USER MOD reduce.3.24.130724 H: found=0, std=0, add=1340, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1344 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: A 112 SER OG : rot 100:sc= 0.00138 USER MOD Set 1.2: C 301 SER OG : rot 170:sc= 0 USER MOD Set 2.1: A 89 TYR OH : rot 30:sc= 0.997 USER MOD Set 2.2: A 99 TYR OH : rot -93:sc= 1.18 USER MOD Set 3.1: A 12 TYR OH : rot -120:sc= 1.1 USER MOD Set 3.2: A 58 LYS NZ :NH3+ -170:sc= 1.22 (180deg=1.1) USER MOD Set 4.1: A 1 GLY N :NH3+ -170:sc= 2.37 (180deg=1.19) USER MOD Set 4.2: A 73 ASN : amide:sc= -1.51! C(o=0.86!,f=-14!) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -1.09 X(o=-1.1,f=-1.5!) USER MOD Single : A 14 TYR OH : rot -22:sc= 0.204 USER MOD Single : A 17 ASN : amide:sc= 0.826 K(o=0.83,f=-0.02) USER MOD Single : A 19 ASN : amide:sc= -0.851 K(o=-0.85,f=-2.9!) USER MOD Single : A 23 THR OG1 : rot -143:sc= 1.18 USER MOD Single : A 29 THR OG1 : rot 62:sc= 1.23 USER MOD Single : A 32 SER OG : rot 19:sc= 0.597 USER MOD Single : A 34 TYR OH : rot 74:sc= 0.604 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 ASN :FLIP amide:sc= 0 F(o=-0.74,f=0) USER MOD Single : A 48 THR OG1 : rot -19:sc= 0.304 USER MOD Single : A 51 SER OG : rot 180:sc=-0.00745 USER MOD Single : A 52 GLN : amide:sc= -0.107 K(o=-0.11,f=-3.2!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.0585 USER MOD Single : A 62 GLN : amide:sc= 1.12 K(o=1.1,f=-0.74) USER MOD Single : A 64 SER OG : rot 154:sc= 0.709 USER MOD Single : A 65 THR OG1 : rot -143:sc=0.000664 USER MOD Single : A 71 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ -158:sc= 1.23 (180deg=0.663) USER MOD Single : A 86 HIS : no HE2:sc= 0.168 K(o=0.17,f=-2.9!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 1.2 K(o=1.2,f=-0.037) USER MOD Single : A 97 LYS NZ :NH3+ 173:sc= 1.3 (180deg=1.12) USER MOD Single : A 98 TYR OH : rot 18:sc= 1.96 USER MOD Single : A 103 LYS NZ :NH3+ -111:sc= 0.142 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ -171:sc= 0.997 (180deg=0.831) USER MOD Single : A 114 ASN : amide:sc= 0.207 X(o=0.21,f=-0.047) USER MOD Single : A 115 ASN : amide:sc= -0.0015 K(o=-0.0015,f=-1.5!) USER MOD Single : A 118 LYS NZ :NH3+ 148:sc= 1.31 (180deg=1.08) USER MOD Single : B 201 SER OG : rot 180:sc= 0 USER MOD Single : B 202 LYS NZ :NH3+ -166:sc= -0.0298 (180deg=-0.277) USER MOD Single : B 203 SER OG : rot 180:sc= 0.0116 USER MOD Single : B 204 GLN : amide:sc= -1.14 X(o=-1.1,f=-0.88) USER MOD Single : B 205 TYR OH : rot 180:sc= 0 USER MOD Single : B 209 MET CE :methyl 145:sc= -0.686 (180deg=-2.64!) USER MOD Single : B 213 SER OG : rot -64:sc= 0.43 USER MOD Single : B 215 SER OG : rot 75:sc= -0.532 USER MOD Single : B 222 SER OG : rot 44:sc= 0.226 USER MOD Single : C 302 TYR OH : rot 180:sc= 0 USER MOD Single : C 304 LYS NZ :NH3+ 153:sc= 0.477 (180deg=-2.06!) USER MOD Single : C 309 ASN : amide:sc= 0.447 K(o=0.45,f=-9.2!) USER MOD Single : C 314 MET CE :methyl 174:sc= -4! (180deg=-4.55!) USER MOD Single : C 317 SER OG : rot -26:sc= 0.682 USER MOD Single : C 323 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 325 SER OG : rot 46:sc= 0.0658 USER MOD Single : C 326 ASN : amide:sc= 1.12 K(o=1.1,f=-0.17) USER MOD Single : C 331 LYS NZ :NH3+ -155:sc= 0.592 (180deg=-0.384!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.271 16.851 -19.899 1.00 0.00 N ATOM 2 CA GLY A 1 3.105 15.934 -20.673 1.00 0.00 C ATOM 3 C GLY A 1 3.870 14.990 -19.779 1.00 0.00 C ATOM 4 O GLY A 1 5.057 15.203 -19.497 1.00 0.00 O ATOM 0 H1 GLY A 1 1.636 17.368 -20.540 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.706 16.311 -19.213 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.877 17.528 -19.393 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.479 15.361 -21.357 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.805 16.505 -21.284 1.00 0.00 H new ATOM 10 N ALA A 2 3.196 13.966 -19.308 1.00 0.00 N ATOM 11 CA ALA A 2 3.787 12.977 -18.451 1.00 0.00 C ATOM 12 C ALA A 2 2.976 11.710 -18.523 1.00 0.00 C ATOM 13 O ALA A 2 1.766 11.724 -18.269 1.00 0.00 O ATOM 14 CB ALA A 2 3.846 13.478 -17.008 1.00 0.00 C ATOM 0 H ALA A 2 2.211 13.799 -19.514 1.00 0.00 H new ATOM 0 HA ALA A 2 4.806 12.781 -18.786 1.00 0.00 H new ATOM 0 HB1 ALA A 2 4.297 12.713 -16.376 1.00 0.00 H new ATOM 0 HB2 ALA A 2 4.446 14.387 -16.963 1.00 0.00 H new ATOM 0 HB3 ALA A 2 2.837 13.691 -16.655 1.00 0.00 H new ATOM 20 N MET A 3 3.594 10.628 -18.921 1.00 0.00 N ATOM 21 CA MET A 3 2.898 9.374 -18.915 1.00 0.00 C ATOM 22 C MET A 3 3.212 8.640 -17.623 1.00 0.00 C ATOM 23 O MET A 3 4.329 8.159 -17.405 1.00 0.00 O ATOM 24 CB MET A 3 3.200 8.502 -20.169 1.00 0.00 C ATOM 25 CG MET A 3 4.657 8.065 -20.381 1.00 0.00 C ATOM 26 SD MET A 3 5.774 9.423 -20.793 1.00 0.00 S ATOM 27 CE MET A 3 7.320 8.529 -20.967 1.00 0.00 C ATOM 0 H MET A 3 4.560 10.591 -19.247 1.00 0.00 H new ATOM 0 HA MET A 3 1.828 9.578 -18.965 1.00 0.00 H new ATOM 0 HB2 MET A 3 2.582 7.606 -20.115 1.00 0.00 H new ATOM 0 HB3 MET A 3 2.881 9.056 -21.052 1.00 0.00 H new ATOM 0 HG2 MET A 3 5.015 7.575 -19.475 1.00 0.00 H new ATOM 0 HG3 MET A 3 4.691 7.324 -21.179 1.00 0.00 H new ATOM 0 HE1 MET A 3 8.117 9.227 -21.222 1.00 0.00 H new ATOM 0 HE2 MET A 3 7.560 8.032 -20.027 1.00 0.00 H new ATOM 0 HE3 MET A 3 7.223 7.785 -21.757 1.00 0.00 H new ATOM 37 N GLY A 4 2.241 8.578 -16.771 1.00 0.00 N ATOM 38 CA GLY A 4 2.417 7.941 -15.504 1.00 0.00 C ATOM 39 C GLY A 4 1.108 7.708 -14.833 1.00 0.00 C ATOM 40 O GLY A 4 1.015 7.633 -13.614 1.00 0.00 O ATOM 0 H GLY A 4 1.310 8.964 -16.930 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.933 6.991 -15.640 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.050 8.559 -14.868 1.00 0.00 H new ATOM 44 N ASN A 5 0.096 7.551 -15.637 1.00 0.00 N ATOM 45 CA ASN A 5 -1.267 7.389 -15.168 1.00 0.00 C ATOM 46 C ASN A 5 -1.486 5.947 -14.734 1.00 0.00 C ATOM 47 O ASN A 5 -2.450 5.628 -14.034 1.00 0.00 O ATOM 48 CB ASN A 5 -2.251 7.770 -16.289 1.00 0.00 C ATOM 49 CG ASN A 5 -3.711 7.829 -15.854 1.00 0.00 C ATOM 50 OD1 ASN A 5 -3.971 8.310 -14.654 1.00 0.00 O flip ATOM 51 ND2 ASN A 5 -4.607 7.498 -16.630 1.00 0.00 N flip ATOM 0 H ASN A 5 0.187 7.530 -16.653 1.00 0.00 H new ATOM 0 HA ASN A 5 -1.441 8.044 -14.315 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -1.965 8.742 -16.692 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -2.155 7.048 -17.100 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -4.373 7.129 -17.552 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -5.584 7.593 -16.351 1.00 0.00 H new ATOM 58 N GLU A 6 -0.583 5.078 -15.147 1.00 0.00 N ATOM 59 CA GLU A 6 -0.655 3.681 -14.787 1.00 0.00 C ATOM 60 C GLU A 6 0.261 3.354 -13.610 1.00 0.00 C ATOM 61 O GLU A 6 0.265 2.216 -13.108 1.00 0.00 O ATOM 62 CB GLU A 6 -0.389 2.729 -15.984 1.00 0.00 C ATOM 63 CG GLU A 6 0.955 2.892 -16.698 1.00 0.00 C ATOM 64 CD GLU A 6 1.055 4.171 -17.475 1.00 0.00 C ATOM 65 OE1 GLU A 6 0.492 4.265 -18.598 1.00 0.00 O1- ATOM 66 OE2 GLU A 6 1.666 5.120 -16.976 1.00 0.00 O ATOM 0 H GLU A 6 0.213 5.321 -15.736 1.00 0.00 H new ATOM 0 HA GLU A 6 -1.684 3.506 -14.474 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -0.464 1.702 -15.627 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -1.184 2.870 -16.716 1.00 0.00 H new ATOM 0 HG2 GLU A 6 1.758 2.857 -15.962 1.00 0.00 H new ATOM 0 HG3 GLU A 6 1.106 2.050 -17.374 1.00 0.00 H new ATOM 73 N TYR A 7 1.031 4.327 -13.152 1.00 0.00 N ATOM 74 CA TYR A 7 1.889 4.099 -12.006 1.00 0.00 C ATOM 75 C TYR A 7 1.095 4.266 -10.726 1.00 0.00 C ATOM 76 O TYR A 7 0.950 5.361 -10.203 1.00 0.00 O ATOM 77 CB TYR A 7 3.127 4.998 -11.982 1.00 0.00 C ATOM 78 CG TYR A 7 4.108 4.787 -13.115 1.00 0.00 C ATOM 79 CD1 TYR A 7 4.825 3.603 -13.247 1.00 0.00 C ATOM 80 CD2 TYR A 7 4.344 5.788 -14.023 1.00 0.00 C ATOM 81 CE1 TYR A 7 5.747 3.442 -14.266 1.00 0.00 C ATOM 82 CE2 TYR A 7 5.250 5.637 -15.042 1.00 0.00 C ATOM 83 CZ TYR A 7 5.950 4.468 -15.161 1.00 0.00 C ATOM 84 OH TYR A 7 6.870 4.330 -16.172 1.00 0.00 O ATOM 0 H TYR A 7 1.079 5.265 -13.549 1.00 0.00 H new ATOM 0 HA TYR A 7 2.256 3.076 -12.089 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.800 6.038 -11.997 1.00 0.00 H new ATOM 0 HB3 TYR A 7 3.650 4.842 -11.038 1.00 0.00 H new ATOM 0 HD1 TYR A 7 4.660 2.799 -12.545 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.803 6.718 -13.933 1.00 0.00 H new ATOM 0 HE1 TYR A 7 6.302 2.520 -14.358 1.00 0.00 H new ATOM 0 HE2 TYR A 7 5.410 6.439 -15.748 1.00 0.00 H new ATOM 0 HH TYR A 7 6.886 5.147 -16.713 1.00 0.00 H new ATOM 94 N LYS A 8 0.559 3.176 -10.251 1.00 0.00 N ATOM 95 CA LYS A 8 -0.298 3.189 -9.075 1.00 0.00 C ATOM 96 C LYS A 8 0.507 2.917 -7.808 1.00 0.00 C ATOM 97 O LYS A 8 0.098 3.264 -6.711 1.00 0.00 O ATOM 98 CB LYS A 8 -1.456 2.153 -9.208 1.00 0.00 C ATOM 99 CG LYS A 8 -1.078 0.654 -9.047 1.00 0.00 C ATOM 100 CD LYS A 8 -0.102 0.145 -10.107 1.00 0.00 C ATOM 101 CE LYS A 8 0.222 -1.328 -9.898 1.00 0.00 C ATOM 102 NZ LYS A 8 1.180 -1.838 -10.903 1.00 0.00 N1+ ATOM 0 H LYS A 8 0.697 2.251 -10.659 1.00 0.00 H new ATOM 0 HA LYS A 8 -0.735 4.185 -9.001 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -2.214 2.394 -8.463 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -1.918 2.284 -10.187 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -0.639 0.504 -8.061 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -1.987 0.054 -9.086 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -0.531 0.288 -11.099 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.817 0.731 -10.070 1.00 0.00 H new ATOM 0 HE2 LYS A 8 0.636 -1.469 -8.900 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -0.698 -1.911 -9.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 1.371 -2.844 -10.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 0.776 -1.729 -11.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 2.068 -1.300 -10.840 1.00 0.00 H new ATOM 116 N ASP A 9 1.663 2.322 -7.970 1.00 0.00 N ATOM 117 CA ASP A 9 2.473 1.928 -6.823 1.00 0.00 C ATOM 118 C ASP A 9 3.483 3.013 -6.477 1.00 0.00 C ATOM 119 O ASP A 9 3.973 3.107 -5.352 1.00 0.00 O ATOM 120 CB ASP A 9 3.173 0.589 -7.114 1.00 0.00 C ATOM 121 CG ASP A 9 3.929 0.043 -5.929 1.00 0.00 C ATOM 122 OD1 ASP A 9 3.330 -0.102 -4.849 1.00 0.00 O ATOM 123 OD2 ASP A 9 5.115 -0.316 -6.066 1.00 0.00 O1- ATOM 0 H ASP A 9 2.071 2.097 -8.877 1.00 0.00 H new ATOM 0 HA ASP A 9 1.822 1.798 -5.958 1.00 0.00 H new ATOM 0 HB2 ASP A 9 2.428 -0.142 -7.429 1.00 0.00 H new ATOM 0 HB3 ASP A 9 3.863 0.721 -7.947 1.00 0.00 H new ATOM 128 N ASN A 10 3.735 3.866 -7.430 1.00 0.00 N ATOM 129 CA ASN A 10 4.718 4.923 -7.290 1.00 0.00 C ATOM 130 C ASN A 10 4.082 6.147 -6.650 1.00 0.00 C ATOM 131 O ASN A 10 3.377 6.917 -7.315 1.00 0.00 O ATOM 132 CB ASN A 10 5.308 5.277 -8.662 1.00 0.00 C ATOM 133 CG ASN A 10 5.960 4.082 -9.343 1.00 0.00 C ATOM 134 OD1 ASN A 10 5.293 3.322 -10.040 1.00 0.00 O ATOM 135 ND2 ASN A 10 7.248 3.912 -9.163 1.00 0.00 N ATOM 0 H ASN A 10 3.265 3.854 -8.335 1.00 0.00 H new ATOM 0 HA ASN A 10 5.525 4.575 -6.644 1.00 0.00 H new ATOM 0 HB2 ASN A 10 4.519 5.670 -9.303 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.046 6.070 -8.543 1.00 0.00 H new ATOM 0 HD21 ASN A 10 7.726 3.129 -9.609 1.00 0.00 H new ATOM 0 HD22 ASN A 10 7.771 4.563 -8.577 1.00 0.00 H new ATOM 142 N ALA A 11 4.275 6.287 -5.345 1.00 0.00 N ATOM 143 CA ALA A 11 3.708 7.404 -4.583 1.00 0.00 C ATOM 144 C ALA A 11 4.602 8.643 -4.638 1.00 0.00 C ATOM 145 O ALA A 11 4.165 9.755 -4.327 1.00 0.00 O ATOM 146 CB ALA A 11 3.469 6.987 -3.142 1.00 0.00 C ATOM 0 H ALA A 11 4.825 5.637 -4.783 1.00 0.00 H new ATOM 0 HA ALA A 11 2.756 7.668 -5.043 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.048 7.825 -2.586 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.773 6.148 -3.117 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.414 6.689 -2.688 1.00 0.00 H new ATOM 152 N TYR A 12 5.843 8.444 -5.025 1.00 0.00 N ATOM 153 CA TYR A 12 6.780 9.537 -5.152 1.00 0.00 C ATOM 154 C TYR A 12 6.743 10.077 -6.559 1.00 0.00 C ATOM 155 O TYR A 12 6.326 9.390 -7.503 1.00 0.00 O ATOM 156 CB TYR A 12 8.230 9.112 -4.814 1.00 0.00 C ATOM 157 CG TYR A 12 8.564 8.979 -3.346 1.00 0.00 C ATOM 158 CD1 TYR A 12 8.269 7.825 -2.632 1.00 0.00 C ATOM 159 CD2 TYR A 12 9.197 10.020 -2.680 1.00 0.00 C ATOM 160 CE1 TYR A 12 8.592 7.721 -1.290 1.00 0.00 C ATOM 161 CE2 TYR A 12 9.524 9.925 -1.344 1.00 0.00 C ATOM 162 CZ TYR A 12 9.221 8.779 -0.652 1.00 0.00 C ATOM 163 OH TYR A 12 9.528 8.687 0.688 1.00 0.00 O ATOM 0 H TYR A 12 6.228 7.529 -5.258 1.00 0.00 H new ATOM 0 HA TYR A 12 6.480 10.303 -4.437 1.00 0.00 H new ATOM 0 HB2 TYR A 12 8.428 8.155 -5.298 1.00 0.00 H new ATOM 0 HB3 TYR A 12 8.911 9.839 -5.255 1.00 0.00 H new ATOM 0 HD1 TYR A 12 7.782 6.999 -3.129 1.00 0.00 H new ATOM 0 HD2 TYR A 12 9.438 10.924 -3.220 1.00 0.00 H new ATOM 0 HE1 TYR A 12 8.355 6.820 -0.743 1.00 0.00 H new ATOM 0 HE2 TYR A 12 10.015 10.747 -0.845 1.00 0.00 H new ATOM 0 HH TYR A 12 9.067 9.399 1.179 1.00 0.00 H new ATOM 173 N ILE A 13 7.159 11.276 -6.698 1.00 0.00 N ATOM 174 CA ILE A 13 7.280 11.894 -7.963 1.00 0.00 C ATOM 175 C ILE A 13 8.657 12.458 -8.150 1.00 0.00 C ATOM 176 O ILE A 13 9.236 13.073 -7.245 1.00 0.00 O ATOM 177 CB ILE A 13 6.187 12.948 -8.248 1.00 0.00 C ATOM 178 CG1 ILE A 13 5.911 13.836 -7.018 1.00 0.00 C ATOM 179 CG2 ILE A 13 4.928 12.292 -8.797 1.00 0.00 C ATOM 180 CD1 ILE A 13 4.811 14.854 -7.218 1.00 0.00 C ATOM 0 H ILE A 13 7.432 11.872 -5.917 1.00 0.00 H new ATOM 0 HA ILE A 13 7.122 11.110 -8.703 1.00 0.00 H new ATOM 0 HB ILE A 13 6.559 13.618 -9.023 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.649 13.197 -6.175 1.00 0.00 H new ATOM 0 HG13 ILE A 13 6.829 14.359 -6.749 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.174 13.055 -8.989 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.164 11.773 -9.726 1.00 0.00 H new ATOM 0 HG23 ILE A 13 4.543 11.577 -8.069 1.00 0.00 H new ATOM 0 HD11 ILE A 13 4.683 15.435 -6.305 1.00 0.00 H new ATOM 0 HD12 ILE A 13 5.077 15.521 -8.038 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.879 14.341 -7.455 1.00 0.00 H new ATOM 192 N TYR A 14 9.187 12.169 -9.288 1.00 0.00 N ATOM 193 CA TYR A 14 10.477 12.596 -9.719 1.00 0.00 C ATOM 194 C TYR A 14 10.354 13.966 -10.305 1.00 0.00 C ATOM 195 O TYR A 14 9.439 14.219 -11.066 1.00 0.00 O ATOM 196 CB TYR A 14 11.002 11.602 -10.780 1.00 0.00 C ATOM 197 CG TYR A 14 12.077 12.150 -11.696 1.00 0.00 C ATOM 198 CD1 TYR A 14 13.393 12.259 -11.281 1.00 0.00 C ATOM 199 CD2 TYR A 14 11.753 12.564 -12.989 1.00 0.00 C ATOM 200 CE1 TYR A 14 14.356 12.762 -12.124 1.00 0.00 C ATOM 201 CE2 TYR A 14 12.702 13.069 -13.838 1.00 0.00 C ATOM 202 CZ TYR A 14 14.012 13.167 -13.399 1.00 0.00 C ATOM 203 OH TYR A 14 14.987 13.658 -14.234 1.00 0.00 O ATOM 0 H TYR A 14 8.707 11.597 -9.983 1.00 0.00 H new ATOM 0 HA TYR A 14 11.175 12.624 -8.882 1.00 0.00 H new ATOM 0 HB2 TYR A 14 11.395 10.723 -10.269 1.00 0.00 H new ATOM 0 HB3 TYR A 14 10.162 11.268 -11.390 1.00 0.00 H new ATOM 0 HD1 TYR A 14 13.666 11.946 -10.284 1.00 0.00 H new ATOM 0 HD2 TYR A 14 10.731 12.484 -13.328 1.00 0.00 H new ATOM 0 HE1 TYR A 14 15.380 12.840 -11.790 1.00 0.00 H new ATOM 0 HE2 TYR A 14 12.433 13.386 -14.835 1.00 0.00 H new ATOM 0 HH TYR A 14 15.744 13.979 -13.700 1.00 0.00 H new ATOM 213 N ILE A 15 11.238 14.836 -9.940 1.00 0.00 N ATOM 214 CA ILE A 15 11.258 16.158 -10.476 1.00 0.00 C ATOM 215 C ILE A 15 12.631 16.356 -11.095 1.00 0.00 C ATOM 216 O ILE A 15 13.641 16.288 -10.402 1.00 0.00 O ATOM 217 CB ILE A 15 11.054 17.229 -9.375 1.00 0.00 C ATOM 218 CG1 ILE A 15 9.950 16.798 -8.397 1.00 0.00 C ATOM 219 CG2 ILE A 15 10.657 18.550 -10.038 1.00 0.00 C ATOM 220 CD1 ILE A 15 9.855 17.666 -7.162 1.00 0.00 C ATOM 0 H ILE A 15 11.972 14.648 -9.257 1.00 0.00 H new ATOM 0 HA ILE A 15 10.450 16.270 -11.199 1.00 0.00 H new ATOM 0 HB ILE A 15 11.983 17.348 -8.818 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.991 16.814 -8.916 1.00 0.00 H new ATOM 0 HG13 ILE A 15 10.130 15.767 -8.092 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.511 19.312 -9.272 1.00 0.00 H new ATOM 0 HG22 ILE A 15 11.447 18.867 -10.719 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.730 18.413 -10.596 1.00 0.00 H new ATOM 0 HD11 ILE A 15 9.054 17.299 -6.520 1.00 0.00 H new ATOM 0 HD12 ILE A 15 10.799 17.631 -6.619 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.643 18.694 -7.455 1.00 0.00 H new ATOM 232 N GLY A 16 12.681 16.544 -12.365 1.00 0.00 N ATOM 233 CA GLY A 16 13.932 16.721 -13.023 1.00 0.00 C ATOM 234 C GLY A 16 13.956 17.966 -13.847 1.00 0.00 C ATOM 235 O GLY A 16 12.908 18.596 -14.056 1.00 0.00 O ATOM 0 H GLY A 16 11.865 16.580 -12.976 1.00 0.00 H new ATOM 0 HA2 GLY A 16 14.730 16.761 -12.281 1.00 0.00 H new ATOM 0 HA3 GLY A 16 14.132 15.860 -13.660 1.00 0.00 H new ATOM 239 N ASN A 17 15.149 18.333 -14.283 1.00 0.00 N ATOM 240 CA ASN A 17 15.393 19.496 -15.145 1.00 0.00 C ATOM 241 C ASN A 17 15.108 20.805 -14.377 1.00 0.00 C ATOM 242 O ASN A 17 14.547 21.760 -14.904 1.00 0.00 O ATOM 243 CB ASN A 17 14.588 19.386 -16.484 1.00 0.00 C ATOM 244 CG ASN A 17 15.065 20.349 -17.592 1.00 0.00 C ATOM 245 OD1 ASN A 17 15.995 20.035 -18.341 1.00 0.00 O ATOM 246 ND2 ASN A 17 14.401 21.453 -17.764 1.00 0.00 N ATOM 0 H ASN A 17 16.001 17.824 -14.046 1.00 0.00 H new ATOM 0 HA ASN A 17 16.446 19.514 -15.425 1.00 0.00 H new ATOM 0 HB2 ASN A 17 14.658 18.363 -16.853 1.00 0.00 H new ATOM 0 HB3 ASN A 17 13.535 19.580 -16.279 1.00 0.00 H new ATOM 0 HD21 ASN A 17 14.645 22.081 -18.530 1.00 0.00 H new ATOM 0 HD22 ASN A 17 13.636 21.692 -17.133 1.00 0.00 H new ATOM 253 N LEU A 18 15.531 20.839 -13.118 1.00 0.00 N ATOM 254 CA LEU A 18 15.396 22.040 -12.297 1.00 0.00 C ATOM 255 C LEU A 18 16.560 22.963 -12.560 1.00 0.00 C ATOM 256 O LEU A 18 17.600 22.540 -13.090 1.00 0.00 O ATOM 257 CB LEU A 18 15.350 21.752 -10.774 1.00 0.00 C ATOM 258 CG LEU A 18 14.119 21.042 -10.196 1.00 0.00 C ATOM 259 CD1 LEU A 18 14.082 19.594 -10.595 1.00 0.00 C ATOM 260 CD2 LEU A 18 14.088 21.180 -8.685 1.00 0.00 C ATOM 0 H LEU A 18 15.970 20.050 -12.643 1.00 0.00 H new ATOM 0 HA LEU A 18 14.444 22.492 -12.577 1.00 0.00 H new ATOM 0 HB2 LEU A 18 16.225 21.152 -10.524 1.00 0.00 H new ATOM 0 HB3 LEU A 18 15.457 22.704 -10.254 1.00 0.00 H new ATOM 0 HG LEU A 18 13.232 21.522 -10.610 1.00 0.00 H new ATOM 0 HD11 LEU A 18 13.197 19.122 -10.168 1.00 0.00 H new ATOM 0 HD12 LEU A 18 14.046 19.517 -11.682 1.00 0.00 H new ATOM 0 HD13 LEU A 18 14.976 19.092 -10.225 1.00 0.00 H new ATOM 0 HD21 LEU A 18 13.208 20.671 -8.291 1.00 0.00 H new ATOM 0 HD22 LEU A 18 14.987 20.733 -8.260 1.00 0.00 H new ATOM 0 HD23 LEU A 18 14.046 22.236 -8.417 1.00 0.00 H new ATOM 272 N ASN A 19 16.403 24.201 -12.191 1.00 0.00 N ATOM 273 CA ASN A 19 17.442 25.192 -12.341 1.00 0.00 C ATOM 274 C ASN A 19 18.393 25.069 -11.141 1.00 0.00 C ATOM 275 O ASN A 19 18.090 24.336 -10.194 1.00 0.00 O ATOM 276 CB ASN A 19 16.830 26.590 -12.453 1.00 0.00 C ATOM 277 CG ASN A 19 17.448 27.402 -13.581 1.00 0.00 C ATOM 278 OD1 ASN A 19 17.906 26.848 -14.574 1.00 0.00 O ATOM 279 ND2 ASN A 19 17.477 28.693 -13.435 1.00 0.00 N ATOM 0 H ASN A 19 15.544 24.560 -11.773 1.00 0.00 H new ATOM 0 HA ASN A 19 18.007 25.026 -13.258 1.00 0.00 H new ATOM 0 HB2 ASN A 19 15.756 26.502 -12.618 1.00 0.00 H new ATOM 0 HB3 ASN A 19 16.965 27.120 -11.510 1.00 0.00 H new ATOM 0 HD21 ASN A 19 17.890 29.279 -14.160 1.00 0.00 H new ATOM 0 HD22 ASN A 19 17.086 29.120 -12.595 1.00 0.00 H new ATOM 286 N ARG A 20 19.513 25.755 -11.163 1.00 0.00 N ATOM 287 CA ARG A 20 20.550 25.536 -10.147 1.00 0.00 C ATOM 288 C ARG A 20 20.182 26.123 -8.778 1.00 0.00 C ATOM 289 O ARG A 20 20.492 25.538 -7.751 1.00 0.00 O ATOM 290 CB ARG A 20 21.888 26.114 -10.601 1.00 0.00 C ATOM 291 CG ARG A 20 23.075 25.670 -9.747 1.00 0.00 C ATOM 292 CD ARG A 20 23.378 24.201 -9.941 1.00 0.00 C ATOM 293 NE ARG A 20 23.602 23.856 -11.350 1.00 0.00 N ATOM 294 CZ ARG A 20 24.131 22.710 -11.769 1.00 0.00 C ATOM 295 NH1 ARG A 20 24.648 21.850 -10.895 1.00 0.00 N1+ ATOM 296 NH2 ARG A 20 24.164 22.448 -13.067 1.00 0.00 N ATOM 0 H