USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 823 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 Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00118) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 92:sc= 1.45 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00178) USER MOD Single : A 25 MET CE :methyl 176:sc= -0.296 (180deg=-0.344) USER MOD Single : A 26 MET CE :methyl 152:sc= 0 (180deg=-0.174) USER MOD Single : A 28 GLN : amide:sc= -0.0513 X(o=-0.051,f=-0.24) USER MOD Single : A 35 GLN : amide:sc= -0.313 X(o=-0.31,f=-0.31) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 169:sc= 0.00662 USER MOD Single : A 38 GLN : amide:sc= -0.085 K(o=-0.085,f=-0.61) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -150:sc= 0.0852 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= 0.149 X(o=0.15,f=-0.012) USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ 180:sc= -0.135 (180deg=-0.135) USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 111 THR OG1 : rot 180:sc= -0.0968 USER MOD Single : B 116 GLN : amide:sc= -0.73 K(o=-0.73,f=-3.5!) USER MOD Single : B 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 125 MET CE :methyl 177:sc= -0.251 (180deg=-0.259) USER MOD Single : B 126 MET CE :methyl -165:sc= -0.125 (180deg=-0.382) USER MOD Single : B 128 GLN : amide:sc= -0.149 X(o=-0.15,f=-0.029) USER MOD Single : B 135 GLN : amide:sc= -0.232 X(o=-0.23,f=-0.23) USER MOD Single : B 136 LYS NZ :NH3+ -135:sc=-0.00748 (180deg=-0.693) USER MOD Single : B 137 TYR OH : rot 130:sc= 0 USER MOD Single : B 138 GLN : amide:sc= -0.0051 K(o=-0.0051,f=-0.94) USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 140 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0271) USER MOD Single : B 142 GLN : amide:sc= -1.36! K(o=-1.4!,f=-0.42) USER MOD Single : B 151 LYS NZ :NH3+ -169:sc= 1.8 (180deg=1.5) USER MOD ----------------------------------------------------------------- ATOM 31 N TYR A 4 -19.686 -4.122 6.824 1.00 0.00 N ATOM 32 CA TYR A 4 -20.673 -3.178 6.292 1.00 0.00 C ATOM 33 C TYR A 4 -21.655 -3.947 5.388 1.00 0.00 C ATOM 34 O TYR A 4 -22.104 -3.495 4.335 1.00 0.00 O ATOM 35 CB TYR A 4 -19.990 -2.038 5.529 1.00 0.00 C ATOM 36 CG TYR A 4 -19.183 -1.111 6.403 1.00 0.00 C ATOM 37 CD1 TYR A 4 -19.859 -0.190 7.218 1.00 0.00 C ATOM 38 CD2 TYR A 4 -17.782 -1.187 6.435 1.00 0.00 C ATOM 39 CE1 TYR A 4 -19.143 0.637 8.094 1.00 0.00 C ATOM 40 CE2 TYR A 4 -17.057 -0.363 7.307 1.00 0.00 C ATOM 41 CZ TYR A 4 -17.736 0.533 8.157 1.00 0.00 C ATOM 42 OH TYR A 4 -17.028 1.263 9.056 1.00 0.00 O ATOM 0 HA TYR A 4 -21.223 -2.722 7.116 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -19.336 -2.464 4.768 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -20.750 -1.458 5.007 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -20.936 -0.118 7.170 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -17.263 -1.879 5.789 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -19.664 1.349 8.717 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -15.978 -0.415 7.327 1.00 0.00 H new ATOM 0 HH TYR A 4 -16.073 1.065 8.959 1.00 0.00 H new ATOM 52 N GLU A 5 -21.994 -5.168 5.781 1.00 0.00 N ATOM 53 CA GLU A 5 -22.900 -6.043 5.032 1.00 0.00 C ATOM 54 C GLU A 5 -24.307 -5.447 4.901 1.00 0.00 C ATOM 55 O GLU A 5 -25.008 -5.769 3.944 1.00 0.00 O ATOM 56 CB GLU A 5 -22.919 -7.438 5.661 1.00 0.00 C ATOM 57 CG GLU A 5 -21.489 -7.998 5.725 1.00 0.00 C ATOM 58 CD GLU A 5 -21.444 -9.468 6.115 1.00 0.00 C ATOM 59 OE1 GLU A 5 -21.868 -9.816 7.237 1.00 0.00 O ATOM 60 OE2 GLU A 5 -20.894 -10.262 5.322 1.00 0.00 O ATOM 0 H GLU A 5 -21.644 -5.589 6.642 1.00 0.00 H new ATOM 0 HA GLU A 5 -22.521 -6.133 4.014 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -23.346 -7.390 6.663 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -23.554 -8.103 5.075 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -21.011 -7.870 4.754 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -20.910 -7.419 6.444 1.00 0.00 H new ATOM 67 N PHE A 6 -24.704 -4.543 5.795 1.00 0.00 N ATOM 68 CA PHE A 6 -26.005 -3.883 5.792 1.00 0.00 C ATOM 69 C PHE A 6 -26.119 -2.845 4.678 1.00 0.00 C ATOM 70 O PHE A 6 -27.213 -2.341 4.428 1.00 0.00 O ATOM 71 CB PHE A 6 -26.257 -3.240 7.158 1.00 0.00 C ATOM 72 CG PHE A 6 -26.449 -4.255 8.261 1.00 0.00 C ATOM 73 CD1 PHE A 6 -25.340 -4.836 8.905 1.00 0.00 C ATOM 74 CD2 PHE A 6 -27.752 -4.663 8.598 1.00 0.00 C ATOM 75 CE1 PHE A 6 -25.538 -5.855 9.850 1.00 0.00 C ATOM 76 CE2 PHE A 6 -27.948 -5.667 9.558 1.00 0.00 C ATOM 77 CZ PHE A 6 -26.840 -6.274 10.168 1.00 0.00 C ATOM 0 H PHE A 6 -24.108 -4.241 6.566 1.00 0.00 H new ATOM 0 HA PHE A 6 -26.767 -4.639 5.600 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -25.417 -2.593 7.409 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -27.141 -2.606 7.097 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -24.341 -4.499 8.673 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -28.603 -4.203 8.117 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -24.689 -6.317 10.332 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -28.949 -5.972 9.827 1.00 0.00 H new ATOM 0 HZ PHE A 6 -26.989 -7.067 10.886 1.00 0.00 H new ATOM 87 N LEU A 7 -25.023 -2.550 3.960 1.00 0.00 N ATOM 88 CA LEU A 7 -25.036 -1.582 2.866 1.00 0.00 C ATOM 89 C LEU A 7 -26.096 -1.948 1.838 1.00 0.00 C ATOM 90 O LEU A 7 -26.569 -1.053 1.148 1.00 0.00 O ATOM 91 CB LEU A 7 -23.675 -1.499 2.159 1.00 0.00 C ATOM 92 CG LEU A 7 -22.636 -0.673 2.924 1.00 0.00 C ATOM 93 CD1 LEU A 7 -21.250 -1.020 2.376 1.00 0.00 C ATOM 94 CD2 LEU A 7 -22.867 0.829 2.737 1.00 0.00 C ATOM 0 H LEU A 7 -24.111 -2.976 4.125 1.00 0.00 H new ATOM 0 HA LEU A 7 -25.262 -0.612 3.308 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -23.289 -2.508 2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -23.815 -1.065 1.169 1.00 0.00 H new ATOM 0 HG LEU A 7 -22.719 -0.906 3.986 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -20.494 -0.442 2.907 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -21.059 -2.084 2.517 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -21.209 -0.781 1.313 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -22.112 1.385 3.293 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -22.795 1.079 1.678 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -23.858 1.093 3.106 1.00 0.00 H new ATOM 106 N LYS A 8 -26.478 -3.229 1.738 1.00 0.00 N ATOM 107 CA LYS A 8 -27.497 -3.707 0.802 1.00 0.00 C ATOM 108 C LYS A 8 -28.812 -2.931 0.934 1.00 0.00 C ATOM 109 O LYS A 8 -29.514 -2.796 -0.071 1.00 0.00 O ATOM 110 CB LYS A 8 -27.778 -5.200 1.038 1.00 0.00 C ATOM 111 CG LYS A 8 -26.620 -6.169 0.769 1.00 0.00 C ATOM 112 CD LYS A 8 -26.054 -6.086 -0.653 1.00 0.00 C ATOM 113 CE LYS A 8 -25.038 -7.201 -0.915 1.00 0.00 C ATOM 114 NZ LYS A 8 -23.816 -7.070 -0.097 1.00 0.00 N ATOM 0 H LYS A 8 -26.080 -3.970 2.315 1.00 0.00 H new ATOM 0 HA LYS A 8 -27.103 -3.549 -0.202 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -28.095 -5.327 2.073 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -28.619 -5.492 0.409 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -25.819 -5.968 1.480 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -26.962 -7.187 0.954 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -26.868 -6.156 -1.375 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -25.579 -5.116 -0.801 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -25.504 -8.165 -0.711 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -24.765 -7.196 -1.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -23.159 -7.842 -0.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -23.361 -6.156 -0.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -24.066 -7.120 0.911 1.00 0.00 H new ATOM 128 N SER A 9 -29.139 -2.423 2.128 1.00 0.00 N ATOM 129 CA SER A 9 -30.359 -1.668 2.387 1.00 0.00 C ATOM 130 C SER A 9 -30.105 -0.176 2.638 1.00 0.00 C ATOM 131 O SER A 9 -31.073 0.572 2.768 1.00 0.00 O ATOM 132 CB SER A 9 -31.150 -2.339 3.520 1.00 0.00 C ATOM 133 OG SER A 9 -30.344 -2.669 4.638 1.00 0.00 O ATOM 0 H SER A 9 -28.549 -2.530 2.953 1.00 0.00 H new ATOM 0 HA SER A 9 -30.968 -1.690 1.483 1.00 0.00 H new ATOM 0 HB2 SER A 9 -31.951 -1.673 3.840 1.00 0.00 H new ATOM 0 HB3 SER A 9 -31.622 -3.245 3.139 1.00 0.00 H new ATOM 0 HG SER A 9 -30.898 -3.091 5.328 1.00 0.00 H new ATOM 139 N TRP A 10 -28.845 0.271 2.732 1.00 0.00 N ATOM 140 CA TRP A 10 -28.537 1.684 2.947 1.00 0.00 C ATOM 141 C TRP A 10 -28.939 2.463 1.688 1.00 0.00 C ATOM 142 O TRP A 10 -28.978 1.905 0.586 1.00 0.00 O ATOM 143 CB TRP A 10 -27.034 1.879 3.213 1.00 0.00 C ATOM 144 CG TRP A 10 -26.491 1.647 4.602 1.00 0.00 C ATOM 145 CD1 TRP A 10 -25.309 2.156 5.017 1.00 0.00 C ATOM 146 CD2 TRP A 10 -27.044 0.949 5.774 1.00 0.00 C ATOM 147 NE1 TRP A 10 -25.063 1.785 6.320 1.00 0.00 N ATOM 148 CE2 TRP A 10 -26.097 1.047 6.841 1.00 0.00 C ATOM 149 CE3 TRP A 10 -28.242 0.263 6.080 1.00 0.00 C ATOM 150 CZ2 TRP A 10 -26.304 0.482 8.110 1.00 0.00 C ATOM 151 CZ3 TRP A 10 -28.468 -0.304 7.349 1.00 0.00 C ATOM 152 CH2 TRP A 10 -27.498 -0.211 8.361 1.00 0.00 C ATOM 0 H TRP A 10 -28.024 -0.330 2.662 1.00 0.00 H new ATOM 0 HA TRP A 10 -29.088 2.047 3.815 1.00 0.00 H new ATOM 0 HB2 TRP A 10 -26.494 1.218 2.536 1.00 0.00 H new ATOM 0 HB3 TRP A 10 -26.782 2.901 2.930 1.00 0.00 H new ATOM 0 HD1 TRP A 10 -24.653 2.766 4.414 1.00 0.00 H new ATOM 0 HE1 TRP A 10 -24.217 2.028 6.835 1.00 0.00 H new ATOM 0 HE3 TRP A 10 -29.004 0.171 5.320 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 -25.555 0.580 8.882 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 -29.398 -0.816 7.547 1.00 0.00 H new ATOM 0 HH2 TRP A 10 -27.670 -0.669 9.324 1.00 0.00 H new ATOM 163 N THR A 11 -29.200 3.761 1.820 1.00 0.00 N ATOM 164 CA THR A 11 -29.577 4.620 0.713 1.00 0.00 C ATOM 165 C THR A 11 -28.451 4.668 -0.329 1.00 0.00 C ATOM 166 O THR A 11 -27.283 4.467 0.009 1.00 0.00 O ATOM 167 CB THR A 11 -29.960 6.013 1.276 1.00 0.00 C ATOM 168 OG1 THR A 11 -29.929 6.092 2.697 1.00 0.00 O ATOM 169 CG2 THR A 11 -31.427 6.251 0.952 1.00 0.00 C ATOM 0 H THR A 11 -29.153 4.248 2.715 1.00 0.00 H new ATOM 0 HA THR A 11 -30.449 4.226 0.191 1.00 0.00 H new ATOM 0 HB THR A 11 -29.248 6.716 0.844 1.00 0.00 H new ATOM 0 HG1 THR A 11 -29.046 6.401 2.988 1.00 0.00 H new ATOM 0 HG21 THR A 11 -31.731 7.225 1.335 1.00 0.00 H new ATOM 0 HG22 THR A 11 -31.570 6.225 -0.128 1.00 0.00 H new ATOM 0 HG23 THR A 11 -32.033 5.473 1.417 1.00 0.00 H new ATOM 177 N VAL A 12 -28.785 4.976 -1.589 1.00 0.00 N ATOM 178 CA VAL A 12 -27.805 5.047 -2.674 1.00 0.00 C ATOM 179 C VAL A 12 -26.715 6.056 -2.327 1.00 0.00 C ATOM 180 O VAL A 12 -25.537 5.756 -2.486 1.00 0.00 O ATOM 181 CB VAL A 12 -28.480 5.373 -4.024 1.00 0.00 C ATOM 182 CG1 VAL A 12 -27.457 5.400 -5.174 1.00 0.00 C ATOM 183 CG2 VAL A 12 -29.568 4.337 -4.345 1.00 0.00 C ATOM 0 H VAL A 12 -29.740 5.182 -1.882 1.00 0.00 H new ATOM 0 HA VAL A 12 -27.339 4.068 -2.786 1.00 0.00 H new ATOM 0 HB VAL A 12 -28.928 6.362 -3.931 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -27.967 5.632 -6.109 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -26.703 6.161 -4.973 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -26.976 4.425 -5.256 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -30.033 4.582 -5.300 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -29.120 3.345 -4.404 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -30.324 4.348 -3.560 1.00 0.00 H new ATOM 193 N GLU A 13 -27.083 7.235 -1.824 1.00 0.00 N ATOM 194 CA GLU A 13 -26.083 8.231 -1.474 1.00 0.00 C ATOM 195 C GLU A 13 -25.206 7.695 -0.337 1.00 0.00 C ATOM 196 O GLU A 13 -23.986 7.727 -0.444 1.00 0.00 O ATOM 197 CB GLU A 13 -26.750 9.560 -1.101 1.00 0.00 C ATOM 198 CG GLU A 13 -27.491 10.212 -2.283 1.00 0.00 C ATOM 199 CD GLU A 13 -28.027 11.619 -1.969 1.00 0.00 C ATOM 200 OE1 GLU A 13 -28.419 11.883 -0.806 1.00 0.00 O ATOM 201 OE2 GLU A 13 -28.068 12.457 -2.903 1.00 0.00 O ATOM 0 H GLU A 13 -28.049 7.516 -1.654 1.00 0.00 H new ATOM 0 HA GLU A 13 -25.445 8.425 -2.336 