USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 TYR OH : rot 110:sc= -0.0903 USER MOD Set 1.2: A 123 LYS NZ :NH3+ 174:sc= 0.0841 (180deg=0) USER MOD Set 2.1: A 96 HIS : no HD1:sc= 0 X(o=1.2,f=1.1) USER MOD Set 2.2: A 100 THR OG1 : rot 104:sc= 1.24 USER MOD Set 3.1: A 80 THR OG1 : rot -102:sc= 1.59 USER MOD Set 3.2: A 94 CYS SG : rot -165:sc= -0.69 USER MOD Set 4.1: A 33 THR OG1 : rot 57:sc= 2.12 USER MOD Set 4.2: A 71 SER OG : rot -108:sc= 0.991 USER MOD Single : A 8 GLN : amide:sc= -0.049 K(o=-0.049,f=-0.79) USER MOD Single : A 9 ASN : amide:sc= 0.878 K(o=0.88,f=-0.014) USER MOD Single : A 13 THR OG1 : rot 95:sc= 1.26 USER MOD Single : A 16 SER OG : rot 97:sc= 1.18 USER MOD Single : A 18 LYS NZ :NH3+ 134:sc= 1.25 (180deg=0.838) USER MOD Single : A 21 LYS NZ :NH3+ 156:sc= 1.21 (180deg=1.15) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 160:sc= 0.86 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 62:sc= 1.19 USER MOD Single : A 35 TYR OH : rot 25:sc= 1.19 USER MOD Single : A 39 HIS : no HD1:sc= -0.455 X(o=-0.46,f=-0.89) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 141:sc= -0.328 (180deg=-2.21!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= -0.0352 USER MOD Single : A 54 SER OG : rot 150:sc= 0 USER MOD Single : A 57 CYS SG : rot -170:sc= -2.16 USER MOD Single : A 60 SER OG : rot -59:sc= 0.979 USER MOD Single : A 61 HIS : no HD1:sc= -0.272 K(o=-0.27,f=-6!) USER MOD Single : A 62 LYS NZ :NH3+ -114:sc= 2.41 (180deg=0.951) USER MOD Single : A 65 SER OG : rot -90:sc= -0.741 USER MOD Single : A 76 TYR OH : rot 158:sc= 0.626 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.172 K(o=-0.17,f=-2.1!) USER MOD Single : A 106 GLN : amide:sc= 0.962 K(o=0.96,f=-0.55) USER MOD Single : A 110 SER OG : rot -102:sc= 0.971 USER MOD Single : A 115 LYS NZ :NH3+ -173:sc= 0.959 (180deg=0.723) USER MOD Single : A 116 SER OG : rot -81:sc= 1.23 USER MOD Single : A 117 ASN : amide:sc= -0.0939 K(o=-0.094,f=-1) USER MOD Single : A 118 GLN : amide:sc= -0.642 K(o=-0.64,f=-1.6!) USER MOD Single : A 120 HIS : no HD1:sc= -1.43 K(o=-1.4,f=-1.9) USER MOD Single : A 121 LYS NZ :NH3+ -132:sc= 2.49 (180deg=0.924) USER MOD Single : A 126 MET CE :methyl -164:sc= -0.0183 (180deg=-0.319) USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 -0.663 -9.165 -1.605 1.00 0.00 N ATOM 79 CA ASP A 6 -0.249 -10.047 -2.688 1.00 0.00 C ATOM 80 C ASP A 6 -1.360 -10.067 -3.731 1.00 0.00 C ATOM 81 O ASP A 6 -1.120 -10.256 -4.923 1.00 0.00 O ATOM 82 CB ASP A 6 -0.062 -11.469 -2.154 1.00 0.00 C ATOM 83 CG ASP A 6 -1.360 -12.079 -1.609 1.00 0.00 C ATOM 84 OD1 ASP A 6 -2.158 -11.333 -0.996 1.00 0.00 O ATOM 85 OD2 ASP A 6 -1.534 -13.298 -1.820 1.00 0.00 O1- ATOM 0 HA ASP A 6 0.688 -9.693 -3.117 1.00 0.00 H new ATOM 0 HB2 ASP A 6 0.324 -12.103 -2.952 1.00 0.00 H new ATOM 0 HB3 ASP A 6 0.688 -11.459 -1.363 1.00 0.00 H new ATOM 90 N PHE A 7 -2.583 -9.862 -3.237 1.00 0.00 N ATOM 91 CA PHE A 7 -3.817 -9.869 -3.989 1.00 0.00 C ATOM 92 C PHE A 7 -3.759 -8.888 -5.152 1.00 0.00 C ATOM 93 O PHE A 7 -4.391 -9.116 -6.176 1.00 0.00 O ATOM 94 CB PHE A 7 -4.925 -9.473 -3.013 1.00 0.00 C ATOM 95 CG PHE A 7 -6.344 -9.787 -3.437 1.00 0.00 C ATOM 96 CD1 PHE A 7 -6.606 -10.628 -4.528 1.00 0.00 C ATOM 97 CD2 PHE A 7 -7.407 -9.229 -2.712 1.00 0.00 C ATOM 98 CE1 PHE A 7 -7.926 -10.923 -4.884 1.00 0.00 C ATOM 99 CE2 PHE A 7 -8.727 -9.526 -3.067 1.00 0.00 C ATOM 100 CZ PHE A 7 -8.982 -10.380 -4.147 1.00 0.00 C ATOM 0 H PHE A 7 -2.735 -9.677 -2.245 1.00 0.00 H new ATOM 0 HA PHE A 7 -3.998 -10.855 -4.418 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -4.735 -9.970 -2.062 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -4.853 -8.401 -2.832 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -5.788 -11.048 -5.094 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -7.207 -8.570 -1.880 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -8.129 -11.568 -5.726 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -9.547 -9.098 -2.510 1.00 0.00 H new ATOM 0 HZ PHE A 7 -10.001 -10.621 -4.412 1.00 0.00 H new ATOM 110 N GLN A 8 -3.000 -7.799 -4.991 1.00 0.00 N ATOM 111 CA GLN A 8 -2.872 -6.740 -5.980 1.00 0.00 C ATOM 112 C GLN A 8 -2.540 -7.291 -7.363 1.00 0.00 C ATOM 113 O GLN A 8 -3.017 -6.760 -8.363 1.00 0.00 O ATOM 114 CB GLN A 8 -1.771 -5.783 -5.507 1.00 0.00 C ATOM 115 CG GLN A 8 -1.454 -4.744 -6.582 1.00 0.00 C ATOM 116 CD GLN A 8 -2.683 -3.919 -6.945 1.00 0.00 C ATOM 117 OE1 GLN A 8 -3.541 -3.668 -6.100 1.00 0.00 O ATOM 118 NE2 GLN A 8 -2.776 -3.493 -8.201 1.00 0.00 N ATOM 0 H GLN A 8 -2.449 -7.632 -4.149 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.824 -6.217 -6.072 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -2.088 -5.281 -4.593 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.871 -6.348 -5.265 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.663 -4.083 -6.228 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -1.075 -5.245 -7.473 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -2.043 -3.722 -8.873 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.580 -2.937 -8.493 1.00 0.00 H new ATOM 127 N ASN A 9 -1.725 -8.348 -7.437 1.00 0.00 N ATOM 128 CA ASN A 9 -1.346 -8.922 -8.718 1.00 0.00 C ATOM 129 C ASN A 9 -2.529 -9.670 -9.335 1.00 0.00 C ATOM 130 O ASN A 9 -2.716 -9.653 -10.552 1.00 0.00 O ATOM 131 CB ASN A 9 -0.159 -9.859 -8.498 1.00 0.00 C ATOM 132 CG ASN A 9 0.979 -9.164 -7.762 1.00 0.00 C ATOM 133 OD1 ASN A 9 1.777 -8.457 -8.369 1.00 0.00 O ATOM 134 ND2 ASN A 9 1.059 -9.360 -6.445 1.00 0.00 N ATOM 0 H ASN A 9 -1.321 -8.816 -6.626 1.00 0.00 H new ATOM 0 HA ASN A 9 -1.059 -8.132 -9.412 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -0.483 -10.729 -7.928 1.00 0.00 H new ATOM 0 HB3 ASN A 9 0.200 -10.224 -9.460 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.803 -8.915 -5.907 1.00 0.00 H new ATOM 0 HD22 ASN A 9 0.376 -9.955 -5.976 1.00 0.00 H new ATOM 141 N PHE A 10 -3.326 -10.324 -8.485 1.00 0.00 N ATOM 142 CA PHE A 10 -4.515 -11.049 -8.897 1.00 0.00 C ATOM 143 C PHE A 10 -5.586 -10.049 -9.320 1.00 0.00 C ATOM 144 O PHE A 10 -6.312 -10.268 -10.290 1.00 0.00 O ATOM 145 CB PHE A 10 -5.013 -11.858 -7.698 1.00 0.00 C ATOM 146 CG PHE A 10 -5.718 -13.146 -8.051 1.00 0.00 C ATOM 147 CD1 PHE A 10 -6.960 -13.126 -8.698 1.00 0.00 C ATOM 148 CD2 PHE A 10 -5.125 -14.370 -7.718 1.00 0.00 C ATOM 149 CE1 PHE A 10 -7.609 -14.330 -9.006 1.00 0.00 C ATOM 150 CE2 PHE A 10 -5.766 -15.573 -8.033 1.00 0.00 C ATOM 151 CZ PHE A 10 -7.013 -15.556 -8.677 1.00 0.00 C ATOM 0 H PHE A 10 -3.155 -10.361 -7.480 1.00 0.00 H new ATOM 0 HA PHE A 10 -4.294 -11.712 -9.734 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -4.163 -12.090 -7.056 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -5.693 -11.236 -7.115 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.418 -12.183 -8.960 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -4.169 -14.385 -7.216 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -8.570 -14.313 -9.498 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -5.301 -16.515 -7.781 1.00 0.00 H new ATOM 0 HZ PHE A 10 -7.511 -16.483 -8.918 1.00 0.00 H new ATOM 161 N VAL A 11 -5.674 -8.941 -8.574 1.00 0.00 N ATOM 162 CA VAL A 11 -6.627 -7.879 -8.839 1.00 0.00 C ATOM 163 C VAL A 11 -6.266 -7.215 -10.162 1.00 0.00 C ATOM 164 O VAL A 11 -7.117 -7.102 -11.035 1.00 0.00 O ATOM 165 CB VAL A 11 -6.600 -6.855 -7.696 1.00 0.00 C ATOM 166 CG1 VAL A 11 -7.450 -5.631 -8.035 1.00 0.00 C ATOM 167 CG2 VAL A 11 -7.134 -7.469 -6.402 1.00 0.00 C ATOM 0 H VAL A 11 -5.077 -8.764 -7.766 1.00 0.00 H new ATOM 0 HA VAL A 11 -7.635 -8.290 -8.904 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.561 -6.554 -7.561 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.413 -4.922 -7.208 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -7.062 -5.157 -8.937 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.482 -5.940 -8.202 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -7.105 -6.724 -5.607 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -8.162 -7.799 -6.553 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -6.516 -8.323 -6.122 1.00 0.00 H new ATOM 177 N ALA A 12 -5.013 -6.776 -10.317 1.00 0.00 N ATOM 178 CA ALA A 12 -4.560 -6.099 -11.521 1.00 0.00 C ATOM 179 C ALA A 12 -4.711 -6.980 -12.759 1.00 0.00 C ATOM 180 O ALA A 12 -4.939 -6.460 -13.852 1.00 0.00 O ATOM 181 CB ALA A 12 -3.100 -5.692 -11.339 1.00 0.00 C ATOM 0 H ALA A 12 -4.289 -6.883 -9.607 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.181 -5.217 -11.676 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.750 -5.183 -12.237 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -3.013 -5.021 -10.484 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.493 -6.581 -11.166 1.00 0.00 H new ATOM 187 N THR A 13 -4.588 -8.303 -12.610 1.00 0.00 N ATOM 188 CA THR A 13 -4.795 -9.205 -13.732 1.00 0.00 C ATOM 189 C THR A 13 -6.273 -9.162 -14.130 1.00 0.00 C ATOM 190 O THR A 13 -6.611 -9.101 -15.310 1.00 0.00 O ATOM 191 CB THR A 13 -4.345 -10.615 -13.329 1.00 0.00 C ATOM 192 OG1 THR A 13 -2.989 -10.596 -12.943 1.00 0.00 O ATOM 193 CG2 THR A 13 -4.472 -11.592 -14.494 1.00 0.00 C ATOM 0 H THR A 13 -4.349 -8.763 -11.731 1.00 0.00 H new ATOM 0 HA THR A 13 -4.204 -8.903 -14.596 1.00 0.00 H new ATOM 0 HB THR A 13 -4.985 -10.935 -12.506 1.00 0.00 H new ATOM 0 HG1 THR A 13 -2.927 -10.498 -11.970 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.145 -12.582 -14.176 1.00 0.00 H new ATOM 0 HG22 THR A 13 -5.512 -11.640 -14.817 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.850 -11.253 -15.322 1.00 0.00 H new ATOM 201 N LEU A 14 -7.160 -9.190 -13.129 1.00 0.00 N ATOM 202 CA LEU A 14 -8.591 -9.164 -13.373 1.00 0.00 C ATOM 203 C LEU A 14 -9.036 -7.809 -13.908 1.00 0.00 C ATOM 204 O LEU A 14 -9.885 -7.733 -14.792 1.00 0.00 O ATOM 205 CB LEU A 14 -9.316 -9.445 -12.063 1.00 0.00 C ATOM 206 CG LEU A 14 -10.710 -10.006 -12.343 1.00 0.00 C ATOM 207 CD1 LEU A 14 -10.632 -11.510 -12.599 1.00 0.00 C ATOM 208 CD2 LEU A 14 -11.578 -9.755 -11.120 1.00 0.00 C ATOM 0 H LEU A 14 -6.903 -9.231 -12.143 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.831 -9.922 -14.119 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.743 -10.155 -11.466 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.395 -8.528 -11.478 1.00 0.00 H new ATOM 0 HG LEU A 14 -11.131 -9.520 -13.223 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.631 -11.898 -12.797 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.992 -11.700 -13.461 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.217 -12.007 -11.722 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.579 -10.148 -11.298 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -11.141 -10.254 -10.255 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -11.637 -8.683 -10.930 1.00 0.00 H new ATOM 220 N GLU A 15 -8.460 -6.734 -13.368 1.00 0.00 N ATOM 221 CA GLU A 15 -8.743 -5.375 -13.789 1.00 0.00 C ATOM 222 C GLU A 15 -8.326 -5.204 -15.246 1.00 0.00 C ATOM 223 O GLU A 15 -8.954 -4.461 -15.999 1.00 0.00 O ATOM 224 CB GLU A 15 -7.957 -4.437 -12.876 1.00 0.00 C ATOM 225 CG GLU A 15 -8.550 -4.440 -11.463 1.00 0.00 C ATOM 226 CD GLU A 15 -9.881 -3.694 -11.385 1.00 0.00 C ATOM 227 OE1 GLU A 15 -10.592 -3.904 -10.375 1.00 0.00 O ATOM 228 OE2 GLU A 15 -10.180 -2.929 -12.326 1.00 0.00 O1- ATOM 0 H GLU A 15 -7.774 -6.792 -12.615 1.00 0.00 H new ATOM 0 HA GLU A 15 -9.807 -5.147 -13.716 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -6.913 -4.747 -12.839 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -7.975 -3.426 -13.282 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -8.695 -5.470 -11.135 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -7.840 -3.983 -10.774 1.00 0.00 H new ATOM 235 N SER A 16 -7.256 -5.900 -15.638 1.00 0.00 N ATOM 236 CA SER A 16 -6.803 -5.875 -17.016 1.00 0.00 C ATOM 237 C SER A 16 -7.856 -6.539 -17.893 1.00 0.00 C ATOM 238 O SER A 16 -8.029 -6.142 -19.041 1.00 0.00 O ATOM 239 CB SER A 16 -5.457 -6.589 -17.143 1.00 0.00 C ATOM 240 OG SER A 16 -4.493 -5.964 -16.322 1.00 0.00 O ATOM 0 H SER A 16 -6.694 -6.483 -15.018 1.00 0.00 H new ATOM 0 HA SER A 16 -6.665 -4.844 -17.342 1.00 0.00 H new ATOM 0 HB2 SER A 16 -5.564 -7.636 -16.858 1.00 0.00 H new ATOM 0 HB3 SER A 16 -5.126 -6.574 -18.181 1.00 0.00 H new ATOM 0 HG SER A 16 -4.420 -6.451 -15.475 1.00 0.00 H new ATOM 246 N PHE A 17 -8.566 -7.547 -17.371 1.00 0.00 N ATOM 247 CA PHE A 17 -9.665 -8.158 -18.111 1.00 0.00 C ATOM 248 C PHE A 17 -10.863 -7.223 -18.240 1.00 0.00 C ATOM 249 O PHE A 17 -11.550 -7.262 -19.256 1.00 0.00 O ATOM 250 CB PHE A 17 -10.101 -9.451 -17.430 1.00 0.00 C ATOM 251 CG PHE A 17 -8.995 -10.458 -17.237 1.00 0.00 C ATOM 252 CD1 PHE A 17 -9.101 -11.409 -16.215 1.00 0.00 C ATOM 253 CD2 PHE A 17 -7.864 -10.449 -18.066 1.00 0.00 C ATOM 254 CE1 PHE A 17 -8.092 -12.358 -16.028 1.00 0.00 C ATOM 255 CE2 PHE A 17 -6.849 -11.390 -17.871 1.00 0.00 C ATOM 256 CZ PHE A 17 -6.967 -12.349 -16.857 1.00 0.00 C ATOM 0 H PHE A 17 -8.398 -7.950 -16.449 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.298 -8.371 -19.115 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -10.529 -9.208 -16.457 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -10.894 -9.909 -18.021 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -9.966 -11.409 -15.568 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.777 -9.716 -18.854 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.182 -13.096 -15.245 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.973 -11.378 -18.503 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.187 -13.083 -16.716 1.00 0.00 H new ATOM 266 N LYS A 18 -11.122 -6.384 -17.229 1.00 0.00 N ATOM 267 CA LYS A 18 -12.184 -5.387 -17.329 1.00 0.00 C ATOM 268 C LYS A 18 -11.834 -4.389 -18.425 1.00 0.00 C ATOM 269 O LYS A 18 -12.711 -3.782 -19.034 1.00 0.00 O ATOM 270 CB LYS A 18 -12.354 -4.630 -16.010 1.00 0.00 C ATOM 271 CG LYS A 18 -12.359 -5.573 -14.810 1.00 0.00 C ATOM 272 CD LYS A 18 -12.812 -4.835 -13.557 1.00 0.00 C ATOM 273 CE LYS A 18 -12.624 -5.737 -12.340 1.00 0.00 C ATOM 274 NZ LYS A 18 -12.873 -5.007 -11.086 1.00 0.00 N1+ ATOM 0 H LYS A 18 -10.615 -6.378 -16.344 1.00 0.00 H new ATOM 0 HA LYS A 18 -13.116 -5.902 -17.561 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.546 -3.906 -15.900 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -13.286 -4.066 -16.033 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -13.023 -6.415 -15.004 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.361 -5.983 -14.657 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.237 -3.917 -13.435 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.859 -4.546 -13.651 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -13.302 -6.588 -12.408 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.610 -6.137 -12.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -13.477 -5.581 -10.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.968 -4.816 -10.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.350 -4.107 -11.297 1.00 0.00 H new ATOM 288 N ASP A 19 -10.534 -4.227 -18.665 1.00 0.00 N ATOM 289 CA ASP A 19 -10.021 -3.358 -19.724 1.00 0.00 C ATOM 290 C ASP A 19 -10.097 -4.029 -21.102 1.00 0.00 C ATOM 291 O ASP A 19 -10.104 -3.346 -22.125 1.00 0.00 O ATOM 292 CB ASP A 19 -8.587 -2.943 -19.382 1.00 0.00 C ATOM 293 CG ASP A 19 -8.078 -1.786 -20.242 1.00 0.00 C ATOM 294 OD1 ASP A 19 -6.845 -1.578 -20.228 1.00 0.00 O ATOM 295 OD2 ASP A 19 -8.913 -1.129 -20.897 1.00 0.00 O1- ATOM 0 H ASP A 19 -9.804 -4.696 -18.129 1.00 0.00 H new ATOM 0 HA ASP A 19 -10.648 -2.468 -19.782 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.539 -2.656 -18.332 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.926 -3.801 -19.509 1.00 0.00 H new ATOM 300 N LEU A 20 -10.154 -5.365 -21.161 1.00 0.00 N ATOM 301 CA LEU A 20 -10.235 -6.054 -22.442 1.00 0.00 C ATOM 302 C LEU A 20 -11.615 -5.879 -23.060 1.00 0.00 C ATOM 303 O LEU A 20 -12.621 -5.770 -22.362 1.00 0.00 O ATOM 304 CB LEU A 20 -9.934 -7.551 -22.295 1.00 0.00 C ATOM 305 CG LEU A 20 -8.488 -7.845 -21.887 1.00 0.00 C ATOM 306 CD1 LEU A 20 -8.311 -9.358 -21.772 1.00 0.00 C ATOM 307 CD2 LEU A 20 -7.491 -7.308 -22.911 1.00 0.00 C ATOM 0 H LEU A 20 -10.145 -5.978 -20.346 1.00 0.00 H new ATOM 0 HA LEU A 20 -9.484 -5.609 -23.095 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.607 -7.978 -21.551 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.145 -8.051 -23.240 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.294 -7.352 -20.935 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -7.285 -9.583 -21.482 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -8.995 -9.748 -21.018 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -8.527 -9.824 -22.734 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.476 -7.537 -22.585 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.676 -7.775 -23.878 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -7.608 -6.228 -23.001 1.00 0.00 H new ATOM 319 N LYS A 21 -11.652 -5.856 -24.393 1.00 0.00 N ATOM 320 CA LYS A 21 -12.885 -5.788 -25.157 1.00 0.00 C ATOM 321 C LYS A 21 -13.425 -7.207 -25.377 1.00 0.00 C ATOM 322 O LYS A 21 -14.220 -7.434 -26.285 1.00 0.00 O ATOM 323 CB LYS A 21 -12.645 -5.038 -26.472 1.00 0.00 C ATOM 324 CG LYS A 21 -12.720 -3.515 -26.297 1.00 0.00 C ATOM 325 CD LYS A 21 -11.726 -2.941 -25.282 1.00 0.00 C ATOM 326 CE LYS A 21 -10.287 -3.274 -25.667 1.00 0.00 C ATOM 327 NZ LYS A 21 -9.330 -2.727 -24.687 1.00 0.00 N1+ ATOM 0 H LYS A 21 -10.814 -5.885 -24.973 1.00 0.00 H new ATOM 0 HA LYS A 21 -13.642 -5.229 -24.607 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.666 -5.308 -26.868 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.385 -5.354 -27.208 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -12.546 -3.042 -27.264 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.730 -3.247 -25.988 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.848 -1.859 -25.222 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.942 -3.342 -24.292 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -10.167 -4.355 -25.732 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -10.070 -2.869 -26.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.447 -3.276 -24.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.129 -1.733 -24.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.738 -2.787 -23.732 1.00 0.00 H new ATOM 341 N SER A 22 -12.981 -8.152 -24.540 1.00 0.00 N ATOM 342 CA SER A 22 -13.334 -9.560 -24.643 1.00 0.00 C ATOM 343 C SER A 22 -13.397 -10.218 -23.263 1.00 0.00 C ATOM 344 O SER A 22 -14.198 -11.124 -23.057 1.00 0.00 O ATOM 345 CB SER A 22 -12.287 -10.248 -25.514 1.00 0.00 C ATOM 346 OG SER A 22 -11.020 -10.100 -24.912 1.00 0.00 O ATOM 0 H SER A 22 -12.355 -7.949 -23.760 1.00 0.00 H new ATOM 0 HA SER A 22 -14.323 -9.657 -25.091 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.528 -11.305 -25.629 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.283 -9.812 -26.513 1.00 0.00 H new ATOM 0 HG SER A 22 -10.342 -10.541 -25.465 1.00 0.00 H new ATOM 352 N GLY A 23 -12.563 -9.769 -22.318 1.00 0.00 N ATOM 353 CA GLY A 23 -12.576 -10.253 -20.942 1.00 0.00 C ATOM 354 C GLY A 23 -11.854 -11.586 -20.755 1.00 0.00 C ATOM 355 O GLY A 23 -11.473 -11.918 -19.635 1.00 0.00 O ATOM 0 H GLY A 23 -11.857 -9.054 -22.493 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.113 -9.505 -20.298 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.610 -10.360 -20.613 1.00 0.00 H new ATOM 359 N ILE A 24 -11.660 -12.352 -21.832 1.00 0.00 N ATOM 360 CA ILE A 24 -10.914 -13.602 -21.785 1.00 0.00 C ATOM 361 C ILE A 24 -9.438 -13.326 -22.054 1.00 0.00 C ATOM 362 O ILE A 24 -9.118 -12.430 -22.834 1.00 0.00 O ATOM 363 CB ILE A 24 -11.475 -14.582 -22.825 1.00 0.00 C ATOM 364 CG1 ILE A 24 -12.914 -14.973 -22.474 1.00 0.00 C ATOM 365 CG2 ILE A 24 -10.595 -15.833 -22.869 1.00 0.00 C ATOM 366 CD1 ILE A 24 -13.596 -15.712 -23.627 1.00 0.00 C ATOM 0 H ILE A 24 -12.018 -12.119 -22.758 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.014 -14.049 -20.796 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.476 -14.099 -23.802 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -12.913 -15.605 -21.586 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.485 -14.078 -22.227 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -10.991 -16.531 -23.607 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.578 -15.553 -23.144 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.588 -16.308 -21.888 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -14.615 -15.973 -23.340 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.620 -15.070 -24.507 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.040 -16.621 -23.856 1.00 0.00 H new ATOM 378 N SER A 25 -8.537 -14.085 -21.417 1.00 0.00 N ATOM 379 CA SER A 25 -7.111 -13.945 -21.667 1.00 0.00 C ATOM 380 C SER A 25 -6.341 -15.119 -21.079 1.00 0.00 C ATOM 381 O SER A 25 -5.898 -15.058 -19.937 1.00 0.00 O ATOM 382 CB SER A 25 -6.642 -12.634 -21.047 1.00 0.00 C ATOM 383 OG SER A 25 -5.283 -12.429 -21.342 1.00 0.00 O ATOM 0 H SER A 25 -8.777 -14.798 -20.728 1.00 0.00 H new ATOM 0 HA SER A 25 -6.925 -13.937 -22.741 1.00 0.00 H new ATOM 0 HB2 SER A 25 -7.236 -11.805 -21.432 1.00 0.00 H new ATOM 0 HB3 SER A 25 -6.790 -12.658 -19.967 1.00 0.00 H new ATOM 0 HG SER A 25 -5.065 -11.480 -21.236 1.00 0.00 H new ATOM 389 N GLY A 26 -6.182 -16.189 -21.857 