ARG A 20 19.740 26.465 -11.860 1.00 0.00 H new ATOM 0 HA ARG A 20 20.633 24.455 -10.032 1.00 0.00 H new ATOM 0 HB2 ARG A 20 22.067 25.821 -11.635 1.00 0.00 H new ATOM 0 HB3 ARG A 20 21.827 27.202 -10.584 1.00 0.00 H new ATOM 0 HG2 ARG A 20 23.953 26.261 -10.007 1.00 0.00 H new ATOM 0 HG3 ARG A 20 22.861 25.863 -8.696 1.00 0.00 H new ATOM 0 HD2 ARG A 20 24.261 23.935 -9.360 1.00 0.00 H new ATOM 0 HD3 ARG A 20 22.550 23.608 -9.552 1.00 0.00 H new ATOM 0 HE ARG A 20 23.334 24.542 -12.056 1.00 0.00 H new ATOM 0 HH11 ARG A 20 24.640 22.068 -9.899 1.00 0.00 H new ATOM 0 HH12 ARG A 20 25.053 20.972 -11.221 1.00 0.00 H new ATOM 0 HH21 ARG A 20 23.786 23.122 -13.733 1.00 0.00 H new ATOM 0 HH22 ARG A 20 24.567 21.572 -13.400 1.00 0.00 H new ATOM 310 N GLU A 21 19.538 27.255 -8.777 1.00 0.00 N ATOM 311 CA GLU A 21 19.191 27.956 -7.549 1.00 0.00 C ATOM 312 C GLU A 21 18.042 27.305 -6.807 1.00 0.00 C ATOM 313 O GLU A 21 17.952 27.430 -5.576 1.00 0.00 O ATOM 314 CB GLU A 21 18.869 29.453 -7.797 1.00 0.00 C ATOM 315 CG GLU A 21 17.900 29.741 -8.929 1.00 0.00 C ATOM 316 CD GLU A 21 18.540 29.678 -10.304 1.00 0.00 C ATOM 317 OE1 GLU A 21 18.689 28.580 -10.858 1.00 0.00 O1- ATOM 318 OE2 GLU A 21 18.902 30.723 -10.848 1.00 0.00 O ATOM 0 H GLU A 21 19.232 27.730 -9.626 1.00 0.00 H new ATOM 0 HA GLU A 21 20.080 27.890 -6.922 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.461 29.874 -6.878 1.00 0.00 H new ATOM 0 HB3 GLU A 21 19.803 29.977 -8.001 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.080 29.025 -8.886 1.00 0.00 H new ATOM 0 HG3 GLU A 21 17.467 30.731 -8.783 1.00 0.00 H new ATOM 325 N LEU A 22 17.185 26.605 -7.541 1.00 0.00 N ATOM 326 CA LEU A 22 15.984 26.019 -6.960 1.00 0.00 C ATOM 327 C LEU A 22 16.340 24.973 -5.898 1.00 0.00 C ATOM 328 O LEU A 22 17.019 23.967 -6.165 1.00 0.00 O ATOM 329 CB LEU A 22 15.091 25.430 -8.066 1.00 0.00 C ATOM 330 CG LEU A 22 14.768 26.387 -9.238 1.00 0.00 C ATOM 331 CD1 LEU A 22 13.854 25.754 -10.245 1.00 0.00 C ATOM 332 CD2 LEU A 22 14.157 27.678 -8.760 1.00 0.00 C ATOM 0 H LEU A 22 17.300 26.430 -8.539 1.00 0.00 H new ATOM 0 HA LEU A 22 15.420 26.805 -6.457 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.578 24.542 -8.468 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.153 25.103 -7.617 1.00 0.00 H new ATOM 0 HG LEU A 22 15.723 26.604 -9.716 1.00 0.00 H new ATOM 0 HD11 LEU A 22 13.654 26.461 -11.050 1.00 0.00 H new ATOM 0 HD12 LEU A 22 14.327 24.862 -10.655 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.916 25.479 -9.763 1.00 0.00 H new ATOM 0 HD21 LEU A 22 13.946 28.320 -9.616 1.00 0.00 H new ATOM 0 HD22 LEU A 22 13.229 27.467 -8.228 1.00 0.00 H new ATOM 0 HD23 LEU A 22 14.852 28.183 -8.090 1.00 0.00 H new ATOM 344 N THR A 23 15.922 25.276 -4.705 1.00 0.00 N ATOM 345 CA THR A 23 16.167 24.492 -3.524 1.00 0.00 C ATOM 346 C THR A 23 14.831 23.884 -2.978 1.00 0.00 C ATOM 347 O THR A 23 13.785 24.043 -3.602 1.00 0.00 O ATOM 348 CB THR A 23 16.918 25.383 -2.494 1.00 0.00 C ATOM 349 OG1 THR A 23 17.123 24.720 -1.247 1.00 0.00 O ATOM 350 CG2 THR A 23 16.191 26.689 -2.286 1.00 0.00 C ATOM 0 H THR A 23 15.375 26.116 -4.517 1.00 0.00 H new ATOM 0 HA THR A 23 16.802 23.635 -3.747 1.00 0.00 H new ATOM 0 HB THR A 23 17.903 25.589 -2.913 1.00 0.00 H new ATOM 0 HG1 THR A 23 17.022 25.363 -0.514 1.00 0.00 H new ATOM 0 HG21 THR A 23 16.734 27.296 -1.562 1.00 0.00 H new ATOM 0 HG22 THR A 23 16.127 27.225 -3.233 1.00 0.00 H new ATOM 0 HG23 THR A 23 15.186 26.491 -1.913 1.00 0.00 H new ATOM 358 N GLU A 24 14.863 23.257 -1.787 1.00 0.00 N ATOM 359 CA GLU A 24 13.688 22.553 -1.219 1.00 0.00 C ATOM 360 C GLU A 24 12.496 23.479 -0.995 1.00 0.00 C ATOM 361 O GLU A 24 11.364 23.148 -1.351 1.00 0.00 O ATOM 362 CB GLU A 24 14.009 21.839 0.107 1.00 0.00 C ATOM 363 CG GLU A 24 15.139 20.832 0.041 1.00 0.00 C ATOM 364 CD GLU A 24 16.509 21.455 0.090 1.00 0.00 C ATOM 365 OE1 GLU A 24 16.666 22.519 0.705 1.00 0.00 O1- ATOM 366 OE2 GLU A 24 17.446 20.902 -0.515 1.00 0.00 O ATOM 0 H GLU A 24 15.692 23.221 -1.194 1.00 0.00 H new ATOM 0 HA GLU A 24 13.424 21.809 -1.971 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.258 22.592 0.855 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.110 21.330 0.454 1.00 0.00 H new ATOM 0 HG2 GLU A 24 15.038 20.131 0.870 1.00 0.00 H new ATOM 0 HG3 GLU A 24 15.045 20.254 -0.878 1.00 0.00 H new ATOM 373 N GLY A 25 12.759 24.645 -0.429 1.00 0.00 N ATOM 374 CA GLY A 25 11.683 25.596 -0.117 1.00 0.00 C ATOM 375 C GLY A 25 11.015 26.145 -1.363 1.00 0.00 C ATOM 376 O GLY A 25 9.854 26.555 -1.338 1.00 0.00 O ATOM 0 H GLY A 25 13.695 24.962 -0.175 1.00 0.00 H new ATOM 0 HA2 GLY A 25 10.936 25.103 0.505 1.00 0.00 H new ATOM 0 HA3 GLY A 25 12.090 26.421 0.467 1.00 0.00 H new ATOM 380 N ASP A 26 11.745 26.116 -2.447 1.00 0.00 N ATOM 381 CA ASP A 26 11.286 26.603 -3.736 1.00 0.00 C ATOM 382 C ASP A 26 10.260 25.625 -4.257 1.00 0.00 C ATOM 383 O ASP A 26 9.128 25.985 -4.619 1.00 0.00 O ATOM 384 CB ASP A 26 12.482 26.658 -4.679 1.00 0.00 C ATOM 385 CG ASP A 26 12.181 27.308 -5.978 1.00 0.00 C ATOM 386 OD1 ASP A 26 11.632 26.661 -6.859 1.00 0.00 O ATOM 387 OD2 ASP A 26 12.553 28.486 -6.123 1.00 0.00 O1- ATOM 0 H ASP A 26 12.696 25.747 -2.466 1.00 0.00 H new ATOM 0 HA ASP A 26 10.844 27.596 -3.656 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.295 27.197 -4.192 1.00 0.00 H new ATOM 0 HB3 ASP A 26 12.837 25.644 -4.863 1.00 0.00 H new ATOM 392 N ILE A 27 10.649 24.372 -4.185 1.00 0.00 N ATOM 393 CA ILE A 27 9.835 23.246 -4.569 1.00 0.00 C ATOM 394 C ILE A 27 8.568 23.196 -3.702 1.00 0.00 C ATOM 395 O ILE A 27 7.470 22.921 -4.195 1.00 0.00 O ATOM 396 CB ILE A 27 10.662 21.952 -4.409 1.00 0.00 C ATOM 397 CG1 ILE A 27 11.917 22.061 -5.273 1.00 0.00 C ATOM 398 CG2 ILE A 27 9.850 20.732 -4.813 1.00 0.00 C ATOM 399 CD1 ILE A 27 12.964 21.027 -4.977 1.00 0.00 C ATOM 0 H ILE A 27 11.572 24.102 -3.846 1.00 0.00 H new ATOM 0 HA ILE A 27 9.528 23.346 -5.610 1.00 0.00 H new ATOM 0 HB ILE A 27 10.940 21.832 -3.362 1.00 0.00 H new ATOM 0 HG12 ILE A 27 11.630 21.980 -6.321 1.00 0.00 H new ATOM 0 HG13 ILE A 27 12.352 23.051 -5.137 1.00 0.00 H new ATOM 0 HG21 ILE A 27 10.456 19.835 -4.691 1.00 0.00 H new ATOM 0 HG22 ILE A 27 8.964 20.660 -4.183 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.547 20.826 -5.856 1.00 0.00 H new ATOM 0 HD11 ILE A 27 13.820 21.177 -5.635 1.00 0.00 H new ATOM 0 HD12 ILE A 27 13.284 21.119 -3.939 1.00 0.00 H new ATOM 0 HD13 ILE A 27 12.550 20.032 -5.142 1.00 0.00 H new ATOM 411 N LEU A 28 8.716 23.498 -2.420 1.00 0.00 N ATOM 412 CA LEU A 28 7.577 23.569 -1.535 1.00 0.00 C ATOM 413 C LEU A 28 6.641 24.683 -1.965 1.00 0.00 C ATOM 414 O LEU A 28 5.448 24.493 -2.001 1.00 0.00 O ATOM 415 CB LEU A 28 7.997 23.760 -0.081 1.00 0.00 C ATOM 416 CG LEU A 28 8.760 22.602 0.557 1.00 0.00 C ATOM 417 CD1 LEU A 28 9.155 22.957 1.967 1.00 0.00 C ATOM 418 CD2 LEU A 28 7.920 21.332 0.552 1.00 0.00 C ATOM 0 H LEU A 28 9.613 23.696 -1.977 1.00 0.00 H new ATOM 0 HA LEU A 28 7.051 22.616 -1.602 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.616 24.655 -0.018 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.102 23.949 0.512 1.00 0.00 H new ATOM 0 HG LEU A 28 9.660 22.419 -0.030 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.699 22.124 2.413 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.792 23.841 1.955 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.260 23.163 2.555 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.484 20.521 1.012 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.002 21.500 1.116 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.671 21.065 -0.475 1.00 0.00 H new ATOM 430 N THR A 29 7.198 25.814 -2.345 1.00 0.00 N ATOM 431 CA THR A 29 6.414 26.953 -2.787 1.00 0.00 C ATOM 432 C THR A 29 5.560 26.605 -4.046 1.00 0.00 C ATOM 433 O THR A 29 4.430 27.127 -4.224 1.00 0.00 O ATOM 434 CB THR A 29 7.328 28.189 -3.037 1.00 0.00 C ATOM 435 OG1 THR A 29 8.004 28.531 -1.810 1.00 0.00 O ATOM 436 CG2 THR A 29 6.523 29.398 -3.509 1.00 0.00 C ATOM 0 H THR A 29 8.206 25.972 -2.357 1.00 0.00 H new ATOM 0 HA THR A 29 5.717 27.210 -1.990 1.00 0.00 H new ATOM 0 HB THR A 29 8.044 27.928 -3.816 1.00 0.00 H new ATOM 0 HG1 THR A 29 8.569 27.782 -1.528 1.00 0.00 H new ATOM 0 HG21 THR A 29 7.195 30.241 -3.673 1.00 0.00 H new ATOM 0 HG22 THR A 29 6.013 29.154 -4.441 1.00 0.00 H new ATOM 0 HG23 THR A 29 5.786 29.663 -2.751 1.00 0.00 H new ATOM 444 N VAL A 30 6.080 25.751 -4.919 1.00 0.00 N ATOM 445 CA VAL A 30 5.297 25.314 -6.059 1.00 0.00 C ATOM 446 C VAL A 30 4.300 24.183 -5.724 1.00 0.00 C ATOM 447 O VAL A 30 3.121 24.289 -6.043 1.00 0.00 O ATOM 448 CB VAL A 30 6.121 25.037 -7.369 1.00 0.00 C ATOM 449 CG1 VAL A 30 6.787 26.307 -7.862 1.00 0.00 C ATOM 450 CG2 VAL A 30 7.158 23.958 -7.184 1.00 0.00 C ATOM 0 H VAL A 30 7.019 25.357 -4.860 1.00 0.00 H new ATOM 0 HA VAL A 30 4.694 26.189 -6.303 1.00 0.00 H new ATOM 0 HB VAL A 30 5.408 24.685 -8.115 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.352 26.093 -8.769 1.00 0.00 H new ATOM 0 HG12 VAL A 30 6.026 27.057 -8.077 1.00 0.00 H new ATOM 0 HG13 VAL A 30 7.463 26.685 -7.095 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.697 23.808 -8.119 1.00 0.00 H new ATOM 0 HG22 VAL A 30 7.859 24.257 -6.405 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.668 23.028 -6.894 1.00 0.00 H new ATOM 460 N PHE A 31 4.753 23.154 -5.017 1.00 0.00 N ATOM 461 CA PHE A 31 3.899 21.991 -4.709 1.00 0.00 C ATOM 462 C PHE A 31 2.892 22.243 -3.584 1.00 0.00 C ATOM 463 O PHE A 31 1.925 21.501 -3.445 1.00 0.00 O ATOM 464 CB PHE A 31 4.732 20.732 -4.403 1.00 0.00 C ATOM 465 CG PHE A 31 5.401 20.110 -5.606 1.00 0.00 C ATOM 466 CD1 PHE A 31 6.528 20.673 -6.159 1.00 0.00 C ATOM 467 CD2 PHE A 31 4.894 18.957 -6.177 1.00 0.00 C ATOM 468 CE1 PHE A 31 7.141 20.112 -7.258 1.00 0.00 C ATOM 469 CE2 PHE A 31 5.505 18.389 -7.278 1.00 0.00 C ATOM 470 CZ PHE A 31 6.626 18.968 -7.818 1.00 0.00 C ATOM 0 H PHE A 31 5.700 23.092 -4.644 1.00 0.00 H new ATOM 0 HA PHE A 31 3.320 21.821 -5.617 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.498 20.989 -3.671 1.00 0.00 H new ATOM 0 HB3 PHE A 31 4.084 19.988 -3.939 1.00 0.00 H new ATOM 0 HD1 PHE A 31 6.940 21.571 -5.724 1.00 0.00 H new ATOM 0 HD2 PHE A 31 4.012 18.496 -5.758 1.00 0.00 H new ATOM 0 HE1 PHE A 31 8.024 20.570 -7.678 1.00 0.00 H new ATOM 0 HE2 PHE A 31 5.100 17.488 -7.714 1.00 0.00 H new ATOM 0 HZ PHE A 31 7.102 18.526 -8.681 1.00 0.00 H new ATOM 480 N SER A 32 3.093 23.294 -2.797 1.00 0.00 N ATOM 481 CA SER A 32 2.200 23.583 -1.676 1.00 0.00 C ATOM 482 C SER A 32 0.808 24.049 -2.152 1.00 0.00 C ATOM 483 O SER A 32 -0.117 24.195 -1.355 1.00 0.00 O ATOM 484 CB SER A 32 2.822 24.572 -0.671 1.00 0.00 C ATOM 485 OG SER A 32 2.097 24.598 0.558 1.00 0.00 O ATOM 0 H SER A 32 3.860 23.957 -2.911 1.00 0.00 H new ATOM 0 HA SER A 32 2.058 22.643 -1.143 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.857 24.292 -0.477 1.00 0.00 H new ATOM 0 HB3 SER A 32 2.838 25.571 -1.106 1.00 0.00 H new ATOM 0 HG SER A 32 1.551 23.788 0.633 1.00 0.00 H new ATOM 491 N GLU A 33 0.661 24.292 -3.437 1.00 0.00 N ATOM 492 CA GLU A 33 -0.640 24.639 -3.989 1.00 0.00 C ATOM 493 C GLU A 33 -1.554 23.413 -3.903 1.00 0.00 C ATOM 494 O GLU A 33 -2.770 23.522 -3.800 1.00 0.00 O ATOM 495 CB GLU A 33 -0.481 25.086 -5.437 1.00 0.00 C ATOM 496 CG GLU A 33 -1.759 25.554 -6.108 1.00 0.00 C ATOM 497 CD GLU A 33 -1.488 26.110 -7.470 1.00 0.00 C ATOM 498 OE1 GLU A 33 -0.855 27.166 -7.541 1.00 0.00 O1- ATOM 499 OE2 GLU A 33 -1.860 25.483 -8.484 1.00 0.00 O ATOM 0 H GLU A 33 1.419 24.257 -4.119 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.082 25.459 -3.423 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.248 25.895 -5.474 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -0.068 24.258 -6.014 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.457 24.721 -6.186 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.238 26.315 -5.491 1.00 0.00 H new ATOM 506 N TYR A 34 -0.928 22.254 -3.864 1.00 0.00 N ATOM 507 CA TYR A 34 -1.617 20.993 -3.854 1.00 0.00 C ATOM 508 C TYR A 34 -1.519 20.367 -2.464 1.00 0.00 C ATOM 509 O TYR A 34 -1.603 19.143 -2.298 1.00 0.00 O ATOM 510 CB TYR A 34 -1.011 20.097 -4.949 1.00 0.00 C ATOM 511 CG TYR A 34 -0.916 20.842 -6.268 1.00 0.00 C ATOM 512 CD1 TYR A 34 -2.055 21.132 -7.011 1.00 0.00 C ATOM 513 CD2 TYR A 34 0.303 21.331 -6.719 1.00 0.00 C ATOM 514 CE1 TYR A 34 -1.974 21.872 -8.173 1.00 0.00 C ATOM 515 CE2 TYR A 34 0.383 22.084 -7.865 1.00 0.00 C ATOM 516 CZ TYR A 34 -0.750 22.350 -8.591 1.00 0.00 C ATOM 517 OH TYR A 34 -0.665 23.135 -9.712 1.00 0.00 O ATOM 0 H TYR A 34 0.088 22.168 -3.838 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.677 21.122 -4.071 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -0.020 19.763 -4.643 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -1.624 19.204 -5.074 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -3.016 20.773 -6.674 1.00 0.00 H new ATOM 0 HD2 TYR A 34 1.202 21.116 -6.160 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -2.863 22.075 -8.751 1.00 0.00 H new ATOM 0 HE2 TYR A 34 1.338 22.467 -8.194 1.00 0.00 H new ATOM 0 HH TYR A 34 -1.018 24.028 -9.514 1.00 0.00 H new ATOM 527 N GLY A 35 -1.374 21.231 -1.466 1.00 0.00 N ATOM 528 CA GLY A 35 -1.368 20.805 -0.087 1.00 0.00 C ATOM 529 C GLY A 35 -0.047 21.066 0.591 1.00 0.00 C ATOM 530 O GLY A 35 0.611 22.074 0.331 1.00 0.00 O ATOM 0 H GLY A 35 -1.259 22.236 -1.596 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.159 21.324 0.454 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.594 19.740 -0.038 1.00 0.00 H new ATOM 534 N VAL A 36 0.328 20.204 1.486 1.00 0.00 N ATOM 535 CA VAL A 36 1.604 20.318 2.144 1.00 0.00 C ATOM 536 C VAL A 36 2.390 19.028 1.890 1.00 0.00 C ATOM 537 O VAL A 36 1.973 17.949 2.335 1.00 0.00 O ATOM 538 CB VAL A 36 1.464 20.536 3.670 1.00 0.00 C ATOM 539 CG1 VAL A 36 2.808 20.919 4.272 1.00 0.00 C ATOM 540 CG2 VAL A 36 0.418 21.587 3.996 1.00 0.00 C ATOM 0 H VAL A 36 -0.233 19.406 1.783 1.00 0.00 H new ATOM 0 HA VAL A 36 2.121 21.188 1.739 1.00 0.00 H new ATOM 0 HB VAL A 36 1.131 19.596 4.110 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.696 21.070 5.346 1.00 0.00 H new ATOM 0 HG12 VAL A 36 3.528 20.121 4.091 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.164 21.841 3.812 1.00 0.00 H new ATOM 0 HG21 VAL A 36 0.350 21.710 5.077 1.00 0.00 H new ATOM 0 HG22 VAL A 36 0.701 22.536 3.540 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -0.549 21.271 3.606 1.00 0.00 H new ATOM 550 N PRO A 37 3.476 19.107 1.096 1.00 0.00 N ATOM 551 CA PRO A 37 4.335 17.949 0.773 1.00 0.00 C ATOM 552 C PRO A 37 4.862 17.210 2.011 1.00 0.00 C ATOM 553 O PRO A 37 5.298 17.824 2.980 1.00 0.00 O ATOM 554 CB PRO A 37 5.487 18.580 -0.007 1.00 0.00 C ATOM 555 CG PRO A 37 4.884 19.787 -0.619 1.00 0.00 C ATOM 556 CD PRO A 37 3.947 20.328 0.417 1.00 0.00 C ATOM 0 HA PRO A 37 3.784 17.185 0.224 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.319 18.838 0.648 1.00 0.00 H new ATOM 0 HB3 PRO A 37 5.876 17.900 -0.765 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.648 20.520 -0.880 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.353 19.539 -1.538 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.452 21.005 1.106 1.00 0.00 H new ATOM 0 HD3 PRO A 37 3.124 20.885 -0.032 1.00 0.00 H new ATOM 564 N VAL A 38 4.840 15.889 1.933 1.00 0.00 N ATOM 565 CA VAL A 38 5.222 15.014 3.037 1.00 0.00 C ATOM 566 C VAL A 38 6.708 14.695 2.992 1.00 0.00 C ATOM 567 O VAL A 38 7.382 14.662 4.021 1.00 0.00 O ATOM 568 CB VAL A 38 4.377 13.707 2.984 1.00 0.00 C ATOM 569 CG1 VAL A 38 4.840 12.678 3.993 1.00 0.00 C ATOM 570 CG2 VAL A 38 2.929 14.029 3.230 1.00 0.00 C ATOM 0 H VAL A 38 4.554 15.386 1.093 1.00 0.00 H new ATOM 0 HA VAL A 38 5.024 15.529 3.977 1.00 0.00 H new ATOM 0 HB VAL A 38 4.509 13.278 1.991 1.00 0.00 H new ATOM 0 HG11 VAL A 38 4.218 11.786 3.915 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.879 12.415 3.794 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.757 13.091 4.998 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.341 13.112 3.192 1.00 0.00 H new ATOM 0 HG22 VAL A 38 2.820 14.489 4.212 1.00 0.00 H new ATOM 0 HG23 VAL A 38 2.575 14.719 2.464 1.00 0.00 H new ATOM 580 N ASP A 39 7.200 14.484 1.807 1.00 0.00 N ATOM 581 CA ASP A 39 8.600 14.179 1.575 1.00 0.00 C ATOM 582 C ASP A 39 9.042 15.000 0.418 1.00 0.00 C ATOM 583 O ASP A 39 8.358 15.037 -0.598 1.00 0.00 O ATOM 584 CB ASP A 39 8.863 12.663 1.248 1.00 0.00 C ATOM 585 CG ASP A 39 8.911 11.714 2.432 1.00 0.00 C ATOM 586 OD1 ASP A 39 9.517 12.039 3.465 1.00 0.00 O1- ATOM 587 OD2 ASP A 39 8.338 10.606 2.329 1.00 0.00 O ATOM 0 H ASP A 39 6.640 14.517 0.955 1.00 0.00 H new ATOM 0 HA ASP A 39 9.152 14.401 2.488 1.00 0.00 H new ATOM 0 HB2 ASP A 39 8.084 12.320 0.567 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.809 12.589 0.712 1.00 0.00 H new ATOM 592 N VAL A 40 10.106 15.709 0.576 1.00 0.00 N ATOM 593 CA VAL A 40 10.696 16.436 -0.506 1.00 0.00 C ATOM 594 C VAL A 40 12.176 16.411 -0.312 1.00 0.00 C ATOM 595 O VAL A 40 12.669 16.696 0.763 1.00 0.00 O ATOM 596 CB VAL A 40 10.163 17.907 -0.682 1.00 0.00 C ATOM 597 CG1 VAL A 40 10.404 18.768 0.536 1.00 0.00 C ATOM 598 CG2 VAL A 40 10.766 18.563 -1.915 1.00 0.00 C ATOM 0 H VAL A 40 10.598 15.804 1.464 1.00 0.00 H new ATOM 0 HA VAL A 40 10.407 15.945 -1.435 1.00 0.00 H new ATOM 0 HB VAL A 40 9.084 17.826 -0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 40 10.016 19.770 0.356 1.00 0.00 H new ATOM 0 HG12 VAL A 40 9.897 18.332 1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 40 11.474 18.824 0.736 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.381 19.578 -2.012 1.00 0.00 H new ATOM 0 HG22 VAL A 40 11.851 18.595 -1.816 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.499 17.987 -2.801 1.00 0.00 H new ATOM 608 N ILE A 41 12.862 15.992 -1.306 1.00 0.00 N ATOM 609 CA ILE A 41 14.287 15.888 -1.244 1.00 0.00 C ATOM 610 C ILE A 41 14.897 16.378 -2.522 1.00 0.00 C ATOM 611 O ILE A 41 14.534 15.937 -3.616 1.00 0.00 O ATOM 612 CB ILE A 41 14.838 14.457 -0.854 1.00 0.00 C ATOM 613 CG1 ILE A 41 14.291 13.296 -1.743 1.00 0.00 C ATOM 614 CG2 ILE A 41 14.585 14.166 0.617 1.00 0.00 C ATOM 615 CD1 ILE A 41 12.846 12.873 -1.472 1.00 0.00 C ATOM 0 H ILE A 41 12.457 15.707 -2.198 1.00 0.00 H new ATOM 0 HA ILE A 41 14.594 16.530 -0.418 1.00 0.00 H new ATOM 0 HB ILE A 41 15.911 14.495 -1.042 1.00 0.00 H new ATOM 0 HG12 ILE A 41 14.372 13.595 -2.788 1.00 0.00 H new ATOM 0 HG13 ILE A 41 14.935 12.427 -1.609 1.00 0.00 H new ATOM 0 HG21 ILE A 41 14.972 13.177 0.864 1.00 0.00 H new ATOM 0 HG22 ILE A 41 15.088 14.915 1.228 1.00 0.00 H new ATOM 0 HG23 ILE A 41 13.514 14.196 0.815 1.00 0.00 H new ATOM 0 HD11 ILE A 41 12.572 12.061 -2.146 1.00 0.00 H new ATOM 0 HD12 ILE A 41 12.753 12.535 -0.440 1.00 0.00 H new ATOM 0 HD13 ILE A 41 12.182 13.721 -1.637 1.00 0.00 H new ATOM 627 N LEU A 42 15.779 17.308 -2.387 1.00 0.00 N ATOM 628 CA LEU A 42 16.433 17.927 -3.489 1.00 0.00 C ATOM 629 C LEU A 42 17.757 17.217 -3.694 1.00 0.00 C ATOM 630 O LEU A 42 18.518 17.016 -2.742 1.00 0.00 O ATOM 631 CB LEU A 42 16.589 19.447 -3.157 1.00 0.00 C ATOM 632 CG LEU A 42 17.201 20.424 -4.192 1.00 0.00 C ATOM 633 CD1 LEU A 42 18.702 20.287 -4.308 1.00 0.00 C ATOM 634 CD2 LEU A 42 16.549 20.250 -5.534 1.00 0.00 C ATOM 0 H LEU A 42 16.074 17.670 -1.480 1.00 0.00 H new ATOM 0 HA LEU A 42 15.872 17.852 -4.420 1.00 0.00 H new ATOM 0 HB2 LEU A 42 15.597 19.824 -2.907 1.00 0.00 H new ATOM 0 HB3 LEU A 42 17.194 19.517 -2.253 1.00 0.00 H new ATOM 0 HG LEU A 42 17.004 21.432 -3.828 1.00 0.00 H new ATOM 0 HD11 LEU A 42 19.076 20.995 -5.047 1.00 0.00 H new ATOM 0 HD12 LEU A 42 19.162 20.494 -3.342 1.00 0.00 H new ATOM 0 HD13 LEU A 42 18.952 19.273 -4.619 1.00 0.00 H new ATOM 0 HD21 LEU A 42 16.993 20.945 -6.247 1.00 0.00 H new ATOM 0 HD22 LEU A 42 16.699 19.228 -5.882 1.00 0.00 H new ATOM 0 HD23 LEU A 42 15.481 20.451 -5.448 1.00 0.00 H new ATOM 646 N SER A 43 18.017 16.802 -4.911 1.00 0.00 