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -27.454 9.391 -0.286 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -25.992 10.249 -0.729 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -26.816 10.271 -3.137 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -28.323 9.572 -2.578 1.00 0.00 H new ATOM 208 N ASP A 14 -25.804 7.136 0.719 1.00 0.00 N ATOM 209 CA ASP A 14 -25.062 6.610 1.867 1.00 0.00 C ATOM 210 C ASP A 14 -24.065 5.536 1.461 1.00 0.00 C ATOM 211 O ASP A 14 -22.899 5.586 1.865 1.00 0.00 O ATOM 212 CB ASP A 14 -26.004 6.002 2.913 1.00 0.00 C ATOM 213 CG ASP A 14 -26.666 7.040 3.799 1.00 0.00 C ATOM 214 OD1 ASP A 14 -26.021 8.039 4.176 1.00 0.00 O ATOM 215 OD2 ASP A 14 -27.845 6.822 4.148 1.00 0.00 O ATOM 0 H ASP A 14 -26.816 7.036 0.802 1.00 0.00 H new ATOM 0 HA ASP A 14 -24.529 7.462 2.289 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -26.775 5.423 2.405 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -25.443 5.307 3.537 1.00 0.00 H new ATOM 220 N LEU A 15 -24.502 4.553 0.669 1.00 0.00 N ATOM 221 CA LEU A 15 -23.607 3.491 0.232 1.00 0.00 C ATOM 222 C LEU A 15 -22.497 4.102 -0.635 1.00 0.00 C ATOM 223 O LEU A 15 -21.320 3.785 -0.439 1.00 0.00 O ATOM 224 CB LEU A 15 -24.388 2.316 -0.416 1.00 0.00 C ATOM 225 CG LEU A 15 -24.664 2.464 -1.924 1.00 0.00 C ATOM 226 CD1 LEU A 15 -23.446 2.061 -2.760 1.00 0.00 C ATOM 227 CD2 LEU A 15 -25.884 1.682 -2.405 1.00 0.00 C ATOM 0 H LEU A 15 -25.459 4.475 0.324 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.113 3.027 1.086 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -23.827 1.395 -0.254 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -25.340 2.204 0.102 1.00 0.00 H new ATOM 0 HG LEU A 15 -24.877 3.523 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.677 2.178 -3.819 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -22.600 2.697 -2.500 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -23.193 1.020 -2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -26.015 1.835 -3.476 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -25.738 0.621 -2.205 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -26.771 2.032 -1.877 1.00 0.00 H new ATOM 239 N GLN A 16 -22.845 5.003 -1.561 1.00 0.00 N ATOM 240 CA GLN A 16 -21.911 5.659 -2.462 1.00 0.00 C ATOM 241 C GLN A 16 -20.859 6.428 -1.655 1.00 0.00 C ATOM 242 O GLN A 16 -19.679 6.415 -2.009 1.00 0.00 O ATOM 243 CB GLN A 16 -22.697 6.530 -3.445 1.00 0.00 C ATOM 244 CG GLN A 16 -21.826 7.109 -4.556 1.00 0.00 C ATOM 245 CD GLN A 16 -22.708 7.677 -5.662 1.00 0.00 C ATOM 246 OE1 GLN A 16 -23.074 8.851 -5.636 1.00 0.00 O ATOM 247 NE2 GLN A 16 -23.083 6.866 -6.630 1.00 0.00 N ATOM 0 H GLN A 16 -23.811 5.299 -1.702 1.00 0.00 H new ATOM 0 HA GLN A 16 -21.359 4.930 -3.055 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -23.496 5.937 -3.889 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -23.171 7.346 -2.900 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -21.181 7.891 -4.155 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -21.174 6.335 -4.960 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -22.768 5.896 -6.633 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -23.688 7.208 -7.376 1.00 0.00 H new ATOM 256 N LYS A 17 -21.243 7.033 -0.523 1.00 0.00 N ATOM 257 CA LYS A 17 -20.316 7.766 0.339 1.00 0.00 C ATOM 258 C LYS A 17 -19.229 6.831 0.848 1.00 0.00 C ATOM 259 O LYS A 17 -18.118 7.310 1.092 1.00 0.00 O ATOM 260 CB LYS A 17 -21.029 8.503 1.490 1.00 0.00 C ATOM 261 CG LYS A 17 -21.267 9.982 1.147 1.00 0.00 C ATOM 262 CD LYS A 17 -22.358 10.150 0.084 1.00 0.00 C ATOM 263 CE LYS A 17 -22.377 11.522 -0.565 1.00 0.00 C ATOM 264 NZ LYS A 17 -22.593 12.609 0.399 1.00 0.00 N ATOM 0 H LYS A 17 -22.204 7.026 -0.182 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.849 8.546 -0.263 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -21.983 8.018 1.699 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -20.429 8.430 2.397 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -21.552 10.523 2.049 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.338 10.426 0.789 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -22.218 9.395 -0.689 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -23.329 9.961 0.541 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -21.432 11.686 -1.084 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -23.164 11.551 -1.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -22.613 13.519 -0.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -23.499 12.464 0.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -21.820 12.615 1.095 1.00 0.00 H new ATOM 278 N ARG A 18 -19.509 5.536 1.063 1.00 0.00 N ATOM 279 CA ARG A 18 -18.454 4.624 1.497 1.00 0.00 C ATOM 280 C ARG A 18 -17.555 4.379 0.286 1.00 0.00 C ATOM 281 O ARG A 18 -16.340 4.429 0.437 1.00 0.00 O ATOM 282 CB ARG A 18 -18.952 3.265 2.029 1.00 0.00 C ATOM 283 CG ARG A 18 -19.793 3.292 3.310 1.00 0.00 C ATOM 284 CD ARG A 18 -19.479 2.058 4.187 1.00 0.00 C ATOM 285 NE ARG A 18 -18.548 2.403 5.273 1.00 0.00 N ATOM 286 CZ ARG A 18 -17.220 2.266 5.316 1.00 0.00 C ATOM 287 NH1 ARG A 18 -16.546 1.557 4.416 1.00 0.00 N ATOM 288 NH2 ARG A 18 -16.536 2.849 6.293 1.00 0.00 N ATOM 0 H ARG A 18 -20.429 5.112 0.946 1.00 0.00 H new ATOM 0 HA ARG A 18 -17.940 5.094 2.335 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -19.541 2.788 1.246 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -18.084 2.630 2.206 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -19.587 4.205 3.869 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -20.853 3.306 3.056 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -20.403 1.663 4.608 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -19.047 1.270 3.570 1.00 0.00 H new ATOM 0 HE ARG A 18 -18.976 2.802 6.109 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -17.043 1.092 3.656 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -15.531 1.478 4.485 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -17.025 3.396 7.002 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -15.522 2.750 6.335 1.00 0.00 H new ATOM 302 N LEU A 19 -18.125 4.141 -0.905 1.00 0.00 N ATOM 303 CA LEU A 19 -17.370 3.860 -2.131 1.00 0.00 C ATOM 304 C LEU A 19 -16.365 4.952 -2.467 1.00 0.00 C ATOM 305 O LEU A 19 -15.177 4.662 -2.608 1.00 0.00 O ATOM 306 CB LEU A 19 -18.322 3.657 -3.333 1.00 0.00 C ATOM 307 CG LEU A 19 -17.652 2.894 -4.499 1.00 0.00 C ATOM 308 CD1 LEU A 19 -18.689 2.017 -5.209 1.00 0.00 C ATOM 309 CD2 LEU A 19 -17.014 3.838 -5.524 1.00 0.00 C ATOM 0 H LEU A 19 -19.136 4.139 -1.043 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.815 2.941 -1.939 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -19.205 3.108 -3.004 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -18.665 4.629 -3.689 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.861 2.281 -4.068 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -18.212 1.482 -6.030 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -19.105 1.300 -4.501 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -19.489 2.645 -5.602 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -16.557 3.253 -6.322 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -17.780 4.490 -5.944 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -16.251 4.443 -5.035 1.00 0.00 H new ATOM 321 N LEU A 20 -16.810 6.207 -2.522 1.00 0.00 N ATOM 322 CA LEU A 20 -15.923 7.319 -2.853 1.00 0.00 C ATOM 323 C LEU A 20 -14.916 7.577 -1.739 1.00 0.00 C ATOM 324 O LEU A 20 -13.854 8.117 -2.007 1.00 0.00 O ATOM 325 CB LEU A 20 -16.720 8.587 -3.208 1.00 0.00 C ATOM 326 CG LEU A 20 -17.222 9.370 -1.977 1.00 0.00 C ATOM 327 CD1 LEU A 20 -16.285 10.523 -1.583 1.00 0.00 C ATOM 328 CD2 LEU A 20 -18.613 9.945 -2.250 1.00 0.00 C ATOM 0 H LEU A 20 -17.777 6.477 -2.342 1.00 0.00 H new ATOM 0 HA LEU A 20 -15.356 7.036 -3.740 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -16.093 9.242 -3.813 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -17.575 8.307 -3.823 1.00 0.00 H new ATOM 0 HG LEU A 20 -17.251 8.660 -1.150 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -16.689 11.038 -0.711 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -15.299 10.125 -1.345 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -16.203 11.225 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -18.957 10.496 -1.375 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -18.567 10.617 -3.107 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -19.307 9.132 -2.464 1.00 0.00 H new ATOM 340 N ALA A 21 -15.230 7.224 -0.487 1.00 0.00 N ATOM 341 CA ALA A 21 -14.316 7.429 0.624 1.00 0.00 C ATOM 342 C ALA A 21 -13.265 6.318 0.670 1.00 0.00 C ATOM 343 O ALA A 21 -12.208 6.518 1.270 1.00 0.00 O ATOM 344 CB ALA A 21 -15.099 7.514 1.930 1.00 0.00 C ATOM 0 H ALA A 21 -16.117 6.793 -0.225 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.787 8.371 0.482 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.408 7.668 2.759 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -15.799 8.348 1.881 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.651 6.587 2.085 1.00 0.00 H new ATOM 350 N LEU A 22 -13.558 5.163 0.065 1.00 0.00 N ATOM 351 CA LEU A 22 -12.712 3.981 -0.040 1.00 0.00 C ATOM 352 C LEU A 22 -11.600 4.255 -1.053 1.00 0.00 C ATOM 353 O LEU A 22 -10.512 3.694 -0.927 1.00 0.00 O ATOM 354 CB LEU A 22 -13.539 2.764 -0.543 1.00 0.00 C ATOM 355 CG LEU A 22 -13.576 1.514 0.351 1.00 0.00 C ATOM 356 CD1 LEU A 22 -12.186 0.963 0.651 1.00 0.00 C ATOM 357 CD2 LEU A 22 -14.320 1.784 1.665 1.00 0.00 C ATOM 0 H LEU A 22 -14.458 5.025 -0.395 1.00 0.00 H new ATOM 0 HA LEU A 22 -12.298 3.758 0.943 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -14.565 3.096 -0.700 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -13.147 2.470 -1.517 1.00 0.00 H new ATOM 0 HG LEU A 22 -14.118 0.758 -0.217 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -12.273 0.081 1.286 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -11.693 0.691 -0.282 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -11.596 1.723 1.164 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -14.327 0.879 2.272 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -13.817 2.583 2.210 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -15.346 2.083 1.448 1.00 0.00 H new ATOM 369 N ASP A 23 -11.862 5.097 -2.059 1.00 0.00 N ATOM 370 CA ASP A 23 -10.886 5.433 -3.104 1.00 0.00 C ATOM 371 C ASP A 23 -9.629 6.086 -2.515 1.00 0.00 C ATOM 372 O ASP A 23 -8.558 5.483 -2.574 1.00 0.00 O ATOM 373 CB ASP A 23 -11.523 6.346 -4.176 1.00 0.00 C ATOM 374 CG ASP A 23 -11.880 5.631 -5.469 1.00 0.00 C ATOM 375 OD1 ASP A 23 -12.542 4.574 -5.410 1.00 0.00 O ATOM 376 OD2 ASP A 23 -11.539 6.145 -6.556 1.00 0.00 O ATOM 0 H ASP A 23 -12.760 5.567 -2.172 1.00 0.00 H new ATOM 0 HA ASP A 23 -10.582 4.501 -3.580 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -12.425 6.799 -3.763 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.833 7.159 -4.402 1.00 0.00 H new ATOM 381 N PRO A 24 -9.715 7.264 -1.871 1.00 0.00 N ATOM 382 CA PRO A 24 -8.549 7.929 -1.318 1.00 0.00 C ATOM 383 C PRO A 24 -7.962 7.233 -0.082 1.00 0.00 C ATOM 384 O PRO A 24 -6.910 7.667 0.391 1.00 0.00 O ATOM 385 CB PRO A 24 -9.013 9.351 -1.027 1.00 0.00 C ATOM 386 CG PRO A 24 -10.491 9.190 -0.721 1.00 0.00 C ATOM 387 CD PRO A 24 -10.890 8.098 -1.696 1.00 0.00 C ATOM 0 HA PRO A 24 -7.718 7.904 -2.023 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -8.474 9.784 -0.184 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -8.850 10.008 -1.881 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.665 8.898 0.315 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -11.047 10.112 -0.890 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -11.726 7.516 -1.308 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -11.211 8.523 -2.647 1.00 0.00 H new ATOM 395 N MET A 25 -8.644 6.225 0.484 1.00 0.00 N ATOM 396 CA MET A 25 -8.145 5.483 1.639 1.00 0.00 C ATOM 397 C MET A 25 -6.994 4.616 1.153 1.00 0.00 C ATOM 398 O