USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 985 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 236 HIS : no HD1:sc= 0.153 K(o=0.31,f=-1.4) USER MOD Set 1.2: B 238 SER OG : rot -89:sc= 0.161 USER MOD Set 2.1: A 85 THR OG1 : rot 128:sc= 1.07 USER MOD Set 2.2: A 106 HIS : no HE2:sc= 0.853 K(o=1.9,f=-1) USER MOD Single : A 25 ASN : amide:sc= -0.733 K(o=-0.73,f=-7.2!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0529) USER MOD Single : A 30 ASN : amide:sc= -0.374 K(o=-0.37,f=-2.9!) USER MOD Single : A 32 TYR OH : rot 30:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0.833 K(o=0.83,f=-1.2) USER MOD Single : A 39 ASN : amide:sc= -0.191 K(o=-0.19,f=-2.9!) USER MOD Single : A 43 THR OG1 : rot -56:sc= 1.18 USER MOD Single : A 49 THR OG1 : rot -52:sc= 0.735 USER MOD Single : A 52 SER OG : rot 61:sc= -0.156 USER MOD Single : A 54 TYR OH : rot 21:sc= 1.23 USER MOD Single : A 63 SER OG : rot 168:sc= 0.832 USER MOD Single : A 67 ASN : amide:sc= 1.15 K(o=1.2,f=-0.13) USER MOD Single : A 68 THR OG1 : rot -81:sc= 0.482 USER MOD Single : A 71 SER OG : rot -157:sc= 0.0828 USER MOD Single : A 72 GLN : amide:sc= -1.75! C(o=-1.8!,f=-1.9!) USER MOD Single : A 76 TYR OH : rot -2:sc= 0.965 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot -13:sc= -0.0221 USER MOD Single : A 82 GLN :FLIP amide:sc= -1.73 F(o=-2.2!,f=-1.7) USER MOD Single : A 84 SER OG : rot 171:sc= -2.42! USER MOD Single : A 91 ASN : amide:sc= -0.448 K(o=-0.45,f=-1.4) USER MOD Single : A 93 ASN : amide:sc= 0.294 X(o=0.29,f=-0.14) USER MOD Single : A 96 LYS NZ :NH3+ -170:sc= 1.25 (180deg=1.17) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 170:sc= 1.09 (180deg=0.855) USER MOD Single : B 222 ASN : amide:sc= -0.403 X(o=-0.4,f=-0.43) USER MOD Single : B 227 MET CE :methyl 135:sc= -0.0905 (180deg=-0.614) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 239 ASN : amide:sc= -2.23! C(o=-2.2!,f=-6.5!) USER MOD Single : B 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 248 LYS NZ :NH3+ -144:sc= -1.18 (180deg=-3.32!) USER MOD Single : B 249 GLN :FLIP amide:sc= -2.42! C(o=-3.8!,f=-2.4!) USER MOD Single : B 250 ASN : amide:sc= 1.01 K(o=1,f=-0.28) USER MOD Single : B 253 ASN : amide:sc= -0.0464 X(o=-0.046,f=-0.13) USER MOD Single : B 255 LYS NZ :NH3+ -165:sc= 1.28 (180deg=1.03) USER MOD Single : B 256 LYS NZ :NH3+ -158:sc= 1.3 (180deg=0.675) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 25 2.430 16.323 3.151 1.00 0.00 N ATOM 2 CA ASN A 25 3.615 17.171 3.302 1.00 0.00 C ATOM 3 C ASN A 25 4.853 16.427 2.805 1.00 0.00 C ATOM 4 O ASN A 25 5.169 15.333 3.277 1.00 0.00 O ATOM 5 CB ASN A 25 3.790 17.595 4.763 1.00 0.00 C ATOM 6 CG ASN A 25 4.998 18.478 4.979 1.00 0.00 C ATOM 7 OD1 ASN A 25 6.085 17.996 5.255 1.00 0.00 O ATOM 8 ND2 ASN A 25 4.822 19.762 4.843 1.00 0.00 N ATOM 0 HA ASN A 25 3.483 18.071 2.702 1.00 0.00 H new ATOM 0 HB2 ASN A 25 2.896 18.124 5.092 1.00 0.00 H new ATOM 0 HB3 ASN A 25 3.881 16.705 5.386 1.00 0.00 H new ATOM 0 HD21 ASN A 25 5.608 20.400 4.968 1.00 0.00 H new ATOM 0 HD22 ASN A 25 3.899 20.129 4.612 1.00 0.00 H new ATOM 17 N GLU A 26 5.585 17.048 1.902 1.00 0.00 N ATOM 18 CA GLU A 26 6.713 16.412 1.209 1.00 0.00 C ATOM 19 C GLU A 26 7.952 16.305 2.070 1.00 0.00 C ATOM 20 O GLU A 26 8.925 15.636 1.712 1.00 0.00 O ATOM 21 CB GLU A 26 7.042 17.188 -0.044 1.00 0.00 C ATOM 22 CG GLU A 26 5.886 17.287 -0.998 1.00 0.00 C ATOM 23 CD GLU A 26 6.284 17.885 -2.305 1.00 0.00 C ATOM 24 OE1 GLU A 26 6.846 17.163 -3.140 1.00 0.00 O ATOM 25 OE2 GLU A 26 6.070 19.098 -2.523 1.00 0.00 O ATOM 0 H GLU A 26 5.422 18.014 1.619 1.00 0.00 H new ATOM 0 HA GLU A 26 6.401 15.397 0.964 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.364 18.192 0.232 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.882 16.711 -0.549 1.00 0.00 H new ATOM 0 HG2 GLU A 26 5.470 16.294 -1.166 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.097 17.891 -0.549 1.00 0.00 H new ATOM 32 N TYR A 27 7.916 16.946 3.188 1.00 0.00 N ATOM 33 CA TYR A 27 9.036 16.978 4.102 1.00 0.00 C ATOM 34 C TYR A 27 8.867 15.924 5.178 1.00 0.00 C ATOM 35 O TYR A 27 9.611 15.883 6.152 1.00 0.00 O ATOM 36 CB TYR A 27 9.173 18.377 4.714 1.00 0.00 C ATOM 37 CG TYR A 27 9.546 19.452 3.712 1.00 0.00 C ATOM 38 CD1 TYR A 27 8.604 19.972 2.838 1.00 0.00 C ATOM 39 CD2 TYR A 27 10.842 19.937 3.637 1.00 0.00 C ATOM 40 CE1 TYR A 27 8.939 20.941 1.923 1.00 0.00 C ATOM 41 CE2 TYR A 27 11.186 20.910 2.719 1.00 0.00 C ATOM 42 CZ TYR A 27 10.228 21.407 1.866 1.00 0.00 C ATOM 43 OH TYR A 27 10.567 22.372 0.941 1.00 0.00 O ATOM 0 H TYR A 27 7.104 17.473 3.509 1.00 0.00 H new ATOM 0 HA TYR A 27 9.951 16.754 3.554 1.00 0.00 H new ATOM 0 HB2 TYR A 27 8.231 18.649 5.190 1.00 0.00 H new ATOM 0 HB3 TYR A 27 9.929 18.347 5.499 1.00 0.00 H new ATOM 0 HD1 TYR A 27 7.588 19.609 2.877 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.595 19.548 4.307 1.00 0.00 H new ATOM 0 HE1 TYR A 27 8.190 21.334 1.251 1.00 0.00 H new ATOM 0 HE2 TYR A 27 12.200 21.278 2.671 1.00 0.00 H new ATOM 0 HH TYR A 27 11.517 22.593 1.033 1.00 0.00 H new ATOM 53 N LYS A 28 7.896 15.064 4.985 1.00 0.00 N ATOM 54 CA LYS A 28 7.624 13.995 5.906 1.00 0.00 C ATOM 55 C LYS A 28 7.616 12.672 5.170 1.00 0.00 C ATOM 56 O LYS A 28 7.452 12.631 3.943 1.00 0.00 O ATOM 57 CB LYS A 28 6.274 14.204 6.607 1.00 0.00 C ATOM 58 CG LYS A 28 6.204 15.383 7.541 1.00 0.00 C ATOM 59 CD LYS A 28 7.144 15.219 8.710 1.00 0.00 C ATOM 60 CE LYS A 28 6.935 16.305 9.737 1.00 0.00 C ATOM 61 NZ LYS A 28 7.226 17.654 9.210 1.00 0.00 N ATOM 0 H LYS A 28 7.271 15.089 4.179 1.00 0.00 H new ATOM 0 HA LYS A 28 8.409 13.988 6.663 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.503 14.320 5.845 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.033 13.302 7.170 1.00 0.00 H new ATOM 0 HG2 LYS A 28 6.453 16.294 6.997 1.00 0.00 H new ATOM 0 HG3 LYS A 28 5.184 15.499 7.907 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.988 14.244 9.171 1.00 0.00 H new ATOM 0 HD3 LYS A 28 8.175 15.243 8.357 1.00 0.00 H new ATOM 0 HE2 LYS A 28 5.904 16.272 10.089 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.573 16.111 10.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 7.148 18.351 9.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 8.190 17.674 8.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 6.545 17.888 8.460 1.00 0.00 H new ATOM 75 N ASP A 29 7.769 11.600 5.904 1.00 0.00 N ATOM 76 CA ASP A 29 7.749 10.245 5.338 1.00 0.00 C ATOM 77 C ASP A 29 6.555 9.492 5.892 1.00 0.00 C ATOM 78 O ASP A 29 6.459 8.277 5.814 1.00 0.00 O ATOM 79 CB ASP A 29 9.071 9.488 5.603 1.00 0.00 C ATOM 80 CG ASP A 29 9.333 9.133 7.052 1.00 0.00 C ATOM 81 OD1 ASP A 29 9.075 9.963 7.941 1.00 0.00 O ATOM 82 OD2 ASP A 29 9.884 8.041 7.318 1.00 0.00 O ATOM 0 H ASP A 29 7.912 11.625 6.914 1.00 0.00 H new ATOM 0 HA ASP A 29 7.654 10.320 4.255 1.00 0.00 H new ATOM 0 HB2 ASP A 29 9.069 8.570 5.016 1.00 0.00 H new ATOM 0 HB3 ASP A 29 9.899 10.097 5.240 1.00 0.00 H new ATOM 87 N ASN A 30 5.587 10.275 6.335 1.00 0.00 N ATOM 88 CA ASN A 30 4.300 9.814 6.918 1.00 0.00 C ATOM 89 C ASN A 30 3.357 9.302 5.822 1.00 0.00 C ATOM 90 O ASN A 30 2.136 9.350 5.964 1.00 0.00 O ATOM 91 CB ASN A 30 3.580 10.998 7.606 1.00 0.00 C ATOM 92 CG ASN A 30 4.323 11.634 8.781 1.00 0.00 C ATOM 93 OD1 ASN A 30 5.556 11.654 8.837 1.00 0.00 O ATOM 94 ND2 ASN A 30 3.582 12.186 9.705 1.00 0.00 N ATOM 0 H ASN A 30 5.660 11.292 6.306 1.00 0.00 H new ATOM 0 HA ASN A 30 4.530 9.019 7.628 1.00 0.00 H new ATOM 0 HB2 ASN A 30 3.392 11.769 6.859 1.00 0.00 H new ATOM 0 HB3 ASN A 30 2.608 10.653 7.959 1.00 0.00 H new ATOM 0 HD21 ASN A 30 4.020 12.650 10.501 1.00 0.00 H new ATOM 0 HD22 ASN A 30 2.565 12.153 9.631 1.00 0.00 H new ATOM 101 N ALA A 31 3.923 8.773 4.770 1.00 0.00 N ATOM 102 CA ALA A 31 3.171 8.327 3.624 1.00 0.00 C ATOM 103 C ALA A 31 2.995 6.819 3.653 1.00 0.00 C ATOM 104 O ALA A 31 2.634 6.211 2.645 1.00 0.00 O ATOM 105 CB ALA A 31 3.896 8.736 2.347 1.00 0.00 C ATOM 0 H ALA A 31 4.930 8.637 4.682 1.00 0.00 H new ATOM 0 HA ALA A 31 2.185 8.792 3.650 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.326 8.398 1.481 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.994 9.821 2.316 1.00 0.00 H new ATOM 0 HB3 ALA A 31 4.887 8.281 2.329 1.00 0.00 H new ATOM 111 N TYR A 32 3.230 6.227 4.807 1.00 0.00 N ATOM 112 CA TYR A 32 3.189 4.786 4.945 1.00 0.00 C ATOM 113 C TYR A 32 1.922 4.374 5.653 1.00 0.00 C ATOM 114 O TYR A 32 1.445 5.079 6.549 1.00 0.00 O ATOM 115 CB TYR A 32 4.396 4.284 5.754 1.00 0.00 C ATOM 116 CG TYR A 32 5.745 4.775 5.268 1.00 0.00 C ATOM 117 CD1 TYR A 32 5.973 5.079 3.931 1.00 0.00 C ATOM 118 CD2 TYR A 32 6.789 4.935 6.156 1.00 0.00 C ATOM 119 CE1 TYR A 32 7.193 5.531 3.503 1.00 0.00 C ATOM 120 CE2 TYR A 32 8.014 5.383 5.731 1.00 0.00 C ATOM 121 CZ TYR A 32 8.210 5.683 4.406 1.00 0.00 C ATOM 122 OH TYR A 32 9.436 6.140 3.977 1.00 0.00 O ATOM 0 H TYR A 32 3.453 6.726 5.668 1.00 0.00 H new ATOM 0 HA TYR A 32 3.218 4.348 3.947 1.00 0.00 H new ATOM 0 HB2 TYR A 32 4.269 4.588 6.793 1.00 0.00 H new ATOM 0 HB3 TYR A 32 4.396 3.194 5.738 1.00 0.00 H new ATOM 0 HD1 TYR A 32 5.173 4.956 3.216 1.00 0.00 H new ATOM 0 HD2 TYR A 32 6.640 4.704 7.200 1.00 0.00 H new ATOM 0 HE1 TYR A 32 7.351 5.766 2.461 1.00 0.00 H new ATOM 0 HE2 TYR A 32 8.823 5.499 6.438 1.00 0.00 H new ATOM 0 HH TYR A 32 9.313 6.731 3.205 1.00 0.00 H new ATOM 132 N ILE A 33 1.387 3.244 5.269 1.00 0.00 N ATOM 133 CA ILE A 33 0.191 2.714 5.874 1.00 0.00 C ATOM 134 C ILE A 33 0.290 1.223 6.024 1.00 0.00 C ATOM 135 O ILE A 33 1.082 0.560 5.336 1.00 0.00 O ATOM 136 CB ILE A 33 -1.098 3.040 5.079 1.00 0.00 C ATOM 137 CG1 ILE A 33 -0.938 2.652 3.603 1.00 0.00 C ATOM 138 CG2 ILE A 33 -1.479 4.501 5.240 1.00 0.00 C ATOM 139 CD1 ILE A 33 -2.192 2.807 2.785 1.00 0.00 C ATOM 0 H ILE A 33 1.770 2.662 4.524 1.00 0.00 H new ATOM 0 HA ILE A 33 0.117 3.199 6.848 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.915 2.445 5.487 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.152 3.264 3.161 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.606 1.615 3.545 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.387 4.705 4.672 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.653 4.717 6.294 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.670 5.131 4.869 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.993 2.512 1.755 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -2.977 2.174 3.199 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -2.515 3.848 2.809 1.00 0.00 H new ATOM 151 N TYR A 34 -0.497 0.720 6.921 1.00 0.00 N ATOM 152 CA TYR A 34 -0.603 -0.660 7.198 1.00 0.00 C ATOM 153 C TYR A 34 -1.892 -1.153 6.615 1.00 0.00 C ATOM 154 O TYR A 34 -2.965 -0.652 6.964 1.00 0.00 O ATOM 155 CB TYR A 34 -0.607 -0.866 8.725 1.00 0.00 C ATOM 156 CG TYR A 34 -0.983 -2.248 9.189 1.00 0.00 C ATOM 157 CD1 TYR A 34 -0.081 -3.292 9.147 1.00 0.00 C ATOM 158 CD2 TYR A 34 -2.254 -2.492 9.667 1.00 0.00 C ATOM 159 CE1 TYR A 34 -0.440 -4.562 9.575 1.00 0.00 C ATOM 160 CE2 TYR A 34 -2.632 -3.742 10.096 1.00 0.00 C ATOM 161 CZ TYR A 34 -1.722 -4.784 10.050 1.00 0.00 C ATOM 162 OH TYR A 34 -2.090 -6.054 10.486 1.00 0.00 O ATOM 0 H TYR A 34 -1.107 1.295 7.502 1.00 0.00 H new ATOM 0 HA TYR A 34 0.235 -1.208 6.767 1.00 0.00 H new ATOM 0 HB2 TYR A 34 0.385 -0.630 9.109 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -1.299 -0.151 9.169 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.918 -3.118 8.776 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.968 -1.683 9.705 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.274 -5.371 9.538 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.632 -3.910 10.467 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.022 -6.039 10.789 1.00 0.00 H new ATOM 172 N ILE A 35 -1.802 -2.064 5.712 1.00 0.00 N ATOM 173 CA ILE A 35 -2.969 -2.695 5.200 1.00 0.00 C ATOM 174 C ILE A 35 -2.947 -4.093 5.760 1.00 0.00 C ATOM 175 O ILE A 35 -1.955 -4.789 5.641 1.00 0.00 O ATOM 176 CB ILE A 35 -2.940 -2.806 3.660 1.00 0.00 C ATOM 177 CG1 ILE A 35 -2.557 -1.481 3.025 1.00 0.00 C ATOM 178 CG2 ILE A 35 -4.333 -3.202 3.165 1.00 0.00 C ATOM 179 CD1 ILE A 35 -1.937 -1.641 1.659 1.00 0.00 C ATOM 0 H ILE A 35 -0.925 -2.392 5.309 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.853 -2.119 5.475 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.200 -3.556 3.380 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.444 -0.853 2.944 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.856 -0.960 3.678 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.323 -3.283 2.078 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.614 -4.162 3.598 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.055 -2.443 3.466 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.685 -0.660 1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.033 -2.244 1.738 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.645 -2.135 0.994 1.00 0.00 H new ATOM 191 N GLY A 36 -3.996 -4.481 6.359 1.00 0.00 N ATOM 192 CA GLY A 36 -4.103 -5.775 6.933 1.00 0.00 C ATOM 193 C GLY A 36 -5.390 -6.391 6.526 1.00 0.00 C ATOM 194 O GLY A 36 -6.229 -5.693 5.938 1.00 0.00 O ATOM 0 H GLY A 36 -4.829 -3.904 6.473 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.270 -6.399 6.608 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.047 -5.708 8.020 1.00 0.00 H new ATOM 198 N ASN A 37 -5.557 -7.673 6.827 1.00 0.00 N ATOM 199 CA ASN A 37 -6.761 -8.441 6.474 1.00 0.00 C ATOM 200 C ASN A 37 -6.789 -8.697 4.983 1.00 0.00 C ATOM 201 O ASN A 37 -7.848 -8.785 4.366 1.00 0.00 O ATOM 202 CB ASN A 37 -8.058 -7.742 6.941 1.00 0.00 C ATOM 203 CG ASN A 37 -8.245 -7.718 8.451 1.00 0.00 C ATOM 204 OD1 ASN A 37 -7.290 -7.791 9.224 1.00 0.00 O ATOM 205 ND2 ASN A 37 -9.461 -7.560 8.879 1.00 0.00 N ATOM 0 H ASN A 37 -4.858 -8.221 7.328 1.00 0.00 H new ATOM 0 HA ASN A 37 -6.715 -9.395 6.999 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -8.059 -6.717 6.570 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -8.912 -8.246 6.488 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.645 -7.493 9.880 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -10.232 -7.503 8.214 1.00 0.00 H new ATOM 212 N LEU A 38 -5.604 -8.850 4.410 1.00 0.00 N ATOM 213 CA LEU A 38 -5.459 -9.149 2.997 1.00 0.00 C ATOM 214 C LEU A 38 -5.997 -10.501 2.667 1.00 0.00 C ATOM 215 O LEU A 38 -5.873 -11.443 3.450 1.00 0.00 O ATOM 216 CB LEU A 38 -4.005 -9.039 2.507 1.00 0.00 C ATOM 217 CG LEU A 38 -3.575 -7.699 1.917 1.00 0.00 C ATOM 218 CD1 LEU A 38 -4.375 -7.399 0.669 1.00 0.00 C ATOM 219 CD2 LEU A 38 -3.738 -6.587 2.914 1.00 0.00 C ATOM 0 H LEU A 38 -4.720 -8.770 4.912 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.043 -8.392 2.474 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.346 -9.268 3.345 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.842 -9.810 1.754 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.518 -7.768 1.658 