N ATOM 647 CA SER A 43 19.241 16.134 -5.216 1.00 0.00 C ATOM 648 C SER A 43 20.344 17.175 -5.223 1.00 0.00 C ATOM 649 O SER A 43 20.411 18.045 -6.107 1.00 0.00 O ATOM 650 CB SER A 43 19.144 15.384 -6.561 1.00 0.00 C ATOM 651 OG SER A 43 20.318 14.634 -6.855 1.00 0.00 O ATOM 0 H SER A 43 17.387 16.920 -5.705 1.00 0.00 H new ATOM 0 HA SER A 43 19.460 15.376 -4.464 1.00 0.00 H new ATOM 0 HB2 SER A 43 18.285 14.713 -6.538 1.00 0.00 H new ATOM 0 HB3 SER A 43 18.966 16.102 -7.361 1.00 0.00 H new ATOM 0 HG SER A 43 20.207 14.176 -7.715 1.00 0.00 H new ATOM 657 N ARG A 44 21.141 17.135 -4.205 1.00 0.00 N ATOM 658 CA ARG A 44 22.205 18.058 -4.021 1.00 0.00 C ATOM 659 C ARG A 44 23.490 17.319 -3.733 1.00 0.00 C ATOM 660 O ARG A 44 23.474 16.181 -3.238 1.00 0.00 O ATOM 661 CB ARG A 44 21.871 19.068 -2.910 1.00 0.00 C ATOM 662 CG ARG A 44 21.356 18.435 -1.627 1.00 0.00 C ATOM 663 CD ARG A 44 21.206 19.452 -0.512 1.00 0.00 C ATOM 664 NE ARG A 44 20.231 20.511 -0.767 1.00 0.00 N ATOM 665 CZ ARG A 44 20.455 21.814 -0.536 1.00 0.00 C ATOM 666 NH1 ARG A 44 21.675 22.261 -0.291 1.00 0.00 N1+ ATOM 667 NH2 ARG A 44 19.456 22.661 -0.556 1.00 0.00 N ATOM 0 H ARG A 44 21.065 16.441 -3.462 1.00 0.00 H new ATOM 0 HA ARG A 44 22.340 18.625 -4.942 1.00 0.00 H new ATOM 0 HB2 ARG A 44 22.765 19.649 -2.682 1.00 0.00 H new ATOM 0 HB3 ARG A 44 21.123 19.767 -3.283 1.00 0.00 H new ATOM 0 HG2 ARG A 44 20.393 17.961 -1.818 1.00 0.00 H new ATOM 0 HG3 ARG A 44 22.041 17.648 -1.310 1.00 0.00 H new ATOM 0 HD2 ARG A 44 20.921 18.929 0.401 1.00 0.00 H new ATOM 0 HD3 ARG A 44 22.177 19.910 -0.326 1.00 0.00 H new ATOM 0 HE ARG A 44 19.322 20.242 -1.145 1.00 0.00 H new ATOM 0 HH11 ARG A 44 22.462 21.613 -0.276 1.00 0.00 H new ATOM 0 HH12 ARG A 44 21.829 23.254 -0.117 1.00 0.00 H new ATOM 0 HH21 ARG A 44 18.510 22.330 -0.747 1.00 0.00 H new ATOM 0 HH22 ARG A 44 19.624 23.652 -0.381 1.00 0.00 H new ATOM 681 N ASP A 45 24.578 17.951 -4.062 1.00 0.00 N ATOM 682 CA ASP A 45 25.904 17.385 -3.914 1.00 0.00 C ATOM 683 C ASP A 45 26.281 17.202 -2.439 1.00 0.00 C ATOM 684 O ASP A 45 25.875 17.987 -1.595 1.00 0.00 O ATOM 685 CB ASP A 45 26.912 18.273 -4.610 1.00 0.00 C ATOM 686 CG ASP A 45 28.280 17.681 -4.598 1.00 0.00 C ATOM 687 OD1 ASP A 45 28.588 16.890 -5.499 1.00 0.00 O ATOM 688 OD2 ASP A 45 29.045 17.981 -3.686 1.00 0.00 O1- ATOM 0 H ASP A 45 24.578 18.894 -4.450 1.00 0.00 H new ATOM 0 HA ASP A 45 25.907 16.397 -4.374 1.00 0.00 H new ATOM 0 HB2 ASP A 45 26.598 18.439 -5.640 1.00 0.00 H new ATOM 0 HB3 ASP A 45 26.934 19.248 -4.122 1.00 0.00 H new ATOM 693 N GLU A 46 27.047 16.164 -2.151 1.00 0.00 N ATOM 694 CA GLU A 46 27.435 15.824 -0.788 1.00 0.00 C ATOM 695 C GLU A 46 28.623 16.674 -0.285 1.00 0.00 C ATOM 696 O GLU A 46 28.799 16.864 0.920 1.00 0.00 O ATOM 697 CB GLU A 46 27.753 14.316 -0.689 1.00 0.00 C ATOM 698 CG GLU A 46 27.955 13.791 0.734 1.00 0.00 C ATOM 699 CD GLU A 46 28.226 12.301 0.780 1.00 0.00 C ATOM 700 OE1 GLU A 46 27.261 11.494 0.728 1.00 0.00 O1- ATOM 701 OE2 GLU A 46 29.394 11.902 0.873 1.00 0.00 O ATOM 0 H GLU A 46 27.420 15.529 -2.857 1.00 0.00 H new ATOM 0 HA GLU A 46 26.591 16.054 -0.138 1.00 0.00 H new ATOM 0 HB2 GLU A 46 26.941 13.757 -1.155 1.00 0.00 H new ATOM 0 HB3 GLU A 46 28.654 14.111 -1.267 1.00 0.00 H new ATOM 0 HG2 GLU A 46 28.788 14.321 1.197 1.00 0.00 H new ATOM 0 HG3 GLU A 46 27.067 14.012 1.327 1.00 0.00 H new ATOM 708 N ASN A 47 29.402 17.208 -1.195 1.00 0.00 N ATOM 709 CA ASN A 47 30.638 17.891 -0.830 1.00 0.00 C ATOM 710 C ASN A 47 30.498 19.399 -0.881 1.00 0.00 C ATOM 711 O ASN A 47 30.927 20.096 0.030 1.00 0.00 O ATOM 712 CB ASN A 47 31.792 17.446 -1.742 1.00 0.00 C ATOM 713 CG ASN A 47 32.086 15.950 -1.678 1.00 0.00 C ATOM 714 OD1 ASN A 47 31.838 15.332 -0.550 1.00 0.00 O flip ATOM 715 ND2 ASN A 47 32.523 15.352 -2.661 1.00 0.00 N flip ATOM 0 H ASN A 47 29.209 17.187 -2.196 1.00 0.00 H new ATOM 0 HA ASN A 47 30.860 17.612 0.200 1.00 0.00 H new ATOM 0 HB2 ASN A 47 31.555 17.716 -2.771 1.00 0.00 H new ATOM 0 HB3 ASN A 47 32.692 17.996 -1.468 1.00 0.00 H new ATOM 0 HD21 ASN A 47 32.707 15.859 -3.527 1.00 0.00 H new ATOM 0 HD22 ASN A 47 32.701 14.349 -2.610 1.00 0.00 H new ATOM 722 N THR A 48 29.924 19.896 -1.939 1.00 0.00 N ATOM 723 CA THR A 48 29.762 21.331 -2.099 1.00 0.00 C ATOM 724 C THR A 48 28.325 21.755 -1.771 1.00 0.00 C ATOM 725 O THR A 48 28.015 22.953 -1.675 1.00 0.00 O ATOM 726 CB THR A 48 30.212 21.800 -3.529 1.00 0.00 C ATOM 727 OG1 THR A 48 29.925 23.190 -3.777 1.00 0.00 O ATOM 728 CG2 THR A 48 29.610 20.937 -4.608 1.00 0.00 C ATOM 0 H THR A 48 29.557 19.337 -2.709 1.00 0.00 H new ATOM 0 HA THR A 48 30.417 21.832 -1.386 1.00 0.00 H new ATOM 0 HB THR A 48 31.296 21.685 -3.556 1.00 0.00 H new ATOM 0 HG1 THR A 48 29.247 23.502 -3.142 1.00 0.00 H new ATOM 0 HG21 THR A 48 29.943 21.290 -5.584 1.00 0.00 H new ATOM 0 HG22 THR A 48 29.929 19.904 -4.468 1.00 0.00 H new ATOM 0 HG23 THR A 48 28.523 20.992 -4.553 1.00 0.00 H new ATOM 736 N GLY A 49 27.462 20.763 -1.600 1.00 0.00 N ATOM 737 CA GLY A 49 26.077 20.991 -1.229 1.00 0.00 C ATOM 738 C GLY A 49 25.299 21.833 -2.219 1.00 0.00 C ATOM 739 O GLY A 49 24.403 22.578 -1.826 1.00 0.00 O ATOM 0 H GLY A 49 27.705 19.779 -1.715 1.00 0.00 H new ATOM 0 HA2 GLY A 49 25.579 20.028 -1.118 1.00 0.00 H new ATOM 0 HA3 GLY A 49 26.049 21.478 -0.254 1.00 0.00 H new ATOM 743 N GLU A 50 25.633 21.732 -3.484 1.00 0.00 N ATOM 744 CA GLU A 50 24.955 22.507 -4.497 1.00 0.00 C ATOM 745 C GLU A 50 23.917 21.645 -5.205 1.00 0.00 C ATOM 746 O GLU A 50 24.002 20.412 -5.149 1.00 0.00 O ATOM 747 CB GLU A 50 25.979 23.195 -5.441 1.00 0.00 C ATOM 748 CG GLU A 50 26.880 22.284 -6.271 1.00 0.00 C ATOM 749 CD GLU A 50 26.252 21.730 -7.522 1.00 0.00 C ATOM 750 OE1 GLU A 50 25.899 22.528 -8.417 1.00 0.00 O ATOM 751 OE2 GLU A 50 26.208 20.509 -7.681 1.00 0.00 O1- ATOM 0 H GLU A 50 26.370 21.121 -3.837 1.00 0.00 H new ATOM 0 HA GLU A 50 24.400 23.325 -4.037 1.00 0.00 H new ATOM 0 HB2 GLU A 50 25.428 23.840 -6.125 1.00 0.00 H new ATOM 0 HB3 GLU A 50 26.616 23.841 -4.836 1.00 0.00 H new ATOM 0 HG2 GLU A 50 27.775 22.840 -6.549 1.00 0.00 H new ATOM 0 HG3 GLU A 50 27.203 21.451 -5.646 1.00 0.00 H new ATOM 758 N SER A 51 22.940 22.268 -5.811 1.00 0.00 N ATOM 759 CA SER A 51 21.853 21.558 -6.445 1.00 0.00 C ATOM 760 C SER A 51 22.290 20.875 -7.745 1.00 0.00 C ATOM 761 O SER A 51 22.943 21.471 -8.585 1.00 0.00 O ATOM 762 CB SER A 51 20.699 22.524 -6.710 1.00 0.00 C ATOM 763 OG SER A 51 20.297 23.176 -5.506 1.00 0.00 O ATOM 0 H SER A 51 22.873 23.283 -5.881 1.00 0.00 H new ATOM 0 HA SER A 51 21.525 20.770 -5.767 1.00 0.00 H new ATOM 0 HB2 SER A 51 21.003 23.267 -7.447 1.00 0.00 H new ATOM 0 HB3 SER A 51 19.854 21.981 -7.134 1.00 0.00 H new ATOM 0 HG SER A 51 19.559 23.791 -5.698 1.00 0.00 H new ATOM 769 N GLN A 52 21.900 19.625 -7.888 1.00 0.00 N ATOM 770 CA GLN A 52 22.190 18.826 -9.085 1.00 0.00 C ATOM 771 C GLN A 52 21.165 19.156 -10.175 1.00 0.00 C ATOM 772 O GLN A 52 21.366 18.859 -11.349 1.00 0.00 O ATOM 773 CB GLN A 52 22.103 17.324 -8.752 1.00 0.00 C ATOM 774 CG GLN A 52 23.074 16.837 -7.672 1.00 0.00 C ATOM 775 CD GLN A 52 24.517 16.713 -8.133 1.00 0.00 C ATOM 776 OE1 GLN A 52 24.977 17.413 -9.023 1.00 0.00 O ATOM 777 NE2 GLN A 52 25.236 15.814 -7.523 1.00 0.00 N ATOM 0 H GLN A 52 21.368 19.121 -7.178 1.00 0.00 H new ATOM 0 HA GLN A 52 23.196 19.060 -9.434 1.00 0.00 H new ATOM 0 HB2 GLN A 52 21.086 17.098 -8.432 1.00 0.00 H new ATOM 0 HB3 GLN A 52 22.284 16.755 -9.664 1.00 0.00 H new ATOM 0 HG2 GLN A 52 23.033 17.525 -6.827 1.00 0.00 H new ATOM 0 HG3 GLN A 52 22.737 15.866 -7.309 1.00 0.00 H new ATOM 0 HE21 GLN A 52 24.822 15.246 -6.784 1.00 0.00 H new ATOM 0 HE22 GLN A 52 26.213 15.679 -7.784 1.00 0.00 H new ATOM 786 N GLY A 53 20.066 19.782 -9.766 1.00 0.00 N ATOM 787 CA GLY A 53 19.009 20.118 -10.696 1.00 0.00 C ATOM 788 C GLY A 53 17.938 19.040 -10.785 1.00 0.00 C ATOM 789 O GLY A 53 17.164 18.999 -11.746 1.00 0.00 O ATOM 0 H GLY A 53 19.890 20.063 -8.801 1.00 0.00 H new ATOM 0 HA2 GLY A 53 18.548 21.058 -10.391 1.00 0.00 H new ATOM 0 HA3 GLY A 53 19.439 20.280 -11.685 1.00 0.00 H new ATOM 793 N PHE A 54 17.893 18.173 -9.793 1.00 0.00 N ATOM 794 CA PHE A 54 16.904 17.100 -9.733 1.00 0.00 C ATOM 795 C PHE A 54 16.345 17.048 -8.324 1.00 0.00 C ATOM 796 O PHE A 54 16.998 17.522 -7.396 1.00 0.00 O ATOM 797 CB PHE A 54 17.533 15.731 -10.090 1.00 0.00 C ATOM 798 CG PHE A 54 18.161 15.669 -11.461 1.00 0.00 C ATOM 799 CD1 PHE A 54 17.389 15.403 -12.579 1.00 0.00 C ATOM 800 CD2 PHE A 54 19.522 15.882 -11.628 1.00 0.00 C ATOM 801 CE1 PHE A 54 17.957 15.351 -13.835 1.00 0.00 C ATOM 802 CE2 PHE A 54 20.095 15.832 -12.883 1.00 0.00 C ATOM 803 CZ PHE A 54 19.311 15.566 -13.989 1.00 0.00 C ATOM 0 H PHE A 54 18.538 18.187 -9.003 1.00 0.00 H new ATOM 0 HA PHE A 54 16.116 17.303 -10.458 1.00 0.00 H new ATOM 0 HB2 PHE A 54 18.291 15.489 -9.346 1.00 0.00 H new ATOM 0 HB3 PHE A 54 16.763 14.963 -10.022 1.00 0.00 H new ATOM 0 HD1 PHE A 54 16.328 15.234 -12.466 1.00 0.00 H new ATOM 0 HD2 PHE A 54 20.140 16.089 -10.767 1.00 0.00 H new ATOM 0 HE1 PHE A 54 17.342 15.142 -14.698 1.00 0.00 H new ATOM 0 HE2 PHE A 54 21.155 16.001 -13.000 1.00 0.00 H new ATOM 0 HZ PHE A 54 19.757 15.526 -14.972 1.00 0.00 H new ATOM 813 N ALA A 55 15.163 16.502 -8.160 1.00 0.00 N ATOM 814 CA ALA A 55 14.528 16.382 -6.861 1.00 0.00 C ATOM 815 C ALA A 55 13.499 15.260 -6.884 1.00 0.00 C ATOM 816 O ALA A 55 13.172 14.730 -7.948 1.00 0.00 O ATOM 817 CB ALA A 55 13.854 17.696 -6.476 1.00 0.00 C ATOM 0 H ALA A 55 14.608 16.125 -8.928 1.00 0.00 H new ATOM 0 HA ALA A 55 15.293 16.149 -6.120 1.00 0.00 H new ATOM 0 HB1 ALA A 55 13.382 17.590 -5.499 1.00 0.00 H new ATOM 0 HB2 ALA A 55 14.600 18.489 -6.434 1.00 0.00 H new ATOM 0 HB3 ALA A 55 13.097 17.948 -7.219 1.00 0.00 H new ATOM 823 N TYR A 56 13.022 14.885 -5.726 1.00 0.00 N ATOM 824 CA TYR A 56 11.975 13.890 -5.587 1.00 0.00 C ATOM 825 C TYR A 56 11.005 14.420 -4.532 1.00 0.00 C ATOM 826 O TYR A 56 11.440 15.100 -3.591 1.00 0.00 O ATOM 827 CB TYR A 56 12.541 12.532 -5.101 1.00 0.00 C ATOM 828 CG TYR A 56 13.738 11.981 -5.872 1.00 0.00 C ATOM 829 CD1 TYR A 56 13.584 11.315 -7.085 1.00 0.00 C ATOM 830 CD2 TYR A 56 15.028 12.118 -5.363 1.00 0.00 C ATOM 831 CE1 TYR A 56 14.684 10.807 -7.766 1.00 0.00 C ATOM 832 CE2 TYR A 56 16.124 11.612 -6.031 1.00 0.00 C ATOM 833 CZ TYR A 56 15.953 10.958 -7.227 1.00 0.00 C ATOM 834 OH TYR A 56 17.058 10.446 -7.886 1.00 0.00 O ATOM 0 H TYR A 56 13.350 15.263 -4.837 1.00 0.00 H new ATOM 0 HA TYR A 56 11.495 13.724 -6.551 1.00 0.00 H new ATOM 0 HB2 TYR A 56 12.827 12.636 -4.054 1.00 0.00 H new ATOM 0 HB3 TYR A 56 11.740 11.794 -5.141 1.00 0.00 H new ATOM 0 HD1 TYR A 56 12.596 11.191 -7.503 1.00 0.00 H new ATOM 0 HD2 TYR A 56 15.173 12.632 -4.424 1.00 0.00 H new ATOM 0 HE1 TYR A 56 14.551 10.298 -8.709 1.00 0.00 H new ATOM 0 HE2 TYR A 56 17.114 11.730 -5.615 1.00 0.00 H new ATOM 0 HH TYR A 56 17.867 10.642 -7.369 1.00 0.00 H new ATOM 844 N LEU A 57 9.727 14.153 -4.676 1.00 0.00 N ATOM 845 CA LEU A 57 8.751 14.624 -3.705 1.00 0.00 C ATOM 846 C LEU A 57 7.639 13.580 -3.537 1.00 0.00 C ATOM 847 O LEU A 57 7.463 12.722 -4.390 1.00 0.00 O ATOM 848 CB LEU A 57 8.213 16.018 -4.151 1.00 0.00 C ATOM 849 CG LEU A 57 7.341 16.819 -3.159 1.00 0.00 C ATOM 850 CD1 LEU A 57 7.473 18.295 -3.440 1.00 0.00 C ATOM 851 CD2 LEU A 57 5.883 16.446 -3.297 1.00 0.00 C ATOM 0 H LEU A 57 9.335 13.616 -5.449 1.00 0.00 H new ATOM 0 HA LEU A 57 9.214 14.752 -2.726 1.00 0.00 H new ATOM 0 HB2 LEU A 57 9.071 16.637 -4.414 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.633 15.874 -5.062 1.00 0.00 H new ATOM 0 HG LEU A 57 7.684 16.585 -2.151 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.856 18.856 -2.738 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.515 18.595 -3.328 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.144 18.502 -4.458 1.00 0.00 H new ATOM 0 HD21 LEU A 57 5.291 17.024 -2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.547 16.662 -4.311 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.758 15.383 -3.092 1.00 0.00 H new ATOM 863 N LYS A 58 6.944 13.628 -2.419 1.00 0.00 N ATOM 864 CA LYS A 58 5.849 12.725 -2.123 1.00 0.00 C ATOM 865 C LYS A 58 4.785 13.490 -1.355 1.00 0.00 C ATOM 866 O LYS A 58 5.107 14.212 -0.389 1.00 0.00 O ATOM 867 CB LYS A 58 6.345 11.635 -1.202 1.00 0.00 C ATOM 868 CG LYS A 58 5.436 10.433 -1.036 1.00 0.00 C ATOM 869 CD LYS A 58 5.940 9.565 0.103 1.00 0.00 C ATOM 870 CE LYS A 58 5.403 10.014 1.454 1.00 0.00 C ATOM 871 NZ LYS A 58 6.081 9.312 2.567 1.00 0.00 N1+ ATOM 0 H LYS A 58 7.126 14.306 -1.679 1.00 0.00 H new ATOM 0 HA LYS A 58 5.458 12.312 -3.053 1.00 0.00 H new ATOM 0 HB2 LYS A 58 7.309 11.287 -1.572 1.00 0.00 H new ATOM 0 HB3 LYS A 58 6.519 12.071 -0.218 1.00 0.00 H new ATOM 0 HG2 LYS A 58 4.417 10.761 -0.833 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.407 9.856 -1.960 1.00 0.00 H new ATOM 0 HD2 LYS A 58 5.648 8.530 -0.076 1.00 0.00 H new ATOM 0 HD3 LYS A 58 7.030 9.590 0.121 1.00 0.00 H new ATOM 0 HE2 LYS A 58 5.541 11.090 1.563 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.331 9.824 1.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 5.582 9.511 3.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.074 8.288 2.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.064 9.644 2.639 1.00 0.00 H new ATOM 885 N TYR A 59 3.559 13.382 -1.771 1.00 0.00 N ATOM 886 CA TYR A 59 2.473 13.938 -1.003 1.00 0.00 C ATOM 887 C TYR A 59 1.821 12.800 -0.202 1.00 0.00 C ATOM 888 O TYR A 59 2.098 11.633 -0.456 1.00 0.00 O ATOM 889 CB TYR A 59 1.450 14.665 -1.911 1.00 0.00 C ATOM 890 CG TYR A 59 0.407 15.467 -1.144 1.00 0.00 C ATOM 891 CD1 TYR A 59 0.703 16.718 -0.660 1.00 0.00 C ATOM 892 CD2 TYR A 59 -0.863 14.956 -0.890 1.00 0.00 C ATOM 893 CE1 TYR A 59 -0.220 17.436 0.058 1.00 0.00 C ATOM 894 CE2 TYR A 59 -1.798 15.675 -0.175 1.00 0.00 C ATOM 895 CZ TYR A 59 -1.470 16.915 0.300 1.00 0.00 C ATOM 896 OH TYR A 59 -2.391 17.640 1.035 1.00 0.00 O ATOM 0 H TYR A 59 3.281 12.916 -2.635 1.00 0.00 H new ATOM 0 HA TYR A 59 2.854 14.693 -0.316 1.00 0.00 H new ATOM 0 HB2 TYR A 59 1.987 15.334 -2.583 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.942 13.928 -2.533 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.678 17.143 -0.848 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -1.122 13.975 -1.261 1.00 0.00 H new ATOM 0 HE1 TYR A 59 0.036 18.415 0.435 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -2.779 15.263 0.008 1.00 0.00 H new ATOM 0 HH TYR A 59 -3.223 17.129 1.112 1.00 0.00 H new ATOM 906 N GLU A 60 1.013 13.163 0.779 1.00 0.00 N ATOM 907 CA GLU A 60 0.296 12.236 1.657 1.00 0.00 C ATOM 908 C GLU A 60 -0.652 11.374 0.797 1.00 0.00 C ATOM 909 O GLU A 60 -0.492 10.152 0.688 1.00 0.00 O ATOM 910 CB GLU A 60 -0.482 13.106 2.680 1.00 0.00 C ATOM 911 CG GLU A 60 -0.898 12.444 3.993 1.00 0.00 C ATOM 912 CD GLU A 60 -1.930 11.368 3.851 1.00 0.00 C ATOM 913 OE1 GLU A 60 -3.080 11.685 3.525 1.00 0.00 O ATOM 914 OE2 GLU A 60 -1.612 10.198 4.121 1.00 0.00 O1- ATOM 0 H GLU A 60 0.828 14.142 0.999 1.00 0.00 H new ATOM 0 HA GLU A 60 0.964 11.558 2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 60 0.132 13.974 2.920 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -1.382 13.478 2.190 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.013 12.020 4.467 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -1.282 13.211 4.665 1.00 0.00 H new ATOM 921 N ASP A 61 -1.589 12.032 0.155 1.00 0.00 N ATOM 922 CA ASP A 61 -2.529 11.378 -0.734 1.00 0.00 C ATOM 923 C ASP A 61 -1.895 11.301 -2.117 1.00 0.00 C ATOM 924 O ASP A 61 -1.424 12.322 -2.653 1.00 0.00 O ATOM 925 CB ASP A 61 -3.835 12.172 -0.814 1.00 0.00 C ATOM 926 CG ASP A 61 -4.949 11.410 -1.504 1.00 0.00 C ATOM 927 OD1 ASP A 61 -4.865 11.136 -2.710 1.00 0.00 O ATOM 928 OD2 ASP A 61 -5.946 11.080 -0.839 1.00 0.00 O1- ATOM 0 H ASP A 61 -1.724 13.040 0.233 1.00 0.00 H new ATOM 0 HA ASP A 61 -2.758 10.381 -0.358 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -4.154 12.439 0.194 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -3.655 13.105 -1.348 1.00 0.00 H new ATOM 933 N GLN A 62 -1.923 10.132 -2.707 1.00 0.00 N ATOM 934 CA GLN A 62 -1.255 9.879 -3.978 1.00 0.00 C ATOM 935 C GLN A 62 -1.981 10.566 -5.156 1.00 0.00 C ATOM 936 O GLN A 62 -1.437 10.713 -6.242 1.00 0.00 O ATOM 937 CB GLN A 62 -1.125 8.367 -4.192 1.00 0.00 C ATOM 938 CG GLN A 62 -0.385 7.952 -5.452 1.00 0.00 C ATOM 939 CD GLN A 62 -0.297 6.455 -5.588 1.00 0.00 C ATOM 940 OE1 GLN A 62 -1.161 5.722 -5.118 1.00 0.00 O ATOM 941 NE2 GLN A 62 0.724 5.984 -6.230 1.00 0.00 N ATOM 0 H GLN A 62 -2.409 9.320 -2.325 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.257 10.315 -3.942 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -0.613 7.937 -3.331 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.124 7.933 -4.217 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.893 8.366 -6.323 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.620 8.374 -5.438 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.426 6.620 -6.609 1.00 0.00 H new ATOM 0 HE22 GLN A 62 0.827 4.977 -6.357 1.00 0.00 H new ATOM 950 N ARG A 63 -3.177 11.035 -4.923 1.00 0.00 N ATOM 951 CA ARG A 63 -3.930 11.708 -5.962 1.00 0.00 C ATOM 952 C ARG A 63 -3.448 13.150 -6.162 1.00 0.00 C ATOM 953 O ARG A 63 -3.662 13.750 -7.216 1.00 0.00 O ATOM 954 CB ARG A 63 -5.416 11.628 -5.665 1.00 0.00 C ATOM 955 CG ARG A 63 -5.969 10.223 -5.809 1.00 0.00 C ATOM 956 CD ARG A 63 -7.361 10.103 -5.236 1.00 0.00 C ATOM 957 NE ARG A 63 -7.365 10.265 -3.770 1.00 0.00 N ATOM 958 CZ ARG A 63 -8.327 9.824 -2.945 1.00 0.00 C ATOM 959 NH1 ARG A 63 -9.429 9.257 -3.430 1.00 0.00 N1+ ATOM 960 NH2 ARG A 63 -8.189 9.964 -1.642 1.00 0.00 N ATOM 0 H ARG A 63 -3.656 10.967 -4.025 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.754 11.196 -6.908 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.599 11.983 -4.651 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.953 12.296 -6.339 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.985 9.946 -6.863 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.307 9.519 -5.305 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.006 10.857 -5.687 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.778 9.130 -5.495 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.573 10.751 -3.350 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.548 9.154 -4.438 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -10.154 8.925 -2.794 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.352 10.407 -1.262 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.919 9.630 -1.013 1.00 0.00 H new ATOM 974 N SER A 64 -2.717 13.669 -5.189 1.00 0.00 N ATOM 975 CA SER A 64 -2.180 15.015 -5.300 1.00 0.00 C ATOM 976 C SER A 64 -0.889 14.902 -6.069 1.00 0.00 C ATOM 977 O SER A 64 -0.519 15.771 -6.855 1.00 0.00 O ATOM 978 CB SER A 64 -1.950 15.630 -3.920 1.00 0.00 C ATOM 979 OG SER A 64 -1.431 16.944 -4.012 1.00 0.00 O ATOM 0 H SER A 64 -2.484 13.185 -4.322 1.00 0.00 H new ATOM 0 HA SER A 64 -2.880 15.672 -5.815 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.890 15.648 -3.368 1.00 0.00 H new ATOM 0 HB3 SER A 64 -1.260 15.005 -3.354 1.00 0.00 H new ATOM 0 HG SER A 64 -1.679 17.451 -3.211 1.00 0.00 H new ATOM 985 N THR A 65 -0.248 13.776 -5.857 1.00 0.00 N ATOM 986 CA THR A 65 0.904 13.354 -6.576 1.00 0.00 C ATOM 987 C THR A 65 0.586 13.344 -8.105 1.00 0.00 C ATOM 988 O THR A 65 1.383 13.806 -8.926 1.00 0.00 O ATOM 989 CB THR A 65 1.248 11.940 -6.046 1.00 0.00 C ATOM 990 OG1 THR A 65 1.689 12.002 -4.676 1.00 0.00 O ATOM 991 CG2 THR A 65 2.243 11.223 -6.882 1.00 0.00 C ATOM 0 H THR A 65 -0.539 13.108 -5.143 1.00 0.00 H new ATOM 0 HA THR A 65 1.754 14.022 -6.435 1.00 0.00 H new ATOM 0 HB THR A 65 0.326 11.362 -6.102 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.402 11.345 -4.532 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.438 10.240 -6.453 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.853 11.107 -7.893 