MET A 25 -5.896 4.688 1.699 1.00 0.00 O ATOM 399 CB MET A 25 -9.210 4.557 2.254 1.00 0.00 C ATOM 400 CG MET A 25 -10.199 5.237 3.194 1.00 0.00 C ATOM 401 SD MET A 25 -9.820 5.162 4.975 1.00 0.00 S ATOM 402 CE MET A 25 -8.187 5.956 5.074 1.00 0.00 C ATOM 0 H MET A 25 -9.554 5.907 0.151 1.00 0.00 H new ATOM 0 HA MET A 25 -7.847 6.198 2.405 1.00 0.00 H new ATOM 0 HB2 MET A 25 -9.768 4.085 1.445 1.00 0.00 H new ATOM 0 HB3 MET A 25 -8.704 3.760 2.800 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.276 6.286 2.906 1.00 0.00 H new ATOM 0 HG3 MET A 25 -11.181 4.790 3.036 1.00 0.00 H new ATOM 0 HE1 MET A 25 -7.883 6.033 6.118 1.00 0.00 H new ATOM 0 HE2 MET A 25 -7.458 5.358 4.527 1.00 0.00 H new ATOM 0 HE3 MET A 25 -8.240 6.953 4.637 1.00 0.00 H new ATOM 412 N MET A 26 -7.253 3.771 0.144 1.00 0.00 N ATOM 413 CA MET A 26 -6.213 2.910 -0.378 1.00 0.00 C ATOM 414 C MET A 26 -5.113 3.769 -0.986 1.00 0.00 C ATOM 415 O MET A 26 -3.942 3.473 -0.798 1.00 0.00 O ATOM 416 CB MET A 26 -6.782 1.899 -1.394 1.00 0.00 C ATOM 417 CG MET A 26 -7.565 2.505 -2.559 1.00 0.00 C ATOM 418 SD MET A 26 -7.517 1.547 -4.095 1.00 0.00 S ATOM 419 CE MET A 26 -5.999 2.315 -4.706 1.00 0.00 C ATOM 0 H MET A 26 -8.161 3.675 -0.312 1.00 0.00 H new ATOM 0 HA MET A 26 -5.787 2.323 0.436 1.00 0.00 H new ATOM 0 HB2 MET A 26 -5.956 1.314 -1.799 1.00 0.00 H new ATOM 0 HB3 MET A 26 -7.434 1.205 -0.863 1.00 0.00 H new ATOM 0 HG2 MET A 26 -8.605 2.624 -2.255 1.00 0.00 H new ATOM 0 HG3 MET A 26 -7.175 3.503 -2.759 1.00 0.00 H new ATOM 0 HE1 MET A 26 -5.473 1.615 -5.355 1.00 0.00 H new ATOM 0 HE2 MET A 26 -6.247 3.215 -5.269 1.00 0.00 H new ATOM 0 HE3 MET A 26 -5.360 2.579 -3.863 1.00 0.00 H new ATOM 429 N GLU A 27 -5.477 4.868 -1.645 1.00 0.00 N ATOM 430 CA GLU A 27 -4.514 5.731 -2.292 1.00 0.00 C ATOM 431 C GLU A 27 -3.458 6.262 -1.330 1.00 0.00 C ATOM 432 O GLU A 27 -2.273 6.104 -1.614 1.00 0.00 O ATOM 433 CB GLU A 27 -5.244 6.899 -2.965 1.00 0.00 C ATOM 434 CG GLU A 27 -4.318 7.643 -3.935 1.00 0.00 C ATOM 435 CD GLU A 27 -4.274 6.928 -5.276 1.00 0.00 C ATOM 436 OE1 GLU A 27 -3.647 5.851 -5.370 1.00 0.00 O ATOM 437 OE2 GLU A 27 -4.918 7.426 -6.224 1.00 0.00 O ATOM 0 H GLU A 27 -6.445 5.176 -1.740 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.990 5.133 -3.038 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -6.115 6.526 -3.503 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.610 7.589 -2.205 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -4.670 8.666 -4.072 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.314 7.705 -3.515 1.00 0.00 H new ATOM 444 N GLN A 28 -3.882 6.855 -0.210 1.00 0.00 N ATOM 445 CA GLN A 28 -2.974 7.423 0.775 1.00 0.00 C ATOM 446 C GLN A 28 -2.158 6.355 1.482 1.00 0.00 C ATOM 447 O GLN A 28 -0.962 6.556 1.694 1.00 0.00 O ATOM 448 CB GLN A 28 -3.782 8.256 1.787 1.00 0.00 C ATOM 449 CG GLN A 28 -2.972 8.799 2.978 1.00 0.00 C ATOM 450 CD GLN A 28 -3.022 7.879 4.200 1.00 0.00 C ATOM 451 OE1 GLN A 28 -4.013 7.869 4.927 1.00 0.00 O ATOM 452 NE2 GLN A 28 -1.994 7.083 4.444 1.00 0.00 N ATOM 0 H GLN A 28 -4.868 6.952 0.034 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.263 8.066 0.256 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.236 9.097 1.262 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.597 7.642 2.171 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -1.934 8.935 2.674 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.354 9.782 3.253 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -1.178 7.102 3.832 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -2.017 6.450 5.244 1.00 0.00 H new ATOM 461 N GLU A 29 -2.776 5.242 1.874 1.00 0.00 N ATOM 462 CA GLU A 29 -2.061 4.197 2.584 1.00 0.00 C ATOM 463 C GLU A 29 -0.948 3.619 1.726 1.00 0.00 C ATOM 464 O GLU A 29 0.107 3.252 2.252 1.00 0.00 O ATOM 465 CB GLU A 29 -3.053 3.121 3.044 1.00 0.00 C ATOM 466 CG GLU A 29 -3.995 3.634 4.142 1.00 0.00 C ATOM 467 CD GLU A 29 -3.294 3.710 5.501 1.00 0.00 C ATOM 468 OE1 GLU A 29 -2.323 4.487 5.667 1.00 0.00 O ATOM 469 OE2 GLU A 29 -3.650 2.928 6.413 1.00 0.00 O ATOM 0 H GLU A 29 -3.764 5.046 1.711 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.584 4.621 3.468 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.642 2.783 2.191 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.503 2.256 3.414 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.368 4.621 3.869 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.861 2.976 4.216 1.00 0.00 H new ATOM 476 N ILE A 30 -1.190 3.523 0.428 1.00 0.00 N ATOM 477 CA ILE A 30 -0.244 3.005 -0.529 1.00 0.00 C ATOM 478 C ILE A 30 0.843 4.016 -0.808 1.00 0.00 C ATOM 479 O ILE A 30 2.006 3.660 -0.691 1.00 0.00 O ATOM 480 CB ILE A 30 -0.979 2.549 -1.796 1.00 0.00 C ATOM 481 CG1 ILE A 30 -1.839 1.343 -1.387 1.00 0.00 C ATOM 482 CG2 ILE A 30 0.026 2.210 -2.914 1.00 0.00 C ATOM 483 CD1 ILE A 30 -2.939 0.966 -2.378 1.00 0.00 C ATOM 0 H ILE A 30 -2.073 3.812 0.008 1.00 0.00 H new ATOM 0 HA ILE A 30 0.254 2.129 -0.113 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.614 3.335 -2.203 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.186 0.481 -1.248 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.298 1.555 -0.421 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.515 1.889 -3.804 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.620 3.093 -3.149 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.685 1.408 -2.580 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -3.490 0.105 -2.000 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -3.621 1.807 -2.502 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -2.492 0.717 -3.340 1.00 0.00 H new ATOM 495 N GLU A 31 0.477 5.246 -1.208 1.00 0.00 N ATOM 496 CA GLU A 31 1.455 6.275 -1.536 1.00 0.00 C ATOM 497 C GLU A 31 2.459 6.448 -0.402 1.00 0.00 C ATOM 498 O GLU A 31 3.652 6.555 -0.673 1.00 0.00 O ATOM 499 CB GLU A 31 0.769 7.564 -2.018 1.00 0.00 C ATOM 500 CG GLU A 31 0.678 8.732 -1.029 1.00 0.00 C ATOM 501 CD GLU A 31 1.982 9.538 -0.957 1.00 0.00 C ATOM 502 OE1 GLU A 31 2.598 9.804 -2.018 1.00 0.00 O ATOM 503 OE2 GLU A 31 2.340 10.007 0.140 1.00 0.00 O ATOM 0 H GLU A 31 -0.493 5.543 -1.309 1.00 0.00 H new ATOM 0 HA GLU A 31 2.052 5.955 -2.390 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.298 7.915 -2.904 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.244 7.309 -2.331 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.138 9.392 -1.323 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.436 8.348 -0.038 1.00 0.00 H new ATOM 510 N GLU A 32 1.985 6.370 0.840 1.00 0.00 N ATOM 511 CA GLU A 32 2.795 6.487 2.033 1.00 0.00 C ATOM 512 C GLU A 32 3.821 5.347 2.052 1.00 0.00 C ATOM 513 O GLU A 32 4.994 5.589 2.324 1.00 0.00 O ATOM 514 CB GLU A 32 1.855 6.457 3.251 1.00 0.00 C ATOM 515 CG GLU A 32 2.562 6.590 4.603 1.00 0.00 C ATOM 516 CD GLU A 32 3.315 7.913 4.745 1.00 0.00 C ATOM 517 OE1 GLU A 32 2.697 8.995 4.649 1.00 0.00 O ATOM 518 OE2 GLU A 32 4.539 7.880 4.997 1.00 0.00 O ATOM 0 H GLU A 32 0.996 6.219 1.041 1.00 0.00 H new ATOM 0 HA GLU A 32 3.352 7.424 2.056 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.129 7.265 3.154 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.295 5.522 3.239 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.826 6.507 5.403 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.261 5.763 4.726 1.00 0.00 H new ATOM 525 N ILE A 33 3.431 4.096 1.767 1.00 0.00 N ATOM 526 CA ILE A 33 4.370 2.984 1.770 1.00 0.00 C ATOM 527 C ILE A 33 5.336 3.144 0.600 1.00 0.00 C ATOM 528 O ILE A 33 6.533 2.899 0.755 1.00 0.00 O ATOM 529 CB ILE A 33 3.598 1.649 1.705 1.00 0.00 C ATOM 530 CG1 ILE A 33 2.851 1.406 3.030 1.00 0.00 C ATOM 531 CG2 ILE A 33 4.535 0.462 1.435 1.00 0.00 C ATOM 532 CD1 ILE A 33 1.968 0.165 2.924 1.00 0.00 C ATOM 0 H ILE A 33 2.472 3.838 1.533 1.00 0.00 H new ATOM 0 HA ILE A 33 4.952 2.979 2.692 1.00 0.00 H new ATOM 0 HB ILE A 33 2.889 1.723 0.881 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.568 1.282 3.841 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.240 2.275 3.275 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.954 -0.459 1.397 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.044 0.610 0.483 1.00 0.00 H new ATOM 0 HG23 ILE A 33 5.273 0.392 2.234 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.447 0.007 3.868 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.239 0.305 2.126 1.00 0.00 H new ATOM 0 HD13 ILE A 33 2.587 -0.704 2.702 1.00 0.00 H new ATOM 544 N ARG A 34 4.836 3.514 -0.583 1.00 0.00 N ATOM 545 CA ARG A 34 5.663 3.690 -1.769 1.00 0.00 C ATOM 546 C ARG A 34 6.737 4.718 -1.466 1.00 0.00 C ATOM 547 O ARG A 34 7.898 4.482 -1.800 1.00 0.00 O ATOM 548 CB ARG A 34 4.824 4.076 -2.994 1.00 0.00 C ATOM 549 CG ARG A 34 3.785 3.012 -3.361 1.00 0.00 C ATOM 550 CD ARG A 34 3.372 3.112 -4.825 1.00 0.00 C ATOM 551 NE ARG A 34 4.330 2.423 -5.699 1.00 0.00 N ATOM 552 CZ ARG A 34 4.187 2.273 -7.017 1.00 0.00 C ATOM 553 NH1 ARG A 34 3.221 2.903 -7.676 1.00 0.00 N ATOM 554 NH2 ARG A 34 5.024 1.492 -7.682 1.00 0.00 N ATOM 0 H ARG A 34 3.845 3.699 -0.740 1.00 0.00 H new ATOM 0 HA ARG A 34 6.140 2.743 -2.021 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.316 5.021 -2.798 1.00 0.00 H new ATOM 0 HB3 ARG A 34 5.485 4.240 -3.845 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.194 2.021 -3.165 1.00 0.00 H new ATOM 0 HG3 ARG A 34 2.906 3.126 -2.726 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.381 2.678 -4.956 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.302 4.161 -5.114 1.00 0.00 H new ATOM 0 HE ARG A 34 5.166 2.030 -5.267 1.00 0.00 H new ATOM 0 HH11 ARG A 34 2.575 3.512 -7.174 1.00 0.00 H new ATOM 0 HH12 ARG A 34 3.125 2.778 -8.684 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.773 1.009 -7.187 1.00 0.00 H new ATOM 0 HH22 ARG A 34 4.920 1.374 -8.690 1.00 0.00 H new ATOM 568 N GLN A 35 6.373 5.827 -0.826 1.00 0.00 N ATOM 569 CA GLN A 35 7.318 6.869 -0.456 1.00 0.00 C ATOM 570 C GLN A 35 8.314 6.353 0.575 1.00 0.00 C ATOM 571 O GLN A 35 9.520 6.415 0.331 1.00 0.00 O ATOM 572 CB GLN A 35 6.578 8.078 0.126 1.00 0.00 C ATOM 573 CG GLN A 35 6.013 8.954 -0.985 1.00 0.00 C ATOM 574 CD GLN A 35 7.132 9.580 -1.819 1.00 0.00 C ATOM 575 OE1 GLN A 35 8.025 10.253 -1.305 1.00 0.00 O ATOM 576 NE2 GLN A 35 7.186 9.278 -3.108 1.00 0.00 N ATOM 0 H GLN A 35 5.411 6.025 -0.550 1.00 0.00 H new ATOM 0 HA GLN A 35 7.855 7.168 -1.356 1.00 0.00 H new ATOM 0 HB2 GLN A 35 5.770 7.738 0.773 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.258 8.662 0.746 1.00 0.00 H new ATOM 0 HG2 GLN A 35 5.366 8.358 -1.629 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.395 9.741 -0.553 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.445 8.720 -3.533 1.00 0.00 H new ATOM 0 HE22 GLN A 35 7.968 9.603 -3.676 1.00 0.00 H new ATOM 585 N LYS A 36 7.834 5.774 1.681 1.00 0.00 N ATOM 586 CA LYS A 36 8.699 5.266 2.740 1.00 0.00 C ATOM 587 C LYS A 36 9.723 4.276 2.200 1.00 0.00 C ATOM 588 O LYS A 36 10.919 4.396 2.472 1.00 0.00 O ATOM 589 CB LYS A 36 7.849 4.774 3.930 1.00 0.00 C ATOM 590 CG LYS A 36 7.755 3.258 4.175 1.00 0.00 C ATOM 591 CD LYS A 36 6.658 2.883 5.184 1.00 0.00 C ATOM 592 CE LYS A 36 6.565 3.777 6.424 1.00 0.00 C ATOM 593 NZ LYS A 36 7.796 3.781 7.250 1.00 0.00 N ATOM 0 H LYS A 36 6.838 5.647 1.863 1.00 0.00 H new ATOM 0 HA LYS A 36 9.312 6.073 3.142 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.245 5.234 4.835 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.836 5.154 3.796 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.559 2.753 3.229 1.00 0.00 H new ATOM 0 HG3 LYS A 36 8.716 2.893 4.538 1.00 0.00 H new ATOM 0 HD2 LYS A 36 5.696 2.902 4.671 1.00 0.00 H new ATOM 0 HD3 LYS A 36 6.825 1.856 5.510 1.00 0.00 H new ATOM 0 HE2 LYS A 36 6.346 4.797 6.110 1.00 0.00 H new ATOM 0 HE3 LYS A 36 5.727 3.446 7.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 7.662 4.406 8.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 7.996 2.815 7.