1.00 0.00 N ATOM 390 CA GLY A 26 -5.645 -17.454 -21.378 1.00 0.00 C ATOM 391 C GLY A 26 -4.369 -17.330 -20.547 1.00 0.00 C ATOM 392 O GLY A 26 -4.348 -17.797 -19.410 1.00 0.00 O ATOM 0 H GLY A 26 -6.426 -16.198 -22.847 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -6.406 -17.953 -20.778 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.443 -18.096 -22.236 1.00 0.00 H new ATOM 396 N SER A 27 -3.305 -16.718 -21.074 1.00 0.00 N ATOM 397 CA SER A 27 -2.045 -16.651 -20.341 1.00 0.00 C ATOM 398 C SER A 27 -2.177 -15.853 -19.049 1.00 0.00 C ATOM 399 O SER A 27 -1.550 -16.202 -18.051 1.00 0.00 O ATOM 400 CB SER A 27 -0.956 -16.055 -21.232 1.00 0.00 C ATOM 401 OG SER A 27 -0.587 -16.980 -22.229 1.00 0.00 O ATOM 0 H SER A 27 -3.292 -16.270 -21.990 1.00 0.00 H new ATOM 0 HA SER A 27 -1.767 -17.667 -20.062 1.00 0.00 H new ATOM 0 HB2 SER A 27 -1.315 -15.135 -21.693 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.087 -15.791 -20.630 1.00 0.00 H new ATOM 0 HG SER A 27 0.110 -16.589 -22.796 1.00 0.00 H new ATOM 407 N ARG A 28 -2.981 -14.788 -19.049 1.00 0.00 N ATOM 408 CA ARG A 28 -3.180 -13.982 -17.853 1.00 0.00 C ATOM 409 C ARG A 28 -4.104 -14.716 -16.880 1.00 0.00 C ATOM 410 O ARG A 28 -3.903 -14.659 -15.670 1.00 0.00 O ATOM 411 CB ARG A 28 -3.757 -12.625 -18.251 1.00 0.00 C ATOM 412 CG ARG A 28 -2.677 -11.623 -18.693 1.00 0.00 C ATOM 413 CD ARG A 28 -1.796 -12.121 -19.840 1.00 0.00 C ATOM 414 NE ARG A 28 -2.600 -12.509 -20.999 1.00 0.00 N ATOM 415 CZ ARG A 28 -2.126 -12.757 -22.226 1.00 0.00 C ATOM 416 NH1 ARG A 28 -0.836 -12.606 -22.522 1.00 0.00 N1+ ATOM 417 NH2 ARG A 28 -2.958 -13.165 -23.181 1.00 0.00 N ATOM 0 H ARG A 28 -3.502 -14.468 -19.865 1.00 0.00 H new ATOM 0 HA ARG A 28 -2.227 -13.818 -17.350 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -4.471 -12.763 -19.063 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.309 -12.209 -17.408 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -3.160 -10.695 -18.997 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.043 -11.387 -17.838 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -1.094 -11.339 -20.128 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.205 -12.973 -19.504 1.00 0.00 H new ATOM 0 HE ARG A 28 -3.607 -12.598 -20.860 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -0.181 -12.294 -21.805 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.503 -12.802 -23.466 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -3.950 -13.287 -22.976 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.604 -13.356 -24.118 1.00 0.00 H new ATOM 431 N ILE A 29 -5.121 -15.416 -17.396 1.00 0.00 N ATOM 432 CA ILE A 29 -5.952 -16.279 -16.581 1.00 0.00 C ATOM 433 C ILE A 29 -5.054 -17.316 -15.915 1.00 0.00 C ATOM 434 O ILE A 29 -5.219 -17.609 -14.732 1.00 0.00 O ATOM 435 CB ILE A 29 -6.996 -16.955 -17.481 1.00 0.00 C ATOM 436 CG1 ILE A 29 -8.062 -15.930 -17.895 1.00 0.00 C ATOM 437 CG2 ILE A 29 -7.630 -18.155 -16.764 1.00 0.00 C ATOM 438 CD1 ILE A 29 -9.030 -16.506 -18.930 1.00 0.00 C ATOM 0 H ILE A 29 -5.381 -15.394 -18.382 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.474 -15.711 -15.811 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.506 -17.329 -18.380 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.619 -15.609 -17.015 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.576 -15.045 -18.305 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.367 -18.621 -17.417 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.856 -18.881 -16.515 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.118 -17.817 -15.850 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -9.769 -15.750 -19.197 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.476 -16.803 -19.821 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -9.536 -17.376 -18.511 1.00 0.00 H new ATOM 450 N LYS A 30 -4.105 -17.870 -16.677 1.00 0.00 N ATOM 451 CA LYS A 30 -3.161 -18.853 -16.169 1.00 0.00 C ATOM 452 C LYS A 30 -2.176 -18.226 -15.182 1.00 0.00 C ATOM 453 O LYS A 30 -1.623 -18.949 -14.356 1.00 0.00 O ATOM 454 CB LYS A 30 -2.437 -19.516 -17.347 1.00 0.00 C ATOM 455 CG LYS A 30 -3.360 -20.564 -17.982 1.00 0.00 C ATOM 456 CD LYS A 30 -2.799 -21.134 -19.292 1.00 0.00 C ATOM 457 CE LYS A 30 -3.038 -20.159 -20.447 1.00 0.00 C ATOM 458 NZ LYS A 30 -2.610 -20.718 -21.741 1.00 0.00 N1+ ATOM 0 H LYS A 30 -3.975 -17.645 -17.663 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.708 -19.618 -15.617 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.157 -18.765 -18.086 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.515 -19.986 -17.005 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.518 -21.378 -17.275 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.334 -20.115 -18.174 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.731 -21.325 -19.185 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.273 -22.091 -19.512 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.097 -19.906 -20.494 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.497 -19.232 -20.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -2.790 -20.025 -22.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.594 -20.936 -21.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.144 -21.589 -21.937 1.00 0.00 H new ATOM 472 N LYS A 31 -1.947 -16.907 -15.245 1.00 0.00 N ATOM 473 CA LYS A 31 -1.095 -16.241 -14.267 1.00 0.00 C ATOM 474 C LYS A 31 -1.755 -16.255 -12.894 1.00 0.00 C ATOM 475 O LYS A 31 -1.121 -16.666 -11.922 1.00 0.00 O ATOM 476 CB LYS A 31 -0.772 -14.801 -14.697 1.00 0.00 C ATOM 477 CG LYS A 31 0.274 -14.759 -15.816 1.00 0.00 C ATOM 478 CD LYS A 31 1.706 -14.685 -15.282 1.00 0.00 C ATOM 479 CE LYS A 31 2.064 -15.916 -14.445 1.00 0.00 C ATOM 480 NZ LYS A 31 3.472 -15.871 -14.007 1.00 0.00 N1+ ATOM 0 H LYS A 31 -2.338 -16.291 -15.958 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.155 -16.789 -14.210 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.685 -14.310 -15.035 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.407 -14.239 -13.838 1.00 0.00 H new ATOM 0 HG2 LYS A 31 0.169 -15.646 -16.440 1.00 0.00 H new ATOM 0 HG3 LYS A 31 0.083 -13.896 -16.454 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.401 -14.598 -16.117 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.822 -13.787 -14.676 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.411 -15.970 -13.574 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.891 -16.820 -15.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.687 -16.717 -13.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.094 -15.844 -14.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.629 -15.020 -13.430 1.00 0.00 H new ATOM 494 N LEU A 32 -3.014 -15.815 -12.794 1.00 0.00 N ATOM 495 CA LEU A 32 -3.687 -15.823 -11.501 1.00 0.00 C ATOM 496 C LEU A 32 -4.099 -17.246 -11.115 1.00 0.00 C ATOM 497 O LEU A 32 -4.274 -17.533 -9.934 1.00 0.00 O ATOM 498 CB LEU A 32 -4.848 -14.814 -11.486 1.00 0.00 C ATOM 499 CG LEU A 32 -5.926 -14.995 -12.561 1.00 0.00 C ATOM 500 CD1 LEU A 32 -6.891 -16.148 -12.277 1.00 0.00 C ATOM 501 CD2 LEU A 32 -6.767 -13.724 -12.608 1.00 0.00 C ATOM 0 H LEU A 32 -3.570 -15.459 -13.571 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.993 -15.492 -10.729 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.329 -14.862 -10.509 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.431 -13.812 -11.587 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.404 -15.211 -13.493 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.625 -16.214 -13.080 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.333 -17.083 -12.217 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.403 -15.969 -11.332 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.542 -13.829 -13.367 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.231 -13.559 -11.636 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -6.130 -12.875 -12.855 1.00 0.00 H new ATOM 513 N THR A 33 -4.253 -18.143 -12.094 1.00 0.00 N ATOM 514 CA THR A 33 -4.583 -19.536 -11.819 1.00 0.00 C ATOM 515 C THR A 33 -3.377 -20.238 -11.210 1.00 0.00 C ATOM 516 O THR A 33 -3.521 -21.052 -10.301 1.00 0.00 O ATOM 517 CB THR A 33 -4.956 -20.238 -13.125 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.130 -19.683 -13.676 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.202 -21.728 -12.921 1.00 0.00 C ATOM 0 H THR A 33 -4.153 -17.924 -13.085 1.00 0.00 H new ATOM 0 HA THR A 33 -5.421 -19.574 -11.123 1.00 0.00 H new ATOM 0 HB THR A 33 -4.111 -20.097 -13.799 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.004 -18.721 -13.813 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.464 -22.187 -13.874 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.299 -22.196 -12.529 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.019 -21.868 -12.214 1.00 0.00 H new ATOM 527 N THR A 34 -2.180 -19.924 -11.714 1.00 0.00 N ATOM 528 CA THR A 34 -0.973 -20.569 -11.236 1.00 0.00 C ATOM 529 C THR A 34 -0.662 -20.093 -9.824 1.00 0.00 C ATOM 530 O THR A 34 -0.276 -20.904 -8.985 1.00 0.00 O ATOM 531 CB THR A 34 0.188 -20.294 -12.192 1.00 0.00 C ATOM 532 OG1 THR A 34 -0.112 -20.824 -13.463 1.00 0.00 O ATOM 533 CG2 THR A 34 1.464 -20.948 -11.669 1.00 0.00 C ATOM 0 H THR A 34 -2.030 -19.231 -12.447 1.00 0.00 H new ATOM 0 HA THR A 34 -1.124 -21.648 -11.204 1.00 0.00 H new ATOM 0 HB THR A 34 0.337 -19.217 -12.264 1.00 0.00 H new ATOM 0 HG1 THR A 34 -0.913 -20.386 -13.819 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.285 -20.746 -12.357 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.705 -20.541 -10.687 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.314 -22.025 -11.589 1.00 0.00 H new ATOM 541 N TYR A 35 -0.820 -18.797 -9.540 1.00 0.00 N ATOM 542 CA TYR A 35 -0.569 -18.318 -8.191 1.00 0.00 C ATOM 543 C TYR A 35 -1.598 -18.910 -7.232 1.00 0.00 C ATOM 544 O TYR A 35 -1.301 -19.121 -6.060 1.00 0.00 O ATOM 545 CB TYR A 35 -0.609 -16.789 -8.145 1.00 0.00 C ATOM 546 CG TYR A 35 -0.405 -16.246 -6.743 1.00 0.00 C ATOM 547 CD1 TYR A 35 -1.317 -15.328 -6.201 1.00 0.00 C ATOM 548 CD2 TYR A 35 0.696 -16.669 -5.981 1.00 0.00 C ATOM 549 CE1 TYR A 35 -1.141 -14.839 -4.897 1.00 0.00 C ATOM 550 CE2 TYR A 35 0.878 -16.190 -4.675 1.00 0.00 C ATOM 551 CZ TYR A 35 -0.044 -15.276 -4.125 1.00 0.00 C ATOM 552 OH TYR A 35 0.134 -14.823 -2.853 1.00 0.00 O ATOM 0 H TYR A 35 -1.112 -18.084 -10.209 1.00 0.00 H new ATOM 0 HA TYR A 35 0.426 -18.639 -7.884 1.00 0.00 H new ATOM 0 HB2 TYR A 35 0.163 -16.388 -8.802 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -1.568 -16.442 -8.530 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -2.159 -14.996 -6.790 1.00 0.00 H new ATOM 0 HD2 TYR A 35 1.406 -17.366 -6.402 