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.060 -6.441 0.256 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.207 -8.184 -0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.435 -7.356 0.918 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.423 -5.646 2.464 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.784 -6.515 3.211 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.125 -6.792 3.791 1.00 0.00 H new ATOM 231 N ASN A 39 -6.597 -10.592 1.521 1.00 0.00 N ATOM 232 CA ASN A 39 -7.170 -11.819 1.053 1.00 0.00 C ATOM 233 C ASN A 39 -6.100 -12.646 0.417 1.00 0.00 C ATOM 234 O ASN A 39 -5.076 -12.113 -0.037 1.00 0.00 O ATOM 235 CB ASN A 39 -8.333 -11.523 0.094 1.00 0.00 C ATOM 236 CG ASN A 39 -9.201 -12.734 -0.193 1.00 0.00 C ATOM 237 OD1 ASN A 39 -9.253 -13.670 0.588 1.00 0.00 O ATOM 238 ND2 ASN A 39 -9.915 -12.695 -1.266 1.00 0.00 N ATOM 0 H ASN A 39 -6.705 -9.809 0.876 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.583 -12.389 1.885 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -8.953 -10.734 0.519 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -7.932 -11.142 -0.845 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -10.549 -13.463 -1.485 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -9.845 -11.896 -1.896 1.00 0.00 H new ATOM 245 N ARG A 40 -6.330 -13.928 0.378 1.00 0.00 N ATOM 246 CA ARG A 40 -5.389 -14.898 -0.144 1.00 0.00 C ATOM 247 C ARG A 40 -5.008 -14.625 -1.587 1.00 0.00 C ATOM 248 O ARG A 40 -3.898 -14.909 -2.020 1.00 0.00 O ATOM 249 CB ARG A 40 -6.011 -16.256 -0.067 1.00 0.00 C ATOM 250 CG ARG A 40 -7.321 -16.380 -0.776 1.00 0.00 C ATOM 251 CD ARG A 40 -7.657 -17.795 -0.850 1.00 0.00 C ATOM 252 NE ARG A 40 -8.961 -18.037 -1.485 1.00 0.00 N ATOM 253 CZ ARG A 40 -9.262 -19.074 -2.285 1.00 0.00 C ATOM 254 NH1 ARG A 40 -8.330 -19.966 -2.611 1.00 0.00 N ATOM 255 NH2 ARG A 40 -10.494 -19.204 -2.764 1.00 0.00 N ATOM 0 H ARG A 40 -7.197 -14.345 0.715 1.00 0.00 H new ATOM 0 HA ARG A 40 -4.482 -14.833 0.457 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -5.316 -16.984 -0.485 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -6.154 -16.517 0.982 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -8.097 -15.831 -0.243 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -7.256 -15.950 -1.776 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -6.882 -18.319 -1.410 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -7.664 -18.216 0.156 1.00 0.00 H new ATOM 0 HE ARG A 40 -9.701 -17.359 -1.303 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -7.380 -19.865 -2.253 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -8.565 -20.751 -3.219 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -11.209 -18.518 -2.524 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -10.725 -19.990 -3.371 1.00 0.00 H new ATOM 269 N GLU A 41 -5.920 -14.025 -2.297 1.00 0.00 N ATOM 270 CA GLU A 41 -5.771 -13.830 -3.718 1.00 0.00 C ATOM 271 C GLU A 41 -5.484 -12.384 -4.113 1.00 0.00 C ATOM 272 O GLU A 41 -5.406 -12.064 -5.308 1.00 0.00 O ATOM 273 CB GLU A 41 -6.993 -14.375 -4.415 1.00 0.00 C ATOM 274 CG GLU A 41 -8.283 -13.888 -3.825 1.00 0.00 C ATOM 275 CD GLU A 41 -9.470 -14.454 -4.517 1.00 0.00 C ATOM 276 OE1 GLU A 41 -9.855 -13.937 -5.581 1.00 0.00 O ATOM 277 OE2 GLU A 41 -10.054 -15.415 -4.002 1.00 0.00 O ATOM 0 H GLU A 41 -6.789 -13.656 -1.911 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.887 -14.380 -4.041 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.956 -14.096 -5.468 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -6.971 -15.464 -4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -8.320 -14.154 -2.769 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -8.317 -12.800 -3.881 1.00 0.00 H new ATOM 284 N LEU A 42 -5.312 -11.524 -3.143 1.00 0.00 N ATOM 285 CA LEU A 42 -5.010 -10.140 -3.438 1.00 0.00 C ATOM 286 C LEU A 42 -3.532 -9.951 -3.659 1.00 0.00 C ATOM 287 O LEU A 42 -2.706 -10.292 -2.801 1.00 0.00 O ATOM 288 CB LEU A 42 -5.551 -9.185 -2.370 1.00 0.00 C ATOM 289 CG LEU A 42 -7.068 -8.967 -2.381 1.00 0.00 C ATOM 290 CD1 LEU A 42 -7.493 -8.077 -1.224 1.00 0.00 C ATOM 291 CD2 LEU A 42 -7.502 -8.350 -3.704 1.00 0.00 C ATOM 0 H LEU A 42 -5.374 -11.750 -2.150 1.00 0.00 H new ATOM 0 HA LEU A 42 -5.525 -9.885 -4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -5.264 -9.565 -1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -5.063 -8.218 -2.492 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.554 -9.936 -2.266 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.573 -7.936 -1.251 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -7.212 -8.547 -0.281 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -6.998 -7.109 -1.309 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.582 -8.200 -3.699 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.003 -7.390 -3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.232 -9.017 -4.523 1.00 0.00 H new ATOM 303 N THR A 43 -3.208 -9.463 -4.811 1.00 0.00 N ATOM 304 CA THR A 43 -1.856 -9.233 -5.197 1.00 0.00 C ATOM 305 C THR A 43 -1.571 -7.732 -5.203 1.00 0.00 C ATOM 306 O THR A 43 -2.498 -6.913 -5.026 1.00 0.00 O ATOM 307 CB THR A 43 -1.565 -9.838 -6.598 1.00 0.00 C ATOM 308 OG1 THR A 43 -2.461 -9.286 -7.586 1.00 0.00 O ATOM 309 CG2 THR A 43 -1.702 -11.356 -6.585 1.00 0.00 C ATOM 0 H THR A 43 -3.891 -9.208 -5.525 1.00 0.00 H new ATOM 0 HA THR A 43 -1.202 -9.723 -4.476 1.00 0.00 H new ATOM 0 HB THR A 43 -0.538 -9.582 -6.856 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.388 -9.435 -7.306 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.492 -11.749 -7.580 1.00 0.00 H new ATOM 0 HG22 THR A 43 -0.995 -11.779 -5.871 1.00 0.00 H new ATOM 0 HG23 THR A 43 -2.717 -11.627 -6.295 1.00 0.00 H new ATOM 317 N GLU A 44 -0.312 -7.377 -5.414 1.00 0.00 N ATOM 318 CA GLU A 44 0.138 -5.980 -5.463 1.00 0.00 C ATOM 319 C GLU A 44 -0.644 -5.173 -6.493 1.00 0.00 C ATOM 320 O GLU A 44 -1.021 -4.031 -6.239 1.00 0.00 O ATOM 321 CB GLU A 44 1.624 -5.940 -5.805 1.00 0.00 C ATOM 322 CG GLU A 44 2.497 -6.533 -4.727 1.00 0.00 C ATOM 323 CD GLU A 44 3.931 -6.699 -5.139 1.00 0.00 C ATOM 324 OE1 GLU A 44 4.495 -5.800 -5.764 1.00 0.00 O ATOM 325 OE2 GLU A 44 4.520 -7.754 -4.857 1.00 0.00 O ATOM 0 H GLU A 44 0.439 -8.052 -5.558 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.037 -5.533 -4.484 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.791 -6.480 -6.737 1.00 0.00 H new ATOM 0 HB3 GLU A 44 1.923 -4.906 -5.978 1.00 0.00 H new ATOM 0 HG2 GLU A 44 2.453 -5.896 -3.844 1.00 0.00 H new ATOM 0 HG3 GLU A 44 2.095 -7.505 -4.439 1.00 0.00 H new ATOM 332 N GLY A 45 -0.932 -5.796 -7.622 1.00 0.00 N ATOM 333 CA GLY A 45 -1.642 -5.135 -8.686 1.00 0.00 C ATOM 334 C GLY A 45 -3.057 -4.771 -8.316 1.00 0.00 C ATOM 335 O GLY A 45 -3.534 -3.688 -8.684 1.00 0.00 O ATOM 0 H GLY A 45 -0.680 -6.765 -7.820 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.102 -4.231 -8.968 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.657 -5.783 -9.562 1.00 0.00 H new ATOM 339 N ASP A 46 -3.723 -5.648 -7.565 1.00 0.00 N ATOM 340 CA ASP A 46 -5.114 -5.417 -7.161 1.00 0.00 C ATOM 341 C ASP A 46 -5.151 -4.248 -6.214 1.00 0.00 C ATOM 342 O ASP A 46 -5.997 -3.351 -6.342 1.00 0.00 O ATOM 343 CB ASP A 46 -5.722 -6.643 -6.455 1.00 0.00 C ATOM 344 CG ASP A 46 -5.609 -7.939 -7.229 1.00 0.00 C ATOM 345 OD1 ASP A 46 -6.245 -8.094 -8.287 1.00 0.00 O ATOM 346 OD2 ASP A 46 -4.896 -8.841 -6.777 1.00 0.00 O ATOM 0 H ASP A 46 -3.325 -6.523 -7.224 1.00 0.00 H new ATOM 0 HA ASP A 46 -5.699 -5.221 -8.060 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.233 -6.769 -5.489 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.775 -6.445 -6.256 1.00 0.00 H new ATOM 351 N ILE A 47 -4.201 -4.251 -5.282 1.00 0.00 N ATOM 352 CA ILE A 47 -4.062 -3.190 -4.302 1.00 0.00 C ATOM 353 C ILE A 47 -3.799 -1.856 -4.990 1.00 0.00 C ATOM 354 O ILE A 47 -4.461 -0.871 -4.703 1.00 0.00 O ATOM 355 CB ILE A 47 -2.927 -3.492 -3.265 1.00 0.00 C ATOM 356 CG1 ILE A 47 -3.305 -4.675 -2.357 1.00 0.00 C ATOM 357 CG2 ILE A 47 -2.571 -2.263 -2.438 1.00 0.00 C ATOM 358 CD1 ILE A 47 -2.295 -4.947 -1.256 1.00 0.00 C ATOM 0 H ILE A 47 -3.507 -4.993 -5.189 1.00 0.00 H new ATOM 0 HA ILE A 47 -5.003 -3.133 -3.756 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.039 -3.770 -3.833 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -4.277 -4.479 -1.905 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.413 -5.571 -2.968 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.780 -2.516 -1.732 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.226 -1.467 -3.099 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.451 -1.925 -1.891 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.629 -5.794 -0.657 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.326 -5.176 -1.700 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -2.204 -4.066 -0.620 1.00 0.00 H new ATOM 370 N LEU A 48 -2.898 -1.860 -5.956 1.00 0.00 N ATOM 371 CA LEU A 48 -2.502 -0.643 -6.650 1.00 0.00 C ATOM 372 C LEU A 48 -3.667 0.013 -7.327 1.00 0.00 C ATOM 373 O LEU A 48 -3.836 1.202 -7.202 1.00 0.00 O ATOM 374 CB LEU A 48 -1.409 -0.921 -7.671 1.00 0.00 C ATOM 375 CG LEU A 48 -0.004 -1.130 -7.127 1.00 0.00 C ATOM 376 CD1 LEU A 48 0.903 -1.615 -8.233 1.00 0.00 C ATOM 377 CD2 LEU A 48 0.542 0.170 -6.544 1.00 0.00 C ATOM 0 H LEU A 48 -2.421 -2.701 -6.282 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.114 0.038 -5.892 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.690 -1.809 -8.237 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.381 -0.089 -8.375 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.043 -1.878 -6.335 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.909 -1.764 -7.840 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.524 -2.558 -8.627 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.932 -0.874 -9.032 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.548 0.002 -6.159 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.574 0.933 -7.322 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.105 0.505 -5.733 1.00 0.00 H new ATOM 389 N THR A 49 -4.480 -0.761 -8.002 1.00 0.00 N ATOM 390 CA THR A 49 -5.636 -0.233 -8.689 1.00 0.00 C ATOM 391 C THR A 49 -6.618 0.449 -7.730 1.00 0.00 C ATOM 392 O THR A 49 -7.064 1.571 -7.989 1.00 0.00 O ATOM 393 CB THR A 49 -6.328 -1.343 -9.465 1.00 0.00 C ATOM 394 OG1 THR A 49 -5.398 -1.871 -10.428 1.00 0.00 O ATOM 395 CG2 THR A 49 -7.542 -0.806 -10.173 1.00 0.00 C ATOM 0 H THR A 49 -4.362 -1.770 -8.092 1.00 0.00 H new ATOM 0 HA THR A 49 -5.289 0.532 -9.384 1.00 0.00 H new ATOM 0 HB THR A 49 -6.649 -2.127 -8.779 1.00 0.00 H new ATOM 0 HG1 THR A 49 -5.030 -1.137 -10.963 1.00 0.00 H new ATOM 0 HG21 THR A 49 -8.027 -1.611 -10.724 1.00 0.00 H new ATOM 0 HG22 THR A 49 -8.238 -0.396 -9.441 1.00 0.00 H new ATOM 0 HG23 THR A 49 -7.241 -0.021 -10.867 1.00 0.00 H new ATOM 403 N VAL A 50 -6.901 -0.204 -6.626 1.00 0.00 N ATOM 404 CA VAL A 50 -7.799 0.331 -5.628 1.00 0.00 C ATOM 405 C VAL A 50 -7.206 1.580 -4.984 1.00 0.00 C ATOM 406 O VAL A 50 -7.848 2.624 -4.916 1.00 0.00 O ATOM 407 CB VAL A 50 -8.110 -0.729 -4.548 1.00 0.00 C ATOM 408 CG1 VAL A 50 -8.990 -0.161 -3.477 1.00 0.00 C ATOM 409 CG2 VAL A 50 -8.764 -1.937 -5.171 1.00 0.00 C ATOM 0 H VAL A 50 -6.516 -1.120 -6.395 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.730 0.604 -6.124 1.00 0.00 H new ATOM 0 HB VAL A 50 -7.168 -1.033 -4.092 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.194 -0.927 -2.729 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.489 0.683 -3.004 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.929 0.175 -3.918 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.977 -2.675 -4.398 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.695 -1.639 -5.654 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.094 -2.372 -5.912 1.00 0.00 H new ATOM 419 N PHE A 51 -5.964 1.474 -4.582 1.00 0.00 N ATOM 420 CA PHE A 51 -5.265 2.533 -3.920 1.00 0.00 C ATOM 421 C PHE A 51 -5.036 3.736 -4.832 1.00 0.00 C ATOM 422 O PHE A 51 -4.956 4.868 -4.375 1.00 0.00 O ATOM 423 CB PHE A 51 -3.987 2.002 -3.277 1.00 0.00 C ATOM 424 CG PHE A 51 -4.238 1.205 -1.986 1.00 0.00 C ATOM 425 CD1 PHE A 51 -5.104 0.121 -1.953 1.00 0.00 C ATOM 426 CD2 PHE A 51 -3.599 1.556 -0.812 1.00 0.00 C ATOM 427 CE1 PHE A 51 -5.319 -0.585 -0.788 1.00 0.00 C ATOM 428 CE2 PHE A 51 -3.808 0.856 0.344 1.00 0.00 C ATOM 429 CZ PHE A 51 -4.664 -0.214 0.366 1.00 0.00 C ATOM 0 H PHE A 51 -5.405 0.631 -4.711 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.894 2.911 -3.115 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -3.466 1.366 -3.993 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.326 2.840 -3.055 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -5.618 -0.175 -2.855 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -2.923 2.398 -0.807 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.998 -1.425 -0.780 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.294 1.149 1.248 1.00 0.00 H new ATOM 0 HZ PHE A 51 -4.824 -0.763 1.282 1.00 0.00 H new ATOM 439 N SER A 52 -5.025 3.493 -6.125 1.00 0.00 N ATOM 440 CA SER A 52 -4.897 4.553 -7.096 1.00 0.00 C ATOM 441 C SER A 52 -6.139 5.449 -7.133 1.00 0.00 C ATOM 442 O SER A 52 -6.061 6.578 -7.599 1.00 0.00 O ATOM 443 CB SER A 52 -4.593 3.994 -8.472 1.00 0.00 C ATOM 444 OG SER A 52 -3.322 3.381 -8.511 1.00 0.00 O ATOM 0 H SER A 52 -5.104 2.560 -6.529 1.00 0.00 H new ATOM 0 HA SER A 52 -4.058 5.175 -6.785 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.357 3.268 -8.748 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.634 4.796 -9.209 1.00 0.00 H new ATOM 0 HG SER A 52 -3.299 2.635 -7.875 1.00 0.00 H new ATOM 450 N GLU A 53 -7.283 4.969 -6.634 1.00 0.00 N ATOM 451 CA GLU A 53 -8.462 5.832 -6.574 1.00 0.00 C ATOM 452 C GLU A 53 -8.236 6.915 -5.499 1.00 0.00 C ATOM 453 O GLU A 53 -8.787 8.023 -5.571 1.00 0.00 O ATOM 454 CB GLU A 53 -9.757 5.048 -6.244 1.00 0.00 C ATOM 455 CG GLU A 53 -11.017 5.912 -6.391 1.00 0.00 C ATOM 456 CD GLU A 53 -12.288 5.309 -5.824 1.00 0.00 C ATOM 457 OE1 GLU A 53 -12.889 4.418 -6.457 1.00 0.00 O ATOM 458 OE2 GLU A 53 -12.763 5.804 -4.782 1.00 0.00 O ATOM 0 H GLU A 53 -7.415 4.022 -6.278 1.00 0.00 H new ATOM 0 HA GLU A 53 -8.595 6.279 -7.559 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -9.833 4.184 -6.904 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -9.698 4.667 -5.225 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -10.840 6.870 -5.902 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -11.174 6.119 -7.450 1.00 0.00 H new ATOM 465 N TYR A 54 -7.383 6.602 -4.532 1.00 0.00 N ATOM 466 CA TYR A 54 -7.137 7.479 -3.404 1.00 0.00 C ATOM 467 C TYR A 54 -5.961 8.396 -3.644 1.00 0.00 C ATOM 468 O TYR A 54 -5.702 9.307 -2.864 1.00 0.00 O ATOM 469 CB TYR A 54 -6.945 6.649 -2.151 1.00 0.00 C ATOM 470 CG TYR A 54 -8.085 5.689 -1.968 1.00 0.00 C ATOM 