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.595 4.125 6.680 1.00 0.00 H new ATOM 607 N TYR A 37 9.284 3.298 1.411 1.00 0.00 N ATOM 608 CA TYR A 37 10.201 2.324 0.858 1.00 0.00 C ATOM 609 C TYR A 37 11.125 2.968 -0.165 1.00 0.00 C ATOM 610 O TYR A 37 12.319 2.677 -0.113 1.00 0.00 O ATOM 611 CB TYR A 37 9.464 1.080 0.363 1.00 0.00 C ATOM 612 CG TYR A 37 9.194 0.099 1.495 1.00 0.00 C ATOM 613 CD1 TYR A 37 10.247 -0.388 2.294 1.00 0.00 C ATOM 614 CD2 TYR A 37 7.884 -0.323 1.766 1.00 0.00 C ATOM 615 CE1 TYR A 37 9.996 -1.300 3.327 1.00 0.00 C ATOM 616 CE2 TYR A 37 7.616 -1.241 2.797 1.00 0.00 C ATOM 617 CZ TYR A 37 8.678 -1.735 3.584 1.00 0.00 C ATOM 618 OH TYR A 37 8.440 -2.624 4.582 1.00 0.00 O ATOM 0 H TYR A 37 8.308 3.165 1.146 1.00 0.00 H new ATOM 0 HA TYR A 37 10.856 1.960 1.650 1.00 0.00 H new ATOM 0 HB2 TYR A 37 8.520 1.375 -0.096 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.056 0.590 -0.410 1.00 0.00 H new ATOM 0 HD1 TYR A 37 11.257 -0.055 2.108 1.00 0.00 H new ATOM 0 HD2 TYR A 37 7.068 0.063 1.173 1.00 0.00 H new ATOM 0 HE1 TYR A 37 10.813 -1.671 3.928 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.603 -1.566 2.985 1.00 0.00 H new ATOM 0 HH TYR A 37 7.476 -2.681 4.747 1.00 0.00 H new ATOM 628 N GLN A 38 10.651 3.881 -1.018 1.00 0.00 N ATOM 629 CA GLN A 38 11.502 4.549 -2.000 1.00 0.00 C ATOM 630 C GLN A 38 12.624 5.277 -1.255 1.00 0.00 C ATOM 631 O GLN A 38 13.781 5.142 -1.647 1.00 0.00 O ATOM 632 CB GLN A 38 10.666 5.520 -2.849 1.00 0.00 C ATOM 633 CG GLN A 38 11.429 6.314 -3.930 1.00 0.00 C ATOM 634 CD GLN A 38 11.224 5.807 -5.365 1.00 0.00 C ATOM 635 OE1 GLN A 38 10.138 5.382 -5.756 1.00 0.00 O ATOM 636 NE2 GLN A 38 12.245 5.872 -6.203 1.00 0.00 N ATOM 0 H GLN A 38 9.674 4.174 -1.046 1.00 0.00 H new ATOM 0 HA GLN A 38 11.943 3.820 -2.680 1.00 0.00 H new ATOM 0 HB2 GLN A 38 9.873 4.953 -3.337 1.00 0.00 H new ATOM 0 HB3 GLN A 38 10.183 6.231 -2.179 1.00 0.00 H new ATOM 0 HG2 GLN A 38 11.119 7.358 -3.881 1.00 0.00 H new ATOM 0 HG3 GLN A 38 12.494 6.286 -3.698 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.147 6.224 -5.882 1.00 0.00 H new ATOM 0 HE22 GLN A 38 12.131 5.570 -7.171 1.00 0.00 H new ATOM 645 N SER A 39 12.315 5.978 -0.162 1.00 0.00 N ATOM 646 CA SER A 39 13.265 6.711 0.665 1.00 0.00 C ATOM 647 C SER A 39 14.316 5.780 1.252 1.00 0.00 C ATOM 648 O SER A 39 15.498 6.119 1.281 1.00 0.00 O ATOM 649 CB SER A 39 12.479 7.423 1.772 1.00 0.00 C ATOM 650 OG SER A 39 13.328 8.293 2.475 1.00 0.00 O ATOM 0 H SER A 39 11.357 6.051 0.181 1.00 0.00 H new ATOM 0 HA SER A 39 13.798 7.442 0.057 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.649 7.981 1.339 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.049 6.690 2.454 1.00 0.00 H new ATOM 0 HG SER A 39 12.820 8.746 3.180 1.00 0.00 H new ATOM 656 N LYS A 40 13.915 4.598 1.719 1.00 0.00 N ATOM 657 CA LYS A 40 14.856 3.631 2.288 1.00 0.00 C ATOM 658 C LYS A 40 15.662 2.959 1.186 1.00 0.00 C ATOM 659 O LYS A 40 16.811 2.581 1.397 1.00 0.00 O ATOM 660 CB LYS A 40 14.123 2.587 3.140 1.00 0.00 C ATOM 661 CG LYS A 40 13.540 3.244 4.398 1.00 0.00 C ATOM 662 CD LYS A 40 13.011 2.232 5.414 1.00 0.00 C ATOM 663 CE LYS A 40 11.739 1.522 4.956 1.00 0.00 C ATOM 664 NZ LYS A 40 11.296 0.574 5.995 1.00 0.00 N ATOM 0 H LYS A 40 12.944 4.286 1.715 1.00 0.00 H new ATOM 0 HA LYS A 40 15.545 4.170 2.938 1.00 0.00 H new ATOM 0 HB2 LYS A 40 13.324 2.127 2.558 1.00 0.00 H new ATOM 0 HB3 LYS A 40 14.811 1.790 3.423 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.309 3.856 4.870 1.00 0.00 H new ATOM 0 HG3 LYS A 40 12.732 3.915 4.108 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.783 1.488 5.610 1.00 0.00 H new ATOM 0 HD3 LYS A 40 12.814 2.743 6.356 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.954 2.253 4.759 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.923 0.992 4.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.803 -0.225 5.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.123 0.222 6.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.650 1.056 6.652 1.00 0.00 H new ATOM 678 N ARG A 41 15.074 2.779 0.004 1.00 0.00 N ATOM 679 CA ARG A 41 15.713 2.147 -1.137 1.00 0.00 C ATOM 680 C ARG A 41 16.671 3.089 -1.852 1.00 0.00 C ATOM 681 O ARG A 41 17.667 2.622 -2.383 1.00 0.00 O ATOM 682 CB ARG A 41 14.632 1.609 -2.074 1.00 0.00 C ATOM 683 CG ARG A 41 15.189 0.625 -3.111 1.00 0.00 C ATOM 684 CD ARG A 41 14.142 0.279 -4.168 1.00 0.00 C ATOM 685 NE ARG A 41 13.747 1.480 -4.917 1.00 0.00 N ATOM 686 CZ ARG A 41 13.112 1.519 -6.084 1.00 0.00 C ATOM 687 NH1 ARG A 41 12.725 0.406 -6.688 1.00 0.00 N ATOM 688 NH2 ARG A 41 12.879 2.696 -6.643 1.00 0.00 N ATOM 0 H ARG A 41 14.117 3.078 -0.186 1.00 0.00 H new ATOM 0 HA ARG A 41 16.325 1.317 -0.785 1.00 0.00 H new ATOM 0 HB2 ARG A 41 13.860 1.113 -1.486 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.154 2.443 -2.589 1.00 0.00 H new ATOM 0 HG2 ARG A 41 16.065 1.059 -3.593 1.00 0.00 H new ATOM 0 HG3 ARG A 41 15.518 -0.286 -2.611 1.00 0.00 H new ATOM 0 HD2 ARG A 41 14.542 -0.468 -4.853 1.00 0.00 H new ATOM 0 HD3 ARG A 41 13.267 -0.162 -3.690 1.00 0.00 H new ATOM 0 HE ARG A 41 13.985 2.378 -4.497 1.00 0.00 H new ATOM 0 HH11 ARG A 41 12.913 -0.500 -6.258 1.00 0.00 H new ATOM 0 HH12 ARG A 41 12.239 0.454 -7.583 1.00 0.00 H new ATOM 0 HH21 ARG A 41 13.185 3.551 -6.178 1.00 0.00 H new ATOM 0 HH22 ARG A 41 12.393 2.748 -7.538 1.00 0.00 H new ATOM 702 N GLN A 42 16.396 4.387 -1.848 1.00 0.00 N ATOM 703 CA GLN A 42 17.181 5.453 -2.464 1.00 0.00 C ATOM 704 C GLN A 42 18.665 5.238 -2.150 1.00 0.00 C ATOM 705 O GLN A 42 19.399 4.956 -3.088 1.00 0.00 O ATOM 706 CB GLN A 42 16.635 6.846 -2.066 1.00 0.00 C ATOM 707 CG GLN A 42 17.528 8.034 -2.488 1.00 0.00 C ATOM 708 CD GLN A 42 17.810 8.084 -3.990 1.00 0.00 C ATOM 709 OE1 GLN A 42 16.880 8.126 -4.796 1.00 0.00 O ATOM 710 NE2 GLN A 42 19.065 8.045 -4.404 1.00 0.00 N ATOM 0 H GLN A 42 15.563 4.749 -1.384 1.00 0.00 H new ATOM 0 HA GLN A 42 17.085 5.417 -3.549 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.648 6.975 -2.511 1.00 0.00 H new ATOM 0 HB3 GLN A 42 16.503 6.874 -0.984 1.00 0.00 H new ATOM 0 HG2 GLN A 42 17.047 8.964 -2.186 1.00 0.00 H new ATOM 0 HG3 GLN A 42 18.475 7.975 -1.951 1.00 0.00 H new ATOM 0 HE21 GLN A 42 19.825 8.010 -3.725 1.00 0.00 H new ATOM 0 HE22 GLN A 42 19.273 8.050 -5.403 1.00 0.00 H new ATOM 719 N PRO A 43 19.113 5.256 -0.881 1.00 0.00 N ATOM 720 CA PRO A 43 20.512 5.061 -0.521 1.00 0.00 C ATOM 721 C PRO A 43 21.094 3.726 -0.982 1.00 0.00 C ATOM 722 O PRO A 43 22.316 3.630 -1.051 1.00 0.00 O ATOM 723 CB PRO A 43 20.596 5.208 1.005 1.00 0.00 C ATOM 724 CG PRO A 43 19.158 4.998 1.454 1.00 0.00 C ATOM 725 CD PRO A 43 18.352 5.561 0.310 1.00 0.00 C ATOM 0 HA PRO A 43 21.118 5.806 -1.036 1.00 0.00 H new ATOM 0 HB2 PRO A 43 21.267 4.470 1.444 1.00 0.00 H new ATOM 0 HB3 PRO A 43 20.969 6.190 1.295 1.00 0.00 H new ATOM 0 HG2 PRO A 43 18.938 3.943 1.620 1.00 0.00 H new ATOM 0 HG3 PRO A 43 18.948 5.518 2.388 1.00 0.00 H new ATOM 0 HD2 PRO A 43 17.360 5.111 0.269 1.00 0.00 H new ATOM 0 HD3 PRO A 43 18.210 6.636 0.421 1.00 0.00 H new ATOM 733 N ILE A 44 20.262 2.710 -1.237 1.00 0.00 N ATOM 734 CA ILE A 44 20.677 1.394 -1.701 1.00 0.00 C ATOM 735 C ILE A 44 21.083 1.535 -3.174 1.00 0.00 C ATOM 736 O ILE A 44 22.178 1.119 -3.542 1.00 0.00 O ATOM 737 CB ILE A 44 19.557 0.334 -1.510 1.00 0.00 C ATOM 738 CG1 ILE A 44 18.962 0.244 -0.090 1.00 0.00 C ATOM 739 CG2 ILE A 44 20.158 -1.034 -1.833 1.00 0.00 C ATOM 740 CD1 ILE A 44 17.720 -0.647 0.030 1.00 0.00 C ATOM 0 H ILE A 44 19.252 2.790 -1.121 1.00 0.00 H new ATOM 0 HA ILE A 44 21.521 1.037 -1.111 1.00 0.00 H new ATOM 0 HB ILE A 44 18.742 0.638 -2.167 1.00 0.00 H new ATOM 0 HG12 ILE A 44 19.729 -0.132 0.587 1.00 0.00 H new ATOM 0 HG13 ILE A 44 18.705 1.249 0.246 1.00 0.00 H new ATOM 0 HG21 ILE A 44 19.397 -1.804 -1.709 1.00 0.00 H new ATOM 0 HG22 ILE A 44 20.516 -1.040 -2.862 1.00 0.00 H new ATOM 0 HG23 ILE A 44 20.990 -1.234 -1.158 1.00 0.00 H new ATOM 0 HD11 ILE A 44 17.372 -0.649 1.063 1.00 0.00 H new ATOM 0 HD12 ILE A 44 16.932 -0.262 -0.617 1.00 0.00 H new ATOM 0 HD13 ILE A 44 17.971 -1.664 -0.270 1.00 0.00 H new ATOM 752 N LEU A 45 20.211 2.103 -4.017 1.00 0.00 N ATOM 753 CA LEU A 45 20.505 2.292 -5.443 1.00 0.00 C ATOM 754 C LEU A 45 21.683 3.241 -5.556 1.00 0.00 C ATOM 755 O LEU A 45 22.592 3.025 -6.349 1.00 0.00 O ATOM 756 CB LEU A 45 19.362 2.934 -6.267 1.00 0.00 C ATOM 757 CG LEU A 45 17.943 2.598 -5.826 1.00 0.00 C ATOM 758 CD1 LEU A 45 16.886 3.267 -6.703 1.00 0.00 C ATOM 759 CD2 LEU A 45 17.692 1.087 -5.845 1.00 0.00 C ATOM 0 H LEU A 45 19.291 2.441 -3.734 1.00 0.00 H new ATOM 0 HA LEU A 45 20.682 1.293 -5.842 1.00 0.00 H new ATOM 0 HB2 LEU A 45 19.483 4.017 -6.235 1.00 0.00 H new ATOM 0 HB3 LEU A 45 19.478 2.631 -7.308 1.00 0.00 H new ATOM 0 HG LEU A 45 17.855 2.979 -4.809 1.00 0.00 H new ATOM 0 HD11 LEU A 45 15.892 2.995 -6.347 1.00 0.00 H new ATOM 0 HD12 LEU A 45 17.005 4.349 -6.655 1.00 0.00 H new ATOM 0 HD13 LEU A 45 17.005 2.934 -7.734 1.00 0.00 H new ATOM 0 HD21 LEU A 45 16.670 0.884 -5.525 1.00 0.00 H new ATOM 0 HD22 LEU A 45 17.838 0.707 -6.856 1.00 0.00 H new ATOM 0 HD23 LEU A 45 18.389 0.594 -5.168 1.00 0.00 H new ATOM 771 N ASP A 46 21.656 4.277 -4.716 1.00 0.00 N ATOM 772 CA ASP A 46 22.676 5.297 -4.695 1.00 0.00 C ATOM 773 C ASP A 46 24.038 4.648 -4.416 1.00 0.00 C ATOM 774 O ASP A 46 25.030 4.984 -5.043 1.00 0.00 O ATOM 775 CB ASP A 46 22.305 6.328 -3.628 1.00 0.00 C ATOM 776 CG ASP A 46 22.793 7.752 -3.862 1.00 0.00 C ATOM 777 OD1 ASP A 46 24.010 8.000 -3.985 1.00 0.00 O ATOM 778 OD2 ASP A 46 21.914 8.642 -3.758 1.00 0.00 O ATOM 0 H ASP A 46 20.915 4.422 -4.030 1.00 0.00 H new ATOM 0 HA ASP A 46 22.745 5.804 -5.657 1.00 0.00 H new ATOM 0 HB2 ASP A 46 21.219 6.350 -3.537 1.00 0.00 H new ATOM 0 HB3 ASP A 46 22.698 5.985 -2.671 1.00 0.00 H new ATOM 783 N ALA A 47 24.066 3.676 -3.486 1.00 0.00 N ATOM 784 CA ALA A 47 25.270 2.962 -3.114 1.00 0.00 C ATOM 785 C ALA A 47 25.787 2.072 -4.245 1.00 0.00 C ATOM 786 O ALA A 47 26.954 2.191 -4.584 1.00 0.00 O ATOM 787 CB ALA A 47 25.023 2.099 -1.863 1.00 0.00 C ATOM 0 H ALA A 47 23.237 3.372 -2.975 1.00 0.00 H new ATOM 0 HA ALA A 47 26.028 3.715 -2.901 1.00 0.00 H new ATOM 0 HB1 ALA A 47 25.939 1.570 -1.599 1.00 0.00 H new ATOM 0 HB2 ALA A 47 24.721 2.739 -1.034 1.00 0.00 H new ATOM 0 HB3 ALA A 47 24.234 1.376 -2.070 1.00 0.00 H new ATOM 793 N ILE A 48 24.972 1.191 -4.834 1.00 0.00 N ATOM 794 CA ILE A 48 25.469 0.321 -5.897 1.00 0.00 C ATOM 795 C ILE A 48 25.929 1.102 -7.120 1.00 0.00 C ATOM 796 O ILE A 48 26.890 0.688 -7.768 1.00 0.00 O ATOM 797 CB ILE A 48 24.471 -0.792 -6.269 1.00 0.00 C ATOM 798 CG1 ILE A 48 25.186 -1.929 -7.021 1.00 0.00 C ATOM 799 CG2 ILE A 48 23.218 -0.287 -6.986 1.00 0.00 C ATOM 800 CD1 ILE A 48 24.351 -3.207 -7.061 1.00 0.00 C ATOM 0 H ILE A 48 23.988 1.065 -4.598 1.00 0.00 H new ATOM 0 HA ILE A 48 26.350 -0.175 -5.490 1.00 0.00 H new ATOM 0 HB ILE A 48 24.088 -1.202 -5.334 1.00 0.00 H new ATOM 0 HG12 ILE A 48 25.405 -1.608 -8.039 1.00 0.00 H new ATOM 0 HG13 ILE A 48 26.142 -2.136 -6.540 1.00 0.00 H new ATOM 0 HG21 ILE A 48 22.565 -1.129 -7.214 1.00 0.00 H new ATOM 0 HG22 ILE A 48 22.690 0.417 -6.343 1.00 0.00 H new ATOM 0 HG23 ILE A 48 23.505 0.211 -7.912 1.00 0.00 H new ATOM 0 HD11 ILE A 48 24.896 -3.981 -7.602 1.00 0.00 H new ATOM 0 HD12 ILE A 48 24.154 -3.545 -6.044 1.00 0.00 H new ATOM 0 HD13 ILE A 48 23.406 -3.008 -7.566 1.00 0.00 H new ATOM 812 N GLU A 49 25.275 2.217 -7.429 1.00 0.00 N ATOM 813 CA GLU A 49 25.641 3.020 -8.581 1.00 0.00 C ATOM 814 C GLU A 49 26.882 3.877 -8.288 1.00 0.00 C ATOM 815 O GLU A 49 27.513 4.370 -9.226 1.00 0.00 O ATOM 816 CB GLU A 49 24.425 3.825 -9.067 1.00 0.00 C ATOM 817 CG GLU A 49 23.333 2.859 -9.568 1.00 0.00 C ATOM 818 CD GLU A 49 22.044 3.508 -10.065 1.00 0.00 C ATOM 819 OE1 GLU A 49 21.905 4.755 -10.057 1.00 0.00 O ATOM 820 OE2 GLU A 49 21.150 2.735 -10.500 1.00 0.00 O ATOM 0 H GLU A 49 24.487 2.582 -6.894 1.00 0.00 H new ATOM 0 HA GLU A 49 25.931 2.369 -9.405 1.00 0.00 H new ATOM 0 HB2 GLU A 49 24.036 4.441 -8.256 1.00 0.00 H new ATOM 0 HB3 GLU A 49 24.721 4.502 -9.868 1.00 0.00 