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -1.844 -14.130 -4.486 1.00 0.00 H new ATOM 0 HE2 TYR A 35 1.724 -16.521 -4.091 1.00 0.00 H new ATOM 0 HH TYR A 35 -0.729 -14.544 -2.481 1.00 0.00 H new ATOM 562 N ALA A 36 -2.808 -19.182 -7.726 1.00 0.00 N ATOM 563 CA ALA A 36 -3.833 -19.822 -6.926 1.00 0.00 C ATOM 564 C ALA A 36 -3.499 -21.293 -6.664 1.00 0.00 C ATOM 565 O ALA A 36 -3.923 -21.838 -5.647 1.00 0.00 O ATOM 566 CB ALA A 36 -5.159 -19.699 -7.674 1.00 0.00 C ATOM 0 H ALA A 36 -3.094 -18.965 -8.681 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.897 -19.332 -5.954 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.950 -20.173 -7.093 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.398 -18.646 -7.820 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.077 -20.190 -8.644 1.00 0.00 H new ATOM 572 N LEU A 37 -2.748 -21.940 -7.566 1.00 0.00 N ATOM 573 CA LEU A 37 -2.380 -23.341 -7.403 1.00 0.00 C ATOM 574 C LEU A 37 -1.193 -23.432 -6.460 1.00 0.00 C ATOM 575 O LEU A 37 -1.122 -24.326 -5.620 1.00 0.00 O ATOM 576 CB LEU A 37 -1.990 -23.939 -8.755 1.00 0.00 C ATOM 577 CG LEU A 37 -3.169 -24.531 -9.535 1.00 0.00 C ATOM 578 CD1 LEU A 37 -2.590 -25.186 -10.789 1.00 0.00 C ATOM 579 CD2 LEU A 37 -3.919 -25.594 -8.723 1.00 0.00 C ATOM 0 H LEU A 37 -2.386 -21.508 -8.416 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.228 -23.893 -6.997 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.518 -23.166 -9.361 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.245 -24.718 -8.595 1.00 0.00 H new ATOM 0 HG LEU A 37 -3.879 -23.738 -9.770 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.397 -25.623 -11.377 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.072 -24.435 -11.385 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.888 -25.968 -10.500 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.746 -25.987 -9.314 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.237 -26.406 -8.469 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.307 -25.146 -7.808 1.00 0.00 H new ATOM 591 N ASP A 38 -0.262 -22.489 -6.610 1.00 0.00 N ATOM 592 CA ASP A 38 0.882 -22.347 -5.747 1.00 0.00 C ATOM 593 C ASP A 38 0.442 -22.132 -4.302 1.00 0.00 C ATOM 594 O ASP A 38 1.147 -22.538 -3.380 1.00 0.00 O ATOM 595 CB ASP A 38 1.663 -21.137 -6.254 1.00 0.00 C ATOM 596 CG ASP A 38 2.273 -21.344 -7.637 1.00 0.00 C ATOM 597 OD1 ASP A 38 2.265 -22.498 -8.113 1.00 0.00 O ATOM 598 OD2 ASP A 38 2.745 -20.330 -8.199 1.00 0.00 O1- ATOM 0 H ASP A 38 -0.295 -21.794 -7.355 1.00 0.00 H new ATOM 0 HA ASP A 38 1.498 -23.246 -5.764 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.000 -20.273 -6.284 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.458 -20.905 -5.546 1.00 0.00 H new ATOM 603 N HIS A 39 -0.719 -21.497 -4.108 1.00 0.00 N ATOM 604 CA HIS A 39 -1.267 -21.241 -2.787 1.00 0.00 C ATOM 605 C HIS A 39 -2.794 -21.211 -2.816 1.00 0.00 C ATOM 606 O HIS A 39 -3.397 -20.233 -3.249 1.00 0.00 O ATOM 607 CB HIS A 39 -0.718 -19.914 -2.263 1.00 0.00 C ATOM 608 CG HIS A 39 0.759 -19.933 -1.969 1.00 0.00 C ATOM 609 ND1 HIS A 39 1.772 -19.596 -2.871 1.00 0.00 N ATOM 610 CD2 HIS A 39 1.315 -20.286 -0.774 1.00 0.00 C ATOM 611 CE1 HIS A 39 2.917 -19.763 -2.193 1.00 0.00 C ATOM 612 NE2 HIS A 39 2.676 -20.175 -0.935 1.00 0.00 N ATOM 0 H HIS A 39 -1.301 -21.148 -4.870 1.00 0.00 H new ATOM 0 HA HIS A 39 -0.967 -22.050 -2.121 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -0.922 -19.134 -2.997 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -1.255 -19.645 -1.354 1.00 0.00 H new ATOM 0 HD2 HIS A 39 0.791 -20.591 0.120 1.00 0.00 H new ATOM 0 HE1 HIS A 39 3.901 -19.590 -2.602 1.00 0.00 H new ATOM 0 HE2 HIS A 39 3.381 -20.371 -0.224 1.00 0.00 H new ATOM 620 N ILE A 40 -3.414 -22.298 -2.344 1.00 0.00 N ATOM 621 CA ILE A 40 -4.850 -22.372 -2.157 1.00 0.00 C ATOM 622 C ILE A 40 -5.233 -21.582 -0.911 1.00 0.00 C ATOM 623 O ILE A 40 -6.416 -21.360 -0.673 1.00 0.00 O ATOM 624 CB ILE A 40 -5.312 -23.830 -2.022 1.00 0.00 C ATOM 625 CG1 ILE A 40 -4.420 -24.683 -1.104 1.00 0.00 C ATOM 626 CG2 ILE A 40 -5.472 -24.470 -3.396 1.00 0.00 C ATOM 627 CD1 ILE A 40 -3.242 -25.372 -1.795 1.00 0.00 C ATOM 0 H ILE A 40 -2.922 -23.152 -2.082 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.343 -21.944 -3.030 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.284 -23.799 -1.530 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.032 -24.047 -0.308 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.038 -25.445 -0.630 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -5.800 -25.503 -3.280 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.214 -23.916 -3.971 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.517 -24.449 -3.921 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.676 -25.948 -1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.616 -26.040 -2.571 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.594 -24.620 -2.245 1.00 0.00 H new ATOM 639 N ASP A 41 -4.238 -21.158 -0.122 1.00 0.00 N ATOM 640 CA ASP A 41 -4.439 -20.435 1.124 1.00 0.00 C ATOM 641 C ASP A 41 -5.289 -19.182 0.916 1.00 0.00 C ATOM 642 O ASP A 41 -5.937 -18.708 1.849 1.00 0.00 O ATOM 643 CB ASP A 41 -3.078 -20.029 1.699 1.00 0.00 C ATOM 644 CG ASP A 41 -2.051 -21.160 1.737 1.00 0.00 C ATOM 645 OD1 ASP A 41 -2.437 -22.325 1.501 1.00 0.00 O ATOM 646 OD2 ASP A 41 -0.876 -20.829 2.008 1.00 0.00 O1- ATOM 0 H ASP A 41 -3.255 -21.315 -0.343 1.00 0.00 H new ATOM 0 HA ASP A 41 -4.965 -21.093 1.815 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.676 -19.208 1.105 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.222 -19.650 2.711 1.00 0.00 H new ATOM 651 N ILE A 42 -5.283 -18.645 -0.306 1.00 0.00 N ATOM 652 CA ILE A 42 -6.032 -17.452 -0.660 1.00 0.00 C ATOM 653 C ILE A 42 -7.265 -17.776 -1.502 1.00 0.00 C ATOM 654 O ILE A 42 -7.828 -16.879 -2.126 1.00 0.00 O ATOM 655 CB ILE A 42 -5.129 -16.421 -1.349 1.00 0.00 C ATOM 656 CG1 ILE A 42 -4.267 -17.027 -2.467 1.00 0.00 C ATOM 657 CG2 ILE A 42 -4.308 -15.670 -0.296 1.00 0.00 C ATOM 658 CD1 ILE A 42 -2.831 -17.321 -2.041 1.00 0.00 C ATOM 0 H ILE A 42 -4.749 -19.036 -1.082 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.396 -17.009 0.267 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.766 -15.699 -1.861 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -4.731 -17.951 -2.812 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.253 -16.342 -3.315 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -3.667 -14.938 -0.788 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -4.980 -15.159 0.393 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.691 -16.378 0.258 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.282 -17.747 -2.881 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.349 -16.396 -1.724 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -2.835 -18.030 -1.213 1.00 0.00 H new ATOM 670 N GLU A 43 -7.704 -19.038 -1.536 1.00 0.00 N ATOM 671 CA GLU A 43 -8.893 -19.406 -2.296 1.00 0.00 C ATOM 672 C GLU A 43 -10.079 -18.516 -1.925 1.00 0.00 C ATOM 673 O GLU A 43 -10.938 -18.246 -2.760 1.00 0.00 O ATOM 674 CB GLU A 43 -9.205 -20.885 -2.059 1.00 0.00 C ATOM 675 CG GLU A 43 -9.505 -21.245 -0.598 1.00 0.00 C ATOM 676 CD GLU A 43 -10.929 -20.932 -0.142 1.00 0.00 C ATOM 677 OE1 GLU A 43 -11.796 -20.694 -1.010 1.00 0.00 O ATOM 678 OE2 GLU A 43 -11.120 -20.939 1.094 1.00 0.00 O1- ATOM 0 H GLU A 43 -7.255 -19.813 -1.049 1.00 0.00 H new ATOM 0 HA GLU A 43 -8.703 -19.253 -3.358 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -10.061 -21.166 -2.672 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -8.359 -21.481 -2.401 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -9.318 -22.309 -0.455 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -8.806 -20.709 0.045 1.00 0.00 H new ATOM 685 N SER A 44 -10.125 -18.060 -0.672 1.00 0.00 N ATOM 686 CA SER A 44 -11.226 -17.241 -0.183 1.00 0.00 C ATOM 687 C SER A 44 -11.339 -15.912 -0.935 1.00 0.00 C ATOM 688 O SER A 44 -12.436 -15.530 -1.343 1.00 0.00 O ATOM 689 CB SER A 44 -11.039 -17.012 1.316 1.00 0.00 C ATOM 690 OG SER A 44 -12.056 -16.166 1.797 1.00 0.00 O ATOM 0 H SER A 44 -9.404 -18.248 0.025 1.00 0.00 H new ATOM 0 HA SER A 44 -12.161 -17.771 -0.362 1.00 0.00 H new ATOM 0 HB2 SER A 44 -11.064 -17.965 1.845 1.00 0.00 H new ATOM 0 HB3 SER A 44 -10.062 -16.567 1.507 1.00 0.00 H new ATOM 0 HG SER A 44 -11.934 -16.022 2.759 1.00 0.00 H new ATOM 696 N LYS A 45 -10.222 -15.196 -1.130 1.00 0.00 N ATOM 697 CA LYS A 45 -10.260 -13.928 -1.855 1.00 0.00 C ATOM 698 C LYS A 45 -10.432 -14.182 -3.349 1.00 0.00 C ATOM 699 O LYS A 45 -10.909 -13.310 -4.071 1.00 0.00 O ATOM 700 CB LYS A 45 -8.991 -13.099 -1.600 1.00 0.00 C ATOM 701 CG LYS A 45 -7.728 -13.878 -1.965 1.00 0.00 C ATOM 702 CD LYS A 45 -6.455 -13.027 -1.971 1.00 0.00 C ATOM 703 CE LYS A 45 -6.249 -12.302 -0.645 1.00 0.00 C ATOM 704 NZ LYS A 45 -4.829 -11.966 -0.427 1.00 0.00 N1+ ATOM 0 H LYS A 45 -9.297 -15.472 -0.800 1.00 0.00 H new ATOM 0 HA LYS A 45 -11.113 -13.357 -1.489 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.033 -12.179 -2.183 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.950 -12.809 -0.550 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.602 -14.698 -1.258 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.860 -14.324 -2.951 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.594 -13.664 -2.174 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.510 -12.297 -2.779 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.846 -11.390 -0.631 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.605 -12.929 0.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -4.758 -11.024 0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.398 -12.672 0.