471 CD1 TYR A 54 -9.389 6.136 -1.819 1.00 0.00 C ATOM 472 CD2 TYR A 54 -7.867 4.342 -2.010 1.00 0.00 C ATOM 473 CE1 TYR A 54 -10.427 5.244 -1.703 1.00 0.00 C ATOM 474 CE2 TYR A 54 -8.894 3.447 -1.904 1.00 0.00 C ATOM 475 CZ TYR A 54 -10.170 3.897 -1.747 1.00 0.00 C ATOM 476 OH TYR A 54 -11.194 2.998 -1.630 1.00 0.00 O ATOM 0 H TYR A 54 -6.846 5.735 -4.511 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.006 8.124 -3.274 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.006 6.098 -2.214 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -6.872 7.304 -1.283 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.591 7.197 -1.794 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -6.858 3.975 -2.130 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -11.439 5.601 -1.578 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -8.695 2.386 -1.945 1.00 0.00 H new ATOM 0 HH TYR A 54 -12.041 3.436 -1.855 1.00 0.00 H new ATOM 486 N GLY A 55 -5.264 8.173 -4.719 1.00 0.00 N ATOM 487 CA GLY A 55 -4.153 8.993 -5.045 1.00 0.00 C ATOM 488 C GLY A 55 -3.151 8.249 -5.849 1.00 0.00 C ATOM 489 O GLY A 55 -3.470 7.227 -6.445 1.00 0.00 O ATOM 0 H GLY A 55 -5.453 7.423 -5.384 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.494 9.866 -5.602 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.688 9.360 -4.130 1.00 0.00 H new ATOM 493 N VAL A 56 -1.947 8.735 -5.858 1.00 0.00 N ATOM 494 CA VAL A 56 -0.890 8.134 -6.630 1.00 0.00 C ATOM 495 C VAL A 56 0.003 7.262 -5.748 1.00 0.00 C ATOM 496 O VAL A 56 0.709 7.779 -4.865 1.00 0.00 O ATOM 497 CB VAL A 56 -0.028 9.212 -7.334 1.00 0.00 C ATOM 498 CG1 VAL A 56 1.112 8.581 -8.122 1.00 0.00 C ATOM 499 CG2 VAL A 56 -0.895 10.057 -8.246 1.00 0.00 C ATOM 0 H VAL A 56 -1.664 9.561 -5.331 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.359 7.509 -7.390 1.00 0.00 H new ATOM 0 HB VAL A 56 0.410 9.850 -6.567 1.00 0.00 H new ATOM 0 HG11 VAL A 56 1.698 9.364 -8.604 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.751 8.013 -7.446 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.704 7.914 -8.881 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -0.280 10.812 -8.736 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.358 9.421 -9.000 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.671 10.547 -7.659 1.00 0.00 H new ATOM 509 N PRO A 57 -0.048 5.937 -5.937 1.00 0.00 N ATOM 510 CA PRO A 57 0.815 5.008 -5.229 1.00 0.00 C ATOM 511 C PRO A 57 2.205 4.977 -5.879 1.00 0.00 C ATOM 512 O PRO A 57 2.324 4.968 -7.114 1.00 0.00 O ATOM 513 CB PRO A 57 0.097 3.668 -5.426 1.00 0.00 C ATOM 514 CG PRO A 57 -0.572 3.794 -6.744 1.00 0.00 C ATOM 515 CD PRO A 57 -0.973 5.234 -6.862 1.00 0.00 C ATOM 0 HA PRO A 57 0.973 5.265 -4.182 1.00 0.00 H new ATOM 0 HB2 PRO A 57 0.801 2.836 -5.416 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.625 3.484 -4.631 1.00 0.00 H new ATOM 0 HG2 PRO A 57 0.100 3.508 -7.553 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.441 3.140 -6.805 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -0.867 5.596 -7.885 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -2.014 5.384 -6.577 1.00 0.00 H new ATOM 523 N VAL A 58 3.247 4.972 -5.080 1.00 0.00 N ATOM 524 CA VAL A 58 4.592 4.974 -5.648 1.00 0.00 C ATOM 525 C VAL A 58 5.342 3.690 -5.341 1.00 0.00 C ATOM 526 O VAL A 58 6.305 3.348 -6.018 1.00 0.00 O ATOM 527 CB VAL A 58 5.439 6.208 -5.227 1.00 0.00 C ATOM 528 CG1 VAL A 58 4.834 7.489 -5.746 1.00 0.00 C ATOM 529 CG2 VAL A 58 5.592 6.289 -3.732 1.00 0.00 C ATOM 0 H VAL A 58 3.203 4.967 -4.061 1.00 0.00 H new ATOM 0 HA VAL A 58 4.445 5.041 -6.726 1.00 0.00 H new ATOM 0 HB VAL A 58 6.427 6.080 -5.670 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.449 8.334 -5.435 1.00 0.00 H new ATOM 0 HG12 VAL A 58 4.788 7.455 -6.834 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.828 7.605 -5.344 1.00 0.00 H new ATOM 0 HG21 VAL A 58 6.190 7.163 -3.474 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.608 6.372 -3.270 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.089 5.390 -3.368 1.00 0.00 H new ATOM 539 N ASP A 59 4.901 2.982 -4.323 1.00 0.00 N ATOM 540 CA ASP A 59 5.531 1.729 -3.943 1.00 0.00 C ATOM 541 C ASP A 59 4.545 0.901 -3.175 1.00 0.00 C ATOM 542 O ASP A 59 3.785 1.443 -2.353 1.00 0.00 O ATOM 543 CB ASP A 59 6.777 1.974 -3.082 1.00 0.00 C ATOM 544 CG ASP A 59 7.536 0.696 -2.759 1.00 0.00 C ATOM 545 OD1 ASP A 59 7.937 -0.032 -3.682 1.00 0.00 O ATOM 546 OD2 ASP A 59 7.780 0.420 -1.568 1.00 0.00 O ATOM 0 H ASP A 59 4.108 3.251 -3.741 1.00 0.00 H new ATOM 0 HA ASP A 59 5.842 1.206 -4.847 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.442 2.663 -3.602 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.480 2.459 -2.152 1.00 0.00 H new ATOM 551 N VAL A 60 4.517 -0.375 -3.456 1.00 0.00 N ATOM 552 CA VAL A 60 3.639 -1.293 -2.774 1.00 0.00 C ATOM 553 C VAL A 60 4.383 -2.597 -2.501 1.00 0.00 C ATOM 554 O VAL A 60 5.156 -3.073 -3.344 1.00 0.00 O ATOM 555 CB VAL A 60 2.329 -1.571 -3.581 1.00 0.00 C ATOM 556 CG1 VAL A 60 2.608 -2.288 -4.895 1.00 0.00 C ATOM 557 CG2 VAL A 60 1.320 -2.344 -2.743 1.00 0.00 C ATOM 0 H VAL A 60 5.105 -0.810 -4.167 1.00 0.00 H new ATOM 0 HA VAL A 60 3.338 -0.833 -1.833 1.00 0.00 H new ATOM 0 HB VAL A 60 1.895 -0.602 -3.827 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.669 -2.460 -5.422 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.263 -1.674 -5.513 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.091 -3.244 -4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.420 -2.522 -3.331 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.752 -3.298 -2.442 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.065 -1.765 -1.855 1.00 0.00 H new ATOM 567 N ILE A 61 4.254 -3.092 -1.307 1.00 0.00 N ATOM 568 CA ILE A 61 4.844 -4.344 -0.924 1.00 0.00 C ATOM 569 C ILE A 61 3.773 -5.296 -0.443 1.00 0.00 C ATOM 570 O ILE A 61 2.970 -4.939 0.427 1.00 0.00 O ATOM 571 CB ILE A 61 5.894 -4.149 0.185 1.00 0.00 C ATOM 572 CG1 ILE A 61 6.985 -3.213 -0.307 1.00 0.00 C ATOM 573 CG2 ILE A 61 6.497 -5.491 0.609 1.00 0.00 C ATOM 574 CD1 ILE A 61 7.946 -2.812 0.755 1.00 0.00 C ATOM 0 H ILE A 61 3.730 -2.634 -0.561 1.00 0.00 H new ATOM 0 HA ILE A 61 5.340 -4.762 -1.800 1.00 0.00 H new ATOM 0 HB ILE A 61 5.406 -3.710 1.055 1.00 0.00 H new ATOM 0 HG12 ILE A 61 7.531 -3.698 -1.116 1.00 0.00 H new ATOM 0 HG13 ILE A 61 6.524 -2.318 -0.725 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.236 -5.326 1.393 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.708 -6.142 0.985 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.977 -5.961 -0.249 1.00 0.00 H new ATOM 0 HD11 ILE A 61 8.697 -2.144 0.333 1.00 0.00 H new ATOM 0 HD12 ILE A 61 7.412 -2.298 1.554 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.435 -3.699 1.157 1.00 0.00 H new ATOM 586 N LEU A 62 3.735 -6.468 -1.006 1.00 0.00 N ATOM 587 CA LEU A 62 2.857 -7.485 -0.535 1.00 0.00 C ATOM 588 C LEU A 62 3.717 -8.480 0.190 1.00 0.00 C ATOM 589 O LEU A 62 4.549 -9.156 -0.428 1.00 0.00 O ATOM 590 CB LEU A 62 2.171 -8.212 -1.684 1.00 0.00 C ATOM 591 CG LEU A 62 0.752 -8.760 -1.433 1.00 0.00 C ATOM 592 CD1 LEU A 62 0.602 -9.523 -0.114 1.00 0.00 C ATOM 593 CD2 LEU A 62 -0.243 -7.652 -1.542 1.00 0.00 C ATOM 0 H LEU A 62 4.312 -6.740 -1.802 1.00 0.00 H new ATOM 0 HA LEU A 62 2.086 -7.041 0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.123 -7.530 -2.533 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.806 -9.046 -1.981 1.00 0.00 H new ATOM 0 HG LEU A 62 0.559 -9.502 -2.208 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.424 -9.876 -0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.281 -10.376 -0.108 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.842 -8.862 0.718 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.245 -8.044 -1.364 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.016 -6.885 -0.801 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.196 -7.217 -2.540 1.00 0.00 H new ATOM 605 N SER A 63 3.542 -8.553 1.457 1.00 0.00 N ATOM 606 CA SER A 63 4.242 -9.488 2.262 1.00 0.00 C ATOM 607 C SER A 63 3.554 -10.840 2.105 1.00 0.00 C ATOM 608 O SER A 63 2.347 -10.968 2.360 1.00 0.00 O ATOM 609 CB SER A 63 4.202 -8.989 3.688 1.00 0.00 C ATOM 610 OG SER A 63 4.725 -7.662 3.741 1.00 0.00 O ATOM 0 H SER A 63 2.898 -7.955 1.975 1.00 0.00 H new ATOM 0 HA SER A 63 5.286 -9.599 1.968 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.178 -9.003 4.061 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.785 -9.647 4.332 1.00 0.00 H new ATOM 0 HG SER A 63 4.521 -7.265 4.613 1.00 0.00 H new ATOM 616 N ARG A 64 4.268 -11.823 1.624 1.00 0.00 N ATOM 617 CA ARG A 64 3.671 -13.112 1.362 1.00 0.00 C ATOM 618 C ARG A 64 4.159 -14.166 2.329 1.00 0.00 C ATOM 619 O ARG A 64 5.349 -14.330 2.531 1.00 0.00 O ATOM 620 CB ARG A 64 3.908 -13.545 -0.085 1.00 0.00 C ATOM 621 CG ARG A 64 3.354 -12.567 -1.114 1.00 0.00 C ATOM 622 CD ARG A 64 3.597 -13.045 -2.533 1.00 0.00 C ATOM 623 NE ARG A 64 2.900 -14.300 -2.837 1.00 0.00 N ATOM 624 CZ ARG A 64 3.057 -15.005 -3.968 1.00 0.00 C ATOM 625 NH1 ARG A 64 3.888 -14.578 -4.913 1.00 0.00 N ATOM 626 NH2 ARG A 64 2.402 -16.141 -4.141 1.00 0.00 N ATOM 0 H ARG A 64 5.262 -11.759 1.405 1.00 0.00 H new ATOM 0 HA ARG A 64 2.597 -13.006 1.513 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.979 -13.664 -0.249 1.00 0.00 H new ATOM 0 HB3 ARG A 64 3.451 -14.522 -0.242 1.00 0.00 H new ATOM 0 HG2 ARG A 64 2.284 -12.437 -0.952 1.00 0.00 H new ATOM 0 HG3 ARG A 64 3.818 -11.591 -0.975 1.00 0.00 H new ATOM 0 HD2 ARG A 64 3.271 -12.275 -3.232 1.00 0.00 H new ATOM 0 HD3 ARG A 64 4.667 -13.182 -2.687 1.00 0.00 H new ATOM 0 HE ARG A 64 2.250 -14.662 -2.139 1.00 0.00 H new ATOM 0 HH11 ARG A 64 4.409 -13.711 -4.780 1.00 0.00 H new ATOM 0 HH12 ARG A 64 4.004 -15.117 -5.771 1.00 0.00 H new ATOM 0 HH21 ARG A 64 1.775 -16.484 -3.413 1.00 0.00 H new ATOM 0 HH22 ARG A 64 2.524 -16.674 -5.002 1.00 0.00 H new ATOM 640 N ASP A 65 3.222 -14.846 2.944 1.00 0.00 N ATOM 641 CA ASP A 65 3.510 -15.917 3.881 1.00 0.00 C ATOM 642 C ASP A 65 4.085 -17.124 3.194 1.00 0.00 C ATOM 643 O ASP A 65 3.483 -17.673 2.283 1.00 0.00 O ATOM 644 CB ASP A 65 2.262 -16.301 4.666 1.00 0.00 C ATOM 645 CG ASP A 65 2.454 -17.554 5.458 1.00 0.00 C ATOM 646 OD1 ASP A 65 3.318 -17.606 6.322 1.00 0.00 O ATOM 647 OD2 ASP A 65 1.760 -18.528 5.187 1.00 0.00 O ATOM 0 H ASP A 65 2.226 -14.673 2.810 1.00 0.00 H new ATOM 0 HA ASP A 65 4.261 -15.541 4.576 1.00 0.00 H new ATOM 0 HB2 ASP A 65 1.993 -15.486 5.338 1.00 0.00 H new ATOM 0 HB3 ASP A 65 1.428 -16.434 3.977 1.00 0.00 H new ATOM 652 N GLU A 66 5.248 -17.514 3.646 1.00 0.00 N ATOM 653 CA GLU A 66 5.986 -18.653 3.130 1.00 0.00 C ATOM 654 C GLU A 66 5.233 -19.984 3.291 1.00 0.00 C ATOM 655 O GLU A 66 5.453 -20.917 2.519 1.00 0.00 O ATOM 656 CB GLU A 66 7.349 -18.743 3.818 1.00 0.00 C ATOM 657 CG GLU A 66 7.267 -18.823 5.337 1.00 0.00 C ATOM 658 CD GLU A 66 8.608 -18.992 5.988 1.00 0.00 C ATOM 659 OE1 GLU A 66 9.302 -17.985 6.213 1.00 0.00 O ATOM 660 OE2 GLU A 66 8.983 -20.138 6.316 1.00 0.00 O ATOM 0 H GLU A 66 5.729 -17.037 4.408 1.00 0.00 H new ATOM 0 HA GLU A 66 6.112 -18.488 2.060 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.876 -19.621 3.445 1.00 0.00 H new ATOM 0 HB3 GLU A 66 7.944 -17.872 3.541 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.796 -17.917 5.718 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.625 -19.658 5.617 1.00 0.00 H new ATOM 667 N ASN A 67 4.343 -20.063 4.271 1.00 0.00 N ATOM 668 CA ASN A 67 3.652 -21.316 4.566 1.00 0.00 C ATOM 669 C ASN A 67 2.525 -21.541 3.584 1.00 0.00 C ATOM 670 O ASN A 67 2.415 -22.606 2.965 1.00 0.00 O ATOM 671 CB ASN A 67 3.084 -21.339 6.001 1.00 0.00 C ATOM 672 CG ASN A 67 4.117 -21.081 7.083 1.00 0.00 C ATOM 673 OD1 ASN A 67 4.794 -21.999 7.564 1.00 0.00 O ATOM 674 ND2 ASN A 67 4.240 -19.846 7.486 1.00 0.00 N ATOM 0 H ASN A 67 4.082 -19.282 4.873 1.00 0.00 H new ATOM 0 HA ASN A 67 4.389 -22.114 4.476 1.00 0.00 H new ATOM 0 HB2 ASN A 67 2.296 -20.590 6.080 1.00 0.00 H new ATOM 0 HB3 ASN A 67 2.620 -22.309 6.181 1.00 0.00 H new ATOM 0 HD21 ASN A 67 4.910 -19.613 8.219 1.00 0.00 H new ATOM 0 HD22 ASN A 67 3.666 -19.114 7.068 1.00 0.00 H new ATOM 681 N THR A 68 1.710 -20.539 3.414 1.00 0.00 N ATOM 682 CA THR A 68 0.562 -20.634 2.542 1.00 0.00 C ATOM 683 C THR A 68 0.961 -20.333 1.099 1.00 0.00 C ATOM 684 O THR A 68 0.348 -20.832 0.145 1.00 0.00 O ATOM 685 CB THR A 68 -0.482 -19.580 2.986 1.00 0.00 C ATOM 686 OG1 THR A 68 0.148 -18.280 2.988 1.00 0.00 O ATOM 687 CG2 THR A 68 -0.977 -19.866 4.392 1.00 0.00 C ATOM 0 H THR A 68 1.817 -19.634 3.872 1.00 0.00 H new ATOM 0 HA THR A 68 0.154 -21.643 2.600 1.00 0.00 H new ATOM 0 HB THR A 68 -1.326 -19.613 2.296 1.00 0.00 H new ATOM 0 HG1 THR A 68 0.658 -18.165 3.817 1.00 0.00 H new ATOM 0 HG21 THR A 68 -1.709 -19.112 4.680 1.00 0.00 H new ATOM 0 HG22 THR A 68 -1.441 -20.852 4.421 1.00 0.00 H new ATOM 0 HG23 THR A 68 -0.137 -19.840 5.086 1.00 0.00 H new ATOM 695 N GLY A 69 2.038 -19.583 0.949 1.00 0.00 N ATOM 696 CA GLY A 69 2.514 -19.182 -0.350 1.00 0.00 C ATOM 697 C GLY A 69 1.595 -18.159 -0.987 1.00 0.00 C ATOM 698 O GLY A 69 1.699 -17.871 -2.168 1.00 0.00 O ATOM 0 H GLY A 69 2.602 -19.239 1.726 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.517 -18.765 -0.258 1.00 0.00 H new ATOM 0 HA3 GLY A 69 2.591 -20.056 -0.996 1.00 0.00 H new ATOM 702 N GLU A 70 0.697 -17.608 -0.205 1.00 0.00 N ATOM 703 CA GLU A 70 -0.266 -16.682 -0.728 1.00 0.00 C ATOM 704 C GLU A 70 0.067 -15.284 -0.271 1.00 0.00 C ATOM 705 O GLU A 70 0.798 -14.562 -0.947 1.00 0.00 O ATOM 706 CB GLU A 70 -1.688 -17.093 -0.325 1.00 0.00 C ATOM 707 CG GLU A 70 -2.060 -18.491 -0.782 1.00 0.00 C ATOM 708 CD GLU A 70 -3.409 -18.912 -0.294 1.00 0.00 C ATOM 709 OE1 GLU A 70 -3.516 -19.379 0.855 1.00 0.00 O ATOM 710 OE2 GLU A 70 -4.390 -18.798 -1.045 1.00 0.00 O ATOM 0 H GLU A 70 0.617 -17.788 0.796 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.225 -16.698 -1.817 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -1.782 -17.036 0.759 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.398 -16.380 -0.745 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -2.042 -18.531 -1.871 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -1.311 -19.198 -0.425 1.00 0.00 H new ATOM 717 N SER A 71 -0.370 -14.937 0.904 1.00 0.00 N ATOM 718 CA SER A 71 -0.135 -13.638 1.429 1.00 0.00 C ATOM 719 C SER A 71 0.035 -13.745 2.932 1.00 0.00 C ATOM 720 O SER A 71 -0.387 -14.720 3.530 1.00 0.00 O ATOM 721 CB SER A 71 -1.319 -12.726 1.078 1.00 0.00 C ATOM 722 OG SER A 71 -2.537 -13.259 1.587 1.00 0.00 O ATOM 0 H SER A 71 -0.900 -15.553 1.521 1.00 0.00 H new ATOM 0 HA SER A 71 0.770 -13.209 0.998 1.00 0.00 H new ATOM 0 HB2 SER A 71 -1.152 -11.731 1.490 1.00 0.00 H new ATOM 0 HB3 SER A 71 -1.390 -12.615 -0.004 1.00 0.00 H new ATOM 0 HG SER A 71 -3.291 -12.895 1.078 1.00 0.00 H new ATOM 728 N GLN A 72 0.697 -12.781 3.526 1.00 0.00 