H new ATOM 0 HG2 GLU A 49 23.750 2.259 -10.377 1.00 0.00 H new ATOM 0 HG3 GLU A 49 23.083 2.173 -8.758 1.00 0.00 H new ATOM 827 N ALA A 50 27.247 4.063 -7.016 1.00 0.00 N ATOM 828 CA ALA A 50 28.423 4.834 -6.597 1.00 0.00 C ATOM 829 C ALA A 50 29.623 3.907 -6.341 1.00 0.00 C ATOM 830 O ALA A 50 30.768 4.334 -6.456 1.00 0.00 O ATOM 831 CB ALA A 50 28.103 5.624 -5.323 1.00 0.00 C ATOM 0 H ALA A 50 26.723 3.674 -6.232 1.00 0.00 H new ATOM 0 HA ALA A 50 28.682 5.525 -7.399 1.00 0.00 H new ATOM 0 HB1 ALA A 50 28.981 6.194 -5.018 1.00 0.00 H new ATOM 0 HB2 ALA A 50 27.276 6.307 -5.517 1.00 0.00 H new ATOM 0 HB3 ALA A 50 27.824 4.933 -4.527 1.00 0.00 H new ATOM 890 N TYR B 104 19.696 4.286 6.796 1.00 0.00 N ATOM 891 CA TYR B 104 20.469 3.327 6.000 1.00 0.00 C ATOM 892 C TYR B 104 21.559 4.024 5.171 1.00 0.00 C ATOM 893 O TYR B 104 22.151 3.430 4.276 1.00 0.00 O ATOM 894 CB TYR B 104 19.508 2.510 5.118 1.00 0.00 C ATOM 895 CG TYR B 104 18.597 1.571 5.886 1.00 0.00 C ATOM 896 CD1 TYR B 104 19.114 0.365 6.386 1.00 0.00 C ATOM 897 CD2 TYR B 104 17.255 1.908 6.132 1.00 0.00 C ATOM 898 CE1 TYR B 104 18.313 -0.484 7.164 1.00 0.00 C ATOM 899 CE2 TYR B 104 16.444 1.065 6.915 1.00 0.00 C ATOM 900 CZ TYR B 104 16.974 -0.134 7.441 1.00 0.00 C ATOM 901 OH TYR B 104 16.209 -0.930 8.240 1.00 0.00 O ATOM 0 HA TYR B 104 20.991 2.646 6.673 1.00 0.00 H new ATOM 0 HB2 TYR B 104 18.894 3.198 4.537 1.00 0.00 H new ATOM 0 HB3 TYR B 104 20.094 1.927 4.407 1.00 0.00 H new ATOM 0 HD1 TYR B 104 20.136 0.089 6.170 1.00 0.00 H new ATOM 0 HD2 TYR B 104 16.844 2.817 5.719 1.00 0.00 H new ATOM 0 HE1 TYR B 104 18.721 -1.406 7.551 1.00 0.00 H new ATOM 0 HE2 TYR B 104 15.417 1.335 7.113 1.00 0.00 H new ATOM 0 HH TYR B 104 15.314 -0.542 8.327 1.00 0.00 H new ATOM 911 N GLU B 105 21.861 5.286 5.458 1.00 0.00 N ATOM 912 CA GLU B 105 22.853 6.092 4.738 1.00 0.00 C ATOM 913 C GLU B 105 24.268 5.484 4.692 1.00 0.00 C ATOM 914 O GLU B 105 25.044 5.807 3.793 1.00 0.00 O ATOM 915 CB GLU B 105 22.883 7.502 5.340 1.00 0.00 C ATOM 916 CG GLU B 105 21.496 8.166 5.324 1.00 0.00 C ATOM 917 CD GLU B 105 21.583 9.614 5.792 1.00 0.00 C ATOM 918 OE1 GLU B 105 21.746 9.834 7.015 1.00 0.00 O ATOM 919 OE2 GLU B 105 21.519 10.517 4.928 1.00 0.00 O ATOM 0 H GLU B 105 21.412 5.795 6.219 1.00 0.00 H new ATOM 0 HA GLU B 105 22.534 6.122 3.696 1.00 0.00 H new ATOM 0 HB2 GLU B 105 23.248 7.450 6.366 1.00 0.00 H new ATOM 0 HB3 GLU B 105 23.587 8.119 4.782 1.00 0.00 H new ATOM 0 HG2 GLU B 105 21.082 8.129 4.316 1.00 0.00 H new ATOM 0 HG3 GLU B 105 20.815 7.611 5.969 1.00 0.00 H new ATOM 926 N PHE B 106 24.621 4.601 5.631 1.00 0.00 N ATOM 927 CA PHE B 106 25.930 3.949 5.688 1.00 0.00 C ATOM 928 C PHE B 106 26.083 2.881 4.597 1.00 0.00 C ATOM 929 O PHE B 106 27.192 2.393 4.390 1.00 0.00 O ATOM 930 CB PHE B 106 26.185 3.368 7.088 1.00 0.00 C ATOM 931 CG PHE B 106 26.716 4.383 8.089 1.00 0.00 C ATOM 932 CD1 PHE B 106 25.892 5.422 8.559 1.00 0.00 C ATOM 933 CD2 PHE B 106 28.050 4.307 8.535 1.00 0.00 C ATOM 934 CE1 PHE B 106 26.390 6.368 9.472 1.00 0.00 C ATOM 935 CE2 PHE B 106 28.551 5.258 9.443 1.00 0.00 C ATOM 936 CZ PHE B 106 27.720 6.288 9.917 1.00 0.00 C ATOM 0 H PHE B 106 23.995 4.316 6.384 1.00 0.00 H new ATOM 0 HA PHE B 106 26.689 4.707 5.494 1.00 0.00 H new ATOM 0 HB2 PHE B 106 25.255 2.947 7.471 1.00 0.00 H new ATOM 0 HB3 PHE B 106 26.897 2.547 7.006 1.00 0.00 H new ATOM 0 HD1 PHE B 106 24.870 5.493 8.216 1.00 0.00 H new ATOM 0 HD2 PHE B 106 28.691 3.515 8.178 1.00 0.00 H new ATOM 0 HE1 PHE B 106 25.748 7.158 9.832 1.00 0.00 H new ATOM 0 HE2 PHE B 106 29.576 5.196 9.777 1.00 0.00 H new ATOM 0 HZ PHE B 106 28.102 7.014 10.620 1.00 0.00 H new ATOM 946 N LEU B 107 25.010 2.555 3.859 1.00 0.00 N ATOM 947 CA LEU B 107 25.009 1.569 2.771 1.00 0.00 C ATOM 948 C LEU B 107 26.085 1.863 1.737 1.00 0.00 C ATOM 949 O LEU B 107 26.517 0.959 1.031 1.00 0.00 O ATOM 950 CB LEU B 107 23.664 1.596 2.033 1.00 0.00 C ATOM 951 CG LEU B 107 22.584 0.743 2.703 1.00 0.00 C ATOM 952 CD1 LEU B 107 21.236 1.196 2.151 1.00 0.00 C ATOM 953 CD2 LEU B 107 22.772 -0.745 2.383 1.00 0.00 C ATOM 0 H LEU B 107 24.096 2.982 4.008 1.00 0.00 H new ATOM 0 HA LEU B 107 25.194 0.599 3.232 1.00 0.00 H new ATOM 0 HB2 LEU B 107 23.314 2.626 1.969 1.00 0.00 H new ATOM 0 HB3 LEU B 107 23.812 1.245 1.012 1.00 0.00 H new ATOM 0 HG LEU B 107 22.644 0.867 3.784 1.00 0.00 H new ATOM 0 HD11 LEU B 107 20.440 0.608 2.607 1.00 0.00 H new ATOM 0 HD12 LEU B 107 21.085 2.251 2.380 1.00 0.00 H new ATOM 0 HD13 LEU B 107 21.219 1.053 1.071 1.00 0.00 H new ATOM 0 HD21 LEU B 107 21.990 -1.324 2.873 1.00 0.00 H new ATOM 0 HD22 LEU B 107 22.714 -0.896 1.305 1.00 0.00 H new ATOM 0 HD23 LEU B 107 23.747 -1.074 2.743 1.00 0.00 H new ATOM 965 N LYS B 108 26.496 3.126 1.626 1.00 0.00 N ATOM 966 CA LYS B 108 27.531 3.552 0.692 1.00 0.00 C ATOM 967 C LYS B 108 28.842 2.792 0.930 1.00 0.00 C ATOM 968 O LYS B 108 29.605 2.571 -0.003 1.00 0.00 O ATOM 969 CB LYS B 108 27.755 5.058 0.875 1.00 0.00 C ATOM 970 CG LYS B 108 26.514 5.917 0.588 1.00 0.00 C ATOM 971 CD LYS B 108 26.003 5.794 -0.847 1.00 0.00 C ATOM 972 CE LYS B 108 24.940 6.850 -1.148 1.00 0.00 C ATOM 973 NZ LYS B 108 23.698 6.672 -0.366 1.00 0.00 N ATOM 0 H LYS B 108 26.115 3.887 2.188 1.00 0.00 H new ATOM 0 HA LYS B 108 27.208 3.336 -0.326 1.00 0.00 H new ATOM 0 HB2 LYS B 108 28.083 5.244 1.898 1.00 0.00 H new ATOM 0 HB3 LYS B 108 28.564 5.377 0.218 1.00 0.00 H new ATOM 0 HG2 LYS B 108 25.717 5.630 1.274 1.00 0.00 H new ATOM 0 HG3 LYS B 108 26.750 6.961 0.792 1.00 0.00 H new ATOM 0 HD2 LYS B 108 26.835 5.903 -1.543 1.00 0.00 H new ATOM 0 HD3 LYS B 108 25.586 4.799 -1.003 1.00 0.00 H new ATOM 0 HE2 LYS B 108 25.352 7.838 -0.942 1.00 0.00 H new ATOM 0 HE3 LYS B 108 24.699 6.820 -2.211 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 23.020 7.419 -0.617 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 23.284 5.742 -0.579 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 23.916 6.729 0.649 1.00 0.00 H new ATOM 987 N SER B 109 29.083 2.368 2.169 1.00 0.00 N ATOM 988 CA SER B 109 30.273 1.647 2.582 1.00 0.00 C ATOM 989 C SER B 109 30.036 0.134 2.709 1.00 0.00 C ATOM 990 O SER B 109 30.933 -0.566 3.177 1.00 0.00 O ATOM 991 CB SER B 109 30.721 2.231 3.930 1.00 0.00 C ATOM 992 OG SER B 109 30.725 3.656 3.921 1.00 0.00 O ATOM 0 H SER B 109 28.429 2.525 2.936 1.00 0.00 H new ATOM 0 HA SER B 109 31.043 1.768 1.820 1.00 0.00 H new ATOM 0 HB2 SER B 109 30.057 1.876 4.718 1.00 0.00 H new ATOM 0 HB3 SER B 109 31.721 1.867 4.168 1.00 0.00 H new ATOM 0 HG SER B 109 31.014 3.988 4.797 1.00 0.00 H new ATOM 998 N TRP B 110 28.832 -0.371 2.413 1.00 0.00 N ATOM 999 CA TRP B 110 28.524 -1.794 2.519 1.00 0.00 C ATOM 1000 C TRP B 110 29.026 -2.550 1.287 1.00 0.00 C ATOM 1001 O TRP B 110 29.402 -1.966 0.268 1.00 0.00 O ATOM 1002 CB TRP B 110 27.002 -2.000 2.661 1.00 0.00 C ATOM 1003 CG TRP B 110 26.393 -1.944 4.035 1.00 0.00 C ATOM 1004 CD1 TRP B 110 25.248 -2.587 4.349 1.00 0.00 C ATOM 1005 CD2 TRP B 110 26.822 -1.283 5.275 1.00 0.00 C ATOM 1006 NE1 TRP B 110 24.950 -2.405 5.680 1.00 0.00 N ATOM 1007 CE2 TRP B 110 25.865 -1.581 6.291 1.00 0.00 C ATOM 1008 CE3 TRP B 110 27.910 -0.475 5.674 1.00 0.00 C ATOM 1009 CZ2 TRP B 110 25.966 -1.089 7.599 1.00 0.00 C ATOM 1010 CZ3 TRP B 110 28.018 0.039 6.979 1.00 0.00 C ATOM 1011 CH2 TRP B 110 27.038 -0.251 7.940 1.00 0.00 C ATOM 0 H TRP B 110 28.048 0.198 2.094 1.00 0.00 H new ATOM 0 HA TRP B 110 29.028 -2.185 3.403 1.00 0.00 H new ATOM 0 HB2 TRP B 110 26.507 -1.246 2.049 1.00 0.00 H new ATOM 0 HB3 TRP B 110 26.758 -2.971 2.230 1.00 0.00 H new ATOM 0 HD1 TRP B 110 24.652 -3.161 3.655 1.00 0.00 H new ATOM 0 HE1 TRP B 110 24.151 -2.828 6.153 1.00 0.00 H new ATOM 0 HE3 TRP B 110 28.682 -0.245 4.955 1.00 0.00 H new ATOM 0 HZ2 TRP B 110 25.225 -1.353 8.339 1.00 0.00 H new ATOM 0 HZ3 TRP B 110 28.861 0.661 7.243 1.00 0.00 H new ATOM 0 HH2 TRP B 110 27.108 0.167 8.933 1.00 0.00 H new ATOM 1022 N THR B 111 29.059 -3.877 1.396 1.00 0.00 N ATOM 1023 CA THR B 111 29.468 -4.728 0.293 1.00 0.00 C ATOM 1024 C THR B 111 28.339 -4.736 -0.741 1.00 0.00 C ATOM 1025 O THR B 111 27.174 -4.469 -0.420 1.00 0.00 O ATOM 1026 CB THR B 111 29.768 -6.158 0.784 1.00 0.00 C ATOM 1027 OG1 THR B 111 28.848 -6.622 1.748 1.00 0.00 O ATOM 1028 CG2 THR B 111 31.172 -6.271 1.366 1.00 0.00 C ATOM 0 H THR B 111 28.805 -4.383 2.244 1.00 0.00 H new ATOM 0 HA THR B 111 30.384 -4.343 -0.155 1.00 0.00 H new ATOM 0 HB THR B 111 29.679 -6.783 -0.105 1.00 0.00 H new ATOM 0 HG1 THR B 111 29.089 -7.533 2.019 1.00 0.00 H new ATOM 0 HG21 THR B 111 31.346 -7.294 1.701 1.00 0.00 H new ATOM 0 HG22 THR B 111 31.905 -6.010 0.602 1.00 0.00 H new ATOM 0 HG23 THR B 111 31.271 -5.590 2.212 1.00 0.00 H new ATOM 1036 N VAL B 112 28.683 -5.064 -1.986 1.00 0.00 N ATOM 1037 CA VAL B 112 27.722 -5.146 -3.074 1.00 0.00 C ATOM 1038 C VAL B 112 26.641 -6.154 -2.687 1.00 0.00 C ATOM 1039 O VAL B 112 25.464 -5.895 -2.911 1.00 0.00 O ATOM 1040 CB VAL B 112 28.399 -5.566 -4.399 1.00 0.00 C ATOM 1041 CG1 VAL B 112 27.450 -5.348 -5.587 1.00 0.00 C ATOM 1042 CG2 VAL B 112 29.716 -4.826 -4.676 1.00 0.00 C ATOM 0 H VAL B 112 29.640 -5.280 -2.264 1.00 0.00 H new ATOM 0 HA VAL B 112 27.282 -4.162 -3.237 1.00 0.00 H new ATOM 0 HB VAL B 112 28.633 -6.624 -4.285 1.00 0.00 H new ATOM 0 HG11 VAL B 112 27.946 -5.650 -6.509 1.00 0.00 H new ATOM 0 HG12 VAL B 112 26.549 -5.945 -5.447 1.00 0.00 H new ATOM 0 HG13 VAL B 112 27.180 -4.294 -5.649 1.00 0.00 H new ATOM 0 HG21 VAL B 112 30.135 -5.171 -5.621 1.00 0.00 H new ATOM 0 HG22 VAL B 112 29.526 -3.754 -4.733 1.00 0.00 H new ATOM 0 HG23 VAL B 112 30.423 -5.027 -3.871 1.00 0.00 H new ATOM 1052 N GLU B 113 27.004 -7.292 -2.087 1.00 0.00 N ATOM 1053 CA GLU B 113 25.995 -8.265 -1.706 1.00 0.00 C ATOM 1054 C GLU B 113 25.086 -7.702 -0.618 1.00 0.00 C ATOM 1055 O GLU B 113 23.869 -7.723 -0.771 1.00 0.00 O ATOM 1056 CB GLU B 113 26.623 -9.576 -1.224 1.00 0.00 C ATOM 1057 CG GLU B 113 27.216 -10.425 -2.353 1.00 0.00 C ATOM 1058 CD GLU B 113 27.196 -11.909 -1.973 1.00 0.00 C ATOM 1059 OE1 GLU B 113 28.098 -12.387 -1.244 1.00 0.00 O ATOM 1060 OE2 GLU B 113 26.251 -12.623 -2.387 1.00 0.00 O ATOM 0 H GLU B 113 27.965 -7.551 -1.862 1.00 0.00 H new ATOM 0 HA GLU B 113 25.403 -8.478 -2.596 1.00 0.00 H new ATOM 0 HB2 GLU B 113 27.407 -9.349 -0.501 1.00 0.00 H new ATOM 0 HB3 GLU B 113 25.866 -10.160 -0.701 1.00 0.00 H new ATOM 0 HG2 GLU B 113 26.647 -10.270 -3.270 1.00 0.00 H new ATOM 0 HG3 GLU B 113 28.239 -10.109 -2.555 1.00 0.00 H new ATOM 1067 N ASP B 114 25.654 -7.166 0.461 1.00 0.00 N ATOM 1068 CA ASP B 114 24.865 -6.644 1.576 1.00 0.00 C ATOM 1069 C ASP B 114 23.900 -5.537 1.191 1.00 0.00 C ATOM 1070 O ASP B 114 22.822 -5.440 1.786 1.00 0.00 O ATOM 1071 CB ASP B 114 25.777 -6.146 2.694 1.00 0.00 C ATOM 1072 CG ASP B 114 26.247 -7.259 3.629 1.00 0.00 C ATOM 1073 OD1 ASP B 114 25.900 -8.446 3.444 1.00 0.00 O ATOM 1074 OD2 ASP B 114 26.880 -6.916 4.652 1.00 0.00 O ATOM 0 H ASP B 114 26.663 -7.082 0.587 1.00 0.00 H new ATOM 0 HA ASP B 114 24.261 -7.485 1.917 1.00 0.00 H new ATOM 0 HB2 ASP B 114 26.647 -5.658 2.254 1.00 0.00 H new ATOM 0 HB3 ASP B 114 25.249 -5.391 3.276 1.00 0.00 H new ATOM 1079 N LEU B 115 24.269 -4.677 0.243 1.00 0.00 N ATOM 1080 CA LEU B 115 23.388 -3.602 -0.185 1.00 0.00 C ATOM 1081 C LEU B 115 22.258 -4.199 -1.033 1.00 0.00 C ATOM 1082 O LEU B 115 21.086 -3.911 -0.793 1.00 0.00 O ATOM 1083 CB LEU B 115 24.194 -2.481 -0.882 1.00 0.00 C ATOM 1084 CG LEU B 115 24.433 -2.662 -2.396 1.00 0.00 C ATOM 1085 CD1 LEU B 115 23.225 -2.152 -3.185 1.00 0.00 C ATOM 1086 CD2 LEU B 115 25.687 -1.905 -2.847 1.00 0.00 C ATOM 0 H LEU B 115 25.168 -4.706 -0.238 1.00 0.00 H new ATOM 0 HA LEU B 115 22.918 -3.116 0.670 1.00 0.00 H new ATOM 0 HB2 LEU B 115 23.673 -1.536 -0.727 1.00 0.00 H new ATOM 0 HB3 LEU B 115 25.162 -2.396 -0.389 1.00 0.00 H new ATOM 0 HG LEU B 115 24.575 -3.725 -2.589 1.00 0.00 H new ATOM 0 HD11 LEU B 115 23.405 -2.285 -4.252 1.00 0.00 H new ATOM 0 HD12 LEU B 115 22.337 -2.713 -2.894 1.00 0.00 H new ATOM 0 HD13 LEU B 115 23.071 -1.094 -2.972 1.00 