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.171 11.795 -6.914 1.00 0.00 H new ATOM 999 N ILE A 66 -0.620 12.885 -8.440 1.00 0.00 N ATOM 1000 CA ILE A 66 -1.109 12.846 -9.816 1.00 0.00 C ATOM 1001 C ILE A 66 -1.363 14.279 -10.348 1.00 0.00 C ATOM 1002 O ILE A 66 -0.990 14.625 -11.497 1.00 0.00 O ATOM 1003 CB ILE A 66 -2.395 11.981 -9.902 1.00 0.00 C ATOM 1004 CG1 ILE A 66 -2.060 10.545 -9.464 1.00 0.00 C ATOM 1005 CG2 ILE A 66 -2.985 12.001 -11.316 1.00 0.00 C ATOM 1006 CD1 ILE A 66 -3.242 9.613 -9.373 1.00 0.00 C ATOM 0 H ILE A 66 -1.289 12.527 -7.758 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.346 12.389 -10.446 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.151 12.396 -9.236 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.340 10.126 -10.166 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.571 10.583 -8.491 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.885 11.386 -11.344 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.237 13.025 -11.591 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.254 11.606 -12.021 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.904 8.626 -9.057 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.956 10.001 -8.647 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.721 9.537 -10.349 1.00 0.00 H new ATOM 1018 N LEU A 67 -1.972 15.114 -9.516 1.00 0.00 N ATOM 1019 CA LEU A 67 -2.178 16.512 -9.877 1.00 0.00 C ATOM 1020 C LEU A 67 -0.848 17.178 -10.172 1.00 0.00 C ATOM 1021 O LEU A 67 -0.642 17.711 -11.249 1.00 0.00 O ATOM 1022 CB LEU A 67 -2.895 17.287 -8.764 1.00 0.00 C ATOM 1023 CG LEU A 67 -4.353 16.927 -8.500 1.00 0.00 C ATOM 1024 CD1 LEU A 67 -4.879 17.731 -7.325 1.00 0.00 C ATOM 1025 CD2 LEU A 67 -5.197 17.198 -9.739 1.00 0.00 C ATOM 0 H LEU A 67 -2.329 14.853 -8.597 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.808 16.528 -10.767 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.338 17.144 -7.838 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.846 18.349 -9.005 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.416 15.865 -8.261 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.921 17.469 -7.142 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.287 17.508 -6.437 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.807 18.795 -7.551 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.236 16.936 -9.536 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.133 18.255 -9.999 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.827 16.597 -10.570 1.00 0.00 H new ATOM 1037 N ALA A 68 0.063 17.074 -9.236 1.00 0.00 N ATOM 1038 CA ALA A 68 1.362 17.700 -9.338 1.00 0.00 C ATOM 1039 C ALA A 68 2.155 17.212 -10.548 1.00 0.00 C ATOM 1040 O ALA A 68 2.815 18.015 -11.215 1.00 0.00 O ATOM 1041 CB ALA A 68 2.144 17.498 -8.059 1.00 0.00 C ATOM 0 H ALA A 68 -0.076 16.548 -8.373 1.00 0.00 H new ATOM 0 HA ALA A 68 1.196 18.767 -9.487 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.120 17.975 -8.150 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.600 17.942 -7.226 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.277 16.431 -7.878 1.00 0.00 H new ATOM 1047 N VAL A 69 2.064 15.917 -10.862 1.00 0.00 N ATOM 1048 CA VAL A 69 2.811 15.380 -11.984 1.00 0.00 C ATOM 1049 C VAL A 69 2.380 15.998 -13.314 1.00 0.00 C ATOM 1050 O VAL A 69 3.233 16.455 -14.080 1.00 0.00 O ATOM 1051 CB VAL A 69 2.857 13.800 -12.055 1.00 0.00 C ATOM 1052 CG1 VAL A 69 1.506 13.181 -12.298 1.00 0.00 C ATOM 1053 CG2 VAL A 69 3.831 13.326 -13.114 1.00 0.00 C ATOM 0 H VAL A 69 1.490 15.238 -10.361 1.00 0.00 H new ATOM 0 HA VAL A 69 3.841 15.681 -11.794 1.00 0.00 H new ATOM 0 HB VAL A 69 3.198 13.470 -11.074 1.00 0.00 H new ATOM 0 HG11 VAL A 69 1.604 12.096 -12.336 1.00 0.00 H new ATOM 0 HG12 VAL A 69 0.829 13.456 -11.489 1.00 0.00 H new ATOM 0 HG13 VAL A 69 1.105 13.543 -13.245 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.840 12.236 -13.138 1.00 0.00 H new ATOM 0 HG22 VAL A 69 3.524 13.708 -14.088 1.00 0.00 H new ATOM 0 HG23 VAL A 69 4.830 13.692 -12.879 1.00 0.00 H new ATOM 1063 N ASP A 70 1.078 16.097 -13.588 1.00 0.00 N ATOM 1064 CA ASP A 70 0.710 16.631 -14.902 1.00 0.00 C ATOM 1065 C ASP A 70 0.350 18.124 -14.891 1.00 0.00 C ATOM 1066 O ASP A 70 0.225 18.754 -15.936 1.00 0.00 O ATOM 1067 CB ASP A 70 -0.331 15.775 -15.647 1.00 0.00 C ATOM 1068 CG ASP A 70 -0.377 16.112 -17.143 1.00 0.00 C ATOM 1069 OD1 ASP A 70 0.710 16.140 -17.807 1.00 0.00 O1- ATOM 1070 OD2 ASP A 70 -1.472 16.374 -17.686 1.00 0.00 O ATOM 0 H ASP A 70 0.310 15.836 -12.970 1.00 0.00 H new ATOM 0 HA ASP A 70 1.627 16.559 -15.486 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.093 14.719 -15.519 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.316 15.935 -15.207 1.00 0.00 H new ATOM 1075 N ASN A 71 0.241 18.707 -13.717 1.00 0.00 N ATOM 1076 CA ASN A 71 -0.103 20.145 -13.610 1.00 0.00 C ATOM 1077 C ASN A 71 1.118 21.017 -13.458 1.00 0.00 C ATOM 1078 O ASN A 71 1.081 22.212 -13.738 1.00 0.00 O ATOM 1079 CB ASN A 71 -1.110 20.440 -12.469 1.00 0.00 C ATOM 1080 CG ASN A 71 -2.565 20.083 -12.797 1.00 0.00 C ATOM 1081 OD1 ASN A 71 -2.776 19.139 -13.687 1.00 0.00 O flip ATOM 1082 ND2 ASN A 71 -3.496 20.676 -12.254 1.00 0.00 N flip ATOM 0 H ASN A 71 0.379 18.233 -12.824 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.587 20.394 -14.554 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -0.805 19.887 -11.580 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.057 21.500 -12.219 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -3.305 21.405 -11.566 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -4.459 20.439 -12.491 1.00 0.00 H new ATOM 1089 N LEU A 72 2.225 20.443 -13.044 1.00 0.00 N ATOM 1090 CA LEU A 72 3.407 21.248 -12.865 1.00 0.00 C ATOM 1091 C LEU A 72 4.436 20.978 -13.919 1.00 0.00 C ATOM 1092 O LEU A 72 5.377 21.747 -14.075 1.00 0.00 O ATOM 1093 CB LEU A 72 4.005 21.106 -11.460 1.00 0.00 C ATOM 1094 CG LEU A 72 3.181 21.681 -10.303 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.885 21.425 -8.984 1.00 0.00 C ATOM 1096 CD2 LEU A 72 2.952 23.178 -10.496 1.00 0.00 C ATOM 0 H LEU A 72 2.330 19.451 -12.831 1.00 0.00 H new ATOM 0 HA LEU A 72 3.087 22.284 -12.975 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.172 20.046 -11.266 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.982 21.589 -11.455 1.00 0.00 H new ATOM 0 HG LEU A 72 2.211 21.184 -10.289 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.291 21.838 -8.168 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.005 20.352 -8.838 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.865 21.902 -8.996 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.365 23.567 -9.664 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.913 23.691 -10.533 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.414 23.347 -11.429 1.00 0.00 H new ATOM 1108 N ASN A 73 4.279 19.898 -14.665 1.00 0.00 N ATOM 1109 CA ASN A 73 5.266 19.609 -15.686 1.00 0.00 C ATOM 1110 C ASN A 73 5.128 20.609 -16.802 1.00 0.00 C ATOM 1111 O ASN A 73 4.016 20.887 -17.279 1.00 0.00 O ATOM 1112 CB ASN A 73 5.235 18.156 -16.224 1.00 0.00 C ATOM 1113 CG ASN A 73 4.095 17.842 -17.182 1.00 0.00 C ATOM 1114 OD1 ASN A 73 4.186 18.082 -18.385 1.00 0.00 O ATOM 1115 ND2 ASN A 73 3.087 17.221 -16.686 1.00 0.00 N ATOM 0 H ASN A 73 3.510 19.232 -14.589 1.00 0.00 H new ATOM 0 HA ASN A 73 6.243 19.700 -15.212 1.00 0.00 H new ATOM 0 HB2 ASN A 73 6.179 17.953 -16.730 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.174 17.473 -15.376 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.330 16.910 -17.294 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.043 17.038 -15.683 1.00 0.00 H new ATOM 1122 N GLY A 74 6.218 21.212 -17.151 1.00 0.00 N ATOM 1123 CA GLY A 74 6.188 22.200 -18.177 1.00 0.00 C ATOM 1124 C GLY A 74 6.054 23.593 -17.609 1.00 0.00 C ATOM 1125 O GLY A 74 6.008 24.567 -18.362 1.00 0.00 O ATOM 0 H GLY A 74 7.136 21.038 -16.742 1.00 0.00 H new ATOM 0 HA2 GLY A 74 7.100 22.136 -18.771 1.00 0.00 H new ATOM 0 HA3 GLY A 74 5.354 22.000 -18.850 1.00 0.00 H new ATOM 1129 N PHE A 75 5.983 23.702 -16.280 1.00 0.00 N ATOM 1130 CA PHE A 75 5.898 25.001 -15.650 1.00 0.00 C ATOM 1131 C PHE A 75 7.270 25.640 -15.739 1.00 0.00 C ATOM 1132 O PHE A 75 8.277 25.031 -15.347 1.00 0.00 O ATOM 1133 CB PHE A 75 5.411 24.889 -14.193 1.00 0.00 C ATOM 1134 CG PHE A 75 5.114 26.213 -13.533 1.00 0.00 C ATOM 1135 CD1 PHE A 75 3.940 26.895 -13.817 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.998 26.769 -12.625 1.00 0.00 C ATOM 1137 CE1 PHE A 75 3.659 28.106 -13.211 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.724 27.979 -12.014 1.00 0.00 C ATOM 1139 CZ PHE A 75 4.554 28.648 -12.308 1.00 0.00 C ATOM 0 H PHE A 75 5.983 22.912 -15.635 1.00 0.00 H new ATOM 0 HA PHE A 75 5.164 25.624 -16.162 1.00 0.00 H new ATOM 0 HB2 PHE A 75 4.511 24.275 -14.170 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.168 24.367 -13.608 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.236 26.475 -14.520 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.916 26.250 -12.390 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.742 28.627 -13.443 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.425 28.399 -11.308 1.00 0.00 H new ATOM 0 HZ PHE A 75 4.338 29.594 -11.833 1.00 0.00 H new ATOM 1149 N LYS A 76 7.310 26.825 -16.279 1.00 0.00 N ATOM 1150 CA LYS A 76 8.545 27.490 -16.579 1.00 0.00 C ATOM 1151 C LYS A 76 9.094 28.186 -15.337 1.00 0.00 C ATOM 1152 O LYS A 76 8.444 29.069 -14.771 1.00 0.00 O ATOM 1153 CB LYS A 76 8.303 28.521 -17.682 1.00 0.00 C ATOM 1154 CG LYS A 76 9.566 29.068 -18.331 1.00 0.00 C ATOM 1155 CD LYS A 76 10.229 28.050 -19.262 1.00 0.00 C ATOM 1156 CE LYS A 76 9.351 27.737 -20.477 1.00 0.00 C ATOM 1157 NZ LYS A 76 10.020 26.830 -21.428 1.00 0.00 N1+ ATOM 0 H LYS A 76 6.478 27.361 -16.525 1.00 0.00 H new ATOM 0 HA LYS A 76 9.275 26.752 -16.913 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.682 28.067 -18.454 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.736 29.353 -17.264 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.321 29.968 -18.896 1.00 0.00 H new ATOM 0 HG3 LYS A 76 10.273 29.361 -17.555 1.00 0.00 H new ATOM 0 HD2 LYS A 76 11.191 28.437 -19.598 1.00 0.00 H new ATOM 0 HD3 LYS A 76 10.430 27.131 -18.712 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.417 27.285 -20.142 1.00 0.00 H new ATOM 0 HE3 LYS A 76 9.091 28.666 -20.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.389 26.646 -22.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.898 27.271 -21.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.245 25.933 -20.952 1.00 0.00 H new ATOM 1171 N ILE A 77 10.266 27.776 -14.916 1.00 0.00 N ATOM 1172 CA ILE A 77 10.942 28.375 -13.797 1.00 0.00 C ATOM 1173 C ILE A 77 12.389 28.641 -14.189 1.00 0.00 C ATOM 1174 O ILE A 77 13.202 27.722 -14.291 1.00 0.00 O ATOM 1175 CB ILE A 77 10.929 27.488 -12.520 1.00 0.00 C ATOM 1176 CG1 ILE A 77 9.500 27.053 -12.169 1.00 0.00 C ATOM 1177 CG2 ILE A 77 11.544 28.276 -11.354 1.00 0.00 C ATOM 1178 CD1 ILE A 77 9.415 26.094 -11.002 1.00 0.00 C ATOM 0 H ILE A 77 10.781 27.008 -15.347 1.00 0.00 H new ATOM 0 HA ILE A 77 10.408 29.294 -13.555 1.00 0.00 H new ATOM 0 HB ILE A 77 11.516 26.589 -12.707 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.908 27.939 -11.941 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.049 26.585 -13.044 1.00 0.00 H new ATOM 0 HG21 ILE A 77 11.538 27.660 -10.455 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.570 28.549 -11.600 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.961 29.180 -11.178 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.372 25.836 -10.819 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.978 25.189 -11.233 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.834 26.565 -10.113 1.00 0.00 H new ATOM 1190 N GLY A 78 12.676 29.881 -14.454 1.00 0.00 N ATOM 1191 CA GLY A 78 14.019 30.307 -14.782 1.00 0.00 C ATOM 1192 C GLY A 78 14.463 29.844 -16.138 1.00 0.00 C ATOM 1193 O GLY A 78 15.526 29.243 -16.280 1.00 0.00 O ATOM 0 H GLY A 78 11.988 30.634 -14.451 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.070 31.395 -14.740 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.710 29.926 -14.029 1.00 0.00 H new ATOM 1197 N GLY A 79 13.630 30.088 -17.127 1.00 0.00 N ATOM 1198 CA GLY A 79 13.964 29.750 -18.497 1.00 0.00 C ATOM 1199 C GLY A 79 13.744 28.289 -18.857 1.00 0.00 C ATOM 1200 O GLY A 79 13.611 27.952 -20.033 1.00 0.00 O ATOM 0 H GLY A 79 12.714 30.520 -17.009 1.00 0.00 H new ATOM 0 HA2 GLY A 79 13.368 30.370 -19.167 1.00 0.00 H new ATOM 0 HA3 GLY A 79 15.009 30.002 -18.676 1.00 0.00 H new ATOM 1204 N ARG A 80 13.690 27.427 -17.876 1.00 0.00 N ATOM 1205 CA ARG A 80 13.471 26.025 -18.130 1.00 0.00 C ATOM 1206 C ARG A 80 12.238 25.556 -17.424 1.00 0.00 C ATOM 1207 O ARG A 80 11.764 26.204 -16.502 1.00 0.00 O ATOM 1208 CB ARG A 80 14.679 25.162 -17.734 1.00 0.00 C ATOM 1209 CG ARG A 80 15.163 25.349 -16.304 1.00 0.00 C ATOM 1210 CD ARG A 80 16.203 24.300 -15.929 1.00 0.00 C ATOM 1211 NE ARG A 80 17.311 24.220 -16.890 1.00 0.00 N ATOM 1212 CZ ARG A 80 18.560 23.828 -16.614 1.00 0.00 C ATOM 1213 NH1 ARG A 80 18.905 23.473 -15.389 1.00 0.00 N1+ ATOM 1214 NH2 ARG A 80 19.459 23.773 -17.579 1.00 0.00 N ATOM 0 H ARG A 80 13.795 27.671 -16.891 1.00 0.00 H new ATOM 0 HA ARG A 80 13.336 25.909 -19.205 1.00 0.00 H new ATOM 0 HB2 ARG A 80 14.420 24.113 -17.880 1.00 0.00 H new ATOM 0 HB3 ARG A 80 15.503 25.384 -18.412 1.00 0.00 H new ATOM 0 HG2 ARG A 80 15.591 26.345 -16.190 1.00 0.00 H new ATOM 0 HG3 ARG A 80 14.317 25.285 -15.620 1.00 0.00 H new ATOM 0 HD2 ARG A 80 16.602 24.529 -14.941 1.00 0.00 H new ATOM 0 HD3 ARG A 80 15.719 23.326 -15.859 1.00 0.00 H new ATOM 0 HE ARG A 80 17.110 24.487 -17.854 1.00 0.00 H new ATOM 0 HH11 ARG A 80 18.215 23.496 -14.638 1.00 0.00 H new ATOM 0 HH12 ARG A 80 19.861 23.176 -15.194 1.00 0.00 H new ATOM 0 HH21 ARG A 80 19.201 24.029 -18.532 1.00 0.00 H new ATOM 0 HH22 ARG A 80 20.412 23.475 -17.372 1.00 0.00 H new ATOM 1228 N ALA A 81 11.707 24.469 -17.865 1.00 0.00 N ATOM 1229 CA ALA A 81 10.537 23.910 -17.264 1.00 0.00 C ATOM 1230 C ALA A 81 10.910 22.645 -16.552 1.00 0.00 C ATOM 1231 O ALA A 81 11.779 21.910 -17.019 1.00 0.00 O ATOM 1232 CB ALA A 81 9.497 23.630 -18.315 1.00 0.00 C ATOM 0 H ALA A 81 12.070 23.937 -18.656 1.00 0.00 H new ATOM 0 HA ALA A 81 10.119 24.619 -16.549 1.00 0.00 H new ATOM 0 HB1 ALA A 81 8.610 23.204 -17.845 1.00 0.00 H new ATOM 0 HB2 ALA A 81 9.230 24.559 -18.819 1.00 0.00 H new ATOM 0 HB3 ALA A 81 9.896 22.924 -19.043 1.00 0.00 H new ATOM 1238 N LEU A 82 10.302 22.397 -15.433 1.00 0.00 N ATOM 1239 CA LEU A 82 10.600 21.197 -14.705 1.00 0.00 C ATOM 1240 C LEU A 82 9.729 20.008 -15.119 1.00 0.00 C ATOM 1241 O LEU A 82 8.562 20.162 -15.537 1.00 0.00 O ATOM 1242 CB LEU A 82 10.697 21.424 -13.172 1.00 0.00 C ATOM 1243 CG LEU A 82 9.637 22.317 -12.494 1.00 0.00 C ATOM 1244 CD1 LEU A 82 8.251 21.742 -12.617 1.00 0.00 C ATOM 1245 CD2 LEU A 82 9.987 22.523 -11.035 1.00 0.00 C ATOM 0 H LEU A 82 9.602 23.002 -15.004 1.00 0.00 H new ATOM 0 HA LEU A 82 11.608 20.906 -15.001 1.00 0.00 H new ATOM 0 HB2 LEU A 82 10.666 20.447 -12.689 1.00 0.00 H new ATOM 0 HB3 LEU A 82 11.677 21.853 -12.961 1.00 0.00 H new ATOM 0 HG LEU A 82 9.640 23.278 -13.009 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.538 22.404 -12.126 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.990 21.645 -13.671 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.221 20.760 -12.144 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.233 23.155 -10.566 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.019 21.558 -10.529 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.962 23.005 -10.959 1.00 0.00 H new ATOM 1257 N LYS A 83 10.319 18.849 -15.034 1.00 0.00 N ATOM 1258 CA LYS A 83 9.729 17.595 -15.443 1.00 0.00 C ATOM 1259 C LYS A 83 9.382 16.742 -14.232 1.00 0.00 C ATOM 1260 O LYS A 83 10.259 16.338 -13.497 1.00 0.00 O ATOM 1261 CB LYS A 83 10.742 16.861 -16.377 1.00 0.00 C ATOM 1262 CG LYS A 83 10.543 15.346 -16.567 1.00 0.00 C ATOM 1263 CD LYS A 83 9.182 14.982 -17.129 1.00 0.00 C ATOM 1264 CE LYS A 83 9.053 13.476 -17.285 1.00 0.00 C ATOM 1265 NZ LYS A 83 7.689 13.054 -17.689 1.00 0.00 N1+ ATOM 0 H LYS A 83 11.263 18.742 -14.663 1.00 0.00 H new ATOM 0 HA LYS A 83 8.799 17.778 -15.982 1.00 0.00 H new ATOM 0 HB2 LYS A 83 10.703 17.334 -17.358 1.00 0.00 H new ATOM 0 HB3 LYS A 83 11.746 17.025 -15.984 1.00 0.00 H new ATOM 0 HG2 LYS A 83 11.317 14.967 -17.235 1.00 0.00 H new ATOM 0 HG3 LYS A 83 10.677 14.846 -15.607 1.00 0.00 H new ATOM 0 HD2 LYS A 83 8.399 15.353 -16.468 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.040 15.467 -18.095 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.771 13.130 -18.029 1.00 0.00 H new ATOM 0 HE3 LYS A 83 9.313 12.994 -16.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.542 12.058 -17.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.985 13.647 -17.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.583 13.161 -18.718 1.00 0.00 H new ATOM 1279 N ILE A 84 8.112 16.497 -14.023 1.00 0.00 N ATOM 1280 CA ILE A 84 7.693 15.611 -12.955 1.00 0.00 C ATOM 1281 C ILE A 84 7.264 14.288 -13.590 1.00 0.00 C ATOM 1282 O ILE A 84 6.771 14.279 -14.740 1.00 0.00 O ATOM 1283 CB ILE A 84 6.510 16.169 -12.059 1.00 0.00 C ATOM 1284 CG1 ILE A 84 6.780 17.569 -11.509 1.00 0.00 C ATOM 1285 CG2 ILE A 84 6.237 15.252 -10.883 1.00 0.00 C ATOM 1286 CD1 ILE A 84 6.508 18.668 -12.477 1.00 0.00 C ATOM 0 H ILE A 84 7.351 16.894 -14.573 1.00 0.00 H new ATOM 0 HA ILE A 84 8.541 15.498 -12.280 1.00 0.00 H new ATOM 0 HB ILE A 84 5.646 16.216 -12.722 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.167 17.723 -10.621 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.821 17.628 -11.192 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.421 15.659 -10.286 1.00 0.00 H new ATOM 0 HG22 ILE A 84 5.960 14.263 -11.249 1.00 0.00 H new ATOM 0 HG23 ILE A 84 7.133 15.173 -10.267 1.00 0.00 H new ATOM 0 HD11 ILE A 84 6.725 19.628 -12.008 1.00 0.00 H new ATOM 0 HD12 ILE A 84 7.140 18.543 -13.356 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.460 18.639 -12.776 1.00 0.00 H new ATOM 1298 N ASP A 85 7.490 13.193 -12.897 1.00 0.00 N ATOM 1299 CA ASP A 85 7.093 11.871 -13.365 1.00 0.00 C ATOM 1300 C ASP A 85 6.901 11.002 -12.132 1.00 0.00 C ATOM 1301 O ASP A 85 7.271 11.423 -11.049 1.00 0.00 O ATOM 1302 CB ASP A 85 8.188 11.281 -14.245 1.00 0.00 C ATOM 1303 CG ASP A 85 7.653 10.307 -15.263 1.00 0.00 C ATOM 1304 OD1 ASP A 85 7.323 9.165 -14.909 1.00 0.00 O1- ATOM 1305 OD2 ASP A 85 7.554 10.689 -16.462 1.00 0.00 O ATOM 0 H ASP A 85 7.955 13.188 -11.989 1.00 0.00 H new ATOM 0 HA ASP A 85 6.177 11.926 -13.953 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.710 12.088 -14.759 1.00 0.00 H new ATOM 0 HB3 ASP A 85 8.922 10.777 -13.616 1.00 0.00 H new ATOM 1310 N HIS A 86 6.367 9.818 -12.271 1.00 0.00 N ATOM 1311 CA HIS A 86 6.149 8.960 -11.101 1.00 0.00 C ATOM 1312 C HIS A 86 7.370 8.109 -10.813 1.00 0.00 C ATOM 1313 O HIS A 86 7.990 7.577 -11.720 1.00 0.00 O ATOM 1314 CB HIS A 86 4.903 8.075 -11.233 1.00 0.00 C ATOM 1315 CG HIS A 86 3.592 8.751 -10.920 1.00 0.00 C ATOM 1316 ND1 HIS A 86 2.867 8.513 -9.765 1.00 0.00 N ATOM 1317 CD2 HIS A 86 2.848 9.626 -11.645 1.00 0.00 C ATOM 1318 CE1 HIS A 86 1.740 9.222 -9.830 1.00 0.00 C ATOM 1319 NE2 HIS A 86 1.677 9.918 -10.948 1.00 0.00 N ATOM 0 H HIS A 86 6.074 9.416 -13.161 1.00 0.00 H new ATOM 0 HA HIS A 86 5.977 9.631 -10.260 1.00 0.00 H new ATOM 0 HB2 HIS A 86 4.859 7.689 -12.251 1.00 0.00 H new ATOM 0 HB3 HIS A 86 5.016 7.216 -10.571 1.00 0.00 H new ATOM 0 HD1 HIS A 86 3.146 7.902 -8.998 1.00 0.00 H new ATOM 0 HD2 HIS A 86 3.121 10.031 -12.608 1.00 0.00 H new ATOM 0 HE1 HIS A 86 0.977 9.226 -9.066 1.00 0.00 H new ATOM 1327 N THR A 87 7.713 7.989 -9.560 1.00 0.00 N ATOM 1328 CA THR A 87 8.873 7.247 -9.148 1.00 0.00 C ATOM 1329 C THR A 87 8.624 6.678 -7.746 1.00 0.00 C ATOM 1330 O THR A 87 7.653 7.037 -7.091 1.00 0.00 O ATOM 