N ATOM 729 CA GLN A 72 0.849 -12.720 4.977 1.00 0.00 C ATOM 730 C GLN A 72 -0.416 -12.210 5.616 1.00 0.00 C ATOM 731 O GLN A 72 -0.633 -12.372 6.814 1.00 0.00 O ATOM 732 CB GLN A 72 1.990 -11.794 5.336 1.00 0.00 C ATOM 733 CG GLN A 72 3.357 -12.430 5.376 1.00 0.00 C ATOM 734 CD GLN A 72 3.559 -13.228 6.638 1.00 0.00 C ATOM 735 OE1 GLN A 72 2.968 -12.927 7.677 1.00 0.00 O ATOM 736 NE2 GLN A 72 4.410 -14.190 6.588 1.00 0.00 N ATOM 0 H GLN A 72 1.148 -12.014 3.027 1.00 0.00 H new ATOM 0 HA GLN A 72 1.059 -13.725 5.344 1.00 0.00 H new ATOM 0 HB2 GLN A 72 2.011 -10.976 4.616 1.00 0.00 H new ATOM 0 HB3 GLN A 72 1.785 -11.355 6.312 1.00 0.00 H new ATOM 0 HG2 GLN A 72 3.483 -13.080 4.510 1.00 0.00 H new ATOM 0 HG3 GLN A 72 4.121 -11.656 5.308 1.00 0.00 H new ATOM 0 HE21 GLN A 72 4.880 -14.410 5.710 1.00 0.00 H new ATOM 0 HE22 GLN A 72 4.615 -14.733 7.427 1.00 0.00 H new ATOM 745 N GLY A 73 -1.236 -11.586 4.810 1.00 0.00 N ATOM 746 CA GLY A 73 -2.451 -11.013 5.300 1.00 0.00 C ATOM 747 C GLY A 73 -2.288 -9.542 5.545 1.00 0.00 C ATOM 748 O GLY A 73 -3.219 -8.876 5.955 1.00 0.00 O ATOM 0 H GLY A 73 -1.079 -11.465 3.810 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.252 -11.179 4.580 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.745 -11.509 6.225 1.00 0.00 H new ATOM 752 N PHE A 74 -1.116 -9.025 5.257 1.00 0.00 N ATOM 753 CA PHE A 74 -0.860 -7.625 5.418 1.00 0.00 C ATOM 754 C PHE A 74 -0.017 -7.172 4.254 1.00 0.00 C ATOM 755 O PHE A 74 0.711 -7.988 3.657 1.00 0.00 O ATOM 756 CB PHE A 74 -0.170 -7.294 6.781 1.00 0.00 C ATOM 757 CG PHE A 74 1.279 -7.712 6.907 1.00 0.00 C ATOM 758 CD1 PHE A 74 1.623 -8.984 7.322 1.00 0.00 C ATOM 759 CD2 PHE A 74 2.295 -6.815 6.602 1.00 0.00 C ATOM 760 CE1 PHE A 74 2.953 -9.359 7.426 1.00 0.00 C ATOM 761 CE2 PHE A 74 3.619 -7.185 6.700 1.00 0.00 C ATOM 762 CZ PHE A 74 3.949 -8.459 7.110 1.00 0.00 C ATOM 0 H PHE A 74 -0.323 -9.564 4.908 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.809 -7.088 5.433 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.233 -6.219 6.947 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.737 -7.773 7.579 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.847 -9.694 7.568 1.00 0.00 H new ATOM 0 HD2 PHE A 74 2.044 -5.814 6.284 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.209 -10.355 7.754 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.397 -6.477 6.456 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.986 -8.752 7.184 1.00 0.00 H new ATOM 772 N ALA A 75 -0.144 -5.930 3.900 1.00 0.00 N ATOM 773 CA ALA A 75 0.611 -5.357 2.842 1.00 0.00 C ATOM 774 C ALA A 75 0.900 -3.905 3.161 1.00 0.00 C ATOM 775 O ALA A 75 0.371 -3.351 4.135 1.00 0.00 O ATOM 776 CB ALA A 75 -0.135 -5.487 1.534 1.00 0.00 C ATOM 0 H ALA A 75 -0.788 -5.279 4.350 1.00 0.00 H new ATOM 0 HA ALA A 75 1.557 -5.889 2.740 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.456 -5.043 0.733 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.308 -6.541 1.317 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.092 -4.970 1.608 1.00 0.00 H new ATOM 782 N TYR A 76 1.713 -3.302 2.356 1.00 0.00 N ATOM 783 CA TYR A 76 2.133 -1.942 2.536 1.00 0.00 C ATOM 784 C TYR A 76 2.070 -1.203 1.222 1.00 0.00 C ATOM 785 O TYR A 76 2.373 -1.774 0.187 1.00 0.00 O ATOM 786 CB TYR A 76 3.571 -1.945 3.076 1.00 0.00 C ATOM 787 CG TYR A 76 4.370 -0.694 2.797 1.00 0.00 C ATOM 788 CD1 TYR A 76 4.229 0.454 3.557 1.00 0.00 C ATOM 789 CD2 TYR A 76 5.287 -0.688 1.766 1.00 0.00 C ATOM 790 CE1 TYR A 76 4.995 1.567 3.287 1.00 0.00 C ATOM 791 CE2 TYR A 76 6.041 0.408 1.488 1.00 0.00 C ATOM 792 CZ TYR A 76 5.898 1.535 2.250 1.00 0.00 C ATOM 793 OH TYR A 76 6.681 2.624 1.994 1.00 0.00 O ATOM 0 H TYR A 76 2.116 -3.749 1.533 1.00 0.00 H new ATOM 0 HA TYR A 76 1.474 -1.438 3.243 1.00 0.00 H new ATOM 0 HB2 TYR A 76 3.536 -2.100 4.154 1.00 0.00 H new ATOM 0 HB3 TYR A 76 4.100 -2.797 2.648 1.00 0.00 H new ATOM 0 HD1 TYR A 76 3.514 0.478 4.366 1.00 0.00 H new ATOM 0 HD2 TYR A 76 5.409 -1.577 1.165 1.00 0.00 H new ATOM 0 HE1 TYR A 76 4.887 2.459 3.886 1.00 0.00 H new ATOM 0 HE2 TYR A 76 6.748 0.389 0.672 1.00 0.00 H new ATOM 0 HH TYR A 76 6.451 3.346 2.616 1.00 0.00 H new ATOM 803 N LEU A 77 1.701 0.052 1.270 1.00 0.00 N ATOM 804 CA LEU A 77 1.687 0.891 0.107 1.00 0.00 C ATOM 805 C LEU A 77 1.960 2.321 0.550 1.00 0.00 C ATOM 806 O LEU A 77 1.525 2.727 1.620 1.00 0.00 O ATOM 807 CB LEU A 77 0.350 0.752 -0.682 1.00 0.00 C ATOM 808 CG LEU A 77 0.282 1.456 -2.061 1.00 0.00 C ATOM 809 CD1 LEU A 77 -0.731 0.775 -2.950 1.00 0.00 C ATOM 810 CD2 LEU A 77 -0.130 2.895 -1.906 1.00 0.00 C ATOM 0 H LEU A 77 1.400 0.520 2.125 1.00 0.00 H new ATOM 0 HA LEU A 77 2.467 0.581 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.151 -0.309 -0.831 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.455 1.143 -0.060 1.00 0.00 H new ATOM 0 HG LEU A 77 1.275 1.400 -2.507 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.767 1.281 -3.915 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.444 -0.266 -3.097 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.714 0.818 -2.481 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.171 3.369 -2.887 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.113 2.944 -1.438 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.595 3.416 -1.281 1.00 0.00 H new ATOM 822 N LYS A 78 2.732 3.039 -0.224 1.00 0.00 N ATOM 823 CA LYS A 78 3.037 4.420 0.069 1.00 0.00 C ATOM 824 C LYS A 78 2.633 5.283 -1.107 1.00 0.00 C ATOM 825 O LYS A 78 2.735 4.863 -2.282 1.00 0.00 O ATOM 826 CB LYS A 78 4.518 4.660 0.411 1.00 0.00 C ATOM 827 CG LYS A 78 5.475 4.378 -0.713 1.00 0.00 C ATOM 828 CD LYS A 78 6.872 4.944 -0.451 1.00 0.00 C ATOM 829 CE LYS A 78 6.872 6.477 -0.409 1.00 0.00 C ATOM 830 NZ LYS A 78 8.236 7.045 -0.275 1.00 0.00 N ATOM 0 H LYS A 78 3.168 2.685 -1.076 1.00 0.00 H new ATOM 0 HA LYS A 78 2.468 4.690 0.959 1.00 0.00 H new ATOM 0 HB2 LYS A 78 4.641 5.697 0.724 1.00 0.00 H new ATOM 0 HB3 LYS A 78 4.786 4.036 1.264 1.00 0.00 H new ATOM 0 HG2 LYS A 78 5.546 3.301 -0.864 1.00 0.00 H new ATOM 0 HG3 LYS A 78 5.082 4.804 -1.636 1.00 0.00 H new ATOM 0 HD2 LYS A 78 7.249 4.555 0.495 1.00 0.00 H new ATOM 0 HD3 LYS A 78 7.554 4.603 -1.230 1.00 0.00 H new ATOM 0 HE2 LYS A 78 6.410 6.861 -1.318 1.00 0.00 H new ATOM 0 HE3 LYS A 78 6.259 6.814 0.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 8.179 8.083 -0.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 8.670 6.702 0.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.817 6.748 -1.085 1.00 0.00 H new ATOM 844 N TYR A 79 2.169 6.449 -0.812 1.00 0.00 N ATOM 845 CA TYR A 79 1.696 7.366 -1.819 1.00 0.00 C ATOM 846 C TYR A 79 2.654 8.489 -2.050 1.00 0.00 C ATOM 847 O TYR A 79 3.588 8.698 -1.276 1.00 0.00 O ATOM 848 CB TYR A 79 0.361 7.956 -1.433 1.00 0.00 C ATOM 849 CG TYR A 79 -0.771 6.998 -1.458 1.00 0.00 C ATOM 850 CD1 TYR A 79 -0.984 6.125 -0.418 1.00 0.00 C ATOM 851 CD2 TYR A 79 -1.650 6.987 -2.518 1.00 0.00 C ATOM 852 CE1 TYR A 79 -2.039 5.273 -0.426 1.00 0.00 C ATOM 853 CE2 TYR A 79 -2.706 6.135 -2.542 1.00 0.00 C ATOM 854 CZ TYR A 79 -2.900 5.282 -1.496 1.00 0.00 C ATOM 855 OH TYR A 79 -3.954 4.455 -1.508 1.00 0.00 O ATOM 0 H TYR A 79 2.102 6.806 0.141 1.00 0.00 H new ATOM 0 HA TYR A 79 1.598 6.785 -2.736 1.00 0.00 H new ATOM 0 HB2 TYR A 79 0.441 8.376 -0.431 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.135 8.782 -2.108 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.301 6.117 0.418 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.497 7.667 -3.343 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -2.200 4.595 0.399 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -3.386 6.133 -3.381 1.00 0.00 H new ATOM 0 HH TYR A 79 -3.851 3.783 -0.802 1.00 0.00 H new ATOM 865 N GLU A 80 2.439 9.176 -3.146 1.00 0.00 N ATOM 866 CA GLU A 80 3.170 10.375 -3.467 1.00 0.00 C ATOM 867 C GLU A 80 2.651 11.526 -2.588 1.00 0.00 C ATOM 868 O GLU A 80 3.404 12.407 -2.197 1.00 0.00 O ATOM 869 CB GLU A 80 2.998 10.714 -4.959 1.00 0.00 C ATOM 870 CG GLU A 80 3.784 11.930 -5.428 1.00 0.00 C ATOM 871 CD GLU A 80 3.575 12.235 -6.892 1.00 0.00 C ATOM 872 OE1 GLU A 80 2.631 12.982 -7.230 1.00 0.00 O ATOM 873 OE2 GLU A 80 4.354 11.752 -7.725 1.00 0.00 O ATOM 0 H GLU A 80 1.745 8.915 -3.846 1.00 0.00 H new ATOM 0 HA GLU A 80 4.232 10.224 -3.273 1.00 0.00 H new ATOM 0 HB2 GLU A 80 3.302 9.851 -5.551 1.00 0.00 H new ATOM 0 HB3 GLU A 80 1.940 10.882 -5.160 1.00 0.00 H new ATOM 0 HG2 GLU A 80 3.490 12.797 -4.836 1.00 0.00 H new ATOM 0 HG3 GLU A 80 4.845 11.763 -5.245 1.00 0.00 H new ATOM 880 N ASP A 81 1.365 11.476 -2.247 1.00 0.00 N ATOM 881 CA ASP A 81 0.746 12.527 -1.447 1.00 0.00 C ATOM 882 C ASP A 81 0.205 11.930 -0.153 1.00 0.00 C ATOM 883 O ASP A 81 -0.425 10.878 -0.167 1.00 0.00 O ATOM 884 CB ASP A 81 -0.402 13.175 -2.223 1.00 0.00 C ATOM 885 CG ASP A 81 -0.832 14.508 -1.645 1.00 0.00 C ATOM 886 OD1 ASP A 81 -1.385 14.563 -0.527 1.00 0.00 O ATOM 887 OD2 ASP A 81 -0.622 15.542 -2.317 1.00 0.00 O ATOM 0 H ASP A 81 0.734 10.720 -2.512 1.00 0.00 H new ATOM 0 HA ASP A 81 1.496 13.285 -1.219 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -0.097 13.317 -3.260 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.255 12.497 -2.231 1.00 0.00 H new ATOM 892 N GLN A 82 0.467 12.580 0.950 1.00 0.00 N ATOM 893 CA GLN A 82 0.031 12.121 2.271 1.00 0.00 C ATOM 894 C GLN A 82 -1.478 12.237 2.501 1.00 0.00 C ATOM 895 O GLN A 82 -2.029 11.605 3.386 1.00 0.00 O ATOM 896 CB GLN A 82 0.838 12.783 3.347 1.00 0.00 C ATOM 897 CG GLN A 82 2.295 12.457 3.181 1.00 0.00 C ATOM 898 CD GLN A 82 3.160 13.083 4.198 1.00 0.00 C ATOM 899 OE1 GLN A 82 4.254 12.468 4.449 1.00 0.00 O flip ATOM 900 NE2 GLN A 82 2.863 14.144 4.727 1.00 0.00 N flip ATOM 0 H GLN A 82 0.994 13.453 0.972 1.00 0.00 H new ATOM 0 HA GLN A 82 0.224 11.049 2.315 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.693 13.863 3.308 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.493 12.451 4.326 1.00 0.00 H new ATOM 0 HG2 GLN A 82 2.424 11.375 3.223 1.00 0.00 H new ATOM 0 HG3 GLN A 82 2.620 12.779 2.192 1.00 0.00 H new ATOM 0 HE21 GLN A 82 1.980 14.599 4.497 1.00 0.00 H new ATOM 0 HE22 GLN A 82 3.498 14.574 5.399 1.00 0.00 H new ATOM 909 N ARG A 83 -2.134 13.065 1.737 1.00 0.00 N ATOM 910 CA ARG A 83 -3.589 13.173 1.802 1.00 0.00 C ATOM 911 C ARG A 83 -4.212 11.884 1.280 1.00 0.00 C ATOM 912 O ARG A 83 -5.280 11.459 1.692 1.00 0.00 O ATOM 913 CB ARG A 83 -4.083 14.387 1.059 1.00 0.00 C ATOM 914 CG ARG A 83 -3.641 15.691 1.688 1.00 0.00 C ATOM 915 CD ARG A 83 -3.934 16.850 0.776 1.00 0.00 C ATOM 916 NE ARG A 83 -3.195 16.720 -0.483 1.00 0.00 N ATOM 917 CZ ARG A 83 -3.432 17.426 -1.577 1.00 0.00 C ATOM 918 NH1 ARG A 83 -4.419 18.311 -1.598 1.00 0.00 N ATOM 919 NH2 ARG A 83 -2.677 17.251 -2.651 1.00 0.00 N ATOM 0 H ARG A 83 -1.694 13.683 1.055 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.895 13.307 2.840 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.724 14.347 0.031 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -5.172 14.362 1.018 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.153 15.833 2.640 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.573 15.653 1.903 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -5.004 16.897 0.572 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.662 17.784 1.268 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.441 16.034 -0.519 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.998 18.449 -0.770 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.599 18.854 -2.443 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.915 16.573 -2.634 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.858 17.794 -3.495 1.00 0.00 H new ATOM 933 N SER A 84 -3.548 11.311 0.341 1.00 0.00 N ATOM 934 CA SER A 84 -3.927 10.064 -0.241 1.00 0.00 C ATOM 935 C SER A 84 -3.919 8.912 0.785 1.00 0.00 C ATOM 936 O SER A 84 -4.781 8.031 0.731 1.00 0.00 O ATOM 937 CB SER A 84 -3.023 9.773 -1.402 1.00 0.00 C ATOM 938 OG SER A 84 -3.128 10.794 -2.360 1.00 0.00 O ATOM 0 H SER A 84 -2.697 11.706 -0.060 1.00 0.00 H new ATOM 0 HA SER A 84 -4.956 10.143 -0.593 1.00 0.00 H new ATOM 0 HB2 SER A 84 -1.992 9.690 -1.059 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.288 8.815 -1.849 1.00 0.00 H new ATOM 0 HG SER A 84 -2.435 10.675 -3.042 1.00 0.00 H new ATOM 944 N THR A 85 -2.956 8.912 1.721 1.00 0.00 N ATOM 945 CA THR A 85 -2.874 7.826 2.688 1.00 0.00 C ATOM 946 C THR A 85 -4.111 7.830 3.594 1.00 0.00 C ATOM 947 O THR A 85 -4.754 6.802 3.778 1.00 0.00 O ATOM 948 CB THR A 85 -1.583 7.909 3.547 1.00 0.00 C ATOM 949 OG1 THR A 85 -1.559 9.114 4.296 1.00 0.00 O ATOM 950 CG2 THR A 85 -0.356 7.871 2.679 1.00 0.00 C ATOM 0 H THR A 85 -2.244 9.636 1.822 1.00 0.00 H new ATOM 0 HA THR A 85 -2.837 6.891 2.128 1.00 0.00 H new ATOM 0 HB THR A 85 -1.585 7.050 4.219 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.389 8.910 5.239 1.00 0.00 H new ATOM 0 HG21 THR A 85 0.534 7.931 3.305 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.340 6.940 2.113 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.372 8.715 1.989 1.00 0.00 H new ATOM 958 N ILE A 86 -4.484 9.015 4.078 1.00 0.00 N ATOM 959 CA ILE A 86 -5.672 9.184 4.903 1.00 0.00 C ATOM 960 C ILE A 86 -6.927 8.865 4.122 1.00 0.00 C ATOM 961 O ILE A 86 -7.867 8.301 4.669 1.00 0.00 O ATOM 962 CB ILE A 86 -5.754 10.574 5.588 1.00 0.00 C ATOM 963 CG1 ILE A 86 -5.533 11.674 4.568 1.00 0.00 C ATOM 964 CG2 ILE A 86 -4.756 10.667 6.724 1.00 0.00 C ATOM 965 CD1 ILE A 86 -5.398 13.046 5.132 1.00 0.00 C ATOM 0 H ILE A 86 -3.971 9.880 3.908 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.587 8.463 5.716 1.00 0.00 H new ATOM 0 HB ILE A 86 -6.750 10.701 6.011 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -4.633 11.443 3.998 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -6.366 11.668 3.865 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.828 11.649 7.192 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.973 9.896 7.463 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.748 10.524 6.335 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.243 13.759 4.322 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -6.306 13.307 5.676 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -4.546 13.078 5.811 1.00 0.00 H new ATOM 977 N LEU A 87 -6.950 9.249 2.845 1.00 0.00 N ATOM 978 CA LEU A 87 -8.070 8.912 1.954 1.00 0.00 C ATOM 979 C LEU A 87 -8.250 7.424 1.851 1.00 0.00 C ATOM 980 O LEU A 87 -9.352 6.915 1.977 1.00 0.00 O ATOM 981 CB LEU A 87 -7.801 9.423 0.545 1.00 0.00 C ATOM 982 CG LEU A 87 -8.278 10.808 0.190 1.00 0.00 C ATOM 983 CD1 LEU A 87 -7.713 11.168 -1.185 1.00 0.00 C ATOM 984 CD2 LEU A 87 -9.801 10.793 0.132 1.00 0.00 C ATOM 0 H LEU A 87 -6.209 9.793 2.402 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.961 9.376 2.376 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.725 9.388 0.377 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.256 