0.00 H new ATOM 0 HD21 LEU B 115 25.833 -2.049 -3.918 1.00 0.00 H new ATOM 0 HD22 LEU B 115 25.566 -0.842 -2.637 1.00 0.00 H new ATOM 0 HD23 LEU B 115 26.555 -2.285 -2.308 1.00 0.00 H new ATOM 1098 N GLN B 116 22.600 -5.057 -1.998 1.00 0.00 N ATOM 1099 CA GLN B 116 21.682 -5.709 -2.923 1.00 0.00 C ATOM 1100 C GLN B 116 20.652 -6.501 -2.155 1.00 0.00 C ATOM 1101 O GLN B 116 19.461 -6.443 -2.439 1.00 0.00 O ATOM 1102 CB GLN B 116 22.481 -6.659 -3.801 1.00 0.00 C ATOM 1103 CG GLN B 116 23.179 -5.906 -4.906 1.00 0.00 C ATOM 1104 CD GLN B 116 22.276 -5.541 -6.085 1.00 0.00 C ATOM 1105 OE1 GLN B 116 21.235 -4.914 -5.923 1.00 0.00 O ATOM 1106 NE2 GLN B 116 22.685 -5.872 -7.295 1.00 0.00 N ATOM 0 H GLN B 116 23.571 -5.325 -2.159 1.00 0.00 H new ATOM 0 HA GLN B 116 21.176 -4.958 -3.529 1.00 0.00 H new ATOM 0 HB2 GLN B 116 23.216 -7.190 -3.196 1.00 0.00 H new ATOM 0 HB3 GLN B 116 21.818 -7.411 -4.229 1.00 0.00 H new ATOM 0 HG2 GLN B 116 23.606 -4.992 -4.494 1.00 0.00 H new ATOM 0 HG3 GLN B 116 24.010 -6.509 -5.272 1.00 0.00 H new ATOM 0 HE21 GLN B 116 23.553 -6.394 -7.415 1.00 0.00 H new ATOM 0 HE22 GLN B 116 22.133 -5.606 -8.110 1.00 0.00 H new ATOM 1115 N LYS B 117 21.125 -7.200 -1.130 1.00 0.00 N ATOM 1116 CA LYS B 117 20.263 -8.001 -0.254 1.00 0.00 C ATOM 1117 C LYS B 117 19.148 -7.128 0.312 1.00 0.00 C ATOM 1118 O LYS B 117 18.025 -7.617 0.450 1.00 0.00 O ATOM 1119 CB LYS B 117 21.050 -8.743 0.841 1.00 0.00 C ATOM 1120 CG LYS B 117 21.309 -10.207 0.446 1.00 0.00 C ATOM 1121 CD LYS B 117 22.197 -10.342 -0.800 1.00 0.00 C ATOM 1122 CE LYS B 117 22.276 -11.766 -1.328 1.00 0.00 C ATOM 1123 NZ LYS B 117 23.019 -12.650 -0.412 1.00 0.00 N ATOM 0 H LYS B 117 22.113 -7.231 -0.879 1.00 0.00 H new ATOM 0 HA LYS B 117 19.808 -8.788 -0.855 1.00 0.00 H new ATOM 0 HB2 LYS B 117 22.000 -8.237 1.016 1.00 0.00 H new ATOM 0 HB3 LYS B 117 20.494 -8.709 1.778 1.00 0.00 H new ATOM 0 HG2 LYS B 117 21.782 -10.725 1.281 1.00 0.00 H new ATOM 0 HG3 LYS B 117 20.356 -10.702 0.262 1.00 0.00 H new ATOM 0 HD2 LYS B 117 21.812 -9.691 -1.585 1.00 0.00 H new ATOM 0 HD3 LYS B 117 23.202 -9.994 -0.562 1.00 0.00 H new ATOM 0 HE2 LYS B 117 21.269 -12.156 -1.472 1.00 0.00 H new ATOM 0 HE3 LYS B 117 22.760 -11.765 -2.305 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 23.051 -13.612 -0.807 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 23.988 -12.292 -0.294 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 22.543 -12.671 0.512 1.00 0.00 H new ATOM 1137 N ARG B 118 19.428 -5.861 0.647 1.00 0.00 N ATOM 1138 CA ARG B 118 18.377 -4.988 1.148 1.00 0.00 C ATOM 1139 C ARG B 118 17.450 -4.624 -0.013 1.00 0.00 C ATOM 1140 O ARG B 118 16.247 -4.594 0.217 1.00 0.00 O ATOM 1141 CB ARG B 118 18.914 -3.716 1.830 1.00 0.00 C ATOM 1142 CG ARG B 118 19.673 -3.964 3.143 1.00 0.00 C ATOM 1143 CD ARG B 118 19.512 -2.761 4.092 1.00 0.00 C ATOM 1144 NE ARG B 118 20.103 -2.977 5.425 1.00 0.00 N ATOM 1145 CZ ARG B 118 19.614 -3.770 6.389 1.00 0.00 C ATOM 1146 NH1 ARG B 118 18.560 -4.550 6.166 1.00 0.00 N ATOM 1147 NH2 ARG B 118 20.170 -3.787 7.596 1.00 0.00 N ATOM 0 H ARG B 118 20.351 -5.433 0.580 1.00 0.00 H new ATOM 0 HA ARG B 118 17.833 -5.531 1.921 1.00 0.00 H new ATOM 0 HB2 ARG B 118 19.576 -3.199 1.135 1.00 0.00 H new ATOM 0 HB3 ARG B 118 18.077 -3.047 2.030 1.00 0.00 H new ATOM 0 HG2 ARG B 118 19.296 -4.867 3.623 1.00 0.00 H new ATOM 0 HG3 ARG B 118 20.730 -4.131 2.934 1.00 0.00 H new ATOM 0 HD2 ARG B 118 19.974 -1.885 3.636 1.00 0.00 H new ATOM 0 HD3 ARG B 118 18.451 -2.538 4.206 1.00 0.00 H new ATOM 0 HE ARG B 118 20.966 -2.475 5.634 1.00 0.00 H new ATOM 0 HH11 ARG B 118 18.111 -4.551 5.250 1.00 0.00 H new ATOM 0 HH12 ARG B 118 18.201 -5.147 6.911 1.00 0.00 H new ATOM 0 HH21 ARG B 118 20.975 -3.194 7.795 1.00 0.00 H new ATOM 0 HH22 ARG B 118 19.791 -4.393 8.323 1.00 0.00 H new ATOM 1161 N LEU B 119 17.966 -4.345 -1.219 1.00 0.00 N ATOM 1162 CA LEU B 119 17.181 -3.974 -2.408 1.00 0.00 C ATOM 1163 C LEU B 119 16.218 -5.078 -2.837 1.00 0.00 C ATOM 1164 O LEU B 119 15.021 -4.838 -2.952 1.00 0.00 O ATOM 1165 CB LEU B 119 18.122 -3.633 -3.586 1.00 0.00 C ATOM 1166 CG LEU B 119 17.450 -2.852 -4.736 1.00 0.00 C ATOM 1167 CD1 LEU B 119 18.564 -2.213 -5.564 1.00 0.00 C ATOM 1168 CD2 LEU B 119 16.605 -3.717 -5.679 1.00 0.00 C ATOM 0 H LEU B 119 18.969 -4.372 -1.400 1.00 0.00 H new ATOM 0 HA LEU B 119 16.589 -3.100 -2.135 1.00 0.00 H new ATOM 0 HB2 LEU B 119 18.960 -3.048 -3.207 1.00 0.00 H new ATOM 0 HB3 LEU B 119 18.534 -4.560 -3.985 1.00 0.00 H new ATOM 0 HG LEU B 119 16.772 -2.131 -4.280 1.00 0.00 H new ATOM 0 HD11 LEU B 119 18.127 -1.650 -6.389 1.00 0.00 H new ATOM 0 HD12 LEU B 119 19.146 -1.540 -4.934 1.00 0.00 H new ATOM 0 HD13 LEU B 119 19.215 -2.992 -5.961 1.00 0.00 H new ATOM 0 HD21 LEU B 119 16.170 -3.089 -6.457 1.00 0.00 H new ATOM 0 HD22 LEU B 119 17.236 -4.478 -6.138 1.00 0.00 H new ATOM 0 HD23 LEU B 119 15.808 -4.199 -5.114 1.00 0.00 H new ATOM 1180 N LEU B 120 16.708 -6.302 -3.015 1.00 0.00 N ATOM 1181 CA LEU B 120 15.866 -7.419 -3.439 1.00 0.00 C ATOM 1182 C LEU B 120 14.832 -7.753 -2.371 1.00 0.00 C ATOM 1183 O LEU B 120 13.783 -8.277 -2.723 1.00 0.00 O ATOM 1184 CB LEU B 120 16.697 -8.639 -3.859 1.00 0.00 C ATOM 1185 CG LEU B 120 17.359 -9.349 -2.668 1.00 0.00 C ATOM 1186 CD1 LEU B 120 16.549 -10.539 -2.135 1.00 0.00 C ATOM 1187 CD2 LEU B 120 18.745 -9.863 -3.080 1.00 0.00 C ATOM 0 H LEU B 120 17.688 -6.547 -2.872 1.00 0.00 H new ATOM 0 HA LEU B 120 15.321 -7.108 -4.330 1.00 0.00 H new ATOM 0 HB2 LEU B 120 16.056 -9.345 -4.386 1.00 0.00 H new ATOM 0 HB3 LEU B 120 17.468 -8.323 -4.562 1.00 0.00 H new ATOM 0 HG LEU B 120 17.422 -8.608 -1.871 1.00 0.00 H new ATOM 0 HD11 LEU B 120 17.077 -10.991 -1.295 1.00 0.00 H new ATOM 0 HD12 LEU B 120 15.570 -10.194 -1.804 1.00 0.00 H new ATOM 0 HD13 LEU B 120 16.425 -11.278 -2.926 1.00 0.00 H new ATOM 0 HD21 LEU B 120 19.213 -10.366 -2.234 1.00 0.00 H new ATOM 0 HD22 LEU B 120 18.642 -10.565 -3.908 1.00 0.00 H new ATOM 0 HD23 LEU B 120 19.367 -9.024 -3.392 1.00 0.00 H new ATOM 1199 N ALA B 121 15.113 -7.480 -1.087 1.00 0.00 N ATOM 1200 CA ALA B 121 14.163 -7.728 -0.010 1.00 0.00 C ATOM 1201 C ALA B 121 13.131 -6.593 -0.001 1.00 0.00 C ATOM 1202 O ALA B 121 11.984 -6.808 0.379 1.00 0.00 O ATOM 1203 CB ALA B 121 14.885 -7.810 1.335 1.00 0.00 C ATOM 0 H ALA B 121 16.000 -7.084 -0.776 1.00 0.00 H new ATOM 0 HA ALA B 121 13.660 -8.681 -0.173 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.159 -7.996 2.127 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.610 -8.623 1.310 1.00 0.00 H new ATOM 0 HB3 ALA B 121 15.401 -6.870 1.529 1.00 0.00 H new ATOM 1209 N LEU B 122 13.538 -5.391 -0.425 1.00 0.00 N ATOM 1210 CA LEU B 122 12.730 -4.183 -0.530 1.00 0.00 C ATOM 1211 C LEU B 122 11.604 -4.435 -1.530 1.00 0.00 C ATOM 1212 O LEU B 122 10.490 -3.952 -1.324 1.00 0.00 O ATOM 1213 CB LEU B 122 13.603 -3.018 -1.063 1.00 0.00 C ATOM 1214 CG LEU B 122 13.560 -1.683 -0.322 1.00 0.00 C ATOM 1215 CD1 LEU B 122 12.171 -1.069 -0.311 1.00 0.00 C ATOM 1216 CD2 LEU B 122 14.145 -1.810 1.086 1.00 0.00 C ATOM 0 H LEU B 122 14.501 -5.232 -0.721 1.00 0.00 H new ATOM 0 HA LEU B 122 12.328 -3.926 0.450 1.00 0.00 H new ATOM 0 HB2 LEU B 122 14.639 -3.358 -1.076 1.00 0.00 H new ATOM 0 HB3 LEU B 122 13.315 -2.833 -2.098 1.00 0.00 H new ATOM 0 HG LEU B 122 14.192 -0.990 -0.877 1.00 0.00 H new ATOM 0 HD11 LEU B 122 12.196 -0.122 0.228 1.00 0.00 H new ATOM 0 HD12 LEU B 122 11.842 -0.895 -1.335 1.00 0.00 H new ATOM 0 HD13 LEU B 122 11.477 -1.749 0.182 1.00 0.00 H new ATOM 0 HD21 LEU B 122 14.100 -0.843 1.587 1.00 0.00 H new ATOM 0 HD22 LEU B 122 13.570 -2.541 1.655 1.00 0.00 H new ATOM 0 HD23 LEU B 122 15.183 -2.137 1.021 1.00 0.00 H new ATOM 1228 N ASP B 123 11.899 -5.201 -2.591 1.00 0.00 N ATOM 1229 CA ASP B 123 10.912 -5.496 -3.631 1.00 0.00 C ATOM 1230 C ASP B 123 9.650 -6.174 -3.078 1.00 0.00 C ATOM 1231 O ASP B 123 8.584 -5.558 -3.174 1.00 0.00 O ATOM 1232 CB ASP B 123 11.519 -6.274 -4.810 1.00 0.00 C ATOM 1233 CG ASP B 123 11.683 -5.366 -6.024 1.00 0.00 C ATOM 1234 OD1 ASP B 123 10.652 -4.966 -6.603 1.00 0.00 O ATOM 1235 OD2 ASP B 123 12.831 -4.985 -6.356 1.00 0.00 O ATOM 0 H ASP B 123 12.813 -5.625 -2.748 1.00 0.00 H new ATOM 0 HA ASP B 123 10.592 -4.531 -4.024 1.00 0.00 H new ATOM 0 HB2 ASP B 123 12.487 -6.684 -4.522 1.00 0.00 H new ATOM 0 HB3 ASP B 123 10.878 -7.118 -5.064 1.00 0.00 H new ATOM 1240 N PRO B 124 9.718 -7.384 -2.488 1.00 0.00 N ATOM 1241 CA PRO B 124 8.549 -8.051 -1.943 1.00 0.00 C ATOM 1242 C PRO B 124 8.045 -7.369 -0.668 1.00 0.00 C ATOM 1243 O PRO B 124 6.921 -7.655 -0.276 1.00 0.00 O ATOM 1244 CB PRO B 124 8.972 -9.496 -1.669 1.00 0.00 C ATOM 1245 CG PRO B 124 10.462 -9.366 -1.373 1.00 0.00 C ATOM 1246 CD PRO B 124 10.881 -8.233 -2.310 1.00 0.00 C ATOM 0 HA PRO B 124 7.717 -8.007 -2.646 1.00 0.00 H new ATOM 0 HB2 PRO B 124 8.429 -9.923 -0.826 1.00 0.00 H new ATOM 0 HB3 PRO B 124 8.786 -10.141 -2.528 1.00 0.00 H new ATOM 0 HG2 PRO B 124 10.649 -9.120 -0.328 1.00 0.00 H new ATOM 0 HG3 PRO B 124 11.001 -10.289 -1.585 1.00 0.00 H new ATOM 0 HD2 PRO B 124 11.711 -7.668 -1.886 1.00 0.00 H new ATOM 0 HD3 PRO B 124 11.221 -8.629 -3.267 1.00 0.00 H new ATOM 1254 N MET B 125 8.829 -6.515 0.006 1.00 0.00 N ATOM 1255 CA MET B 125 8.361 -5.849 1.220 1.00 0.00 C ATOM 1256 C MET B 125 7.201 -4.925 0.867 1.00 0.00 C ATOM 1257 O MET B 125 6.115 -5.072 1.415 1.00 0.00 O ATOM 1258 CB MET B 125 9.486 -5.045 1.893 1.00 0.00 C ATOM 1259 CG MET B 125 10.450 -5.907 2.714 1.00 0.00 C ATOM 1260 SD MET B 125 10.187 -5.932 4.507 1.00 0.00 S ATOM 1261 CE MET B 125 8.486 -6.555 4.600 1.00 0.00 C ATOM 0 H MET B 125 9.781 -6.274 -0.269 1.00 0.00 H new ATOM 0 HA MET B 125 8.032 -6.611 1.927 1.00 0.00 H new ATOM 0 HB2 MET B 125 10.050 -4.514 1.126 1.00 0.00 H new ATOM 0 HB3 MET B 125 9.043 -4.291 2.543 1.00 0.00 H new ATOM 0 HG2 MET B 125 10.389 -6.931 2.346 1.00 0.00 H new ATOM 0 HG3 MET B 125 11.465 -5.559 2.523 1.00 0.00 H new ATOM 0 HE1 MET B 125 8.199 -6.676 5.645 1.00 0.00 H new ATOM 0 HE2 MET B 125 7.812 -5.846 4.119 1.00 0.00 H new ATOM 0 HE3 MET B 125 8.423 -7.518 4.093 1.00 0.00 H new ATOM 1271 N MET B 126 7.417 -3.985 -0.058 1.00 0.00 N ATOM 1272 CA MET B 126 6.360 -3.061 -0.450 1.00 0.00 C ATOM 1273 C MET B 126 5.259 -3.811 -1.183 1.00 0.00 C ATOM 1274 O MET B 126 4.086 -3.586 -0.918 1.00 0.00 O ATOM 1275 CB MET B 126 6.955 -1.937 -1.308 1.00 0.00 C ATOM 1276 CG MET B 126 5.934 -0.955 -1.897 1.00 0.00 C ATOM 1277 SD MET B 126 4.973 -1.412 -3.375 1.00 0.00 S ATOM 1278 CE MET B 126 6.260 -1.959 -4.521 1.00 0.00 C ATOM 0 H MET B 126 8.305 -3.848 -0.542 1.00 0.00 H new ATOM 0 HA MET B 126 5.914 -2.609 0.436 1.00 0.00 H new ATOM 0 HB2 MET B 126 7.666 -1.376 -0.702 1.00 0.00 H new ATOM 0 HB3 MET B 126 7.518 -2.386 -2.127 1.00 0.00 H new ATOM 0 HG2 MET B 126 5.221 -0.718 -1.108 1.00 0.00 H new ATOM 0 HG3 MET B 126 6.468 -0.034 -2.131 1.00 0.00 H new ATOM 0 HE1 MET B 126 5.851 -2.010 -5.530 1.00 0.00 H new ATOM 0 HE2 MET B 126 7.090 -1.252 -4.501 1.00 0.00 H new ATOM 0 HE3 MET B 126 6.616 -2.945 -4.224 1.00 0.00 H new ATOM 1288 N GLU B 127 5.630 -4.709 -2.090 1.00 0.00 N ATOM 1289 CA GLU B 127 4.675 -5.474 -2.878 1.00 0.00 C ATOM 1290 C GLU B 127 3.701 -6.249 -1.994 1.00 0.00 C ATOM 1291 O GLU B 127 2.529 -6.346 -2.358 1.00 0.00 O ATOM 1292 CB GLU B 127 5.430 -6.390 -3.846 1.00 0.00 C ATOM 1293 CG GLU B 127 4.494 -7.147 -4.795 1.00 0.00 C ATOM 1294 CD GLU B 127 5.297 -7.833 -5.899 1.00 0.00 C ATOM 1295 OE1 GLU B 127 5.651 -7.165 -6.899 1.00 0.00 O ATOM 1296 OE2 GLU B 127 5.614 -9.041 -5.773 1.00 0.00 O ATOM 0 H GLU B 127 6.605 -4.926 -2.298 1.00 0.00 H new ATOM 0 HA GLU B 127 4.066 -4.783 -3.460 1.00 0.00 H new ATOM 0 HB2 GLU B 127 6.131 -5.795 -4.432 1.00 0.00 H new ATOM 0 HB3 GLU B 127 6.020 -7.107 -3.276 1.00 0.00 H new ATOM 0 HG2 GLU B 127 3.923 -7.889 -4.237 1.00 0.00 H new ATOM 0 HG3 GLU B 127 3.775 -6.456 -5.235 1.00 0.00 H new ATOM 1303 N GLN B 128 4.175 -6.764 -0.854 1.00 0.00 N ATOM 1304 CA GLN B 128 3.365 -7.529 0.080 1.00 0.00 C ATOM 1305 C GLN B 128 2.368 -6.623 0.787 1.00 0.00 C ATOM 