A 17 -16.762 7.993 -5.158 1.00 0.00 C ATOM 265 CG1 VAL A 17 -16.734 7.324 -3.792 1.00 0.00 C ATOM 266 CG2 VAL A 17 -16.405 6.998 -6.253 1.00 0.00 C ATOM 0 H VAL A 17 -17.221 9.657 -6.990 1.00 0.00 H new ATOM 0 HA VAL A 17 -18.881 7.796 -5.515 1.00 0.00 H new ATOM 0 HB VAL A 17 -16.021 8.792 -5.158 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -15.745 6.901 -3.614 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -16.957 8.062 -3.021 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -17.480 6.530 -3.760 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -15.422 6.573 -6.052 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -17.148 6.200 -6.276 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -16.390 7.507 -7.217 1.00 0.00 H new ATOM 276 N ALA A 18 -17.883 10.668 -4.193 1.00 0.00 N ATOM 277 CA ALA A 18 -18.227 11.669 -3.188 1.00 0.00 C ATOM 278 C ALA A 18 -18.003 11.117 -1.786 1.00 0.00 C ATOM 279 O ALA A 18 -18.717 11.471 -0.847 1.00 0.00 O ATOM 280 CB ALA A 18 -19.689 12.089 -3.345 1.00 0.00 C ATOM 0 H ALA A 18 -17.109 10.929 -4.804 1.00 0.00 H new ATOM 0 HA ALA A 18 -17.584 12.537 -3.333 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -19.936 12.836 -2.591 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -19.841 12.512 -4.338 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -20.333 11.219 -3.218 1.00 0.00 H new ATOM 286 N ARG A 19 -17.011 10.241 -1.654 1.00 0.00 N ATOM 287 CA ARG A 19 -16.656 9.669 -0.356 1.00 0.00 C ATOM 288 C ARG A 19 -15.142 9.530 -0.235 1.00 0.00 C ATOM 289 O ARG A 19 -14.433 9.394 -1.237 1.00 0.00 O ATOM 290 CB ARG A 19 -17.308 8.307 -0.166 1.00 0.00 C ATOM 291 CG ARG A 19 -18.828 8.329 -0.109 1.00 0.00 C ATOM 292 CD ARG A 19 -19.321 8.960 1.142 1.00 0.00 C ATOM 293 NE ARG A 19 -20.768 8.869 1.260 1.00 0.00 N ATOM 294 CZ ARG A 19 -21.636 9.752 0.729 1.00 0.00 C ATOM 295 NH1 ARG A 19 -21.190 10.784 0.047 1.00 0.00 N ATOM 296 NH2 ARG A 19 -22.936 9.581 0.893 1.00 0.00 N ATOM 0 H ARG A 19 -16.437 9.911 -2.430 1.00 0.00 H new ATOM 0 HA ARG A 19 -17.020 10.343 0.419 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -16.999 7.655 -0.983 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -16.930 7.865 0.756 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -19.217 8.874 -0.969 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -19.210 7.310 -0.178 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -18.855 8.476 2.001 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -19.020 10.007 1.164 1.00 0.00 H new ATOM 0 HE ARG A 19 -21.153 8.081 1.781 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -20.187 10.916 -0.080 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -21.847 11.452 -0.355 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -23.282 8.780 1.422 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -23.593 10.250 0.491 1.00 0.00 H new ATOM 310 N ASP A 20 -14.649 9.575 1.005 1.00 0.00 N ATOM 311 CA ASP A 20 -13.237 9.320 1.276 1.00 0.00 C ATOM 312 C ASP A 20 -12.918 7.854 1.017 1.00 0.00 C ATOM 313 O ASP A 20 -13.552 6.968 1.582 1.00 0.00 O ATOM 314 CB ASP A 20 -12.883 9.687 2.720 1.00 0.00 C ATOM 315 CG ASP A 20 -12.895 11.189 2.970 1.00 0.00 C ATOM 316 OD1 ASP A 20 -12.962 11.929 2.018 1.00 0.00 O ATOM 317 OD2 ASP A 20 -12.838 11.581 4.111 1.00 0.00 O ATOM 0 H ASP A 20 -15.206 9.785 1.833 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.640 9.942 0.610 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -13.590 9.206 3.396 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.895 9.292 2.958 1.00 0.00 H new ATOM 322 N ARG A 21 -11.943 7.605 0.148 1.00 0.00 N ATOM 323 CA ARG A 21 -11.567 6.240 -0.219 1.00 0.00 C ATOM 324 C ARG A 21 -10.069 6.048 -0.042 1.00 0.00 C ATOM 325 O ARG A 21 -9.280 6.959 -0.304 1.00 0.00 O ATOM 326 CB ARG A 21 -11.954 5.936 -1.659 1.00 0.00 C ATOM 327 CG ARG A 21 -13.427 6.136 -1.982 1.00 0.00 C ATOM 328 CD ARG A 21 -14.288 5.192 -1.226 1.00 0.00 C ATOM 329 NE ARG A 21 -14.032 3.809 -1.596 1.00 0.00 N ATOM 330 CZ ARG A 21 -14.607 3.177 -2.637 1.00 0.00 C ATOM 331 NH1 ARG A 21 -15.466 3.814 -3.400 1.00 0.00 N ATOM 332 NH2 ARG A 21 -14.307 1.915 -2.891 1.00 0.00 N ATOM 0 H ARG A 21 -11.397 8.331 -0.317 1.00 0.00 H new ATOM 0 HA ARG A 21 -12.103 5.553 0.436 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.363 6.569 -2.320 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -11.685 4.904 -1.882 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -13.715 7.160 -1.746 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -13.587 5.998 -3.051 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -14.116 5.320 -0.157 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -15.336 5.429 -1.410 1.00 0.00 H new ATOM 0 HE ARG A 21 -13.371 3.281 -1.027 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -15.698 4.788 -3.204 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -15.901 3.335 -4.188 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -13.640 1.420 -2.299 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -14.742 1.436 -3.679 1.00 0.00 H new ATOM 346 N LEU A 22 -9.680 4.857 0.400 1.00 0.00 N ATOM 347 CA LEU A 22 -8.267 4.494 0.499 1.00 0.00 C ATOM 348 C LEU A 22 -8.001 3.228 -0.312 1.00 0.00 C ATOM 349 O LEU A 22 -8.798 2.294 -0.303 1.00 0.00 O ATOM 350 CB LEU A 22 -7.866 4.274 1.963 1.00 0.00 C ATOM 351 CG LEU A 22 -7.973 5.504 2.873 1.00 0.00 C ATOM 352 CD1 LEU A 22 -9.380 5.591 3.449 1.00 0.00 C ATOM 353 CD2 LEU A 22 -6.934 5.408 3.980 1.00 0.00 C ATOM 0 H LEU A 22 -10.324 4.123 0.697 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.668 5.312 0.098 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -8.491 3.483 2.377 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.838 3.914 1.989 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.781 6.410 2.298 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -9.455 6.465 4.096 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -10.101 5.678 2.636 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.592 4.692 4.028 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -7.010 6.282 4.627 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -7.109 4.506 4.566 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.937 5.367 3.541 1.00 0.00 H new ATOM 365 N GLN A 23 -6.866 3.215 -1.012 1.00 0.00 N ATOM 366 CA GLN A 23 -6.447 2.049 -1.792 1.00 0.00 C ATOM 367 C GLN A 23 -4.996 1.721 -1.483 1.00 0.00 C ATOM 368 O GLN A 23 -4.098 2.523 -1.742 1.00 0.00 O ATOM 369 CB GLN A 23 -6.625 2.298 -3.292 1.00 0.00 C ATOM 370 CG GLN A 23 -8.067 2.499 -3.723 1.00 0.00 C ATOM 371 CD GLN A 23 -8.193 2.793 -5.205 1.00 0.00 C ATOM 372 OE1 GLN A 23 -7.324 3.435 -5.801 1.00 0.00 O ATOM 373 NE2 GLN A 23 -9.278 2.325 -5.811 1.00 0.00 N ATOM 0 H GLN A 23 -6.218 4.002 -1.055 1.00 0.00 H new ATOM 0 HA GLN A 23 -7.076 1.203 -1.515 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.047 3.178 -3.574 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -6.208 1.454 -3.841 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -8.643 1.605 -3.483 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -8.502 3.321 -3.154 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -9.972 1.799 -5.280 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -9.418 2.492 -6.808 1.00 0.00 H new ATOM 382 N ILE A 24 -4.771 0.538 -0.921 1.00 0.00 N ATOM 383 CA ILE A 24 -3.437 0.152 -0.466 1.00 0.00 C ATOM 384 C ILE A 24 -2.980 -1.108 -1.183 1.00 0.00 C ATOM 385 O ILE A 24 -3.643 -2.144 -1.124 1.00 0.00 O ATOM 386 CB ILE A 24 -3.412 -0.080 1.056 1.00 0.00 C ATOM 387 CG1 ILE A 24 -3.889 1.173 1.795 1.00 0.00 C ATOM 388 CG2 ILE A 24 -2.014 -0.470 1.511 1.00 0.00 C ATOM 389 CD1 ILE A 24 -5.362 1.159 2.133 1.00 0.00 C ATOM 0 H ILE A 24 -5.491 -0.169 -0.769 1.00 0.00 H new ATOM 0 HA ILE A 24 -2.756 0.970 -0.701 1.00 0.00 H new ATOM 0 HB ILE A 24 -4.091 -0.899 1.293 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -3.316 1.281 2.716 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -3.675 2.048 1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -2.014 -0.630 2.589 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -1.710 -1.388 1.008 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -1.315 0.328 1.263 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -5.624 2.079 2.655 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.945 1.084 1.215 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.580 0.304 2.773 1.00 0.00 H new ATOM 401 N ILE A 25 -1.836 -1.013 -1.855 1.00 0.00 N ATOM 402 CA ILE A 25 -1.241 -2.167 -2.526 1.00 0.00 C ATOM 403 C ILE A 25 0.111 -2.485 -1.905 1.00 0.00 C ATOM 404 O ILE A 25 1.041 -1.683 -1.971 1.00 0.00 O ATOM 405 CB ILE A 25 -1.075 -1.913 -4.035 1.00 0.00 C ATOM 406 CG1 ILE A 25 -2.425 -1.566 -4.671 1.00 0.00 C ATOM 407 CG2 ILE A 25 -0.460 -3.127 -4.714 1.00 0.00 C ATOM 408 CD1 ILE A 25 -2.702 -0.082 -4.743 1.00 0.00 C ATOM 0 H ILE A 25 -1.302 -0.149 -1.950 1.00 0.00 H new ATOM 0 HA ILE A 25 -1.912 -3.016 -2.397 1.00 0.00 H new ATOM 0 HB ILE A 25 -0.403 -1.066 -4.172 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -2.459 -1.982 -5.678 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.219 -2.047 -4.100 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -0.350 -2.930 -5.780 1.00 0.00 H new ATOM 0 HG22 ILE A 25 0.519 -3.330 -4.279 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.108 -3.992 -4.570 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.675 0.084 -5.205 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -2.701 0.337 -3.737 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -1.930 0.404 -5.339 1.00 0.00 H new ATOM 420 N ILE A 26 0.209 -3.663 -1.300 1.00 0.00 N ATOM 421 CA ILE A 26 1.429 -4.072 -0.606 1.00 0.00 C ATOM 422 C ILE A 26 2.020 -5.310 -1.262 1.00 0.00 C ATOM 423 O ILE A 26 1.399 -6.367 -1.271 1.00 0.00 O ATOM 424 CB ILE A 26 1.157 -4.358 0.883 1.00 0.00 C ATOM 425 CG1 ILE A 26 0.566 -3.120 1.564 1.00 0.00 C ATOM 426 CG2 ILE A 26 2.434 -4.795 1.583 1.00 0.00 C ATOM 427 CD1 ILE A 26 0.050 -3.380 2.961 1.00 0.00 C ATOM 0 H ILE A 26 -0.541 -4.354 -1.275 1.00 0.00 H new ATOM 0 HA ILE A 26 2.140 -3.249 -0.675 1.00 0.00 H new ATOM 0 HB ILE A 26 0.433 -5.170 0.954 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.328 -2.342 1.607 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.249 -2.734 0.952 1.00 0.00 H new ATOM 0 HG21 ILE A 26 2.223 -4.993 2.634 1.00 0.00 H new ATOM 0 HG22 ILE A 26 2.815 -5.701 1.112 1.00 0.00 H new ATOM 0 HG23 ILE A 26 3.180 -4.004 1.505 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -0.353 -2.457 3.378 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.736 -4.135 2.924 1.00 0.00 H new ATOM 0 HD13 ILE A 26 0.866 -3.736 3.590 1.00 0.00 H new ATOM 439 N ALA A 27 3.229 -5.170 -1.805 1.00 0.00 N ATOM 440 CA ALA A 27 3.947 -6.308 -2.386 1.00 0.00 C ATOM 441 C ALA A 27 4.947 -6.861 -1.382 1.00 0.00 C ATOM 442 O ALA A 27 5.662 -6.108 -0.721 1.00 0.00 O ATOM 443 CB ALA A 27 4.686 -5.874 -3.653 1.00 0.00 C ATOM 0 H ALA A 27 3.732 -4.284 -1.856 1.00 0.00 H new ATOM 0 HA ALA A 27 3.223 -7.083 -2.640 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.216 -6.728 -4.076 1.00 0.00 H new ATOM 0 HB2 ALA A 27 3.969 -5.495 -4.381 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.401 -5.089 -3.406 1.00 0.00 H new ATOM 449 N GLN A 28 4.988 -8.186 -1.270 1.00 0.00 N ATOM 450 CA GLN A 28 5.874 -8.844 -0.315 1.00 0.00 C ATOM 451 C GLN A 28 6.681 -9.936 -0.999 1.00 0.00 C ATOM 452 O GLN A 28 6.139 -10.975 -1.378 1.00 0.00 O ATOM 453 CB GLN A 28 5.074 -9.434 0.850 1.00 0.00 C ATOM 454 CG GLN A 28 5.898 -10.283 1.803 1.00 0.00 C ATOM 455 CD GLN A 28 6.956 -9.476 2.530 1.00 0.00 C ATOM 456 OE1 GLN A 28 6.642 -8.596 3.336 1.00 0.00 O ATOM 457 NE2 GLN A 28 8.220 -9.771 2.249 1.00 0.00 N ATOM 0 H GLN A 28 4.419 -8.824 -1.827 1.00 0.00 H new ATOM 0 HA GLN A 28 6.561 -8.095 0.079 1.00 0.00 H new ATOM 0 HB2 GLN A 28 4.615 -8.620 1.411 1.00 0.00 H new ATOM 0 HB3 GLN A 28 4.263 -10.041 0.449 1.00 0.00 H new ATOM 0 HG2 GLN A 28 5.237 -10.751 2.533 1.00 0.00 H new ATOM 0 HG3 GLN A 28 6.378 -11.088 1.246 1.00 0.00 H new ATOM 0 HE21 GLN A 28 8.434 -10.507 1.576 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.976 -9.262 2.706 1.00 0.00 H new ATOM 466 N GLU A 29 7.982 -9.700 -1.140 1.00 0.00 N ATOM 467 CA GLU A 29 8.876 -10.673 -1.771 1.00 0.00 C ATOM 468 C GLU A 29 8.849 -11.974 -0.981 1.00 0.00 C ATOM 469 O GLU A 29 8.876 -11.963 0.249 1.00 0.00 O ATOM 470 CB GLU A 29 10.307 -10.133 -1.849 1.00 0.00 C ATOM 471 CG GLU A 29 11.290 -11.058 -2.554 1.00 0.00 C ATOM 472 CD GLU A 29 11.036 -11.164 -4.032 1.00 0.00 C ATOM 473 OE1 GLU A 29 10.550 -10.217 -4.602 1.00 0.00 O ATOM 474 OE2 GLU A 29 11.327 -12.195 -4.591 1.00 0.00 O ATOM 0 H GLU A 29 8.443 -8.845 -0.827 1.00 0.00 H new ATOM 0 HA GLU A 29 8.530 -10.857 -2.788 1.00 0.00 H new ATOM 0 HB2 GLU A 29 10.293 -9.174 -2.367 1.00 0.00 H new ATOM 0 HB3 GLU A 29 10.667 -9.943 -0.838 1.00 0.00 H new ATOM 0 HG2 GLU A 29 12.305 -10.695 -2.390 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.231 -12.051 -2.108 1.00 0.00 H new ATOM 481 N ARG A 30 8.793 -13.097 -1.692 1.00 0.00 N ATOM 482 CA ARG A 30 8.909 -14.415 -1.064 1.00 0.00 C ATOM 483 C ARG A 30 9.228 -15.477 -2.104 1.00 0.00 C ATOM 484 O ARG A 30 8.645 -16.561 -2.100 1.00 0.00 O ATOM 485 CB ARG A 30 7.623 -14.785 -0.340 1.00 0.00 C ATOM 486 CG ARG A 30 6.467 -15.173 -1.249 1.00 0.00 C ATOM 487 CD ARG A 30 5.350 -15.787 -0.486 1.00 0.00 C ATOM 488 NE ARG A 30 4.320 -16.317 -1.364 1.00 0.00 N ATOM 489 CZ ARG A 30 4.338 -17.549 -1.909 1.00 0.00 C ATOM 490 NH1 ARG A 30 5.339 -18.364 -1.657 1.00 0.00 N ATOM 491 NH2 ARG A 30 3.351 -17.938 -2.697 1.00 0.00 N ATOM 0 H ARG A 30 8.668 -13.123 -2.704 1.00 0.00 H new ATOM 0 HA ARG A 30 9.722 -14.367 -0.339 1.00 0.00 H new ATOM 0 HB2 ARG A 30 7.829 -15.615 0.336 1.00 0.00 H new ATOM 0 HB3 ARG A 30 7.314 -13.941 0.277 1.00 0.00 H new ATOM 0 HG2 ARG A 30 6.106 -14.290 -1.775 1.00 0.00 H new ATOM 0 HG3 ARG A 30 6.819 -15.874 -2.006 1.00 0.00 H new ATOM 0 HD2 ARG A 30 5.738 -16.588 0.144 1.00 0.00 H new ATOM 0 HD3 ARG A 30 4.912 -15.042 0.179 1.00 0.00 H new ATOM 0 HE ARG A 30 3.527 -15.713 -1.583 1.00 0.00 H new ATOM 0 HH11 ARG A 30 6.101 -18.063 -1.049 1.00 0.00 H new ATOM 0 HH12 ARG A 30 5.353 -19.297 -2.069 1.00 0.00 H new ATOM 0 HH21 ARG A 30 2.575 -17.305 -2.893 1.00 0.00 H new ATOM 0 HH22 ARG A 30 3.365 -18.871 -3.109 1.00 0.00 H new ATOM 505 N ALA A 31 10.160 -15.156 -2.997 1.00 0.00 N ATOM 506 CA ALA A 31 10.686 -16.147 -3.929 1.00 0.00 C ATOM 507 C ALA A 31 11.298 -17.313 -3.160 1.00 0.00 C ATOM 508 O ALA A 31 11.263 -17.333 -1.929 1.00 0.00 O ATOM 509 CB ALA A 31 11.750 -15.500 -4.820 1.00 0.00 C ATOM 0 H ALA A 31 10.564 -14.224 -3.094 1.00 0.00 H new ATOM 0 HA ALA A 31 9.872 -16.520 -4.550 1.00 0.00 H new ATOM 0 HB1 ALA A 31 12.142 -16.242 -5.516 1.00 0.00 H new ATOM 0 HB2 ALA A 31 11.305 -14.677 -5.379 1.00 0.00 H new ATOM 0 HB3 ALA A 31 12.562 -15.120 -4.200 1.00 0.00 H new ATOM 515 N GLN A 32 11.846 -18.284 -3.887 1.00 0.00 N ATOM 516 CA GLN A 32 12.364 -19.505 -3.266 1.00 0.00 C ATOM 517 C GLN A 32 13.401 -19.177 -2.194 1.00 0.00 C ATOM 518 O GLN A 32 13.492 -19.861 -1.174 1.00 0.00 O ATOM 519 CB GLN A 32 12.977 -20.429 -4.321 1.00 0.00 C ATOM 520 CG GLN A 32 13.443 -21.769 -3.780 1.00 0.00 C ATOM 521 CD GLN A 32 12.297 -22.616 -3.262 1.00 0.00 C ATOM 522 OE1 GLN A 32 11.305 -22.838 -3.962 1.00 0.00 O ATOM 523 NE2 GLN A 32 12.425 -23.094 -2.030 1.00 0.00 N ATOM 0 H GLN A 32 11.944 -18.252 -4.902 1.00 0.00 H new ATOM 0 HA GLN A 32 11.527 -20.018 -2.792 1.00 0.00 H new ATOM 0 HB2 GLN A 32 12.242 -20.603 -5.107 1.00 0.00 H new ATOM 0 HB3 GLN A 32 13.824 -19.922 -4.784 1.00 0.00 H new ATOM 0 HG2 GLN A 32 13.966 -22.313 -4.567 1.00 0.00 H new ATOM 0 HG3 GLN A 32 14.160 -21.603 -2.976 1.00 0.00 H new ATOM 0 HE21 GLN A 32 13.263 -22.885 -1.487 1.00 0.00 H new ATOM 0 HE22 GLN A 32 11.686 -23.670 -1.627 1.00 0.00 H new ATOM 532 N GLU A 33 14.177 -18.123 -2.434 1.00 0.00 N ATOM 533 CA GLU A 33 15.143 -17.660 -1.448 1.00 0.00 C ATOM 534 C GLU A 33 14.426 -16.911 -0.330 1.00 0.00 C ATOM 535 O GLU A 33 13.830 -15.858 -0.554 1.00 0.00 O ATOM 536 CB GLU A 33 16.192 -16.756 -2.101 1.00 0.00 C ATOM 537 CG GLU A 33 17.294 -16.291 -1.161 1.00 0.00 C ATOM 538 CD GLU A 33 18.338 -15.457 -1.850 1.00 0.00 C ATOM 539 OE1 GLU A 33 18.250 -15.296 -3.044 1.00 0.00 O ATOM 540 OE2 GLU A 33 19.226 -14.980 -1.183 1.00 0.00 O ATOM 0 H GLU A 33 14.155 -17.579 -3.296 1.00 0.00 H new ATOM 0 HA GLU A 33 15.652 -18.527 -1.027 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.645 -17.290 -2.936 1.00 0.00 H new ATOM 0 HB3 GLU A 33 15.692 -15.881 -2.516 1.00 0.00 H new ATOM 0 HG2 GLU A 33 16.852 -15.713 -0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 33 17.771 -17.161 -0.710 1.00 0.00 H new ATOM 547 N GLY A 34 14.487 -17.468 0.876 1.00 0.00 N ATOM 548 CA GLY A 34 13.789 -16.893 2.024 1.00 0.00 C ATOM 549 C GLY A 34 12.711 -17.841 2.530 1.00 0.00 C ATOM 550 O GLY A 34 12.230 -18.703 1.794 1.00 0.00 O ATOM 0 H GLY A 34 15.012 -18.317 1.085 1.00 0.00 H new ATOM 0 HA2 GLY A 34 14.502 -16.686 2.822 1.00 0.00 H new ATOM 0 HA3 GLY A 34 13.340 -15.941 1.743 1.00 0.00 H new ATOM 554 N GLN A 35 12.332 -17.677 3.795 1.00 0.00 N ATOM 555 CA GLN A 35 11.354 -18.569 