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -4.329 -11.964 -1.339 1.00 0.00 H new ATOM 718 N ILE A 46 -10.046 -15.372 -3.817 1.00 0.00 N ATOM 719 CA ILE A 46 -10.135 -15.719 -5.225 1.00 0.00 C ATOM 720 C ILE A 46 -11.587 -15.972 -5.610 1.00 0.00 C ATOM 721 O ILE A 46 -12.048 -15.448 -6.622 1.00 0.00 O ATOM 722 CB ILE A 46 -9.262 -16.950 -5.487 1.00 0.00 C ATOM 723 CG1 ILE A 46 -7.796 -16.539 -5.313 1.00 0.00 C ATOM 724 CG2 ILE A 46 -9.509 -17.505 -6.893 1.00 0.00 C ATOM 725 CD1 ILE A 46 -6.870 -17.750 -5.204 1.00 0.00 C ATOM 0 H ILE A 46 -9.666 -16.114 -3.229 1.00 0.00 H new ATOM 0 HA ILE A 46 -9.772 -14.895 -5.840 1.00 0.00 H new ATOM 0 HB ILE A 46 -9.513 -17.741 -4.781 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.489 -15.923 -6.159 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.696 -15.924 -4.418 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.878 -18.379 -7.055 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.556 -17.790 -6.993 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.269 -16.741 -7.633 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.841 -17.411 -5.082 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -7.159 -18.352 -4.343 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -6.949 -18.351 -6.110 1.00 0.00 H new ATOM 737 N ILE A 47 -12.304 -16.770 -4.813 1.00 0.00 N ATOM 738 CA ILE A 47 -13.704 -17.067 -5.083 1.00 0.00 C ATOM 739 C ILE A 47 -14.542 -15.802 -4.916 1.00 0.00 C ATOM 740 O ILE A 47 -15.478 -15.569 -5.680 1.00 0.00 O ATOM 741 CB ILE A 47 -14.188 -18.194 -4.163 1.00 0.00 C ATOM 742 CG1 ILE A 47 -13.443 -19.507 -4.441 1.00 0.00 C ATOM 743 CG2 ILE A 47 -15.696 -18.401 -4.330 1.00 0.00 C ATOM 744 CD1 ILE A 47 -13.586 -20.005 -5.881 1.00 0.00 C ATOM 0 H ILE A 47 -11.933 -17.220 -3.976 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.815 -17.409 -6.112 1.00 0.00 H new ATOM 0 HB ILE A 47 -13.976 -17.899 -3.135 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -12.385 -19.368 -4.218 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -13.814 -20.275 -3.762 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -16.028 -19.204 -3.672 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.220 -17.481 -4.073 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.914 -18.666 -5.364 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.033 -20.936 -6.000 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.639 -20.177 -6.103 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -13.188 -19.256 -6.566 1.00 0.00 H new ATOM 756 N SER A 48 -14.211 -14.978 -3.918 1.00 0.00 N ATOM 757 CA SER A 48 -14.926 -13.730 -3.706 1.00 0.00 C ATOM 758 C SER A 48 -14.712 -12.784 -4.888 1.00 0.00 C ATOM 759 O SER A 48 -15.613 -12.028 -5.248 1.00 0.00 O ATOM 760 CB SER A 48 -14.431 -13.098 -2.405 1.00 0.00 C ATOM 761 OG SER A 48 -14.955 -11.798 -2.265 1.00 0.00 O ATOM 0 H SER A 48 -13.458 -15.156 -3.253 1.00 0.00 H new ATOM 0 HA SER A 48 -15.996 -13.924 -3.630 1.00 0.00 H new ATOM 0 HB2 SER A 48 -14.732 -13.712 -1.556 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.342 -13.061 -2.402 1.00 0.00 H new ATOM 0 HG SER A 48 -14.633 -11.404 -1.428 1.00 0.00 H new ATOM 767 N LEU A 49 -13.524 -12.818 -5.497 1.00 0.00 N ATOM 768 CA LEU A 49 -13.200 -11.908 -6.581 1.00 0.00 C ATOM 769 C LEU A 49 -13.885 -12.289 -7.896 1.00 0.00 C ATOM 770 O LEU A 49 -14.253 -11.403 -8.665 1.00 0.00 O ATOM 771 CB LEU A 49 -11.677 -11.860 -6.707 1.00 0.00 C ATOM 772 CG LEU A 49 -11.211 -10.904 -7.803 1.00 0.00 C ATOM 773 CD1 LEU A 49 -11.772 -9.492 -7.604 1.00 0.00 C ATOM 774 CD2 LEU A 49 -9.687 -10.816 -7.808 1.00 0.00 C ATOM 0 H LEU A 49 -12.776 -13.468 -5.253 1.00 0.00 H new ATOM 0 HA LEU A 49 -13.583 -10.914 -6.352 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -11.246 -11.553 -5.754 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -11.301 -12.861 -6.919 1.00 0.00 H new ATOM 0 HG LEU A 49 -11.578 -11.300 -8.750 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.417 -8.843 -8.405 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -12.861 -9.527 -7.622 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -11.438 -9.100 -6.644 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -9.365 -10.132 -8.593 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.341 -10.449 -6.842 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -9.266 -11.804 -7.993 1.00 0.00 H new ATOM 786 N ILE A 50 -14.063 -13.588 -8.170 1.00 0.00 N ATOM 787 CA ILE A 50 -14.739 -14.000 -9.397 1.00 0.00 C ATOM 788 C ILE A 50 -16.227 -13.680 -9.310 1.00 0.00 C ATOM 789 O ILE A 50 -16.795 -13.187 -10.283 1.00 0.00 O ATOM 790 CB ILE A 50 -14.562 -15.495 -9.694 1.00 0.00 C ATOM 791 CG1 ILE A 50 -14.794 -16.343 -8.443 1.00 0.00 C ATOM 792 CG2 ILE A 50 -13.186 -15.763 -10.302 1.00 0.00 C ATOM 793 CD1 ILE A 50 -14.882 -17.835 -8.736 1.00 0.00 C ATOM 0 H ILE A 50 -13.754 -14.353 -7.571 1.00 0.00 H new ATOM 0 HA ILE A 50 -14.278 -13.442 -10.212 1.00 0.00 H new ATOM 0 HB ILE A 50 -15.316 -15.786 -10.425 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.983 -16.165 -7.736 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -15.715 -16.020 -7.959 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -13.079 -16.829 -10.506 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -13.084 -15.204 -11.232 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -12.412 -15.448 -9.603 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -15.047 -18.379 -7.806 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -15.710 -18.023 -9.419 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -13.951 -18.172 -9.193 1.00 0.00 H new ATOM 805 N ILE A 51 -16.869 -13.949 -8.169 1.00 0.00 N ATOM 806 CA ILE A 51 -18.300 -13.686 -8.061 1.00 0.00 C ATOM 807 C ILE A 51 -18.586 -12.190 -8.158 1.00 0.00 C ATOM 808 O ILE A 51 -19.564 -11.794 -8.792 1.00 0.00 O ATOM 809 CB ILE A 51 -18.881 -14.297 -6.777 1.00 0.00 C ATOM 810 CG1 ILE A 51 -18.283 -13.638 -5.530 1.00 0.00 C ATOM 811 CG2 ILE A 51 -18.661 -15.815 -6.780 1.00 0.00 C ATOM 812 CD1 ILE A 51 -18.897 -14.174 -4.240 1.00 0.00 C ATOM 0 H ILE A 51 -16.433 -14.337 -7.332 1.00 0.00 H new ATOM 0 HA ILE A 51 -18.799 -14.170 -8.901 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.954 -14.107 -6.749 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -17.206 -13.806 -5.514 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -18.437 -12.560 -5.582 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -19.075 -16.244 -5.867 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -19.159 -16.253 -7.645 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -17.593 -16.028 -6.829 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -18.440 -13.676 -3.385 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -19.970 -13.982 -4.241 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -18.720 -15.247 -4.171 1.00 0.00 H new ATOM 824 N ASP A 52 -17.741 -11.359 -7.538 1.00 0.00 N ATOM 825 CA ASP A 52 -17.919 -9.917 -7.591 1.00 0.00 C ATOM 826 C ASP A 52 -17.745 -9.391 -9.013 1.00 0.00 C ATOM 827 O ASP A 52 -18.607 -8.666 -9.509 1.00 0.00 O ATOM 828 CB ASP A 52 -16.929 -9.254 -6.633 1.00 0.00 C ATOM 829 CG ASP A 52 -17.280 -9.485 -5.164 1.00 0.00 C ATOM 830 OD1 ASP A 52 -16.482 -9.020 -4.318 1.00 0.00 O ATOM 831 OD2 ASP A 52 -18.329 -10.113 -4.902 1.00 0.00 O1- ATOM 0 H ASP A 52 -16.932 -11.666 -6.997 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.935 -9.672 -7.282 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.928 -9.640 -6.828 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.901 -8.182 -6.831 1.00 0.00 H new ATOM 836 N TYR A 53 -16.640 -9.743 -9.680 1.00 0.00 N ATOM 837 CA TYR A 53 -16.389 -9.274 -11.032 1.00 0.00 C ATOM 838 C TYR A 53 -17.451 -9.815 -11.979 1.00 0.00 C ATOM 839 O TYR A 53 -17.976 -9.060 -12.791 1.00 0.00 O ATOM 840 CB TYR A 53 -14.983 -9.715 -11.445 1.00 0.00 C ATOM 841 CG TYR A 53 -14.653 -9.744 -12.930 1.00 0.00 C ATOM 842 CD1 TYR A 53 -14.632 -8.575 -13.709 1.00 0.00 C ATOM 843 CD2 TYR A 53 -14.350 -10.978 -13.522 1.00 0.00 C ATOM 844 CE1 TYR A 53 -14.266 -8.639 -15.069 1.00 0.00 C ATOM 845 CE2 TYR A 53 -13.981 -11.054 -14.871 1.00 0.00 C ATOM 846 CZ TYR A 53 -13.930 -9.881 -15.648 1.00 0.00 C ATOM 847 OH TYR A 53 -13.556 -9.950 -16.957 1.00 0.00 O ATOM 0 H TYR A 53 -15.913 -10.349 -9.301 1.00 0.00 H new ATOM 0 HA TYR A 53 -16.443 -8.186 -11.075 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -14.268 -9.053 -10.957 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -14.816 -10.715 -11.046 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -14.896 -7.626 -13.266 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -14.402 -11.881 -12.931 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -14.243 -7.739 -15.666 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -13.737 -12.008 -15.313 1.00 0.00 H new ATOM 0 HH TYR A 53 -13.358 -10.881 -17.192 1.00 0.00 H new ATOM 857 N SER A 54 -17.776 -11.109 -11.886 1.00 0.00 N ATOM 858 CA SER A 54 -18.704 -11.729 -12.819 1.00 0.00 C ATOM 859 C SER A 54 -20.117 -11.163 -12.706 1.00 0.00 C ATOM 860 O SER A 54 -20.842 -11.141 -13.697 1.00 0.00 O ATOM 861 CB SER A 54 -18.745 -13.231 -12.558 1.00 0.00 C ATOM 862 OG SER A 54 -19.561 -13.866 -13.522 1.00 0.00 O ATOM 0 H SER A 54 -17.408 -11.740 -11.174 1.00 0.00 H new ATOM 0 HA SER A 54 -18.346 -11.516 -13.826 1.00 0.00 H new ATOM 0 HB2 SER A 54 -17.736 -13.643 -12.595 1.00 0.00 H new ATOM 0 HB3 SER A 54 -19.132 -13.424 -11.557 1.00 0.00 H new ATOM 0 HG SER A 54 -19.236 -14.778 -13.676 1.00 0.00 H new ATOM 868 N ARG A 55 -20.530 -10.705 -11.521 1.00 0.00 N ATOM 869 CA ARG A 55 -21.883 -10.191 -11.379 1.00 0.00 C ATOM 870 C ARG A 55 -21.976 -8.741 -11.854 1.00 0.00 C ATOM 871 O ARG A 55 -22.985 -8.354 -12.438 1.00 0.00 O ATOM 872 CB ARG A 55 -22.339 -10.354 -9.925 1.00 0.00 C ATOM 873 CG ARG A 55 -23.866 -10.419 -9.809 1.00 0.00 C ATOM 874 CD ARG A 55 -24.411 -11.685 -10.487 1.00 0.00 C ATOM 875 NE ARG A 55 -25.815 -11.932 -10.134 1.00 0.00 N ATOM 876 CZ ARG A 55 -26.872 -11.408 -10.760 1.00 0.00 C ATOM 877 NH1 ARG A 55 -26.733 -10.600 -11.812 1.00 0.00 N1+ ATOM 878 NH2 ARG A 55 -28.094 -11.705 -10.318 1.00 0.00 N ATOM 0 H ARG A 55 -19.963 -10.681 -10.674 1.00 0.00 H new ATOM 0 HA ARG A 55 -22.556 -10.766 -12.015 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.904 -11.262 -9.508 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -21.965 -9.520 -9.331 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -24.156 -10.410 -8.758 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -24.308 -9.535 -10.269 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -24.320 -11.586 -11.569 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -23.806 -12.543 -10.194 1.00 0.00 H new ATOM 0 HE ARG A 55 -25.998 -12.554 -9.347 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -25.802 -10.368 -12.158 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -27.558 -10.214 -12.271 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -28.210 -12.323 -9.515 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -28.913 -11.314 -10.783 1.00 0.00 H new ATOM 892 N LEU A 56 -20.932 -7.944 -11.605 1.00 0.00 N ATOM 893 CA LEU A 56 -20.913 -6.533 -11.979 1.00 0.00 C ATOM 894 C LEU A 56 -20.559 -6.316 -13.448 1.00 0.00 C ATOM 895 O LEU A 56 -21.182 -5.501 -14.121 1.00 0.00 O ATOM 896 CB LEU A 56 -19.856 -5.825 -11.137 1.00 0.00 C ATOM 897 CG LEU A 56 -20.139 -5.916 -9.640 1.00 0.00 C ATOM 898 CD1 LEU A 56 -18.882 -5.460 -8.908 1.00 0.00 C ATOM 899 CD2 LEU A 56 -21.324 -5.027 -9.267 1.00 0.00 C ATOM 0 H LEU A 56 -20.081 -8.261 -11.140 1.00 0.00 H new ATOM 0 HA LEU A 56 -21.914 -6.137 -11.810 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -18.879 -6.261 -11.345 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -19.806 -4.776 -11.430 1.00 0.00 H new ATOM 0 HG LEU A 56 -20.394 -6.939 -9.361 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -19.048 -5.512 -7.832 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -18.048 -6.108 -9.178 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -18.649 -4.433 -9.190 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -21.513 -5.103 -8.196 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -21.097 -3.992 -9.523 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -22.209 -5.351 -9.815 1.00 0.00 H new ATOM 911 N CYS A 57 -19.554 -7.050 -13.935 1.00 0.00 N ATOM 912 CA CYS A 57 -19.008 -6.874 -15.276 1.00 0.00 C ATOM 913 C CYS A 57 -20.040 -7.144 -16.381 1.00 0.00 C ATOM 914 O CYS A 57 -21.045 -7.811 -16.142 1.00 0.00 O ATOM 915 CB CYS A 57 -17.788 -7.784 -15.431 1.00 0.00 C ATOM 916 SG CYS A 57 -18.330 -9.493 -15.689 1.00 0.00 S ATOM 0 H CYS A 57 -19.095 -7.789 -13.402 1.00 0.00 H new ATOM 0 HA CYS A 57 -18.717 -5.830 -15.392 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -17.181 -7.454 -16.274 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -17.160 -7.722 -14.542 1.00 0.00 H new ATOM 0 HG CYS A 57 -17.306 -10.290 -15.610 1.00 0.00 H new ATOM 922 N PRO A 58 -19.794 -6.626 -17.596 1.00 0.00 N ATOM 923 CA PRO A 58 -20.660 -6.799 -18.747 1.00 0.00 C ATOM 924 C PRO A 58 -20.520 -8.215 -19.304 1.00 0.00 C ATOM 925 O PRO A 58 -19.627 -8.964 -18.905 1.00 0.00 O ATOM 926 CB PRO A 58 -20.201 -5.745 -19.754 1.00 0.00 C ATOM 927 CG PRO A 58 -18.709 -5.626 -19.461 1.00 0.00 C ATOM 928 CD PRO A 58 -18.640 -5.819 -17.948 1.00 0.00 C ATOM 0 HA PRO A 58 -21.715 -6.673 -18.502 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -20.388 -6.058 -20.781 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -20.718 -4.796 -19.611 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -18.132 -6.383 -19.991 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.315 -4.656 -19.763 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.714 -6.316 -17.660 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.662 -4.860 -17.431 1.00 0.00 H new ATOM 936 N ASP A 59 -21.409 -8.576 -20.232 1.00 0.00 N ATOM 937 CA ASP A 59 -21.567 -9.930 -20.745 1.00 0.00 C ATOM 938 C ASP A 59 -20.267 -10.583 -21.203 1.00 0.00 C ATOM 939 O ASP A 59 -20.009 -11.732 -20.846 1.00 0.00 O ATOM 940 CB ASP A 59 -22.548 -9.928 -21.918 1.00 0.00 C ATOM 941 CG ASP A 59 -22.569 -8.612 -22.691 1.00 0.00 C ATOM 942 OD1 ASP A 59 -23.686 -8.203 -23.075 1.00 0.00 O ATOM 943 OD2 ASP A 59 -21.475 -8.036 -22.887 1.00 0.00 O1- ATOM 0 H ASP A 59 -22.056 -7.911 -20.657 1.00 0.00 H new ATOM 0 HA ASP A 59 -21.941 -10.519 -19.907 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -22.288 -10.737 -22.600 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -23.550 -10.137 -21.544 1.00 0.00 H new ATOM 948 N SER A 60 -19.443 -9.882 -21.983 1.00 0.00 N ATOM 949 CA SER A 60 -18.225 -10.503 -22.481 1.00 0.00 C ATOM 950 C SER A 60 -17.270 -10.783 -21.324 1.00 0.00 C ATOM 951 O SER A 60 -16.518 -11.754 -21.360 1.00 0.00 O ATOM 952 CB SER A 60 -17.565 -9.600 -23.526 1.00 0.00 C ATOM 953 OG SER A 60 -16.515 -10.299 -24.159 1.00 0.00 O ATOM 0 H SER A 60 -19.592 -8.916 -22.274 1.00 0.00 H new ATOM 0 HA SER A 60 -18.475 -11.451 -22.956 1.00 0.00 H new ATOM 0 HB2 SER A 60 -18.301 -9.283 -24.264 1.00 0.00 H new ATOM 0 HB3 SER A 60 -17.180 -8.698 -23.051 1.00 0.00 H new ATOM 0 HG SER A 60 -15.857 -10.578 -23.489 1.00 0.00 H new ATOM 959 N HIS A 61 -17.295 -9.935 -20.292 1.00 0.00 N ATOM 960 CA HIS A 61 -16.476 -10.129 -19.107 1.00 0.00 C ATOM 961 C HIS A 61 -17.074 -11.231 -18.234 1.00 0.00 C ATOM 962 O HIS A 61 -16.338 -11.894 -17.506 1.00 0.00 O ATOM 963 CB HIS A 61 -16.358 -8.804 -18.356 1.00 0.00 C ATOM 964 CG HIS A 61 -15.677 -7.709 -19.139 1.00 0.00 C ATOM 965 ND1 HIS A 61 -15.555 -6.387 -18.712 1.00 0.00 N ATOM 966 CD2 HIS A 61 -15.080 -7.841 -20.361 1.00 0.00 C ATOM 967 CE1 HIS A 61 -14.903 -5.750 -19.696 1.00 0.00 C ATOM 968 NE2 HIS A 61 -14.594 -6.597 -20.691 1.00 0.00 N ATOM 0 H HIS A 61 -17.882 -9.101 -20.260 1.00 0.00 H new ATOM 0 HA HIS A 61 -15.473 -10.448 -19.390 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -17.356 -8.468 -18.075 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -15.806 -8.971 -17.431 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -15.005 -8.743 -20.951 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -14.659 -4.698 -19.689 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -14.087 -6.359 -21.544 1.00 0.00 H new ATOM 976 N LYS A 62 -18.399 -11.441 -18.297 1.00 0.00 N ATOM 977 CA LYS A 62 -19.021 -12.554 -17.593 1.00 0.00 C ATOM 978 C LYS A 62 -18.534 -13.862 -18.200 1.00 0.00 C ATOM 979 O LYS A 62 -18.275 -14.820 -17.475 1.00 0.00 O ATOM 980 CB LYS A 62 -20.550 -12.490 -17.682 1.00 0.00 C ATOM 981 CG LYS A 62 -21.111 -11.242 -17.004 1.00 0.00 C ATOM 982 CD LYS A 62 -22.643 -11.260 -16.997 1.00 0.00 C ATOM 983 CE LYS A 62 -23.170 -9.933 -16.453 1.00 0.00 C ATOM 984 NZ LYS A 62 -22.857 -9.765 -15.021 1.00 0.00 N1+ ATOM 0 H LYS A 62 -19.047 -10.857 -18.825 1.00 0.00 H new ATOM 0 HA LYS A 62 -18.741 -12.494 -16.541 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -20.853 -12.501 -18.729 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -20.978 -13.378 -17.217 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -20.740 -11.182 -15.981 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -20.757 -10.352 -17.524 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -23.019 -11.426 -18.007 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -23.004 -12.085 -16.383 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -22.735 -9.110 -17.019 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -24.249 -9.884 -16.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -23.739 -9.766 -14.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -22.250 -10.548 -14.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -22.361 -8.862 -14.878 1.00 0.00 H new ATOM 998 N LEU A 63 -18.405 -13.910 -19.531 1.00 0.00 N ATOM 999 CA LEU A 63 -17.883 -15.079 -20.215 1.00 0.00 C ATOM 1000 C LEU A 63 -16.436 -15.293 -19.764 1.00 0.00 C ATOM 1001 O LEU A 63 -16.008 -16.420 -19.520 1.00 0.00 O ATOM 1002 CB LEU A 63 -17.950 -14.855 -21.730 1.00 0.00 C ATOM 1003 CG LEU A 63 -18.194 -16.160 -22.500 1.00 0.00 C ATOM 1004 CD1 LEU A 63 -17.899 -15.922 -23.978 1.00 0.00 C ATOM 1005 CD2 LEU A 63 -17.308 -17.316 -22.032 1.00 0.00 C ATOM 0 H LEU A 63 -18.660 -13.142 -20.152 1.00 0.00 H new ATOM 0 HA LEU A 63 -18.473 -15.963 -19.973 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -18.748 -14.148 -21.956 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -17.018 -14.404 -22.070 1.00 0.00 H new ATOM 0 HG LEU A 63 -19.232 -16.439 -22.321 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -18.069 -16.843 -24.536 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -18.556 -15.140 -24.359 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -16.861 -15.612 -24.097 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -17.533 -18.207 -22.618 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -16.260 -17.048 -22.166 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -17.499 -17.517 -20.978 1.00 0.00 H new ATOM 1017 N GLY A 64 -15.678 -14.196 -19.653 1.00 0.00 N ATOM 1018 CA GLY A 64 -14.281 -14.244 -19.252 1.00 0.00 C ATOM 1019 C GLY A 64 -14.111 -14.679 -17.800 1.00 0.00 C ATOM 1020 O GLY A 64 -13.112 -15.316 -17.467 1.00 0.00 O ATOM 0 H GLY A 64 -16.022 -13.254 -19.840 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.742 -14.934 -19.901 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -13.832 -13.260 -19.389 1.00 0.00 H new ATOM 1024 N SER A 65 -15.069 -14.351 -16.928 1.00 0.00 N ATOM 1025 CA SER A 65 -14.980 -14.773 -15.540 1.00 0.00 C ATOM 1026 C SER A 65 -15.287 -16.258 -15.412 1.00 0.00 C ATOM 1027 O SER A 65 -14.726 -16.930 -14.548 1.00 0.00 O ATOM 1028 CB SER A 65 -15.931 -13.963 -14.668 1.00 0.00 C ATOM 1029 OG SER A 65 -15.675 -14.286 -13.317 1.00 0.00 O ATOM 0 H SER A 65 -15.898 -13.804 -17.159 1.00 0.00 H new ATOM 0 HA SER A 65 -13.961 -14.596 -15.197 1.00 0.00 H new ATOM 0 HB2 SER A 65 -15.787 -12.896 -14.838 1.00 0.00 H new ATOM 0 HB3 SER A 65 -16.966 -14.189 -14.923 1.00 0.00 H new ATOM 0 HG SER A 65 -16.239 -15.041 -13.049 1.00 0.00 H new ATOM 1035 N LEU A 66 -16.176 -16.778 -16.268 1.00 0.00 N ATOM 1036 CA LEU A 66 -16.476 -18.199 -16.286 1.00 0.00 C ATOM 1037 C LEU A 66 -15.290 -18.959 -16.878 1.00 0.00 C ATOM 1038 O LEU A 66 -15.110 -20.139 -16.587 1.00 0.00 O ATOM 1039 CB LEU A 66 -17.761 -18.434 -17.084 1.00 0.00 C ATOM 1040 CG LEU A 66 -18.975 -17.835 -16.360 1.00 0.00 C ATOM 1041 CD1 LEU A 66 -20.163 -17.756 -17.311 1.00 0.00 C ATOM 1042 CD2 LEU A 66 -19.372 -18.691 -15.160 1.00 0.00 C ATOM 0 H LEU A 66 -16.695 -16.229 -16.953 1.00 0.00 H new ATOM 0 HA LEU A 66 -16.638 -18.569 -15.274 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.666 -17.987 -18.073 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.912 -19.503 -17.231 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.699 -16.838 -16.017 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -21.020 -17.330 -16.789 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.906 -17.125 -18.162 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -20.414 -18.756 -17.664 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -20.234 -18.245 -14.664 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.627 -19.695 -15.498 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.539 -18.745 -14.460 1.00 0.00 H new ATOM 1054 N TYR A 67 -14.479 -18.288 -17.706 1.00 0.00 N ATOM 1055 CA TYR A 67 -13.256 -18.871 -18.237 1.00 0.00 C ATOM 1056 C TYR A 67 -12.196 -18.966 -17.144 1.00 0.00 C ATOM 1057 O TYR A 67 -11.436 -19.932 -17.106 1.00 0.00 O ATOM 1058 CB TYR A 67 -12.750 -18.006 -19.389 1.00 0.00 C ATOM 1059 CG TYR A 67 -12.838 -18.683 -20.735 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -11.715 -18.708 -21.572 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -14.035 -19.285 -21.142 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -11.784 -19.333 -22.824 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -14.106 -19.929 -22.384 1.00 0.00 C ATOM 1064 CZ TYR A 67 -12.981 -19.952 -23.231 1.00 0.00 C ATOM 1065 OH TYR A 67 -13.051 -20.570 -24.444 1.00 0.00 O ATOM 0 H TYR A 67 -14.656 -17.334 -18.020 1.00 0.00 H new ATOM 0 HA TYR A 67 -13.463 -19.878 -18.601 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -13.326 -17.081 -19.418 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.713 -17.730 -19.197 