8.723 -0.156 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.948 11.538 0.929 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.045 12.168 -1.464 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.624 11.144 -1.148 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.067 10.449 -1.924 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.165 11.788 -0.124 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.129 10.081 -0.625 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.199 10.500 1.103 1.00 0.00 H new ATOM 996 N ALA A 88 -7.159 6.731 1.689 1.00 0.00 N ATOM 997 CA ALA A 88 -7.204 5.312 1.543 1.00 0.00 C ATOM 998 C ALA A 88 -7.561 4.637 2.847 1.00 0.00 C ATOM 999 O ALA A 88 -8.355 3.737 2.864 1.00 0.00 O ATOM 1000 CB ALA A 88 -5.919 4.794 0.946 1.00 0.00 C ATOM 0 H ALA A 88 -6.222 7.134 1.655 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.000 5.061 0.842 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.976 3.710 0.844 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.767 5.243 -0.035 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.085 5.054 1.597 1.00 0.00 H new ATOM 1006 N VAL A 89 -7.012 5.114 3.945 1.00 0.00 N ATOM 1007 CA VAL A 89 -7.333 4.546 5.247 1.00 0.00 C ATOM 1008 C VAL A 89 -8.822 4.719 5.560 1.00 0.00 C ATOM 1009 O VAL A 89 -9.513 3.764 5.849 1.00 0.00 O ATOM 1010 CB VAL A 89 -6.496 5.187 6.388 1.00 0.00 C ATOM 1011 CG1 VAL A 89 -6.947 4.657 7.734 1.00 0.00 C ATOM 1012 CG2 VAL A 89 -5.015 4.911 6.197 1.00 0.00 C ATOM 0 H VAL A 89 -6.347 5.887 3.967 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.086 3.486 5.195 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.655 6.265 6.356 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.351 5.115 8.524 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.999 4.899 7.886 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.816 3.575 7.762 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.452 5.371 7.009 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.842 3.835 6.199 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.687 5.329 5.245 1.00 0.00 H new ATOM 1022 N ASP A 90 -9.298 5.919 5.389 1.00 0.00 N ATOM 1023 CA ASP A 90 -10.674 6.303 5.728 1.00 0.00 C ATOM 1024 C ASP A 90 -11.694 5.602 4.854 1.00 0.00 C ATOM 1025 O ASP A 90 -12.750 5.204 5.322 1.00 0.00 O ATOM 1026 CB ASP A 90 -10.820 7.833 5.637 1.00 0.00 C ATOM 1027 CG ASP A 90 -12.245 8.355 5.720 1.00 0.00 C ATOM 1028 OD1 ASP A 90 -12.926 8.165 6.754 1.00 0.00 O ATOM 1029 OD2 ASP A 90 -12.696 8.992 4.752 1.00 0.00 O ATOM 0 H ASP A 90 -8.745 6.685 5.004 1.00 0.00 H new ATOM 0 HA ASP A 90 -10.874 5.985 6.751 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.237 8.286 6.439 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -10.382 8.168 4.697 1.00 0.00 H new ATOM 1034 N ASN A 91 -11.349 5.403 3.615 1.00 0.00 N ATOM 1035 CA ASN A 91 -12.273 4.786 2.657 1.00 0.00 C ATOM 1036 C ASN A 91 -12.195 3.260 2.647 1.00 0.00 C ATOM 1037 O ASN A 91 -13.202 2.574 2.403 1.00 0.00 O ATOM 1038 CB ASN A 91 -12.066 5.327 1.231 1.00 0.00 C ATOM 1039 CG ASN A 91 -12.512 6.780 1.008 1.00 0.00 C ATOM 1040 OD1 ASN A 91 -12.510 7.618 1.913 1.00 0.00 O ATOM 1041 ND2 ASN A 91 -12.876 7.093 -0.215 1.00 0.00 N ATOM 0 H ASN A 91 -10.439 5.652 3.227 1.00 0.00 H new ATOM 0 HA ASN A 91 -13.270 5.063 2.999 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -11.008 5.246 0.980 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -12.609 4.687 0.535 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.165 8.047 -0.433 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -12.869 6.382 -0.947 1.00 0.00 H new ATOM 1048 N LEU A 92 -11.038 2.726 2.962 1.00 0.00 N ATOM 1049 CA LEU A 92 -10.801 1.282 2.855 1.00 0.00 C ATOM 1050 C LEU A 92 -10.963 0.563 4.171 1.00 0.00 C ATOM 1051 O LEU A 92 -11.258 -0.635 4.195 1.00 0.00 O ATOM 1052 CB LEU A 92 -9.413 1.019 2.302 1.00 0.00 C ATOM 1053 CG LEU A 92 -9.229 1.124 0.807 1.00 0.00 C ATOM 1054 CD1 LEU A 92 -7.791 1.495 0.504 1.00 0.00 C ATOM 1055 CD2 LEU A 92 -9.546 -0.216 0.176 1.00 0.00 C ATOM 0 H LEU A 92 -10.236 3.261 3.297 1.00 0.00 H new ATOM 0 HA LEU A 92 -11.557 0.891 2.175 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.724 1.718 2.776 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.113 0.017 2.609 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.894 1.888 0.405 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.655 1.572 -0.575 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.557 2.453 0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -7.126 0.728 0.900 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.416 -0.149 -0.904 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -8.874 -0.975 0.576 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.577 -0.489 0.401 1.00 0.00 H new ATOM 1067 N ASN A 93 -10.749 1.268 5.264 1.00 0.00 N ATOM 1068 CA ASN A 93 -10.870 0.664 6.589 1.00 0.00 C ATOM 1069 C ASN A 93 -12.282 0.150 6.785 1.00 0.00 C ATOM 1070 O ASN A 93 -13.246 0.903 6.611 1.00 0.00 O ATOM 1071 CB ASN A 93 -10.570 1.718 7.660 1.00 0.00 C ATOM 1072 CG ASN A 93 -10.755 1.225 9.088 1.00 0.00 C ATOM 1073 OD1 ASN A 93 -11.854 1.252 9.631 1.00 0.00 O ATOM 1074 ND2 ASN A 93 -9.679 0.851 9.733 1.00 0.00 N ATOM 0 H ASN A 93 -10.491 2.255 5.268 1.00 0.00 H new ATOM 0 HA ASN A 93 -10.163 -0.161 6.674 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -9.544 2.063 7.537 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -11.218 2.579 7.498 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.742 0.573 10.712 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -8.777 0.838 9.256 1.00 0.00 H new ATOM 1081 N GLY A 94 -12.406 -1.116 7.116 1.00 0.00 N ATOM 1082 CA GLY A 94 -13.702 -1.693 7.370 1.00 0.00 C ATOM 1083 C GLY A 94 -14.452 -2.092 6.105 1.00 0.00 C ATOM 1084 O GLY A 94 -15.564 -2.621 6.192 1.00 0.00 O ATOM 0 H GLY A 94 -11.624 -1.763 7.215 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.581 -2.572 8.003 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.305 -0.978 7.929 1.00 0.00 H new ATOM 1088 N PHE A 95 -13.863 -1.853 4.939 1.00 0.00 N ATOM 1089 CA PHE A 95 -14.524 -2.175 3.683 1.00 0.00 C ATOM 1090 C PHE A 95 -14.251 -3.631 3.335 1.00 0.00 C ATOM 1091 O PHE A 95 -13.133 -4.108 3.496 1.00 0.00 O ATOM 1092 CB PHE A 95 -14.052 -1.245 2.545 1.00 0.00 C ATOM 1093 CG PHE A 95 -14.816 -1.428 1.260 1.00 0.00 C ATOM 1094 CD1 PHE A 95 -15.973 -0.721 1.025 1.00 0.00 C ATOM 1095 CD2 PHE A 95 -14.385 -2.318 0.301 1.00 0.00 C ATOM 1096 CE1 PHE A 95 -16.684 -0.901 -0.143 1.00 0.00 C ATOM 1097 CE2 PHE A 95 -15.091 -2.500 -0.867 1.00 0.00 C ATOM 1098 CZ PHE A 95 -16.242 -1.791 -1.088 1.00 0.00 C ATOM 0 H PHE A 95 -12.936 -1.440 4.839 1.00 0.00 H new ATOM 0 HA PHE A 95 -15.597 -2.023 3.801 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -14.148 -0.209 2.870 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -12.993 -1.423 2.357 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -16.328 -0.017 1.763 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -13.479 -2.882 0.468 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -17.591 -0.340 -0.314 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -14.738 -3.201 -1.608 1.00 0.00 H new ATOM 0 HZ PHE A 95 -16.799 -1.932 -2.002 1.00 0.00 H new ATOM 1108 N LYS A 96 -15.256 -4.322 2.866 1.00 0.00 N ATOM 1109 CA LYS A 96 -15.134 -5.730 2.572 1.00 0.00 C ATOM 1110 C LYS A 96 -14.743 -5.979 1.123 1.00 0.00 C ATOM 1111 O LYS A 96 -15.470 -5.604 0.198 1.00 0.00 O ATOM 1112 CB LYS A 96 -16.430 -6.519 2.920 1.00 0.00 C ATOM 1113 CG LYS A 96 -16.788 -6.618 4.420 1.00 0.00 C ATOM 1114 CD LYS A 96 -17.180 -5.274 5.022 1.00 0.00 C ATOM 1115 CE LYS A 96 -17.492 -5.372 6.508 1.00 0.00 C ATOM 1116 NZ LYS A 96 -17.787 -4.050 7.100 1.00 0.00 N ATOM 0 H LYS A 96 -16.178 -3.930 2.677 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.332 -6.100 3.210 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -17.266 -6.052 2.399 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -16.332 -7.530 2.524 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.610 -7.322 4.547 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.936 -7.021 4.967 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.370 -4.561 4.870 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -18.051 -4.884 4.496 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.345 -6.034 6.656 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.645 -5.821 7.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.827 -4.135 8.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.040 -3.377 6.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.703 -3.707 6.745 1.00 0.00 H new ATOM 1130 N ILE A 97 -13.588 -6.573 0.938 1.00 0.00 N ATOM 1131 CA ILE A 97 -13.127 -7.018 -0.361 1.00 0.00 C ATOM 1132 C ILE A 97 -12.785 -8.486 -0.182 1.00 0.00 C ATOM 1133 O ILE A 97 -12.266 -8.862 0.870 1.00 0.00 O ATOM 1134 CB ILE A 97 -11.832 -6.254 -0.836 1.00 0.00 C ATOM 1135 CG1 ILE A 97 -12.067 -4.733 -0.918 1.00 0.00 C ATOM 1136 CG2 ILE A 97 -11.337 -6.789 -2.184 1.00 0.00 C ATOM 1137 CD1 ILE A 97 -10.870 -3.934 -1.397 1.00 0.00 C ATOM 0 H ILE A 97 -12.931 -6.765 1.694 1.00 0.00 H new ATOM 0 HA ILE A 97 -13.894 -6.833 -1.113 1.00 0.00 H new ATOM 0 HB ILE A 97 -11.061 -6.436 -0.087 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -12.905 -4.544 -1.588 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -12.359 -4.370 0.068 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -10.443 -6.243 -2.486 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -11.101 -7.849 -2.090 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -12.115 -6.656 -2.936 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -11.126 -2.875 -1.423 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -10.033 -4.088 -0.715 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -10.589 -4.264 -2.397 1.00 0.00 H new ATOM 1149 N GLY A 98 -13.072 -9.310 -1.170 1.00 0.00 N ATOM 1150 CA GLY A 98 -12.775 -10.735 -1.087 1.00 0.00 C ATOM 1151 C GLY A 98 -13.487 -11.441 0.062 1.00 0.00 C ATOM 1152 O GLY A 98 -13.061 -12.510 0.496 1.00 0.00 O ATOM 0 H GLY A 98 -13.512 -9.021 -2.044 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -13.057 -11.212 -2.026 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -11.699 -10.867 -0.973 1.00 0.00 H new ATOM 1156 N GLY A 99 -14.550 -10.837 0.564 1.00 0.00 N ATOM 1157 CA GLY A 99 -15.299 -11.419 1.649 1.00 0.00 C ATOM 1158 C GLY A 99 -14.703 -11.096 3.006 1.00 0.00 C ATOM 1159 O GLY A 99 -15.105 -11.669 4.031 1.00 0.00 O ATOM 0 H GLY A 99 -14.910 -9.942 0.232 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -16.327 -11.057 1.612 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.337 -12.501 1.521 1.00 0.00 H new ATOM 1163 N ARG A 100 -13.755 -10.185 3.033 1.00 0.00 N ATOM 1164 CA ARG A 100 -13.117 -9.806 4.266 1.00 0.00 C ATOM 1165 C ARG A 100 -12.967 -8.307 4.374 1.00 0.00 C ATOM 1166 O ARG A 100 -12.784 -7.620 3.379 1.00 0.00 O ATOM 1167 CB ARG A 100 -11.784 -10.543 4.453 1.00 0.00 C ATOM 1168 CG ARG A 100 -10.823 -10.473 3.271 1.00 0.00 C ATOM 1169 CD ARG A 100 -9.568 -11.253 3.571 1.00 0.00 C ATOM 1170 NE ARG A 100 -9.857 -12.668 3.838 1.00 0.00 N ATOM 1171 CZ ARG A 100 -8.959 -13.621 4.114 1.00 0.00 C ATOM 1172 NH1 ARG A 100 -7.664 -13.340 4.187 1.00 0.00 N ATOM 1173 NH2 ARG A 100 -9.368 -14.857 4.329 1.00 0.00 N ATOM 0 H ARG A 100 -13.410 -9.693 2.209 1.00 0.00 H new ATOM 0 HA ARG A 100 -13.766 -10.114 5.086 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -11.283 -10.134 5.331 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -11.995 -11.591 4.666 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -11.304 -10.873 2.378 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -10.572 -9.434 3.059 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -8.881 -11.175 2.728 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -9.065 -10.815 4.434 1.00 0.00 H new ATOM 0 HE ARG A 100 -10.836 -12.952 3.810 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.340 -12.385 4.032 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -6.993 -14.079 4.398 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -10.362 -15.080 4.284 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -8.690 -15.589 4.540 1.00 0.00 H new ATOM 1187 N ALA A 101 -13.073 -7.807 5.574 1.00 0.00 N ATOM 1188 CA ALA A 101 -13.003 -6.388 5.816 1.00 0.00 C ATOM 1189 C ALA A 101 -11.572 -5.957 5.930 1.00 0.00 C ATOM 1190 O ALA A 101 -10.867 -6.417 6.814 1.00 0.00 O ATOM 1191 CB ALA A 101 -13.756 -6.031 7.081 1.00 0.00 C ATOM 0 H ALA A 101 -13.210 -8.370 6.414 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.465 -5.867 4.977 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -13.694 -4.956 7.250 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -14.801 -6.322 6.977 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -13.315 -6.558 7.928 1.00 0.00 H new ATOM 1197 N LEU A 102 -11.151 -5.098 5.039 1.00 0.00 N ATOM 1198 CA LEU A 102 -9.803 -4.589 5.028 1.00 0.00 C ATOM 1199 C LEU A 102 -9.498 -3.753 6.228 1.00 0.00 C ATOM 1200 O LEU A 102 -10.330 -2.959 6.698 1.00 0.00 O ATOM 1201 CB LEU A 102 -9.498 -3.801 3.761 1.00 0.00 C ATOM 1202 CG LEU A 102 -8.856 -4.579 2.622 1.00 0.00 C ATOM 1203 CD1 LEU A 102 -8.680 -3.678 1.420 1.00 0.00 C ATOM 1204 CD2 LEU A 102 -7.503 -5.098 3.070 1.00 0.00 C ATOM 0 H LEU A 102 -11.740 -4.728 4.293 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.158 -5.468 5.054 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.428 -3.366 3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.840 -2.973 4.023 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.498 -5.416 2.349 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -8.220 -4.241 0.608 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.653 -3.306 1.098 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -8.040 -2.837 1.686 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.040 -5.656 2.256 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.864 -4.259 3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.632 -5.753 3.932 1.00 0.00 H new ATOM 1216 N LYS A 103 -8.330 -3.934 6.737 1.00 0.00 N ATOM 1217 CA LYS A 103 -7.889 -3.184 7.851 1.00 0.00 C ATOM 1218 C LYS A 103 -6.814 -2.242 7.394 1.00 0.00 C ATOM 1219 O LYS A 103 -5.782 -2.663 6.952 1.00 0.00 O ATOM 1220 CB LYS A 103 -7.383 -4.127 8.956 1.00 0.00 C ATOM 1221 CG LYS A 103 -6.744 -3.463 10.175 1.00 0.00 C ATOM 1222 CD LYS A 103 -7.717 -2.610 10.975 1.00 0.00 C ATOM 1223 CE LYS A 103 -7.022 -2.070 12.222 1.00 0.00 C ATOM 1224 NZ LYS A 103 -7.908 -1.249 13.068 1.00 0.00 N ATOM 0 H LYS A 103 -7.653 -4.612 6.387 1.00 0.00 H new ATOM 0 HA LYS A 103 -8.712 -2.605 8.271 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -8.221 -4.734 9.298 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.654 -4.808 8.517 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.329 -4.234 10.824 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.911 -2.841 9.846 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -8.080 -1.784 10.363 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -8.587 -3.203 11.259 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.641 -2.906 12.809 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -6.161 -1.473 11.