4.425 1.00 0.00 C ATOM 556 C GLN A 35 10.598 -17.841 5.529 1.00 0.00 C ATOM 557 O GLN A 35 10.938 -16.714 5.892 1.00 0.00 O ATOM 558 CB GLN A 35 12.042 -19.814 4.993 1.00 0.00 C ATOM 559 CG GLN A 35 13.037 -19.522 6.104 1.00 0.00 C ATOM 560 CD GLN A 35 13.743 -20.774 6.591 1.00 0.00 C ATOM 561 OE1 GLN A 35 14.218 -21.586 5.792 1.00 0.00 O ATOM 562 NE2 GLN A 35 13.816 -20.936 7.907 1.00 0.00 N ATOM 0 H GLN A 35 12.684 -16.939 4.404 1.00 0.00 H new ATOM 0 HA GLN A 35 10.643 -18.883 3.661 1.00 0.00 H new ATOM 0 HB2 GLN A 35 11.280 -20.495 5.372 1.00 0.00 H new ATOM 0 HB3 GLN A 35 12.558 -20.331 4.184 1.00 0.00 H new ATOM 0 HG2 GLN A 35 13.777 -18.806 5.746 1.00 0.00 H new ATOM 0 HG3 GLN A 35 12.518 -19.053 6.939 1.00 0.00 H new ATOM 0 HE21 GLN A 35 13.409 -20.239 8.530 1.00 0.00 H new ATOM 0 HE22 GLN A 35 14.279 -21.758 8.295 1.00 0.00 H new ATOM 571 N THR A 36 9.565 -18.490 6.052 1.00 0.00 N ATOM 572 CA THR A 36 8.853 -17.959 7.205 1.00 0.00 C ATOM 573 C THR A 36 7.982 -16.772 6.778 1.00 0.00 C ATOM 574 O THR A 36 8.423 -15.629 6.840 1.00 0.00 O ATOM 575 CB THR A 36 9.829 -17.528 8.316 1.00 0.00 C ATOM 576 OG1 THR A 36 10.653 -18.640 8.689 1.00 0.00 O ATOM 577 CG2 THR A 36 9.065 -17.037 9.536 1.00 0.00 C ATOM 0 H THR A 36 9.205 -19.377 5.699 1.00 0.00 H new ATOM 0 HA THR A 36 8.217 -18.749 7.605 1.00 0.00 H new ATOM 0 HB THR A 36 10.451 -16.716 7.938 1.00 0.00 H new ATOM 0 HG1 THR A 36 11.275 -18.364 9.395 1.00 0.00 H new ATOM 0 HG21 THR A 36 9.771 -16.737 10.311 1.00 0.00 H new ATOM 0 HG22 THR A 36 8.446 -16.184 9.259 1.00 0.00 H new ATOM 0 HG23 THR A 36 8.430 -17.838 9.914 1.00 0.00 H new ATOM 585 N PRO A 37 6.768 -17.023 6.339 1.00 0.00 N ATOM 586 CA PRO A 37 5.774 -15.938 6.052 1.00 0.00 C ATOM 587 C PRO A 37 5.465 -15.076 7.297 1.00 0.00 C ATOM 588 O PRO A 37 6.218 -15.096 8.253 1.00 0.00 O ATOM 589 CB PRO A 37 4.535 -16.717 5.599 1.00 0.00 C ATOM 590 CG PRO A 37 5.075 -18.036 5.160 1.00 0.00 C ATOM 591 CD PRO A 37 6.181 -18.333 6.136 1.00 0.00 C ATOM 0 HA PRO A 37 6.139 -15.226 5.312 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.817 -16.831 6.411 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.019 -16.207 4.786 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.306 -18.808 5.185 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.449 -17.991 4.137 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.801 -18.758 7.065 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.901 -19.044 5.731 1.00 0.00 H new ATOM 599 N ASP A 38 4.333 -14.375 7.301 1.00 0.00 N ATOM 600 CA ASP A 38 3.887 -13.592 8.472 1.00 0.00 C ATOM 601 C ASP A 38 4.333 -12.131 8.398 1.00 0.00 C ATOM 602 O ASP A 38 5.081 -11.657 9.253 1.00 0.00 O ATOM 603 CB ASP A 38 4.418 -14.217 9.765 1.00 0.00 C ATOM 604 CG ASP A 38 3.653 -13.762 11.000 1.00 0.00 C ATOM 605 OD1 ASP A 38 2.531 -13.338 10.857 1.00 0.00 O ATOM 606 OD2 ASP A 38 4.197 -13.844 12.075 1.00 0.00 O ATOM 0 H ASP A 38 3.698 -14.328 6.504 1.00 0.00 H new ATOM 0 HA ASP A 38 2.797 -13.612 8.468 1.00 0.00 H new ATOM 0 HB2 ASP A 38 4.361 -15.303 9.688 1.00 0.00 H new ATOM 0 HB3 ASP A 38 5.471 -13.960 9.881 1.00 0.00 H new ATOM 611 N TYR A 39 3.850 -11.414 7.383 1.00 0.00 N ATOM 612 CA TYR A 39 4.266 -10.028 7.148 1.00 0.00 C ATOM 613 C TYR A 39 3.072 -9.184 6.700 1.00 0.00 C ATOM 614 O TYR A 39 2.732 -8.183 7.327 1.00 0.00 O ATOM 615 CB TYR A 39 5.385 -9.965 6.106 1.00 0.00 C ATOM 616 CG TYR A 39 6.637 -10.711 6.510 1.00 0.00 C ATOM 617 CD1 TYR A 39 6.980 -11.892 5.866 1.00 0.00 C ATOM 618 CD2 TYR A 39 7.443 -10.217 7.525 1.00 0.00 C ATOM 619 CE1 TYR A 39 8.124 -12.573 6.236 1.00 0.00 C ATOM 620 CE2 TYR A 39 8.587 -10.898 7.894 1.00 0.00 C ATOM 621 CZ TYR A 39 8.927 -12.071 7.253 1.00 0.00 C ATOM 622 OH TYR A 39 10.066 -12.750 7.621 1.00 0.00 O ATOM 0 H TYR A 39 3.171 -11.768 6.710 1.00 0.00 H new ATOM 0 HA TYR A 39 4.650 -9.623 8.084 1.00 0.00 H new ATOM 0 HB2 TYR A 39 5.017 -10.375 5.165 1.00 0.00 H new ATOM 0 HB3 TYR A 39 5.639 -8.921 5.921 1.00 0.00 H new ATOM 0 HD1 TYR A 39 6.353 -12.278 5.076 1.00 0.00 H new ATOM 0 HD2 TYR A 39 7.176 -9.299 8.027 1.00 0.00 H new ATOM 0 HE1 TYR A 39 8.393 -13.492 5.737 1.00 0.00 H new ATOM 0 HE2 TYR A 39 9.215 -10.512 8.684 1.00 0.00 H new ATOM 0 HH TYR A 39 10.516 -12.266 8.345 1.00 0.00 H new ATOM 632 N LEU A 40 2.435 -9.609 5.615 1.00 0.00 N ATOM 633 CA LEU A 40 1.283 -8.890 5.078 1.00 0.00 C ATOM 634 C LEU A 40 0.186 -8.788 6.154 1.00 0.00 C ATOM 635 O LEU A 40 -0.303 -7.692 6.435 1.00 0.00 O ATOM 636 CB LEU A 40 0.741 -9.600 3.832 1.00 0.00 C ATOM 637 CG LEU A 40 1.602 -9.479 2.569 1.00 0.00 C ATOM 638 CD1 LEU A 40 1.051 -10.399 1.487 1.00 0.00 C ATOM 639 CD2 LEU A 40 1.617 -8.031 2.101 1.00 0.00 C ATOM 0 H LEU A 40 2.694 -10.445 5.091 1.00 0.00 H new ATOM 0 HA LEU A 40 1.596 -7.886 4.792 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.617 -10.658 4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.250 -9.203 3.613 1.00 0.00 H new ATOM 0 HG LEU A 40 2.627 -9.780 2.787 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.663 -10.313 0.589 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.070 -11.430 1.841 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.025 -10.114 1.255 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.229 -7.945 1.203 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.599 -7.710 1.878 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.033 -7.399 2.886 1.00 0.00 H new ATOM 651 N PRO A 41 -0.204 -9.888 6.775 1.00 0.00 N ATOM 652 CA PRO A 41 -1.300 -9.879 7.800 1.00 0.00 C ATOM 653 C PRO A 41 -0.879 -9.160 9.082 1.00 0.00 C ATOM 654 O PRO A 41 -1.721 -8.635 9.813 1.00 0.00 O ATOM 655 CB PRO A 41 -1.572 -11.373 8.060 1.00 0.00 C ATOM 656 CG PRO A 41 -0.294 -12.050 7.697 1.00 0.00 C ATOM 657 CD PRO A 41 0.237 -11.286 6.489 1.00 0.00 C ATOM 0 HA PRO A 41 -2.183 -9.341 7.455 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -1.836 -11.554 9.102 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -2.401 -11.738 7.454 1.00 0.00 H new ATOM 0 HG2 PRO A 41 0.415 -12.020 8.524 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -0.460 -13.100 7.456 1.00 0.00 H new ATOM 0 HD2 PRO A 41 1.321 -11.361 6.405 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -0.181 -11.661 5.555 1.00 0.00 H new ATOM 665 N THR A 42 0.425 -9.123 9.343 1.00 0.00 N ATOM 666 CA THR A 42 0.937 -8.376 10.488 1.00 0.00 C ATOM 667 C THR A 42 0.734 -6.873 10.296 1.00 0.00 C ATOM 668 O THR A 42 0.224 -6.186 11.183 1.00 0.00 O ATOM 669 CB THR A 42 2.430 -8.674 10.720 1.00 0.00 C ATOM 670 OG1 THR A 42 2.602 -10.065 11.020 1.00 0.00 O ATOM 671 CG2 THR A 42 2.967 -7.841 11.874 1.00 0.00 C ATOM 0 H THR A 42 1.138 -9.594 8.786 1.00 0.00 H new ATOM 0 HA THR A 42 0.375 -8.697 11.365 1.00 0.00 H new ATOM 0 HB THR A 42 2.980 -8.420 9.814 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.553 -10.253 11.166 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.023 -8.065 12.024 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.849 -6.782 11.644 1.00 0.00 H new ATOM 0 HG23 THR A 42 2.414 -8.079 12.783 1.00 0.00 H new ATOM 679 N LEU A 43 1.137 -6.367 9.133 1.00 0.00 N ATOM 680 CA LEU A 43 0.968 -4.953 8.820 1.00 0.00 C ATOM 681 C LEU A 43 -0.496 -4.634 8.537 1.00 0.00 C ATOM 682 O LEU A 43 -0.958 -3.525 8.793 1.00 0.00 O ATOM 683 CB LEU A 43 1.828 -4.568 7.609 1.00 0.00 C ATOM 684 CG LEU A 43 3.346 -4.638 7.822 1.00 0.00 C ATOM 685 CD1 LEU A 43 4.057 -4.335 6.511 1.00 0.00 C ATOM 686 CD2 LEU A 43 3.752 -3.650 8.906 1.00 0.00 C ATOM 0 H LEU A 43 1.581 -6.914 8.395 1.00 0.00 H new ATOM 0 HA LEU A 43 1.291 -4.373 9.685 1.00 0.00 H new ATOM 0 HB2 LEU A 43 1.566 -5.222 6.778 1.00 0.00 H new ATOM 0 HB3 LEU A 43 1.568 -3.553 7.310 1.00 0.00 H new ATOM 0 HG LEU A 43 3.632 -5.639 8.145 1.00 0.00 H new ATOM 0 HD11 LEU A 43 5.135 -4.385 6.662 1.00 0.00 H new ATOM 0 HD12 LEU A 43 3.762 -5.067 5.759 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.784 -3.336 6.171 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.830 -3.699 9.058 1.00 0.00 H new ATOM 0 HD22 LEU A 43 3.474 -2.641 8.601 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.243 -3.901 9.836 1.00 0.00 H new ATOM 698 N ARG A 44 -1.219 -5.613 8.012 1.00 0.00 N ATOM 699 CA ARG A 44 -2.656 -5.462 7.830 1.00 0.00 C ATOM 700 C ARG A 44 -3.346 -5.227 9.168 1.00 0.00 C ATOM 701 O ARG A 44 -4.183 -4.336 9.290 1.00 0.00 O ATOM 702 CB ARG A 44 -3.247 -6.697 7.165 1.00 0.00 C ATOM 703 CG ARG A 44 -4.742 -6.626 6.899 1.00 0.00 C ATOM 704 CD ARG A 44 -5.266 -7.909 6.363 1.00 0.00 C ATOM 705 NE ARG A 44 -5.179 -8.981 7.341 1.00 0.00 N ATOM 706 CZ ARG A 44 -5.299 -10.292 7.053 1.00 0.00 C ATOM 707 NH1 ARG A 44 -5.510 -10.675 5.813 1.00 0.00 N ATOM 708 NH2 ARG A 44 -5.205 -11.192 8.016 1.00 0.00 N ATOM 0 H ARG A 44 -0.840 -6.510 7.708 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.821 -4.598 7.187 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -2.732 -6.864 6.219 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.045 -7.563 7.795 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.265 -6.377 7.823 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.948 -5.824 6.190 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.305 -7.778 6.059 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.705 -8.186 5.470 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.016 -8.723 8.314 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.583 -9.980 5.070 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -5.601 -11.667 5.594 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.042 -10.895 8.978 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.296 -12.184 7.797 1.00 0.00 H new ATOM 722 N LYS A 45 -3.010 -6.036 10.159 1.00 0.00 N ATOM 723 CA LYS A 45 -3.561 -5.840 11.491 1.00 0.00 C ATOM 724 C LYS A 45 -3.188 -4.472 12.054 1.00 0.00 C ATOM 725 O LYS A 45 -4.009 -3.810 12.692 1.00 0.00 O ATOM 726 CB LYS A 45 -3.079 -6.945 12.433 1.00 0.00 C ATOM 727 CG LYS A 45 -3.646 -6.861 13.844 1.00 0.00 C ATOM 728 CD LYS A 45 -3.185 -8.034 14.696 1.00 0.00 C ATOM 729 CE LYS A 45 -3.732 -7.940 16.112 1.00 0.00 C ATOM 730 NZ LYS A 45 -3.287 -9.080 16.958 1.00 0.00 N ATOM 0 H LYS A 45 -2.368 -6.824 10.070 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.647 -5.886 11.411 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -3.344 -7.912 12.005 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -1.991 -6.909 12.489 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -3.333 -5.926 14.309 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -4.735 -6.846 13.800 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -3.512 -8.968 14.239 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -2.096 -8.058 14.726 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -3.406 -7.004 16.565 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.821 -7.916 16.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -3.682 -8.977 17.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -3.619 -9.973 16.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -2.248 -9.088 17.011 1.00 0.00 H new ATOM 744 N ALA A 46 -1.945 -4.062 11.837 1.00 0.00 N ATOM 745 CA ALA A 46 -1.493 -2.764 12.315 1.00 0.00 C ATOM 746 C ALA A 46 -2.302 -1.653 11.688 1.00 0.00 C ATOM 747 O ALA A 46 -2.752 -0.735 12.369 1.00 0.00 O ATOM 748 CB ALA A 46 -0.014 -2.554 11.995 1.00 0.00 C ATOM 0 H ALA A 46 -1.239 -4.604 11.338 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.631 -2.742 13.396 1.00 0.00 H new ATOM 0 HB1 ALA A 46 0.302 -1.577 12.361 1.00 0.00 H new ATOM 0 HB2 ALA A 46 0.577 -3.332 12.479 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.135 -2.603 10.916 1.00 0.00 H new ATOM 754 N LEU A 47 -2.495 -1.743 10.388 1.00 0.00 N ATOM 755 CA LEU A 47 -3.308 -0.762 9.685 1.00 0.00 C ATOM 756 C LEU A 47 -4.748 -0.776 10.192 1.00 0.00 C ATOM 757 O LEU A 47 -5.360 0.275 10.376 1.00 0.00 O ATOM 758 CB LEU A 47 -3.285 -1.042 8.177 1.00 0.00 C ATOM 759 CG LEU A 47 -1.967 -0.722 7.461 1.00 0.00 C ATOM 760 CD1 LEU A 47 -2.017 -1.261 6.038 1.00 0.00 C ATOM 761 CD2 LEU A 47 -1.737 0.783 7.468 1.00 0.00 C ATOM 0 H LEU A 47 -2.105 -2.478 9.798 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.887 0.225 9.876 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.517 -2.095 8.018 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.082 -0.466 7.707 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.136 -1.199 7.980 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.080 -1.033 5.530 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.163 -2.341 6.063 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.844 -0.795 5.501 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.800 1.010 6.959 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.559 1.279 6.953 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -1.686 1.139 8.497 1.00 0.00 H new ATOM 773 N MET A 48 -5.272 -1.970 10.415 1.00 0.00 N ATOM 774 CA MET A 48 -6.618 -2.121 10.952 1.00 0.00 C ATOM 775 C MET A 48 -6.748 -1.417 12.299 1.00 0.00 C ATOM 776 O MET A 48 -7.689 -0.653 12.525 1.00 0.00 O ATOM 777 CB MET A 48 -6.972 -3.601 11.084 1.00 0.00 C ATOM 778 CG MET A 48 -8.345 -3.869 11.685 1.00 0.00 C ATOM 779 SD MET A 48 -8.655 -5.625 11.956 1.00 0.00 S ATOM 780 CE MET A 48 -7.506 -5.971 13.285 1.00 0.00 C ATOM 0 H MET A 48 -4.788 -2.849 10.233 1.00 0.00 H new ATOM 0 HA MET A 48 -7.318 -1.655 10.259 1.00 0.00 H new ATOM 0 HB2 MET A 48 -6.924 -4.063 10.098 1.00 0.00 H new ATOM 0 HB3 MET A 48 -6.217 -4.089 11.701 1.00 0.00 H new ATOM 0 HG2 MET A 48 -8.432 -3.338 12.633 1.00 0.00 H new ATOM 0 HG3 MET A 48 -9.112 -3.467 11.023 1.00 0.00 H new ATOM 0 HE1 MET A 48 -6.797 -6.734 12.964 1.00 0.00 H new ATOM 0 HE2 MET A 48 -6.966 -5.061 13.545 1.00 0.00 H new ATOM 0 HE3 MET A 48 -8.055 -6.329 14.156 1.00 0.00 H new ATOM 790 N GLU A 49 -5.795 -1.671 13.186 1.00 0.00 N ATOM 791 CA GLU A 49 -5.808 -1.063 14.511 1.00 0.00 C ATOM 792 C GLU A 49 -5.759 0.462 14.421 1.00 0.00 C ATOM 793 O GLU A 49 -6.617 1.153 14.971 1.00 0.00 O ATOM 794 CB GLU A 49 -4.628 -1.575 15.341 1.00 0.00 C ATOM 795 CG GLU A 49 -4.554 -1.000 16.748 1.00 0.00 C ATOM 796 CD GLU A 49 -3.401 -1.546 17.543 1.00 0.00 C ATOM 797 OE1 GLU A 49 -2.709 -2.399 17.041 1.00 0.00 O ATOM 798 OE2 GLU A 49 -3.211 -1.110 18.654 1.00 0.00 O ATOM 0 H GLU A 49 -5.005 -2.292 13.013 1.00 0.00 H new ATOM 0 HA GLU A 49 -6.740 -1.346 15.000 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.691 -2.661 15.408 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.702 -1.341 14.817 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.466 0.085 16.688 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.485 -1.215 17.273 1.00 0.00 H new ATOM 805 N VAL A 50 -4.771 0.984 13.703 1.00 0.00 N ATOM 806 CA VAL A 50 -4.590 2.431 13.620 1.00 0.00 C ATOM 807 C VAL A 50 -5.783 3.072 12.923 1.00 0.00 C ATOM 808 O VAL A 50 -6.312 4.083 13.381 1.00 0.00 O ATOM 809 CB VAL A 50 -3.299 2.771 12.852 1.00 0.00 C ATOM 810 CG1 VAL A 50 -3.212 4.267 12.592 1.00 0.00 C ATOM 811 CG2 VAL A 50 -2.088 2.289 13.635 1.00 0.00 C ATOM 0 H VAL A 50 -4.091 0.437 13.176 1.00 0.00 H new ATOM 0 HA VAL A 50 -4.512 2.824 14.634 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.317 2.261 11.889 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.294 4.489 12.049 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.070 4.584 11.999 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.210 4.802 13.542 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.179 2.533 13.086 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.066 2.778 14.609 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.150 1.210 13.773 1.00 0.00 H new ATOM 821 N LEU A 51 -6.193 2.485 11.805 1.00 0.00 N ATOM 822 CA LEU A 51 -7.295 3.045 11.039 1.00 0.00 C ATOM 823 C LEU A 51 -8.558 3.105 11.890 1.00 0.00 C ATOM 824 O LEU A 51 -9.164 4.162 12.038 1.00 0.00 O ATOM 825 CB LEU A 51 -7.551 2.206 9.780 1.00 0.00 C ATOM 826 CG LEU A 51 -8.739 2.649 8.917 1.00 0.00 C ATOM 827 CD1 LEU A 51 -8.487 4.055 8.387 1.00 0.00 C ATOM 828 CD2 LEU A 51 -8.933 1.662 7.775 1.00 0.00 C ATOM 0 H LEU A 51 -5.786 1.635 11.415 1.00 0.00 H new ATOM 0 HA LEU A 51 -7.025 4.058 10.739 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -6.652 2.224 9.165 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.710 1.171 10.082 1.00 0.00 H new ATOM 0 HG LEU A 51 -9.649 2.665 9.517 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -9.331 4.369 7.774 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.370 4.744 9.224 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.579 4.059 7.784 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -9.777 1.977 7.162 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -8.031 1.632 7.163 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -9.130 0.670 8.181 1.00 0.00 H new ATOM 840 N SER A 52 -8.952 1.979 12.464 1.00 0.00 N ATOM 841 CA SER A 52 -10.218 1.921 13.179 1.00 0.00 C ATOM 842 C SER A 52 -10.153 2.755 14.459 1.00 0.00 C ATOM 843 O SER A 52 -11.169 3.263 14.930 1.00 0.00 O ATOM 844 CB SER A 52 -10.565 0.483 13.512 1.00 0.00 C ATOM 845 OG SER A 52 -9.629 -0.067 14.399 1.00 0.00 O ATOM 0 H SER A 52 -8.424 1.106 12.450 1.00 0.00 H new ATOM 0 HA SER A 52 -10.995 2.334 12.536 1.00 0.00 H new ATOM 0 HB2 SER A 52 -11.560 0.438 13.954 1.00 0.00 H new ATOM 0 HB3 SER A 52 -10.596 -0.109 12.597 1.00 0.00 H new ATOM 0 HG SER A 52 -8.827 -0.335 13.904 1.00 0.00 H new ATOM 851 N LYS A 53 -8.950 2.894 15.014 1.00 0.00 N ATOM 852 CA LYS A 53 -8.745 3.714 16.214 1.00 0.00 C ATOM 853 C LYS A 53 -9.058 5.189 15.944 1.00 0.00 C ATOM 854 O LYS A 53 -9.823 5.816 16.677 1.00 0.00 O ATOM 855 CB LYS A 53 -7.310 3.567 16.723 1.00 0.00 C ATOM 856 CG LYS A 53 -7.000 4.382 17.971 1.00 0.00 C ATOM 857 CD LYS A 53 -5.584 4.120 18.464 1.00 0.00 C ATOM 858 CE LYS A 53 -5.265 4.949 19.700 1.00 0.00 C ATOM 859 NZ LYS A 53 -3.885 4.700 20.196 1.00 0.00 N ATOM 0 H LYS A 53 -8.103 2.452 14.656 1.00 0.00 H new ATOM 0 HA LYS A 53 -9.433 3.357 16.980 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -7.118 2.515 16.934 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -6.624 3.864 15.930 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -7.122 5.443 17.755 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -7.713 4.133 18.757 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -5.467 3.061 18.694 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -4.872 4.355 17.673 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.381 6.007 19.467 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.981 4.716 20.