1306 O GLN B 128 1.188 -6.961 0.906 1.00 0.00 O ATOM 1307 CB GLN B 128 4.245 -8.283 1.086 1.00 0.00 C ATOM 1308 CG GLN B 128 3.421 -9.182 2.019 1.00 0.00 C ATOM 1309 CD GLN B 128 3.155 -8.573 3.392 1.00 0.00 C ATOM 1310 OE1 GLN B 128 3.929 -8.770 4.327 1.00 0.00 O ATOM 1311 NE2 GLN B 128 2.048 -7.873 3.564 1.00 0.00 N ATOM 0 H GLN B 128 5.145 -6.656 -0.557 1.00 0.00 H new ATOM 0 HA GLN B 128 2.804 -8.274 -0.484 1.00 0.00 H new ATOM 0 HB2 GLN B 128 4.971 -8.891 0.546 1.00 0.00 H new ATOM 0 HB3 GLN B 128 4.810 -7.565 1.681 1.00 0.00 H new ATOM 0 HG2 GLN B 128 2.467 -9.406 1.541 1.00 0.00 H new ATOM 0 HG3 GLN B 128 3.944 -10.130 2.148 1.00 0.00 H new ATOM 0 HE21 GLN B 128 1.416 -7.718 2.779 1.00 0.00 H new ATOM 0 HE22 GLN B 128 1.826 -7.488 4.482 1.00 0.00 H new ATOM 1320 N GLU B 129 2.823 -5.486 1.304 1.00 0.00 N ATOM 1321 CA GLU B 129 1.903 -4.585 1.984 1.00 0.00 C ATOM 1322 C GLU B 129 0.899 -4.023 0.986 1.00 0.00 C ATOM 1323 O GLU B 129 -0.255 -3.783 1.336 1.00 0.00 O ATOM 1324 CB GLU B 129 2.638 -3.459 2.702 1.00 0.00 C ATOM 1325 CG GLU B 129 3.638 -4.015 3.716 1.00 0.00 C ATOM 1326 CD GLU B 129 3.940 -3.020 4.832 1.00 0.00 C ATOM 1327 OE1 GLU B 129 3.005 -2.554 5.529 1.00 0.00 O ATOM 1328 OE2 GLU B 129 5.137 -2.734 5.049 1.00 0.00 O ATOM 0 H GLU B 129 3.793 -5.174 1.267 1.00 0.00 H new ATOM 0 HA GLU B 129 1.372 -5.156 2.745 1.00 0.00 H new ATOM 0 HB2 GLU B 129 3.160 -2.839 1.974 1.00 0.00 H new ATOM 0 HB3 GLU B 129 1.919 -2.817 3.210 1.00 0.00 H new ATOM 0 HG2 GLU B 129 3.242 -4.934 4.148 1.00 0.00 H new ATOM 0 HG3 GLU B 129 4.564 -4.277 3.204 1.00 0.00 H new ATOM 1335 N ILE B 130 1.305 -3.828 -0.273 1.00 0.00 N ATOM 1336 CA ILE B 130 0.417 -3.308 -1.268 1.00 0.00 C ATOM 1337 C ILE B 130 -0.598 -4.397 -1.605 1.00 0.00 C ATOM 1338 O ILE B 130 -1.787 -4.106 -1.500 1.00 0.00 O ATOM 1339 CB ILE B 130 1.189 -2.688 -2.463 1.00 0.00 C ATOM 1340 CG1 ILE B 130 1.462 -1.176 -2.199 1.00 0.00 C ATOM 1341 CG2 ILE B 130 0.436 -2.866 -3.801 1.00 0.00 C ATOM 1342 CD1 ILE B 130 2.253 -0.846 -0.934 1.00 0.00 C ATOM 0 H ILE B 130 2.247 -4.029 -0.608 1.00 0.00 H new ATOM 0 HA ILE B 130 -0.153 -2.456 -0.896 1.00 0.00 H new ATOM 0 HB ILE B 130 2.136 -3.221 -2.549 1.00 0.00 H new ATOM 0 HG12 ILE B 130 2.000 -0.770 -3.056 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.504 -0.658 -2.149 1.00 0.00 H new ATOM 0 HG21 ILE B 130 1.015 -2.416 -4.607 1.00 0.00 H new ATOM 0 HG22 ILE B 130 0.298 -3.928 -4.002 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -0.537 -2.379 -3.738 1.00 0.00 H new ATOM 0 HD11 ILE B 130 2.381 0.234 -0.856 1.00 0.00 H new ATOM 0 HD12 ILE B 130 1.712 -1.211 -0.061 1.00 0.00 H new ATOM 0 HD13 ILE B 130 3.231 -1.325 -0.981 1.00 0.00 H new ATOM 1354 N GLU B 131 -0.209 -5.619 -1.978 1.00 0.00 N ATOM 1355 CA GLU B 131 -1.194 -6.647 -2.319 1.00 0.00 C ATOM 1356 C GLU B 131 -2.211 -6.812 -1.195 1.00 0.00 C ATOM 1357 O GLU B 131 -3.405 -6.917 -1.481 1.00 0.00 O ATOM 1358 CB GLU B 131 -0.551 -7.951 -2.817 1.00 0.00 C ATOM 1359 CG GLU B 131 0.333 -8.723 -1.831 1.00 0.00 C ATOM 1360 CD GLU B 131 -0.411 -9.654 -0.874 1.00 0.00 C ATOM 1361 OE1 GLU B 131 -1.426 -10.260 -1.270 1.00 0.00 O ATOM 1362 OE2 GLU B 131 0.117 -9.958 0.218 1.00 0.00 O ATOM 0 H GLU B 131 0.764 -5.917 -2.051 1.00 0.00 H new ATOM 0 HA GLU B 131 -1.762 -6.306 -3.184 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -1.350 -8.616 -3.146 1.00 0.00 H new ATOM 0 HB3 GLU B 131 0.050 -7.716 -3.696 1.00 0.00 H new ATOM 0 HG2 GLU B 131 1.052 -9.313 -2.399 1.00 0.00 H new ATOM 0 HG3 GLU B 131 0.904 -8.005 -1.242 1.00 0.00 H new ATOM 1369 N GLU B 132 -1.756 -6.726 0.055 1.00 0.00 N ATOM 1370 CA GLU B 132 -2.612 -6.837 1.216 1.00 0.00 C ATOM 1371 C GLU B 132 -3.540 -5.617 1.323 1.00 0.00 C ATOM 1372 O GLU B 132 -4.715 -5.808 1.632 1.00 0.00 O ATOM 1373 CB GLU B 132 -1.746 -7.025 2.474 1.00 0.00 C ATOM 1374 CG GLU B 132 -2.558 -7.191 3.770 1.00 0.00 C ATOM 1375 CD GLU B 132 -3.560 -8.352 3.749 1.00 0.00 C ATOM 1376 OE1 GLU B 132 -3.276 -9.432 3.167 1.00 0.00 O ATOM 1377 OE2 GLU B 132 -4.627 -8.221 4.390 1.00 0.00 O ATOM 0 H GLU B 132 -0.773 -6.576 0.283 1.00 0.00 H new ATOM 0 HA GLU B 132 -3.255 -7.711 1.117 1.00 0.00 H new ATOM 0 HB2 GLU B 132 -1.112 -7.901 2.339 1.00 0.00 H new ATOM 0 HB3 GLU B 132 -1.084 -6.166 2.579 1.00 0.00 H new ATOM 0 HG2 GLU B 132 -1.867 -7.339 4.600 1.00 0.00 H new ATOM 0 HG3 GLU B 132 -3.098 -6.265 3.966 1.00 0.00 H new ATOM 1384 N ILE B 133 -3.095 -4.372 1.075 1.00 0.00 N ATOM 1385 CA ILE B 133 -3.970 -3.212 1.188 1.00 0.00 C ATOM 1386 C ILE B 133 -5.013 -3.260 0.081 1.00 0.00 C ATOM 1387 O ILE B 133 -6.182 -2.959 0.338 1.00 0.00 O ATOM 1388 CB ILE B 133 -3.140 -1.908 1.203 1.00 0.00 C ATOM 1389 CG1 ILE B 133 -2.437 -1.749 2.571 1.00 0.00 C ATOM 1390 CG2 ILE B 133 -4.005 -0.659 0.967 1.00 0.00 C ATOM 1391 CD1 ILE B 133 -1.388 -0.632 2.592 1.00 0.00 C ATOM 0 H ILE B 133 -2.138 -4.153 0.797 1.00 0.00 H new ATOM 0 HA ILE B 133 -4.508 -3.231 2.136 1.00 0.00 H new ATOM 0 HB ILE B 133 -2.416 -1.988 0.393 1.00 0.00 H new ATOM 0 HG12 ILE B 133 -3.188 -1.546 3.335 1.00 0.00 H new ATOM 0 HG13 ILE B 133 -1.958 -2.692 2.836 1.00 0.00 H new ATOM 0 HG21 ILE B 133 -3.374 0.230 0.987 1.00 0.00 H new ATOM 0 HG22 ILE B 133 -4.495 -0.734 -0.004 1.00 0.00 H new ATOM 0 HG23 ILE B 133 -4.760 -0.586 1.750 1.00 0.00 H new ATOM 0 HD11 ILE B 133 -0.935 -0.577 3.582 1.00 0.00 H new ATOM 0 HD12 ILE B 133 -0.617 -0.843 1.851 1.00 0.00 H new ATOM 0 HD13 ILE B 133 -1.865 0.320 2.358 1.00 0.00 H new ATOM 1403 N ARG B 134 -4.615 -3.624 -1.143 1.00 0.00 N ATOM 1404 CA ARG B 134 -5.542 -3.706 -2.260 1.00 0.00 C ATOM 1405 C ARG B 134 -6.607 -4.712 -1.887 1.00 0.00 C ATOM 1406 O ARG B 134 -7.784 -4.393 -1.996 1.00 0.00 O ATOM 1407 CB ARG B 134 -4.841 -4.064 -3.581 1.00 0.00 C ATOM 1408 CG ARG B 134 -3.716 -3.065 -3.885 1.00 0.00 C ATOM 1409 CD ARG B 134 -3.486 -2.738 -5.356 1.00 0.00 C ATOM 1410 NE ARG B 134 -4.620 -2.009 -5.951 1.00 0.00 N ATOM 1411 CZ ARG B 134 -4.525 -1.046 -6.876 1.00 0.00 C ATOM 1412 NH1 ARG B 134 -3.365 -0.743 -7.449 1.00 0.00 N ATOM 1413 NH2 ARG B 134 -5.616 -0.385 -7.242 1.00 0.00 N ATOM 0 H ARG B 134 -3.652 -3.866 -1.378 1.00 0.00 H new ATOM 0 HA ARG B 134 -5.993 -2.730 -2.441 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -4.432 -5.073 -3.520 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -5.566 -4.062 -4.395 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -3.931 -2.136 -3.357 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -2.787 -3.459 -3.472 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -2.580 -2.140 -5.456 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -3.320 -3.662 -5.910 1.00 0.00 H new ATOM 0 HE ARG B 134 -5.556 -2.259 -5.631 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -2.519 -1.249 -7.187 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -3.321 -0.005 -8.151 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -6.516 -0.613 -6.819 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -5.555 0.351 -7.946 1.00 0.00 H new ATOM 1427 N GLN B 135 -6.215 -5.880 -1.382 1.00 0.00 N ATOM 1428 CA GLN B 135 -7.207 -6.882 -0.995 1.00 0.00 C ATOM 1429 C GLN B 135 -8.115 -6.392 0.130 1.00 0.00 C ATOM 1430 O GLN B 135 -9.338 -6.418 -0.023 1.00 0.00 O ATOM 1431 CB GLN B 135 -6.574 -8.199 -0.572 1.00 0.00 C ATOM 1432 CG GLN B 135 -5.984 -8.903 -1.777 1.00 0.00 C ATOM 1433 CD GLN B 135 -6.973 -9.262 -2.887 1.00 0.00 C ATOM 1434 OE1 GLN B 135 -7.975 -9.952 -2.701 1.00 0.00 O ATOM 1435 NE2 GLN B 135 -6.729 -8.789 -4.096 1.00 0.00 N ATOM 0 H GLN B 135 -5.243 -6.152 -1.234 1.00 0.00 H new ATOM 0 HA GLN B 135 -7.804 -7.050 -1.891 1.00 0.00 H new ATOM 0 HB2 GLN B 135 -5.796 -8.016 0.169 1.00 0.00 H new ATOM 0 HB3 GLN B 135 -7.322 -8.836 -0.099 1.00 0.00 H new ATOM 0 HG2 GLN B 135 -5.206 -8.268 -2.201 1.00 0.00 H new ATOM 0 HG3 GLN B 135 -5.499 -9.818 -1.438 1.00 0.00 H new ATOM 0 HE21 GLN B 135 -5.902 -8.216 -4.262 1.00 0.00 H new ATOM 0 HE22 GLN B 135 -7.368 -8.997 -4.863 1.00 0.00 H new ATOM 1444 N LYS B 136 -7.545 -5.904 1.237 1.00 0.00 N ATOM 1445 CA LYS B 136 -8.317 -5.432 2.382 1.00 0.00 C ATOM 1446 C LYS B 136 -9.342 -4.377 1.981 1.00 0.00 C ATOM 1447 O LYS B 136 -10.493 -4.440 2.422 1.00 0.00 O ATOM 1448 CB LYS B 136 -7.363 -5.010 3.516 1.00 0.00 C ATOM 1449 CG LYS B 136 -7.228 -3.506 3.805 1.00 0.00 C ATOM 1450 CD LYS B 136 -6.025 -3.122 4.675 1.00 0.00 C ATOM 1451 CE LYS B 136 -5.523 -4.168 5.672 1.00 0.00 C ATOM 1452 NZ LYS B 136 -6.525 -4.579 6.678 1.00 0.00 N ATOM 0 H LYS B 136 -6.535 -5.827 1.360 1.00 0.00 H new ATOM 0 HA LYS B 136 -8.921 -6.248 2.778 1.00 0.00 H new ATOM 0 HB2 LYS B 136 -7.691 -5.501 4.432 1.00 0.00 H new ATOM 0 HB3 LYS B 136 -6.371 -5.399 3.284 1.00 0.00 H new ATOM 0 HG2 LYS B 136 -7.157 -2.973 2.857 1.00 0.00 H new ATOM 0 HG3 LYS B 136 -8.138 -3.162 4.296 1.00 0.00 H new ATOM 0 HD2 LYS B 136 -5.199 -2.861 4.014 1.00 0.00 H new ATOM 0 HD3 LYS B 136 -6.284 -2.221 5.232 1.00 0.00 H new ATOM 0 HE2 LYS B 136 -5.195 -5.050 5.121 1.00 0.00 H new ATOM 0 HE3 LYS B 136 -4.649 -3.771 6.188 1.00 0.00 H new ATOM 0 HZ1 LYS B 136 -6.083 -4.603 7.619 1.00 0.00 H new ATOM 0 HZ2 LYS B 136 -7.312 -3.899 6.682 1.00 0.00 H new ATOM 0 HZ3 LYS B 136 -6.886 -5.525 6.442 1.00 0.00 H new ATOM 1466 N TYR B 137 -8.955 -3.398 1.161 1.00 0.00 N ATOM 1467 CA TYR B 137 -9.877 -2.364 0.733 1.00 0.00 C ATOM 1468 C TYR B 137 -10.855 -2.925 -0.298 1.00 0.00 C ATOM 1469 O TYR B 137 -12.037 -2.600 -0.204 1.00 0.00 O ATOM 1470 CB TYR B 137 -9.131 -1.095 0.309 1.00 0.00 C ATOM 1471 CG TYR B 137 -8.629 -0.259 1.484 1.00 0.00 C ATOM 1472 CD1 TYR B 137 -9.505 0.157 2.504 1.00 0.00 C ATOM 1473 CD2 TYR B 137 -7.286 0.136 1.550 1.00 0.00 C ATOM 1474 CE1 TYR B 137 -9.054 0.931 3.585 1.00 0.00 C ATOM 1475 CE2 TYR B 137 -6.824 0.945 2.607 1.00 0.00 C ATOM 1476 CZ TYR B 137 -7.704 1.334 3.637 1.00 0.00 C ATOM 1477 OH TYR B 137 -7.264 2.134 4.641 1.00 0.00 O ATOM 0 H TYR B 137 -8.011 -3.306 0.785 1.00 0.00 H new ATOM 0 HA TYR B 137 -10.494 -2.042 1.572 1.00 0.00 H new ATOM 0 HB2 TYR B 137 -8.283 -1.374 -0.316 1.00 0.00 H new ATOM 0 HB3 TYR B 137 -9.792 -0.483 -0.305 1.00 0.00 H new ATOM 0 HD1 TYR B 137 -10.546 -0.125 2.454 1.00 0.00 H new ATOM 0 HD2 TYR B 137 -6.597 -0.183 0.782 1.00 0.00 H new ATOM 0 HE1 TYR B 137 -9.737 1.216 4.372 1.00 0.00 H new ATOM 0 HE2 TYR B 137 -5.794 1.268 2.628 1.00 0.00 H new ATOM 0 HH TYR B 137 -6.456 1.746 5.038 1.00 0.00 H new ATOM 1487 N GLN B 138 -10.440 -3.822 -1.201 1.00 0.00 N ATOM 1488 CA GLN B 138 -11.326 -4.421 -2.200 1.00 0.00 C ATOM 1489 C GLN B 138 -12.447 -5.149 -1.458 1.00 0.00 C ATOM 1490 O GLN B 138 -13.620 -4.953 -1.762 1.00 0.00 O ATOM 1491 CB GLN B 138 -10.532 -5.375 -3.115 1.00 0.00 C ATOM 1492 CG GLN B 138 -11.309 -5.924 -4.322 1.00 0.00 C ATOM 1493 CD GLN B 138 -11.612 -4.872 -5.392 1.00 0.00 C ATOM 1494 OE1 GLN B 138 -11.059 -3.775 -5.398 1.00 0.00 O ATOM 1495 NE2 GLN B 138 -12.490 -5.180 -6.333 1.00 0.00 N ATOM 0 H GLN B 138 -9.477 -4.152 -1.257 1.00 0.00 H new ATOM 0 HA GLN B 138 -11.759 -3.654 -2.843 1.00 0.00 H new ATOM 0 HB2 GLN B 138 -9.649 -4.851 -3.480 1.00 0.00 H new ATOM 0 HB3 GLN B 138 -10.179 -6.216 -2.518 1.00 0.00 H new ATOM 0 HG2 GLN B 138 -10.736 -6.733 -4.774 1.00 0.00 H new ATOM 0 HG3 GLN B 138 -12.248 -6.354 -3.973 1.00 0.00 H new ATOM 0 HE21 GLN B 138 -12.947 -6.092 -6.325 1.00 0.00 H new ATOM 0 HE22 GLN B 138 -12.709 -4.506 -7.066 1.00 0.00 H new ATOM 1504 N SER B 139 -12.114 -5.927 -0.424 1.00 0.00 N ATOM 1505 CA SER B 139 -13.072 -6.658 0.397 1.00 0.00 C ATOM 1506 C SER B 139 -14.093 -5.682 0.988 1.00 0.00 C ATOM 1507 O SER B 139 -15.262 -6.033 1.153 1.00 0.00 O ATOM 1508 CB SER B 139 -12.283 -7.404 1.474 1.00 0.00 C ATOM 1509 OG SER B 139 -13.108 -8.161 2.333 1.00 0.00 O ATOM 0 H SER B 139 -11.147 -6.066 -0.131 1.00 0.00 H new ATOM 0 HA SER B 139 -13.636 -7.383 -0.190 1.00 0.00 H new ATOM 0 HB2 SER B 139 -11.561 -8.066 0.996 1.00 0.00 H new ATOM 0 HB3 SER B 139 -11.715 -6.685 2.064 1.00 0.00 H new ATOM 0 HG SER B 139 -12.554 -8.618 3.000 1.00 0.00 H new ATOM 1515 N LYS B 140 -13.669 -4.468 1.355 1.00 0.00 N ATOM 1516 CA LYS B 140 -14.565 -3.449 1.889 1.00 0.00 C ATOM 1517 C LYS B 140 -15.398 -2.836 0.771 1.00 0.00 C ATOM 1518 O LYS B 140 -16.552 -2.502 1.024 1.00 0.00 O ATOM 1519 CB LYS B 140 -13.798 -2.341 2.615 1.00 0.00 C ATOM 1520 CG LYS B 140 -13.150 -2.862 3.895 1.00 0.00 C ATOM 1521 CD LYS B 140 -12.165 -1.848 4.482 1.00 0.00 C ATOM 1522 CE LYS B 140 -11.054 -2.536 5.277 1.00 0.00 C ATOM 1523 NZ LYS B 140 -11.571 -3.415 6.350 1.00 0.00 N ATOM 0 H LYS B 140 -12.696 -4.169 1.289 1.00 0.00 H new ATOM 0 HA LYS B 140 -15.219 -3.941 2.609 1.00 0.00 H new ATOM 0 HB2 LYS B 140 -13.031 -1.935 1.956 1.00 0.00 H new ATOM 0 HB3 LYS B 140 -14.477 -1.523 2.856 1.00 0.00 H new ATOM 0 HG2 LYS B 140 -13.923 -3.086 4.630 1.00 0.00 H new ATOM 0 HG3 LYS B 140 -12.629 -3.796 3.685 1.00 0.00 H new ATOM 0 HD2 LYS B 140 -11.726 -1.259 3.677 1.00 0.00 H new ATOM 0 HD3 LYS B 140 -12.700 -1.154 5.130 1.00 0.00 H new ATOM 0 HE2 LYS B 140 -10.439 -3.125 4.597 1.00 0.00 H new ATOM 0 HE3 LYS B 140 -10.406 -1.778 5.