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -7.380 -0.911 13.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -8.252 -0.434 12.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -8.717 -1.822 13.382 1.00 0.00 H new ATOM 1238 N ILE A 104 -7.066 -0.977 7.474 1.00 0.00 N ATOM 1239 CA ILE A 104 -6.070 -0.018 7.073 1.00 0.00 C ATOM 1240 C ILE A 104 -5.794 0.841 8.267 1.00 0.00 C ATOM 1241 O ILE A 104 -6.744 1.287 8.938 1.00 0.00 O ATOM 1242 CB ILE A 104 -6.538 0.912 5.928 1.00 0.00 C ATOM 1243 CG1 ILE A 104 -7.433 0.181 4.921 1.00 0.00 C ATOM 1244 CG2 ILE A 104 -5.310 1.467 5.202 1.00 0.00 C ATOM 1245 CD1 ILE A 104 -6.775 -0.931 4.148 1.00 0.00 C ATOM 0 H ILE A 104 -7.943 -0.578 7.809 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.199 -0.565 6.711 1.00 0.00 H new ATOM 0 HB ILE A 104 -7.125 1.718 6.369 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.289 -0.230 5.456 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -7.821 0.911 4.211 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -5.631 2.124 4.393 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -4.696 2.030 5.904 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -4.727 0.643 4.790 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -7.499 -1.378 3.466 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.937 -0.531 3.577 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -6.412 -1.690 4.841 1.00 0.00 H new ATOM 1257 N ASP A 105 -4.553 1.028 8.576 1.00 0.00 N ATOM 1258 CA ASP A 105 -4.165 1.825 9.713 1.00 0.00 C ATOM 1259 C ASP A 105 -2.893 2.583 9.356 1.00 0.00 C ATOM 1260 O ASP A 105 -2.174 2.169 8.453 1.00 0.00 O ATOM 1261 CB ASP A 105 -3.936 0.901 10.920 1.00 0.00 C ATOM 1262 CG ASP A 105 -3.857 1.640 12.239 1.00 0.00 C ATOM 1263 OD1 ASP A 105 -4.932 1.923 12.840 1.00 0.00 O ATOM 1264 OD2 ASP A 105 -2.754 1.954 12.702 1.00 0.00 O ATOM 0 H ASP A 105 -3.771 0.635 8.052 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.945 2.541 9.972 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.745 0.172 10.969 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -3.012 0.342 10.770 1.00 0.00 H new ATOM 1269 N HIS A 106 -2.642 3.692 9.994 1.00 0.00 N ATOM 1270 CA HIS A 106 -1.418 4.451 9.737 1.00 0.00 C ATOM 1271 C HIS A 106 -0.262 3.892 10.541 1.00 0.00 C ATOM 1272 O HIS A 106 -0.390 3.670 11.743 1.00 0.00 O ATOM 1273 CB HIS A 106 -1.603 5.939 10.019 1.00 0.00 C ATOM 1274 CG HIS A 106 -1.725 6.779 8.783 1.00 0.00 C ATOM 1275 ND1 HIS A 106 -2.915 7.247 8.265 1.00 0.00 N ATOM 1276 CD2 HIS A 106 -0.755 7.263 7.973 1.00 0.00 C ATOM 1277 CE1 HIS A 106 -2.634 7.981 7.189 1.00 0.00 C ATOM 1278 NE2 HIS A 106 -1.335 8.025 6.966 1.00 0.00 N ATOM 0 H HIS A 106 -3.258 4.102 10.697 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.186 4.347 8.677 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -2.496 6.075 10.629 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -0.757 6.296 10.607 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -3.846 7.063 8.640 1.00 0.00 H new ATOM 0 HD2 HIS A 106 0.304 7.085 8.091 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -3.375 8.476 6.578 1.00 0.00 H new ATOM 1286 N THR A 107 0.857 3.682 9.898 1.00 0.00 N ATOM 1287 CA THR A 107 1.984 3.082 10.552 1.00 0.00 C ATOM 1288 C THR A 107 3.252 3.552 9.829 1.00 0.00 C ATOM 1289 O THR A 107 3.172 4.029 8.699 1.00 0.00 O ATOM 1290 CB THR A 107 1.880 1.503 10.452 1.00 0.00 C ATOM 1291 OG1 THR A 107 2.754 0.864 11.391 1.00 0.00 O ATOM 1292 CG2 THR A 107 2.262 1.023 9.048 1.00 0.00 C ATOM 0 H THR A 107 1.010 3.920 8.918 1.00 0.00 H new ATOM 0 HA THR A 107 2.010 3.370 11.603 1.00 0.00 H new ATOM 0 HB THR A 107 0.846 1.238 10.673 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.668 -0.109 11.308 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.184 -0.063 9.001 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.588 1.467 8.316 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.286 1.323 8.827 1.00 0.00 H new ATOM 1300 N PHE A 108 4.387 3.469 10.472 1.00 0.00 N ATOM 1301 CA PHE A 108 5.620 3.683 9.768 1.00 0.00 C ATOM 1302 C PHE A 108 6.194 2.333 9.455 1.00 0.00 C ATOM 1303 O PHE A 108 6.582 1.582 10.358 1.00 0.00 O ATOM 1304 CB PHE A 108 6.620 4.525 10.566 1.00 0.00 C ATOM 1305 CG PHE A 108 6.248 5.976 10.683 1.00 0.00 C ATOM 1306 CD1 PHE A 108 6.570 6.863 9.667 1.00 0.00 C ATOM 1307 CD2 PHE A 108 5.585 6.456 11.800 1.00 0.00 C ATOM 1308 CE1 PHE A 108 6.239 8.197 9.761 1.00 0.00 C ATOM 1309 CE2 PHE A 108 5.251 7.792 11.899 1.00 0.00 C ATOM 1310 CZ PHE A 108 5.578 8.663 10.878 1.00 0.00 C ATOM 0 H PHE A 108 4.482 3.258 11.465 1.00 0.00 H new ATOM 0 HA PHE A 108 5.420 4.249 8.858 1.00 0.00 H new ATOM 0 HB2 PHE A 108 6.715 4.104 11.567 1.00 0.00 H new ATOM 0 HB3 PHE A 108 7.600 4.450 10.094 1.00 0.00 H new ATOM 0 HD1 PHE A 108 7.087 6.503 8.790 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.327 5.779 12.601 1.00 0.00 H new ATOM 0 HE1 PHE A 108 6.497 8.876 8.962 1.00 0.00 H new ATOM 0 HE2 PHE A 108 4.734 8.156 12.775 1.00 0.00 H new ATOM 0 HZ PHE A 108 5.316 9.708 10.954 1.00 0.00 H new ATOM 1320 N TYR A 109 6.227 2.014 8.206 1.00 0.00 N ATOM 1321 CA TYR A 109 6.688 0.727 7.756 1.00 0.00 C ATOM 1322 C TYR A 109 8.066 0.870 7.159 1.00 0.00 C ATOM 1323 O TYR A 109 8.333 1.835 6.439 1.00 0.00 O ATOM 1324 CB TYR A 109 5.692 0.174 6.720 1.00 0.00 C ATOM 1325 CG TYR A 109 6.002 -1.202 6.136 1.00 0.00 C ATOM 1326 CD1 TYR A 109 6.930 -1.354 5.114 1.00 0.00 C ATOM 1327 CD2 TYR A 109 5.337 -2.337 6.585 1.00 0.00 C ATOM 1328 CE1 TYR A 109 7.191 -2.580 4.557 1.00 0.00 C ATOM 1329 CE2 TYR A 109 5.594 -3.580 6.035 1.00 0.00 C ATOM 1330 CZ TYR A 109 6.520 -3.699 5.019 1.00 0.00 C ATOM 1331 OH TYR A 109 6.776 -4.940 4.460 1.00 0.00 O ATOM 0 H TYR A 109 5.934 2.639 7.455 1.00 0.00 H new ATOM 0 HA TYR A 109 6.747 0.030 8.592 1.00 0.00 H new ATOM 0 HB2 TYR A 109 4.707 0.132 7.184 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.627 0.886 5.897 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.459 -0.486 4.749 1.00 0.00 H new ATOM 0 HD2 TYR A 109 4.608 -2.247 7.376 1.00 0.00 H new ATOM 0 HE1 TYR A 109 7.916 -2.672 3.762 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.072 -4.453 6.399 1.00 0.00 H new ATOM 0 HH TYR A 109 6.222 -5.618 4.900 1.00 0.00 H new ATOM 1341 N ARG A 110 8.937 -0.061 7.456 1.00 0.00 N ATOM 1342 CA ARG A 110 10.250 -0.052 6.873 1.00 0.00 C ATOM 1343 C ARG A 110 10.433 -1.316 6.042 1.00 0.00 C ATOM 1344 O ARG A 110 10.392 -2.444 6.568 1.00 0.00 O ATOM 1345 CB ARG A 110 11.352 0.096 7.930 1.00 0.00 C ATOM 1346 CG ARG A 110 11.213 1.354 8.772 1.00 0.00 C ATOM 1347 CD ARG A 110 11.270 2.629 7.939 1.00 0.00 C ATOM 1348 NE ARG A 110 10.924 3.814 8.741 1.00 0.00 N ATOM 1349 CZ ARG A 110 10.652 5.028 8.239 1.00 0.00 C ATOM 1350 NH1 ARG A 110 10.862 5.294 6.965 1.00 0.00 N ATOM 1351 NH2 ARG A 110 10.205 5.991 9.023 1.00 0.00 N ATOM 0 H ARG A 110 8.759 -0.833 8.098 1.00 0.00 H new ATOM 0 HA ARG A 110 10.339 0.820 6.225 1.00 0.00 H new ATOM 0 HB2 ARG A 110 11.337 -0.775 8.585 1.00 0.00 H new ATOM 0 HB3 ARG A 110 12.323 0.105 7.434 1.00 0.00 H new ATOM 0 HG2 ARG A 110 10.268 1.321 9.314 1.00 0.00 H new ATOM 0 HG3 ARG A 110 12.007 1.377 9.518 1.00 0.00 H new ATOM 0 HD2 ARG A 110 12.271 2.749 7.524 1.00 0.00 H new ATOM 0 HD3 ARG A 110 10.583 2.545 7.097 1.00 0.00 H new ATOM 0 HE ARG A 110 10.888 3.704 9.754 1.00 0.00 H new ATOM 0 HH11 ARG A 110 11.236 4.573 6.348 1.00 0.00 H new ATOM 0 HH12 ARG A 110 10.651 6.221 6.596 1.00 0.00 H new ATOM 0 HH21 ARG A 110 10.064 5.815 10.018 1.00 0.00 H new ATOM 0 HH22 ARG A 110 10.000 6.912 8.634 1.00 0.00 H new ATOM 1365 N PRO A 111 10.570 -1.138 4.736 1.00 0.00 N ATOM 1366 CA PRO A 111 10.714 -2.228 3.771 1.00 0.00 C ATOM 1367 C PRO A 111 12.075 -2.909 3.792 1.00 0.00 C ATOM 1368 O PRO A 111 13.099 -2.284 4.090 1.00 0.00 O ATOM 1369 CB PRO A 111 10.537 -1.516 2.432 1.00 0.00 C ATOM 1370 CG PRO A 111 10.997 -0.134 2.687 1.00 0.00 C ATOM 1371 CD PRO A 111 10.546 0.173 4.072 1.00 0.00 C ATOM 0 HA PRO A 111 10.003 -3.027 3.984 1.00 0.00 H new ATOM 0 HB2 PRO A 111 11.125 -1.992 1.648 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.497 -1.535 2.106 1.00 0.00 H new ATOM 0 HG2 PRO A 111 12.081 -0.056 2.598 1.00 0.00 H new ATOM 0 HG3 PRO A 111 10.567 0.564 1.968 1.00 0.00 H new ATOM 0 HD2 PRO A 111 11.210 0.884 4.563 1.00 0.00 H new ATOM 0 HD3 PRO A 111 9.548 0.610 4.082 1.00 0.00 H new ATOM 1379 N LYS A 112 12.073 -4.170 3.470 1.00 0.00 N ATOM 1380 CA LYS A 112 13.275 -4.928 3.303 1.00 0.00 C ATOM 1381 C LYS A 112 13.491 -5.165 1.823 1.00 0.00 C ATOM 1382 O LYS A 112 12.645 -5.749 1.148 1.00 0.00 O ATOM 1383 CB LYS A 112 13.210 -6.260 4.056 1.00 0.00 C ATOM 1384 CG LYS A 112 14.381 -7.201 3.763 1.00 0.00 C ATOM 1385 CD LYS A 112 15.735 -6.609 4.148 1.00 0.00 C ATOM 1386 CE LYS A 112 16.875 -7.574 3.819 1.00 0.00 C ATOM 1387 NZ LYS A 112 16.925 -7.935 2.373 1.00 0.00 N ATOM 0 H LYS A 112 11.221 -4.708 3.314 1.00 0.00 H new ATOM 0 HA LYS A 112 14.111 -4.367 3.720 1.00 0.00 H new ATOM 0 HB2 LYS A 112 13.179 -6.059 5.127 1.00 0.00 H new ATOM 0 HB3 LYS A 112 12.279 -6.765 3.799 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.233 -8.136 4.304 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.386 -7.445 2.701 1.00 0.00 H new ATOM 0 HD2 LYS A 112 15.887 -5.668 3.619 1.00 0.00 H new ATOM 0 HD3 LYS A 112 15.745 -6.380 5.214 1.00 0.00 H new ATOM 0 HE2 LYS A 112 17.823 -7.122 4.109 1.00 0.00 H new ATOM 0 HE3 LYS A 112 16.760 -8.481 4.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 17.807 -8.450 2.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 16.111 -8.538 2.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 16.892 -7.069 1.798 1.00 0.00 H new ATOM 1401 N ARG A 113 14.584 -4.689 1.329 1.00 0.00 N ATOM 1402 CA ARG A 113 14.925 -4.845 -0.054 1.00 0.00 C ATOM 1403 C ARG A 113 15.901 -5.982 -0.171 1.00 0.00 C ATOM 1404 O ARG A 113 16.962 -5.935 0.494 1.00 0.00 O ATOM 1405 CB ARG A 113 15.508 -3.551 -0.635 1.00 0.00 C ATOM 1406 CG ARG A 113 14.589 -2.336 -0.509 1.00 0.00 C ATOM 1407 CD ARG A 113 13.245 -2.550 -1.203 1.00 0.00 C ATOM 1408 NE ARG A 113 12.358 -1.383 -1.050 1.00 0.00 N ATOM 1409 CZ ARG A 113 11.066 -1.329 -1.431 1.00 0.00 C ATOM 1410 NH1 ARG A 113 10.486 -2.370 -2.026 1.00 0.00 N ATOM 1411 NH2 ARG A 113 10.365 -0.225 -1.212 1.00 0.00 N ATOM 1412 OXT ARG A 113 15.623 -6.945 -0.895 1.00 0.00 O ATOM 0 H ARG A 113 15.276 -4.175 1.875 1.00 0.00 H new ATOM 0 HA ARG A 113 14.027 -5.067 -0.631 1.00 0.00 H new ATOM 0 HB2 ARG A 113 16.450 -3.333 -0.133 1.00 0.00 H new ATOM 0 HB3 ARG A 113 15.738 -3.711 -1.688 1.00 0.00 H new ATOM 0 HG2 ARG A 113 14.420 -2.119 0.546 1.00 0.00 H new ATOM 0 HG3 ARG A 113 15.082 -1.464 -0.939 1.00 0.00 H new ATOM 0 HD2 ARG A 113 13.410 -2.745 -2.263 1.00 0.00 H new ATOM 0 HD3 ARG A 113 12.759 -3.433 -0.789 1.00 0.00 H new ATOM 0 HE ARG A 113 12.754 -0.547 -0.620 1.00 0.00 H new ATOM 0 HH11 ARG A 113 11.020 -3.222 -2.198 1.00 0.00 H new ATOM 0 HH12 ARG A 113 9.508 -2.316 -2.309 1.00 0.00 H new ATOM 0 HH21 ARG A 113 10.804 0.576 -0.758 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.387 -0.177 -1.498 1.00 0.00 H new TER 1426 ARG A 113 ATOM 1427 N ASN B 222 -12.065 11.000 3.121 1.00 0.00 N ATOM 1428 CA ASN B 222 -13.320 11.187 2.402 1.00 0.00 C ATOM 1429 C ASN B 222 -13.311 12.471 1.564 1.00 0.00 C ATOM 1430 O ASN B 222 -13.058 13.549 2.095 1.00 0.00 O ATOM 1431 CB ASN B 222 -14.455 11.283 3.416 1.00 0.00 C ATOM 1432 CG ASN B 222 -15.807 11.482 2.781 1.00 0.00 C ATOM 1433 OD1 ASN B 222 -16.059 11.030 1.673 1.00 0.00 O ATOM 1434 ND2 ASN B 222 -16.675 12.173 3.472 1.00 0.00 N ATOM 0 HA ASN B 222 -13.454 10.339 1.731 1.00 0.00 H new ATOM 0 HB2 ASN B 222 -14.474 10.374 4.017 1.00 0.00 H new ATOM 0 HB3 ASN B 222 -14.256 12.111 4.097 1.00 0.00 H new ATOM 0 HD21 ASN B 222 -17.604 12.353 3.090 1.00 0.00 H new ATOM 0 HD22 ASN B 222 -16.424 12.532 4.393 1.00 0.00 H new ATOM 1443 N ARG B 223 -13.550 12.331 0.256 1.00 0.00 N ATOM 1444 CA ARG B 223 -13.804 13.456 -0.671 1.00 0.00 C ATOM 1445 C ARG B 223 -12.684 14.539 -0.722 1.00 0.00 C ATOM 1446 O ARG B 223 -12.915 15.737 -0.510 1.00 0.00 O ATOM 1447 CB ARG B 223 -15.165 14.076 -0.415 1.00 0.00 C ATOM 1448 CG ARG B 223 -15.630 14.999 -1.520 1.00 0.00 C ATOM 1449 CD ARG B 223 -16.774 15.830 -1.045 1.00 0.00 C ATOM 1450 NE ARG B 223 -16.364 16.622 0.109 1.00 0.00 N ATOM 1451 CZ ARG B 223 -17.193 17.314 0.901 1.00 0.00 C ATOM 1452 NH1 ARG B 223 -18.499 17.336 0.654 1.00 0.00 N ATOM 1453 NH2 ARG B 223 -16.714 17.989 1.929 1.00 0.00 N ATOM 0 H ARG B 223 -13.574 11.420 -0.203 1.00 0.00 H new ATOM 0 HA ARG B 223 -13.795 13.009 -1.665 1.00 0.00 H new ATOM 0 HB2 ARG B 223 -15.898 13.280 -0.286 1.00 0.00 H new ATOM 0 HB3 ARG B 223 -15.130 14.633 0.521 1.00 0.00 H new ATOM 0 HG2 ARG B 223 -14.809 15.643 -1.836 1.00 0.00 H new ATOM 0 HG3 ARG B 223 -15.931 14.415 -2.390 1.00 0.00 H new ATOM 0 HD2 ARG B 223 -17.115 16.487 -1.845 1.00 0.00 H new ATOM 0 HD3 ARG B 223 -17.614 15.189 -0.778 1.00 0.00 H new ATOM 0 HE ARG B 223 -15.369 16.651 0.330 1.00 0.00 H new ATOM 0 HH11 ARG B 223 -18.876 16.824 -0.143 1.00 0.00 H new ATOM 0 HH12 ARG B 223 -19.124 17.865 1.262 1.00 0.00 H new ATOM 0 HH21 ARG B 223 -15.712 17.984 2.120 1.00 0.00 H new ATOM 0 HH22 ARG B 223 -17.346 18.516 2.532 1.00 0.00 H new ATOM 1467 N PHE B 224 -11.508 14.099 -0.919 1.00 0.00 N ATOM 1468 CA PHE B 224 -10.331 14.964 -1.085 1.00 0.00 C ATOM 1469 C PHE B 224 -10.060 15.152 -2.577 1.00 0.00 C ATOM 1470 O PHE B 224 -10.616 14.422 -3.416 1.00 0.00 O ATOM 1471 CB PHE B 224 -9.096 14.361 -0.461 1.00 0.00 C ATOM 1472 CG PHE B 224 -8.968 14.376 1.029 1.00 0.00 C ATOM 1473 CD1 PHE B 224 -9.889 13.748 1.831 1.00 0.00 C ATOM 1474 CD2 PHE B 224 -7.877 14.981 1.619 1.00 0.00 C ATOM 1475 CE1 PHE B 224 -9.735 13.724 3.187 1.00 0.00 C ATOM 1476 CE2 PHE B 224 -7.709 14.949 2.980 1.00 0.00 C ATOM 1477 CZ PHE B 224 -8.642 14.319 3.764 1.00 0.00 C ATOM 0 H PHE B 224 -11.291 13.104 -0.977 1.00 0.00 H new ATOM 0 HA PHE B 224 -10.545 15.912 -0.592 1.00 0.00 H new ATOM 0 HB2 PHE B 224 -9.032 13.323 -0.788 1.00 0.00 H new ATOM 0 HB3 PHE B 224 -8.230 14.879 -0.873 1.00 0.00 H new ATOM 0 HD1 PHE B 224 -10.746 13.267 1.383 1.00 0.00 H new ATOM 0 HD2 PHE B 224 -7.148 15.485 1.002 1.00 0.00 H new ATOM 0 HE1 PHE B 224 -10.474 13.236 3.806 1.00 0.00 H new ATOM 0 HE2 PHE B 224 -6.847 15.417 3.432 1.00 0.00 H new ATOM 0 HZ PHE B 224 -8.516 14.291 4.836 1.00 0.00 H new ATOM 1487 N ALA B 225 -9.217 16.097 -2.911 1.00 0.00 N ATOM 1488 CA ALA B 