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -3.708 5.284 21.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.781 3.695 20.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.200 4.947 19.454 1.00 0.00 H new ATOM 873 N TYR A 54 -8.444 5.734 14.900 1.00 0.00 N ATOM 874 CA TYR A 54 -8.502 7.170 14.634 1.00 0.00 C ATOM 875 C TYR A 54 -9.581 7.503 13.612 1.00 0.00 C ATOM 876 O TYR A 54 -9.931 8.669 13.432 1.00 0.00 O ATOM 877 CB TYR A 54 -7.142 7.681 14.152 1.00 0.00 C ATOM 878 CG TYR A 54 -6.040 7.546 15.179 1.00 0.00 C ATOM 879 CD1 TYR A 54 -5.026 6.618 14.990 1.00 0.00 C ATOM 880 CD2 TYR A 54 -6.043 8.350 16.309 1.00 0.00 C ATOM 881 CE1 TYR A 54 -4.019 6.495 15.928 1.00 0.00 C ATOM 882 CE2 TYR A 54 -5.037 8.226 17.247 1.00 0.00 C ATOM 883 CZ TYR A 54 -4.028 7.303 17.059 1.00 0.00 C ATOM 884 OH TYR A 54 -3.025 7.181 17.994 1.00 0.00 O ATOM 0 H TYR A 54 -7.898 5.203 14.221 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.757 7.670 15.568 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.857 7.135 13.253 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.237 8.730 13.871 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -5.024 5.992 14.110 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -6.832 9.073 16.455 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -3.228 5.774 15.783 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -5.040 8.851 18.128 1.00 0.00 H new ATOM 0 HH TYR A 54 -3.178 7.818 18.723 1.00 0.00 H new ATOM 894 N VAL A 55 -10.101 6.479 12.940 1.00 0.00 N ATOM 895 CA VAL A 55 -11.111 6.675 11.892 1.00 0.00 C ATOM 896 C VAL A 55 -12.220 5.629 12.009 1.00 0.00 C ATOM 897 O VAL A 55 -11.954 4.428 12.049 1.00 0.00 O ATOM 898 CB VAL A 55 -10.467 6.586 10.496 1.00 0.00 C ATOM 899 CG1 VAL A 55 -11.503 6.846 9.413 1.00 0.00 C ATOM 900 CG2 VAL A 55 -9.318 7.577 10.392 1.00 0.00 C ATOM 0 H VAL A 55 -9.843 5.505 13.099 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.542 7.667 12.024 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.074 5.580 10.352 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -11.030 6.779 8.433 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.298 6.103 9.484 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -11.925 7.842 9.545 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.867 7.509 9.402 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -9.694 8.588 10.551 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -8.568 7.346 11.149 1.00 0.00 H new ATOM 910 N ASN A 56 -13.465 6.098 12.086 1.00 0.00 N ATOM 911 CA ASN A 56 -14.620 5.208 12.237 1.00 0.00 C ATOM 912 C ASN A 56 -14.907 4.447 10.950 1.00 0.00 C ATOM 913 O ASN A 56 -15.773 4.836 10.175 1.00 0.00 O ATOM 914 CB ASN A 56 -15.845 5.989 12.674 1.00 0.00 C ATOM 915 CG ASN A 56 -17.010 5.098 13.007 1.00 0.00 C ATOM 916 OD1 ASN A 56 -16.934 3.873 12.854 1.00 0.00 O ATOM 917 ND2 ASN A 56 -18.087 5.689 13.460 1.00 0.00 N ATOM 0 H ASN A 56 -13.702 7.089 12.046 1.00 0.00 H new ATOM 0 HA ASN A 56 -14.376 4.479 13.010 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -15.594 6.594 13.545 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -16.134 6.678 11.880 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -18.909 5.135 13.703 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -18.104 6.703 13.570 1.00 0.00 H new ATOM 924 N VAL A 57 -14.187 3.351 10.736 1.00 0.00 N ATOM 925 CA VAL A 57 -14.419 2.506 9.563 1.00 0.00 C ATOM 926 C VAL A 57 -15.078 1.196 9.977 1.00 0.00 C ATOM 927 O VAL A 57 -14.547 0.453 10.802 1.00 0.00 O ATOM 928 CB VAL A 57 -13.093 2.207 8.838 1.00 0.00 C ATOM 929 CG1 VAL A 57 -13.335 1.299 7.641 1.00 0.00 C ATOM 930 CG2 VAL A 57 -12.435 3.508 8.405 1.00 0.00 C ATOM 0 H VAL A 57 -13.442 3.026 11.353 1.00 0.00 H new ATOM 0 HA VAL A 57 -15.081 3.044 8.884 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.422 1.690 9.524 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.388 1.098 7.140 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -13.774 0.360 7.979 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -14.017 1.788 6.945 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.498 3.289 7.893 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -13.101 4.045 7.729 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -12.234 4.124 9.282 1.00 0.00 H new ATOM 940 N SER A 58 -16.237 0.917 9.390 1.00 0.00 N ATOM 941 CA SER A 58 -16.933 -0.339 9.645 1.00 0.00 C ATOM 942 C SER A 58 -16.258 -1.460 8.871 1.00 0.00 C ATOM 943 O SER A 58 -15.706 -1.226 7.803 1.00 0.00 O ATOM 944 CB SER A 58 -18.391 -0.231 9.247 1.00 0.00 C ATOM 945 OG SER A 58 -19.033 -1.473 9.349 1.00 0.00 O ATOM 0 H SER A 58 -16.712 1.540 8.737 1.00 0.00 H new ATOM 0 HA SER A 58 -16.887 -0.559 10.712 1.00 0.00 H new ATOM 0 HB2 SER A 58 -18.893 0.495 9.886 1.00 0.00 H new ATOM 0 HB3 SER A 58 -18.466 0.138 8.224 1.00 0.00 H new ATOM 0 HG SER A 58 -19.973 -1.378 9.089 1.00 0.00 H new ATOM 951 N LEU A 59 -16.309 -2.673 9.408 1.00 0.00 N ATOM 952 CA LEU A 59 -15.732 -3.834 8.734 1.00 0.00 C ATOM 953 C LEU A 59 -16.391 -4.047 7.366 1.00 0.00 C ATOM 954 O LEU A 59 -15.758 -4.541 6.435 1.00 0.00 O ATOM 955 CB LEU A 59 -15.902 -5.090 9.598 1.00 0.00 C ATOM 956 CG LEU A 59 -15.095 -5.114 10.903 1.00 0.00 C ATOM 957 CD1 LEU A 59 -15.493 -6.331 11.725 1.00 0.00 C ATOM 958 CD2 LEU A 59 -13.609 -5.135 10.581 1.00 0.00 C ATOM 0 H LEU A 59 -16.743 -2.880 10.307 1.00 0.00 H new ATOM 0 HA LEU A 59 -14.668 -3.648 8.584 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -16.958 -5.200 9.843 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -15.621 -5.959 9.003 1.00 0.00 H new ATOM 0 HG LEU A 59 -15.308 -4.219 11.488 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -14.919 -6.348 12.652 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -16.557 -6.281 11.957 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -15.288 -7.238 11.155 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -13.036 -5.152 11.508 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -13.376 -6.024 9.994 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -13.348 -4.244 10.009 1.00 0.00 H new ATOM 970 N ASP A 60 -17.660 -3.665 7.260 1.00 0.00 N ATOM 971 CA ASP A 60 -18.393 -3.809 6.008 1.00 0.00 C ATOM 972 C ASP A 60 -17.795 -2.918 4.917 1.00 0.00 C ATOM 973 O ASP A 60 -18.038 -3.144 3.729 1.00 0.00 O ATOM 974 CB ASP A 60 -19.870 -3.464 6.209 1.00 0.00 C ATOM 975 CG ASP A 60 -20.619 -4.513 7.019 1.00 0.00 C ATOM 976 OD1 ASP A 60 -20.102 -5.594 7.177 1.00 0.00 O ATOM 977 OD2 ASP A 60 -21.700 -4.223 7.473 1.00 0.00 O ATOM 0 H ASP A 60 -18.200 -3.255 8.022 1.00 0.00 H new ATOM 0 HA ASP A 60 -18.311 -4.848 5.690 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -19.947 -2.500 6.712 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -20.348 -3.355 5.236 1.00 0.00 H new ATOM 982 N ASN A 61 -17.014 -1.906 5.315 1.00 0.00 N ATOM 983 CA ASN A 61 -16.409 -0.971 4.358 1.00 0.00 C ATOM 984 C ASN A 61 -14.946 -1.331 4.098 1.00 0.00 C ATOM 985 O ASN A 61 -14.228 -0.589 3.434 1.00 0.00 O ATOM 986 CB ASN A 61 -16.488 0.447 4.928 1.00 0.00 C ATOM 987 CG ASN A 61 -17.942 0.902 4.968 1.00 0.00 C ATOM 988 OD1 ASN A 61 -18.727 0.550 4.087 1.00 0.00 O ATOM 989 ND2 ASN A 61 -18.352 1.664 5.943 1.00 0.00 N ATOM 0 H ASN A 61 -16.787 -1.714 6.291 1.00 0.00 H new ATOM 0 HA ASN A 61 -16.953 -1.031 3.416 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -16.061 0.471 5.931 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -15.900 1.130 4.315 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -19.325 1.970 5.977 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -17.700 1.955 6.672 1.00 0.00 H new ATOM 996 N ILE A 62 -14.511 -2.478 4.627 1.00 0.00 N ATOM 997 CA ILE A 62 -13.128 -2.934 4.446 1.00 0.00 C ATOM 998 C ILE A 62 -13.072 -4.161 3.539 1.00 0.00 C ATOM 999 O ILE A 62 -13.448 -5.262 3.941 1.00 0.00 O ATOM 1000 CB ILE A 62 -12.473 -3.266 5.800 1.00 0.00 C ATOM 1001 CG1 ILE A 62 -12.467 -2.033 6.707 1.00 0.00 C ATOM 1002 CG2 ILE A 62 -11.059 -3.786 5.594 1.00 0.00 C ATOM 1003 CD1 ILE A 62 -11.983 -2.311 8.112 1.00 0.00 C ATOM 0 H ILE A 62 -15.093 -3.106 5.182 1.00 0.00 H new ATOM 0 HA ILE A 62 -12.576 -2.120 3.977 1.00 0.00 H new ATOM 0 HB ILE A 62 -13.058 -4.047 6.285 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -11.833 -1.267 6.259 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -13.476 -1.624 6.755 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -10.611 -4.016 6.561 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -11.089 -4.689 4.984 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.462 -3.027 5.089 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -12.007 -1.390 8.694 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -12.630 -3.053 8.580 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -10.962 -2.691 8.077 1.00 0.00 H new ATOM 1015 N ARG A 63 -12.566 -3.962 2.327 1.00 0.00 N ATOM 1016 CA ARG A 63 -12.370 -5.066 1.393 1.00 0.00 C ATOM 1017 C ARG A 63 -10.911 -5.504 1.426 1.00 0.00 C ATOM 1018 O ARG A 63 -10.005 -4.693 1.256 1.00 0.00 O ATOM 1019 CB ARG A 63 -12.755 -4.662 -0.022 1.00 0.00 C ATOM 1020 CG ARG A 63 -12.570 -5.748 -1.070 1.00 0.00 C ATOM 1021 CD ARG A 63 -13.006 -5.293 -2.415 1.00 0.00 C ATOM 1022 NE ARG A 63 -12.782 -6.310 -3.430 1.00 0.00 N ATOM 1023 CZ ARG A 63 -13.098 -6.174 -4.733 1.00 0.00 C ATOM 1024 NH1 ARG A 63 -13.650 -5.061 -5.162 1.00 0.00 N ATOM 1025 NH2 ARG A 63 -12.854 -7.160 -5.579 1.00 0.00 N ATOM 0 H ARG A 63 -12.285 -3.050 1.968 1.00 0.00 H new ATOM 0 HA ARG A 63 -13.012 -5.893 1.695 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -13.799 -4.350 -0.024 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -12.162 -3.794 -0.311 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -11.521 -6.043 -1.108 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -13.139 -6.632 -0.783 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -14.065 -5.036 -2.386 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -12.465 -4.386 -2.684 1.00 0.00 H new ATOM 0 HE ARG A 63 -12.356 -7.188 -3.135 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -13.839 -4.301 -4.509 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -13.889 -4.958 -6.148 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -12.426 -8.024 -5.246 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -13.093 -7.057 -6.565 1.00 0.00 H new ATOM 1039 N ILE A 64 -10.697 -6.797 1.658 1.00 0.00 N ATOM 1040 CA ILE A 64 -9.350 -7.365 1.722 1.00 0.00 C ATOM 1041 C ILE A 64 -9.173 -8.431 0.658 1.00 0.00 C ATOM 1042 O ILE A 64 -9.897 -9.426 0.630 1.00 0.00 O ATOM 1043 CB ILE A 64 -9.063 -7.972 3.108 1.00 0.00 C ATOM 1044 CG1 ILE A 64 -9.197 -6.903 4.195 1.00 0.00 C ATOM 1045 CG2 ILE A 64 -7.677 -8.597 3.138 1.00 0.00 C ATOM 1046 CD1 ILE A 64 -9.149 -7.453 5.602 1.00 0.00 C ATOM 0 H ILE A 64 -11.444 -7.476 1.806 1.00 0.00 H new ATOM 0 HA ILE A 64 -8.644 -6.554 1.545 1.00 0.00 H new ATOM 0 HB ILE A 64 -9.796 -8.755 3.303 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -8.397 -6.172 4.073 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -10.138 -6.372 4.055 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -7.490 -9.021 4.125 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -7.617 -9.385 2.387 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -6.929 -7.834 2.924 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -9.250 -6.636 6.316 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -9.965 -8.162 5.744 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -8.197 -7.959 5.763 1.00 0.00 H new ATOM 1058 N SER A 65 -8.193 -8.219 -0.209 1.00 0.00 N ATOM 1059 CA SER A 65 -7.898 -9.175 -1.264 1.00 0.00 C ATOM 1060 C SER A 65 -6.406 -9.479 -1.299 1.00 0.00 C ATOM 1061 O SER A 65 -5.606 -8.664 -1.763 1.00 0.00 O ATOM 1062 CB SER A 65 -8.353 -8.637 -2.607 1.00 0.00 C ATOM 1063 OG SER A 65 -8.037 -9.529 -3.639 1.00 0.00 O ATOM 0 H SER A 65 -7.591 -7.396 -0.202 1.00 0.00 H new ATOM 0 HA SER A 65 -8.439 -10.098 -1.056 1.00 0.00 H new ATOM 0 HB2 SER A 65 -9.429 -8.464 -2.588 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.879 -7.674 -2.796 1.00 0.00 H new ATOM 0 HG SER A 65 -8.342 -9.161 -4.495 1.00 0.00 H new ATOM 1069 N GLN A 66 -6.037 -10.656 -0.799 1.00 0.00 N ATOM 1070 CA GLN A 66 -4.640 -11.073 -0.786 1.00 0.00 C ATOM 1071 C GLN A 66 -4.385 -12.097 -1.883 1.00 0.00 C ATOM 1072 O GLN A 66 -4.914 -13.207 -1.846 1.00 0.00 O ATOM 1073 CB GLN A 66 -4.258 -11.656 0.578 1.00 0.00 C ATOM 1074 CG GLN A 66 -2.795 -12.045 0.701 1.00 0.00 C ATOM 1075 CD GLN A 66 -2.453 -12.579 2.079 1.00 0.00 C ATOM 1076 OE1 GLN A 66 -3.151 -12.303 3.059 1.00 0.00 O ATOM 1077 NE2 GLN A 66 -1.374 -13.349 2.163 1.00 0.00 N ATOM 0 H GLN A 66 -6.685 -11.335 -0.399 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.021 -10.195 -0.970 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.494 -10.926 1.352 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.873 -12.535 0.770 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -2.559 -12.801 -0.048 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -2.172 -11.177 0.486 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -0.826 -13.552 1.327 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -1.094 -13.738 3.063 1.00 0.00 H new ATOM 1086 N GLU A 67 -3.555 -11.719 -2.853 1.00 0.00 N ATOM 1087 CA GLU A 67 -3.251 -12.597 -3.982 1.00 0.00 C ATOM 1088 C GLU A 67 -1.751 -12.870 -4.047 1.00 0.00 C ATOM 1089 O GLU A 67 -0.987 -12.383 -3.216 1.00 0.00 O ATOM 1090 CB GLU A 67 -3.729 -11.975 -5.296 1.00 0.00 C ATOM 1091 CG GLU A 67 -5.232 -11.752 -5.375 1.00 0.00 C ATOM 1092 CD GLU A 67 -6.011 -13.036 -5.440 1.00 0.00 C ATOM 1093 OE1 GLU A 67 -5.441 -14.038 -5.799 1.00 0.00 O ATOM 1094 OE2 GLU A 67 -7.179 -13.015 -5.129 1.00 0.00 O ATOM 0 H GLU A 67 -3.083 -10.815 -2.881 1.00 0.00 H new ATOM 0 HA GLU A 67 -3.778 -13.540 -3.835 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.224 -11.019 -5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.426 -12.620 -6.121 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.556 -11.180 -4.505 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.459 -11.150 -6.255 1.00 0.00 H new ATOM 1101 N LYS A 68 -1.337 -13.654 -5.042 1.00 0.00 N ATOM 1102 CA LYS A 68 0.081 -13.966 -5.234 1.00 0.00 C ATOM 1103 C LYS A 68 0.544 -13.529 -6.617 1.00 0.00 C ATOM 1104 O LYS A 68 -0.240 -13.513 -7.567 1.00 0.00 O ATOM 1105 CB LYS A 68 0.338 -15.461 -5.041 1.00 0.00 C ATOM 1106 CG LYS A 68 -0.373 -16.358 -6.047 1.00 0.00 C ATOM 1107 CD LYS A 68 -0.103 -17.828 -5.763 1.00 0.00 C ATOM 1108 CE LYS A 68 -0.765 -18.723 -6.802 1.00 0.00 C ATOM 1109 NZ LYS A 68 -0.517 -20.165 -6.532 1.00 0.00 N ATOM 0 H LYS A 68 -1.960 -14.084 -5.726 1.00 0.00 H new ATOM 0 HA LYS A 68 0.652 -13.417 -4.485 1.00 0.00 H new ATOM 0 HB2 LYS A 68 1.411 -15.644 -5.104 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.025 -15.744 -4.036 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -1.446 -16.169 -6.011 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -0.040 -16.113 -7.055 1.00 0.00 H new ATOM 0 HD2 LYS A 68 0.972 -18.008 -5.757 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -0.474 -18.083 -4.771 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -1.839 -18.535 -6.812 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -0.388 -18.469 -7.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.984 -20.740 -7.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 0.506 -20.350 -6.