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 -10.776 -3.787 6.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 -12.204 -2.870 6.970 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 -12.097 -4.206 5.927 1.00 0.00 H new ATOM 1537 N ARG B 141 -14.841 -2.649 -0.429 1.00 0.00 N ATOM 1538 CA ARG B 141 -15.508 -2.060 -1.586 1.00 0.00 C ATOM 1539 C ARG B 141 -16.579 -2.973 -2.165 1.00 0.00 C ATOM 1540 O ARG B 141 -17.657 -2.508 -2.511 1.00 0.00 O ATOM 1541 CB ARG B 141 -14.466 -1.723 -2.664 1.00 0.00 C ATOM 1542 CG ARG B 141 -14.948 -0.610 -3.612 1.00 0.00 C ATOM 1543 CD ARG B 141 -14.285 -0.677 -4.994 1.00 0.00 C ATOM 1544 NE ARG B 141 -12.824 -0.747 -4.904 1.00 0.00 N ATOM 1545 CZ ARG B 141 -11.945 -0.569 -5.891 1.00 0.00 C ATOM 1546 NH1 ARG B 141 -12.322 -0.157 -7.093 1.00 0.00 N ATOM 1547 NH2 ARG B 141 -10.661 -0.786 -5.642 1.00 0.00 N ATOM 0 H ARG B 141 -13.876 -2.915 -0.625 1.00 0.00 H new ATOM 0 HA ARG B 141 -16.008 -1.151 -1.251 1.00 0.00 H new ATOM 0 HB2 ARG B 141 -13.537 -1.413 -2.185 1.00 0.00 H new ATOM 0 HB3 ARG B 141 -14.242 -2.619 -3.243 1.00 0.00 H new ATOM 0 HG2 ARG B 141 -16.029 -0.682 -3.729 1.00 0.00 H new ATOM 0 HG3 ARG B 141 -14.740 0.360 -3.161 1.00 0.00 H new ATOM 0 HD2 ARG B 141 -14.656 -1.550 -5.531 1.00 0.00 H new ATOM 0 HD3 ARG B 141 -14.570 0.200 -5.575 1.00 0.00 H new ATOM 0 HE ARG B 141 -12.436 -0.955 -3.984 1.00 0.00 H new ATOM 0 HH11 ARG B 141 -13.306 0.032 -7.282 1.00 0.00 H new ATOM 0 HH12 ARG B 141 -11.628 -0.029 -7.829 1.00 0.00 H new ATOM 0 HH21 ARG B 141 -10.365 -1.082 -4.712 1.00 0.00 H new ATOM 0 HH22 ARG B 141 -9.969 -0.657 -6.380 1.00 0.00 H new ATOM 1561 N GLN B 142 -16.314 -4.263 -2.203 1.00 0.00 N ATOM 1562 CA GLN B 142 -17.160 -5.323 -2.722 1.00 0.00 C ATOM 1563 C GLN B 142 -18.621 -5.194 -2.250 1.00 0.00 C ATOM 1564 O GLN B 142 -19.486 -4.988 -3.094 1.00 0.00 O ATOM 1565 CB GLN B 142 -16.463 -6.679 -2.480 1.00 0.00 C ATOM 1566 CG GLN B 142 -17.129 -7.824 -3.242 1.00 0.00 C ATOM 1567 CD GLN B 142 -17.259 -7.521 -4.732 1.00 0.00 C ATOM 1568 OE1 GLN B 142 -16.263 -7.344 -5.437 1.00 0.00 O ATOM 1569 NE2 GLN B 142 -18.474 -7.380 -5.222 1.00 0.00 N ATOM 0 H GLN B 142 -15.432 -4.628 -1.844 1.00 0.00 H new ATOM 0 HA GLN B 142 -17.273 -5.238 -3.803 1.00 0.00 H new ATOM 0 HB2 GLN B 142 -15.418 -6.606 -2.782 1.00 0.00 H new ATOM 0 HB3 GLN B 142 -16.472 -6.903 -1.413 1.00 0.00 H new ATOM 0 HG2 GLN B 142 -16.547 -8.736 -3.107 1.00 0.00 H new ATOM 0 HG3 GLN B 142 -18.118 -8.012 -2.823 1.00 0.00 H new ATOM 0 HE21 GLN B 142 -19.286 -7.531 -4.623 1.00 0.00 H new ATOM 0 HE22 GLN B 142 -18.603 -7.120 -6.200 1.00 0.00 H new ATOM 1578 N PRO B 143 -18.945 -5.207 -0.946 1.00 0.00 N ATOM 1579 CA PRO B 143 -20.324 -5.065 -0.480 1.00 0.00 C ATOM 1580 C PRO B 143 -20.948 -3.720 -0.877 1.00 0.00 C ATOM 1581 O PRO B 143 -22.167 -3.598 -0.848 1.00 0.00 O ATOM 1582 CB PRO B 143 -20.272 -5.192 1.044 1.00 0.00 C ATOM 1583 CG PRO B 143 -18.827 -4.847 1.354 1.00 0.00 C ATOM 1584 CD PRO B 143 -18.071 -5.425 0.178 1.00 0.00 C ATOM 0 HA PRO B 143 -20.950 -5.829 -0.940 1.00 0.00 H new ATOM 0 HB2 PRO B 143 -20.966 -4.508 1.532 1.00 0.00 H new ATOM 0 HB3 PRO B 143 -20.529 -6.198 1.376 1.00 0.00 H new ATOM 0 HG2 PRO B 143 -18.679 -3.770 1.437 1.00 0.00 H new ATOM 0 HG3 PRO B 143 -18.502 -5.287 2.297 1.00 0.00 H new ATOM 0 HD2 PRO B 143 -17.111 -4.928 0.038 1.00 0.00 H new ATOM 0 HD3 PRO B 143 -17.863 -6.485 0.321 1.00 0.00 H new ATOM 1592 N ILE B 144 -20.133 -2.702 -1.168 1.00 0.00 N ATOM 1593 CA ILE B 144 -20.580 -1.384 -1.574 1.00 0.00 C ATOM 1594 C ILE B 144 -21.077 -1.496 -3.015 1.00 0.00 C ATOM 1595 O ILE B 144 -22.197 -1.071 -3.291 1.00 0.00 O ATOM 1596 CB ILE B 144 -19.473 -0.313 -1.416 1.00 0.00 C ATOM 1597 CG1 ILE B 144 -18.724 -0.329 -0.072 1.00 0.00 C ATOM 1598 CG2 ILE B 144 -20.147 1.052 -1.557 1.00 0.00 C ATOM 1599 CD1 ILE B 144 -17.485 0.577 -0.057 1.00 0.00 C ATOM 0 H ILE B 144 -19.117 -2.783 -1.124 1.00 0.00 H new ATOM 0 HA ILE B 144 -21.388 -1.047 -0.925 1.00 0.00 H new ATOM 0 HB ILE B 144 -18.723 -0.527 -2.177 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -19.405 -0.015 0.719 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -18.421 -1.351 0.155 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -19.400 1.839 -1.452 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -20.617 1.126 -2.538 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -20.905 1.165 -0.782 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -17.004 0.519 0.919 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -16.786 0.250 -0.826 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -17.785 1.606 -0.253 1.00 0.00 H new ATOM 1611 N LEU B 145 -20.268 -2.027 -3.948 1.00 0.00 N ATOM 1612 CA LEU B 145 -20.752 -2.164 -5.327 1.00 0.00 C ATOM 1613 C LEU B 145 -21.929 -3.126 -5.306 1.00 0.00 C ATOM 1614 O LEU B 145 -22.952 -2.821 -5.897 1.00 0.00 O ATOM 1615 CB LEU B 145 -19.736 -2.594 -6.403 1.00 0.00 C ATOM 1616 CG LEU B 145 -18.498 -3.392 -5.982 1.00 0.00 C ATOM 1617 CD1 LEU B 145 -18.070 -4.386 -7.062 1.00 0.00 C ATOM 1618 CD2 LEU B 145 -17.347 -2.423 -5.693 1.00 0.00 C ATOM 0 H LEU B 145 -19.317 -2.355 -3.782 1.00 0.00 H new ATOM 0 HA LEU B 145 -21.017 -1.155 -5.642 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -20.273 -3.187 -7.144 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -19.390 -1.692 -6.907 1.00 0.00 H new ATOM 0 HG LEU B 145 -18.750 -3.960 -5.087 1.00 0.00 H new ATOM 0 HD11 LEU B 145 -17.189 -4.932 -6.725 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -18.882 -5.088 -7.252 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -17.834 -3.847 -7.980 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -16.464 -2.987 -5.393 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -17.122 -1.847 -6.591 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -17.635 -1.745 -4.890 1.00 0.00 H new ATOM 1630 N ASP B 146 -21.829 -4.223 -4.552 1.00 0.00 N ATOM 1631 CA ASP B 146 -22.908 -5.212 -4.458 1.00 0.00 C ATOM 1632 C ASP B 146 -24.220 -4.550 -4.003 1.00 0.00 C ATOM 1633 O ASP B 146 -25.304 -5.069 -4.267 1.00 0.00 O ATOM 1634 CB ASP B 146 -22.552 -6.354 -3.490 1.00 0.00 C ATOM 1635 CG ASP B 146 -21.461 -7.322 -3.955 1.00 0.00 C ATOM 1636 OD1 ASP B 146 -21.503 -7.783 -5.117 1.00 0.00 O ATOM 1637 OD2 ASP B 146 -20.605 -7.708 -3.125 1.00 0.00 O ATOM 0 H ASP B 146 -21.006 -4.451 -3.994 1.00 0.00 H new ATOM 0 HA ASP B 146 -23.040 -5.632 -5.455 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -22.239 -5.915 -2.543 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -23.457 -6.928 -3.291 1.00 0.00 H new ATOM 1642 N ALA B 147 -24.154 -3.442 -3.262 1.00 0.00 N ATOM 1643 CA ALA B 147 -25.309 -2.713 -2.778 1.00 0.00 C ATOM 1644 C ALA B 147 -25.912 -1.798 -3.853 1.00 0.00 C ATOM 1645 O ALA B 147 -27.137 -1.766 -3.953 1.00 0.00 O ATOM 1646 CB ALA B 147 -24.919 -1.931 -1.526 1.00 0.00 C ATOM 0 H ALA B 147 -23.268 -3.023 -2.979 1.00 0.00 H new ATOM 0 HA ALA B 147 -26.090 -3.430 -2.524 1.00 0.00 H new ATOM 0 HB1 ALA B 147 -25.784 -1.380 -1.157 1.00 0.00 H new ATOM 0 HB2 ALA B 147 -24.574 -2.623 -0.757 1.00 0.00 H new ATOM 0 HB3 ALA B 147 -24.120 -1.231 -1.769 1.00 0.00 H new ATOM 1652 N ILE B 148 -25.110 -1.037 -4.614 1.00 0.00 N ATOM 1653 CA ILE B 148 -25.617 -0.146 -5.675 1.00 0.00 C ATOM 1654 C ILE B 148 -26.061 -0.947 -6.899 1.00 0.00 C ATOM 1655 O ILE B 148 -26.988 -0.549 -7.590 1.00 0.00 O ATOM 1656 CB ILE B 148 -24.632 0.991 -6.009 1.00 0.00 C ATOM 1657 CG1 ILE B 148 -25.333 2.171 -6.709 1.00 0.00 C ATOM 1658 CG2 ILE B 148 -23.380 0.514 -6.749 1.00 0.00 C ATOM 1659 CD1 ILE B 148 -24.455 3.428 -6.773 1.00 0.00 C ATOM 0 H ILE B 148 -24.095 -1.020 -4.514 1.00 0.00 H new ATOM 0 HA ILE B 148 -26.506 0.355 -5.292 1.00 0.00 H new ATOM 0 HB ILE B 148 -24.266 1.367 -5.054 1.00 0.00 H new ATOM 0 HG12 ILE B 148 -25.611 1.875 -7.721 1.00 0.00 H new ATOM 0 HG13 ILE B 148 -26.257 2.405 -6.180 1.00 0.00 H new ATOM 0 HG21 ILE B 148 -22.731 1.366 -6.952 1.00 0.00 H new ATOM 0 HG22 ILE B 148 -22.847 -0.210 -6.133 1.00 0.00 H new ATOM 0 HG23 ILE B 148 -23.670 0.046 -7.690 1.00 0.00 H new ATOM 0 HD11 ILE B 148 -25.000 4.227 -7.276 1.00 0.00 H new ATOM 0 HD12 ILE B 148 -24.199 3.745 -5.762 1.00 0.00 H new ATOM 0 HD13 ILE B 148 -23.542 3.207 -7.326 1.00 0.00 H new ATOM 1671 N GLU B 149 -25.401 -2.068 -7.191 1.00 0.00 N ATOM 1672 CA GLU B 149 -25.713 -2.965 -8.305 1.00 0.00 C ATOM 1673 C GLU B 149 -27.111 -3.577 -8.108 1.00 0.00 C ATOM 1674 O GLU B 149 -27.624 -4.255 -8.998 1.00 0.00 O ATOM 1675 CB GLU B 149 -24.634 -4.050 -8.426 1.00 0.00 C ATOM 1676 CG GLU B 149 -23.262 -3.484 -8.841 1.00 0.00 C ATOM 1677 CD GLU B 149 -23.077 -3.211 -10.333 1.00 0.00 C ATOM 1678 OE1 GLU B 149 -23.989 -3.429 -11.164 1.00 0.00 O ATOM 1679 OE2 GLU B 149 -21.962 -2.754 -10.679 1.00 0.00 O ATOM 0 H GLU B 149 -24.606 -2.388 -6.639 1.00 0.00 H new ATOM 0 HA GLU B 149 -25.722 -2.399 -9.237 1.00 0.00 H new ATOM 0 HB2 GLU B 149 -24.535 -4.566 -7.471 1.00 0.00 H new ATOM 0 HB3 GLU B 149 -24.952 -4.792 -9.158 1.00 0.00 H new ATOM 0 HG2 GLU B 149 -23.095 -2.554 -8.298 1.00 0.00 H new ATOM 0 HG3 GLU B 149 -22.490 -4.184 -8.521 1.00 0.00 H new ATOM 1686 N ALA B 150 -27.671 -3.429 -6.901 1.00 0.00 N ATOM 1687 CA ALA B 150 -28.975 -3.882 -6.465 1.00 0.00 C ATOM 1688 C ALA B 150 -29.986 -2.711 -6.458 1.00 0.00 C ATOM 1689 O ALA B 150 -31.002 -2.801 -5.761 1.00 0.00 O ATOM 1690 CB ALA B 150 -28.831 -4.540 -5.083 1.00 0.00 C ATOM 0 H ALA B 150 -27.174 -2.949 -6.151 1.00 0.00 H new ATOM 0 HA ALA B 150 -29.369 -4.623 -7.160 1.00 0.00 H new ATOM 0 HB1 ALA B 150 -29.806 -4.886 -4.742 1.00 0.00 H new ATOM 0 HB2 ALA B 150 -28.149 -5.387 -5.153 1.00 0.00 H new ATOM 0 HB3 ALA B 150 -28.435 -3.813 -4.373 1.00 0.00 H new ATOM 1696 N LYS B 151 -29.698 -1.601 -7.150 1.00 0.00 N ATOM 1697 CA LYS B 151 -30.494 -0.388 -7.295 1.00 0.00 C ATOM 1698 C LYS B 151 -30.533 -0.001 -8.770 1.00 0.00 C ATOM 1699 O LYS B 151 -30.133 -0.838 -9.606 1.00 0.00 O ATOM 1700 CB LYS B 151 -29.852 0.739 -6.469 1.00 0.00 C ATOM 1701 CG LYS B 151 -29.486 0.331 -5.047 1.00 0.00 C ATOM 1702 CD LYS B 151 -30.717 0.255 -4.135 1.00 0.00 C ATOM 1703 CE LYS B 151 -30.343 -0.212 -2.728 1.00 0.00 C ATOM 1704 NZ LYS B 151 -29.716 -1.554 -2.713 1.00 0.00 N ATOM 0 H LYS B 151 -28.822 -1.529 -7.667 1.00 0.00 H new ATOM 0 HA LYS B 151 -31.510 -0.556 -6.937 1.00 0.00 H new ATOM 0 HB2 LYS B 151 -28.953 1.084 -6.980 1.00 0.00 H new ATOM 0 HB3 LYS B 151 -30.540 1.584 -6.429 1.00 0.00 H new ATOM 0 HG2 LYS B 151 -28.988 -0.638 -5.065 1.00 0.00 H new ATOM 0 HG3 LYS B 151 -28.774 1.047 -4.636 1.00 0.00 H new ATOM 0 HD2 LYS B 151 -31.192 1.235 -4.080 1.00 0.00 H new ATOM 0 HD3 LYS B 151 -31.448 -0.430 -4.565 1.00 0.00 H new ATOM 0 HE2 LYS B 151 -29.658 0.509 -2.282 1.00 0.00 H new ATOM 0 HE3 LYS B 151 -31.238 -0.228 -2.106 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 -29.655 -1.898 -1.733 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 -30.292 -2.213 -3.275 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 -28.761 -1.495 -3.120 1.00 0.00 H new