1331 CB THR A 87 10.168 8.130 -9.175 1.00 0.00 C ATOM 1332 OG1 THR A 87 11.332 7.311 -9.032 1.00 0.00 O ATOM 1333 CG2 THR A 87 10.166 9.158 -8.051 1.00 0.00 C ATOM 0 H THR A 87 7.191 8.407 -8.790 1.00 0.00 H new ATOM 0 HA THR A 87 9.038 6.431 -9.851 1.00 0.00 H new ATOM 0 HB THR A 87 10.183 8.647 -10.134 1.00 0.00 H new ATOM 0 HG1 THR A 87 12.133 7.875 -9.052 1.00 0.00 H new ATOM 0 HG21 THR A 87 11.078 9.753 -8.100 1.00 0.00 H new ATOM 0 HG22 THR A 87 9.301 9.812 -8.158 1.00 0.00 H new ATOM 0 HG23 THR A 87 10.118 8.646 -7.090 1.00 0.00 H new ATOM 1341 N PHE A 88 9.392 5.729 -7.340 1.00 0.00 N ATOM 1342 CA PHE A 88 9.297 5.243 -6.011 1.00 0.00 C ATOM 1343 C PHE A 88 10.696 5.126 -5.518 1.00 0.00 C ATOM 1344 O PHE A 88 11.424 4.199 -5.859 1.00 0.00 O ATOM 1345 CB PHE A 88 8.541 3.922 -5.889 1.00 0.00 C ATOM 1346 CG PHE A 88 8.105 3.659 -4.472 1.00 0.00 C ATOM 1347 CD1 PHE A 88 6.896 4.155 -4.017 1.00 0.00 C ATOM 1348 CD2 PHE A 88 8.898 2.946 -3.594 1.00 0.00 C ATOM 1349 CE1 PHE A 88 6.484 3.947 -2.719 1.00 0.00 C ATOM 1350 CE2 PHE A 88 8.488 2.733 -2.292 1.00 0.00 C ATOM 1351 CZ PHE A 88 7.282 3.233 -1.855 1.00 0.00 C ATOM 0 H PHE A 88 10.099 5.271 -7.916 1.00 0.00 H new ATOM 0 HA PHE A 88 8.709 5.934 -5.407 1.00 0.00 H new ATOM 0 HB2 PHE A 88 7.668 3.941 -6.541 1.00 0.00 H new ATOM 0 HB3 PHE A 88 9.177 3.106 -6.232 1.00 0.00 H new ATOM 0 HD1 PHE A 88 6.265 4.715 -4.691 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.846 2.552 -3.928 1.00 0.00 H new ATOM 0 HE1 PHE A 88 5.538 4.343 -2.381 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.116 2.173 -1.615 1.00 0.00 H new ATOM 0 HZ PHE A 88 6.963 3.065 -0.837 1.00 0.00 H new ATOM 1361 N TYR A 89 11.081 6.093 -4.782 1.00 0.00 N ATOM 1362 CA TYR A 89 12.416 6.214 -4.339 1.00 0.00 C ATOM 1363 C TYR A 89 12.569 5.730 -2.909 1.00 0.00 C ATOM 1364 O TYR A 89 11.840 6.156 -2.017 1.00 0.00 O ATOM 1365 CB TYR A 89 12.863 7.668 -4.520 1.00 0.00 C ATOM 1366 CG TYR A 89 14.180 8.024 -3.869 1.00 0.00 C ATOM 1367 CD1 TYR A 89 15.387 7.708 -4.479 1.00 0.00 C ATOM 1368 CD2 TYR A 89 14.217 8.675 -2.639 1.00 0.00 C ATOM 1369 CE1 TYR A 89 16.589 8.026 -3.883 1.00 0.00 C ATOM 1370 CE2 TYR A 89 15.413 8.996 -2.040 1.00 0.00 C ATOM 1371 CZ TYR A 89 16.594 8.669 -2.665 1.00 0.00 C ATOM 1372 OH TYR A 89 17.787 8.984 -2.068 1.00 0.00 O ATOM 0 H TYR A 89 10.465 6.841 -4.462 1.00 0.00 H new ATOM 0 HA TYR A 89 13.065 5.575 -4.938 1.00 0.00 H new ATOM 0 HB2 TYR A 89 12.935 7.879 -5.587 1.00 0.00 H new ATOM 0 HB3 TYR A 89 12.089 8.322 -4.118 1.00 0.00 H new ATOM 0 HD1 TYR A 89 15.384 7.205 -5.435 1.00 0.00 H new ATOM 0 HD2 TYR A 89 13.291 8.932 -2.147 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.520 7.773 -4.368 1.00 0.00 H new ATOM 0 HE2 TYR A 89 15.425 9.501 -1.086 1.00 0.00 H new ATOM 0 HH TYR A 89 18.466 9.142 -2.757 1.00 0.00 H new ATOM 1382 N ARG A 90 13.486 4.812 -2.720 1.00 0.00 N ATOM 1383 CA ARG A 90 13.815 4.311 -1.409 1.00 0.00 C ATOM 1384 C ARG A 90 14.918 5.176 -0.821 1.00 0.00 C ATOM 1385 O ARG A 90 15.918 5.451 -1.502 1.00 0.00 O ATOM 1386 CB ARG A 90 14.275 2.853 -1.478 1.00 0.00 C ATOM 1387 CG ARG A 90 13.218 1.872 -1.951 1.00 0.00 C ATOM 1388 CD ARG A 90 12.033 1.826 -1.006 1.00 0.00 C ATOM 1389 NE ARG A 90 11.058 0.811 -1.406 1.00 0.00 N ATOM 1390 CZ ARG A 90 10.133 0.272 -0.601 1.00 0.00 C ATOM 1391 NH1 ARG A 90 10.010 0.696 0.657 1.00 0.00 N1+ ATOM 1392 NH2 ARG A 90 9.322 -0.676 -1.064 1.00 0.00 N ATOM 0 H ARG A 90 14.027 4.390 -3.475 1.00 0.00 H new ATOM 0 HA ARG A 90 12.927 4.351 -0.778 1.00 0.00 H new ATOM 0 HB2 ARG A 90 15.134 2.789 -2.146 1.00 0.00 H new ATOM 0 HB3 ARG A 90 14.617 2.548 -0.489 1.00 0.00 H new ATOM 0 HG2 ARG A 90 12.878 2.155 -2.947 1.00 0.00 H new ATOM 0 HG3 ARG A 90 13.656 0.877 -2.034 1.00 0.00 H new ATOM 0 HD2 ARG A 90 12.382 1.616 0.005 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.551 2.803 -0.980 1.00 0.00 H new ATOM 0 HE ARG A 90 11.085 0.489 -2.373 1.00 0.00 H new ATOM 0 HH11 ARG A 90 10.621 1.433 1.009 1.00 0.00 H new ATOM 0 HH12 ARG A 90 9.305 0.284 1.268 1.00 0.00 H new ATOM 0 HH21 ARG A 90 9.405 -0.991 -2.031 1.00 0.00 H new ATOM 0 HH22 ARG A 90 8.617 -1.088 -0.452 1.00 0.00 H new ATOM 1406 N PRO A 91 14.751 5.634 0.421 1.00 0.00 N ATOM 1407 CA PRO A 91 15.717 6.513 1.077 1.00 0.00 C ATOM 1408 C PRO A 91 17.080 5.849 1.341 1.00 0.00 C ATOM 1409 O PRO A 91 17.176 4.654 1.682 1.00 0.00 O ATOM 1410 CB PRO A 91 15.034 6.891 2.398 1.00 0.00 C ATOM 1411 CG PRO A 91 14.039 5.812 2.642 1.00 0.00 C ATOM 1412 CD PRO A 91 13.594 5.338 1.292 1.00 0.00 C ATOM 0 HA PRO A 91 15.956 7.367 0.443 1.00 0.00 H new ATOM 0 HB2 PRO A 91 15.756 6.953 3.212 1.00 0.00 H new ATOM 0 HB3 PRO A 91 14.550 7.865 2.327 1.00 0.00 H new ATOM 0 HG2 PRO A 91 14.482 4.997 3.214 1.00 0.00 H new ATOM 0 HG3 PRO A 91 13.194 6.185 3.221 1.00 0.00 H new ATOM 0 HD2 PRO A 91 13.359 4.274 1.298 1.00 0.00 H new ATOM 0 HD3 PRO A 91 12.697 5.861 0.959 1.00 0.00 H new ATOM 1420 N LYS A 92 18.116 6.618 1.130 1.00 0.00 N ATOM 1421 CA LYS A 92 19.474 6.204 1.401 1.00 0.00 C ATOM 1422 C LYS A 92 19.837 6.621 2.826 1.00 0.00 C ATOM 1423 O LYS A 92 19.525 7.732 3.244 1.00 0.00 O ATOM 1424 CB LYS A 92 20.398 6.901 0.409 1.00 0.00 C ATOM 1425 CG LYS A 92 20.083 6.577 -1.044 1.00 0.00 C ATOM 1426 CD LYS A 92 20.953 7.371 -2.006 1.00 0.00 C ATOM 1427 CE LYS A 92 22.431 7.111 -1.778 1.00 0.00 C ATOM 1428 NZ LYS A 92 23.270 7.770 -2.793 1.00 0.00 N1+ ATOM 0 H LYS A 92 18.042 7.565 0.759 1.00 0.00 H new ATOM 0 HA LYS A 92 19.576 5.123 1.301 1.00 0.00 H new ATOM 0 HB2 LYS A 92 20.329 7.979 0.556 1.00 0.00 H new ATOM 0 HB3 LYS A 92 21.428 6.615 0.622 1.00 0.00 H new ATOM 0 HG2 LYS A 92 20.230 5.511 -1.218 1.00 0.00 H new ATOM 0 HG3 LYS A 92 19.033 6.791 -1.244 1.00 0.00 H new ATOM 0 HD2 LYS A 92 20.692 7.110 -3.032 1.00 0.00 H new ATOM 0 HD3 LYS A 92 20.749 8.435 -1.887 1.00 0.00 H new ATOM 0 HE2 LYS A 92 22.713 7.467 -0.787 1.00 0.00 H new ATOM 0 HE3 LYS A 92 22.617 6.037 -1.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 24.272 7.567 -2.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 23.019 7.412 -3.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 23.112 8.797 -2.760 1.00 0.00 H new ATOM 1442 N ARG A 93 20.522 5.768 3.552 1.00 0.00 N ATOM 1443 CA ARG A 93 20.819 6.061 4.944 1.00 0.00 C ATOM 1444 C ARG A 93 22.002 7.009 5.109 1.00 0.00 C ATOM 1445 O ARG A 93 22.101 7.710 6.101 1.00 0.00 O ATOM 1446 CB ARG A 93 20.928 4.776 5.818 1.00 0.00 C ATOM 1447 CG ARG A 93 22.073 3.793 5.513 1.00 0.00 C ATOM 1448 CD ARG A 93 23.416 4.311 6.004 1.00 0.00 C ATOM 1449 NE ARG A 93 24.486 3.328 5.884 1.00 0.00 N ATOM 1450 CZ ARG A 93 25.431 3.124 6.821 1.00 0.00 C ATOM 1451 NH1 ARG A 93 25.370 3.769 8.000 1.00 0.00 N1+ ATOM 1452 NH2 ARG A 93 26.406 2.256 6.599 1.00 0.00 N ATOM 0 H ARG A 93 20.882 4.876 3.212 1.00 0.00 H new ATOM 0 HA ARG A 93 19.958 6.605 5.332 1.00 0.00 H new ATOM 0 HB2 ARG A 93 21.022 5.086 6.859 1.00 0.00 H new ATOM 0 HB3 ARG A 93 19.988 4.232 5.731 1.00 0.00 H new ATOM 0 HG2 ARG A 93 21.861 2.833 5.983 1.00 0.00 H new ATOM 0 HG3 ARG A 93 22.123 3.617 4.438 1.00 0.00 H new ATOM 0 HD2 ARG A 93 23.684 5.202 5.437 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.323 4.613 7.047 1.00 0.00 H new ATOM 0 HE ARG A 93 24.521 2.760 5.038 1.00 0.00 H new ATOM 0 HH11 ARG A 93 24.605 4.417 8.188 1.00 0.00 H new ATOM 0 HH12 ARG A 93 26.089 3.610 8.706 1.00 0.00 H new ATOM 0 HH21 ARG A 93 26.441 1.742 5.718 1.00 0.00 H new ATOM 0 HH22 ARG A 93 27.122 2.101 7.309 1.00 0.00 H new ATOM 1466 N SER A 94 22.884 7.042 4.127 1.00 0.00 N ATOM 1467 CA SER A 94 24.041 7.928 4.172 1.00 0.00 C ATOM 1468 C SER A 94 23.599 9.388 4.106 1.00 0.00 C ATOM 1469 O SER A 94 24.300 10.294 4.549 1.00 0.00 O ATOM 1470 CB SER A 94 24.964 7.610 3.010 1.00 0.00 C ATOM 1471 OG SER A 94 25.312 6.236 3.019 1.00 0.00 O ATOM 0 H SER A 94 22.824 6.467 3.287 1.00 0.00 H new ATOM 0 HA SER A 94 24.572 7.773 5.111 1.00 0.00 H new ATOM 0 HB2 SER A 94 24.475 7.862 2.069 1.00 0.00 H new ATOM 0 HB3 SER A 94 25.865 8.221 3.075 1.00 0.00 H new ATOM 0 HG SER A 94 25.906 6.044 2.264 1.00 0.00 H new ATOM 1477 N LEU A 95 22.440 9.599 3.528 1.00 0.00 N ATOM 1478 CA LEU A 95 21.886 10.914 3.401 1.00 0.00 C ATOM 1479 C LEU A 95 20.646 11.072 4.275 1.00 0.00 C ATOM 1480 O LEU A 95 19.888 12.034 4.108 1.00 0.00 O ATOM 1481 CB LEU A 95 21.572 11.217 1.933 1.00 0.00 C ATOM 1482 CG LEU A 95 22.770 11.234 0.974 1.00 0.00 C ATOM 1483 CD1 LEU A 95 22.316 11.556 -0.433 1.00 0.00 C ATOM 1484 CD2 LEU A 95 23.822 12.236 1.432 1.00 0.00 C ATOM 0 H LEU A 95 21.859 8.859 3.134 1.00 0.00 H new ATOM 0 HA LEU A 95 22.625 11.636 3.749 1.00 0.00 H new ATOM 0 HB2 LEU A 95 20.857 10.476 1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 95 21.078 12.187 1.881 1.00 0.00 H new ATOM 0 HG LEU A 95 23.220 10.241 0.979 1.00 0.00 H new ATOM 0 HD11 LEU A 95 23.178 11.564 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 95 21.605 10.801 -0.768 1.00 0.00 H new ATOM 0 HD13 LEU A 95 21.838 12.535 -0.446 1.00 0.00 H new ATOM 0 HD21 LEU A 95 24.660 12.228 0.735 1.00 0.00 H new ATOM 0 HD22 LEU A 95 23.385 13.234 1.462 1.00 0.00 H new ATOM 0 HD23 LEU A 95 24.175 11.964 2.427 1.00 0.00 H new ATOM 1496 N GLN A 96 20.475 10.166 5.255 1.00 0.00 N ATOM 1497 CA GLN A 96 19.251 10.146 6.075 1.00 0.00 C ATOM 1498 C GLN A 96 19.026 11.459 6.807 1.00 0.00 C ATOM 1499 O GLN A 96 17.920 11.972 6.805 1.00 0.00 O ATOM 1500 CB GLN A 96 19.215 8.986 7.085 1.00 0.00 C ATOM 1501 CG GLN A 96 20.197 9.112 8.240 1.00 0.00 C ATOM 1502 CD GLN A 96 19.991 8.054 9.270 1.00 0.00 C ATOM 1503 OE1 GLN A 96 20.598 6.999 9.210 1.00 0.00 O ATOM 1504 NE2 GLN A 96 19.111 8.307 10.199 1.00 0.00 N ATOM 0 H GLN A 96 21.158 9.448 5.496 1.00 0.00 H new ATOM 0 HA GLN A 96 18.441 9.994 5.361 1.00 0.00 H new ATOM 0 HB2 GLN A 96 18.207 8.908 7.491 1.00 0.00 H new ATOM 0 HB3 GLN A 96 19.417 8.055 6.555 1.00 0.00 H new ATOM 0 HG2 GLN A 96 21.216 9.051 7.857 1.00 0.00 H new ATOM 0 HG3 GLN A 96 20.088 10.093 8.702 1.00 0.00 H new ATOM 0 HE21 GLN A 96 18.626 9.204 10.211 1.00 0.00 H new ATOM 0 HE22 GLN A 96 18.908 7.608 10.913 1.00 0.00 H new ATOM 1513 N LYS A 97 20.103 12.033 7.370 1.00 0.00 N ATOM 1514 CA LYS A 97 20.000 13.254 8.158 1.00 0.00 C ATOM 1515 C LYS A 97 19.514 14.402 7.330 1.00 0.00 C ATOM 1516 O LYS A 97 18.886 15.296 7.839 1.00 0.00 O ATOM 1517 CB LYS A 97 21.310 13.612 8.867 1.00 0.00 C ATOM 1518 CG LYS A 97 21.784 12.573 9.872 1.00 0.00 C ATOM 1519 CD LYS A 97 20.746 12.281 10.962 1.00 0.00 C ATOM 1520 CE LYS A 97 20.359 13.531 11.760 1.00 0.00 C ATOM 1521 NZ LYS A 97 19.388 13.223 12.836 1.00 0.00 N1+ ATOM 0 H LYS A 97 21.051 11.664 7.289 1.00 0.00 H new ATOM 0 HA LYS A 97 19.261 13.054 8.934 1.00 0.00 H new ATOM 0 HB2 LYS A 97 22.088 13.756 8.117 1.00 0.00 H new ATOM 0 HB3 LYS A 97 21.183 14.565 9.380 1.00 0.00 H new ATOM 0 HG2 LYS A 97 22.022 11.648 9.346 1.00 0.00 H new ATOM 0 HG3 LYS A 97 22.706 12.920 10.339 1.00 0.00 H new ATOM 0 HD2 LYS A 97 19.853 11.857 10.503 1.00 0.00 H new ATOM 0 HD3 LYS A 97 21.143 11.528 11.643 1.00 0.00 H new ATOM 0 HE2 LYS A 97 21.254 13.975 12.195 1.00 0.00 H new ATOM 0 HE3 LYS A 97 19.931 14.273 11.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 19.243 14.068 13.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 18.482 12.935 12.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 19.757 12.449 13.425 1.00 0.00 H new ATOM 1535 N TYR A 98 19.794 14.361 6.043 1.00 0.00 N ATOM 1536 CA TYR A 98 19.295 15.367 5.155 1.00 0.00 C ATOM 1537 C TYR A 98 17.784 15.193 4.999 1.00 0.00 C ATOM 1538 O TYR A 98 17.034 16.137 5.172 1.00 0.00 O ATOM 1539 CB TYR A 98 20.026 15.336 3.779 1.00 0.00 C ATOM 1540 CG TYR A 98 19.322 16.147 2.705 1.00 0.00 C ATOM 1541 CD1 TYR A 98 19.274 17.531 2.754 1.00 0.00 C ATOM 1542 CD2 TYR A 98 18.656 15.509 1.674 1.00 0.00 C ATOM 1543 CE1 TYR A 98 18.565 18.247 1.803 1.00 0.00 C ATOM 1544 CE2 TYR A 98 17.967 16.212 0.719 1.00 0.00 C ATOM 1545 CZ TYR A 98 17.915 17.578 0.788 1.00 0.00 C ATOM 1546 OH TYR A 98 17.190 18.272 -0.148 1.00 0.00 O ATOM 0 H TYR A 98 20.363 13.641 5.599 1.00 0.00 H new ATOM 0 HA TYR A 98 19.495 16.349 5.583 1.00 0.00 H new ATOM 0 HB2 TYR A 98 21.040 15.716 3.906 1.00 0.00 H new ATOM 0 HB3 TYR A 98 20.113 14.302 3.445 1.00 0.00 H new ATOM 0 HD1 TYR A 98 19.794 18.057 3.541 1.00 0.00 H new ATOM 0 HD2 TYR A 98 18.679 14.431 1.620 1.00 0.00 H new ATOM 0 HE1 TYR A 98 18.522 19.325 1.857 1.00 0.00 H new ATOM 0 HE2 TYR A 98 17.468 15.690 -0.084 1.00 0.00 H new ATOM 0 HH TYR A 98 17.459 19.214 -0.138 1.00 0.00 H new ATOM 1556 N TYR A 99 17.366 13.963 4.768 1.00 0.00 N ATOM 1557 CA TYR A 99 15.958 13.638 4.517 1.00 0.00 C ATOM 1558 C TYR A 99 15.107 13.928 5.740 1.00 0.00 C ATOM 1559 O TYR A 99 14.068 14.605 5.651 1.00 0.00 O ATOM 1560 CB TYR A 99 15.790 12.157 4.148 1.00 0.00 C ATOM 1561 CG TYR A 99 16.657 11.665 3.004 1.00 0.00 C ATOM 1562 CD1 TYR A 99 17.079 12.512 1.995 1.00 0.00 C ATOM 1563 CD2 TYR A 99 17.039 10.345 2.936 1.00 0.00 C ATOM 1564 CE1 TYR A 99 17.858 12.061 0.957 1.00 0.00 C ATOM 1565 CE2 TYR A 99 17.818 9.889 1.905 1.00 0.00 C ATOM 1566 CZ TYR A 99 18.226 10.750 0.920 1.00 0.00 C ATOM 1567 OH TYR A 99 19.002 10.292 -0.119 1.00 0.00 O ATOM 0 H TYR A 99 17.987 13.154 4.747 1.00 0.00 H new ATOM 0 HA TYR A 99 15.630 14.261 3.685 1.00 0.00 H new ATOM 0 HB2 TYR A 99 16.007 11.554 5.030 1.00 0.00 H new ATOM 0 HB3 TYR A 99 14.746 11.981 3.891 1.00 0.00 H new ATOM 0 HD1 TYR A 99 16.789 13.552 2.024 1.00 0.00 H new ATOM 0 HD2 TYR A 99 16.720 9.658 3.706 1.00 0.00 H new ATOM 0 HE1 TYR A 99 18.175 12.739 0.178 1.00 0.00 H new ATOM 0 HE2 TYR A 99 18.111 8.850 1.869 1.00 0.00 H new ATOM 0 HH TYR A 99 18.424 9.942 -0.829 1.00 0.00 H new ATOM 1577 N GLU A 100 15.551 13.428 6.880 1.00 0.00 N ATOM 1578 CA GLU A 100 14.822 13.604 8.111 1.00 0.00 C ATOM 1579 C GLU A 100 14.772 15.074 8.535 1.00 0.00 C ATOM 1580 O GLU A 100 13.731 15.547 8.975 1.00 0.00 O ATOM 1581 CB GLU A 100 15.328 12.665 9.225 1.00 0.00 C ATOM 1582 CG GLU A 100 16.804 12.767 9.519 1.00 0.00 C ATOM 1583 CD GLU A 100 17.278 11.757 10.533 1.00 0.00 C ATOM 1584 OE1 GLU A 100 17.252 12.061 11.740 1.00 0.00 O ATOM 1585 OE2 GLU A 100 17.718 10.668 10.151 1.00 0.00 O1- ATOM 0 H GLU A 100 16.416 12.896 6.972 1.00 0.00 H new ATOM 0 HA GLU A 100 13.790 13.308 7.924 1.00 0.00 H new ATOM 0 HB2 GLU A 100 14.775 12.878 10.139 1.00 0.00 H new ATOM 0 HB3 GLU A 100 15.098 11.637 8.946 1.00 0.00 H new ATOM 0 HG2 GLU A 100 17.363 12.632 8.593 1.00 0.00 H new ATOM 0 HG3 GLU A 100 17.027 13.770 9.883 1.00 0.00 H new ATOM 1592 N ALA A 101 15.871 15.811 8.318 1.00 0.00 N ATOM 1593 CA ALA A 101 15.916 17.243 8.640 1.00 0.00 C ATOM 1594 C ALA A 101 14.925 18.019 7.784 1.00 0.00 C ATOM 1595 O ALA A 101 14.349 19.016 8.233 1.00 0.00 O ATOM 1596 CB ALA A 101 17.317 17.808 8.457 1.00 0.00 C ATOM 0 H ALA A 101 16.736 15.441 7.923 1.00 0.00 H new ATOM 0 HA ALA A 101 15.638 17.352 9.688 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.316 18.870 8.703 1.00 0.00 H new ATOM 0 HB2 ALA A 101 18.010 17.283 9.115 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.630 17.676 7.421 1.00 0.00 H new ATOM 1602 N VAL A 102 14.717 17.563 6.559 1.00 0.00 N ATOM 1603 CA VAL A 102 13.764 18.203 5.680 1.00 0.00 C ATOM 1604 C VAL A 102 12.343 17.961 6.184 1.00 0.00 C ATOM 1605 O VAL A 102 11.558 18.908 6.368 1.00 0.00 O ATOM 1606 CB VAL A 102 13.885 17.730 4.200 1.00 0.00 C ATOM 1607 CG1 VAL A 102 12.816 18.380 3.343 1.00 0.00 C ATOM 1608 CG2 VAL A 102 15.244 18.079 3.635 1.00 0.00 C ATOM 0 H VAL A 102 15.195 16.756 6.157 1.00 0.00 H new ATOM 0 HA VAL A 102 13.992 19.269 5.694 1.00 0.00 H new ATOM 0 HB VAL A 102 13.755 16.648 4.188 1.00 0.00 H new ATOM 0 HG11 VAL A 102 12.917 18.037 2.313 1.00 0.00 H new ATOM 0 HG12 VAL A 102 11.831 18.107 3.721 1.00 0.00 H new ATOM 0 HG13 VAL A 102 12.931 19.463 3.378 1.00 0.00 H new ATOM 0 HG21 VAL A 102 15.306 17.740 2.601 1.00 0.00 H new ATOM 0 HG22 VAL A 102 15.387 19.159 3.672 1.00 0.00 H new ATOM 0 HG23 VAL A 102 16.020 17.590 4.225 1.00 0.00 H new ATOM 1618 N LYS A 103 12.030 16.702 6.473 1.00 0.00 N ATOM 1619 CA LYS A 103 10.688 16.346 6.892 1.00 0.00 C ATOM 1620 C LYS A 103 10.348 16.881 8.261 1.00 0.00 C ATOM 1621 O LYS A 103 9.201 16.877 8.634 1.00 0.00 O ATOM 1622 CB LYS A 103 10.374 14.868 6.790 1.00 0.00 C ATOM 1623 CG LYS A 103 10.999 14.001 7.852 1.00 0.00 C ATOM 1624 CD LYS A 103 10.567 12.556 7.684 1.00 0.00 C ATOM 1625 CE LYS A 103 10.974 11.990 6.324 1.00 0.00 C ATOM 1626 NZ LYS A 103 10.375 10.671 6.066 1.00 0.00 N1+ ATOM 0 H LYS A 103 12.684 15.921 6.424 1.00 0.00 H new ATOM 0 HA LYS A 103 10.040 16.840 6.168 1.00 0.00 H new ATOM 0 HB2 LYS A 103 9.292 14.740 6.830 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.701 14.511 5.814 1.00 0.00 H new ATOM 0 HG2 LYS A 103 12.085 14.071 7.793 1.00 0.00 H new ATOM 0 HG3 LYS A 103 10.709 14.360 8.839 1.00 0.00 H new ATOM 0 HD2 LYS A 103 11.010 11.951 8.475 1.00 0.00 H new ATOM 0 HD3 LYS A 103 9.485 12.486 7.797 1.00 0.00 H new ATOM 0 HE2 LYS A 103 10.672 12.684 5.539 1.00 0.00 H new ATOM 0 HE3 LYS A 103 12.060 11.909 6.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 11.118 9.944 6.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 9.672 10.459 6.