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.899 -20.414 -5.597 1.00 0.00 H new ATOM 1123 N GLN A 69 1.819 -13.170 -6.725 1.00 0.00 N ATOM 1124 CA GLN A 69 2.382 -12.767 -8.005 1.00 0.00 C ATOM 1125 C GLN A 69 3.785 -13.341 -8.173 1.00 0.00 C ATOM 1126 O GLN A 69 4.759 -12.787 -7.663 1.00 0.00 O ATOM 1127 CB GLN A 69 2.417 -11.240 -8.122 1.00 0.00 C ATOM 1128 CG GLN A 69 2.987 -10.730 -9.434 1.00 0.00 C ATOM 1129 CD GLN A 69 2.062 -10.989 -10.607 1.00 0.00 C ATOM 1130 OE1 GLN A 69 0.870 -10.671 -10.558 1.00 0.00 O ATOM 1131 NE2 GLN A 69 2.604 -11.570 -11.671 1.00 0.00 N ATOM 0 H GLN A 69 2.477 -13.150 -5.946 1.00 0.00 H new ATOM 0 HA GLN A 69 1.746 -13.160 -8.798 1.00 0.00 H new ATOM 0 HB2 GLN A 69 1.404 -10.854 -8.004 1.00 0.00 H new ATOM 0 HB3 GLN A 69 3.009 -10.837 -7.300 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.175 -9.659 -9.353 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.948 -11.210 -9.620 1.00 0.00 H new ATOM 0 HE21 GLN A 69 3.594 -11.816 -11.669 1.00 0.00 H new ATOM 0 HE22 GLN A 69 2.030 -11.770 -12.490 1.00 0.00 H new ATOM 1140 N ASP A 70 3.879 -14.456 -8.890 1.00 0.00 N ATOM 1141 CA ASP A 70 5.173 -15.064 -9.178 1.00 0.00 C ATOM 1142 C ASP A 70 5.924 -15.379 -7.879 1.00 0.00 C ATOM 1143 O ASP A 70 5.538 -16.279 -7.135 1.00 0.00 O ATOM 1144 CB ASP A 70 6.016 -14.138 -10.059 1.00 0.00 C ATOM 1145 CG ASP A 70 5.378 -13.868 -11.415 1.00 0.00 C ATOM 1146 OD1 ASP A 70 4.877 -14.792 -12.009 1.00 0.00 O ATOM 1147 OD2 ASP A 70 5.399 -12.739 -11.844 1.00 0.00 O ATOM 0 H ASP A 70 3.079 -14.955 -9.280 1.00 0.00 H new ATOM 0 HA ASP A 70 4.998 -15.997 -9.714 1.00 0.00 H new ATOM 0 HB2 ASP A 70 6.169 -13.192 -9.540 1.00 0.00 H new ATOM 0 HB3 ASP A 70 7.000 -14.583 -10.208 1.00 0.00 H new ATOM 1152 N GLY A 71 7.000 -14.632 -7.615 1.00 0.00 N ATOM 1153 CA GLY A 71 7.869 -14.905 -6.465 1.00 0.00 C ATOM 1154 C GLY A 71 7.618 -13.903 -5.341 1.00 0.00 C ATOM 1155 O GLY A 71 8.490 -13.664 -4.504 1.00 0.00 O ATOM 0 H GLY A 71 7.290 -13.835 -8.181 1.00 0.00 H new ATOM 0 HA2 GLY A 71 7.690 -15.917 -6.102 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.913 -14.857 -6.774 1.00 0.00 H new ATOM 1159 N MET A 72 6.419 -13.318 -5.334 1.00 0.00 N ATOM 1160 CA MET A 72 6.012 -12.408 -4.259 1.00 0.00 C ATOM 1161 C MET A 72 4.507 -12.476 -4.043 1.00 0.00 C ATOM 1162 O MET A 72 3.775 -13.036 -4.857 1.00 0.00 O ATOM 1163 CB MET A 72 6.442 -10.978 -4.577 1.00 0.00 C ATOM 1164 CG MET A 72 5.750 -10.366 -5.787 1.00 0.00 C ATOM 1165 SD MET A 72 6.364 -8.716 -6.180 1.00 0.00 S ATOM 1166 CE MET A 72 7.974 -9.109 -6.860 1.00 0.00 C ATOM 0 H MET A 72 5.714 -13.457 -6.058 1.00 0.00 H new ATOM 0 HA MET A 72 6.506 -12.720 -3.339 1.00 0.00 H new ATOM 0 HB2 MET A 72 6.247 -10.351 -3.707 1.00 0.00 H new ATOM 0 HB3 MET A 72 7.519 -10.964 -4.745 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.892 -11.017 -6.650 1.00 0.00 H new ATOM 0 HG3 MET A 72 4.677 -10.315 -5.600 1.00 0.00 H new ATOM 0 HE1 MET A 72 8.273 -8.329 -7.561 1.00 0.00 H new ATOM 0 HE2 MET A 72 8.704 -9.172 -6.053 1.00 0.00 H new ATOM 0 HE3 MET A 72 7.926 -10.065 -7.381 1.00 0.00 H new ATOM 1176 N ASP A 73 4.052 -11.895 -2.935 1.00 0.00 N ATOM 1177 CA ASP A 73 2.621 -11.740 -2.674 1.00 0.00 C ATOM 1178 C ASP A 73 2.193 -10.311 -2.978 1.00 0.00 C ATOM 1179 O ASP A 73 3.031 -9.413 -3.087 1.00 0.00 O ATOM 1180 CB ASP A 73 2.287 -12.087 -1.222 1.00 0.00 C ATOM 1181 CG ASP A 73 2.452 -13.570 -0.914 1.00 0.00 C ATOM 1182 OD1 ASP A 73 2.434 -14.353 -1.834 1.00 0.00 O ATOM 1183 OD2 ASP A 73 2.593 -13.904 0.237 1.00 0.00 O ATOM 0 H ASP A 73 4.655 -11.523 -2.201 1.00 0.00 H new ATOM 0 HA ASP A 73 2.078 -12.428 -3.322 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.931 -11.509 -0.558 1.00 0.00 H new ATOM 0 HB3 ASP A 73 1.260 -11.789 -1.009 1.00 0.00 H new ATOM 1188 N VAL A 74 0.887 -10.097 -3.107 1.00 0.00 N ATOM 1189 CA VAL A 74 0.343 -8.749 -3.251 1.00 0.00 C ATOM 1190 C VAL A 74 -0.963 -8.616 -2.483 1.00 0.00 C ATOM 1191 O VAL A 74 -1.858 -9.452 -2.620 1.00 0.00 O ATOM 1192 CB VAL A 74 0.100 -8.418 -4.735 1.00 0.00 C ATOM 1193 CG1 VAL A 74 -0.870 -9.415 -5.351 1.00 0.00 C ATOM 1194 CG2 VAL A 74 -0.427 -6.998 -4.870 1.00 0.00 C ATOM 0 H VAL A 74 0.186 -10.838 -3.115 1.00 0.00 H new ATOM 0 HA VAL A 74 1.071 -8.048 -2.844 1.00 0.00 H new ATOM 0 HB VAL A 74 1.045 -8.491 -5.273 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.030 -9.166 -6.400 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.455 -10.420 -5.276 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.820 -9.374 -4.819 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.596 -6.771 -5.923 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.365 -6.905 -4.323 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.302 -6.299 -4.461 1.00 0.00 H new ATOM 1204 N LEU A 75 -1.070 -7.568 -1.662 1.00 0.00 N ATOM 1205 CA LEU A 75 -2.278 -7.350 -0.857 1.00 0.00 C ATOM 1206 C LEU A 75 -2.945 -6.040 -1.261 1.00 0.00 C ATOM 1207 O LEU A 75 -2.333 -4.972 -1.214 1.00 0.00 O ATOM 1208 CB LEU A 75 -1.933 -7.323 0.638 1.00 0.00 C ATOM 1209 CG LEU A 75 -3.087 -6.954 1.579 1.00 0.00 C ATOM 1210 CD1 LEU A 75 -4.165 -8.027 1.506 1.00 0.00 C ATOM 1211 CD2 LEU A 75 -2.558 -6.807 2.998 1.00 0.00 C ATOM 0 H LEU A 75 -0.344 -6.863 -1.537 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.968 -8.174 -1.039 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.556 -8.305 0.923 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.121 -6.612 0.792 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.526 -6.004 1.275 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.985 -7.765 2.175 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.538 -8.099 0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.744 -8.987 1.807 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.378 -6.545 3.667 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.114 -7.749 3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.802 -6.022 3.025 1.00 0.00 H new ATOM 1223 N GLU A 76 -4.214 -6.143 -1.646 1.00 0.00 N ATOM 1224 CA GLU A 76 -4.989 -4.975 -2.046 1.00 0.00 C ATOM 1225 C GLU A 76 -6.055 -4.696 -0.997 1.00 0.00 C ATOM 1226 O GLU A 76 -6.872 -5.567 -0.680 1.00 0.00 O ATOM 1227 CB GLU A 76 -5.637 -5.190 -3.415 1.00 0.00 C ATOM 1228 CG GLU A 76 -6.440 -4.002 -3.924 1.00 0.00 C ATOM 1229 CD GLU A 76 -6.999 -4.219 -5.303 1.00 0.00 C ATOM 1230 OE1 GLU A 76 -6.682 -5.220 -5.900 1.00 0.00 O ATOM 1231 OE2 GLU A 76 -7.742 -3.385 -5.760 1.00 0.00 O ATOM 0 H GLU A 76 -4.726 -7.024 -1.689 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.320 -4.118 -2.124 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -4.857 -5.423 -4.140 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -6.292 -6.059 -3.361 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -7.259 -3.801 -3.233 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.804 -3.117 -3.931 1.00 0.00 H new ATOM 1238 N LEU A 77 -6.031 -3.481 -0.450 1.00 0.00 N ATOM 1239 CA LEU A 77 -7.050 -3.042 0.504 1.00 0.00 C ATOM 1240 C LEU A 77 -7.866 -1.907 -0.095 1.00 0.00 C ATOM 1241 O LEU A 77 -7.319 -1.003 -0.726 1.00 0.00 O ATOM 1242 CB LEU A 77 -6.401 -2.584 1.817 1.00 0.00 C ATOM 1243 CG LEU A 77 -5.465 -3.598 2.486 1.00 0.00 C ATOM 1244 CD1 LEU A 77 -4.803 -2.955 3.697 1.00 0.00 C ATOM 1245 CD2 LEU A 77 -6.256 -4.834 2.885 1.00 0.00 C ATOM 0 H LEU A 77 -5.316 -2.782 -0.651 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.709 -3.884 0.719 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -5.838 -1.671 1.623 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.192 -2.328 2.522 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.684 -3.902 1.789 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.138 -3.675 4.173 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.228 -2.085 3.379 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.569 -2.644 4.408 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.590 -5.554 3.360 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.044 -4.552 3.584 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.702 -5.283 1.997 1.00 0.00 H new ATOM 1257 N ASN A 78 -9.182 -1.956 0.117 1.00 0.00 N ATOM 1258 CA ASN A 78 -10.082 -0.922 -0.385 1.00 0.00 C ATOM 1259 C ASN A 78 -11.009 -0.457 0.731 1.00 0.00 C ATOM 1260 O ASN A 78 -11.891 -1.200 1.159 1.00 0.00 O ATOM 1261 CB ASN A 78 -10.877 -1.421 -1.577 1.00 0.00 C ATOM 1262 CG ASN A 78 -11.697 -0.337 -2.219 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -12.334 0.467 -1.530 1.00 0.00 O ATOM 1264 ND2 ASN A 78 -11.696 -0.301 -3.527 1.00 0.00 N ATOM 0 H ASN A 78 -9.647 -2.703 0.634 1.00 0.00 H new ATOM 0 HA ASN A 78 -9.485 -0.075 -0.722 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -10.193 -1.840 -2.315 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -11.535 -2.229 -1.258 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -12.236 0.411 -4.018 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -11.155 -0.985 -4.056 1.00 0.00 H new ATOM 1271 N ILE A 79 -10.804 0.766 1.214 1.00 0.00 N ATOM 1272 CA ILE A 79 -11.540 1.273 2.374 1.00 0.00 C ATOM 1273 C ILE A 79 -12.556 2.318 1.931 1.00 0.00 C ATOM 1274 O ILE A 79 -12.207 3.280 1.256 1.00 0.00 O ATOM 1275 CB ILE A 79 -10.587 1.886 3.417 1.00 0.00 C ATOM 1276 CG1 ILE A 79 -9.455 0.907 3.744 1.00 0.00 C ATOM 1277 CG2 ILE A 79 -11.350 2.262 4.678 1.00 0.00 C ATOM 1278 CD1 ILE A 79 -9.930 -0.404 4.327 1.00 0.00 C ATOM 0 H ILE A 79 -10.134 1.427 0.821 1.00 0.00 H new ATOM 0 HA ILE A 79 -12.058 0.432 2.836 1.00 0.00 H new ATOM 0 HB ILE A 79 -10.149 2.792 2.998 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -8.888 0.705 2.835 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.771 1.380 4.448 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -10.662 2.694 5.405 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -12.122 2.991 4.432 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -11.814 1.371 5.102 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.071 -1.043 4.532 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.471 -0.215 5.254 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -10.591 -0.900 3.616 1.00 0.00 H new ATOM 1290 N THR A 80 -13.815 2.138 2.324 1.00 0.00 N ATOM 1291 CA THR A 80 -14.836 3.155 2.080 1.00 0.00 C ATOM 1292 C THR A 80 -15.081 3.930 3.367 1.00 0.00 C ATOM 1293 O THR A 80 -15.292 3.334 4.425 1.00 0.00 O ATOM 1294 CB THR A 80 -16.153 2.535 1.578 1.00 0.00 C ATOM 1295 OG1 THR A 80 -15.922 1.855 0.337 1.00 0.00 O ATOM 1296 CG2 THR A 80 -17.206 3.612 1.372 1.00 0.00 C ATOM 0 H THR A 80 -14.151 1.306 2.808 1.00 0.00 H new ATOM 0 HA THR A 80 -14.475 3.825 1.300 1.00 0.00 H new ATOM 0 HB THR A 80 -16.512 1.829 2.327 1.00 0.00 H new ATOM 0 HG1 THR A 80 -16.761 1.460 0.020 1.00 0.00 H new ATOM 0 HG21 THR A 80 -18.130 3.155 1.017 1.00 0.00 H new ATOM 0 HG22 THR A 80 -17.394 4.123 2.316 1.00 0.00 H new ATOM 0 HG23 THR A 80 -16.851 4.332 0.634 1.00 0.00 H new ATOM 1304 N LEU A 81 -15.038 5.253 3.289 1.00 0.00 N ATOM 1305 CA LEU A 81 -15.286 6.075 4.464 1.00 0.00 C ATOM 1306 C LEU A 81 -16.291 7.190 4.129 1.00 0.00 C ATOM 1307 O LEU A 81 -16.024 8.002 3.226 1.00 0.00 O ATOM 1308 CB LEU A 81 -13.973 6.680 4.975 1.00 0.00 C ATOM 1309 CG LEU A 81 -14.103 7.651 6.156 1.00 0.00 C ATOM 1310 CD1 LEU A 81 -14.591 6.896 7.384 1.00 0.00 C ATOM 1311 CD2 LEU A 81 -12.758 8.313 6.419 1.00 0.00 C ATOM 1312 OXT LEU A 81 -17.321 7.272 4.738 1.00 0.00 O ATOM 0 H LEU A 81 -14.836 5.774 2.436 1.00 0.00 H new ATOM 0 HA LEU A 81 -15.709 5.447 5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -13.310 5.867 5.269 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.490 7.203 4.150 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.829 8.429 5.921 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -14.683 7.586 8.223 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -15.562 6.449 7.174 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -13.877 6.112 7.636 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -12.850 9.003 7.258 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -12.017 7.550 6.656 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -12.443 8.861 5.531 1.00 0.00 H new TER 1324 LEU A 81 ATOM 1325 N MET B 1 -1.742 -7.468 -16.071 1.00 0.00 N ATOM 1326 CA MET B 1 -3.141 -7.466 -15.559 1.00 0.00 C ATOM 1327 C MET B 1 -3.172 -6.806 -14.183 1.00 0.00 C ATOM 1328 O MET B 1 -4.076 -6.030 -13.877 1.00 0.00 O ATOM 1329 CB MET B 1 -3.703 -8.884 -15.485 1.00 0.00 C ATOM 1330 CG MET B 1 -3.908 -9.551 -16.838 1.00 0.00 C ATOM 1331 SD MET B 1 -5.039 -8.634 -17.902 1.00 0.00 S ATOM 1332 CE MET B 1 -6.585 -8.861 -17.027 1.00 0.00 C ATOM 0 H1 MET B 1 -1.749 -7.626 -17.099 1.00 0.00 H new ATOM 0 H2 MET B 1 -1.295 -6.552 -15.864 1.00 0.00 H new ATOM 0 H3 MET B 1 -1.204 -8.228 -15.608 1.00 0.00 H new ATOM 0 HA MET B 1 -3.767 -6.900 -16.249 1.00 0.00 H new ATOM 0 HB2 MET B 1 -3.028 -9.499 -14.889 1.00 0.00 H new ATOM 0 HB3 MET B 1 -4.657 -8.857 -14.959 1.00 0.00 H new ATOM 0 HG2 MET B 1 -2.945 -9.651 -17.339 1.00 0.00 H new ATOM 0 HG3 MET B 1 -4.295 -10.559 -16.687 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.414 -8.573 -17.673 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.692 -9.908 -16.743 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.591 -8.240 -16.131 1.00 0.00 H new ATOM 1344 N SER B 2 -2.178 -7.123 -13.358 1.00 0.00 N ATOM 1345 CA SER B 2 -2.113 -6.563 -12.014 1.00 0.00 C ATOM 1346 C SER B 2 -1.314 -5.263 -12.009 1.00 0.00 C ATOM 1347 O SER B 2 -0.480 -5.033 -12.886 1.00 0.00 O ATOM 1348 CB SER B 2 -1.483 -7.562 -11.061 1.00 0.00 C ATOM 1349 OG SER B 2 -1.258 -6.983 -9.805 1.00 0.00 O ATOM 0 H SER B 2 -1.415 -7.758 -13.594 1.00 0.00 H new ATOM 0 HA SER B 2 -3.129 -6.346 -11.683 1.00 0.00 H new ATOM 0 HB2 SER B 2 -2.135 -8.429 -10.954 1.00 0.00 H new ATOM 0 HB3 SER B 2 -0.540 -7.920 -11.475 1.00 0.00 H new ATOM 0 HG SER B 2 -1.162 -7.689 -9.132 1.00 0.00 H new ATOM 1355 N LEU B 3 -1.576 -4.419 -11.018 1.00 0.00 N ATOM 1356 CA LEU B 3 -0.834 -3.173 -10.866 1.00 0.00 C ATOM 1357 C LEU B 3 0.647 -3.450 -10.628 1.00 0.00 C ATOM 1358 O LEU B 3 1.507 -2.671 -11.037 1.00 0.00 O ATOM 1359 CB LEU B 3 -1.405 -2.353 -9.702 1.00 0.00 C ATOM 1360 CG LEU B 3 -2.815 -1.789 -9.913 1.00 0.00 C ATOM 1361 CD1 LEU B 3 -3.302 -1.141 -8.625 1.00 0.00 C ATOM 1362 CD2 LEU B 3 -2.794 -0.785 -11.056 1.00 0.00 C ATOM 0 H LEU B 3 -2.294 -4.574 -10.310 1.00 0.00 H new ATOM 0 HA LEU B 3 -0.936 -2.602 -11.789 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -1.414 -2.980 -8.811 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -0.728 -1.523 -9.501 1.00 0.00 H new ATOM 0 HG LEU B 3 -3.503 -2.594 -10.174 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -4.304 -0.740 -8.776 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -3.325 -1.885 -7.829 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -2.626 -0.332 -8.346 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -3.796 -0.384 -11.206 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -2.110 0.028 -10.813 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -2.460 -1.279 -11.968 1.00 0.00 H new ATOM 1374 N ILE B 4 0.937 -4.563 -9.966 1.00 0.00 N ATOM 1375 CA ILE B 4 2.314 -4.922 -9.657 1.00 0.00 C ATOM 1376 C ILE B 4 3.023 -5.438 -10.902 1.00 0.00 C ATOM 1377 O ILE B 4 4.231 -5.250 -11.067 1.00 0.00 O ATOM 1378 CB ILE B 4 2.373 -5.989 -8.548 1.00 0.00 C ATOM 1379 CG1 ILE B 4 3.758 -6.004 -7.894 1.00 0.00 C ATOM 1380 CG2 ILE B 4 2.032 -7.360 -9.110 1.00 0.00 C ATOM 1381 CD1 ILE B 4 4.102 -4.726 -7.164 1.00 0.00 C ATOM 0 H ILE B 4 0.240 -5.230 -9.634 1.00 0.00 H new ATOM 0 HA ILE B 4 2.819 -4.024 -9.303 1.00 0.00 H new ATOM 0 HB ILE B 4 1.635 -5.738 -7.786 1.00 0.00 H new ATOM 0 HG12 ILE B 4 3.809 -6.837 -7.193 1.00 0.00 H new ATOM 0 HG13 ILE B 4 4.510 -6.187 -8.662 1.00 0.00 H new ATOM 0 HG21 ILE B 4 2.079 -8.102 -8.313 1.00 0.00 H new ATOM 0 HG22 ILE B 4 1.026 -7.341 -9.530 1.00 0.00 H new ATOM 0 HG23 ILE B 4 2.746 -7.621 -9.891 1.00 0.00 H new ATOM 0 HD11 ILE B 4 5.097 -4.813 -6.728 1.00 0.00 H new ATOM 0 HD12 ILE B 4 4.084 -3.891 -7.864 1.00 0.00 H new ATOM 0 HD13 ILE B 4 3.373 -4.551 -6.373 1.00 0.00 H new ATOM 1393 N GLU B 5 2.263 -6.072 -11.788 1.00 0.00 N ATOM 1394 CA GLU B 5 2.806 -6.481 -13.074 1.00 0.00 C ATOM 1395 C GLU B 5 3.128 -5.271 -13.936 1.00 0.00 C ATOM 1396 O GLU B 5 4.094 -5.281 -14.684 1.00 0.00 O ATOM 1397 CB GLU B 5 1.820 -7.396 -13.804 1.00 0.00 C ATOM 1398 CG GLU B 5 1.667 -8.777 -13.184 1.00 0.00 C ATOM 1399 CD GLU B 5 0.640 -9.623 -13.884 1.00 0.00 C ATOM 1400 OE1 GLU B 5 -0.292 -9.070 -14.419 1.00 0.00 O ATOM 1401 OE2 GLU B 5 0.787 -10.822 -13.885 1.00 0.00 O ATOM 0 H GLU B 5 1.282 -6.311 -11.641 1.00 0.00 H new ATOM 0 HA GLU B 5 3.729 -7.030 -12.891 1.00 0.00 H new ATOM 0 HB2 GLU B 5 0.844 -6.912 -13.828 1.00 0.00 H new ATOM 0 HB3 GLU B 5 2.146 -7.509 -14.838 1.00 0.00 H new ATOM 0 HG2 GLU B 5 2.629 -9.289 -13.208 1.00 0.00 H new ATOM 0 HG3 GLU B 5 1.389 -8.670 -12.136 1.00 0.00 H new ATOM 1408 N LEU B 6 2.303 -4.235 -13.840 1.00 0.00 N ATOM 1409 CA LEU B 6 2.593 -2.982 -14.531 1.00 0.00 C ATOM 1410 C LEU B 6 3.881 -2.346 -13.994 1.00 0.00 C ATOM 1411 O LEU B 6 4.688 -1.821 -14.760 1.00 0.00 O ATOM 1412 CB LEU B 6 1.421 -2.006 -14.369 1.00 0.00 C ATOM 1413 CG LEU B 6 0.128 -2.388 -15.102 1.00 0.00 C ATOM 1414 CD1 LEU B 6 -0.988 -1.436 -14.697 1.00 0.00 C ATOM 1415 CD2 LEU B 6 0.366 -2.345 -16.604 1.00 0.00 C ATOM 0 H LEU B 6 1.439 -4.235 -13.298 1.00 0.00 H new ATOM 0 HA LEU B 6 2.733 -3.202 -15.589 1.00 0.00 H new ATOM 0 HB2 LEU B 6 1.199 -1.908 -13.306 1.00 0.00 H new ATOM 0 HB3 LEU B 6 1.739 -1.024 -14.720 1.00 0.00 H new ATOM 0 HG LEU B 6 -0.170 -3.400 -14.829 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -1.906 -1.708 -15.218 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -1.149 -1.501 -13.621 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -0.710 -0.416 -14.961 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -0.552 -2.616 -17.126 1.00 0.00 H new ATOM 0 HD22 LEU B 6 0.666 -1.339 -16.896 1.00 0.00 H new ATOM 0 HD23 LEU B 6 1.155 -3.049 -16.868 1.00 0.00 H new ATOM 1427 N LEU B 7 4.050 -2.376 -12.679 1.00 0.00 N ATOM 1428 CA LEU B 7 5.260 -1.853 -12.051 1.00 0.00 C ATOM 1429 C LEU B 7 6.497 -2.581 -12.565 1.00 0.00 C ATOM 1430 O LEU B 7 7.511 -1.957 -12.872 1.00 0.00 O ATOM 1431 CB LEU B 7 5.172 -1.993 -10.526 1.00 0.00 C ATOM 1432 CG LEU B 7 6.393 -1.497 -9.741 1.00 0.00 C ATOM 1433 CD1 LEU B 7 6.607 -0.014 -10.016 1.00 0.00 C ATOM 1434 CD2 LEU B 7 6.180 -1.752 -8.256 1.00 0.00 C ATOM 0 H LEU B 7 3.366 -2.756 -12.025 1.00 0.00 H new ATOM 0 HA LEU B 7 5.345 -0.797 -12.309 1.00 0.00 H new ATOM 0 HB2 LEU B 7 4.294 -1.448 -10.180 1.00 0.00 H new ATOM 0 HB3 LEU B 7 5.010 -3.044 -10.285 1.00 0.00 H new ATOM 0 HG LEU B 7 7.284 -2.038 -10.059 1.00 0.00 H new ATOM 0 HD11 LEU B 7 7.475 0.338 -9.458 1.00 0.00 H new ATOM 0 HD12 LEU B 7 6.775 0.138 -11.082 1.00 0.00 H new ATOM 0 HD13 LEU B 7 5.724 0.545 -9.705 1.00 0.00 H new ATOM 0 HD21 LEU B 7 7.048 -1.400 -7.698 1.00 0.00 H new ATOM 0 HD22 LEU B 7 5.291 -1.219 -7.919 1.00 0.00 H new ATOM 0 HD23 LEU B 7 6.049 -2.821 -8.085 1.00 0.00 H new ATOM 1446 N PHE B 8 6.408 -3.906 -12.639 1.00 0.00 N ATOM 1447 CA PHE B 8 7.523 -4.727 -13.120 1.00 0.00 C ATOM 1448 C PHE B 8 7.330 -5.135 -14.575 1.00 0.00 C ATOM 1449 O PHE B 8 7.849 -6.161 -15.018 1.00 0.00 O ATOM 1450 CB PHE B 8 7.675 -5.980 -12.255 1.00 0.00 C ATOM 1451 CG PHE B 8 8.043 -5.690 -10.828 1.00 0.00 C ATOM 1452 CD1 PHE B 8 7.151 -5.950 -9.800 1.00 0.00 C ATOM 1453 CD2 PHE B 8 9.283 -5.156 -10.511 1.00 0.00 C ATOM 1454 CE1 PHE B 8 7.488 -5.684 -8.486 1.00 0.00 C ATOM 1455 CE2 PHE B 8 9.624 -4.890 -9.199 1.00 0.00 C ATOM 1456 CZ PHE B 8 8.724 -5.154 -8.186 1.00 0.00 C ATOM 0 H PHE B 8 5.578 -4.437 -12.373 1.00 0.00 H new ATOM 0 HA PHE B 8 8.427 -4.123 -13.049 1.00 0.00 H new ATOM 0 HB2 PHE B 8 6.739 -6.538 -12.273 1.00 0.00 H new ATOM 0 HB3 PHE B 8 8.438 -6.623 -12.694 1.00 0.00 H new ATOM 0 HD1 PHE B 8 6.181 -6.366 -10.028 1.00 0.00 H new ATOM 0 HD2 PHE B 8 9.991 -4.946 -11.299 1.00 0.00 H new ATOM 0 HE1 PHE B 8 6.783 -5.892 -7.695 1.00 0.00 H new ATOM 0 HE2 PHE B 8 10.594 -4.476 -8.966 1.00 0.00 H new ATOM 0 HZ PHE B 8 8.988 -4.945 -7.160 1.00 0.00 H new ATOM 1466 N GLY B 9 6.576 -4.331 -15.309 1.00 0.00 N ATOM 1467 CA GLY B 9 6.385 -4.555 -16.743 1.00 0.00 C ATOM 1468 C GLY B 9 7.222 -3.589 -17.571 1.00 0.00 C ATOM 1469 O GLY B 9 7.168 -3.602 -18.802 1.00 0.00 O ATOM 0 H GLY B 9 6.085 -3.517 -14.940 1.00 0.00 H new ATOM 0 HA2 GLY B 9 6.657 -5.581 -16.992 1.00 0.00 H new ATOM 0 HA3 GLY B 9 5.331 -4.434 -16.995 1.00 0.00 H new ATOM 1473 N GLN B 10 7.992 -2.751 -16.886 1.00 0.00 N ATOM 1474 CA GLN B 10 8.832 -1.761 -17.555 1.00 0.00 C ATOM 1475 C GLN B 10 10.071 -2.411 -18.122 1.00 0.00 C ATOM 1476 O GLN B 10 11.148 -2.359 -17.526 1.00 0.00 O ATOM 1477 CB GLN B 10 9.227 -0.639 -16.591 1.00 0.00 C ATOM 1478 CG GLN B 10 8.052 0.154 -16.044 1.00 0.00 C ATOM 1479 CD GLN B 10 8.474 1.162 -14.992 1.00 0.00 C ATOM 1480 OE1 GLN B 10 9.310 0.870 -14.132 1.00 0.00 O ATOM 1481 NE2 GLN B 10 7.897 2.357 -15.054 1.00 0.00 N ATOM 0 H GLN B 10 8.053 -2.736 -15.868 1.00 0.00 H new ATOM 0 HA GLN B 10 8.254 -1.330 -18.372 1.00 0.00 H new ATOM 0 HB2 GLN B 10 9.780 -1.070 -15.756 1.00 0.00 H new ATOM 0 HB3 GLN B 10 9.905 0.044 -17.104 1.00 0.00 H new ATOM 0 HG2 GLN B 10 7.555 0.674 -16.863 1.00 0.00 H new ATOM 0 HG3 GLN B 10 7.323 -0.532 -15.614 1.00 0.00 H new ATOM 0 HE21 GLN B 10 7.211 2.555 -15.782 1.00 0.00 H new ATOM 0 HE22 GLN B 10 8.140 3.077 -14.373 1.00 0.00 H new ATOM 1490 N MET B 11 9.909 -3.019 -19.279 1.00 0.00 N ATOM 1491 CA MET B 11 10.993 -3.743 -19.903 1.00 0.00 C ATOM 1492 C MET B 11 11.530 -4.808 -18.955 1.00 0.00 C ATOM 1493 O MET B 11 10.898 -5.137 -17.949 1.00 0.00 O ATOM 1494 CB MET B 11 12.102 -2.781 -20.323 1.00 0.00 C ATOM 1495 CG MET B 11 11.696 -1.784 -21.399 1.00 0.00 C ATOM 1496 SD MET B 11 13.051 -0.699 -21.889 1.00 0.00 S ATOM 1497 CE MET B 11 13.156 0.377 -20.463 1.00 0.00 C ATOM 0 H MET B 11 9.035 -3.025 -19.806 1.00 0.00 H new ATOM 0 HA MET B 11 10.616 -4.239 -20.797 1.00 0.00 H new ATOM 0 HB2 MET B 11 12.441 -2.231 -19.445 1.00 0.00 H new ATOM 0 HB3 MET B 11 12.952 -3.361 -20.684 1.00 0.00 H new ATOM 0 HG2 MET B 11 11.335 -2.326 -22.273 1.00 0.00 H new ATOM 0 HG3 MET B 11 10.866 -1.180 -21.034 1.00 0.00 H new ATOM 0 HE1 MET B 11 13.823 1.210 -20.684 1.00 0.00 H new ATOM 0 HE2 MET B 11 12.164 0.760 -20.223 1.00 0.00 H new ATOM 0 HE3 MET B 11 13.545 -0.183 -19.612 1.00 0.00 H new ATOM 1507 N GLN B 12 12.708 -5.330 -19.271 1.00 0.00 N ATOM 1508 CA GLN B 12 13.334 -6.337 -18.425 1.00 0.00 C ATOM 1509 C GLN B 12 13.953 -5.682 -17.198 1.00 0.00 C ATOM 1510 O GLN B 12 14.765 -4.763 -17.306 1.00 0.00 O ATOM 1511 CB GLN B 12 14.398 -7.115 -19.203 1.00 0.00 C ATOM 1512 CG GLN B 12 15.032 -8.254 -18.422 1.00 0.00 C ATOM 1513 CD GLN B 12 16.037 -9.034 -19.249 1.00 0.00 C ATOM 1514 OE1 GLN B 12 16.674 -8.487 -20.155 1.00 0.00 O ATOM 1515 NE2 GLN B 12 16.185 -10.317 -18.943 1.00 0.00 N ATOM 0 H GLN B 12 13.245 -5.075 -20.100 1.00 0.00 H new ATOM 0 HA GLN B 12 12.565 -7.039 -18.101 1.00 0.00 H new ATOM 0 HB2 GLN B 12 13.947 -7.518 -20.110 1.00 0.00 H new ATOM 0 HB3 GLN B 12 15.181 -6.424 -19.516 1.00 0.00 H new ATOM 0 HG2 GLN B 12 15.527 -7.853 -17.537 1.00 0.00 H new ATOM 0 HG3 GLN B 12 14.251 -8.929 -18.072 1.00 0.00 H new ATOM 0 HE21 GLN B 12 15.638 -10.727 -18.186 1.00 0.00 H new ATOM 0 HE22 GLN B 12 16.846 -10.893 -19.464 1.00 0.00 H new ATOM 1524 N LYS B 13 13.561 -6.169 -16.035 1.00 0.00 N ATOM 1525 CA LYS B 13 14.109 -5.673 -14.789 1.00 0.00 C ATOM 1526 C LYS B 13 15.411 -6.393 -14.434 1.00 0.00 C ATOM 1527 O LYS B 13 16.320 -5.782 -13.889 1.00 0.00 O ATOM 1528 CB LYS B 13 13.089 -5.832 -13.661 1.00 0.00 C ATOM 1529 CG LYS B 13 11.853 -4.952 -13.801 1.00 0.00 C ATOM 1530 CD LYS B 13 12.205 -3.479 -13.651 1.00 0.00 C ATOM 1531 CE LYS B 13 10.963 -2.603 -13.715 1.00 0.00 C ATOM 1532 NZ LYS B 13 11.294 -1.158 -13.592 1.00 0.00 N ATOM 0 H LYS B 13 12.865 -6.907 -15.929 1.00 0.00 H new ATOM 0 HA LYS B 13 14.333 -4.614 -14.916 1.00 0.00 H new ATOM 0 HB2 LYS B 13 12.774 -6.875 -13.616 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.576 -5.605 -12.713 1.00 0.00 H new ATOM 0 HG2 LYS B 13 11.392 -5.121 -14.774 1.00 0.00 H new ATOM 0 HG3 LYS B 13 11.117 -5.231 -13.047 1.00 0.00 H new ATOM 0 HD2 LYS B 13 12.716 -3.320 -12.701 1.00 0.00 H new ATOM 0 HD3 LYS B 13 12.899 -3.187 -14.439 1.00 0.00 H new ATOM 0 HE2 LYS B 13 10.445 -2.777 -14.658 1.00 0.00 H new ATOM 0 HE3 LYS B 13 10.277 -2.887 -12.917 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 10.446 -0.589 -13.792 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 11.625 -0.959 -12.626 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 12.043 -0.914 -14.272 1.00 0.00 H new ATOM 1546 N THR B 14 15.489 -7.688 -14.745 1.00 0.00 N ATOM 1547 CA THR B 14 16.670 -8.503 -14.418 1.00 0.00 C ATOM 1548 C THR B 14 17.285 -8.078 -13.081 1.00 0.00 C ATOM 1549 O THR B 14 16.602 -7.550 -12.205 1.00 0.00 O ATOM 1550 CB THR B 14 17.734 -8.410 -15.528 1.00 0.00 C ATOM 1551 OG1 THR B 14 18.837 -9.269 -15.208 1.00 0.00 O ATOM 1552 CG2 THR B 14 18.234 -6.981 -15.669 1.00 0.00 C ATOM 0 H THR B 14 14.748 -8.200 -15.224 1.00 0.00 H new ATOM 0 HA THR B 14 16.334 -9.537 -14.337 1.00 0.00 H new ATOM 0 HB THR B 14 17.283 -8.721 -16.470 1.00 0.00 H new ATOM 0 HG1 THR B 14 19.679 -8.805 -15.399 1.00 0.00 H new ATOM 0 HG21 THR B 14 18.985 -6.934 -16.458 1.00 0.00 H new ATOM 0 HG22 THR B 14 17.400 -6.327 -15.923 1.00 0.00 H new ATOM 0 HG23 THR B 14 18.676 -6.656 -14.727 1.00 0.00 H new ATOM 1560 N ALA B 15 18.581 -8.321 -12.923 1.00 0.00 N ATOM 1561 CA ALA B 15 19.251 -8.018 -11.664 1.00 0.00 C ATOM 1562 C ALA B 15 18.674 -8.859 -10.528 1.00 0.00 C ATOM 1563 O ALA B 15 17.464 -8.890 -10.319 1.00 0.00 O ATOM 1564 CB ALA B 15 19.087 -6.527 -11.342 1.00 0.00 C ATOM 0 H ALA B 15 19.183 -8.722 -13.642 1.00 0.00 H new ATOM 0 HA ALA B 15 20.310 -8.257 -11.765 1.00 0.00 H new ATOM 0 HB1 ALA B 15 19.588 -6.301 -10.401 1.00 0.00 H new ATOM 0 HB2 ALA B 15 19.529 -5.931 -12.141 1.00 0.00 H new ATOM 0 HB3 ALA B 15 18.027 -6.288 -11.255 1.00 0.00 H new ATOM 1570 N THR B 16 19.553 -9.536 -9.794 1.00 0.00 N ATOM 1571 CA THR B 16 19.124 -10.348 -8.660 1.00 0.00 C ATOM 1572 C THR B 16 19.266 -9.559 -7.364 1.00 0.00 C ATOM 1573 O THR B 16 20.366 -9.159 -6.985 1.00 0.00 O ATOM 1574 CB THR B 16 19.931 -11.656 -8.566 1.00 0.00 C ATOM 1575 OG1 THR B 16 19.729 -12.431 -9.755 1.00 0.00 O ATOM 1576 CG2 THR B 16 19.494 -12.467 -7.356 1.00 0.00 C ATOM 0 H THR B 16 20.559 -9.539 -9.962 1.00 0.00 H new ATOM 0 HA THR B 16 18.076 -10.606 -8.814 1.00 0.00 H new ATOM 0 HB THR B 16 20.987 -11.407 -8.461 1.00 0.00 H new ATOM 0 HG1 THR B 16 20.244 -13.262 -9.695 1.00 0.00 H new ATOM 0 HG21 THR B 16 20.075 -13.388 -7.306 1.00 0.00 H new ATOM 0 HG22 THR B 16 19.658 -11.885 -6.449 1.00 0.00 H new ATOM 0 HG23 THR B 16 18.435 -12.711 -7.444 1.00 0.00 H new ATOM 1584 N VAL B 17 18.142 -9.338 -6.690 1.00 0.00 N ATOM 1585 CA VAL B 17 18.150 -8.600 -5.433 1.00 0.00 C ATOM 1586 C VAL B 17 18.546 -9.516 -4.279 1.00 0.00 C ATOM 1587 O VAL B 17 19.424 -9.187 -3.483 1.00 0.00 O ATOM 1588 CB VAL B 17 16.762 -7.993 -5.158 1.00 0.00 C ATOM 1589 CG1 VAL B 17 16.734 -7.324 -3.792 1.00 0.00 C ATOM 1590 CG2 VAL B 17 16.405 -6.998 -6.253 1.00 0.00 C ATOM 0 H VAL B 17 17.221 -9.657 -6.990 1.00 0.00 H new ATOM 0 HA VAL B 17 18.881 -7.796 -5.515 1.00 0.00 H new ATOM 0 HB VAL B 17 16.021 -8.792 -5.158 1.00 0.00 H new ATOM 0 HG11 VAL B 17 15.745 -6.901 -3.614 1.00 0.00 H new ATOM 0 HG12 VAL B 17 16.957 -8.062 -3.021 1.00 0.00 H new ATOM 0 HG13 VAL B 17 17.480 -6.530 -3.760 1.00 0.00 H new ATOM 0 HG21 VAL B 17 15.422 -6.573 -6.052 1.00 0.00 H new ATOM 0 HG22 VAL B 17 17.148 -6.200 -6.276 1.00 0.00 H new ATOM 0 HG23 VAL B 17 16.390 -7.507 -7.217 1.00 0.00 H new ATOM 1600 N ALA B 18 17.883 -10.668 -4.193 1.00 0.00 N ATOM 1601 CA ALA B 18 18.227 -11.669 -3.188 1.00 0.00 C ATOM 1602 C ALA B 18 18.003 -11.117 -1.786 1.00 0.00 C ATOM 1603 O ALA B 18 18.717 -11.471 -0.847 1.00 0.00 O ATOM 1604 CB ALA B 18 19.689 -12.089 -3.345 1.00 0.00 C ATOM 0 H ALA B 18 17.109 -10.929 -4.804 1.00 0.00 H new ATOM 0 HA ALA B 18 17.584 -12.537 -3.333 1.00 0.00 H new ATOM 0 HB1 ALA B 18 19.936 -12.836 -2.591 1.00 0.00 H new ATOM 0 HB2 ALA B 18 19.841 -12.512 -4.338 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.333 -11.219 -3.218 1.00 0.00 H new ATOM 1610 N ARG B 19 17.011 -10.241 -1.654 1.00 0.00 N ATOM 1611 CA ARG B 19 16.656 -9.669 -0.356 1.00 0.00 C ATOM 1612 C ARG B 19 15.142 -9.530 -0.235 1.00 0.00 C ATOM 1613 O ARG B 19 14.433 -9.394 -1.237 1.00 0.00 O ATOM 1614 CB ARG B 19 17.308 -8.307 -0.166 1.00 0.00 C ATOM 1615 CG ARG B 19 18.828 -8.329 -0.109 1.00 0.00 C ATOM 1616 CD ARG B 19 19.321 -8.960 1.142 1.00 0.00 C ATOM 1617 NE ARG B 19 20.768 -8.869 1.260 1.00 0.00 N ATOM 1618 CZ ARG B 19 21.636 -9.752 0.729 1.00 0.00 C ATOM 1619 NH1 ARG B 19 21.190 -10.784 0.047 1.00 0.00 N ATOM 1620 NH2 ARG B 19 22.936 -9.581 0.893 1.00 0.00 N ATOM 0 H ARG B 19 16.437 -9.911 -2.430 1.00 0.00 H new ATOM 0 HA ARG B 19 17.020 -10.343 0.419 1.00 0.00 H new ATOM 0 HB2 ARG B 19 16.999 -7.655 -0.983 1.00 0.00 H new ATOM 0 HB3 ARG B 19 16.930 -7.865 0.756 1.00 0.00 H new ATOM 0 HG2 ARG B 19 19.217 -8.874 -0.969 1.00 0.00 H new ATOM 0 HG3 ARG B 19 19.210 -7.310 -0.178 1.00 0.00 H new ATOM 0 HD2 ARG B 19 18.855 -8.476 2.001 1.00 0.00 H new ATOM 0 HD3 ARG B 19 19.020 -10.007 1.164 1.00 0.00 H new ATOM 0 HE ARG B 19 21.153 -8.081 1.781 1.00 0.00 H new ATOM 0 HH11 ARG B 19 20.187 -10.916 -0.080 1.00 0.00 H new ATOM 0 HH12 ARG B 19 21.847 -11.452 -0.355 1.00 0.00 H new ATOM 0 HH21 ARG B 19 23.282 -8.780 1.422 1.00 0.00 H new ATOM 0 HH22 ARG B 19 23.593 -10.250 0.491 1.00 0.00 H new ATOM 1634 N ASP B 20 14.649 -9.575 1.005 1.00 0.00 N ATOM 1635 CA ASP B 20 13.237 -9.320 1.276 1.00 0.00 C ATOM 1636 C ASP B 20 12.918 -7.854 1.017 1.00 0.00 C ATOM 1637 O ASP B 20 13.552 -6.968 1.582 1.00 0.00 O ATOM 1638 CB ASP B 20 12.883 -9.687 2.720 1.00 0.00 C ATOM 1639 CG ASP B 20 12.895 -11.189 2.970 1.00 0.00 C ATOM 1640 OD1 ASP B 20 12.962 -11.929 2.018 1.00 0.00 O ATOM 1641 OD2 ASP B 20 12.838 -11.581 4.111 1.00 0.00 O ATOM 0 H ASP B 20 15.206 -9.785 1.833 1.00 0.00 H new ATOM 0 HA ASP B 20 12.640 -9.942 0.610 1.00 0.00 H new ATOM 0 HB2 ASP B 20 13.590 -9.206 3.396 1.00 0.00 H new ATOM 0 HB3 ASP B 20 11.895 -9.292 2.958 1.00 0.00 H new ATOM 1646 N ARG B 21 11.943 -7.605 0.148 1.00 0.00 N ATOM 1647 CA ARG B 21 11.567 -6.240 -0.219 1.00 0.00 C ATOM 1648 C ARG B 21 10.069 -6.048 -0.042 1.00 0.00 C ATOM 1649 O ARG B 21 9.280 -6.959 -0.304 1.00 0.00 O ATOM 1650 CB ARG B 21 11.954 -5.936 -1.659 1.00 0.00 C ATOM 1651 CG ARG B 21 13.427 -6.136 -1.982 1.00 0.00 C ATOM 1652 CD ARG B 21 14.288 -5.192 -1.226 1.00 0.00 C ATOM 1653 NE ARG B 21 14.032 -3.809 -1.596 1.00 0.00 N ATOM 1654 CZ ARG B 21 14.607 -3.177 -2.637 1.00 0.00 C ATOM 1655 NH1 ARG B 21 15.466 -3.814 -3.400 1.00 0.00 N ATOM 1656 NH2 ARG B 21 14.307 -1.915 -2.891 1.00 0.00 N ATOM 0 H ARG B 21 11.397 -8.331 -0.317 1.00 0.00 H new ATOM 0 HA ARG B 21 12.103 -5.553 0.436 1.00 0.00 H new ATOM 0 HB2 ARG B 21 11.363 -6.569 -2.320 1.00 0.00 H new ATOM 0 HB3 ARG B 21 11.685 -4.904 -1.882 1.00 0.00 H new ATOM 0 HG2 ARG B 21 13.715 -7.160 -1.746 1.00 0.00 H new ATOM 0 HG3 ARG B 21 13.587 -5.998 -3.051 1.00 0.00 H new ATOM 0 HD2 ARG B 21 14.116 -5.320 -0.157 1.00 0.00 H new ATOM 0 HD3 ARG B 21 15.336 -5.429 -1.410 1.00 0.00 H new ATOM 0 HE ARG B 21 13.371 -3.281 -1.027 1.00 0.00 H new ATOM 0 HH11 ARG B 21 15.698 -4.788 -3.204 1.00 0.00 H new ATOM 0 HH12 ARG B 21 15.901 -3.335 -4.188 1.00 0.00 H new ATOM 0 HH21 ARG B 21 13.640 -1.420 -2.299 1.00 0.00 H new ATOM 0 HH22 ARG B 21 14.742 -1.436 -3.679 1.00 0.00 H new ATOM 1670 N LEU B 22 9.680 -4.857 0.400 1.00 0.00 N ATOM 1671 CA LEU B 22 8.267 -4.494 0.499 1.00 0.00 C ATOM 1672 C LEU B 22 8.001 -3.228 -0.312 1.00 0.00 C ATOM 1673 O LEU B 22 8.798 -2.294 -0.303 1.00 0.00 O ATOM 1674 CB LEU B 22 7.866 -4.274 1.963 1.00 0.00 C ATOM 1675 CG LEU B 22 7.973 -5.504 2.873 1.00 0.00 C ATOM 1676 CD1 LEU B 22 9.380 -5.591 3.449 1.00 0.00 C ATOM 1677 CD2 LEU B 22 6.934 -5.408 3.980 1.00 0.00 C ATOM 0 H LEU B 22 10.324 -4.123 0.697 1.00 0.00 H new ATOM 0 HA LEU B 22 7.668 -5.312 0.098 1.00 0.00 H new ATOM 0 HB2 LEU B 22 8.491 -3.483 2.377 1.00 0.00 H new ATOM 0 HB3 LEU B 22 6.838 -3.914 1.989 1.00 0.00 H new ATOM 0 HG LEU B 22 7.781 -6.410 2.298 1.00 0.00 H new ATOM 0 HD11 LEU B 22 9.455 -6.465 4.096 1.00 0.00 H new ATOM 0 HD12 LEU B 22 10.101 -5.678 2.636 1.00 0.00 H new ATOM 0 HD13 LEU B 22 9.592 -4.692 4.028 1.00 0.00 H new ATOM 0 HD21 LEU B 22 7.010 -6.282 4.627 1.00 0.00 H new ATOM 0 HD22 LEU B 22 7.109 -4.506 4.566 1.00 0.00 H new ATOM 0 HD23 LEU B 22 5.937 -5.367 3.541 1.00 0.00 H new ATOM 1689 N GLN B 23 6.866 -3.215 -1.012 1.00 0.00 N ATOM 1690 CA GLN B 23 6.447 -2.049 -1.792 1.00 0.00 C ATOM 1691 C GLN B 23 4.996 -1.721 -1.483 1.00 0.00 C ATOM 1692 O GLN B 23 4.098 -2.523 -1.742 1.00 0.00 O ATOM 1693 CB GLN B 23 6.625 -2.298 -3.292 1.00 0.00 C ATOM 1694 CG GLN B 23 8.067 -2.499 -3.723 1.00 0.00 C ATOM 1695 CD GLN B 23 8.193 -2.793 -5.205 1.00 0.00 C ATOM 1696 OE1 GLN B 23 7.324 -3.435 -5.801 1.00 0.00 O ATOM 1697 NE2 GLN B 23 9.278 -2.325 -5.811 1.00 0.00 N ATOM 0 H GLN B 23 6.218 -4.002 -1.055 1.00 0.00 H new ATOM 0 HA GLN B 23 7.076 -1.203 -1.515 1.00 0.00 H new ATOM 0 HB2 GLN B 23 6.047 -3.178 -3.574 1.00 0.00 H new ATOM 0 HB3 GLN B 23 6.208 -1.454 -3.841 1.00 0.00 H new ATOM 0 HG2 GLN B 23 8.643 -1.605 -3.483 1.00 0.00 H new ATOM 0 HG3 GLN B 23 8.502 -3.321 -3.154 1.00 0.00 H new ATOM 0 HE21 GLN B 23 9.972 -1.799 -5.280 1.00 0.00 H new ATOM 0 HE22 GLN B 23 9.418 -2.492 -6.808 1.00 0.00 H new ATOM 1706 N ILE B 24 4.771 -0.538 -0.921 1.00 0.00 N ATOM 1707 CA ILE B 24 3.437 -0.152 -0.466 1.00 0.00 C ATOM 1708 C ILE B 24 2.980 1.108 -1.183 1.00 0.00 C ATOM 1709 O ILE B 24 3.643 2.144 -1.124 1.00 0.00 O ATOM 1710 CB ILE B 24 3.412 0.080 1.056 1.00 0.00 C ATOM 1711 CG1 ILE B 24 3.889 -1.173 1.795 1.00 0.00 C ATOM 1712 CG2 ILE B 24 2.014 0.470 1.511 1.00 0.00 C ATOM 1713 CD1 ILE B 24 5.362 -1.159 2.133 1.00 0.00 C ATOM 0 H ILE B 24 5.491 0.169 -0.769 1.00 0.00 H new ATOM 0 HA ILE B 24 2.756 -0.970 -0.701 1.00 0.00 H new ATOM 0 HB ILE B 24 4.091 0.899 1.293 1.00 0.00 H new ATOM 0 HG12 ILE B 24 3.316 -1.281 2.716 1.00 0.00 H new ATOM 0 HG13 ILE B 24 3.675 -2.048 1.182 1.00 0.00 H new ATOM 0 HG21 ILE B 24 2.014 0.630 2.589 1.00 0.00 H new ATOM 0 HG22 ILE B 24 1.710 1.388 1.008 1.00 0.00 H new ATOM 0 HG23 ILE B 24 1.315 -0.328 1.263 1.00 0.00 H new ATOM 0 HD11 ILE B 24 5.624 -2.079 2.655 1.00 0.00 H new ATOM 0 HD12 ILE B 24 5.945 -1.084 1.215 1.00 0.00 H new ATOM 0 HD13 ILE B 24 5.580 -0.304 2.773 1.00 0.00 H new ATOM 1725 N ILE B 25 1.836 1.013 -1.855 1.00 0.00 N ATOM 1726 CA ILE B 25 1.241 2.167 -2.526 1.00 0.00 C ATOM 1727 C ILE B 25 -0.111 2.485 -1.905 1.00 0.00 C ATOM 1728 O ILE B 25 -1.041 1.683 -1.971 1.00 0.00 O ATOM 1729 CB