225 -8.938 16.418 -4.283 1.00 0.00 C ATOM 1489 C ALA B 225 -7.495 16.110 -4.613 1.00 0.00 C ATOM 1490 O ALA B 225 -6.621 16.973 -4.550 1.00 0.00 O ATOM 1491 CB ALA B 225 -9.286 17.869 -4.597 1.00 0.00 C ATOM 0 H ALA B 225 -8.705 16.665 -2.236 1.00 0.00 H new ATOM 0 HA ALA B 225 -9.571 15.794 -4.915 1.00 0.00 H new ATOM 0 HB1 ALA B 225 -9.063 18.079 -5.643 1.00 0.00 H new ATOM 0 HB2 ALA B 225 -10.347 18.037 -4.412 1.00 0.00 H new ATOM 0 HB3 ALA B 225 -8.697 18.530 -3.961 1.00 0.00 H new ATOM 1497 N ILE B 226 -7.241 14.859 -4.855 1.00 0.00 N ATOM 1498 CA ILE B 226 -5.931 14.386 -5.246 1.00 0.00 C ATOM 1499 C ILE B 226 -6.092 13.609 -6.520 1.00 0.00 C ATOM 1500 O ILE B 226 -7.076 12.880 -6.672 1.00 0.00 O ATOM 1501 CB ILE B 226 -5.241 13.483 -4.146 1.00 0.00 C ATOM 1502 CG1 ILE B 226 -4.882 14.279 -2.887 1.00 0.00 C ATOM 1503 CG2 ILE B 226 -4.019 12.749 -4.670 1.00 0.00 C ATOM 1504 CD1 ILE B 226 -5.999 14.414 -1.908 1.00 0.00 C ATOM 0 H ILE B 226 -7.942 14.122 -4.788 1.00 0.00 H new ATOM 0 HA ILE B 226 -5.278 15.249 -5.378 1.00 0.00 H new ATOM 0 HB ILE B 226 -5.985 12.734 -3.876 1.00 0.00 H new ATOM 0 HG12 ILE B 226 -4.038 13.796 -2.394 1.00 0.00 H new ATOM 0 HG13 ILE B 226 -4.551 15.275 -3.183 1.00 0.00 H new ATOM 0 HG21 ILE B 226 -3.587 12.145 -3.872 1.00 0.00 H new ATOM 0 HG22 ILE B 226 -4.310 12.102 -5.497 1.00 0.00 H new ATOM 0 HG23 ILE B 226 -3.281 13.472 -5.018 1.00 0.00 H new ATOM 0 HD11 ILE B 226 -5.661 14.991 -1.047 1.00 0.00 H new ATOM 0 HD12 ILE B 226 -6.837 14.926 -2.381 1.00 0.00 H new ATOM 0 HD13 ILE B 226 -6.317 13.424 -1.580 1.00 0.00 H new ATOM 1516 N MET B 227 -5.176 13.792 -7.442 1.00 0.00 N ATOM 1517 CA MET B 227 -5.233 13.090 -8.700 1.00 0.00 C ATOM 1518 C MET B 227 -4.999 11.612 -8.482 1.00 0.00 C ATOM 1519 O MET B 227 -4.091 11.224 -7.742 1.00 0.00 O ATOM 1520 CB MET B 227 -4.219 13.629 -9.703 1.00 0.00 C ATOM 1521 CG MET B 227 -4.467 15.054 -10.136 1.00 0.00 C ATOM 1522 SD MET B 227 -3.277 15.632 -11.361 1.00 0.00 S ATOM 1523 CE MET B 227 -3.664 14.547 -12.744 1.00 0.00 C ATOM 0 H MET B 227 -4.381 14.423 -7.343 1.00 0.00 H new ATOM 0 HA MET B 227 -6.228 13.249 -9.116 1.00 0.00 H new ATOM 0 HB2 MET B 227 -3.223 13.563 -9.265 1.00 0.00 H new ATOM 0 HB3 MET B 227 -4.223 12.988 -10.585 1.00 0.00 H new ATOM 0 HG2 MET B 227 -5.473 15.133 -10.548 1.00 0.00 H new ATOM 0 HG3 MET B 227 -4.428 15.706 -9.263 1.00 0.00 H new ATOM 0 HE1 MET B 227 -3.709 15.131 -13.663 1.00 0.00 H new ATOM 0 HE2 MET B 227 -2.890 13.785 -12.836 1.00 0.00 H new ATOM 0 HE3 MET B 227 -4.627 14.067 -12.571 1.00 0.00 H new ATOM 1533 N PRO B 228 -5.835 10.779 -9.086 1.00 0.00 N ATOM 1534 CA PRO B 228 -5.726 9.336 -8.971 1.00 0.00 C ATOM 1535 C PRO B 228 -4.481 8.790 -9.678 1.00 0.00 C ATOM 1536 O PRO B 228 -3.904 9.446 -10.562 1.00 0.00 O ATOM 1537 CB PRO B 228 -6.999 8.829 -9.655 1.00 0.00 C ATOM 1538 CG PRO B 228 -7.378 9.913 -10.599 1.00 0.00 C ATOM 1539 CD PRO B 228 -6.973 11.184 -9.935 1.00 0.00 C ATOM 0 HA PRO B 228 -5.627 9.014 -7.934 1.00 0.00 H new ATOM 0 HB2 PRO B 228 -6.819 7.891 -10.181 1.00 0.00 H new ATOM 0 HB3 PRO B 228 -7.790 8.641 -8.929 1.00 0.00 H new ATOM 0 HG2 PRO B 228 -6.872 9.793 -11.557 1.00 0.00 H new ATOM 0 HG3 PRO B 228 -8.449 9.900 -10.801 1.00 0.00 H new ATOM 0 HD2 PRO B 228 -6.682 11.942 -10.662 1.00 0.00 H new ATOM 0 HD3 PRO B 228 -7.786 11.605 -9.343 1.00 0.00 H new ATOM 1547 N GLY B 229 -4.071 7.615 -9.280 1.00 0.00 N ATOM 1548 CA GLY B 229 -2.919 6.979 -9.858 1.00 0.00 C ATOM 1549 C GLY B 229 -3.205 6.408 -11.226 1.00 0.00 C ATOM 1550 O GLY B 229 -4.367 6.222 -11.606 1.00 0.00 O ATOM 0 H GLY B 229 -4.527 7.073 -8.546 1.00 0.00 H new ATOM 0 HA2 GLY B 229 -2.106 7.702 -9.931 1.00 0.00 H new ATOM 0 HA3 GLY B 229 -2.578 6.181 -9.198 1.00 0.00 H new ATOM 1554 N SER B 230 -2.162 6.117 -11.952 1.00 0.00 N ATOM 1555 CA SER B 230 -2.257 5.590 -13.297 1.00 0.00 C ATOM 1556 C SER B 230 -2.604 4.092 -13.278 1.00 0.00 C ATOM 1557 O SER B 230 -3.017 3.524 -14.282 1.00 0.00 O ATOM 1558 CB SER B 230 -0.931 5.829 -14.016 1.00 0.00 C ATOM 1559 OG SER B 230 -0.537 7.197 -13.888 1.00 0.00 O ATOM 0 H SER B 230 -1.203 6.239 -11.626 1.00 0.00 H new ATOM 0 HA SER B 230 -3.058 6.103 -13.829 1.00 0.00 H new ATOM 0 HB2 SER B 230 -0.161 5.181 -13.598 1.00 0.00 H new ATOM 0 HB3 SER B 230 -1.029 5.569 -15.070 1.00 0.00 H new ATOM 0 HG SER B 230 0.315 7.337 -14.352 1.00 0.00 H new ATOM 1565 N ARG B 231 -2.468 3.467 -12.108 1.00 0.00 N ATOM 1566 CA ARG B 231 -2.732 2.024 -11.954 1.00 0.00 C ATOM 1567 C ARG B 231 -4.238 1.782 -11.789 1.00 0.00 C ATOM 1568 O ARG B 231 -4.695 0.644 -11.625 1.00 0.00 O ATOM 1569 CB ARG B 231 -2.010 1.480 -10.714 1.00 0.00 C ATOM 1570 CG ARG B 231 -0.528 1.828 -10.615 1.00 0.00 C ATOM 1571 CD ARG B 231 0.297 1.248 -11.753 1.00 0.00 C ATOM 1572 NE ARG B 231 1.706 1.660 -11.644 1.00 0.00 N ATOM 1573 CZ ARG B 231 2.728 1.141 -12.343 1.00 0.00 C ATOM 1574 NH1 ARG B 231 2.527 0.146 -13.200 1.00 0.00 N ATOM 1575 NH2 ARG B 231 3.952 1.615 -12.160 1.00 0.00 N ATOM 0 H ARG B 231 -2.177 3.932 -11.248 1.00 0.00 H new ATOM 0 HA ARG B 231 -2.367 1.512 -12.845 1.00 0.00 H new ATOM 0 HB2 ARG B 231 -2.515 1.858 -9.825 1.00 0.00 H new ATOM 0 HB3 ARG B 231 -2.113 0.395 -10.701 1.00 0.00 H new ATOM 0 HG2 ARG B 231 -0.415 2.912 -10.608 1.00 0.00 H new ATOM 0 HG3 ARG B 231 -0.137 1.460 -9.666 1.00 0.00 H new ATOM 0 HD2 ARG B 231 0.230 0.160 -11.738 1.00 0.00 H new ATOM 0 HD3 ARG B 231 -0.110 1.580 -12.708 1.00 0.00 H new ATOM 0 HE ARG B 231 1.925 2.403 -10.981 1.00 0.00 H new ATOM 0 HH11 ARG B 231 1.589 -0.231 -13.332 1.00 0.00 H new ATOM 0 HH12 ARG B 231 3.311 -0.241 -13.726 1.00 0.00 H new ATOM 0 HH21 ARG B 231 4.112 2.369 -11.492 1.00 0.00 H new ATOM 0 HH22 ARG B 231 4.734 1.226 -12.687 1.00 0.00 H new ATOM 1589 N TRP B 232 -4.979 2.859 -11.820 1.00 0.00 N ATOM 1590 CA TRP B 232 -6.395 2.858 -11.642 1.00 0.00 C ATOM 1591 C TRP B 232 -7.108 2.503 -12.915 1.00 0.00 C ATOM 1592 O TRP B 232 -6.818 3.022 -14.001 1.00 0.00 O ATOM 1593 CB TRP B 232 -6.854 4.232 -11.113 1.00 0.00 C ATOM 1594 CG TRP B 232 -8.313 4.352 -10.769 1.00 0.00 C ATOM 1595 CD1 TRP B 232 -9.083 3.440 -10.121 1.00 0.00 C ATOM 1596 CD2 TRP B 232 -9.152 5.481 -11.004 1.00 0.00 C ATOM 1597 NE1 TRP B 232 -10.359 3.911 -9.980 1.00 0.00 N ATOM 1598 CE2 TRP B 232 -10.425 5.168 -10.495 1.00 0.00 C ATOM 1599 CE3 TRP B 232 -8.956 6.721 -11.600 1.00 0.00 C ATOM 1600 CZ2 TRP B 232 -11.489 6.051 -10.566 1.00 0.00 C ATOM 1601 CZ3 TRP B 232 -10.016 7.598 -11.668 1.00 0.00 C ATOM 1602 CH2 TRP B 232 -11.265 7.259 -11.150 1.00 0.00 C ATOM 0 H TRP B 232 -4.593 3.790 -11.976 1.00 0.00 H new ATOM 0 HA TRP B 232 -6.651 2.094 -10.908 1.00 0.00 H new ATOM 0 HB2 TRP B 232 -6.271 4.470 -10.224 1.00 0.00 H new ATOM 0 HB3 TRP B 232 -6.615 4.986 -11.863 1.00 0.00 H new ATOM 0 HD1 TRP B 232 -8.737 2.480 -9.768 1.00 0.00 H new ATOM 0 HE1 TRP B 232 -11.135 3.402 -9.557 1.00 0.00 H new ATOM 0 HE3 TRP B 232 -7.991 6.992 -12.002 1.00 0.00 H new ATOM 0 HZ2 TRP B 232 -12.460 5.790 -10.172 1.00 0.00 H new ATOM 0 HZ3 TRP B 232 -9.877 8.564 -12.130 1.00 0.00 H new ATOM 0 HH2 TRP B 232 -12.074 7.972 -11.214 1.00 0.00 H new ATOM 1613 N ASP B 233 -7.985 1.594 -12.760 1.00 0.00 N ATOM 1614 CA ASP B 233 -8.921 1.186 -13.744 1.00 0.00 C ATOM 1615 C ASP B 233 -10.204 1.526 -13.080 1.00 0.00 C ATOM 1616 O ASP B 233 -10.216 1.488 -11.887 1.00 0.00 O ATOM 1617 CB ASP B 233 -8.836 -0.324 -13.974 1.00 0.00 C ATOM 1618 CG ASP B 233 -9.737 -0.807 -15.091 1.00 0.00 C ATOM 1619 OD1 ASP B 233 -10.919 -1.134 -14.831 1.00 0.00 O ATOM 1620 OD2 ASP B 233 -9.267 -0.903 -16.242 1.00 0.00 O ATOM 0 H ASP B 233 -8.081 1.076 -11.887 1.00 0.00 H new ATOM 0 HA ASP B 233 -8.774 1.649 -14.720 1.00 0.00 H new ATOM 0 HB2 ASP B 233 -7.805 -0.593 -14.205 1.00 0.00 H new ATOM 0 HB3 ASP B 233 -9.101 -0.841 -13.052 1.00 0.00 H new ATOM 1625 N GLY B 234 -11.203 1.898 -13.839 1.00 0.00 N ATOM 1626 CA GLY B 234 -12.570 2.383 -13.415 1.00 0.00 C ATOM 1627 C GLY B 234 -13.320 1.589 -12.326 1.00 0.00 C ATOM 1628 O GLY B 234 -14.510 1.267 -12.453 1.00 0.00 O ATOM 0 H GLY B 234 -11.115 1.883 -14.855 1.00 0.00 H new ATOM 0 HA2 GLY B 234 -12.465 3.410 -13.065 1.00 0.00 H new ATOM 0 HA3 GLY B 234 -13.203 2.411 -14.302 1.00 0.00 H new ATOM 1632 N VAL B 235 -12.626 1.331 -11.307 1.00 0.00 N ATOM 1633 CA VAL B 235 -13.042 0.707 -10.101 1.00 0.00 C ATOM 1634 C VAL B 235 -13.537 1.795 -9.192 1.00 0.00 C ATOM 1635 O VAL B 235 -12.904 2.850 -9.091 1.00 0.00 O ATOM 1636 CB VAL B 235 -11.797 -0.005 -9.448 1.00 0.00 C ATOM 1637 CG1 VAL B 235 -12.035 -0.489 -8.015 1.00 0.00 C ATOM 1638 CG2 VAL B 235 -11.343 -1.161 -10.320 1.00 0.00 C ATOM 0 H VAL B 235 -11.636 1.573 -11.277 1.00 0.00 H new ATOM 0 HA VAL B 235 -13.824 -0.032 -10.278 1.00 0.00 H new ATOM 0 HB VAL B 235 -11.015 0.752 -9.384 1.00 0.00 H new ATOM 0 HG11 VAL B 235 -11.131 -0.967 -7.638 1.00 0.00 H new ATOM 0 HG12 VAL B 235 -12.287 0.361 -7.381 1.00 0.00 H new ATOM 0 HG13 VAL B 235 -12.856 -1.206 -8.005 1.00 0.00 H new ATOM 0 HG21 VAL B 235 -10.482 -1.647 -9.861 1.00 0.00 H new ATOM 0 HG22 VAL B 235 -12.155 -1.881 -10.421 1.00 0.00 H new ATOM 0 HG23 VAL B 235 -11.065 -0.786 -11.305 1.00 0.00 H new ATOM 1648 N HIS B 236 -14.676 1.590 -8.626 1.00 0.00 N ATOM 1649 CA HIS B 236 -15.221 2.497 -7.659 1.00 0.00 C ATOM 1650 C HIS B 236 -15.160 1.805 -6.336 1.00 0.00 C ATOM 1651 O HIS B 236 -15.884 0.831 -6.107 1.00 0.00 O ATOM 1652 CB HIS B 236 -16.671 2.888 -8.026 1.00 0.00 C ATOM 1653 CG HIS B 236 -17.391 3.718 -6.997 1.00 0.00 C ATOM 1654 ND1 HIS B 236 -17.112 5.038 -6.729 1.00 0.00 N ATOM 1655 CD2 HIS B 236 -18.385 3.369 -6.150 1.00 0.00 C ATOM 1656 CE1 HIS B 236 -17.918 5.443 -5.750 1.00 0.00 C ATOM 1657 NE2 HIS B 236 -18.719 4.461 -5.363 1.00 0.00 N ATOM 0 H HIS B 236 -15.266 0.781 -8.819 1.00 0.00 H new ATOM 0 HA HIS B 236 -14.651 3.426 -7.630 1.00 0.00 H new ATOM 0 HB2 HIS B 236 -16.655 3.438 -8.967 1.00 0.00 H new ATOM 0 HB3 HIS B 236 -17.243 1.977 -8.200 1.00 0.00 H new ATOM 0 HD2 HIS B 236 -18.846 2.394 -6.095 1.00 0.00 H new ATOM 0 HE1 HIS B 236 -17.919 6.437 -5.328 1.00 0.00 H new ATOM 0 HE2 HIS B 236 -19.434 4.500 -4.636 1.00 0.00 H new ATOM 1665 N ARG B 237 -14.292 2.245 -5.492 1.00 0.00 N ATOM 1666 CA ARG B 237 -14.117 1.598 -4.233 1.00 0.00 C ATOM 1667 C ARG B 237 -14.269 2.649 -3.136 1.00 0.00 C ATOM 1668 O ARG B 237 -13.417 3.494 -2.957 1.00 0.00 O ATOM 1669 CB ARG B 237 -12.711 0.987 -4.250 1.00 0.00 C ATOM 1670 CG ARG B 237 -12.425 -0.082 -3.224 1.00 0.00 C ATOM 1671 CD ARG B 237 -13.332 -1.281 -3.372 1.00 0.00 C ATOM 1672 NE ARG B 237 -13.336 -1.876 -4.720 1.00 0.00 N ATOM 1673 CZ ARG B 237 -14.444 -2.246 -5.390 1.00 0.00 C ATOM 1674 NH1 ARG B 237 -15.653 -1.963 -4.905 1.00 0.00 N ATOM 1675 NH2 ARG B 237 -14.338 -2.879 -6.548 1.00 0.00 N ATOM 0 H ARG B 237 -13.689 3.053 -5.649 1.00 0.00 H new ATOM 0 HA ARG B 237 -14.850 0.813 -4.048 1.00 0.00 H new ATOM 0 HB2 ARG B 237 -12.535 0.565 -5.239 1.00 0.00 H new ATOM 0 HB3 ARG B 237 -11.988 1.792 -4.114 1.00 0.00 H new ATOM 0 HG2 ARG B 237 -11.387 -0.402 -3.316 1.00 0.00 H new ATOM 0 HG3 ARG B 237 -12.542 0.337 -2.225 1.00 0.00 H new ATOM 0 HD2 ARG B 237 -13.029 -2.042 -2.653 1.00 0.00 H new ATOM 0 HD3 ARG B 237 -14.349 -0.986 -3.115 1.00 0.00 H new ATOM 0 HE ARG B 237 -12.436 -2.018 -5.178 1.00 0.00 H new ATOM 0 HH11 ARG B 237 -15.743 -1.463 -4.021 1.00 0.00 H new ATOM 0 HH12 ARG B 237 -16.488 -2.247 -5.418 1.00 0.00 H new ATOM 0 HH21 ARG B 237 -13.417 -3.087 -6.933 1.00 0.00 H new ATOM 0 HH22 ARG B 237 -15.178 -3.159 -7.055 1.00 0.00 H new ATOM 1689 N SER B 238 -15.367 2.604 -2.432 1.00 0.00 N ATOM 1690 CA SER B 238 -15.665 3.597 -1.438 1.00 0.00 C ATOM 1691 C SER B 238 -16.487 2.999 -0.297 1.00 0.00 C ATOM 1692 O SER B 238 -17.190 2.013 -0.506 1.00 0.00 O ATOM 1693 CB SER B 238 -16.395 4.743 -2.109 1.00 0.00 C ATOM 1694 OG SER B 238 -17.518 4.252 -2.790 1.00 0.00 O ATOM 0 H SER B 238 -16.078 1.880 -2.531 1.00 0.00 H new ATOM 0 HA SER B 238 -14.740 3.969 -0.996 1.00 0.00 H new ATOM 0 HB2 SER B 238 -16.701 5.478 -1.364 1.00 0.00 H new ATOM 0 HB3 SER B 238 -15.729 5.253 -2.805 1.00 0.00 H new ATOM 0 HG SER B 238 -17.264 4.003 -3.703 1.00 0.00 H new ATOM 1700 N ASN B 239 -16.394 3.594 0.898 1.00 0.00 N ATOM 1701 CA ASN B 239 -17.169 3.166 2.112 1.00 0.00 C ATOM 1702 C ASN B 239 -18.661 3.029 1.809 1.00 0.00 C ATOM 1703 O ASN B 239 -19.351 2.209 2.402 1.00 0.00 O ATOM 1704 CB ASN B 239 -17.082 4.228 3.209 1.00 0.00 C ATOM 1705 CG ASN B 239 -15.695 4.678 3.531 1.00 0.00 C ATOM 1706 OD1 ASN B 239 -15.174 5.563 2.869 1.00 0.00 O ATOM 1707 ND2 ASN B 239 -15.107 4.132 4.547 1.00 0.00 N ATOM 0 H ASN B 239 -15.782 4.391 1.071 1.00 0.00 H new ATOM 0 HA ASN B 239 -16.737 2.214 2.421 1.00 0.00 H new ATOM 0 HB2 ASN B 239 -17.669 5.094 2.905 1.00 0.00 H new ATOM 0 HB3 ASN B 239 -17.541 3.834 4.115 1.00 0.00 H new ATOM 0 HD21 ASN B 239 -14.173 4.438 4.821 1.00 0.00 H new ATOM 0 HD22 ASN B 239 -15.577 3.396 5.073 1.00 0.00 H new ATOM 1714 N GLY B 240 -19.148 3.835 0.889 1.00 0.00 N ATOM 1715 CA GLY B 240 -20.560 3.848 0.595 1.00 0.00 C ATOM 1716 C GLY B 240 -21.167 5.197 0.896 1.00 0.00 C ATOM 1717 O GLY B 240 -22.345 5.311 1.097 1.00 0.00 O ATOM 0 H GLY B 240 -18.589 4.485 0.336 1.00 0.00 H new ATOM 0 HA2 GLY B 240 -20.718 3.601 -0.455 1.00 0.00 H new ATOM 0 HA3 GLY B 240 -21.064 3.080 1.182 1.00 0.00 H new ATOM 1721 N PHE B 241 -20.333 6.213 0.950 1.00 0.00 N ATOM 1722 CA PHE B 241 -20.772 7.576 1.241 1.00 0.00 C ATOM 1723 C PHE B 241 -21.455 8.250 0.038 1.00 0.00 C ATOM 1724 O PHE B 241 -22.414 9.001 0.200 1.00 0.00 O ATOM 1725 CB PHE B 241 -19.591 8.428 1.762 1.00 0.00 C ATOM 1726 CG PHE B 241 -18.349 8.385 0.890 1.00 0.00 C ATOM 1727 CD1 PHE B 241 -18.241 9.174 -0.243 1.00 0.00 C ATOM 1728 CD2 PHE B 241 -17.296 7.552 1.209 1.00 0.00 C ATOM 1729 CE1 PHE B 241 -17.120 9.128 -1.036 1.00 0.00 C ATOM 1730 CE2 PHE B 241 -16.168 7.503 0.420 1.00 0.00 C ATOM 1731 CZ PHE B 241 -16.080 8.292 -0.705 1.00 0.00 C ATOM 0 H PHE B 241 -19.329 6.125 0.794 1.00 0.00 H new ATOM 0 HA PHE B 241 -21.527 7.508 2.025 1.00 0.00 H new ATOM 0 HB2 PHE B 241 -19.919 9.463 1.853 1.00 0.00 H new ATOM 0 HB3 PHE B 241 -19.328 8.087 2.763 1.00 0.00 H new ATOM 0 HD1 PHE B 241 -19.052 9.837 -0.508 1.00 0.00 H new ATOM 0 HD2 PHE B 241 -17.357 6.930 2.090 1.00 0.00 H new ATOM 0 HE1 PHE B 241 -17.056 9.748 -1.918 1.00 0.00 H new ATOM 0 HE2 PHE B 241 -15.353 6.846 0.684 1.00 0.00 H new ATOM 0 HZ PHE B 241 -15.197 8.254 -1.325 1.00 0.00 H new ATOM 1741 N GLU B 242 -20.983 7.934 -1.162 1.00 0.00 N ATOM 1742 CA GLU B 242 -21.443 8.586 -2.380 1.00 0.00 C ATOM 1743 C GLU B 242 -22.913 8.308 -2.618 1.00 0.00 C ATOM 1744 O GLU B 242 -23.663 9.209 -2.951 1.00 0.00 O ATOM 1745 CB GLU B 242 -20.615 8.139 -3.583 1.00 0.00 C ATOM 1746 CG GLU B 242 -20.925 8.898 -4.857 1.00 0.00 C ATOM 1747 CD GLU B 242 -20.209 8.332 -6.044 1.00 0.00 C ATOM 1748 OE1 GLU B 242 -19.051 8.735 -6.314 1.00 0.00 O ATOM 1749 OE2 GLU B 242 -20.791 7.472 -6.736 1.00 0.00 O ATOM 