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 9.911 10.677 5.135 1.00 0.00 H new ATOM 1640 N GLU A 104 11.355 17.252 9.044 1.00 0.00 N ATOM 1641 CA GLU A 104 11.122 17.929 10.316 1.00 0.00 C ATOM 1642 C GLU A 104 10.187 19.115 10.098 1.00 0.00 C ATOM 1643 O GLU A 104 9.147 19.225 10.728 1.00 0.00 O ATOM 1644 CB GLU A 104 12.443 18.405 10.912 1.00 0.00 C ATOM 1645 CG GLU A 104 13.303 17.296 11.467 1.00 0.00 C ATOM 1646 CD GLU A 104 12.710 16.673 12.700 1.00 0.00 C ATOM 1647 OE1 GLU A 104 11.846 15.775 12.584 1.00 0.00 O ATOM 1648 OE2 GLU A 104 13.108 17.064 13.818 1.00 0.00 O1- ATOM 0 H GLU A 104 12.338 17.096 8.822 1.00 0.00 H new ATOM 0 HA GLU A 104 10.660 17.230 11.013 1.00 0.00 H new ATOM 0 HB2 GLU A 104 13.005 18.937 10.144 1.00 0.00 H new ATOM 0 HB3 GLU A 104 12.234 19.121 11.707 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.438 16.529 10.705 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.292 17.690 11.702 1.00 0.00 H new ATOM 1655 N GLU A 105 10.540 19.936 9.148 1.00 0.00 N ATOM 1656 CA GLU A 105 9.747 21.092 8.780 1.00 0.00 C ATOM 1657 C GLU A 105 8.414 20.691 8.233 1.00 0.00 C ATOM 1658 O GLU A 105 7.388 21.247 8.611 1.00 0.00 O ATOM 1659 CB GLU A 105 10.466 21.925 7.741 1.00 0.00 C ATOM 1660 CG GLU A 105 11.558 22.767 8.300 1.00 0.00 C ATOM 1661 CD GLU A 105 11.001 23.748 9.297 1.00 0.00 C ATOM 1662 OE1 GLU A 105 10.255 24.657 8.880 1.00 0.00 O1- ATOM 1663 OE2 GLU A 105 11.237 23.605 10.517 1.00 0.00 O ATOM 0 H GLU A 105 11.392 19.827 8.598 1.00 0.00 H new ATOM 0 HA GLU A 105 9.598 21.678 9.687 1.00 0.00 H new ATOM 0 HB2 GLU A 105 10.882 21.263 6.982 1.00 0.00 H new ATOM 0 HB3 GLU A 105 9.743 22.569 7.240 1.00 0.00 H new ATOM 0 HG2 GLU A 105 12.305 22.135 8.780 1.00 0.00 H new ATOM 0 HG3 GLU A 105 12.062 23.302 7.495 1.00 0.00 H new ATOM 1670 N LEU A 106 8.442 19.716 7.361 1.00 0.00 N ATOM 1671 CA LEU A 106 7.260 19.261 6.664 1.00 0.00 C ATOM 1672 C LEU A 106 6.249 18.699 7.642 1.00 0.00 C ATOM 1673 O LEU A 106 5.115 19.123 7.661 1.00 0.00 O ATOM 1674 CB LEU A 106 7.637 18.213 5.628 1.00 0.00 C ATOM 1675 CG LEU A 106 8.821 18.566 4.723 1.00 0.00 C ATOM 1676 CD1 LEU A 106 9.039 17.493 3.687 1.00 0.00 C ATOM 1677 CD2 LEU A 106 8.657 19.939 4.080 1.00 0.00 C ATOM 0 H LEU A 106 9.291 19.210 7.111 1.00 0.00 H new ATOM 0 HA LEU A 106 6.806 20.111 6.155 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.866 17.282 6.147 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.768 18.022 4.999 1.00 0.00 H new ATOM 0 HG LEU A 106 9.711 18.617 5.350 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.885 17.764 3.055 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.246 16.545 4.183 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.144 17.393 3.073 1.00 0.00 H new ATOM 0 HD21 LEU A 106 9.519 20.149 3.447 1.00 0.00 H new ATOM 0 HD22 LEU A 106 7.750 19.952 3.475 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.585 20.699 4.858 1.00 0.00 H new ATOM 1689 N ASP A 107 6.696 17.797 8.496 1.00 0.00 N ATOM 1690 CA ASP A 107 5.837 17.161 9.490 1.00 0.00 C ATOM 1691 C ASP A 107 5.205 18.200 10.408 1.00 0.00 C ATOM 1692 O ASP A 107 4.022 18.136 10.667 1.00 0.00 O ATOM 1693 CB ASP A 107 6.610 16.101 10.296 1.00 0.00 C ATOM 1694 CG ASP A 107 5.786 15.430 11.393 1.00 0.00 C ATOM 1695 OD1 ASP A 107 5.020 14.476 11.098 1.00 0.00 O ATOM 1696 OD2 ASP A 107 5.956 15.803 12.576 1.00 0.00 O1- ATOM 0 H ASP A 107 7.665 17.481 8.524 1.00 0.00 H new ATOM 0 HA ASP A 107 5.033 16.650 8.960 1.00 0.00 H new ATOM 0 HB2 ASP A 107 6.977 15.336 9.612 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.484 16.570 10.748 1.00 0.00 H new ATOM 1701 N ARG A 108 5.977 19.224 10.822 1.00 0.00 N ATOM 1702 CA ARG A 108 5.411 20.256 11.721 1.00 0.00 C ATOM 1703 C ARG A 108 4.400 21.111 10.965 1.00 0.00 C ATOM 1704 O ARG A 108 3.504 21.710 11.559 1.00 0.00 O ATOM 1705 CB ARG A 108 6.452 21.242 12.325 1.00 0.00 C ATOM 1706 CG ARG A 108 7.723 20.682 12.947 1.00 0.00 C ATOM 1707 CD ARG A 108 7.530 19.330 13.578 1.00 0.00 C ATOM 1708 NE ARG A 108 8.650 18.861 14.456 1.00 0.00 N ATOM 1709 CZ ARG A 108 9.998 18.892 14.219 1.00 0.00 C ATOM 1710 NH1 ARG A 108 10.550 19.728 13.336 1.00 0.00 N1+ ATOM 1711 NH2 ARG A 108 10.790 18.135 14.949 1.00 0.00 N ATOM 0 H ARG A 108 6.954 19.360 10.563 1.00 0.00 H new ATOM 0 HA ARG A 108 4.967 19.687 12.538 1.00 0.00 H new ATOM 0 HB2 ARG A 108 6.748 21.932 11.535 1.00 0.00 H new ATOM 0 HB3 ARG A 108 5.943 21.831 13.089 1.00 0.00 H new ATOM 0 HG2 ARG A 108 8.494 20.611 12.180 1.00 0.00 H new ATOM 0 HG3 ARG A 108 8.088 21.379 13.702 1.00 0.00 H new ATOM 0 HD2 ARG A 108 6.614 19.351 14.168 1.00 0.00 H new ATOM 0 HD3 ARG A 108 7.382 18.597 12.785 1.00 0.00 H new ATOM 0 HE ARG A 108 8.370 18.464 15.353 1.00 0.00 H new ATOM 0 HH11 ARG A 108 9.962 20.374 12.809 1.00 0.00 H new ATOM 0 HH12 ARG A 108 11.559 19.720 13.188 1.00 0.00 H new ATOM 0 HH21 ARG A 108 10.397 17.538 15.677 1.00 0.00 H new ATOM 0 HH22 ARG A 108 11.797 18.145 14.787 1.00 0.00 H new ATOM 1725 N ASP A 109 4.569 21.179 9.667 1.00 0.00 N ATOM 1726 CA ASP A 109 3.740 22.017 8.819 1.00 0.00 C ATOM 1727 C ASP A 109 2.428 21.292 8.513 1.00 0.00 C ATOM 1728 O ASP A 109 1.341 21.896 8.517 1.00 0.00 O ATOM 1729 CB ASP A 109 4.497 22.327 7.513 1.00 0.00 C ATOM 1730 CG ASP A 109 4.126 23.651 6.880 1.00 0.00 C ATOM 1731 OD1 ASP A 109 3.141 23.741 6.146 1.00 0.00 O1- ATOM 1732 OD2 ASP A 109 4.869 24.639 7.108 1.00 0.00 O ATOM 0 H ASP A 109 5.285 20.656 9.163 1.00 0.00 H new ATOM 0 HA ASP A 109 3.515 22.953 9.330 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.568 22.322 7.717 1.00 0.00 H new ATOM 0 HB3 ASP A 109 4.305 21.528 6.797 1.00 0.00 H new ATOM 1737 N ILE A 110 2.540 19.991 8.293 1.00 0.00 N ATOM 1738 CA ILE A 110 1.408 19.132 7.955 1.00 0.00 C ATOM 1739 C ILE A 110 0.627 18.723 9.190 1.00 0.00 C ATOM 1740 O ILE A 110 -0.554 19.050 9.334 1.00 0.00 O ATOM 1741 CB ILE A 110 1.874 17.803 7.286 1.00 0.00 C ATOM 1742 CG1 ILE A 110 2.764 18.069 6.096 1.00 0.00 C ATOM 1743 CG2 ILE A 110 0.663 16.963 6.852 1.00 0.00 C ATOM 1744 CD1 ILE A 110 3.397 16.835 5.527 1.00 0.00 C ATOM 0 H ILE A 110 3.429 19.493 8.344 1.00 0.00 H new ATOM 0 HA ILE A 110 0.791 19.721 7.276 1.00 0.00 H new ATOM 0 HB ILE A 110 2.448 17.247 8.027 1.00 0.00 H new ATOM 0 HG12 ILE A 110 2.178 18.558 5.318 1.00 0.00 H new ATOM 0 HG13 ILE A 110 3.549 18.766 6.389 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.008 16.040 6.387 1.00 0.00 H new ATOM 0 HG22 ILE A 110 0.054 16.725 7.724 1.00 0.00 H new ATOM 0 HG23 ILE A 110 0.066 17.528 6.136 1.00 0.00 H new ATOM 0 HD11 ILE A 110 4.021 17.106 4.676 1.00 0.00 H new ATOM 0 HD12 ILE A 110 4.011 16.356 6.290 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.619 16.144 5.201 1.00 0.00 H new ATOM 1756 N VAL A 111 1.293 18.015 10.080 1.00 0.00 N ATOM 1757 CA VAL A 111 0.621 17.367 11.163 1.00 0.00 C ATOM 1758 C VAL A 111 0.347 18.346 12.288 1.00 0.00 C ATOM 1759 O VAL A 111 1.200 19.184 12.634 1.00 0.00 O ATOM 1760 CB VAL A 111 1.418 16.104 11.686 1.00 0.00 C ATOM 1761 CG1 VAL A 111 2.499 16.439 12.704 1.00 0.00 C ATOM 1762 CG2 VAL A 111 0.479 15.025 12.192 1.00 0.00 C ATOM 0 H VAL A 111 2.304 17.880 10.065 1.00 0.00 H new ATOM 0 HA VAL A 111 -0.334 17.005 10.783 1.00 0.00 H new ATOM 0 HB VAL A 111 1.949 15.708 10.820 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.001 15.523 13.016 1.00 0.00 H new ATOM 0 HG12 VAL A 111 3.225 17.116 12.254 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.046 16.918 13.572 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.060 14.172 12.543 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.120 15.419 13.013 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.179 14.707 11.383 1.00 0.00 H new ATOM 1772 N SER A 112 -0.843 18.293 12.811 1.00 0.00 N ATOM 1773 CA SER A 112 -1.195 19.108 13.927 1.00 0.00 C ATOM 1774 C SER A 112 -0.446 18.612 15.162 1.00 0.00 C ATOM 1775 O SER A 112 0.113 19.405 15.928 1.00 0.00 O ATOM 1776 CB SER A 112 -2.697 19.043 14.137 1.00 0.00 C ATOM 1777 OG SER A 112 -3.379 19.370 12.929 1.00 0.00 O ATOM 0 H SER A 112 -1.590 17.686 12.475 1.00 0.00 H new ATOM 0 HA SER A 112 -0.916 20.146 13.745 1.00 0.00 H new ATOM 0 HB2 SER A 112 -2.982 18.043 14.465 1.00 0.00 H new ATOM 0 HB3 SER A 112 -2.991 19.734 14.927 1.00 0.00 H new ATOM 0 HG SER A 112 -3.667 18.546 12.483 1.00 0.00 H new ATOM 1783 N LYS A 113 -0.361 17.300 15.306 1.00 0.00 N ATOM 1784 CA LYS A 113 0.294 16.711 16.438 1.00 0.00 C ATOM 1785 C LYS A 113 0.953 15.396 16.023 1.00 0.00 C ATOM 1786 O LYS A 113 0.270 14.446 15.632 1.00 0.00 O ATOM 1787 CB LYS A 113 -0.751 16.518 17.586 1.00 0.00 C ATOM 1788 CG LYS A 113 -0.198 16.089 18.958 1.00 0.00 C ATOM 1789 CD LYS A 113 0.215 14.624 19.008 1.00 0.00 C ATOM 1790 CE LYS A 113 0.911 14.283 20.308 1.00 0.00 C ATOM 1791 NZ LYS A 113 2.195 14.998 20.454 1.00 0.00 N1+ ATOM 0 H LYS A 113 -0.744 16.627 14.642 1.00 0.00 H new ATOM 0 HA LYS A 113 1.084 17.364 16.810 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -1.292 17.455 17.715 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -1.478 15.772 17.263 1.00 0.00 H new ATOM 0 HG2 LYS A 113 0.662 16.711 19.206 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -0.955 16.273 19.721 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -0.666 13.993 18.891 1.00 0.00 H new ATOM 0 HD3 LYS A 113 0.878 14.404 18.171 1.00 0.00 H new ATOM 0 HE2 LYS A 113 0.259 14.534 21.145 1.00 0.00 H new ATOM 0 HE3 LYS A 113 1.088 13.208 20.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.709 14.625 21.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 2.768 14.861 19.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 2.014 16.013 20.590 1.00 0.00 H new ATOM 1805 N ASN A 114 2.272 15.364 16.065 1.00 0.00 N ATOM 1806 CA ASN A 114 3.024 14.134 15.809 1.00 0.00 C ATOM 1807 C ASN A 114 3.145 13.430 17.131 1.00 0.00 C ATOM 1808 O ASN A 114 3.497 14.068 18.142 1.00 0.00 O ATOM 1809 CB ASN A 114 4.434 14.439 15.286 1.00 0.00 C ATOM 1810 CG ASN A 114 5.231 13.189 14.911 1.00 0.00 C ATOM 1811 OD1 ASN A 114 5.857 12.560 15.765 1.00 0.00 O ATOM 1812 ND2 ASN A 114 5.294 12.880 13.636 1.00 0.00 N ATOM 0 H ASN A 114 2.853 16.176 16.274 1.00 0.00 H new ATOM 0 HA ASN A 114 2.512 13.533 15.057 1.00 0.00 H new ATOM 0 HB2 ASN A 114 4.356 15.086 14.412 1.00 0.00 H new ATOM 0 HB3 ASN A 114 4.982 14.995 16.047 1.00 0.00 H new ATOM 0 HD21 ASN A 114 5.874 12.099 13.329 1.00 0.00 H new ATOM 0 HD22 ASN A 114 4.763 13.421 12.953 1.00 0.00 H new ATOM 1819 N ASN A 115 2.842 12.176 17.177 1.00 0.00 N ATOM 1820 CA ASN A 115 2.874 11.479 18.430 1.00 0.00 C ATOM 1821 C ASN A 115 4.136 10.664 18.564 1.00 0.00 C ATOM 1822 O ASN A 115 4.279 9.592 17.968 1.00 0.00 O ATOM 1823 CB ASN A 115 1.630 10.611 18.634 1.00 0.00 C ATOM 1824 CG ASN A 115 1.570 10.019 20.032 1.00 0.00 C ATOM 1825 OD1 ASN A 115 1.060 10.655 20.956 1.00 0.00 O ATOM 1826 ND2 ASN A 115 2.051 8.810 20.200 1.00 0.00 N ATOM 0 H ASN A 115 2.571 11.612 16.372 1.00 0.00 H new ATOM 0 HA ASN A 115 2.872 12.231 19.219 1.00 0.00 H new ATOM 0 HB2 ASN A 115 0.737 11.210 18.456 1.00 0.00 H new ATOM 0 HB3 ASN A 115 1.626 9.806 17.899 1.00 0.00 H new ATOM 0 HD21 ASN A 115 2.010 8.368 21.118 1.00 0.00 H new ATOM 0 HD22 ASN A 115 2.466 8.312 19.412 1.00 0.00 H new ATOM 1833 N ALA A 116 5.058 11.200 19.306 1.00 0.00 N ATOM 1834 CA ALA A 116 6.297 10.544 19.586 1.00 0.00 C ATOM 1835 C ALA A 116 6.258 10.039 21.011 1.00 0.00 C ATOM 1836 O ALA A 116 6.317 10.823 21.962 1.00 0.00 O ATOM 1837 CB ALA A 116 7.457 11.501 19.383 1.00 0.00 C ATOM 0 H ALA A 116 4.968 12.119 19.740 1.00 0.00 H new ATOM 0 HA ALA A 116 6.439 9.705 18.905 1.00 0.00 H new ATOM 0 HB1 ALA A 116 8.394 10.988 19.600 1.00 0.00 H new ATOM 0 HB2 ALA A 116 7.465 11.850 18.350 1.00 0.00 H new ATOM 0 HB3 ALA A 116 7.347 12.354 20.053 1.00 0.00 H new ATOM 1843 N GLU A 117 6.097 8.760 21.166 1.00 0.00 N ATOM 1844 CA GLU A 117 5.996 8.171 22.466 1.00 0.00 C ATOM 1845 C GLU A 117 7.279 7.387 22.727 1.00 0.00 C ATOM 1846 O GLU A 117 7.386 6.217 22.386 1.00 0.00 O ATOM 1847 CB GLU A 117 4.736 7.273 22.512 1.00 0.00 C ATOM 1848 CG GLU A 117 4.197 6.920 23.898 1.00 0.00 C ATOM 1849 CD GLU A 117 5.098 6.039 24.718 1.00 0.00 C ATOM 1850 OE1 GLU A 117 5.132 4.818 24.466 1.00 0.00 O1- ATOM 1851 OE2 GLU A 117 5.775 6.550 25.642 1.00 0.00 O ATOM 0 H GLU A 117 6.032 8.096 20.395 1.00 0.00 H new ATOM 0 HA GLU A 117 5.889 8.924 23.247 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.942 7.771 21.955 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.960 6.344 21.987 1.00 0.00 H new ATOM 0 HG2 GLU A 117 4.016 7.843 24.448 1.00 0.00 H new ATOM 0 HG3 GLU A 117 3.234 6.424 23.782 1.00 0.00 H new ATOM 1858 N LYS A 118 8.271 8.067 23.235 1.00 0.00 N ATOM 1859 CA LYS A 118 9.564 7.481 23.528 1.00 0.00 C ATOM 1860 C LYS A 118 10.048 8.034 24.844 1.00 0.00 C ATOM 1861 O LYS A 118 10.721 9.076 24.851 1.00 0.00 O ATOM 1862 CB LYS A 118 10.584 7.786 22.404 1.00 0.00 C ATOM 1863 CG LYS A 118 10.344 7.072 21.058 1.00 0.00 C ATOM 1864 CD LYS A 118 11.039 5.691 20.963 1.00 0.00 C ATOM 1865 CE LYS A 118 10.538 4.652 21.972 1.00 0.00 C ATOM 1866 NZ LYS A 118 9.116 4.288 21.777 1.00 0.00 N1+ ATOM 1867 OXT LYS A 118 9.683 7.467 25.890 1.00 0.00 O1- ATOM 0 H LYS A 118 8.209 9.059 23.463 1.00 0.00 H new ATOM 0 HA LYS A 118 9.466 6.397 23.590 1.00 0.00 H new ATOM 0 HB2 LYS A 118 10.587 8.861 22.226 1.00 0.00 H new ATOM 0 HB3 LYS A 118 11.579 7.519 22.761 1.00 0.00 H new ATOM 0 HG2 LYS A 118 9.272 6.942 20.910 1.00 0.00 H new ATOM 0 HG3 LYS A 118 10.703 7.708 20.249 1.00 0.00 H new ATOM 0 HD2 LYS A 118 10.899 5.297 19.956 1.00 0.00 H new ATOM 0 HD3 LYS A 118 12.111 5.828 21.105 1.00 0.00 H new ATOM 0 HE2 LYS A 118 11.150 3.754 21.893 1.00 0.00 H new ATOM 0 HE3 LYS A 118 10.672 5.041 22.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 8.971 3.295 22.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 8.517 4.901 22.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 8.860 4.412 20.777 1.00 0.00 H new TER 1881 LYS A 118 ATOM 1882 N GLY B 200 29.602 6.956 16.100 1.00 0.00 N ATOM 1883 CA GLY B 200 29.853 7.072 14.671 1.00 0.00 C ATOM 1884 C GLY B 200 30.291 8.459 14.315 1.00 0.00 C ATOM 1885 O GLY B 200 31.085 9.059 15.042 1.00 0.00 O ATOM 0 HA2 GLY B 200 30.620 6.357 14.373 1.00 0.00 H new ATOM 0 HA3 GLY B 200 28.949 6.819 14.117 1.00 0.00 H new ATOM 1891 N SER B 201 29.781 8.988 13.223 1.00 0.00 N ATOM 1892 CA SER B 201 30.150 10.314 12.780 1.00 0.00 C ATOM 1893 C SER B 201 29.323 11.366 13.506 1.00 0.00 C ATOM 1894 O SER B 201 28.238 11.736 13.072 1.00 0.00 O ATOM 1895 CB SER B 201 29.977 10.441 11.268 1.00 0.00 C ATOM 1896 OG SER B 201 30.734 9.438 10.584 1.00 0.00 O ATOM 0 H SER B 201 29.105 8.515 12.623 1.00 0.00 H new ATOM 0 HA SER B 201 31.201 10.479 13.018 1.00 0.00 H new ATOM 0 HB2 SER B 201 28.922 10.347 11.009 1.00 0.00 H new ATOM 0 HB3 SER B 201 30.298 11.430 10.943 1.00 0.00 H new ATOM 0 HG SER B 201 30.608 9.536 9.617 1.00 0.00 H new ATOM 1902 N LYS B 202 29.814 11.797 14.633 1.00 0.00 N ATOM 1903 CA LYS B 202 29.113 12.771 15.420 1.00 0.00 C ATOM 1904 C LYS B 202 29.809 14.131 15.292 1.00 0.00 C ATOM 1905 O LYS B 202 29.363 15.144 15.853 1.00 0.00 O ATOM 1906 CB LYS B 202 29.027 12.294 16.873 1.00 0.00 C ATOM 1907 CG LYS B 202 28.071 13.081 17.755 1.00 0.00 C ATOM 1908 CD LYS B 202 26.637 13.003 17.251 1.00 0.00 C ATOM 1909 CE LYS B 202 25.683 13.760 18.164 1.00 0.00 C ATOM 1910 NZ LYS B 202 25.673 13.215 19.546 1.00 0.00 N1+ ATOM 0 H LYS B 202 30.702 11.487 15.029 1.00 0.00 H new ATOM 0 HA LYS B 202 28.093 12.890 15.055 1.00 0.00 H new ATOM 0 HB2 LYS B 202 28.723 11.247 16.878 1.00 0.00 H new ATOM 0 HB3 LYS B 202 30.023 12.339 17.313 1.00 0.00 H new ATOM 0 HG2 LYS B 202 28.119 12.697 18.774 1.00 0.00 H new ATOM 0 HG3 LYS B 202 28.386 14.124 17.792 1.00 0.00 H new ATOM 0 HD2 LYS B 202 26.581 13.415 16.243 1.00 0.00 H new ATOM 0 HD3 LYS B 202 26.329 11.959 17.186 1.00 0.00 H new ATOM 0 HE2 LYS B 202 25.969 14.811 18.193 1.00 0.00 H new ATOM 0 HE3 LYS B 202 24.675 13.715 17.751 1.00 0.00 H new ATOM 0 HZ1 LYS B 202 24.854 13.594 20.063 1.00 0.00 H new ATOM 0 HZ2 LYS B 202 25.610 12.178 19.510 1.00 0.00 H new ATOM 0 HZ3 LYS B 202 26.548 13.492 20.035 1.00 0.00 H new ATOM 1924 N SER B 203 30.921 14.140 14.554 1.00 0.00 N ATOM 1925 CA SER B 203 31.625 15.364 14.215 1.00 0.00 C ATOM 1926 C SER B 203 30.635 16.265 13.475 1.00 0.00 C ATOM 1927 O SER B 203 30.417 17.418 13.828 1.00 0.00 O ATOM 1928 CB SER B 203 32.795 14.997 13.307 1.00 0.00 C ATOM 1929 OG SER B 203 33.539 13.927 13.881 1.00 0.00 O ATOM 0 H SER B 203 31.353 13.296 14.178 1.00 0.00 H new ATOM 0 HA SER B 203 32.006 15.880 15.097 1.00 0.00 H new ATOM 0 HB2 SER B 203 32.426 14.708 12.323 1.00 0.00 H new ATOM 0 HB3 SER B 203 33.440 15.864 13.163 1.00 0.00 H new ATOM 0 HG SER B 203 34.287 13.696 13.292 1.00 0.00 H new ATOM 1935 N GLN B 204 30.018 15.670 12.490 1.00 0.00 N ATOM 1936 CA GLN B 204 28.935 16.214 11.745 1.00 0.00 C ATOM 1937 C GLN B 204 28.395 15.029 11.007 1.00 0.00 C ATOM 1938 O GLN B 204 29.190 14.224 10.498 1.00 0.00 O ATOM 1939 CB GLN B 204 29.384 17.292 10.756 1.00 0.00 C ATOM 1940 CG GLN B 204 28.233 18.094 10.155 1.00 0.00 C ATOM 1941 CD GLN B 204 28.670 19.147 9.139 1.00 0.00 C ATOM 1942 OE1 GLN B 204 28.033 20.195 9.008 1.00 0.00 O ATOM 1943 NE2 GLN B 204 29.724 18.881 8.403 1.00 0.00 N ATOM 0 H GLN B 204 30.281 14.736 12.174 1.00 0.00 H new ATOM 0 HA GLN B 204 28.208 16.706 12.390 1.00 0.00 H new ATOM 0 HB2 GLN B 204 30.065 17.976 11.263 1.00 0.00 H new ATOM 0 HB3 GLN B 204 29.946 16.821 9.950 1.00 0.00 H new ATOM 0 HG2 GLN B 204 27.538 17.406 9.673 1.00 0.00 H new ATOM 0 HG3 GLN B 204 27.688 18.586 10.960 1.00 0.00 H new ATOM 0 HE21 GLN B 204 30.230 18.005 8.535 1.00 0.00 H new ATOM 0 HE22 GLN B 204 30.037 19.550 7.699 1.00 0.00 H new ATOM 1952 N TYR B 205 27.100 14.861 11.010 1.00 0.00 N ATOM 1953 CA TYR B 205 26.489 13.696 10.381 1.00 0.00 C ATOM 1954 C TYR B 205 26.768 13.745 8.900 1.00 0.00 C ATOM 1955 O TYR B 205 27.406 12.871 8.342 1.00 0.00 O ATOM 1956 CB TYR B 205 24.987 13.701 10.581 1.00 0.00 C ATOM 1957 CG TYR B 205 24.529 14.244 11.901 1.00 0.00 C ATOM 1958 CD1 TYR B 205 24.646 13.513 13.072 1.00 0.00 C ATOM 1959 CD2 TYR B 205 23.963 15.503 11.962 1.00 0.00 C ATOM 1960 CE1 TYR B 205 24.210 14.034 14.273 1.00 0.00 C ATOM 1961 CE2 TYR B 205 23.526 16.031 13.145 1.00 0.00 C ATOM 1962 CZ TYR B 205 23.650 15.297 14.303 1.00 0.00 C ATOM 1963 OH TYR B 205 23.214 15.822 15.496 1.00 0.00 O ATOM 0 H TYR B 205 26.439 15.509 11.438 1.00 0.00 H new ATOM 0 HA TYR B 205 26.906 12.796 10.833 1.00 0.00 H new ATOM 0 HB2 TYR B 205 24.531 14.289 9.785 1.00 0.00 H new ATOM 0 HB3 TYR B 205 24.617 12.681 10.476 1.00 0.00 H new ATOM 0 HD1 TYR B 205 25.083 12.526 13.045 1.00 0.00 H new ATOM 0 HD2 TYR B 205 23.864 16.082 11.056 1.00 0.00 H new ATOM 0 HE1 TYR B 205 24.306 13.459 15.182 1.00 0.00 H new ATOM 0 HE2 TYR B 205 23.087 17.017 13.171 1.00 0.00 H new ATOM 0 HH TYR B 205 22.848 16.718 15.345 1.00 0.00 H new ATOM 1973 N ILE B 206 26.291 14.794 8.280 1.00 0.00 N ATOM 1974 CA ILE B 206 26.519 15.032 6.887 1.00 0.00 C ATOM 1975 C ILE B 206 26.793 16.506 6.794 1.00 0.00 C ATOM 1976 O ILE B 206 26.275 17.271 7.609 1.00 0.00 O ATOM 1977 CB ILE B 206 25.289 14.737 5.987 1.00 0.00 C ATOM 1978 CG1 ILE B 206 24.483 13.533 6.486 1.00 0.00 C ATOM 1979 CG2 ILE B 206 25.780 14.453 4.564 1.00 0.00 C ATOM 1980 CD1 ILE B 206 23.208 13.301 5.713 1.00 0.00 C ATOM 0 H ILE B 206 25.728 15.511 8.737 1.00 0.00 H new ATOM 0 HA ILE B 206 27.321 14.380 6.541 1.00 0.00 H new ATOM 0 HB ILE B 206 24.634 15.608 6.013 1.00 0.00 H new ATOM 0 HG12 ILE B 206 25.104 12.639 6.424 1.00 0.00 H new ATOM 0 HG13 ILE B 206 24.239 13.680 7.538 1.00 0.00 H new ATOM 0 HG21 ILE B 206 24.926 14.244 3.919 1.00 0.00 H new ATOM 0 HG22 ILE B 206 26.317 15.322 4.184 1.00 0.00 H new ATOM 0 HG23 ILE B 206 26.447 13.591 4.574 1.00 0.00 H new ATOM 0 HD11 ILE B 206 22.688 12.434 6.120 1.00 0.00 H new ATOM 0 HD12 ILE B 206 22.568 14.179 5.795 1.00 0.00 H new ATOM 0 HD13 ILE B 206 23.446 13.122 4.664 1.00 0.00 H new ATOM 1992 N ASP B 207 27.529 16.899 5.814 1.00 0.00 N ATOM 1993 CA ASP B 207 27.979 18.273 5.674 1.00 0.00 C ATOM 1994 C ASP B 207 27.003 19.105 4.860 1.00 0.00 C ATOM 1995 O ASP B 207 27.104 20.325 4.803 1.00 0.00 O ATOM 1996 CB ASP B 207 29.340 18.240 4.993 1.00 0.00 C ATOM 1997 CG ASP B 207 30.033 19.584 4.921 1.00 0.00 C ATOM 1998 OD1 ASP B 207 30.630 20.013 5.937 1.00 0.00 O1- ATOM 1999 OD2 ASP B 207 30.038 20.218 3.843 1.00 0.00 O ATOM 0 H ASP B 207 27.849 16.281 5.068 1.00 0.00 H new ATOM 0 HA ASP B 207 28.044 18.739 6.657 1.00 0.00 H new ATOM 0 HB2 ASP B 207 29.983 17.541 5.527 1.00 0.00 H new ATOM 0 HB3 ASP B 207 29.218 17.853 3.982 1.00 0.00 H new ATOM 2004 N ILE B 208 26.013 18.448 4.293 1.00 0.00 N ATOM 2005 CA ILE B 208 25.141 19.108 3.353 1.00 0.00 C ATOM 2006 C ILE B 208 24.084 19.934 4.066 1.00 0.00 C ATOM 2007 O ILE B 208 24.213 21.137 4.173 1.00 0.00 O ATOM 2008 CB ILE B 208 24.413 18.126 2.417 1.00 0.00 C ATOM 2009 CG1 ILE B 208 25.315 16.983 1.977 1.00 0.00 C ATOM 2010 CG2 ILE B 208 23.960 18.890 1.199 1.00 0.00 C ATOM 2011 CD1 ILE B 208 24.576 15.917 1.182 1.00 0.00 C ATOM 0 H ILE B 208 25.796 17.467 4.466 1.00 0.00 H new ATOM 0 HA ILE B 208 25.794 19.747 2.759 1.00 0.00 H new ATOM 0 HB ILE B 208 23.570 17.693 2.956 1.00 0.00 H new ATOM 0 HG12 ILE B 208 26.129 17.382 1.371 1.00 0.00 H new ATOM 0 HG13 ILE B 208 25.767 16.525 2.856 1.00 0.00 H new ATOM 0 HG21 ILE B 208 23.440 18.215 0.519 1.00 0.00 H new ATOM 0 HG22 ILE B 208 23.285 19.691 1.502 1.00 0.00 H new ATOM 0 HG23 ILE B 208 24.827 19.317 0.694 1.00 0.00 H new ATOM 0 HD11 ILE B 208 25.272 15.128 0.896 1.00 0.00 H new ATOM 0 HD12 ILE B 208 23.779 15.494 1.794 1.00 0.00 H new ATOM 0 HD13 ILE B 208 24.146 16.364 0.286 1.00 0.00 H new ATOM 2023 N MET B 209 23.053 19.239 4.590 1.00 0.00 N ATOM 2024 CA MET B 209 21.856 19.871 5.211 1.00 0.00 C ATOM 2025 C MET B 209 21.022 20.665 4.137 1.00 0.00 C ATOM 2026 O MET B 209 21.560 21.081 3.106 1.00 0.00 O ATOM 2027 CB MET B 209 22.251 20.760 6.419 1.00 0.00 C ATOM 2028 CG MET B 209 23.002 20.037 7.563 1.00 0.00 C ATOM 2029 SD MET B 209 21.970 19.114 8.761 1.00 0.00 S ATOM 2030 CE MET B 209 21.348 17.725 7.820 1.00 0.00 C ATOM 0 H MET B 209 23.021 18.220 4.597 1.00 0.00 H new ATOM 0 HA MET B 209 21.215 19.079 5.599 1.00 0.00 H new ATOM 0 HB2 MET B 209 22.876 21.577 6.057 1.00 0.00 H new ATOM 0 HB3 MET B 209 21.346 21.208 6.829 1.00 0.00 H new ATOM 0 HG2 MET B 209 23.713 19.341 7.118 1.00 0.00 H new ATOM 0 HG3 MET B 209 23.582 20.778 8.112 1.00 0.00 H new ATOM 0 HE1 MET B 209 21.275 16.851 8.467 1.00 0.00 H new ATOM 0 HE2 MET B 209 20.362 17.966 7.424 1.00 0.00 H new ATOM 0 HE3 MET B 209 22.028 17.511 6.995 1.00 0.00 H new ATOM 2040 N PRO B 210 19.694 20.816 4.325 1.00 0.00 N ATOM 2041 CA PRO B 210 18.824 