ILE B 25 1.075 1.913 -4.035 1.00 0.00 C ATOM 1730 CG1 ILE B 25 2.425 1.566 -4.671 1.00 0.00 C ATOM 1731 CG2 ILE B 25 0.460 3.127 -4.714 1.00 0.00 C ATOM 1732 CD1 ILE B 25 2.702 0.082 -4.743 1.00 0.00 C ATOM 0 H ILE B 25 1.302 0.149 -1.950 1.00 0.00 H new ATOM 0 HA ILE B 25 1.912 3.016 -2.397 1.00 0.00 H new ATOM 0 HB ILE B 25 0.403 1.066 -4.172 1.00 0.00 H new ATOM 0 HG12 ILE B 25 2.459 1.982 -5.678 1.00 0.00 H new ATOM 0 HG13 ILE B 25 3.219 2.047 -4.100 1.00 0.00 H new ATOM 0 HG21 ILE B 25 0.350 2.930 -5.780 1.00 0.00 H new ATOM 0 HG22 ILE B 25 -0.519 3.330 -4.279 1.00 0.00 H new ATOM 0 HG23 ILE B 25 1.108 3.992 -4.570 1.00 0.00 H new ATOM 0 HD11 ILE B 25 3.675 -0.084 -5.205 1.00 0.00 H new ATOM 0 HD12 ILE B 25 2.701 -0.337 -3.737 1.00 0.00 H new ATOM 0 HD13 ILE B 25 1.930 -0.404 -5.339 1.00 0.00 H new ATOM 1744 N ILE B 26 -0.209 3.663 -1.300 1.00 0.00 N ATOM 1745 CA ILE B 26 -1.429 4.072 -0.606 1.00 0.00 C ATOM 1746 C ILE B 26 -2.020 5.310 -1.262 1.00 0.00 C ATOM 1747 O ILE B 26 -1.399 6.367 -1.271 1.00 0.00 O ATOM 1748 CB ILE B 26 -1.157 4.358 0.883 1.00 0.00 C ATOM 1749 CG1 ILE B 26 -0.566 3.120 1.564 1.00 0.00 C ATOM 1750 CG2 ILE B 26 -2.434 4.795 1.583 1.00 0.00 C ATOM 1751 CD1 ILE B 26 -0.050 3.380 2.961 1.00 0.00 C ATOM 0 H ILE B 26 0.541 4.354 -1.275 1.00 0.00 H new ATOM 0 HA ILE B 26 -2.140 3.249 -0.675 1.00 0.00 H new ATOM 0 HB ILE B 26 -0.433 5.170 0.954 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -1.328 2.342 1.607 1.00 0.00 H new ATOM 0 HG13 ILE B 26 0.249 2.734 0.952 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -2.223 4.993 2.634 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -2.815 5.701 1.112 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -3.180 4.004 1.505 1.00 0.00 H new ATOM 0 HD11 ILE B 26 0.353 2.457 3.378 1.00 0.00 H new ATOM 0 HD12 ILE B 26 0.736 4.135 2.924 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -0.866 3.736 3.590 1.00 0.00 H new ATOM 1763 N ALA B 27 -3.229 5.170 -1.805 1.00 0.00 N ATOM 1764 CA ALA B 27 -3.947 6.308 -2.386 1.00 0.00 C ATOM 1765 C ALA B 27 -4.947 6.861 -1.382 1.00 0.00 C ATOM 1766 O ALA B 27 -5.662 6.108 -0.721 1.00 0.00 O ATOM 1767 CB ALA B 27 -4.686 5.874 -3.653 1.00 0.00 C ATOM 0 H ALA B 27 -3.732 4.284 -1.856 1.00 0.00 H new ATOM 0 HA ALA B 27 -3.223 7.083 -2.640 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -5.216 6.728 -4.076 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -3.969 5.495 -4.381 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -5.401 5.089 -3.406 1.00 0.00 H new ATOM 1773 N GLN B 28 -4.988 8.186 -1.270 1.00 0.00 N ATOM 1774 CA GLN B 28 -5.874 8.844 -0.315 1.00 0.00 C ATOM 1775 C GLN B 28 -6.681 9.936 -0.999 1.00 0.00 C ATOM 1776 O GLN B 28 -6.139 10.975 -1.378 1.00 0.00 O ATOM 1777 CB GLN B 28 -5.074 9.434 0.850 1.00 0.00 C ATOM 1778 CG GLN B 28 -5.898 10.283 1.803 1.00 0.00 C ATOM 1779 CD GLN B 28 -6.956 9.476 2.530 1.00 0.00 C ATOM 1780 OE1 GLN B 28 -6.642 8.596 3.336 1.00 0.00 O ATOM 1781 NE2 GLN B 28 -8.220 9.771 2.249 1.00 0.00 N ATOM 0 H GLN B 28 -4.419 8.824 -1.827 1.00 0.00 H new ATOM 0 HA GLN B 28 -6.561 8.095 0.079 1.00 0.00 H new ATOM 0 HB2 GLN B 28 -4.615 8.620 1.411 1.00 0.00 H new ATOM 0 HB3 GLN B 28 -4.263 10.041 0.449 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -5.237 10.751 2.533 1.00 0.00 H new ATOM 0 HG3 GLN B 28 -6.378 11.088 1.246 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -8.434 10.507 1.576 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -8.976 9.262 2.706 1.00 0.00 H new ATOM 1790 N GLU B 29 -7.982 9.700 -1.140 1.00 0.00 N ATOM 1791 CA GLU B 29 -8.876 10.673 -1.771 1.00 0.00 C ATOM 1792 C GLU B 29 -8.849 11.974 -0.981 1.00 0.00 C ATOM 1793 O GLU B 29 -8.876 11.963 0.249 1.00 0.00 O ATOM 1794 CB GLU B 29 -10.307 10.133 -1.849 1.00 0.00 C ATOM 1795 CG GLU B 29 -11.290 11.058 -2.554 1.00 0.00 C ATOM 1796 CD GLU B 29 -11.036 11.164 -4.032 1.00 0.00 C ATOM 1797 OE1 GLU B 29 -10.550 10.217 -4.602 1.00 0.00 O ATOM 1798 OE2 GLU B 29 -11.327 12.195 -4.591 1.00 0.00 O ATOM 0 H GLU B 29 -8.443 8.845 -0.827 1.00 0.00 H new ATOM 0 HA GLU B 29 -8.530 10.857 -2.788 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -10.293 9.174 -2.367 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -10.667 9.943 -0.838 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -12.305 10.695 -2.390 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -11.231 12.051 -2.108 1.00 0.00 H new ATOM 1805 N ARG B 30 -8.793 13.097 -1.692 1.00 0.00 N ATOM 1806 CA ARG B 30 -8.909 14.415 -1.064 1.00 0.00 C ATOM 1807 C ARG B 30 -9.228 15.477 -2.104 1.00 0.00 C ATOM 1808 O ARG B 30 -8.645 16.561 -2.100 1.00 0.00 O ATOM 1809 CB ARG B 30 -7.623 14.785 -0.340 1.00 0.00 C ATOM 1810 CG ARG B 30 -6.467 15.173 -1.249 1.00 0.00 C ATOM 1811 CD ARG B 30 -5.350 15.787 -0.486 1.00 0.00 C ATOM 1812 NE ARG B 30 -4.320 16.317 -1.364 1.00 0.00 N ATOM 1813 CZ ARG B 30 -4.338 17.549 -1.909 1.00 0.00 C ATOM 1814 NH1 ARG B 30 -5.339 18.364 -1.657 1.00 0.00 N ATOM 1815 NH2 ARG B 30 -3.351 17.938 -2.697 1.00 0.00 N ATOM 0 H ARG B 30 -8.668 13.123 -2.704 1.00 0.00 H new ATOM 0 HA ARG B 30 -9.722 14.367 -0.339 1.00 0.00 H new ATOM 0 HB2 ARG B 30 -7.829 15.615 0.336 1.00 0.00 H new ATOM 0 HB3 ARG B 30 -7.314 13.941 0.277 1.00 0.00 H new ATOM 0 HG2 ARG B 30 -6.106 14.290 -1.775 1.00 0.00 H new ATOM 0 HG3 ARG B 30 -6.819 15.874 -2.006 1.00 0.00 H new ATOM 0 HD2 ARG B 30 -5.738 16.588 0.144 1.00 0.00 H new ATOM 0 HD3 ARG B 30 -4.912 15.042 0.179 1.00 0.00 H new ATOM 0 HE ARG B 30 -3.527 15.713 -1.583 1.00 0.00 H new ATOM 0 HH11 ARG B 30 -6.101 18.063 -1.049 1.00 0.00 H new ATOM 0 HH12 ARG B 30 -5.353 19.297 -2.069 1.00 0.00 H new ATOM 0 HH21 ARG B 30 -2.575 17.305 -2.893 1.00 0.00 H new ATOM 0 HH22 ARG B 30 -3.365 18.871 -3.109 1.00 0.00 H new ATOM 1829 N ALA B 31 -10.160 15.156 -2.997 1.00 0.00 N ATOM 1830 CA ALA B 31 -10.686 16.147 -3.929 1.00 0.00 C ATOM 1831 C ALA B 31 -11.298 17.313 -3.160 1.00 0.00 C ATOM 1832 O ALA B 31 -11.263 17.333 -1.929 1.00 0.00 O ATOM 1833 CB ALA B 31 -11.750 15.500 -4.820 1.00 0.00 C ATOM 0 H ALA B 31 -10.564 14.224 -3.094 1.00 0.00 H new ATOM 0 HA ALA B 31 -9.872 16.520 -4.550 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -12.142 16.242 -5.516 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -11.305 14.677 -5.379 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -12.562 15.120 -4.200 1.00 0.00 H new ATOM 1839 N GLN B 32 -11.846 18.284 -3.887 1.00 0.00 N ATOM 1840 CA GLN B 32 -12.364 19.505 -3.266 1.00 0.00 C ATOM 1841 C GLN B 32 -13.401 19.177 -2.194 1.00 0.00 C ATOM 1842 O GLN B 32 -13.492 19.861 -1.174 1.00 0.00 O ATOM 1843 CB GLN B 32 -12.977 20.429 -4.321 1.00 0.00 C ATOM 1844 CG GLN B 32 -13.443 21.769 -3.780 1.00 0.00 C ATOM 1845 CD GLN B 32 -12.297 22.616 -3.262 1.00 0.00 C ATOM 1846 OE1 GLN B 32 -11.305 22.838 -3.962 1.00 0.00 O ATOM 1847 NE2 GLN B 32 -12.425 23.094 -2.030 1.00 0.00 N ATOM 0 H GLN B 32 -11.944 18.252 -4.902 1.00 0.00 H new ATOM 0 HA GLN B 32 -11.527 20.018 -2.792 1.00 0.00 H new ATOM 0 HB2 GLN B 32 -12.242 20.603 -5.107 1.00 0.00 H new ATOM 0 HB3 GLN B 32 -13.824 19.922 -4.784 1.00 0.00 H new ATOM 0 HG2 GLN B 32 -13.966 22.313 -4.567 1.00 0.00 H new ATOM 0 HG3 GLN B 32 -14.160 21.603 -2.976 1.00 0.00 H new ATOM 0 HE21 GLN B 32 -13.263 22.885 -1.487 1.00 0.00 H new ATOM 0 HE22 GLN B 32 -11.686 23.670 -1.627 1.00 0.00 H new ATOM 1856 N GLU B 33 -14.177 18.123 -2.434 1.00 0.00 N ATOM 1857 CA GLU B 33 -15.143 17.660 -1.448 1.00 0.00 C ATOM 1858 C GLU B 33 -14.426 16.911 -0.330 1.00 0.00 C ATOM 1859 O GLU B 33 -13.830 15.858 -0.554 1.00 0.00 O ATOM 1860 CB GLU B 33 -16.192 16.756 -2.101 1.00 0.00 C ATOM 1861 CG GLU B 33 -17.294 16.291 -1.161 1.00 0.00 C ATOM 1862 CD GLU B 33 -18.338 15.457 -1.850 1.00 0.00 C ATOM 1863 OE1 GLU B 33 -18.250 15.296 -3.044 1.00 0.00 O ATOM 1864 OE2 GLU B 33 -19.226 14.980 -1.183 1.00 0.00 O ATOM 0 H GLU B 33 -14.155 17.579 -3.296 1.00 0.00 H new ATOM 0 HA GLU B 33 -15.652 18.527 -1.027 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.645 17.290 -2.936 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.692 15.881 -2.516 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -16.852 15.713 -0.349 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -17.771 17.161 -0.710 1.00 0.00 H new ATOM 1871 N GLY B 34 -14.487 17.468 0.876 1.00 0.00 N ATOM 1872 CA GLY B 34 -13.789 16.893 2.024 1.00 0.00 C ATOM 1873 C GLY B 34 -12.711 17.841 2.530 1.00 0.00 C ATOM 1874 O GLY B 34 -12.230 18.703 1.794 1.00 0.00 O ATOM 0 H GLY B 34 -15.012 18.317 1.085 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -14.502 16.686 2.822 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -13.340 15.941 1.743 1.00 0.00 H new ATOM 1878 N GLN B 35 -12.332 17.677 3.795 1.00 0.00 N ATOM 1879 CA GLN B 35 -11.354 18.569 4.425 1.00 0.00 C ATOM 1880 C GLN B 35 -10.598 17.841 5.529 1.00 0.00 C ATOM 1881 O GLN B 35 -10.938 16.714 5.892 1.00 0.00 O ATOM 1882 CB GLN B 35 -12.042 19.814 4.993 1.00 0.00 C ATOM 1883 CG GLN B 35 -13.037 19.522 6.104 1.00 0.00 C ATOM 1884 CD GLN B 35 -13.743 20.774 6.591 1.00 0.00 C ATOM 1885 OE1 GLN B 35 -14.218 21.586 5.792 1.00 0.00 O ATOM 1886 NE2 GLN B 35 -13.816 20.936 7.907 1.00 0.00 N ATOM 0 H GLN B 35 -12.684 16.939 4.404 1.00 0.00 H new ATOM 0 HA GLN B 35 -10.643 18.883 3.661 1.00 0.00 H new ATOM 0 HB2 GLN B 35 -11.280 20.495 5.372 1.00 0.00 H new ATOM 0 HB3 GLN B 35 -12.558 20.331 4.184 1.00 0.00 H new ATOM 0 HG2 GLN B 35 -13.777 18.806 5.746 1.00 0.00 H new ATOM 0 HG3 GLN B 35 -12.518 19.053 6.939 1.00 0.00 H new ATOM 0 HE21 GLN B 35 -13.409 20.239 8.530 1.00 0.00 H new ATOM 0 HE22 GLN B 35 -14.279 21.758 8.295 1.00 0.00 H new ATOM 1895 N THR B 36 -9.565 18.490 6.052 1.00 0.00 N ATOM 1896 CA THR B 36 -8.853 17.959 7.205 1.00 0.00 C ATOM 1897 C THR B 36 -7.982 16.772 6.778 1.00 0.00 C ATOM 1898 O THR B 36 -8.423 15.629 6.840 1.00 0.00 O ATOM 1899 CB THR B 36 -9.829 17.528 8.316 1.00 0.00 C ATOM 1900 OG1 THR B 36 -10.653 18.640 8.689 1.00 0.00 O ATOM 1901 CG2 THR B 36 -9.065 17.037 9.536 1.00 0.00 C ATOM 0 H THR B 36 -9.205 19.377 5.699 1.00 0.00 H new ATOM 0 HA THR B 36 -8.217 18.749 7.605 1.00 0.00 H new ATOM 0 HB THR B 36 -10.451 16.716 7.938 1.00 0.00 H new ATOM 0 HG1 THR B 36 -11.275 18.364 9.395 1.00 0.00 H new ATOM 0 HG21 THR B 36 -9.771 16.737 10.311 1.00 0.00 H new ATOM 0 HG22 THR B 36 -8.446 16.184 9.259 1.00 0.00 H new ATOM 0 HG23 THR B 36 -8.430 17.838 9.914 1.00 0.00 H new ATOM 1909 N PRO B 37 -6.768 17.023 6.339 1.00 0.00 N ATOM 1910 CA PRO B 37 -5.774 15.938 6.052 1.00 0.00 C ATOM 1911 C PRO B 37 -5.465 15.076 7.297 1.00 0.00 C ATOM 1912 O PRO B 37 -6.218 15.096 8.253 1.00 0.00 O ATOM 1913 CB PRO B 37 -4.535 16.717 5.599 1.00 0.00 C ATOM 1914 CG PRO B 37 -5.075 18.036 5.160 1.00 0.00 C ATOM 1915 CD PRO B 37 -6.181 18.333 6.136 1.00 0.00 C ATOM 0 HA PRO B 37 -6.139 15.226 5.312 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.817 16.831 6.411 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -4.019 16.207 4.786 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -4.306 18.808 5.185 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -5.449 17.991 4.137 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -5.801 18.758 7.065 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -6.901 19.044 5.731 1.00 0.00 H new ATOM 1923 N ASP B 38 -4.333 14.375 7.301 1.00 0.00 N ATOM 1924 CA ASP B 38 -3.887 13.592 8.472 1.00 0.00 C ATOM 1925 C ASP B 38 -4.333 12.131 8.398 1.00 0.00 C ATOM 1926 O ASP B 38 -5.081 11.657 9.253 1.00 0.00 O ATOM 1927 CB ASP B 38 -4.418 14.217 9.765 1.00 0.00 C ATOM 1928 CG ASP B 38 -3.653 13.762 11.000 1.00 0.00 C ATOM 1929 OD1 ASP B 38 -2.531 13.338 10.857 1.00 0.00 O ATOM 1930 OD2 ASP B 38 -4.197 13.844 12.075 1.00 0.00 O ATOM 0 H ASP B 38 -3.698 14.328 6.504 1.00 0.00 H new ATOM 0 HA ASP B 38 -2.797 13.612 8.468 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -4.361 15.303 9.688 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -5.471 13.960 9.881 1.00 0.00 H new ATOM 1935 N TYR B 39 -3.850 11.414 7.383 1.00 0.00 N ATOM 1936 CA TYR B 39 -4.266 10.028 7.148 1.00 0.00 C ATOM 1937 C TYR B 39 -3.072 9.184 6.700 1.00 0.00 C ATOM 1938 O TYR B 39 -2.732 8.183 7.327 1.00 0.00 O ATOM 1939 CB TYR B 39 -5.385 9.965 6.106 1.00 0.00 C ATOM 1940 CG TYR B 39 -6.637 10.711 6.510 1.00 0.00 C ATOM 1941 CD1 TYR B 39 -6.980 11.892 5.866 1.00 0.00 C ATOM 1942 CD2 TYR B 39 -7.443 10.217 7.525 1.00 0.00 C ATOM 1943 CE1 TYR B 39 -8.124 12.573 6.236 1.00 0.00 C ATOM 1944 CE2 TYR B 39 -8.587 10.898 7.894 1.00 0.00 C ATOM 1945 CZ TYR B 39 -8.927 12.071 7.253 1.00 0.00 C ATOM 1946 OH TYR B 39 -10.066 12.750 7.621 1.00 0.00 O ATOM 0 H TYR B 39 -3.171 11.768 6.710 1.00 0.00 H new ATOM 0 HA TYR B 39 -4.650 9.623 8.084 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -5.017 10.375 5.165 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -5.639 8.921 5.921 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -6.353 12.278 5.076 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -7.176 9.299 8.027 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -8.393 13.492 5.737 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -9.215 10.512 8.684 1.00 0.00 H new ATOM 0 HH TYR B 39 -10.516 12.266 8.345 1.00 0.00 H new ATOM 1956 N LEU B 40 -2.435 9.609 5.615 1.00 0.00 N ATOM 1957 CA LEU B 40 -1.283 8.890 5.078 1.00 0.00 C ATOM 1958 C LEU B 40 -0.186 8.788 6.154 1.00 0.00 C ATOM 1959 O LEU B 40 0.303 7.692 6.435 1.00 0.00 O ATOM 1960 CB LEU B 40 -0.741 9.600 3.832 1.00 0.00 C ATOM 1961 CG LEU B 40 -1.602 9.479 2.569 1.00 0.00 C ATOM 1962 CD1 LEU B 40 -1.051 10.399 1.487 1.00 0.00 C ATOM 1963 CD2 LEU B 40 -1.617 8.031 2.101 1.00 0.00 C ATOM 0 H LEU B 40 -2.694 10.445 5.091 1.00 0.00 H new ATOM 0 HA LEU B 40 -1.596 7.886 4.792 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -0.617 10.658 4.065 1.00 0.00 H new ATOM 0 HB3 LEU B 40 0.250 9.203 3.613 1.00 0.00 H new ATOM 0 HG LEU B 40 -2.627 9.780 2.787 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -1.663 10.313 0.589 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -1.070 11.430 1.841 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -0.025 10.114 1.255 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -2.229 7.945 1.203 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -0.599 7.710 1.878 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -2.033 7.399 2.886 1.00 0.00 H new ATOM 1975 N PRO B 41 0.204 9.888 6.775 1.00 0.00 N ATOM 1976 CA PRO B 41 1.300 9.879 7.800 1.00 0.00 C ATOM 1977 C PRO B 41 0.879 9.160 9.082 1.00 0.00 C ATOM 1978 O PRO B 41 1.721 8.635 9.813 1.00 0.00 O ATOM 1979 CB PRO B 41 1.572 11.373 8.060 1.00 0.00 C ATOM 1980 CG PRO B 41 0.294 12.050 7.697 1.00 0.00 C ATOM 1981 CD PRO B 41 -0.237 11.286 6.489 1.00 0.00 C ATOM 0 HA PRO B 41 2.183 9.341 7.455 1.00 0.00 H new ATOM 0 HB2 PRO B 41 1.836 11.554 9.102 1.00 0.00 H new ATOM 0 HB3 PRO B 41 2.401 11.738 7.454 1.00 0.00 H new ATOM 0 HG2 PRO B 41 -0.415 12.020 8.524 1.00 0.00 H new ATOM 0 HG3 PRO B 41 0.460 13.100 7.456 1.00 0.00 H new ATOM 0 HD2 PRO B 41 -1.321 11.361 6.405 1.00 0.00 H new ATOM 0 HD3 PRO B 41 0.181 11.661 5.555 1.00 0.00 H new ATOM 1989 N THR B 42 -0.425 9.123 9.343 1.00 0.00 N ATOM 1990 CA THR B 42 -0.937 8.376 10.488 1.00 0.00 C ATOM 1991 C THR B 42 -0.734 6.873 10.296 1.00 0.00 C ATOM 1992 O THR B 42 -0.224 6.186 11.183 1.00 0.00 O ATOM 1993 CB THR B 42 -2.430 8.674 10.720 1.00 0.00 C ATOM 1994 OG1 THR B 42 -2.602 10.065 11.020 1.00 0.00 O ATOM 1995 CG2 THR B 42 -2.967 7.841 11.874 1.00 0.00 C ATOM 0 H THR B 42 -1.138 9.594 8.786 1.00 0.00 H new ATOM 0 HA THR B 42 -0.375 8.697 11.365 1.00 0.00 H new ATOM 0 HB THR B 42 -2.980 8.420 9.814 1.00 0.00 H new ATOM 0 HG1 THR B 42 -3.553 10.253 11.166 1.00 0.00 H new ATOM 0 HG21 THR B 42 -4.023 8.065 12.024 1.00 0.00 H new ATOM 0 HG22 THR B 42 -2.849 6.782 11.644 1.00 0.00 H new ATOM 0 HG23 THR B 42 -2.414 8.079 12.783 1.00 0.00 H new ATOM 2003 N LEU B 43 -1.137 6.367 9.133 1.00 0.00 N ATOM 2004 CA LEU B 43 -0.968 4.953 8.820 1.00 0.00 C ATOM 2005 C LEU B 43 0.496 4.634 8.537 1.00 0.00 C ATOM 2006 O LEU B 43 0.958 3.525 8.793 1.00 0.00 O ATOM 2007 CB LEU B 43 -1.828 4.568 7.609 1.00 0.00 C ATOM 2008 CG LEU B 43 -3.346 4.638 7.822 1.00 0.00 C ATOM 2009 CD1 LEU B 43 -4.057 4.335 6.511 1.00 0.00 C ATOM 2010 CD2 LEU B 43 -3.752 3.650 8.906 1.00 0.00 C ATOM 0 H LEU B 43 -1.581 6.914 8.395 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.291 4.373 9.685 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -1.566 5.222 6.778 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -1.568 3.553 7.310 1.00 0.00 H new ATOM 0 HG LEU B 43 -3.632 5.639 8.145 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -5.135 4.385 6.662 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -3.762 5.067 5.759 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -3.784 3.336 6.171 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -4.830 3.699 9.058 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -3.474 2.641 8.601 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -3.243 3.901 9.836 1.00 0.00 H new ATOM 2022 N ARG B 44 1.219 5.613 8.012 1.00 0.00 N ATOM 2023 CA ARG B 44 2.656 5.462 7.830 1.00 0.00 C ATOM 2024 C ARG B 44 3.346 5.227 9.168 1.00 0.00 C ATOM 2025 O ARG B 44 4.183 