0 H GLU B 242 -20.272 7.220 -1.317 1.00 0.00 H new ATOM 0 HA GLU B 242 -21.312 9.661 -2.254 1.00 0.00 H new ATOM 0 HB2 GLU B 242 -19.557 8.259 -3.348 1.00 0.00 H new ATOM 0 HB3 GLU B 242 -20.785 7.076 -3.754 1.00 0.00 H new ATOM 0 HG2 GLU B 242 -22.000 8.875 -5.039 1.00 0.00 H new ATOM 0 HG3 GLU B 242 -20.645 9.944 -4.731 1.00 0.00 H new ATOM 1756 N GLU B 243 -23.320 7.064 -2.400 1.00 0.00 N ATOM 1757 CA GLU B 243 -24.714 6.655 -2.556 1.00 0.00 C ATOM 1758 C GLU B 243 -25.618 7.410 -1.613 1.00 0.00 C ATOM 1759 O GLU B 243 -26.763 7.691 -1.935 1.00 0.00 O ATOM 1760 CB GLU B 243 -24.889 5.160 -2.356 1.00 0.00 C ATOM 1761 CG GLU B 243 -24.429 4.648 -1.004 1.00 0.00 C ATOM 1762 CD GLU B 243 -24.431 3.155 -0.927 1.00 0.00 C ATOM 1763 OE1 GLU B 243 -25.489 2.556 -0.658 1.00 0.00 O ATOM 1764 OE2 GLU B 243 -23.380 2.548 -1.151 1.00 0.00 O ATOM 0 H GLU B 243 -22.697 6.310 -2.111 1.00 0.00 H new ATOM 0 HA GLU B 243 -24.998 6.897 -3.580 1.00 0.00 H new ATOM 0 HB2 GLU B 243 -25.942 4.910 -2.486 1.00 0.00 H new ATOM 0 HB3 GLU B 243 -24.338 4.635 -3.136 1.00 0.00 H new ATOM 0 HG2 GLU B 243 -23.424 5.018 -0.802 1.00 0.00 H new ATOM 0 HG3 GLU B 243 -25.079 5.050 -0.227 1.00 0.00 H new ATOM 1771 N LYS B 244 -25.106 7.710 -0.440 1.00 0.00 N ATOM 1772 CA LYS B 244 -25.856 8.410 0.571 1.00 0.00 C ATOM 1773 C LYS B 244 -26.120 9.819 0.088 1.00 0.00 C ATOM 1774 O LYS B 244 -27.260 10.303 0.105 1.00 0.00 O ATOM 1775 CB LYS B 244 -25.043 8.454 1.853 1.00 0.00 C ATOM 1776 CG LYS B 244 -24.470 7.111 2.258 1.00 0.00 C ATOM 1777 CD LYS B 244 -25.504 6.138 2.761 1.00 0.00 C ATOM 1778 CE LYS B 244 -24.831 4.839 3.179 1.00 0.00 C ATOM 1779 NZ LYS B 244 -25.766 3.897 3.795 1.00 0.00 N ATOM 0 H LYS B 244 -24.154 7.473 -0.162 1.00 0.00 H new ATOM 0 HA LYS B 244 -26.801 7.901 0.761 1.00 0.00 H new ATOM 0 HB2 LYS B 244 -24.226 9.165 1.730 1.00 0.00 H new ATOM 0 HB3 LYS B 244 -25.673 8.828 2.660 1.00 0.00 H new ATOM 0 HG2 LYS B 244 -23.957 6.672 1.402 1.00 0.00 H new ATOM 0 HG3 LYS B 244 -23.721 7.265 3.035 1.00 0.00 H new ATOM 0 HD2 LYS B 244 -26.040 6.569 3.607 1.00 0.00 H new ATOM 0 HD3 LYS B 244 -26.241 5.942 1.982 1.00 0.00 H new ATOM 0 HE2 LYS B 244 -24.373 4.373 2.306 1.00 0.00 H new ATOM 0 HE3 LYS B 244 -24.027 5.060 3.881 1.00 0.00 H new ATOM 0 HZ1 LYS B 244 -25.259 3.029 4.062 1.00 0.00 H new ATOM 0 HZ2 LYS B 244 -26.185 4.328 4.644 1.00 0.00 H new ATOM 0 HZ3 LYS B 244 -26.520 3.663 3.118 1.00 0.00 H new ATOM 1793 N TRP B 245 -25.069 10.440 -0.400 1.00 0.00 N ATOM 1794 CA TRP B 245 -25.120 11.793 -0.917 1.00 0.00 C ATOM 1795 C TRP B 245 -25.991 11.838 -2.148 1.00 0.00 C ATOM 1796 O TRP B 245 -26.789 12.730 -2.314 1.00 0.00 O ATOM 1797 CB TRP B 245 -23.716 12.298 -1.256 1.00 0.00 C ATOM 1798 CG TRP B 245 -22.772 12.294 -0.091 1.00 0.00 C ATOM 1799 CD1 TRP B 245 -23.098 12.238 1.232 1.00 0.00 C ATOM 1800 CD2 TRP B 245 -21.347 12.374 -0.145 1.00 0.00 C ATOM 1801 NE1 TRP B 245 -21.970 12.268 1.996 1.00 0.00 N ATOM 1802 CE2 TRP B 245 -20.881 12.354 1.181 1.00 0.00 C ATOM 1803 CE3 TRP B 245 -20.419 12.459 -1.184 1.00 0.00 C ATOM 1804 CZ2 TRP B 245 -19.537 12.418 1.495 1.00 0.00 C ATOM 1805 CZ3 TRP B 245 -19.080 12.524 -0.867 1.00 0.00 C ATOM 1806 CH2 TRP B 245 -18.651 12.505 0.463 1.00 0.00 C ATOM 0 H TRP B 245 -24.143 10.016 -0.450 1.00 0.00 H new ATOM 0 HA TRP B 245 -25.544 12.440 -0.149 1.00 0.00 H new ATOM 0 HB2 TRP B 245 -23.300 11.679 -2.051 1.00 0.00 H new ATOM 0 HB3 TRP B 245 -23.790 13.312 -1.648 1.00 0.00 H new ATOM 0 HD1 TRP B 245 -24.105 12.178 1.618 1.00 0.00 H new ATOM 0 HE1 TRP B 245 -21.945 12.232 3.015 1.00 0.00 H new ATOM 0 HE3 TRP B 245 -20.744 12.473 -2.214 1.00 0.00 H new ATOM 0 HZ2 TRP B 245 -19.201 12.400 2.521 1.00 0.00 H new ATOM 0 HZ3 TRP B 245 -18.349 12.591 -1.660 1.00 0.00 H new ATOM 0 HH2 TRP B 245 -17.594 12.560 0.678 1.00 0.00 H new ATOM 1817 N PHE B 246 -25.860 10.828 -2.960 1.00 0.00 N ATOM 1818 CA PHE B 246 -26.611 10.671 -4.187 1.00 0.00 C ATOM 1819 C PHE B 246 -28.102 10.464 -3.893 1.00 0.00 C ATOM 1820 O PHE B 246 -28.972 10.854 -4.671 1.00 0.00 O ATOM 1821 CB PHE B 246 -25.984 9.506 -4.980 1.00 0.00 C ATOM 1822 CG PHE B 246 -26.874 8.785 -5.931 1.00 0.00 C ATOM 1823 CD1 PHE B 246 -27.017 9.199 -7.240 1.00 0.00 C ATOM 1824 CD2 PHE B 246 -27.558 7.665 -5.500 1.00 0.00 C ATOM 1825 CE1 PHE B 246 -27.835 8.502 -8.103 1.00 0.00 C ATOM 1826 CE2 PHE B 246 -28.376 6.969 -6.345 1.00 0.00 C ATOM 1827 CZ PHE B 246 -28.518 7.384 -7.652 1.00 0.00 C ATOM 0 H PHE B 246 -25.208 10.063 -2.786 1.00 0.00 H new ATOM 0 HA PHE B 246 -26.557 11.575 -4.794 1.00 0.00 H new ATOM 0 HB2 PHE B 246 -25.133 9.895 -5.539 1.00 0.00 H new ATOM 0 HB3 PHE B 246 -25.592 8.782 -4.266 1.00 0.00 H new ATOM 0 HD1 PHE B 246 -26.486 10.072 -7.589 1.00 0.00 H new ATOM 0 HD2 PHE B 246 -27.444 7.334 -4.478 1.00 0.00 H new ATOM 0 HE1 PHE B 246 -27.943 8.826 -9.127 1.00 0.00 H new ATOM 0 HE2 PHE B 246 -28.908 6.099 -5.991 1.00 0.00 H new ATOM 0 HZ PHE B 246 -29.162 6.837 -8.325 1.00 0.00 H new ATOM 1837 N ALA B 247 -28.380 9.864 -2.781 1.00 0.00 N ATOM 1838 CA ALA B 247 -29.731 9.630 -2.372 1.00 0.00 C ATOM 1839 C ALA B 247 -30.365 10.901 -1.797 1.00 0.00 C ATOM 1840 O ALA B 247 -31.499 11.220 -2.109 1.00 0.00 O ATOM 1841 CB ALA B 247 -29.770 8.487 -1.382 1.00 0.00 C ATOM 0 H ALA B 247 -27.676 9.521 -2.127 1.00 0.00 H new ATOM 0 HA ALA B 247 -30.323 9.352 -3.244 1.00 0.00 H new ATOM 0 HB1 ALA B 247 -30.800 8.310 -1.071 1.00 0.00 H new ATOM 0 HB2 ALA B 247 -29.372 7.587 -1.850 1.00 0.00 H new ATOM 0 HB3 ALA B 247 -29.166 8.740 -0.510 1.00 0.00 H new ATOM 1847 N LYS B 248 -29.600 11.668 -1.021 1.00 0.00 N ATOM 1848 CA LYS B 248 -30.137 12.856 -0.352 1.00 0.00 C ATOM 1849 C LYS B 248 -30.050 14.089 -1.219 1.00 0.00 C ATOM 1850 O LYS B 248 -30.632 15.120 -0.907 1.00 0.00 O ATOM 1851 CB LYS B 248 -29.440 13.092 0.995 1.00 0.00 C ATOM 1852 CG LYS B 248 -27.929 13.336 0.924 1.00 0.00 C ATOM 1853 CD LYS B 248 -27.509 14.780 0.543 1.00 0.00 C ATOM 1854 CE LYS B 248 -27.818 15.845 1.618 1.00 0.00 C ATOM 1855 NZ LYS B 248 -29.265 16.163 1.786 1.00 0.00 N ATOM 0 H LYS B 248 -28.612 11.491 -0.840 1.00 0.00 H new ATOM 0 HA LYS B 248 -31.194 12.664 -0.168 1.00 0.00 H new ATOM 0 HB2 LYS B 248 -29.906 13.950 1.480 1.00 0.00 H new ATOM 0 HB3 LYS B 248 -29.621 12.228 1.634 1.00 0.00 H new ATOM 0 HG2 LYS B 248 -27.492 13.091 1.892 1.00 0.00 H new ATOM 0 HG3 LYS B 248 -27.500 12.646 0.197 1.00 0.00 H new ATOM 0 HD2 LYS B 248 -26.439 14.791 0.337 1.00 0.00 H new ATOM 0 HD3 LYS B 248 -28.014 15.059 -0.382 1.00 0.00 H new ATOM 0 HE2 LYS B 248 -27.423 15.501 2.574 1.00 0.00 H new ATOM 0 HE3 LYS B 248 -27.286 16.762 1.364 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 -29.376 17.176 1.994 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 -29.775 15.932 0.910 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 -29.654 15.604 2.571 1.00 0.00 H new ATOM 1869 N GLN B 249 -29.314 13.983 -2.305 1.00 0.00 N ATOM 1870 CA GLN B 249 -29.119 15.099 -3.239 1.00 0.00 C ATOM 1871 C GLN B 249 -30.370 15.327 -4.069 1.00 0.00 C ATOM 1872 O GLN B 249 -30.390 16.159 -4.971 1.00 0.00 O ATOM 1873 CB GLN B 249 -27.915 14.857 -4.151 1.00 0.00 C ATOM 1874 CG GLN B 249 -28.116 13.789 -5.205 1.00 0.00 C ATOM 1875 CD GLN B 249 -26.880 13.544 -6.047 1.00 0.00 C ATOM 1876 OE1 GLN B 249 -25.721 13.677 -5.455 1.00 0.00 O flip ATOM 1877 NE2 GLN B 249 -26.975 13.195 -7.225 1.00 0.00 N flip ATOM 0 H GLN B 249 -28.830 13.127 -2.575 1.00 0.00 H new ATOM 0 HA GLN B 249 -28.921 15.994 -2.649 1.00 0.00 H new ATOM 0 HB2 GLN B 249 -27.660 15.793 -4.648 1.00 0.00 H new ATOM 0 HB3 GLN B 249 -27.060 14.581 -3.534 1.00 0.00 H new ATOM 0 HG2 GLN B 249 -28.408 12.858 -4.719 1.00 0.00 H new ATOM 0 HG3 GLN B 249 -28.940 14.080 -5.856 1.00 0.00 H new ATOM 0 HE21 GLN B 249 -27.894 13.101 -7.656 1.00 0.00 H new ATOM 0 HE22 GLN B 249 -26.134 13.000 -7.769 1.00 0.00 H new ATOM 1886 N ASN B 250 -31.394 14.544 -3.770 1.00 0.00 N ATOM 1887 CA ASN B 250 -32.697 14.650 -4.430 1.00 0.00 C ATOM 1888 C ASN B 250 -33.264 16.056 -4.266 1.00 0.00 C ATOM 1889 O ASN B 250 -33.909 16.599 -5.172 1.00 0.00 O ATOM 1890 CB ASN B 250 -33.705 13.616 -3.893 1.00 0.00 C ATOM 1891 CG ASN B 250 -34.047 13.792 -2.425 1.00 0.00 C ATOM 1892 OD1 ASN B 250 -34.957 14.533 -2.058 1.00 0.00 O ATOM 1893 ND2 ASN B 250 -33.358 13.097 -1.599 1.00 0.00 N ATOM 0 H ASN B 250 -31.350 13.812 -3.061 1.00 0.00 H new ATOM 0 HA ASN B 250 -32.538 14.442 -5.488 1.00 0.00 H new ATOM 0 HB2 ASN B 250 -34.622 13.679 -4.479 1.00 0.00 H new ATOM 0 HB3 ASN B 250 -33.299 12.616 -4.043 1.00 0.00 H new ATOM 0 HD21 ASN B 250 -33.557 13.147 -0.600 1.00 0.00 H new ATOM 0 HD22 ASN B 250 -32.610 12.493 -1.940 1.00 0.00 H new ATOM 1900 N GLU B 251 -33.008 16.636 -3.115 1.00 0.00 N ATOM 1901 CA GLU B 251 -33.415 17.966 -2.823 1.00 0.00 C ATOM 1902 C GLU B 251 -32.348 18.948 -3.259 1.00 0.00 C ATOM 1903 O GLU B 251 -31.255 19.034 -2.682 1.00 0.00 O ATOM 1904 CB GLU B 251 -33.764 18.122 -1.357 1.00 0.00 C ATOM 1905 CG GLU B 251 -32.711 17.555 -0.434 1.00 0.00 C ATOM 1906 CD GLU B 251 -32.997 17.747 1.020 1.00 0.00 C ATOM 1907 OE1 GLU B 251 -34.090 17.363 1.483 1.00 0.00 O ATOM 1908 OE2 GLU B 251 -32.106 18.227 1.738 1.00 0.00 O ATOM 0 H GLU B 251 -32.504 16.180 -2.354 1.00 0.00 H new ATOM 0 HA GLU B 251 -34.321 18.186 -3.388 1.00 0.00 H new ATOM 0 HB2 GLU B 251 -33.903 19.180 -1.133 1.00 0.00 H new ATOM 0 HB3 GLU B 251 -34.715 17.627 -1.161 1.00 0.00 H new ATOM 0 HG2 GLU B 251 -32.606 16.489 -0.634 1.00 0.00 H new ATOM 0 HG3 GLU B 251 -31.753 18.019 -0.668 1.00 0.00 H new ATOM 1915 N ILE B 252 -32.653 19.629 -4.300 1.00 0.00 N ATOM 1916 CA ILE B 252 -31.778 20.609 -4.898 1.00 0.00 C ATOM 1917 C ILE B 252 -32.391 21.992 -4.838 1.00 0.00 C ATOM 1918 O ILE B 252 -31.697 22.979 -4.647 1.00 0.00 O ATOM 1919 CB ILE B 252 -31.429 20.232 -6.363 1.00 0.00 C ATOM 1920 CG1 ILE B 252 -32.703 19.921 -7.179 1.00 0.00 C ATOM 1921 CG2 ILE B 252 -30.487 19.059 -6.384 1.00 0.00 C ATOM 1922 CD1 ILE B 252 -32.443 19.432 -8.591 1.00 0.00 C ATOM 0 H ILE B 252 -33.543 19.528 -4.787 1.00 0.00 H new ATOM 0 HA ILE B 252 -30.853 20.619 -4.322 1.00 0.00 H new ATOM 0 HB ILE B 252 -30.938 21.087 -6.828 1.00 0.00 H new ATOM 0 HG12 ILE B 252 -33.284 19.167 -6.648 1.00 0.00 H new ATOM 0 HG13 ILE B 252 -33.317 20.820 -7.227 1.00 0.00 H new ATOM 0 HG21 ILE B 252 -30.248 18.802 -7.416 1.00 0.00 H new ATOM 0 HG22 ILE B 252 -29.571 19.319 -5.854 1.00 0.00 H new ATOM 0 HG23 ILE B 252 -30.958 18.205 -5.898 1.00 0.00 H new ATOM 0 HD11 ILE B 252 -33.393 19.238 -9.090 1.00 0.00 H new ATOM 0 HD12 ILE B 252 -31.891 20.192 -9.144 1.00 0.00 H new ATOM 0 HD13 ILE B 252 -31.858 18.513 -8.556 1.00 0.00 H new ATOM 1934 N ASN B 253 -33.694 22.057 -4.957 1.00 0.00 N ATOM 1935 CA ASN B 253 -34.383 23.345 -4.938 1.00 0.00 C ATOM 1936 C ASN B 253 -35.270 23.411 -3.726 1.00 0.00 C ATOM 1937 O ASN B 253 -35.562 24.490 -3.203 1.00 0.00 O ATOM 1938 CB ASN B 253 -35.249 23.550 -6.206 1.00 0.00 C ATOM 1939 CG ASN B 253 -36.587 22.803 -6.177 1.00 0.00 C ATOM 1940 OD1 ASN B 253 -37.601 23.331 -5.720 1.00 0.00 O ATOM 1941 ND2 ASN B 253 -36.603 21.594 -6.643 1.00 0.00 N ATOM 0 H ASN B 253 -34.304 21.247 -5.068 1.00 0.00 H new ATOM 0 HA ASN B 253 -33.628 24.131 -4.910 1.00 0.00 H new ATOM 0 HB2 ASN B 253 -35.442 24.615 -6.333 1.00 0.00 H new ATOM 0 HB3 ASN B 253 -34.681 23.223 -7.077 1.00 0.00 H new ATOM 0 HD21 ASN B 253 -37.470 21.056 -6.637 1.00 0.00 H new ATOM 0 HD22 ASN B 253 -35.749 21.180 -7.016 1.00 0.00 H new ATOM 1948 N GLU B 254 -35.680 22.237 -3.279 1.00 0.00 N ATOM 1949 CA GLU B 254 -36.604 22.090 -2.195 1.00 0.00 C ATOM 1950 C GLU B 254 -36.007 22.647 -0.921 1.00 0.00 C ATOM 1951 O GLU B 254 -34.785 22.602 -0.716 1.00 0.00 O ATOM 1952 CB GLU B 254 -36.952 20.635 -2.016 1.00 0.00 C ATOM 1953 CG GLU B 254 -38.256 20.409 -1.315 1.00 0.00 C ATOM 1954 CD GLU B 254 -38.545 18.949 -1.078 1.00 0.00 C ATOM 1955 OE1 GLU B 254 -38.948 18.244 -2.040 1.00 0.00 O ATOM 1956 OE2 GLU B 254 -38.416 18.482 0.074 1.00 0.00 O ATOM 0 H GLU B 254 -35.368 21.350 -3.674 1.00 0.00 H new ATOM 0 HA GLU B 254 -37.513 22.646 -2.424 1.00 0.00 H new ATOM 0 HB2 GLU B 254 -36.988 20.156 -2.995 1.00 0.00 H new ATOM 0 HB3 GLU B 254 -36.157 20.147 -1.452 1.00 0.00 H new ATOM 0 HG2 GLU B 254 -38.245 20.933 -0.359 1.00 0.00 H new ATOM 0 HG3 GLU B 254 -39.062 20.843 -1.907 1.00 0.00 H new ATOM 1963 N LYS B 255 -36.849 23.144 -0.086 1.00 0.00 N ATOM 1964 CA LYS B 255 -36.431 23.803 1.116 1.00 0.00 C ATOM 1965 C LYS B 255 -36.412 22.807 2.241 1.00 0.00 C ATOM 1966 O LYS B 255 -37.271 21.920 2.310 1.00 0.00 O ATOM 1967 CB LYS B 255 -37.366 24.978 1.428 1.00 0.00 C ATOM 1968 CG LYS B 255 -37.530 25.951 0.260 1.00 0.00 C ATOM 1969 CD LYS B 255 -36.203 26.603 -0.126 1.00 0.00 C ATOM 1970 CE LYS B 255 -36.344 27.535 -1.327 1.00 0.00 C ATOM 1971 NZ LYS B 255 -36.784 26.822 -2.547 1.00 0.00 N ATOM 0 H LYS B 255 -37.860 23.108 -0.213 1.00 0.00 H new ATOM 0 HA LYS B 255 -35.426 24.206 0.988 1.00 0.00 H new ATOM 0 HB2 LYS B 255 -38.345 24.589 1.707 1.00 0.00 H new ATOM 0 HB3 LYS B 255 -36.980 25.520 2.291 1.00 0.00 H new ATOM 0 HG2 LYS B 255 -37.938 25.421 -0.600 1.00 0.00 H new ATOM 0 HG3 LYS B 255 -38.250 26.724 0.529 1.00 0.00 H new ATOM 0 HD2 LYS B 255 -35.816 27.165 0.724 1.00 0.00 H new ATOM 0 HD3 LYS B 255 -35.472 25.827 -0.355 1.00 0.00 H new ATOM 0 HE2 LYS B 255 -37.061 28.321 -1.091 1.00 0.00 H new ATOM 0 HE3 LYS B 255 -35.388 28.022 -1.519 1.00 0.00 H new ATOM 0 HZ1 LYS B 255 -36.623 27.425 -3.379 1.00 0.00 H new ATOM 0 HZ2 LYS B 255 -36.242 25.941 -2.649 1.00 0.00 H new ATOM 0 HZ3 LYS B 255 -37.797 26.598 -2.472 1.00 0.00 H new ATOM 1985 N LYS B 256 -35.451 22.926 3.089 1.00 0.00 N ATOM 1986 CA LYS B 256 -35.283 21.999 4.157 1.00 0.00 C ATOM 1987 C LYS B 256 -35.450 22.693 5.496 1.00 0.00 C ATOM 1988 O LYS B 256 -34.561 23.470 5.908 1.00 0.00 O ATOM 1989 CB LYS B 256 -33.954 21.238 3.997 1.00 0.00 C ATOM 1990 CG LYS B 256 -32.700 22.109 3.943 1.00 0.00 C ATOM 1991 CD LYS B 256 -31.536 21.365 3.317 1.00 0.00 C ATOM 1992 CE LYS B 256 -31.712 21.251 1.801 1.00 0.00 C ATOM 1993 NZ LYS B 256 -30.664 20.419 1.184 1.00 0.00 N ATOM 1994 OXT LYS B 256 -36.506 22.500 6.127 1.00 0.00 O ATOM 0 H LYS B 256 -34.755 23.672 3.063 1.00 0.00 H new ATOM 0 HA LYS B 256 -36.066 21.242 4.122 1.00 0.00 H new ATOM 0 HB2 LYS B 256 -33.854 20.538 4.827 1.00 0.00 H new ATOM 0 HB3 LYS B 256 -34.003 20.645 3.084 1.00 0.00 H new ATOM 0 HG2 LYS B 256 -32.907 23.012 3.369 1.00 0.00 H new ATOM 0 HG3 LYS B 256 -32.432 22.426 4.951 1.00 0.00 H new ATOM 0 HD2 LYS B 256 -30.604 21.885 3.541 1.00 0.00 H new ATOM 0 HD3 LYS B 256 -31.458 20.369 3.754 1.00 0.00 H new ATOM 0 HE2 LYS B 256 -32.690 20.824 1.581 1.00 0.00 H new ATOM 0 HE3 LYS B 256 -31.692 22.247 1.358 1.00 0.00 H new ATOM 0 HZ1 LYS B 256 -30.582 20.656 0.175 1.00 0.00 H new ATOM 0 HZ2 LYS B 256 -29.755 20.599 1.657 1.00 0.00 H new ATOM 0 HZ3 LYS B 256 -30.914 19.415 1.285 1.00 0.00 H new TER 2008 LYS B 256