21.525 3.343 1.00 0.00 C ATOM 2042 C PRO B 210 18.976 23.059 3.365 1.00 0.00 C ATOM 2043 O PRO B 210 19.652 23.611 4.240 1.00 0.00 O ATOM 2044 CB PRO B 210 17.417 21.130 3.789 1.00 0.00 C ATOM 2045 CG PRO B 210 17.536 20.866 5.253 1.00 0.00 C ATOM 2046 CD PRO B 210 18.912 20.299 5.473 1.00 0.00 C ATOM 0 HA PRO B 210 19.077 21.248 2.320 1.00 0.00 H new ATOM 0 HB2 PRO B 210 16.701 21.927 3.589 1.00 0.00 H new ATOM 0 HB3 PRO B 210 17.067 20.246 3.256 1.00 0.00 H new ATOM 0 HG2 PRO B 210 17.398 21.783 5.825 1.00 0.00 H new ATOM 0 HG3 PRO B 210 16.770 20.165 5.585 1.00 0.00 H new ATOM 0 HD2 PRO B 210 19.333 20.627 6.424 1.00 0.00 H new ATOM 0 HD3 PRO B 210 18.898 19.209 5.489 1.00 0.00 H new ATOM 2054 N ASP B 211 18.333 23.728 2.404 1.00 0.00 N ATOM 2055 CA ASP B 211 18.361 25.196 2.293 1.00 0.00 C ATOM 2056 C ASP B 211 16.979 25.727 1.931 1.00 0.00 C ATOM 2057 O ASP B 211 16.823 26.399 0.898 1.00 0.00 O ATOM 2058 CB ASP B 211 19.353 25.717 1.216 1.00 0.00 C ATOM 2059 CG ASP B 211 20.812 25.494 1.503 1.00 0.00 C ATOM 2060 OD1 ASP B 211 21.393 26.213 2.351 1.00 0.00 O ATOM 2061 OD2 ASP B 211 21.438 24.650 0.829 1.00 0.00 O1- ATOM 0 H ASP B 211 17.778 23.272 1.680 1.00 0.00 H new ATOM 0 HA ASP B 211 18.689 25.554 3.269 1.00 0.00 H new ATOM 0 HB2 ASP B 211 19.112 25.239 0.267 1.00 0.00 H new ATOM 0 HB3 ASP B 211 19.188 26.786 1.085 1.00 0.00 H new ATOM 2066 N PHE B 212 15.974 25.355 2.710 1.00 0.00 N ATOM 2067 CA PHE B 212 14.587 25.870 2.560 1.00 0.00 C ATOM 2068 C PHE B 212 14.545 27.391 2.277 1.00 0.00 C ATOM 2069 O PHE B 212 14.903 28.192 3.127 1.00 0.00 O ATOM 2070 CB PHE B 212 13.766 25.616 3.832 1.00 0.00 C ATOM 2071 CG PHE B 212 13.488 24.186 4.171 1.00 0.00 C ATOM 2072 CD1 PHE B 212 14.372 23.452 4.940 1.00 0.00 C ATOM 2073 CD2 PHE B 212 12.320 23.584 3.742 1.00 0.00 C ATOM 2074 CE1 PHE B 212 14.095 22.146 5.269 1.00 0.00 C ATOM 2075 CE2 PHE B 212 12.040 22.281 4.073 1.00 0.00 C ATOM 2076 CZ PHE B 212 12.925 21.564 4.833 1.00 0.00 C ATOM 0 H PHE B 212 16.080 24.685 3.472 1.00 0.00 H new ATOM 0 HA PHE B 212 14.165 25.334 1.710 1.00 0.00 H new ATOM 0 HB2 PHE B 212 14.290 26.071 4.673 1.00 0.00 H new ATOM 0 HB3 PHE B 212 12.813 26.135 3.732 1.00 0.00 H new ATOM 0 HD1 PHE B 212 15.288 23.908 5.285 1.00 0.00 H new ATOM 0 HD2 PHE B 212 11.620 24.144 3.140 1.00 0.00 H new ATOM 0 HE1 PHE B 212 14.792 21.578 5.867 1.00 0.00 H new ATOM 0 HE2 PHE B 212 11.123 21.822 3.734 1.00 0.00 H new ATOM 0 HZ PHE B 212 12.705 20.539 5.091 1.00 0.00 H new ATOM 2086 N SER B 213 14.143 27.745 1.064 1.00 0.00 N ATOM 2087 CA SER B 213 13.970 29.119 0.613 1.00 0.00 C ATOM 2088 C SER B 213 13.460 29.058 -0.832 1.00 0.00 C ATOM 2089 O SER B 213 13.642 28.032 -1.470 1.00 0.00 O ATOM 2090 CB SER B 213 15.321 29.868 0.670 1.00 0.00 C ATOM 2091 OG SER B 213 16.333 29.137 -0.018 1.00 0.00 O ATOM 0 H SER B 213 13.921 27.060 0.342 1.00 0.00 H new ATOM 0 HA SER B 213 13.264 29.652 1.250 1.00 0.00 H new ATOM 0 HB2 SER B 213 15.213 30.857 0.224 1.00 0.00 H new ATOM 0 HB3 SER B 213 15.616 30.017 1.709 1.00 0.00 H new ATOM 0 HG SER B 213 16.489 28.285 0.440 1.00 0.00 H new ATOM 2097 N PRO B 214 12.749 30.073 -1.336 1.00 0.00 N ATOM 2098 CA PRO B 214 12.352 30.118 -2.739 1.00 0.00 C ATOM 2099 C PRO B 214 13.362 30.901 -3.584 1.00 0.00 C ATOM 2100 O PRO B 214 14.014 31.838 -3.088 1.00 0.00 O ATOM 2101 CB PRO B 214 11.028 30.879 -2.708 1.00 0.00 C ATOM 2102 CG PRO B 214 11.029 31.672 -1.426 1.00 0.00 C ATOM 2103 CD PRO B 214 12.217 31.223 -0.593 1.00 0.00 C ATOM 0 HA PRO B 214 12.286 29.122 -3.177 1.00 0.00 H new ATOM 0 HB2 PRO B 214 10.937 31.537 -3.572 1.00 0.00 H new ATOM 0 HB3 PRO B 214 10.183 30.191 -2.740 1.00 0.00 H new ATOM 0 HG2 PRO B 214 11.095 32.739 -1.639 1.00 0.00 H new ATOM 0 HG3 PRO B 214 10.099 31.513 -0.880 1.00 0.00 H new ATOM 0 HD2 PRO B 214 12.960 32.015 -0.495 1.00 0.00 H new ATOM 0 HD3 PRO B 214 11.915 30.943 0.416 1.00 0.00 H new ATOM 2111 N SER B 215 13.547 30.509 -4.802 1.00 0.00 N ATOM 2112 CA SER B 215 14.385 31.245 -5.678 1.00 0.00 C ATOM 2113 C SER B 215 13.501 32.239 -6.420 1.00 0.00 C ATOM 2114 O SER B 215 12.515 31.866 -7.004 1.00 0.00 O ATOM 2115 CB SER B 215 15.090 30.323 -6.654 1.00 0.00 C ATOM 2116 OG SER B 215 15.305 29.076 -6.054 1.00 0.00 O ATOM 0 H SER B 215 13.124 29.676 -5.211 1.00 0.00 H new ATOM 0 HA SER B 215 15.160 31.765 -5.115 1.00 0.00 H new ATOM 0 HB2 SER B 215 14.490 30.205 -7.556 1.00 0.00 H new ATOM 0 HB3 SER B 215 16.041 30.759 -6.959 1.00 0.00 H new ATOM 0 HG SER B 215 14.460 28.580 -6.018 1.00 0.00 H new ATOM 2122 N GLY B 216 13.886 33.458 -6.406 1.00 0.00 N ATOM 2123 CA GLY B 216 13.154 34.584 -6.984 1.00 0.00 C ATOM 2124 C GLY B 216 12.903 34.519 -8.489 1.00 0.00 C ATOM 2125 O GLY B 216 12.377 35.468 -9.065 1.00 0.00 O ATOM 0 H GLY B 216 14.765 33.742 -5.974 1.00 0.00 H new ATOM 0 HA2 GLY B 216 12.192 34.664 -6.479 1.00 0.00 H new ATOM 0 HA3 GLY B 216 13.705 35.499 -6.767 1.00 0.00 H new ATOM 2129 N LEU B 217 13.273 33.418 -9.142 1.00 0.00 N ATOM 2130 CA LEU B 217 12.935 33.250 -10.555 1.00 0.00 C ATOM 2131 C LEU B 217 11.452 32.987 -10.578 1.00 0.00 C ATOM 2132 O LEU B 217 10.707 33.458 -11.426 1.00 0.00 O ATOM 2133 CB LEU B 217 13.563 31.985 -11.172 1.00 0.00 C ATOM 2134 CG LEU B 217 14.828 31.404 -10.557 1.00 0.00 C ATOM 2135 CD1 LEU B 217 15.213 30.144 -11.291 1.00 0.00 C ATOM 2136 CD2 LEU B 217 15.965 32.377 -10.603 1.00 0.00 C ATOM 0 H LEU B 217 13.795 32.646 -8.728 1.00 0.00 H new ATOM 0 HA LEU B 217 13.280 34.127 -11.103 1.00 0.00 H new ATOM 0 HB2 LEU B 217 12.804 31.203 -11.159 1.00 0.00 H new ATOM 0 HB3 LEU B 217 13.778 32.203 -12.218 1.00 0.00 H new ATOM 0 HG LEU B 217 14.620 31.181 -9.511 1.00 0.00 H new ATOM 0 HD11 LEU B 217 16.119 29.728 -10.850 1.00 0.00 H new ATOM 0 HD12 LEU B 217 14.405 29.416 -11.213 1.00 0.00 H new ATOM 0 HD13 LEU B 217 15.394 30.375 -12.341 1.00 0.00 H new ATOM 0 HD21 LEU B 217 16.849 31.925 -10.154 1.00 0.00 H new ATOM 0 HD22 LEU B 217 16.178 32.639 -11.639 1.00 0.00 H new ATOM 0 HD23 LEU B 217 15.697 33.276 -10.049 1.00 0.00 H new ATOM 2148 N LEU B 218 11.077 32.269 -9.556 1.00 0.00 N ATOM 2149 CA LEU B 218 9.798 31.680 -9.321 1.00 0.00 C ATOM 2150 C LEU B 218 8.644 32.670 -9.470 1.00 0.00 C ATOM 2151 O LEU B 218 7.660 32.397 -10.155 1.00 0.00 O ATOM 2152 CB LEU B 218 9.842 31.146 -7.902 1.00 0.00 C ATOM 2153 CG LEU B 218 9.093 29.833 -7.650 1.00 0.00 C ATOM 2154 CD1 LEU B 218 9.565 28.753 -8.588 1.00 0.00 C ATOM 2155 CD2 LEU B 218 9.303 29.379 -6.248 1.00 0.00 C ATOM 0 H LEU B 218 11.726 32.065 -8.796 1.00 0.00 H new ATOM 0 HA LEU B 218 9.612 30.902 -10.061 1.00 0.00 H new ATOM 0 HB2 LEU B 218 10.886 31.004 -7.621 1.00 0.00 H new ATOM 0 HB3 LEU B 218 9.433 31.907 -7.237 1.00 0.00 H new ATOM 0 HG LEU B 218 8.033 30.019 -7.824 1.00 0.00 H new ATOM 0 HD11 LEU B 218 9.017 27.832 -8.388 1.00 0.00 H new ATOM 0 HD12 LEU B 218 9.389 29.063 -9.618 1.00 0.00 H new ATOM 0 HD13 LEU B 218 10.631 28.581 -8.438 1.00 0.00 H new ATOM 0 HD21 LEU B 218 8.765 28.445 -6.083 1.00 0.00 H new ATOM 0 HD22 LEU B 218 10.367 29.221 -6.072 1.00 0.00 H new ATOM 0 HD23 LEU B 218 8.931 30.138 -5.560 1.00 0.00 H new ATOM 2167 N GLU B 219 8.791 33.819 -8.861 1.00 0.00 N ATOM 2168 CA GLU B 219 7.730 34.807 -8.831 1.00 0.00 C ATOM 2169 C GLU B 219 7.665 35.646 -10.112 1.00 0.00 C ATOM 2170 O GLU B 219 6.731 36.411 -10.313 1.00 0.00 O ATOM 2171 CB GLU B 219 7.865 35.693 -7.598 1.00 0.00 C ATOM 2172 CG GLU B 219 9.178 36.451 -7.506 1.00 0.00 C ATOM 2173 CD GLU B 219 9.255 37.293 -6.266 1.00 0.00 C ATOM 2174 OE1 GLU B 219 8.491 38.283 -6.162 1.00 0.00 O1- ATOM 2175 OE2 GLU B 219 10.060 36.979 -5.363 1.00 0.00 O ATOM 0 H GLU B 219 9.642 34.100 -8.373 1.00 0.00 H new ATOM 0 HA GLU B 219 6.786 34.264 -8.773 1.00 0.00 H new ATOM 0 HB2 GLU B 219 7.045 36.411 -7.591 1.00 0.00 H new ATOM 0 HB3 GLU B 219 7.755 35.074 -6.708 1.00 0.00 H new ATOM 0 HG2 GLU B 219 10.007 35.743 -7.516 1.00 0.00 H new ATOM 0 HG3 GLU B 219 9.292 37.087 -8.384 1.00 0.00 H new ATOM 2182 N LEU B 220 8.653 35.513 -10.957 1.00 0.00 N ATOM 2183 CA LEU B 220 8.695 36.270 -12.194 1.00 0.00 C ATOM 2184 C LEU B 220 8.297 35.390 -13.366 1.00 0.00 C ATOM 2185 O LEU B 220 7.490 35.776 -14.213 1.00 0.00 O ATOM 2186 CB LEU B 220 10.107 36.821 -12.418 1.00 0.00 C ATOM 2187 CG LEU B 220 10.641 37.768 -11.341 1.00 0.00 C ATOM 2188 CD1 LEU B 220 12.085 38.120 -11.624 1.00 0.00 C ATOM 2189 CD2 LEU B 220 9.796 39.031 -11.271 1.00 0.00 C ATOM 0 H LEU B 220 9.446 34.887 -10.816 1.00 0.00 H new ATOM 0 HA LEU B 220 7.991 37.099 -12.121 1.00 0.00 H new ATOM 0 HB2 LEU B 220 10.794 35.979 -12.505 1.00 0.00 H new ATOM 0 HB3 LEU B 220 10.123 37.345 -13.374 1.00 0.00 H new ATOM 0 HG LEU B 220 10.584 37.262 -10.378 1.00 0.00 H new ATOM 0 HD11 LEU B 220 12.453 38.794 -10.851 1.00 0.00 H new ATOM 0 HD12 LEU B 220 12.687 37.211 -11.630 1.00 0.00 H new ATOM 0 HD13 LEU B 220 12.157 38.609 -12.596 1.00 0.00 H new ATOM 0 HD21 LEU B 220 10.192 39.691 -10.499 1.00 0.00 H new ATOM 0 HD22 LEU B 220 9.823 39.541 -12.234 1.00 0.00 H new ATOM 0 HD23 LEU B 220 8.766 38.767 -11.029 1.00 0.00 H new ATOM 2201 N GLU B 221 8.837 34.195 -13.367 1.00 0.00 N ATOM 2202 CA GLU B 221 8.681 33.220 -14.448 1.00 0.00 C ATOM 2203 C GLU B 221 7.326 32.530 -14.443 1.00 0.00 C ATOM 2204 O GLU B 221 7.008 31.789 -15.373 1.00 0.00 O ATOM 2205 CB GLU B 221 9.775 32.191 -14.307 1.00 0.00 C ATOM 2206 CG GLU B 221 11.161 32.753 -14.533 1.00 0.00 C ATOM 2207 CD GLU B 221 11.415 33.082 -15.974 1.00 0.00 C ATOM 2208 OE1 GLU B 221 11.608 32.144 -16.780 1.00 0.00 O1- ATOM 2209 OE2 GLU B 221 11.425 34.277 -16.338 1.00 0.00 O ATOM 0 H GLU B 221 9.415 33.853 -12.600 1.00 0.00 H new ATOM 0 HA GLU B 221 8.748 33.754 -15.396 1.00 0.00 H new ATOM 0 HB2 GLU B 221 9.726 31.754 -13.310 1.00 0.00 H new ATOM 0 HB3 GLU B 221 9.598 31.384 -15.018 1.00 0.00 H new ATOM 0 HG2 GLU B 221 11.289 33.652 -13.930 1.00 0.00 H new ATOM 0 HG3 GLU B 221 11.903 32.032 -14.191 1.00 0.00 H new ATOM 2216 N SER B 222 6.573 32.770 -13.403 1.00 0.00 N ATOM 2217 CA SER B 222 5.251 32.210 -13.203 1.00 0.00 C ATOM 2218 C SER B 222 4.339 32.414 -14.430 1.00 0.00 C ATOM 2219 O SER B 222 3.911 33.556 -14.682 1.00 0.00 O ATOM 2220 CB SER B 222 4.644 32.834 -11.944 1.00 0.00 C ATOM 2221 OG SER B 222 4.735 34.258 -11.996 1.00 0.00 O ATOM 2222 OXT SER B 222 4.028 31.426 -15.139 1.00 0.00 O1- ATOM 0 H SER B 222 6.868 33.381 -12.642 1.00 0.00 H new ATOM 0 HA SER B 222 5.339 31.131 -13.074 1.00 0.00 H new ATOM 0 HB2 SER B 222 3.600 32.534 -11.850 1.00 0.00 H new ATOM 0 HB3 SER B 222 5.164 32.463 -11.061 1.00 0.00 H new ATOM 0 HG SER B 222 4.486 34.569 -12.891 1.00 0.00 H new TER 2228 SER B 222 ATOM 2229 N GLY C 300 -8.680 14.957 15.088 1.00 0.00 N ATOM 2230 CA GLY C 300 -7.830 14.429 14.019 1.00 0.00 C ATOM 2231 C GLY C 300 -7.367 15.539 13.124 1.00 0.00 C ATOM 2232 O GLY C 300 -7.931 16.630 13.156 1.00 0.00 O ATOM 0 HA2 GLY C 300 -6.969 13.917 14.449 1.00 0.00 H new ATOM 0 HA3 GLY C 300 -8.382 13.691 13.438 1.00 0.00 H new ATOM 2238 N SER C 301 -6.358 15.288 12.317 1.00 0.00 N ATOM 2239 CA SER C 301 -5.844 16.294 11.409 1.00 0.00 C ATOM 2240 C SER C 301 -6.614 16.264 10.076 1.00 0.00 C ATOM 2241 O SER C 301 -6.043 16.072 9.004 1.00 0.00 O ATOM 2242 CB SER C 301 -4.334 16.104 11.207 1.00 0.00 C ATOM 2243 OG SER C 301 -3.643 16.162 12.467 1.00 0.00 O ATOM 0 H SER C 301 -5.874 14.391 12.271 1.00 0.00 H new ATOM 0 HA SER C 301 -5.996 17.281 11.846 1.00 0.00 H new ATOM 0 HB2 SER C 301 -4.144 15.145 10.726 1.00 0.00 H new ATOM 0 HB3 SER C 301 -3.951 16.876 10.540 1.00 0.00 H new ATOM 0 HG SER C 301 -2.712 15.881 12.343 1.00 0.00 H new ATOM 2249 N TYR C 302 -7.928 16.377 10.185 1.00 0.00 N ATOM 2250 CA TYR C 302 -8.815 16.439 9.049 1.00 0.00 C ATOM 2251 C TYR C 302 -9.559 17.743 9.164 1.00 0.00 C ATOM 2252 O TYR C 302 -10.390 17.914 10.066 1.00 0.00 O ATOM 2253 CB TYR C 302 -9.789 15.247 9.052 1.00 0.00 C ATOM 2254 CG TYR C 302 -9.089 13.903 9.138 1.00 0.00 C ATOM 2255 CD1 TYR C 302 -8.564 13.287 8.011 1.00 0.00 C ATOM 2256 CD2 TYR C 302 -8.933 13.266 10.360 1.00 0.00 C ATOM 2257 CE1 TYR C 302 -7.908 12.070 8.106 1.00 0.00 C ATOM 2258 CE2 TYR C 302 -8.280 12.065 10.465 1.00 0.00 C ATOM 2259 CZ TYR C 302 -7.771 11.467 9.342 1.00 0.00 C ATOM 2260 OH TYR C 302 -7.101 10.267 9.461 1.00 0.00 O ATOM 0 H TYR C 302 -8.410 16.429 11.083 1.00 0.00 H new ATOM 0 HA TYR C 302 -8.261 16.386 8.112 1.00 0.00 H new ATOM 0 HB2 TYR C 302 -10.473 15.347 9.894 1.00 0.00 H new ATOM 0 HB3 TYR C 302 -10.393 15.277 8.145 1.00 0.00 H new ATOM 0 HD1 TYR C 302 -8.668 13.762 7.047 1.00 0.00 H new ATOM 0 HD2 TYR C 302 -9.335 13.727 11.250 1.00 0.00 H new ATOM 0 HE1 TYR C 302 -7.507 11.597 7.222 1.00 0.00 H new ATOM 0 HE2 TYR C 302 -8.167 11.592 11.429 1.00 0.00 H new ATOM 0 HH TYR C 302 -7.097 9.986 10.400 1.00 0.00 H new ATOM 2270 N ASP C 303 -9.260 18.658 8.302 1.00 0.00 N ATOM 2271 CA ASP C 303 -9.790 20.010 8.414 1.00 0.00 C ATOM 2272 C ASP C 303 -11.018 20.245 7.555 1.00 0.00 C ATOM 2273 O ASP C 303 -11.944 20.949 7.968 1.00 0.00 O ATOM 2274 CB ASP C 303 -8.698 21.024 8.071 1.00 0.00 C ATOM 2275 CG ASP C 303 -9.189 22.448 8.027 1.00 0.00 C ATOM 2276 OD1 ASP C 303 -9.350 23.083 9.099 1.00 0.00 O1- ATOM 2277 OD2 ASP C 303 -9.401 22.970 6.924 1.00 0.00 O ATOM 0 H ASP C 303 -8.648 18.509 7.500 1.00 0.00 H new ATOM 0 HA ASP C 303 -10.110 20.141 9.448 1.00 0.00 H new ATOM 0 HB2 ASP C 303 -7.898 20.947 8.807 1.00 0.00 H new ATOM 0 HB3 ASP C 303 -8.266 20.767 7.104 1.00 0.00 H new ATOM 2282 N LYS C 304 -11.048 19.646 6.391 1.00 0.00 N ATOM 2283 CA LYS C 304 -12.127 19.890 5.453 1.00 0.00 C ATOM 2284 C LYS C 304 -13.365 19.096 5.803 1.00 0.00 C ATOM 2285 O LYS C 304 -13.321 17.869 5.880 1.00 0.00 O ATOM 2286 CB LYS C 304 -11.697 19.589 4.013 1.00 0.00 C ATOM 2287 CG LYS C 304 -10.478 20.373 3.553 1.00 0.00 C ATOM 2288 CD LYS C 304 -10.658 21.899 3.617 1.00 0.00 C ATOM 2289 CE LYS C 304 -11.543 22.482 2.505 1.00 0.00 C ATOM 2290 NZ LYS C 304 -12.989 22.132 2.582 1.00 0.00 N1+ ATOM 0 H LYS C 304 -10.341 18.986 6.066 1.00 0.00 H new ATOM 0 HA LYS C 304 -12.372 20.950 5.526 1.00 0.00 H new ATOM 0 HB2 LYS C 304 -11.486 18.523 3.923 1.00 0.00 H new ATOM 0 HB3 LYS C 304 -12.529 19.806 3.344 1.00 0.00 H new ATOM 0 HG2 LYS C 304 -9.624 20.092 4.169 1.00 0.00 H new ATOM 0 HG3 LYS C 304 -10.240 20.088 2.528 1.00 0.00 H new ATOM 0 HD2 LYS C 304 -11.090 22.161 4.583 1.00 0.00 H new ATOM 0 HD3 LYS C 304 -9.677 22.371 3.568 1.00 0.00 H new ATOM 0 HE2 LYS C 304 -11.449 23.568 2.523 1.00 0.00 H new ATOM 0 HE3 LYS C 304 -11.157 22.144 1.543 1.00 0.00 H new ATOM 0 HZ1 LYS C 304 -13.552 22.878 2.126 1.00 0.00 H new ATOM 0 HZ2 LYS C 304 -13.154 21.228 2.095 1.00 0.00 H new ATOM 0 HZ3 LYS C 304 -13.273 22.045 3.579 1.00 0.00 H new ATOM 2304 N PRO C 305 -14.487 19.784 6.049 1.00 0.00 N ATOM 2305 CA PRO C 305 -15.744 19.123 6.319 1.00 0.00 C ATOM 2306 C PRO C 305 -16.380 18.573 5.038 1.00 0.00 C ATOM 2307 O PRO C 305 -17.094 17.569 5.072 1.00 0.00 O ATOM 2308 CB PRO C 305 -16.616 20.211 6.948 1.00 0.00 C ATOM 2309 CG PRO C 305 -16.039 21.508 6.492 1.00 0.00 C ATOM 2310 CD PRO C 305 -14.591 21.259 6.147 1.00 0.00 C ATOM 0 HA PRO C 305 -15.621 18.259 6.972 1.00 0.00 H new ATOM 0 HB2 PRO C 305 -17.654 20.112 6.631 1.00 0.00 H new ATOM 0 HB3 PRO C 305 -16.607 20.140 8.036 1.00 0.00 H new ATOM 0 HG2 PRO C 305 -16.581 21.886 5.625 1.00 0.00 H new ATOM 0 HG3 PRO C 305 -16.123 22.262 7.274 1.00 0.00 H new ATOM 0 HD2 PRO C 305 -14.317 21.740 5.208 1.00 0.00 H new ATOM 0 HD3 PRO C 305 -13.925 21.655 6.914 1.00 0.00 H new ATOM 2318 N ALA C 306 -16.114 19.222 3.917 1.00 0.00 N ATOM 2319 CA ALA C 306 -16.633 18.805 2.631 1.00 0.00 C ATOM 2320 C ALA C 306 -15.628 19.185 1.544 1.00 0.00 C ATOM 2321 O ALA C 306 -14.731 20.007 1.799 1.00 0.00 O ATOM 2322 CB ALA C 306 -17.985 19.466 2.372 1.00 0.00 C ATOM 0 H ALA C 306 -15.529 20.057 3.876 1.00 0.00 H new ATOM 0 HA ALA C 306 -16.779 17.725 2.623 1.00 0.00 H new ATOM 0 HB1 ALA C 306 -18.367 19.146 1.402 1.00 0.00 H new ATOM 0 HB2 ALA C 306 -18.688 19.175 3.153 1.00 0.00 H new ATOM 0 HB3 ALA C 306 -17.867 20.550 2.376 1.00 0.00 H new ATOM 2328 N PRO C 307 -15.704 18.570 0.348 1.00 0.00 N ATOM 2329 CA PRO C 307 -14.826 18.890 -0.754 1.00 0.00 C ATOM 2330 C PRO C 307 -15.445 19.844 -1.785 1.00 0.00 C ATOM 2331 O PRO C 307 -16.389 19.501 -2.517 1.00 0.00 O ATOM 2332 CB PRO C 307 -14.565 17.515 -1.383 1.00 0.00 C ATOM 2333 CG PRO C 307 -15.707 16.626 -0.932 1.00 0.00 C ATOM 2334 CD PRO C 307 -16.586 17.453 -0.021 1.00 0.00 C ATOM 0 HA PRO C 307 -13.934 19.417 -0.416 1.00 0.00 H new ATOM 0 HB2 PRO C 307 -14.530 17.584 -2.470 1.00 0.00 H new ATOM 0 HB3 PRO C 307 -13.606 17.113 -1.058 1.00 0.00 H new ATOM 0 HG2 PRO C 307 -16.274 16.264 -1.789 1.00 0.00 H new ATOM 0 HG3 PRO C 307 -15.328 15.749 -0.408 1.00 0.00 H new ATOM 0 HD2 PRO C 307 -17.486 17.798 -0.530 1.00 0.00 H new ATOM 0 HD3 PRO C 307 -16.911 16.887 0.852 1.00 0.00 H new ATOM 2342 N GLU C 308 -14.938 21.040 -1.802 1.00 0.00 N ATOM 2343 CA GLU C 308 -15.271 22.017 -2.816 1.00 0.00 C ATOM 2344 C GLU C 308 -14.382 21.730 -4.011 1.00 0.00 C ATOM 2345 O GLU C 308 -14.793 21.829 -5.165 1.00 0.00 O ATOM 2346 CB GLU C 308 -15.080 23.474 -2.314 1.00 0.00 C ATOM 2347 CG GLU C 308 -13.704 23.787 -1.713 1.00 0.00 C ATOM 2348 CD GLU C 308 -13.503 23.198 -0.353 1.00 0.00 C ATOM 2349 OE1 GLU C 308 -13.041 22.051 -0.259 1.00 0.00 O ATOM 2350 OE2 GLU C 308 -13.833 23.850 0.653 1.00 0.00 O1- ATOM 0 H GLU C 308 -14.272 21.377 -1.107 1.00 0.00 H new ATOM 0 HA GLU C 308 -16.325 21.934 -3.081 1.00 0.00 H new ATOM 0 HB2 GLU C 308 -15.257 24.154 -3.148 1.00 0.00 H new ATOM 0 HB3 GLU C 308 -15.842 23.685 -1.564 1.00 0.00 H new ATOM 0 HG2 GLU C 308 -12.930 23.411 -2.382 1.00 0.00 H new ATOM 0 HG3 GLU C 308 -13.578 24.868 -1.655 1.00 0.00 H new ATOM 2357 N ASN C 309 -13.166 21.343 -3.700 1.00 0.00 N ATOM 2358 CA ASN C 309 -12.216 20.883 -4.677 1.00 0.00 C ATOM 2359 C ASN C 309 -12.499 19.412 -4.847 1.00 0.00 C ATOM 2360 O ASN C 309 -12.738 18.722 -3.854 1.00 0.00 O ATOM 2361 CB ASN C 309 -10.763 21.098 -4.155 1.00 0.00 C ATOM 2362 CG ASN C 309 -9.641 20.647 -5.120 1.00 0.00 C ATOM 2363 OD1 ASN C 309 -9.789 19.713 -5.903 1.00 0.00 O ATOM 2364 ND2 ASN C 309 -8.503 21.275 -5.022 1.00 0.00 N ATOM 0 H ASN C 309 -12.807 21.340 -2.745 1.00 0.00 H new ATOM 0 HA ASN C 309 -12.304 21.424 -5.619 1.00 0.00 H new ATOM 0 HB2 ASN C 309 -10.626 22.157 -3.935 1.00 0.00 H new ATOM 0 HB3 ASN C 309 -10.649 20.559 -3.214 1.00 0.00 H new ATOM 0 HD21 ASN C 309 -7.713 20.993 -5.603 1.00 0.00 H new ATOM 0 HD22 ASN C 309 -8.402 22.048 -4.365 1.00 0.00 H new ATOM 2371 N ARG C 310 -12.489 18.940 -6.074 1.00 0.00 N ATOM 2372 CA ARG C 310 -12.746 17.539 -6.401 1.00 0.00 C ATOM 2373 C ARG C 310 -11.811 16.597 -5.625 1.00 0.00 C ATOM 2374 O ARG C 310 -12.215 15.529 -5.187 1.00 0.00 O ATOM 2375 CB ARG C 310 -12.580 17.351 -7.907 1.00 0.00 C ATOM 2376 CG ARG C 310 -12.614 15.914 -8.412 1.00 0.00 C ATOM 2377 CD ARG C 310 -12.443 15.891 -9.919 1.00 0.00 C ATOM 2378 NE ARG C 310 -11.270 16.675 -10.335 1.00 0.00 N ATOM 2379 CZ ARG C 310 -11.219 17.452 -11.425 1.00 0.00 C ATOM 2380 NH1 ARG C 310 -12.215 17.448 -12.309 1.00 0.00 N1+ ATOM 2381 NH2 ARG C 310 -10.166 18.215 -11.636 1.00 0.00 N ATOM 0 H ARG C 310 -12.300 19.521 -6.891 1.00 0.00 H new ATOM 0 HA ARG C 310 -13.764 17.285 -6.107 1.00 0.00 H new ATOM 0 HB2 ARG C 310 -13.368 17.910 -8.411 1.00 0.00 H new ATOM 0 HB3 ARG C 310 -11.631 17.797 -8.206 1.00 0.00 H new ATOM 0 HG2 ARG C 310 -11.821 15.334 -7.939 1.00 0.00 H new ATOM 0 HG3 ARG C 310 -13.559 15.445 -8.138 1.00 0.00 H new ATOM 0 HD2 ARG C 310 -12.334 14.861 -10.259 1.00 0.00 H new ATOM 0 HD3 ARG C 310 -13.338 16.291 -10.395 1.00 0.00 H new ATOM 0 HE ARG C 310 -10.435 16.623 -9.751 1.00 0.00 H new ATOM 0 HH11 ARG C 310 -13.027 16.849 -12.160 1.00 0.00 H new ATOM 0 HH12 ARG C 310 -12.166 18.044 -13.136 1.00 0.00 H new ATOM 0 HH21 ARG C 310 -9.393 18.213 -10.971 1.00 0.00 H new ATOM 0 HH22 ARG C 310 -10.124 18.808 -12.465 1.00 0.00 H new ATOM 2395 N PHE C 311 -10.582 17.021 -5.434 1.00 0.00 N ATOM 2396 CA PHE C 311 -9.601 16.211 -4.730 1.00 0.00 C ATOM 2397 C PHE C 311 -9.580 16.505 -3.220 1.00 0.00 C ATOM 2398 O PHE C 311 -8.785 15.914 -2.490 1.00 0.00 O ATOM 2399 CB PHE C 311 -8.203 16.389 -5.340 1.00 0.00 C ATOM 2400 CG PHE C 311 -7.992 15.709 -6.678 1.00 0.00 C ATOM 2401 CD1 PHE C 311 -8.606 16.173 -7.832 1.00 0.00 C ATOM 2402 CD2 PHE C 311 -7.152 14.616 -6.777 1.00 0.00 C ATOM 2403 CE1 PHE C 311 -8.383 15.552 -9.053 1.00 0.00 C ATOM 2404 CE2 PHE C 311 -6.929 13.993 -7.993 1.00 0.00 C ATOM 2405 CZ PHE C 311 -7.542 14.460 -9.129 1.00 0.00 C ATOM 0 H PHE C 311 -10.233 17.924 -5.755 1.00 0.00 H new ATOM 0 HA PHE C 311 -9.901 15.170 -4.851 1.00 0.00 H new ATOM 0 HB2 PHE C 311 -8.008 17.455 -5.457 1.00 0.00 H new ATOM 0 HB3 PHE C 311 -7.465 16.006 -4.635 1.00 0.00 H new ATOM 0 HD1 PHE C 311 -9.265 17.027 -7.780 1.00 0.00 H new ATOM 0 HD2 PHE C 311 -6.661 14.242 -5.891 1.00 0.00 H new ATOM 0 HE1 PHE C 311 -8.868 15.923 -9.944 1.00 0.00 H new ATOM 0 HE2 PHE C 311 -6.272 13.138 -8.048 1.00 0.00 H new ATOM 0 HZ PHE C 311 -7.367 13.975 -10.078 1.00 0.00 H new ATOM 2415 N ALA C 312 -10.464 17.419 -2.767 1.00 0.00 N ATOM 2416 CA ALA C 312 -10.599 17.822 -1.337 1.00 0.00 C ATOM 2417 C ALA C 312 -9.331 18.493 -0.783 1.00 0.00 C ATOM 2418 O ALA C 312 -9.174 18.660 0.427 1.00 0.00 O ATOM 2419 CB ALA C 312 -11.000 16.624 -0.464 1.00 0.00 C ATOM 0 H ALA C 312 -11.114 17.907 -3.384 1.00 0.00 H new ATOM 0 HA ALA C 312 -11.393 18.568 -1.301 1.00 0.00 H new ATOM 0 HB1 ALA C 312 -11.092 16.945 0.574 1.00 0.00 H new ATOM 0 HB2 ALA C 312 -11.956 16.227 -0.807 1.00 0.00 H new ATOM 0 HB3 ALA C 312 -10.238 15.848 -0.538 1.00 0.00 H new ATOM 2425 N ILE C 313 -8.472 18.925 -1.667 1.00 0.00 N ATOM 2426 CA ILE C 313 -7.198 19.499 -1.288 1.00 0.00 C ATOM 2427 C ILE C 313 -7.269 21.010 -1.325 1.00 0.00 C ATOM 2428 O ILE C 313 -7.826 21.571 -2.256 1.00 0.00 O ATOM 2429 CB ILE C 313 -6.104 19.084 -2.286 1.00 0.00 C ATOM 2430 CG1 ILE C 313 -6.025 17.576 -2.422 1.00 0.00 C ATOM 2431 CG2 ILE C 313 -4.753 19.637 -1.861 1.00 0.00 C ATOM 2432 CD1 ILE C 313 -5.139 17.159 -3.553 1.00 0.00 C ATOM 0 H ILE C 313 -8.631 18.891 -2.674 1.00 0.00 H new ATOM 0 HA ILE C 313 -6.967 19.142 -0.284 1.00 0.00 H new ATOM 0 HB ILE C 313 -6.369 19.502 -3.257 1.00 0.00 H new ATOM 0 HG12 ILE C 313 -5.651 17.148 -1.492 1.00 0.00 H new ATOM 0 HG13 ILE C 313 -7.026 17.174 -2.579 1.00 0.00 H new ATOM 0 HG21 ILE C 313 -3.993 19.332 -2.580 1.00 0.00 H new ATOM 0 HG22 ILE C 313 -4.801 20.725 -1.823 1.00 0.00 H new ATOM 0 HG23 ILE C 313 -4.496 19.250 -0.875 1.00 0.00 H new ATOM 0 HD11 ILE C 313 -5.113 16.071 -3.612 1.00 0.00 H new ATOM 0 HD12 ILE C 313 -5.527 17.564 -4.488 1.00 0.00 H new ATOM 0 HD13 ILE C 313 -4.131 17.538 -3.384 1.00 0.00 H new ATOM 2444 N MET C 314 -6.739 21.647 -0.314 1.00 0.00 N ATOM 2445 CA MET C 314 -6.579 23.085 -0.300 1.00 0.00 C ATOM 2446 C MET C 314 -5.102 23.419 -0.133 1.00 0.00 C ATOM 2447 O MET C 314 -4.351 22.588 0.404 1.00 0.00 O ATOM 2448 CB MET C 314 -7.435 23.751 0.787 1.00 0.00 C ATOM 2449 CG MET C 314 -8.946 23.786 0.514 1.00 0.00 C ATOM 2450 SD MET C 314 -9.511 25.021 -0.729 1.00 0.00 S ATOM 2451 CE MET C 314 -8.934 24.371 -2.312 1.00 0.00 C ATOM 0 H MET C 314 -6.403 21.184 0.530 1.00 0.00 H new ATOM 0 HA MET C 314 -6.933 23.486 -1.250 1.00 0.00 H new ATOM 0 HB2 MET C 314 -7.266 23.228 1.728 1.00 0.00 H new ATOM 0 HB3 MET C 314 -7.085 24.774 0.924 1.00 0.00 H new ATOM 0 HG2 MET C 314 -9.258 22.796 0.182 1.00 0.00 H new ATOM 0 HG3 MET C 314 -9.461 23.984 1.454 1.00 0.00 H new ATOM 0 HE1 MET C 314 -9.319 24.991 -3.122 1.00 0.00 H new ATOM 0 HE2 MET C 314 -7.844 24.381 -2.334 1.00 0.00 H new ATOM 0 HE3 MET C 314 -9.290 23.348 -2.437 1.00 0.00 H new ATOM 2461 N PRO C 315 -4.654 24.598 -0.627 1.00 0.00 N ATOM 2462 CA PRO C 315 -3.251 25.050 -0.521 1.00 0.00 C ATOM 2463 C PRO C 315 -2.685 24.970 0.910 1.00 0.00 C ATOM 2464 O PRO C 315 -3.398 25.193 1.896 1.00 0.00 O ATOM 2465 CB PRO C 315 -3.315 26.525 -0.966 1.00 0.00 C ATOM 2466 CG PRO C 315 -4.764 26.862 -1.042 1.00 0.00 C ATOM 2467 CD PRO C 315 -5.461 25.585 -1.355 1.00 0.00 C ATOM 0 HA PRO C 315 -2.594 24.419 -1.120 1.00 0.00 H new ATOM 0 HB2 PRO C 315 -2.800 27.171 -0.255 1.00 0.00 H new ATOM 0 HB3 PRO C 315 -2.830 26.664 -1.932 1.00 0.00 H new ATOM 0 HG2 PRO C 315 -5.118 27.280 -0.100 1.00 0.00 H new ATOM 0 HG3 PRO C 315 -4.952 27.609 -1.813 1.00 0.00 H new ATOM 0 HD2 PRO C 315 -6.496 25.593 -1.015 1.00 0.00 H new ATOM 0 HD3 PRO C 315 -5.479 25.384 -2.426 1.00 0.00 H new ATOM 2475 N GLY C 316 -1.409 24.665 1.005 1.00 0.00 N ATOM 2476 CA GLY C 316 -0.755 24.562 2.281 1.00 0.00 C ATOM 2477 C GLY C 316 -0.189 25.889 2.731 1.00 0.00 C ATOM 2478 O GLY C 316 -0.247 26.879 1.990 1.00 0.00 O ATOM 0 H GLY C 316 -0.804 24.484 0.204 1.00 0.00 H new ATOM 0 HA2 GLY C 316 -1.464 24.199 3.025 1.00 0.00 H new ATOM 0 HA3 GLY C 316 0.047 23.827 2.220 1.00 0.00 H new ATOM 2482 N SER C 317 0.415 25.906 3.902 1.00 0.00 N ATOM 2483 CA SER C 317 0.917 27.134 4.497 1.00 0.00 C ATOM 2484 C SER C 317 2.218 27.642 3.842 1.00 0.00 C ATOM 2485 O SER C 317 2.725 28.714 4.207 1.00 0.00 O ATOM 2486 CB SER C 317 1.089 26.958 6.021 1.00 0.00 C ATOM 2487 OG SER C 317 1.558 28.155 6.646 1.00 0.00 O ATOM 0 H SER C 317 0.573 25.073 4.469 1.00 0.00 H new ATOM 0 HA SER C 317 0.170 27.905 4.309 1.00 0.00 H new ATOM 0 HB2 SER C 317 0.136 26.667 6.463 1.00 0.00 H new ATOM 0 HB3 SER C 317 1.791 26.147 6.216 1.00 0.00 H new ATOM 0 HG SER C 317 2.055 28.692 5.994 1.00 0.00 H new ATOM 2493 N ARG C 318 2.762 26.908 2.891 1.00 0.00 N ATOM 2494 CA ARG C 318 3.977 27.364 2.240 1.00 0.00 C ATOM 2495 C ARG C 318 3.697 27.820 0.825 1.00 0.00 C ATOM 2496 O ARG C 318 4.610 28.157 0.062 1.00 0.00 O ATOM 2497 CB ARG C 318 5.107 26.326 2.325 1.00 0.00 C ATOM 2498 CG ARG C 318 5.486 26.025 3.765 1.00 0.00 C ATOM 2499 CD ARG C 318 6.720 25.153 3.900 1.00 0.00 C ATOM 2500 NE ARG C 318 6.952 24.836 5.317 1.00 0.00 N ATOM 2501 CZ ARG C 318 8.122 24.812 5.962 1.00 0.00 C ATOM 2502 NH1 ARG C 318 9.258 25.117 5.342 1.00 0.00 N1+ ATOM 2503 NH2 ARG C 318 8.139 24.501 7.249 1.00 0.00 N ATOM 0 H ARG C 318 2.395 26.017 2.558 1.00 0.00 H new ATOM 0 HA ARG C 318 4.340 28.235 2.786 1.00 0.00 H new ATOM 0 HB2 ARG C 318 4.794 25.406 1.831 1.00 0.00 H new ATOM 0 HB3 ARG C 318 5.981 26.695 1.788 1.00 0.00 H new ATOM 0 HG2 ARG C 318 5.656 26.964 4.291 1.00 0.00 H new ATOM 0 HG3 ARG C 318 4.648 25.532 4.257 1.00 0.00 H new ATOM 0 HD2 ARG C 318 6.592 24.234 3.328 1.00 0.00 H new ATOM 0 HD3 ARG C 318 7.587 25.667 3.486 1.00 0.00 H new ATOM 0 HE ARG C 318 6.126 24.609 5.870 1.00 0.00 H new ATOM 0 HH11 ARG C 318 9.247 25.376 4.355 1.00 0.00 H new ATOM 0 HH12 ARG C 318 10.140 25.092 5.853 1.00 0.00 H new ATOM 0 HH21 ARG C 318 7.268 24.284 7.733 1.00 0.00 H new ATOM 0 HH22 ARG C 318 9.024 24.478 7.756 1.00 0.00 H new ATOM 2517 N TRP C 319 2.420 27.862 0.486 1.00 0.00 N ATOM 2518 CA TRP C 319 1.989 28.364 -0.787 1.00 0.00 C ATOM 2519 C TRP C 319 2.006 29.876 -0.720 1.00 0.00 C ATOM 2520 O TRP C 319 1.342 30.476 0.118 1.00 0.00 O ATOM 2521 CB TRP C 319 0.597 27.834 -1.136 1.00 0.00 C ATOM 2522 CG TRP C 319 0.067 28.302 -2.463 1.00 0.00 C ATOM 2523 CD1 TRP C 319 0.619 28.085 -3.688 1.00 0.00 C ATOM 2524 CD2 TRP C 319 -1.142 29.033 -2.691 1.00 0.00 C ATOM 2525 NE1 TRP C 319 -0.168 28.651 -4.659 1.00 0.00 N ATOM 2526 CE2 TRP C 319 -1.254 29.230 -4.075 1.00 0.00 C ATOM 2527 CE3 TRP C 319 -2.137 29.541 -1.859 1.00 0.00 C ATOM 2528 CZ2 TRP C 319 -2.324 29.910 -4.649 1.00 0.00 C ATOM 2529 CZ3 TRP C 319 -3.197 30.211 -2.425 1.00 0.00 C ATOM 2530 CH2 TRP C 319 -3.286 30.391 -3.808 1.00 0.00 C ATOM 0 H TRP C 319 1.662 27.547 1.091 1.00 0.00 H new ATOM 0 HA TRP C 319 2.660 28.025 -1.576 1.00 0.00 H new ATOM 0 HB2 TRP C 319 0.626 26.744 -1.134 1.00 0.00 H new ATOM 0 HB3 TRP C 319 -0.100 28.136 -0.354 1.00 0.00 H new ATOM 0 HD1 TRP C 319 1.538 27.548 -3.869 1.00 0.00 H new ATOM 0 HE1 TRP C 319 0.029 28.640 -5.660 1.00 0.00 H new ATOM 0 HE3 TRP C 319 -2.077 29.411 -0.788 1.00 0.00 H new ATOM 0 HZ2 TRP C 319 -2.391 30.052 -5.718 1.00 0.00 H new ATOM 0 HZ3 TRP C 319 -3.975 30.605 -1.788 1.00 0.00 H new ATOM 0 HH2 TRP C 319 -4.132 30.921 -4.220 1.00 0.00 H new ATOM 2541 N ASP C 320 2.807 30.466 -1.567 1.00 0.00 N ATOM 2542 CA ASP C 320 3.006 31.911 -1.585 1.00 0.00 C ATOM 2543 C ASP C 320 1.765 32.660 -2.047 1.00 0.00 C ATOM 2544 O ASP C 320 1.436 33.722 -1.523 1.00 0.00 O ATOM 2545 CB ASP C 320 4.177 32.269 -2.492 1.00 0.00 C ATOM 2546 CG ASP C 320 4.501 33.735 -2.431 1.00 0.00 C ATOM 2547 OD1 ASP C 320 5.252 34.133 -1.525 1.00 0.00 O ATOM 2548 OD2 ASP C 320 4.002 34.505 -3.266 1.00 0.00 O1- ATOM 0 H ASP C 320 3.348 29.965 -2.272 1.00 0.00 H new ATOM 0 HA ASP C 320 3.218 32.215 -0.560 1.00 0.00 H new ATOM 0 HB2 ASP C 320 5.053 31.690 -2.200 1.00 0.00 H new ATOM 0 HB3 ASP C 320 3.940 31.991 -3.519 1.00 0.00 H new ATOM 2553 N GLY C 321 1.069 32.090 -3.002 1.00 0.00 N ATOM 2554 CA GLY C 321 -0.087 32.753 -3.552 1.00 0.00 C ATOM 2555 C GLY C 321 -0.079 32.720 -5.060 1.00 0.00 C ATOM 2556 O GLY C 321 -1.024 33.160 -5.710 1.00 0.00 O ATOM 0 H GLY C 321 1.280 31.179 -3.410 1.00 0.00 H new ATOM 0 HA2 GLY C 321 -0.993 32.274 -3.182 1.00 0.00 H new ATOM 0 HA3 GLY C 321 -0.111 33.788 -3.210 1.00 0.00 H new ATOM 2560 N VAL C 322 1.015 32.243 -5.617 1.00 0.00 N ATOM 2561 CA VAL C 322 1.130 32.057 -7.058 1.00 0.00 C ATOM 2562 C VAL C 322 0.267 30.871 -7.465 1.00 0.00 C ATOM 2563 O VAL C 322 0.545 29.760 -7.057 1.00 0.00 O ATOM 2564 CB VAL C 322 2.601 31.765 -7.475 1.00 0.00 C ATOM 2565 CG1 VAL C 322 2.730 31.627 -8.987 1.00 0.00 C ATOM 2566 CG2 VAL C 322 3.544 32.838 -6.952 1.00 0.00 C ATOM 0 H VAL C 322 1.847 31.973 -5.092 1.00 0.00 H new ATOM 0 HA VAL C 322 0.804 32.972 -7.552 1.00 0.00 H new ATOM 0 HB VAL C 322 2.886 30.814 -7.024 1.00 0.00 H new ATOM 0 HG11 VAL C 322 3.769 31.423 -9.246 1.00 0.00 H new ATOM 0 HG12 VAL C 322 2.102 30.806 -9.332 1.00 0.00 H new ATOM 0 HG13 VAL C 322 2.411 32.553 -9.465 1.00 0.00 H new ATOM 0 HG21 VAL C 322 4.564 32.607 -7.259 1.00 0.00 H new ATOM 0 HG22 VAL C 322 3.253 33.807 -7.358 1.00 0.00 H new ATOM 0 HG23 VAL C 322 3.491 32.870 -5.864 1.00 0.00 H new ATOM 2576 N HIS C 323 -0.771 31.110 -8.223 1.00 0.00 N ATOM 2577 CA HIS C 323 -1.669 30.041 -8.648 1.00 0.00 C ATOM 2578 C HIS C 323 -1.240 29.557 -10.026 1.00 0.00 C ATOM 2579 O HIS C 323 -0.896 30.369 -10.885 1.00 0.00 O ATOM 2580 CB HIS C 323 -3.123 30.560 -8.688 1.00 0.00 C ATOM 2581 CG HIS C 323 -4.168 29.505 -8.970 1.00 0.00 C ATOM 2582 ND1 HIS C 323 -4.741 29.286 -10.210 1.00 0.00 N ATOM 2583 CD2 HIS C 323 -4.765 28.629 -8.128 1.00 0.00 C ATOM 2584 CE1 HIS C 323 -5.647 28.313 -10.084 1.00 0.00 C ATOM 2585 NE2 HIS C 323 -5.704 27.875 -8.834 1.00 0.00 N ATOM 0 H HIS C 323 -1.026 32.036 -8.566 1.00 0.00 H new ATOM 0 HA HIS C 323 -1.620 29.212 -7.942 1.00 0.00 H new ATOM 0 HB2 HIS C 323 -3.352 31.031 -7.732 1.00 0.00 H new ATOM 0 HB3 HIS C 323 -3.196 31.336 -9.451 1.00 0.00 H new ATOM 0 HD2 HIS C 323 -4.549 28.529 -7.075 1.00 0.00 H new ATOM 0 HE1 HIS C 323 -6.253 27.933 -10.893 1.00 0.00 H new ATOM 0 HE2 HIS C 323 -6.308 27.140 -8.465 1.00 0.00 H new ATOM 2593 N ARG C 324 -1.217 28.267 -10.238 1.00 0.00 N ATOM 2594 CA ARG C 324 -0.829 27.743 -11.536 1.00 0.00 C ATOM 2595 C ARG C 324 -2.038 27.369 -12.350 1.00 0.00 C ATOM 2596 O ARG C 324 -3.085 27.009 -11.818 1.00 0.00 O ATOM 2597 CB ARG C 324 0.139 26.527 -11.460 1.00 0.00 C ATOM 2598 CG ARG C 324 1.520 26.817 -10.876 1.00 0.00 C ATOM 2599 CD ARG C 324 1.426 27.116 -9.419 1.00 0.00 C ATOM 2600 NE ARG C 324 2.679 27.515 -8.796 1.00 0.00 N ATOM 2601 CZ ARG C 324 2.824 27.550 -7.473 1.00 0.00 C ATOM 2602 NH1 ARG C 324 1.791 27.239 -6.700 1.00 0.00 N1+ ATOM 2603 NH2 ARG C 324 3.970 27.948 -6.924 1.00 0.00 N ATOM 0 H ARG C 324 -1.458 27.561 -9.542 1.00 0.00 H new ATOM 0 HA ARG C 324 -0.286 28.553 -12.022 1.00 0.00 H new ATOM 0 HB2 ARG C 324 -0.332 25.747 -10.861 1.00 0.00 H new ATOM 0 HB3 ARG C 324 0.267 26.124 -12.465 1.00 0.00 H new ATOM 0 HG2 ARG C 324 2.174 25.960 -11.034 1.00 0.00 H new ATOM 0 HG3 ARG C 324 1.970 27.662 -11.397 1.00 0.00 H new ATOM 0 HD2 ARG C 324 0.694 27.910 -9.272 1.00 0.00 H new ATOM 0 HD3 ARG C 324 1.046 26.233 -8.905 1.00 0.00 H new ATOM 0 HE ARG C 324 3.467 27.775 -9.389 1.00 0.00 H new ATOM 0 HH11 ARG C 324 0.900 26.977 -7.121 1.00 0.00 H new ATOM 0 HH12 ARG C 324 1.889 27.262 -5.685 1.00 0.00 H new ATOM 0 HH21 ARG C 324 4.749 28.231 -7.518 1.00 0.00 H new ATOM 0 HH22 ARG C 324 4.069 27.970 -5.909 1.00 0.00 H new ATOM 2617 N SER C 325 -1.898 27.480 -13.626 1.00 0.00 N ATOM 2618 CA SER C 325 -2.899 27.071 -14.544 1.00 0.00 C ATOM 2619 C SER C 325 -2.220 26.300 -15.664 1.00 0.00 C ATOM 2620 O SER C 325 -1.730 26.874 -16.636 1.00 0.00 O ATOM 2621 CB SER C 325 -3.708 28.286 -15.045 1.00 0.00 C ATOM 2622 OG SER C 325 -2.853 29.366 -15.459 1.00 0.00 O ATOM 0 H SER C 325 -1.064 27.867 -14.068 1.00 0.00 H new ATOM 0 HA SER C 325 -3.625 26.414 -14.065 1.00 0.00 H new ATOM 0 HB2 SER C 325 -4.339 27.982 -15.880 1.00 0.00 H new ATOM 0 HB3 SER C 325 -4.372 28.632 -14.253 1.00 0.00 H new ATOM 0 HG SER C 325 -2.126 29.014 -16.014 1.00 0.00 H new ATOM 2628 N ASN C 326 -2.103 25.013 -15.467 1.00 0.00 N ATOM 2629 CA ASN C 326 -1.405 24.144 -16.393 1.00 0.00 C ATOM 2630 C ASN C 326 -1.934 22.746 -16.207 1.00 0.00 C ATOM 2631 O ASN C 326 -2.086 22.312 -15.080 1.00 0.00 O ATOM 2632 CB ASN C 326 0.104 24.161 -16.069 1.00 0.00 C ATOM 2633 CG ASN C 326 0.954 23.287 -16.984 1.00 0.00 C ATOM 2634 OD1 ASN C 326 0.674 23.139 -18.172 1.00 0.00 O ATOM 2635 ND2 ASN C 326 1.968 22.676 -16.424 1.00 0.00 N ATOM 0 H ASN C 326 -2.490 24.530 -14.656 1.00 0.00 H new ATOM 0 HA ASN C 326 -1.558 24.479 -17.419 1.00 0.00 H new ATOM 0 HB2 ASN C 326 0.465 25.188 -16.130 1.00 0.00 H new ATOM 0 HB3 ASN C 326 0.246 23.833 -15.039 1.00 0.00 H new ATOM 0 HD21 ASN C 326 2.556 22.053 -16.977 1.00 0.00 H new ATOM 0 HD22 ASN C 326 2.169 22.824 -15.435 1.00 0.00 H new ATOM 2642 N GLY C 327 -2.256 22.069 -17.286 1.00 0.00 N ATOM 2643 CA GLY C 327 -2.736 20.705 -17.175 1.00 0.00 C ATOM 2644 C GLY C 327 -4.178 20.651 -16.721 1.00 0.00 C ATOM 2645 O GLY C 327 -4.602 19.707 -16.052 1.00 0.00 O ATOM 0 H GLY C 327 -2.197 22.431 -18.238 1.00 0.00 H new ATOM 0 HA2 GLY C 327 -2.640 20.206 -18.140 1.00 0.00 H new ATOM 0 HA3 GLY C 327 -2.112 20.157 -16.469 1.00 0.00 H new ATOM 2649 N PHE C 328 -4.931 21.659 -17.087 1.00 0.00 N ATOM 2650 CA PHE C 328 -6.285 21.782 -16.643 1.00 0.00 C ATOM 2651 C PHE C 328 -7.248 20.995 -17.574 1.00 0.00 C ATOM 2652 O PHE C 328 -6.924 20.698 -18.726 1.00 0.00 O ATOM 2653 CB PHE C 328 -6.649 23.273 -16.506 1.00 0.00 C ATOM 2654 CG PHE C 328 -7.950 23.543 -15.807 1.00 0.00 C ATOM 2655 CD1 PHE C 328 -8.184 23.046 -14.535 1.00 0.00 C ATOM 2656 CD2 PHE C 328 -8.937 24.267 -16.426 1.00 0.00 C ATOM 2657 CE1 PHE C 328 -9.381 23.278 -13.898 1.00 0.00 C ATOM 2658 CE2 PHE C 328 -10.143 24.502 -15.798 1.00 0.00 C ATOM 2659 CZ PHE C 328 -10.364 24.006 -14.529 1.00 0.00 C ATOM 0 H PHE C 328 -4.618 22.412 -17.700 1.00 0.00 H new ATOM 0 HA PHE C 328 -6.394 21.331 -15.657 1.00 0.00 H new ATOM 0 HB2 PHE C 328 -5.850 23.779 -15.964 1.00 0.00 H new ATOM 0 HB3 PHE C 328 -6.689 23.715 -17.501 1.00 0.00 H new ATOM 0 HD1 PHE C 328 -7.418 22.470 -14.038 1.00 0.00 H new ATOM 0 HD2 PHE C 328 -8.768 24.658 -17.418 1.00 0.00 H new ATOM 0 HE1 PHE C 328 -9.549 22.890 -12.904 1.00 0.00 H new ATOM 0 HE2 PHE C 328 -10.912 25.072 -16.298 1.00 0.00 H new ATOM 0 HZ PHE C 328 -11.306 24.189 -14.033 1.00 0.00 H new ATOM 2669 N GLU C 329 -8.416 20.686 -17.052 1.00 0.00 N ATOM 2670 CA GLU C 329 -9.433 19.813 -17.679 1.00 0.00 C ATOM 2671 C GLU C 329 -10.361 20.551 -18.669 1.00 0.00 C ATOM 2672 O GLU C 329 -11.277 19.939 -19.236 1.00 0.00 O ATOM 2673 CB GLU C 329 -10.275 19.232 -16.555 1.00 0.00 C ATOM 2674 CG GLU C 329 -11.007 20.310 -15.764 1.00 0.00 C ATOM 2675 CD GLU C 329 -11.559 19.817 -14.474 1.00 0.00 C ATOM 2676 OE1 GLU C 329 -12.693 19.293 -14.439 1.00 0.00 O ATOM 2677 OE2 GLU C 329 -10.871 19.945 -13.464 1.00 0.00 O1- ATOM 0 H GLU C 329 -8.712 21.041 -16.143 1.00 0.00 H new ATOM 0 HA GLU C 329 -8.913 19.051 -18.260 1.00 0.00 H new ATOM 0 HB2 GLU C 329 -11.001 18.534 -16.972 1.00 0.00 H new ATOM 0 HB3 GLU C 329 -9.635 18.662 -15.882 1.00 0.00 H new ATOM 0 HG2 GLU C 329 -10.322 21.135 -15.567 1.00 0.00 H new ATOM 0 HG3 GLU C 329 -11.820 20.708 -16.371 1.00 0.00 H new ATOM 2684 N GLU C 330 -10.129 21.842 -18.851 1.00 0.00 N ATOM 2685 CA GLU C 330 -10.998 22.722 -19.654 1.00 0.00 C ATOM 2686 C GLU C 330 -11.176 22.179 -21.085 1.00 0.00 C ATOM 2687 O GLU C 330 -12.301 22.132 -21.601 1.00 0.00 O ATOM 2688 CB GLU C 330 -10.408 24.153 -19.620 1.00 0.00 C ATOM 2689 CG GLU C 330 -11.286 25.309 -20.109 1.00 0.00 C ATOM 2690 CD GLU C 330 -11.476 25.388 -21.596 1.00 0.00 C ATOM 2691 OE1 GLU C 330 -10.493 25.629 -22.313 1.00 0.00 O ATOM 2692 OE2 GLU C 330 -12.624 25.296 -22.068 1.00 0.00 O1- ATOM 0 H GLU C 330 -9.326 22.324 -18.446 1.00 0.00 H new ATOM 0 HA GLU C 330 -12.001 22.751 -19.229 1.00 0.00 H new ATOM 0 HB2 GLU C 330 -10.116 24.368 -18.592 1.00 0.00 H new ATOM 0 HB3 GLU C 330 -9.496 24.152 -20.217 1.00 0.00 H new ATOM 0 HG2 GLU C 330 -12.265 25.223 -19.639 1.00 0.00 H new ATOM 0 HG3 GLU C 330 -10.848 26.246 -19.765 1.00 0.00 H new ATOM 2699 N LYS C 331 -10.095 21.731 -21.691 1.00 0.00 N ATOM 2700 CA LYS C 331 -10.152 21.187 -23.040 1.00 0.00 C ATOM 2701 C LYS C 331 -10.787 19.784 -22.999 1.00 0.00 C ATOM 2702 O LYS C 331 -10.416 18.946 -22.164 1.00 0.00 O ATOM 2703 CB LYS C 331 -8.717 21.137 -23.670 1.00 0.00 C ATOM 2704 CG LYS C 331 -8.642 20.928 -25.211 1.00 0.00 C ATOM 2705 CD LYS C 331 -9.099 19.543 -25.668 1.00 0.00 C ATOM 2706 CE LYS C 331 -9.188 19.431 -27.185 1.00 0.00 C ATOM 2707 NZ LYS C 331 -9.812 18.149 -27.602 1.00 0.00 N1+ ATOM 0 H LYS C 331 -9.164 21.731 -21.274 1.00 0.00 H new ATOM 0 HA LYS C 331 -10.768 21.833 -23.666 1.00 0.00 H new ATOM 0 HB2 LYS C 331 -8.205 22.068 -23.427 1.00 0.00 H new ATOM 0 HB3 LYS C 331 -8.161 20.332 -23.189 1.00 0.00 H new ATOM 0 HG2 LYS C 331 -9.256 21.683 -25.701 1.00 0.00 H new ATOM 0 HG3 LYS C 331 -7.616 21.089 -25.541 1.00 0.00 H new ATOM 0 HD2 LYS C 331 -8.405 18.792 -25.291 1.00 0.00 H new ATOM 0 HD3 LYS C 331 -10.074 19.323 -25.233 1.00 0.00 H new ATOM 0 HE2 LYS C 331 -9.770 20.265 -27.579 1.00 0.00 H new ATOM 0 HE3 LYS C 331 -8.190 19.508 -27.615 1.00 0.00 H new ATOM 0 HZ1 LYS C 331 -9.493 17.903 -28.561 1.00 0.00 H new ATOM 0 HZ2 LYS C 331 -9.534 17.396 -26.941 1.00 0.00 H new ATOM 0 HZ3 LYS C 331 -10.847 18.249 -27.597 1.00 0.00 H new ATOM 2721 N TRP C 332 -11.732 19.551 -23.878 1.00 0.00 N ATOM 2722 CA TRP C 332 -12.348 18.259 -24.024 1.00 0.00 C ATOM 2723 C TRP C 332 -12.076 17.742 -25.430 1.00 0.00 C ATOM 2724 O TRP C 332 -11.423 16.710 -25.572 1.00 0.00 O ATOM 2725 CB TRP C 332 -13.857 18.266 -23.667 1.00 0.00 C ATOM 2726 CG TRP C 332 -14.715 19.204 -24.460 1.00 0.00 C ATOM 2727 CD1 TRP C 332 -14.906 20.528 -24.226 1.00 0.00 C ATOM 2728 CD2 TRP C 332 -15.524 18.874 -25.594 1.00 0.00 C ATOM 2729 NE1 TRP C 332 -15.762 21.049 -25.154 1.00 0.00 N ATOM 2730 CE2 TRP C 332 -16.161 20.054 -26.002 1.00 0.00 C ATOM 2731 CE3 TRP C 332 -15.762 17.694 -26.307 1.00 0.00 C ATOM 2732 CZ2 TRP C 332 -17.023 20.093 -27.086 1.00 0.00 C ATOM 2733 CZ3 TRP C 332 -16.621 17.734 -27.384 1.00 0.00 C ATOM 2734 CH2 TRP C 332 -17.241 18.926 -27.765 1.00 0.00 C ATOM 2735 OXT TRP C 332 -12.369 18.466 -26.411 1.00 0.00 O1- ATOM 0 H TRP C 332 -12.096 20.259 -24.515 1.00 0.00 H new ATOM 0 HA TRP C 332 -11.902 17.574 -23.303 1.00 0.00 H new ATOM 0 HB2 TRP C 332 -14.245 17.255 -23.794 1.00 0.00 H new ATOM 0 HB3 TRP C 332 -13.959 18.516 -22.611 1.00 0.00 H new ATOM 0 HD1 TRP C 332 -14.448 21.087 -23.424 1.00 0.00 H new ATOM 0 HE1 TRP C 332 -16.056 22.024 -25.206 1.00 0.00 H new ATOM 0 HE3 TRP C 332 -15.282 16.770 -26.019 1.00 0.00 H new ATOM 0 HZ2 TRP C 332 -17.506 21.012 -27.384 1.00 0.00 H new ATOM 0 HZ3 TRP C 332 -16.818 16.830 -27.942 1.00 0.00 H new ATOM 0 HH2 TRP C 332 -17.907 18.926 -28.615 1.00 0.00 H new TER 2746 TRP C 332