4.336 9.290 1.00 0.00 O ATOM 2026 CB ARG B 44 3.247 6.697 7.165 1.00 0.00 C ATOM 2027 CG ARG B 44 4.742 6.626 6.899 1.00 0.00 C ATOM 2028 CD ARG B 44 5.266 7.909 6.363 1.00 0.00 C ATOM 2029 NE ARG B 44 5.179 8.981 7.341 1.00 0.00 N ATOM 2030 CZ ARG B 44 5.299 10.292 7.053 1.00 0.00 C ATOM 2031 NH1 ARG B 44 5.510 10.675 5.813 1.00 0.00 N ATOM 2032 NH2 ARG B 44 5.205 11.192 8.016 1.00 0.00 N ATOM 0 H ARG B 44 0.840 6.510 7.708 1.00 0.00 H new ATOM 0 HA ARG B 44 2.821 4.598 7.187 1.00 0.00 H new ATOM 0 HB2 ARG B 44 2.732 6.864 6.219 1.00 0.00 H new ATOM 0 HB3 ARG B 44 3.045 7.563 7.795 1.00 0.00 H new ATOM 0 HG2 ARG B 44 5.265 6.377 7.823 1.00 0.00 H new ATOM 0 HG3 ARG B 44 4.948 5.824 6.190 1.00 0.00 H new ATOM 0 HD2 ARG B 44 6.305 7.778 6.059 1.00 0.00 H new ATOM 0 HD3 ARG B 44 4.705 8.186 5.470 1.00 0.00 H new ATOM 0 HE ARG B 44 5.016 8.723 8.314 1.00 0.00 H new ATOM 0 HH11 ARG B 44 5.583 9.980 5.070 1.00 0.00 H new ATOM 0 HH12 ARG B 44 5.601 11.667 5.594 1.00 0.00 H new ATOM 0 HH21 ARG B 44 5.042 10.895 8.978 1.00 0.00 H new ATOM 0 HH22 ARG B 44 5.296 12.184 7.797 1.00 0.00 H new ATOM 2046 N LYS B 45 3.010 6.036 10.159 1.00 0.00 N ATOM 2047 CA LYS B 45 3.561 5.840 11.491 1.00 0.00 C ATOM 2048 C LYS B 45 3.188 4.472 12.054 1.00 0.00 C ATOM 2049 O LYS B 45 4.009 3.810 12.692 1.00 0.00 O ATOM 2050 CB LYS B 45 3.079 6.945 12.433 1.00 0.00 C ATOM 2051 CG LYS B 45 3.646 6.861 13.844 1.00 0.00 C ATOM 2052 CD LYS B 45 3.185 8.034 14.696 1.00 0.00 C ATOM 2053 CE LYS B 45 3.732 7.940 16.112 1.00 0.00 C ATOM 2054 NZ LYS B 45 3.287 9.080 16.958 1.00 0.00 N ATOM 0 H LYS B 45 2.368 6.824 10.070 1.00 0.00 H new ATOM 0 HA LYS B 45 4.647 5.886 11.411 1.00 0.00 H new ATOM 0 HB2 LYS B 45 3.344 7.912 12.005 1.00 0.00 H new ATOM 0 HB3 LYS B 45 1.991 6.909 12.489 1.00 0.00 H new ATOM 0 HG2 LYS B 45 3.333 5.926 14.309 1.00 0.00 H new ATOM 0 HG3 LYS B 45 4.735 6.846 13.800 1.00 0.00 H new ATOM 0 HD2 LYS B 45 3.512 8.968 14.239 1.00 0.00 H new ATOM 0 HD3 LYS B 45 2.096 8.058 14.726 1.00 0.00 H new ATOM 0 HE2 LYS B 45 3.406 7.004 16.565 1.00 0.00 H new ATOM 0 HE3 LYS B 45 4.821 7.916 16.079 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 3.682 8.977 17.915 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 3.619 9.973 16.540 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 2.248 9.088 17.011 1.00 0.00 H new ATOM 2068 N ALA B 46 1.945 4.062 11.837 1.00 0.00 N ATOM 2069 CA ALA B 46 1.493 2.764 12.315 1.00 0.00 C ATOM 2070 C ALA B 46 2.302 1.653 11.688 1.00 0.00 C ATOM 2071 O ALA B 46 2.752 0.735 12.369 1.00 0.00 O ATOM 2072 CB ALA B 46 0.014 2.554 11.995 1.00 0.00 C ATOM 0 H ALA B 46 1.239 4.604 11.338 1.00 0.00 H new ATOM 0 HA ALA B 46 1.631 2.742 13.396 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -0.302 1.577 12.361 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -0.577 3.332 12.479 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -0.135 2.603 10.916 1.00 0.00 H new ATOM 2078 N LEU B 47 2.495 1.743 10.388 1.00 0.00 N ATOM 2079 CA LEU B 47 3.308 0.762 9.685 1.00 0.00 C ATOM 2080 C LEU B 47 4.748 0.776 10.192 1.00 0.00 C ATOM 2081 O LEU B 47 5.360 -0.275 10.376 1.00 0.00 O ATOM 2082 CB LEU B 47 3.285 1.042 8.177 1.00 0.00 C ATOM 2083 CG LEU B 47 1.967 0.722 7.461 1.00 0.00 C ATOM 2084 CD1 LEU B 47 2.017 1.261 6.038 1.00 0.00 C ATOM 2085 CD2 LEU B 47 1.737 -0.783 7.468 1.00 0.00 C ATOM 0 H LEU B 47 2.105 2.478 9.798 1.00 0.00 H new ATOM 0 HA LEU B 47 2.887 -0.225 9.876 1.00 0.00 H new ATOM 0 HB2 LEU B 47 3.517 2.095 8.018 1.00 0.00 H new ATOM 0 HB3 LEU B 47 4.082 0.466 7.707 1.00 0.00 H new ATOM 0 HG LEU B 47 1.136 1.199 7.980 1.00 0.00 H new ATOM 0 HD11 LEU B 47 1.080 1.033 5.530 1.00 0.00 H new ATOM 0 HD12 LEU B 47 2.163 2.341 6.063 1.00 0.00 H new ATOM 0 HD13 LEU B 47 2.844 0.795 5.501 1.00 0.00 H new ATOM 0 HD21 LEU B 47 0.800 -1.010 6.959 1.00 0.00 H new ATOM 0 HD22 LEU B 47 2.559 -1.279 6.953 1.00 0.00 H new ATOM 0 HD23 LEU B 47 1.686 -1.139 8.497 1.00 0.00 H new ATOM 2097 N MET B 48 5.272 1.970 10.415 1.00 0.00 N ATOM 2098 CA MET B 48 6.618 2.121 10.952 1.00 0.00 C ATOM 2099 C MET B 48 6.748 1.417 12.299 1.00 0.00 C ATOM 2100 O MET B 48 7.689 0.653 12.525 1.00 0.00 O ATOM 2101 CB MET B 48 6.972 3.601 11.084 1.00 0.00 C ATOM 2102 CG MET B 48 8.345 3.869 11.685 1.00 0.00 C ATOM 2103 SD MET B 48 8.655 5.625 11.956 1.00 0.00 S ATOM 2104 CE MET B 48 7.506 5.971 13.285 1.00 0.00 C ATOM 0 H MET B 48 4.788 2.849 10.233 1.00 0.00 H new ATOM 0 HA MET B 48 7.318 1.655 10.259 1.00 0.00 H new ATOM 0 HB2 MET B 48 6.924 4.063 10.098 1.00 0.00 H new ATOM 0 HB3 MET B 48 6.217 4.089 11.701 1.00 0.00 H new ATOM 0 HG2 MET B 48 8.432 3.338 12.633 1.00 0.00 H new ATOM 0 HG3 MET B 48 9.112 3.467 11.023 1.00 0.00 H new ATOM 0 HE1 MET B 48 6.755 6.682 12.941 1.00 0.00 H new ATOM 0 HE2 MET B 48 7.017 5.047 13.593 1.00 0.00 H new ATOM 0 HE3 MET B 48 8.046 6.395 14.131 1.00 0.00 H new ATOM 2114 N GLU B 49 5.795 1.671 13.186 1.00 0.00 N ATOM 2115 CA GLU B 49 5.808 1.063 14.511 1.00 0.00 C ATOM 2116 C GLU B 49 5.759 -0.462 14.421 1.00 0.00 C ATOM 2117 O GLU B 49 6.617 -1.153 14.971 1.00 0.00 O ATOM 2118 CB GLU B 49 4.628 1.575 15.341 1.00 0.00 C ATOM 2119 CG GLU B 49 4.554 1.000 16.748 1.00 0.00 C ATOM 2120 CD GLU B 49 3.401 1.546 17.543 1.00 0.00 C ATOM 2121 OE1 GLU B 49 2.709 2.399 17.041 1.00 0.00 O ATOM 2122 OE2 GLU B 49 3.211 1.110 18.654 1.00 0.00 O ATOM 0 H GLU B 49 5.005 2.292 13.013 1.00 0.00 H new ATOM 0 HA GLU B 49 6.740 1.346 15.000 1.00 0.00 H new ATOM 0 HB2 GLU B 49 4.691 2.661 15.408 1.00 0.00 H new ATOM 0 HB3 GLU B 49 3.702 1.341 14.817 1.00 0.00 H new ATOM 0 HG2 GLU B 49 4.466 -0.085 16.688 1.00 0.00 H new ATOM 0 HG3 GLU B 49 5.485 1.215 17.273 1.00 0.00 H new ATOM 2129 N VAL B 50 4.771 -0.984 13.703 1.00 0.00 N ATOM 2130 CA VAL B 50 4.590 -2.431 13.620 1.00 0.00 C ATOM 2131 C VAL B 50 5.783 -3.072 12.923 1.00 0.00 C ATOM 2132 O VAL B 50 6.312 -4.083 13.381 1.00 0.00 O ATOM 2133 CB VAL B 50 3.299 -2.771 12.852 1.00 0.00 C ATOM 2134 CG1 VAL B 50 3.212 -4.267 12.592 1.00 0.00 C ATOM 2135 CG2 VAL B 50 2.088 -2.289 13.635 1.00 0.00 C ATOM 0 H VAL B 50 4.091 -0.437 13.176 1.00 0.00 H new ATOM 0 HA VAL B 50 4.512 -2.824 14.634 1.00 0.00 H new ATOM 0 HB VAL B 50 3.317 -2.261 11.889 1.00 0.00 H new ATOM 0 HG11 VAL B 50 2.294 -4.489 12.049 1.00 0.00 H new ATOM 0 HG12 VAL B 50 4.070 -4.584 11.999 1.00 0.00 H new ATOM 0 HG13 VAL B 50 3.210 -4.802 13.542 1.00 0.00 H new ATOM 0 HG21 VAL B 50 1.179 -2.533 13.086 1.00 0.00 H new ATOM 0 HG22 VAL B 50 2.066 -2.778 14.609 1.00 0.00 H new ATOM 0 HG23 VAL B 50 2.150 -1.210 13.773 1.00 0.00 H new ATOM 2145 N LEU B 51 6.193 -2.485 11.805 1.00 0.00 N ATOM 2146 CA LEU B 51 7.295 -3.045 11.039 1.00 0.00 C ATOM 2147 C LEU B 51 8.558 -3.105 11.890 1.00 0.00 C ATOM 2148 O LEU B 51 9.164 -4.162 12.038 1.00 0.00 O ATOM 2149 CB LEU B 51 7.551 -2.206 9.780 1.00 0.00 C ATOM 2150 CG LEU B 51 8.739 -2.649 8.917 1.00 0.00 C ATOM 2151 CD1 LEU B 51 8.487 -4.055 8.387 1.00 0.00 C ATOM 2152 CD2 LEU B 51 8.933 -1.662 7.775 1.00 0.00 C ATOM 0 H LEU B 51 5.786 -1.635 11.415 1.00 0.00 H new ATOM 0 HA LEU B 51 7.025 -4.058 10.739 1.00 0.00 H new ATOM 0 HB2 LEU B 51 6.652 -2.224 9.165 1.00 0.00 H new ATOM 0 HB3 LEU B 51 7.710 -1.171 10.082 1.00 0.00 H new ATOM 0 HG LEU B 51 9.649 -2.665 9.517 1.00 0.00 H new ATOM 0 HD11 LEU B 51 9.331 -4.369 7.774 1.00 0.00 H new ATOM 0 HD12 LEU B 51 8.370 -4.744 9.224 1.00 0.00 H new ATOM 0 HD13 LEU B 51 7.579 -4.059 7.784 1.00 0.00 H new ATOM 0 HD21 LEU B 51 9.777 -1.977 7.162 1.00 0.00 H new ATOM 0 HD22 LEU B 51 8.031 -1.632 7.163 1.00 0.00 H new ATOM 0 HD23 LEU B 51 9.130 -0.670 8.181 1.00 0.00 H new ATOM 2164 N SER B 52 8.952 -1.979 12.464 1.00 0.00 N ATOM 2165 CA SER B 52 10.218 -1.921 13.179 1.00 0.00 C ATOM 2166 C SER B 52 10.153 -2.755 14.459 1.00 0.00 C ATOM 2167 O SER B 52 11.169 -3.263 14.930 1.00 0.00 O ATOM 2168 CB SER B 52 10.565 -0.483 13.512 1.00 0.00 C ATOM 2169 OG SER B 52 9.629 0.067 14.399 1.00 0.00 O ATOM 0 H SER B 52 8.424 -1.106 12.450 1.00 0.00 H new ATOM 0 HA SER B 52 10.995 -2.334 12.536 1.00 0.00 H new ATOM 0 HB2 SER B 52 11.560 -0.438 13.954 1.00 0.00 H new ATOM 0 HB3 SER B 52 10.596 0.109 12.597 1.00 0.00 H new ATOM 0 HG SER B 52 8.833 0.349 13.901 1.00 0.00 H new ATOM 2175 N LYS B 53 8.950 -2.894 15.014 1.00 0.00 N ATOM 2176 CA LYS B 53 8.745 -3.714 16.214 1.00 0.00 C ATOM 2177 C LYS B 53 9.058 -5.189 15.944 1.00 0.00 C ATOM 2178 O LYS B 53 9.823 -5.816 16.677 1.00 0.00 O ATOM 2179 CB LYS B 53 7.310 -3.567 16.723 1.00 0.00 C ATOM 2180 CG LYS B 53 7.000 -4.382 17.971 1.00 0.00 C ATOM 2181 CD LYS B 53 5.584 -4.120 18.464 1.00 0.00 C ATOM 2182 CE LYS B 53 5.265 -4.949 19.700 1.00 0.00 C ATOM 2183 NZ LYS B 53 3.885 -4.700 20.196 1.00 0.00 N ATOM 0 H LYS B 53 8.103 -2.452 14.656 1.00 0.00 H new ATOM 0 HA LYS B 53 9.433 -3.357 16.980 1.00 0.00 H new ATOM 0 HB2 LYS B 53 7.118 -2.515 16.934 1.00 0.00 H new ATOM 0 HB3 LYS B 53 6.624 -3.864 15.930 1.00 0.00 H new ATOM 0 HG2 LYS B 53 7.122 -5.443 17.755 1.00 0.00 H new ATOM 0 HG3 LYS B 53 7.713 -4.133 18.757 1.00 0.00 H new ATOM 0 HD2 LYS B 53 5.467 -3.061 18.694 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.872 -4.355 17.673 1.00 0.00 H new ATOM 0 HE2 LYS B 53 5.381 -6.007 19.467 1.00 0.00 H new ATOM 0 HE3 LYS B 53 5.981 -4.716 20.488 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 3.708 -5.284 21.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 3.781 -3.695 20.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 3.200 -4.947 19.454 1.00 0.00 H new ATOM 2197 N TYR B 54 8.444 -5.734 14.900 1.00 0.00 N ATOM 2198 CA TYR B 54 8.502 -7.170 14.634 1.00 0.00 C ATOM 2199 C TYR B 54 9.581 -7.503 13.612 1.00 0.00 C ATOM 2200 O TYR B 54 9.931 -8.669 13.432 1.00 0.00 O ATOM 2201 CB TYR B 54 7.142 -7.681 14.152 1.00 0.00 C ATOM 2202 CG TYR B 54 6.040 -7.546 15.179 1.00 0.00 C ATOM 2203 CD1 TYR B 54 5.026 -6.618 14.990 1.00 0.00 C ATOM 2204 CD2 TYR B 54 6.043 -8.350 16.309 1.00 0.00 C ATOM 2205 CE1 TYR B 54 4.019 -6.495 15.928 1.00 0.00 C ATOM 2206 CE2 TYR B 54 5.037 -8.226 17.247 1.00 0.00 C ATOM 2207 CZ TYR B 54 4.028 -7.303 17.059 1.00 0.00 C ATOM 2208 OH TYR B 54 3.025 -7.181 17.994 1.00 0.00 O ATOM 0 H TYR B 54 7.898 -5.203 14.221 1.00 0.00 H new ATOM 0 HA TYR B 54 8.757 -7.670 15.568 1.00 0.00 H new ATOM 0 HB2 TYR B 54 6.857 -7.135 13.253 1.00 0.00 H new ATOM 0 HB3 TYR B 54 7.237 -8.730 13.871 1.00 0.00 H new ATOM 0 HD1 TYR B 54 5.024 -5.992 14.110 1.00 0.00 H new ATOM 0 HD2 TYR B 54 6.832 -9.073 16.455 1.00 0.00 H new ATOM 0 HE1 TYR B 54 3.228 -5.774 15.783 1.00 0.00 H new ATOM 0 HE2 TYR B 54 5.040 -8.851 18.128 1.00 0.00 H new ATOM 0 HH TYR B 54 3.178 -7.818 18.723 1.00 0.00 H new ATOM 2218 N VAL B 55 10.101 -6.479 12.940 1.00 0.00 N ATOM 2219 CA VAL B 55 11.111 -6.675 11.892 1.00 0.00 C ATOM 2220 C VAL B 55 12.220 -5.629 12.009 1.00 0.00 C ATOM 2221 O VAL B 55 11.954 -4.428 12.049 1.00 0.00 O ATOM 2222 CB VAL B 55 10.467 -6.586 10.496 1.00 0.00 C ATOM 2223 CG1 VAL B 55 11.503 -6.846 9.413 1.00 0.00 C ATOM 2224 CG2 VAL B 55 9.318 -7.577 10.392 1.00 0.00 C ATOM 0 H VAL B 55 9.843 -5.505 13.099 1.00 0.00 H new ATOM 0 HA VAL B 55 11.542 -7.667 12.024 1.00 0.00 H new ATOM 0 HB VAL B 55 10.074 -5.580 10.352 1.00 0.00 H new ATOM 0 HG11 VAL B 55 11.030 -6.779 8.433 1.00 0.00 H new ATOM 0 HG12 VAL B 55 12.298 -6.103 9.484 1.00 0.00 H new ATOM 0 HG13 VAL B 55 11.925 -7.842 9.545 1.00 0.00 H new ATOM 0 HG21 VAL B 55 8.867 -7.509 9.402 1.00 0.00 H new ATOM 0 HG22 VAL B 55 9.694 -8.588 10.551 1.00 0.00 H new ATOM 0 HG23 VAL B 55 8.568 -7.346 11.149 1.00 0.00 H new ATOM 2234 N ASN B 56 13.465 -6.098 12.086 1.00 0.00 N ATOM 2235 CA ASN B 56 14.620 -5.208 12.237 1.00 0.00 C ATOM 2236 C ASN B 56 14.907 -4.447 10.950 1.00 0.00 C ATOM 2237 O ASN B 56 15.773 -4.836 10.175 1.00 0.00 O ATOM 2238 CB ASN B 56 15.845 -5.989 12.674 1.00 0.00 C ATOM 2239 CG ASN B 56 17.010 -5.098 13.007 1.00 0.00 C ATOM 2240 OD1 ASN B 56 16.934 -3.873 12.854 1.00 0.00 O ATOM 2241 ND2 ASN B 56 18.087 -5.689 13.460 1.00 0.00 N ATOM 0 H ASN B 56 13.702 -7.089 12.046 1.00 0.00 H new ATOM 0 HA ASN B 56 14.376 -4.479 13.010 1.00 0.00 H new ATOM 0 HB2 ASN B 56 15.594 -6.594 13.545 1.00 0.00 H new ATOM 0 HB3 ASN B 56 16.134 -6.678 11.880 1.00 0.00 H new ATOM 0 HD21 ASN B 56 18.909 -5.135 13.703 1.00 0.00 H new ATOM 0 HD22 ASN B 56 18.104 -6.703 13.570 1.00 0.00 H new ATOM 2248 N VAL B 57 14.187 -3.351 10.736 1.00 0.00 N ATOM 2249 CA VAL B 57 14.419 -2.506 9.563 1.00 0.00 C ATOM 2250 C VAL B 57 15.078 -1.196 9.977 1.00 0.00 C ATOM 2251 O VAL B 57 14.547 -0.453 10.802 1.00 0.00 O ATOM 2252 CB VAL B 57 13.093 -2.207 8.838 1.00 0.00 C ATOM 2253 CG1 VAL B 57 13.335 -1.299 7.641 1.00 0.00 C ATOM 2254 CG2 VAL B 57 12.435 -3.508 8.405 1.00 0.00 C ATOM 0 H VAL B 57 13.442 -3.026 11.353 1.00 0.00 H new ATOM 0 HA VAL B 57 15.081 -3.044 8.884 1.00 0.00 H new ATOM 0 HB VAL B 57 12.422 -1.690 9.524 1.00 0.00 H new ATOM 0 HG11 VAL B 57 12.388 -1.098 7.140 1.00 0.00 H new ATOM 0 HG12 VAL B 57 13.774 -0.360 7.979 1.00 0.00 H new ATOM 0 HG13 VAL B 57 14.017 -1.788 6.945 1.00 0.00 H new ATOM 0 HG21 VAL B 57 11.498 -3.289 7.893 1.00 0.00 H new ATOM 0 HG22 VAL B 57 13.101 -4.045 7.729 1.00 0.00 H new ATOM 0 HG23 VAL B 57 12.234 -4.124 9.282 1.00 0.00 H new ATOM 2264 N SER B 58 16.237 -0.917 9.390 1.00 0.00 N ATOM 2265 CA SER B 58 16.933 0.339 9.645 1.00 0.00 C ATOM 2266 C SER B 58 16.258 1.460 8.871 1.00 0.00 C ATOM 2267 O SER B 58 15.706 1.226 7.803 1.00 0.00 O ATOM 2268 CB SER B 58 18.391 0.231 9.247 1.00 0.00 C ATOM 2269 OG SER B 58 19.033 1.473 9.349 1.00 0.00 O ATOM 0 H SER B 58 16.712 -1.540 8.737 1.00 0.00 H new ATOM 0 HA SER B 58 16.887 0.559 10.712 1.00 0.00 H new ATOM 0 HB2 SER B 58 18.893 -0.495 9.886 1.00 0.00 H new ATOM 0 HB3 SER B 58 18.466 -0.138 8.224 1.00 0.00 H new ATOM 0 HG SER B 58 19.973 1.378 9.089 1.00 0.00 H new ATOM 2275 N LEU B 59 16.309 2.673 9.408 1.00 0.00 N ATOM 2276 CA LEU B 59 15.732 3.834 8.734 1.00 0.00 C ATOM 2277 C LEU B 59 16.391 4.047 7.366 1.00 0.00 C ATOM 2278 O LEU B 59 15.758 4.541 6.435 1.00 0.00 O ATOM 2279 CB LEU B 59 15.902 5.090 9.598 1.00 0.00 C ATOM 2280 CG LEU B 59 15.095 5.114 10.903 1.00 0.00 C ATOM 2281 CD1 LEU B 59 15.493 6.331 11.725 1.00 0.00 C ATOM 2282 CD2 LEU B 59 13.609 5.135 10.581 1.00 0.00 C ATOM 0 H LEU B 59 16.743 2.880 10.307 1.00 0.00 H new ATOM 0 HA LEU B 59 14.668 3.648 8.584 1.00 0.00 H new ATOM 0 HB2 LEU B 59 16.958 5.200 9.843 1.00 0.00 H new ATOM 0 HB3 LEU B 59 15.621 5.959 9.003 1.00 0.00 H new ATOM 0 HG LEU B 59 15.308 4.219 11.488 1.00 0.00 H new ATOM 0 HD11 LEU B 59 14.919 6.348 12.652 1.00 0.00 H new ATOM 0 HD12 LEU B 59 16.557 6.281 11.957 1.00 0.00 H new ATOM 0 HD13 LEU B 59 15.288 7.238 11.155 1.00 0.00 H new ATOM 0 HD21 LEU B 59 13.036 5.152 11.508 1.00 0.00 H new ATOM 0 HD22 LEU B 59 13.376 6.024 9.994 1.00 0.00 H new ATOM 0 HD23 LEU B 59 13.348 4.244 10.009 1.00 0.00 H new ATOM 2294 N ASP B 60 17.660 3.665 7.260 1.00 0.00 N ATOM 2295 CA ASP B 60 18.393 3.809 6.008 1.00 0.00 C ATOM 2296 C ASP B 60 17.795 2.918 4.917 1.00 0.00 C ATOM 2297 O ASP B 60 18.038 3.144 3.729 1.00 0.00 O ATOM 2298 CB ASP B 60 19.870 3.464 6.209 1.00 0.00 C ATOM 2299 CG ASP B 60 20.619 4.513 7.019 1.00 0.00 C ATOM 2300 OD1 ASP B 60 20.102 5.594 7.177 1.00 0.00 O ATOM 2301 OD2 ASP B 60 21.700 4.223 7.473 1.00 0.00 O ATOM 0 H ASP B 60 18.200 3.255 8.022 1.00 0.00 H new ATOM 0 HA ASP B 60 18.311 4.848 5.690 1.00 0.00 H new ATOM 0 HB2 ASP B 60 19.947 2.500 6.712 1.00 0.00 H new ATOM 0 HB3 ASP B 60 20.348 3.355 5.236 1.00 0.00 H new ATOM 2306 N ASN B 61 17.014 1.906 5.315 1.00 0.00 N ATOM 2307 CA ASN B 61 16.409 0.971 4.358 1.00 0.00 C ATOM 2308 C ASN B 61 14.946 1.331 4.098 1.00 0.00 C ATOM 2309 O ASN B 61 14.228 0.589 3.434 1.00 0.00 O ATOM 2310 CB ASN B 61 16.488 -0.447 4.928 1.00 0.00 C ATOM 2311 CG ASN B 61 17.942 -0.902 4.968 1.00 0.00 C ATOM 2312 OD1 ASN B 61 18.727 -0.550 4.087 1.00 0.00 O ATOM 2313 ND2 ASN B 61 18.352 -1.664 5.943 1.00 0.00 N ATOM 0 H ASN B 61 16.787 1.714 6.291 1.00 0.00 H new ATOM 0 HA ASN B 61 16.953 1.031 3.416 1.00 0.00 H new ATOM 0 HB2 ASN B 61 16.061 -0.471 5.931 1.00 0.00 H new ATOM 0 HB3 ASN B 61 15.900 -1.130 4.315 1.00 0.00 H new ATOM 0 HD21 ASN B 61 19.325 -1.970 5.977 1.00 0.00 H new ATOM 0 HD22 ASN B 61 17.700 -1.955 6.672 1.00 0.00 H new ATOM 2320 N ILE B 62 14.511 2.478 4.627 1.00 0.00 N ATOM 2321 CA ILE B 62 13.128 2.934 4.446 1.00 0.00 C ATOM 2322 C ILE B 62 13.072 4.161 3.539 1.00 0.00 C ATOM 2323 O ILE B 62 13.448 5.262 3.941 1.00 0.00 O ATOM 2324 CB ILE B 62 12.473 3.266 5.800 1.00 0.00 C ATOM 2325 CG1 ILE B 62 12.467 2.033 6.707 1.00 0.00 C ATOM 2326 CG2 ILE B 62 11.059 3.786 5.594 1.00 0.00 C ATOM 2327 CD1 ILE B 62 11.983 2.311 8.112 1.00 0.00 C ATOM 0 H ILE B 62 15.093 3.106 5.182 1.00 0.00 H new ATOM 0 HA ILE B 62 12.576 2.120 3.977 1.00 0.00 H new ATOM 0 HB ILE B 62 13.058 4.047 6.285 1.00 0.00 H new ATOM 0 HG12 ILE B 62 11.833 1.267 6.259 1.00 0.00 H new ATOM 0 HG13 ILE B 62 13.476 1.624 6.755 1.00 0.00 H new ATOM 0 HG21 ILE B 62 10.611 4.016 6.561 1.00 0.00 H new ATOM 0 HG22 ILE B 62 11.089 4.689 4.984 1.00 0.00 H new ATOM 0 HG23 ILE B 62 10.462 3.027 5.089 1.00 0.00 H new ATOM 0 HD11 ILE B 62 12.007 1.390 8.694 1.00 0.00 H new ATOM 0 HD12 ILE B 62 12.630 3.053 8.580 1.00 0.00 H new ATOM 0 HD13 ILE B 62 10.962 2.691 8.077 1.00 0.00 H new ATOM 2339 N ARG B 63 12.566 3.962 2.327 1.00 0.00 N ATOM 2340 CA ARG B 63 12.370 5.066 1.393 1.00 0.00 C ATOM 2341 C ARG B 63 10.911 5.504 1.426 1.00 0.00 C ATOM 2342 O ARG B 63 10.005 4.693 1.256 1.00 0.00 O ATOM 2343 CB ARG B 63 12.755 4.662 -0.022 1.00 0.00 C ATOM 2344 CG ARG B 63 12.570 5.748 -1.070 1.00 0.00 C ATOM 2345 CD ARG B 63 13.006 5.293 -2.415 1.00 0.00 C ATOM 2346 NE ARG B 63 12.782 6.310 -3.430 1.00 0.00 N ATOM 2347 CZ ARG B 63 13.098 6.174 -4.733 1.00 0.00 C ATOM 2348 NH1 ARG B 63 13.650 5.061 -5.162 1.00 0.00 N ATOM 2349 NH2 ARG B 63 12.854 7.160 -5.579 1.00 0.00 N ATOM 0 H ARG B 63 12.285 3.050 1.968 1.00 0.00 H new ATOM 0 HA ARG B 63 13.012 5.893 1.695 1.00 0.00 H new ATOM 0 HB2 ARG B 63 13.799 4.350 -0.024 1.00 0.00 H new ATOM 0 HB3 ARG B 63 12.162 3.794 -0.311 1.00 0.00 H new ATOM 0 HG2 ARG B 63 11.521 6.043 -1.108 1.00 0.00 H new ATOM 0 HG3 ARG B 63 13.139 6.632 -0.783 1.00 0.00 H new ATOM 0 HD2 ARG B 63 14.065 5.036 -2.386 1.00 0.00 H new ATOM 0 HD3 ARG B 63 12.465 4.386 -2.684 1.00 0.00 H new ATOM 0 HE ARG B 63 12.356 7.188 -3.135 1.00 0.00 H new ATOM 0 HH11 ARG B 63 13.839 4.301 -4.509 1.00 0.00 H new ATOM 0 HH12 ARG B 63 13.889 4.958 -6.148 1.00 0.00 H new ATOM 0 HH21 ARG B 63 12.426 8.024 -5.246 1.00 0.00 H new ATOM 0 HH22 ARG B 63 13.093 7.057 -6.565 1.00 0.00 H new ATOM 2363 N ILE B 64 10.697 6.797 1.658 1.00 0.00 N ATOM 2364 CA ILE B 64 9.350 7.365 1.722 1.00 0.00 C ATOM 2365 C ILE B 64 9.173 8.431 0.658 1.00 0.00 C ATOM 2366 O ILE B 64 9.897 9.426 0.630 1.00 0.00 O ATOM 2367 CB ILE B 64 9.063 7.972 3.108 1.00 0.00 C ATOM 2368 CG1 ILE B 64 9.197 6.903 4.195 1.00 0.00 C ATOM 2369 CG2 ILE B 64 7.677 8.597 3.138 1.00 0.00 C ATOM 2370 CD1 ILE B 64 9.149 7.453 5.602 1.00 0.00 C ATOM 0 H ILE B 64 11.444 7.476 1.806 1.00 0.00 H new ATOM 0 HA ILE B 64 8.644 6.554 1.545 1.00 0.00 H new ATOM 0 HB ILE B 64 9.796 8.755 3.303 1.00 0.00 H new ATOM 0 HG12 ILE B 64 8.397 6.172 4.073 1.00 0.00 H new ATOM 0 HG13 ILE B 64 10.138 6.372 4.055 1.00 0.00 H new ATOM 0 HG21 ILE B 64 7.490 9.021 4.125 1.00 0.00 H new ATOM 0 HG22 ILE B 64 7.617 9.385 2.387 1.00 0.00 H new ATOM 0 HG23 ILE B 64 6.929 7.834 2.924 1.00 0.00 H new ATOM 0 HD11 ILE B 64 9.250 6.636 6.316 1.00 0.00 H new ATOM 0 HD12 ILE B 64 9.965 8.162 5.744 1.00 0.00 H new ATOM 0 HD13 ILE B 64 8.197 7.959 5.763 1.00 0.00 H new ATOM 2382 N SER B 65 8.193 8.219 -0.209 1.00 0.00 N ATOM 2383 CA SER B 65 7.898 9.175 -1.264 1.00 0.00 C ATOM 2384 C SER B 65 6.406 9.479 -1.299 1.00 0.00 C ATOM 2385 O SER B 65 5.606 8.664 -1.763 1.00 0.00 O ATOM 2386 CB SER B 65 8.353 8.637 -2.607 1.00 0.00 C ATOM 2387 OG SER B 65 8.037 9.529 -3.639 1.00 0.00 O ATOM 0 H SER B 65 7.591 7.396 -0.202 1.00 0.00 H new ATOM 0 HA SER B 65 8.439 10.098 -1.056 1.00 0.00 H new ATOM 0 HB2 SER B 65 9.429 8.464 -2.588 1.00 0.00 H new ATOM 0 HB3 SER B 65 7.879 7.674 -2.796 1.00 0.00 H new ATOM 0 HG SER B 65 8.342 9.161 -4.495 1.00 0.00 H new ATOM 2393 N GLN B 66 6.037 10.656 -0.799 1.00 0.00 N ATOM 2394 CA GLN B 66 4.640 11.073 -0.786 1.00 0.00 C ATOM 2395 C GLN B 66 4.385 12.097 -1.883 1.00 0.00 C ATOM 2396 O GLN B 66 4.914 13.207 -1.846 1.00 0.00 O ATOM 2397 CB GLN B 66 4.258 11.656 0.578 1.00 0.00 C ATOM 2398 CG GLN B 66 2.795 12.045 0.701 1.00 0.00 C ATOM 2399 CD GLN B 66 2.453 12.579 2.079 1.00 0.00 C ATOM 2400 OE1 GLN B 66 3.151 12.303 3.059 1.00 0.00 O ATOM 2401 NE2 GLN B 66 1.374 13.349 2.163 1.00 0.00 N ATOM 0 H GLN B 66 6.685 11.335 -0.399 1.00 0.00 H new ATOM 0 HA GLN B 66 4.021 10.195 -0.970 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.494 10.926 1.352 1.00 0.00 H new ATOM 0 HB3 GLN B 66 4.873 12.535 0.770 1.00 0.00 H new ATOM 0 HG2 GLN B 66 2.559 12.801 -0.048 1.00 0.00 H new ATOM 0 HG3 GLN B 66 2.172 11.177 0.486 1.00 0.00 H new ATOM 0 HE21 GLN B 66 0.826 13.552 1.327 1.00 0.00 H new ATOM 0 HE22 GLN B 66 1.094 13.738 3.063 1.00 0.00 H new ATOM 2410 N GLU B 67 3.555 11.719 -2.853 1.00 0.00 N ATOM 2411 CA GLU B 67 3.251 12.597 -3.982 1.00 0.00 C ATOM 2412 C GLU B 67 1.751 12.870 -4.047 1.00 0.00 C ATOM 2413 O GLU B 67 0.987 12.383 -3.216 1.00 0.00 O ATOM 2414 CB GLU B 67 3.729 11.975 -5.296 1.00 0.00 C ATOM 2415 CG GLU B 67 5.232 11.752 -5.375 1.00 0.00 C ATOM 2416 CD GLU B 67 6.011 13.036 -5.440 1.00 0.00 C ATOM 2417 OE1 GLU B 67 5.441 14.038 -5.799 1.00 0.00 O ATOM 2418 OE2 GLU B 67 7.179 13.015 -5.129 1.00 0.00 O ATOM 0 H GLU B 67 3.083 10.815 -2.881 1.00 0.00 H new ATOM 0 HA GLU B 67 3.778 13.540 -3.835 1.00 0.00 H new ATOM 0 HB2 GLU B 67 3.224 11.019 -5.436 1.00 0.00 H new ATOM 0 HB3 GLU B 67 3.426 12.620 -6.121 1.00 0.00 H new ATOM 0 HG2 GLU B 67 5.556 11.180 -4.505 1.00 0.00 H new ATOM 0 HG3 GLU B 67 5.459 11.150 -6.255 1.00 0.00 H new ATOM 2425 N LYS B 68 1.337 13.654 -5.042 1.00 0.00 N ATOM 2426 CA LYS B 68 -0.081 13.966 -5.234 1.00 0.00 C ATOM 2427 C LYS B 68 -0.544 13.529 -6.617 1.00 0.00 C ATOM 2428 O LYS B 68 0.240 13.513 -7.567 1.00 0.00 O ATOM 2429 CB LYS B 68 -0.338 15.461 -5.041 1.00 0.00 C ATOM 2430 CG LYS B 68 0.373 16.358 -6.047 1.00 0.00 C ATOM 2431 CD LYS B 68 0.103 17.828 -5.763 1.00 0.00 C ATOM 2432 CE LYS B 68 0.765 18.723 -6.802 1.00 0.00 C ATOM 2433 NZ LYS B 68 0.517 20.165 -6.532 1.00 0.00 N ATOM 0 H LYS B 68 1.960 14.084 -5.726 1.00 0.00 H new ATOM 0 HA LYS B 68 -0.652 13.417 -4.485 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -1.411 15.644 -5.104 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -0.025 15.744 -4.036 1.00 0.00 H new ATOM 0 HG2 LYS B 68 1.446 16.169 -6.011 1.00 0.00 H new ATOM 0 HG3 LYS B 68 0.040 16.113 -7.055 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -0.972 18.008 -5.757 1.00 0.00 H new ATOM 0 HD3 LYS B 68 0.474 18.083 -4.771 1.00 0.00 H new ATOM 0 HE2 LYS B 68 1.839 18.535 -6.812 1.00 0.00 H new ATOM 0 HE3 LYS B 68 0.388 18.469 -7.793 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 0.984 20.740 -7.262 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -0.506 20.350 -6.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 0.899 20.414 -5.597 1.00 0.00 H new ATOM 2447 N GLN B 69 -1.819 13.170 -6.725 1.00 0.00 N ATOM 2448 CA GLN B 69 -2.382 12.767 -8.005 1.00 0.00 C ATOM 2449 C GLN B 69 -3.785 13.341 -8.173 1.00 0.00 C ATOM 2450 O GLN B 69 -4.759 12.787 -7.663 1.00 0.00 O ATOM 2451 CB GLN B 69 -2.417 11.240 -8.122 1.00 0.00 C ATOM 2452 CG GLN B 69 -2.987 10.730 -9.434 1.00 0.00 C ATOM 2453 CD GLN B 69 -2.062 10.989 -10.607 1.00 0.00 C ATOM 2454 OE1 GLN B 69 -0.870 10.671 -10.558 1.00 0.00 O ATOM 2455 NE2 GLN B 69 -2.604 11.570 -11.671 1.00 0.00 N ATOM 0 H GLN B 69 -2.477 13.150 -5.946 1.00 0.00 H new ATOM 0 HA GLN B 69 -1.746 13.160 -8.798 1.00 0.00 H new ATOM 0 HB2 GLN B 69 -1.404 10.854 -8.004 1.00 0.00 H new ATOM 0 HB3 GLN B 69 -3.009 10.837 -7.300 1.00 0.00 H new ATOM 0 HG2 GLN B 69 -3.175 9.659 -9.353 1.00 0.00 H new ATOM 0 HG3 GLN B 69 -3.948 11.210 -9.620 1.00 0.00 H new ATOM 0 HE21 GLN B 69 -3.594 11.816 -11.669 1.00 0.00 H new ATOM 0 HE22 GLN B 69 -2.030 11.770 -12.490 1.00 0.00 H new ATOM 2464 N ASP B 70 -3.879 14.456 -8.890 1.00 0.00 N ATOM 2465 CA ASP B 70 -5.173 15.064 -9.178 1.00 0.00 C ATOM 2466 C ASP B 70 -5.924 15.379 -7.879 1.00 0.00 C ATOM 2467 O ASP B 70 -5.538 16.279 -7.135 1.00 0.00 O ATOM 2468 CB ASP B 70 -6.016 14.138 -10.059 1.00 0.00 C ATOM 2469 CG ASP B 70 -5.378 13.868 -11.415 1.00 0.00 C ATOM 2470 OD1 ASP B 70 -4.877 14.792 -12.009 1.00 0.00 O ATOM 2471 OD2 ASP B 70 -5.399 12.739 -11.844 1.00 0.00 O ATOM 0 H ASP B 70 -3.079 14.955 -9.280 1.00 0.00 H new ATOM 0 HA ASP B 70 -4.998 15.997 -9.714 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -6.169 13.192 -9.540 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -7.000 14.583 -10.208 1.00 0.00 H new ATOM 2476 N GLY B 71 -7.000 14.632 -7.615 1.00 0.00 N ATOM 2477 CA GLY B 71 -7.869 14.905 -6.465 1.00 0.00 C ATOM 2478 C GLY B 71 -7.618 13.903 -5.341 1.00 0.00 C ATOM 2479 O GLY B 71 -8.490 13.664 -4.504 1.00 0.00 O ATOM 0 H GLY B 71 -7.290 13.835 -8.181 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -7.690 15.917 -6.102 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -8.913 14.857 -6.774 1.00 0.00 H new ATOM 2483 N MET B 72 -6.419 13.318 -5.334 1.00 0.00 N ATOM 2484 CA MET B 72 -6.012 12.408 -4.259 1.00 0.00 C ATOM 2485 C MET B 72 -4.507 12.476 -4.043 1.00 0.00 C ATOM 2486 O MET B 72 -3.775 13.036 -4.857 1.00 0.00 O ATOM 2487 CB MET B 72 -6.442 10.978 -4.577 1.00 0.00 C ATOM 2488 CG MET B 72 -5.750 10.366 -5.787 1.00 0.00 C ATOM 2489 SD MET B 72 -6.364 8.716 -6.180 1.00 0.00 S ATOM 2490 CE MET B 72 -7.974 9.109 -6.860 1.00 0.00 C ATOM 0 H MET B 72 -5.714 13.457 -6.058 1.00 0.00 H new ATOM 0 HA MET B 72 -6.506 12.720 -3.339 1.00 0.00 H new ATOM 0 HB2 MET B 72 -6.247 10.351 -3.707 1.00 0.00 H new ATOM 0 HB3 MET B 72 -7.519 10.964 -4.745 1.00 0.00 H new ATOM 0 HG2 MET B 72 -5.892 11.017 -6.650 1.00 0.00 H new ATOM 0 HG3 MET B 72 -4.677 10.315 -5.600 1.00 0.00 H new ATOM 0 HE1 MET B 72 -8.250 8.358 -7.600 1.00 0.00 H new ATOM 0 HE2 MET B 72 -8.714 9.119 -6.060 1.00 0.00 H new ATOM 0 HE3 MET B 72 -7.939 10.090 -7.334 1.00 0.00 H new ATOM 2500 N ASP B 73 -4.052 11.895 -2.935 1.00 0.00 N ATOM 2501 CA ASP B 73 -2.621 11.740 -2.674 1.00 0.00 C ATOM 2502 C ASP B 73 -2.193 10.311 -2.978 1.00 0.00 C ATOM 2503 O ASP B 73 -3.031 9.413 -3.087 1.00 0.00 O ATOM 2504 CB ASP B 73 -2.287 12.087 -1.222 1.00 0.00 C ATOM 2505 CG ASP B 73 -2.452 13.570 -0.914 1.00 0.00 C ATOM 2506 OD1 ASP B 73 -2.434 14.353 -1.834 1.00 0.00 O ATOM 2507 OD2 ASP B 73 -2.593 13.904 0.237 1.00 0.00 O ATOM 0 H ASP B 73 -4.655 11.523 -2.201 1.00 0.00 H new ATOM 0 HA ASP B 73 -2.078 12.428 -3.322 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -2.931 11.509 -0.558 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -1.260 11.789 -1.009 1.00 0.00 H new ATOM 2512 N VAL B 74 -0.887 10.097 -3.107 1.00 0.00 N ATOM 2513 CA VAL B 74 -0.343 8.749 -3.251 1.00 0.00 C ATOM 2514 C VAL B 74 0.963 8.616 -2.483 1.00 0.00 C ATOM 2515 O VAL B 74 1.858 9.452 -2.620 1.00 0.00 O ATOM 2516 CB VAL B 74 -0.100 8.418 -4.735 1.00 0.00 C ATOM 2517 CG1 VAL B 74 0.870 9.415 -5.351 1.00 0.00 C ATOM 2518 CG2 VAL B 74 0.427 6.998 -4.870 1.00 0.00 C ATOM 0 H VAL B 74 -0.186 10.838 -3.115 1.00 0.00 H new ATOM 0 HA VAL B 74 -1.071 8.048 -2.844 1.00 0.00 H new ATOM 0 HB VAL B 74 -1.045 8.491 -5.273 1.00 0.00 H new ATOM 0 HG11 VAL B 74 1.030 9.166 -6.400 1.00 0.00 H new ATOM 0 HG12 VAL B 74 0.455 10.420 -5.276 1.00 0.00 H new ATOM 0 HG13 VAL B 74 1.820 9.374 -4.819 1.00 0.00 H new ATOM 0 HG21 VAL B 74 0.596 6.771 -5.923 1.00 0.00 H new ATOM 0 HG22 VAL B 74 1.365 6.905 -4.323 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -0.302 6.299 -4.461 1.00 0.00 H new ATOM 2528 N LEU B 75 1.070 7.568 -1.662 1.00 0.00 N ATOM 2529 CA LEU B 75 2.278 7.350 -0.857 1.00 0.00 C ATOM 2530 C LEU B 75 2.945 6.040 -1.261 1.00 0.00 C ATOM 2531 O LEU B 75 2.333 4.972 -1.214 1.00 0.00 O ATOM 2532 CB LEU B 75 1.933 7.323 0.638 1.00 0.00 C ATOM 2533 CG LEU B 75 3.087 6.954 1.579 1.00 0.00 C ATOM 2534 CD1 LEU B 75 4.165 8.027 1.506 1.00 0.00 C ATOM 2535 CD2 LEU B 75 2.558 6.807 2.998 1.00 0.00 C ATOM 0 H LEU B 75 0.344 6.863 -1.537 1.00 0.00 H new ATOM 0 HA LEU B 75 2.968 8.174 -1.039 1.00 0.00 H new ATOM 0 HB2 LEU B 75 1.556 8.305 0.923 1.00 0.00 H new ATOM 0 HB3 LEU B 75 1.121 6.612 0.792 1.00 0.00 H new ATOM 0 HG LEU B 75 3.526 6.004 1.275 1.00 0.00 H new ATOM 0 HD11 LEU B 75 4.985 7.765 2.175 1.00 0.00 H new ATOM 0 HD12 LEU B 75 4.538 8.099 0.484 1.00 0.00 H new ATOM 0 HD13 LEU B 75 3.744 8.987 1.807 1.00 0.00 H new ATOM 0 HD21 LEU B 75 3.378 6.545 3.667 1.00 0.00 H new ATOM 0 HD22 LEU B 75 2.114 7.749 3.320 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.802 6.022 3.025 1.00 0.00 H new ATOM 2547 N GLU B 76 4.214 6.143 -1.646 1.00 0.00 N ATOM 2548 CA GLU B 76 4.989 4.975 -2.046 1.00 0.00 C ATOM 2549 C GLU B 76 6.055 4.696 -0.997 1.00 0.00 C ATOM 2550 O GLU B 76 6.872 5.567 -0.680 1.00 0.00 O ATOM 2551 CB GLU B 76 5.637 5.190 -3.415 1.00 0.00 C ATOM 2552 CG GLU B 76 6.440 4.002 -3.924 1.00 0.00 C ATOM 2553 CD GLU B 76 6.999 4.219 -5.303 1.00 0.00 C ATOM 2554 OE1 GLU B 76 6.682 5.220 -5.900 1.00 0.00 O ATOM 2555 OE2 GLU B 76 7.742 3.385 -5.760 1.00 0.00 O ATOM 0 H GLU B 76 4.726 7.024 -1.689 1.00 0.00 H new ATOM 0 HA GLU B 76 4.320 4.118 -2.124 1.00 0.00 H new ATOM 0 HB2 GLU B 76 4.857 5.423 -4.140 1.00 0.00 H new ATOM 0 HB3 GLU B 76 6.292 6.059 -3.361 1.00 0.00 H new ATOM 0 HG2 GLU B 76 7.259 3.801 -3.233 1.00 0.00 H new ATOM 0 HG3 GLU B 76 5.804 3.117 -3.931 1.00 0.00 H new ATOM 2562 N LEU B 77 6.031 3.481 -0.450 1.00 0.00 N ATOM 2563 CA LEU B 77 7.050 3.042 0.504 1.00 0.00 C ATOM 2564 C LEU B 77 7.866 1.907 -0.095 1.00 0.00 C ATOM 2565 O LEU B 77 7.319 1.003 -0.726 1.00 0.00 O ATOM 2566 CB LEU B 77 6.401 2.584 1.817 1.00 0.00 C ATOM 2567 CG LEU B 77 5.465 3.598 2.486 1.00 0.00 C ATOM 2568 CD1 LEU B 77 4.803 2.955 3.697 1.00 0.00 C ATOM 2569 CD2 LEU B 77 6.256 4.834 2.885 1.00 0.00 C ATOM 0 H LEU B 77 5.316 2.782 -0.651 1.00 0.00 H new ATOM 0 HA LEU B 77 7.709 3.884 0.719 1.00 0.00 H new ATOM 0 HB2 LEU B 77 5.838 1.671 1.623 1.00 0.00 H new ATOM 0 HB3 LEU B 77 7.192 2.328 2.522 1.00 0.00 H new ATOM 0 HG LEU B 77 4.684 3.902 1.789 1.00 0.00 H new ATOM 0 HD11 LEU B 77 4.138 3.675 4.173 1.00 0.00 H new ATOM 0 HD12 LEU B 77 4.228 2.085 3.379 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.569 2.644 4.408 1.00 0.00 H new ATOM 0 HD21 LEU B 77 5.590 5.554 3.360 1.00 0.00 H new ATOM 0 HD22 LEU B 77 7.044 4.552 3.584 1.00 0.00 H new ATOM 0 HD23 LEU B 77 6.702 5.283 1.997 1.00 0.00 H new ATOM 2581 N ASN B 78 9.182 1.956 0.117 1.00 0.00 N ATOM 2582 CA ASN B 78 10.082 0.922 -0.385 1.00 0.00 C ATOM 2583 C ASN B 78 11.009 0.457 0.731 1.00 0.00 C ATOM 2584 O ASN B 78 11.891 1.200 1.159 1.00 0.00 O ATOM 2585 CB ASN B 78 10.877 1.421 -1.577 1.00 0.00 C ATOM 2586 CG ASN B 78 11.697 0.337 -2.219 1.00 0.00 C ATOM 2587 OD1 ASN B 78 12.334 -0.467 -1.530 1.00 0.00 O ATOM 2588 ND2 ASN B 78 11.696 0.301 -3.527 1.00 0.00 N ATOM 0 H ASN B 78 9.647 2.703 0.634 1.00 0.00 H new ATOM 0 HA ASN B 78 9.485 0.075 -0.722 1.00 0.00 H new ATOM 0 HB2 ASN B 78 10.193 1.840 -2.315 1.00 0.00 H new ATOM 0 HB3 ASN B 78 11.535 2.229 -1.258 1.00 0.00 H new ATOM 0 HD21 ASN B 78 12.236 -0.411 -4.018 1.00 0.00 H new ATOM 0 HD22 ASN B 78 11.155 0.985 -4.056 1.00 0.00 H new ATOM 2595 N ILE B 79 10.804 -0.766 1.214 1.00 0.00 N ATOM 2596 CA ILE B 79 11.540 -1.273 2.374 1.00 0.00 C ATOM 2597 C ILE B 79 12.556 -2.318 1.931 1.00 0.00 C ATOM 2598 O ILE B 79 12.207 -3.280 1.256 1.00 0.00 O ATOM 2599 CB ILE B 79 10.587 -1.886 3.417 1.00 0.00 C ATOM 2600 CG1 ILE B 79 9.455 -0.907 3.744 1.00 0.00 C ATOM 2601 CG2 ILE B 79 11.350 -2.262 4.678 1.00 0.00 C ATOM 2602 CD1 ILE B 79 9.930 0.404 4.327 1.00 0.00 C ATOM 0 H ILE B 79 10.134 -1.427 0.821 1.00 0.00 H new ATOM 0 HA ILE B 79 12.058 -0.432 2.836 1.00 0.00 H new ATOM 0 HB ILE B 79 10.149 -2.792 2.998 1.00 0.00 H new ATOM 0 HG12 ILE B 79 8.888 -0.705 2.835 1.00 0.00 H new ATOM 0 HG13 ILE B 79 8.771 -1.380 4.448 1.00 0.00 H new ATOM 0 HG21 ILE B 79 10.662 -2.694 5.405 1.00 0.00 H new ATOM 0 HG22 ILE B 79 12.122 -2.991 4.432 1.00 0.00 H new ATOM 0 HG23 ILE B 79 11.814 -1.371 5.102 1.00 0.00 H new ATOM 0 HD11 ILE B 79 9.071 1.043 4.532 1.00 0.00 H new ATOM 0 HD12 ILE B 79 10.471 0.215 5.254 1.00 0.00 H new ATOM 0 HD13 ILE B 79 10.591 0.900 3.616 1.00 0.00 H new ATOM 2614 N THR B 80 13.815 -2.138 2.324 1.00 0.00 N ATOM 2615 CA THR B 80 14.836 -3.155 2.080 1.00 0.00 C ATOM 2616 C THR B 80 15.081 -3.930 3.367 1.00 0.00 C ATOM 2617 O THR B 80 15.292 -3.334 4.425 1.00 0.00 O ATOM 2618 CB THR B 80 16.153 -2.535 1.578 1.00 0.00 C ATOM 2619 OG1 THR B 80 15.922 -1.855 0.337 1.00 0.00 O ATOM 2620 CG2 THR B 80 17.206 -3.612 1.372 1.00 0.00 C ATOM 0 H THR B 80 14.151 -1.306 2.808 1.00 0.00 H new ATOM 0 HA THR B 80 14.475 -3.825 1.300 1.00 0.00 H new ATOM 0 HB THR B 80 16.512 -1.829 2.327 1.00 0.00 H new ATOM 0 HG1 THR B 80 16.761 -1.460 0.020 1.00 0.00 H new ATOM 0 HG21 THR B 80 18.130 -3.155 1.017 1.00 0.00 H new ATOM 0 HG22 THR B 80 17.394 -4.123 2.316 1.00 0.00 H new ATOM 0 HG23 THR B 80 16.851 -4.332 0.634 1.00 0.00 H new ATOM 2628 N LEU B 81 15.038 -5.253 3.289 1.00 0.00 N ATOM 2629 CA LEU B 81 15.286 -6.075 4.464 1.00 0.00 C ATOM 2630 C LEU B 81 16.291 -7.190 4.129 1.00 0.00 C ATOM 2631 O LEU B 81 16.024 -8.002 3.226 1.00 0.00 O ATOM 2632 CB LEU B 81 13.973 -6.680 4.975 1.00 0.00 C ATOM 2633 CG LEU B 81 14.103 -7.651 6.156 1.00 0.00 C ATOM 2634 CD1 LEU B 81 14.591 -6.896 7.384 1.00 0.00 C ATOM 2635 CD2 LEU B 81 12.758 -8.313 6.419 1.00 0.00 C ATOM 2636 OXT LEU B 81 17.321 -7.272 4.738 1.00 0.00 O ATOM 0 H LEU B 81 14.836 -5.774 2.436 1.00 0.00 H new ATOM 0 HA LEU B 81 15.709 -5.447 5.248 1.00 0.00 H new ATOM 0 HB2 LEU B 81 13.310 -5.867 5.269 1.00 0.00 H new ATOM 0 HB3 LEU B 81 13.490 -7.203 4.150 1.00 0.00 H new ATOM 0 HG LEU B 81 14.829 -8.429 5.921 1.00 0.00 H new ATOM 0 HD11 LEU B 81 14.683 -7.586 8.223 1.00 0.00 H new ATOM 0 HD12 LEU B 81 15.562 -6.449 7.174 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.877 -6.112 7.636 1.00 0.00 H new ATOM 0 HD21 LEU B 81 12.850 -9.003 7.258 1.00 0.00 H new ATOM 0 HD22 LEU B 81 12.017 -7.550 6.656 1.00 0.00 H new ATOM 0 HD23 LEU B 81 12.443 -8.861 5.531 1.00 0.00 H new TER 2648 LEU B 81