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -10.794 -18.244 -21.251 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.902 -19.253 -20.499 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -10.922 -19.340 -23.475 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -15.024 -20.408 -22.692 1.00 0.00 H new ATOM 0 HH TYR A 67 -13.107 -21.540 -24.314 1.00 0.00 H new ATOM 1075 N ILE A 68 -12.140 -17.971 -16.254 1.00 0.00 N ATOM 1076 CA ILE A 68 -11.239 -18.029 -15.117 1.00 0.00 C ATOM 1077 C ILE A 68 -11.690 -19.146 -14.191 1.00 0.00 C ATOM 1078 O ILE A 68 -10.873 -19.971 -13.796 1.00 0.00 O ATOM 1079 CB ILE A 68 -11.232 -16.680 -14.399 1.00 0.00 C ATOM 1080 CG1 ILE A 68 -10.419 -15.688 -15.231 1.00 0.00 C ATOM 1081 CG2 ILE A 68 -10.625 -16.797 -13.000 1.00 0.00 C ATOM 1082 CD1 ILE A 68 -10.845 -14.255 -14.922 1.00 0.00 C ATOM 0 H ILE A 68 -12.707 -17.124 -16.304 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.221 -18.238 -15.447 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.260 -16.335 -14.288 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.357 -15.811 -15.019 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -10.559 -15.894 -16.292 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -10.635 -15.820 -12.516 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -11.209 -17.501 -12.408 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.598 -17.153 -13.078 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -10.256 -13.563 -15.523 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -11.902 -14.131 -15.157 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -10.682 -14.047 -13.865 1.00 0.00 H new ATOM 1094 N ILE A 69 -12.982 -19.170 -13.850 1.00 0.00 N ATOM 1095 CA ILE A 69 -13.572 -20.230 -13.044 1.00 0.00 C ATOM 1096 C ILE A 69 -13.303 -21.606 -13.639 1.00 0.00 C ATOM 1097 O ILE A 69 -13.131 -22.560 -12.889 1.00 0.00 O ATOM 1098 CB ILE A 69 -15.079 -19.981 -12.938 1.00 0.00 C ATOM 1099 CG1 ILE A 69 -15.293 -18.774 -12.026 1.00 0.00 C ATOM 1100 CG2 ILE A 69 -15.817 -21.198 -12.370 1.00 0.00 C ATOM 1101 CD1 ILE A 69 -16.709 -18.220 -12.157 1.00 0.00 C ATOM 0 H ILE A 69 -13.647 -18.449 -14.129 1.00 0.00 H new ATOM 0 HA ILE A 69 -13.116 -20.215 -12.054 1.00 0.00 H new ATOM 0 HB ILE A 69 -15.481 -19.796 -13.934 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -15.107 -19.061 -10.991 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -14.572 -17.996 -12.275 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -16.884 -20.982 -12.310 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -15.657 -22.057 -13.021 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -15.436 -21.422 -11.374 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -16.827 -17.362 -11.495 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -16.884 -17.910 -13.187 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -17.428 -18.992 -11.883 1.00 0.00 H new ATOM 1113 N ASP A 70 -13.263 -21.743 -14.965 1.00 0.00 N ATOM 1114 CA ASP A 70 -12.933 -23.033 -15.545 1.00 0.00 C ATOM 1115 C ASP A 70 -11.475 -23.389 -15.271 1.00 0.00 C ATOM 1116 O ASP A 70 -11.170 -24.520 -14.900 1.00 0.00 O ATOM 1117 CB ASP A 70 -13.169 -23.006 -17.057 1.00 0.00 C ATOM 1118 CG ASP A 70 -12.744 -24.329 -17.681 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -11.828 -24.315 -18.532 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -13.348 -25.351 -17.291 1.00 0.00 O1- ATOM 0 H ASP A 70 -13.450 -20.998 -15.636 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.575 -23.785 -15.087 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.223 -22.820 -17.264 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.606 -22.187 -17.505 1.00 0.00 H new ATOM 1125 N SER A 71 -10.581 -22.412 -15.458 1.00 0.00 N ATOM 1126 CA SER A 71 -9.153 -22.620 -15.303 1.00 0.00 C ATOM 1127 C SER A 71 -8.798 -22.895 -13.847 1.00 0.00 C ATOM 1128 O SER A 71 -8.214 -23.931 -13.537 1.00 0.00 O ATOM 1129 CB SER A 71 -8.429 -21.388 -15.851 1.00 0.00 C ATOM 1130 OG SER A 71 -7.039 -21.464 -15.635 1.00 0.00 O ATOM 0 H SER A 71 -10.835 -21.460 -15.720 1.00 0.00 H new ATOM 0 HA SER A 71 -8.835 -23.499 -15.864 1.00 0.00 H new ATOM 0 HB2 SER A 71 -8.627 -21.294 -16.919 1.00 0.00 H new ATOM 0 HB3 SER A 71 -8.823 -20.491 -15.373 1.00 0.00 H new ATOM 0 HG SER A 71 -6.780 -20.820 -14.943 1.00 0.00 H new ATOM 1136 N ILE A 72 -9.151 -21.971 -12.950 1.00 0.00 N ATOM 1137 CA ILE A 72 -8.817 -22.099 -11.537 1.00 0.00 C ATOM 1138 C ILE A 72 -9.715 -23.132 -10.869 1.00 0.00 C ATOM 1139 O ILE A 72 -9.297 -23.794 -9.923 1.00 0.00 O ATOM 1140 CB ILE A 72 -8.920 -20.705 -10.891 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -8.075 -20.575 -9.620 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -10.366 -20.287 -10.615 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -8.792 -20.989 -8.334 1.00 0.00 C ATOM 0 H ILE A 72 -9.670 -21.124 -13.183 1.00 0.00 H new ATOM 0 HA ILE A 72 -7.797 -22.462 -11.409 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.511 -20.018 -11.632 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.178 -21.183 -9.732 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -7.748 -19.540 -9.521 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -10.378 -19.297 -10.160 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -10.923 -20.262 -11.552 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -10.829 -21.004 -9.937 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -8.119 -20.864 -7.486 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -9.674 -20.365 -8.192 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -9.095 -22.034 -8.406 1.00 0.00 H new ATOM 1155 N GLY A 73 -10.950 -23.277 -11.357 1.00 0.00 N ATOM 1156 CA GLY A 73 -11.919 -24.165 -10.743 1.00 0.00 C ATOM 1157 C GLY A 73 -11.526 -25.623 -10.911 1.00 0.00 C ATOM 1158 O GLY A 73 -11.437 -26.353 -9.924 1.00 0.00 O ATOM 0 H GLY A 73 -11.296 -22.784 -12.180 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.007 -23.931 -9.682 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.900 -23.998 -11.188 1.00 0.00 H new ATOM 1162 N ARG A 74 -11.290 -26.055 -12.155 1.00 0.00 N ATOM 1163 CA ARG A 74 -10.895 -27.433 -12.389 1.00 0.00 C ATOM 1164 C ARG A 74 -9.489 -27.660 -11.862 1.00 0.00 C ATOM 1165 O ARG A 74 -9.217 -28.730 -11.329 1.00 0.00 O ATOM 1166 CB ARG A 74 -10.982 -27.784 -13.872 1.00 0.00 C ATOM 1167 CG ARG A 74 -12.447 -27.941 -14.276 1.00 0.00 C ATOM 1168 CD ARG A 74 -12.560 -28.583 -15.655 1.00 0.00 C ATOM 1169 NE ARG A 74 -12.139 -27.659 -16.713 1.00 0.00 N ATOM 1170 CZ ARG A 74 -11.130 -27.866 -17.567 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -10.425 -29.000 -17.547 1.00 0.00 N1+ ATOM 1172 NH2 ARG A 74 -10.823 -26.922 -18.455 1.00 0.00 N ATOM 0 H ARG A 74 -11.365 -25.479 -12.993 1.00 0.00 H new ATOM 0 HA ARG A 74 -11.583 -28.089 -11.855 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -10.511 -27.003 -14.469 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.439 -28.708 -14.070 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -12.969 -28.553 -13.540 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.934 -26.966 -14.282 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.946 -29.483 -15.690 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -13.590 -28.893 -15.830 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.658 -26.786 -16.806 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -10.652 -29.730 -16.871 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.660 -29.137 -18.207 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -11.355 -26.052 -18.479 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.056 -27.069 -19.111 1.00 0.00 H new ATOM 1186 N ALA A 75 -8.596 -26.678 -12.001 1.00 0.00 N ATOM 1187 CA ALA A 75 -7.244 -26.843 -11.504 1.00 0.00 C ATOM 1188 C ALA A 75 -7.259 -27.085 -9.997 1.00 0.00 C ATOM 1189 O ALA A 75 -6.453 -27.867 -9.499 1.00 0.00 O ATOM 1190 CB ALA A 75 -6.433 -25.594 -11.837 1.00 0.00 C ATOM 0 H ALA A 75 -8.786 -25.780 -12.446 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.784 -27.709 -11.981 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.415 -25.712 -11.466 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.411 -25.452 -12.917 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.893 -24.725 -11.366 1.00 0.00 H new ATOM 1196 N TYR A 76 -8.161 -26.426 -9.263 1.00 0.00 N ATOM 1197 CA TYR A 76 -8.256 -26.622 -7.828 1.00 0.00 C ATOM 1198 C TYR A 76 -8.759 -28.018 -7.500 1.00 0.00 C ATOM 1199 O TYR A 76 -8.113 -28.738 -6.742 1.00 0.00 O ATOM 1200 CB TYR A 76 -9.200 -25.587 -7.216 1.00 0.00 C ATOM 1201 CG TYR A 76 -8.506 -24.359 -6.674 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -9.133 -23.595 -5.678 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -7.244 -23.987 -7.155 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -8.476 -22.490 -5.120 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -6.579 -22.894 -6.595 1.00 0.00 C ATOM 1206 CZ TYR A 76 -7.179 -22.152 -5.556 1.00 0.00 C ATOM 1207 OH TYR A 76 -6.513 -21.116 -4.975 1.00 0.00 O ATOM 0 H TYR A 76 -8.830 -25.757 -9.644 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.258 -26.502 -7.407 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -9.922 -25.278 -7.972 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -9.764 -26.057 -6.410 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -10.124 -23.859 -5.341 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.786 -24.545 -7.958 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -8.962 -21.899 -4.358 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -5.601 -22.616 -6.959 1.00 0.00 H new ATOM 0 HH TYR A 76 -5.550 -21.222 -5.123 1.00 0.00 H new ATOM 1217 N LEU A 77 -9.905 -28.423 -8.053 1.00 0.00 N ATOM 1218 CA LEU A 77 -10.454 -29.705 -7.662 1.00 0.00 C ATOM 1219 C LEU A 77 -9.539 -30.814 -8.173 1.00 0.00 C ATOM 1220 O LEU A 77 -9.276 -31.768 -7.450 1.00 0.00 O ATOM 1221 CB LEU A 77 -11.887 -29.829 -8.187 1.00 0.00 C ATOM 1222 CG LEU A 77 -12.783 -30.637 -7.236 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -14.231 -30.581 -7.712 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -12.362 -32.103 -7.152 1.00 0.00 C ATOM 0 H LEU A 77 -10.445 -27.901 -8.743 1.00 0.00 H new ATOM 0 HA LEU A 77 -10.503 -29.794 -6.577 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -12.310 -28.834 -8.324 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -11.874 -30.308 -9.166 1.00 0.00 H new ATOM 0 HG LEU A 77 -12.681 -30.189 -6.248 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -14.860 -31.156 -7.033 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -14.569 -29.545 -7.729 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -14.301 -31.002 -8.715 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -13.025 -32.633 -6.468 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.423 -32.556 -8.141 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.337 -32.167 -6.787 1.00 0.00 H new ATOM 1236 N ASP A 78 -9.043 -30.706 -9.409 1.00 0.00 N ATOM 1237 CA ASP A 78 -8.147 -31.714 -9.959 1.00 0.00 C ATOM 1238 C ASP A 78 -6.843 -31.849 -9.168 1.00 0.00 C ATOM 1239 O ASP A 78 -6.469 -32.969 -8.828 1.00 0.00 O ATOM 1240 CB ASP A 78 -7.793 -31.380 -11.415 1.00 0.00 C ATOM 1241 CG ASP A 78 -8.992 -31.417 -12.360 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -10.055 -31.912 -11.932 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -8.829 -30.945 -13.507 1.00 0.00 O1- ATOM 0 H ASP A 78 -9.249 -29.932 -10.041 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.685 -32.660 -9.897 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.342 -30.388 -11.452 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.041 -32.085 -11.768 1.00 0.00 H new ATOM 1248 N GLU A 79 -6.139 -30.750 -8.866 1.00 0.00 N ATOM 1249 CA GLU A 79 -4.876 -30.863 -8.146 1.00 0.00 C ATOM 1250 C GLU A 79 -5.081 -31.375 -6.728 1.00 0.00 C ATOM 1251 O GLU A 79 -4.322 -32.226 -6.264 1.00 0.00 O ATOM 1252 CB GLU A 79 -4.176 -29.506 -8.095 1.00 0.00 C ATOM 1253 CG GLU A 79 -3.526 -29.184 -9.445 1.00 0.00 C ATOM 1254 CD GLU A 79 -2.443 -30.196 -9.803 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -2.210 -30.383 -11.017 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -1.862 -30.771 -8.855 1.00 0.00 O1- ATOM 0 H GLU A 79 -6.418 -29.798 -9.104 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.257 -31.581 -8.684 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.896 -28.729 -7.837 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.418 -29.511 -7.312 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -4.289 -29.176 -10.224 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -3.094 -28.184 -9.412 1.00 0.00 H new ATOM 1263 N THR A 80 -6.098 -30.871 -6.026 1.00 0.00 N ATOM 1264 CA THR A 80 -6.374 -31.344 -4.683 1.00 0.00 C ATOM 1265 C THR A 80 -6.792 -32.811 -4.729 1.00 0.00 C ATOM 1266 O THR A 80 -6.462 -33.568 -3.822 1.00 0.00 O ATOM 1267 CB THR A 80 -7.496 -30.513 -4.074 1.00 0.00 C ATOM 1268 OG1 THR A 80 -8.605 -30.551 -4.940 1.00 0.00 O ATOM 1269 CG2 THR A 80 -7.095 -29.061 -3.830 1.00 0.00 C ATOM 0 H THR A 80 -6.731 -30.147 -6.365 1.00 0.00 H new ATOM 0 HA THR A 80 -5.476 -31.246 -4.074 1.00 0.00 H new ATOM 0 HB THR A 80 -7.736 -30.944 -3.102 1.00 0.00 H new ATOM 0 HG1 THR A 80 -8.648 -29.717 -5.454 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.935 -28.520 -3.395 1.00 0.00 H new ATOM 0 HG22 THR A 80 -6.248 -29.028 -3.145 1.00 0.00 H new ATOM 0 HG23 THR A 80 -6.815 -28.597 -4.776 1.00 0.00 H new ATOM 1277 N ARG A 81 -7.516 -33.214 -5.777 1.00 0.00 N ATOM 1278 CA ARG A 81 -7.970 -34.579 -5.962 1.00 0.00 C ATOM 1279 C ARG A 81 -6.812 -35.525 -6.263 1.00 0.00 C ATOM 1280 O ARG A 81 -6.768 -36.623 -5.711 1.00 0.00 O ATOM 1281 CB ARG A 81 -8.981 -34.537 -7.102 1.00 0.00 C ATOM 1282 CG ARG A 81 -9.442 -35.899 -7.592 1.00 0.00 C ATOM 1283 CD ARG A 81 -10.797 -35.695 -8.258 1.00 0.00 C ATOM 1284 NE ARG A 81 -10.767 -34.772 -9.399 1.00 0.00 N ATOM 1285 CZ ARG A 81 -11.876 -34.441 -10.074 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -13.052 -34.997 -9.778 1.00 0.00 N1+ ATOM 1287 NH2 ARG A 81 -11.835 -33.552 -11.060 1.00 0.00 N ATOM 0 H ARG A 81 -7.803 -32.585 -6.527 1.00 0.00 H new ATOM 0 HA ARG A 81 -8.426 -34.967 -5.051 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.852 -33.969 -6.776 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.542 -33.994 -7.939 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -8.725 -36.319 -8.297 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -9.522 -36.601 -6.762 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -11.174 -36.661 -8.594 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -11.502 -35.318 -7.517 1.00 0.00 H new ATOM 0 HE ARG A 81 -9.875 -34.370 -9.687 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -13.116 -35.685 -9.028 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -13.887 -34.734 -10.302 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -10.951 -33.111 -11.313 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -12.688 -33.310 -11.565 1.00 0.00 H new ATOM 1301 N SER A 82 -5.887 -35.106 -7.127 1.00 0.00 N ATOM 1302 CA SER A 82 -4.779 -35.949 -7.546 1.00 0.00 C ATOM 1303 C SER A 82 -3.602 -35.935 -6.577 1.00 0.00 C ATOM 1304 O SER A 82 -2.957 -36.967 -6.403 1.00 0.00 O ATOM 1305 CB SER A 82 -4.299 -35.482 -8.922 1.00 0.00 C ATOM 1306 OG SER A 82 -3.185 -36.244 -9.341 1.00 0.00 O ATOM 0 H SER A 82 -5.889 -34.178 -7.551 1.00 0.00 H new ATOM 0 HA SER A 82 -5.150 -36.974 -7.574 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.107 -35.578 -9.648 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.031 -34.426 -8.881 1.00 0.00 H new ATOM 0 HG SER A 82 -2.890 -35.935 -10.223 1.00 0.00 H new ATOM 1420 N PRO A 91 -11.369 -23.603 4.708 1.00 0.00 N ATOM 1421 CA PRO A 91 -10.834 -22.524 3.901 1.00 0.00 C ATOM 1422 C PRO A 91 -9.379 -22.811 3.559 1.00 0.00 C ATOM 1423 O PRO A 91 -8.652 -23.378 4.372 1.00 0.00 O ATOM 1424 CB PRO A 91 -10.986 -21.259 4.745 1.00 0.00 C ATOM 1425 CG PRO A 91 -12.166 -21.595 5.658 1.00 0.00 C ATOM 1426 CD PRO A 91 -11.972 -23.085 5.923 1.00 0.00 C ATOM 0 HA PRO A 91 -11.357 -22.411 2.952 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -10.083 -21.043 5.316 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -11.190 -20.384 4.128 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -12.143 -21.014 6.580 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -13.122 -21.391 5.176 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -11.328 -23.253 6.786 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -12.922 -23.576 6.134 1.00 0.00 H new ATOM 1434 N GLY A 92 -8.954 -22.418 2.358 1.00 0.00 N ATOM 1435 CA GLY A 92 -7.597 -22.677 1.920 1.00 0.00 C ATOM 1436 C GLY A 92 -7.475 -23.983 1.137 1.00 0.00 C ATOM 1437 O GLY A 92 -6.377 -24.517 1.032 1.00 0.00 O ATOM 0 H GLY A 92 -9.532 -21.922 1.680 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -7.256 -21.850 1.297 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.939 -22.715 2.788 1.00 0.00 H new ATOM 1441 N THR A 93 -8.584 -24.498 0.593 1.00 0.00 N ATOM 1442 CA THR A 93 -8.582 -25.691 -0.243 1.00 0.00 C ATOM 1443 C THR A 93 -9.736 -25.642 -1.234 1.00 0.00 C ATOM 1444 O THR A 93 -10.641 -24.818 -1.114 1.00 0.00 O ATOM 1445 CB THR A 93 -8.725 -26.969 0.587 1.00 0.00 C ATOM 1446 OG1 THR A 93 -9.896 -26.923 1.372 1.00 0.00 O ATOM 1447 CG2 THR A 93 -7.496 -27.240 1.445 1.00 0.00 C ATOM 0 H THR A 93 -9.510 -24.092 0.725 1.00 0.00 H new ATOM 0 HA THR A 93 -7.625 -25.709 -0.765 1.00 0.00 H new ATOM 0 HB THR A 93 -8.810 -27.802 -0.111 1.00 0.00 H new ATOM 0 HG1 THR A 93 -9.972 -27.749 1.895 1.00 0.00 H new ATOM 0 HG21 THR A 93 -7.645 -28.157 2.015 1.00 0.00 H new ATOM 0 HG22 THR A 93 -6.622 -27.350 0.804 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.340 -26.407 2.131 1.00 0.00 H new ATOM 1455 N CYS A 94 -9.691 -26.546 -2.220 1.00 0.00 N ATOM 1456 CA CYS A 94 -10.745 -26.706 -3.201 1.00 0.00 C ATOM 1457 C CYS A 94 -12.054 -27.054 -2.500 1.00 0.00 C ATOM 1458 O CYS A 94 -13.125 -26.799 -3.037 1.00 0.00 O ATOM 1459 CB CYS A 94 -10.360 -27.857 -4.127 1.00 0.00 C ATOM 1460 SG CYS A 94 -10.536 -29.414 -3.207 1.00 0.00 S ATOM 0 H CYS A 94 -8.910 -27.188 -2.351 1.00 0.00 H new ATOM 0 HA CYS A 94 -10.874 -25.781 -3.763 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -10.999 -27.864 -5.010 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -9.335 -27.736 -4.476 1.00 0.00 H new ATOM 0 HG CYS A 94 -9.933 -30.369 -3.851 1.00 0.00 H new ATOM 1466 N ALA A 95 -11.965 -27.638 -1.302 1.00 0.00 N ATOM 1467 CA ALA A 95 -13.139 -28.131 -0.617 1.00 0.00 C ATOM 1468 C ALA A 95 -14.064 -26.967 -0.300 1.00 0.00 C ATOM 1469 O ALA A 95 -15.221 -26.963 -0.714 1.00 0.00 O ATOM 1470 CB ALA A 95 -12.696 -28.872 0.638 1.00 0.00 C ATOM 0 H ALA A 95 -11.090 -27.776 -0.796 1.00 0.00 H new ATOM 0 HA ALA A 95 -13.694 -28.828 -1.245 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.572 -29.250 1.166 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.052 -29.706 0.360 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.147 -28.191 1.288 1.00 0.00 H new ATOM 1476 N HIS A 96 -13.550 -25.980 0.437 1.00 0.00 N ATOM 1477 CA HIS A 96 -14.344 -24.827 0.809 1.00 0.00 C ATOM 1478 C HIS A 96 -14.530 -23.895 -0.384 1.00 0.00 C ATOM 1479 O HIS A 96 -15.539 -23.201 -0.471 1.00 0.00 O ATOM 1480 CB HIS A 96 -13.643 -24.107 1.954 1.00 0.00 C ATOM 1481 CG HIS A 96 -14.475 -22.989 2.520 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -15.497 -23.141 3.461 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -14.353 -21.669 2.195 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -15.963 -21.899 3.678 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -15.295 -20.999 2.935 1.00 0.00 N ATOM 0 H HIS A 96 -12.590 -25.964 0.783 1.00 0.00 H new ATOM 0 HA HIS A 96 -15.335 -25.149 1.130 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -13.414 -24.822 2.744 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -12.693 -23.707 1.601 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -13.654 -21.237 1.494 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -16.766 -21.656 4.358 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -15.460 -19.992 2.923 1.00 0.00 H new ATOM 1493 N ALA A 97 -13.561 -23.879 -1.304 1.00 0.00 N ATOM 1494 CA ALA A 97 -13.621 -23.018 -2.472 1.00 0.00 C ATOM 1495 C ALA A 97 -14.741 -23.435 -3.422 1.00 0.00 C ATOM 1496 O ALA A 97 -15.586 -22.613 -3.771 1.00 0.00 O ATOM 1497 CB ALA A 97 -12.274 -23.056 -3.190 1.00 0.00 C ATOM 0 H ALA A 97 -12.724 -24.459 -1.255 1.00 0.00 H new ATOM 0 HA ALA A 97 -13.838 -22.002 -2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -12.312 -22.412 -4.068 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -11.492 -22.705 -2.516 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -12.055 -24.078 -3.499 1.00 0.00 H new ATOM 1503 N ILE A 98 -14.761 -24.705 -3.851 1.00 0.00 N ATOM 1504 CA ILE A 98 -15.795 -25.167 -4.765 1.00 0.00 C ATOM 1505 C ILE A 98 -17.144 -25.231 -4.057 1.00 0.00 C ATOM 1506 O ILE A 98 -18.174 -25.020 -4.692 1.00 0.00 O ATOM 1507 CB ILE A 98 -15.405 -26.519 -5.389 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -14.350 -26.346 -6.492 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -16.625 -27.185 -6.032 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -12.926 -26.289 -5.945 1.00 0.00 C ATOM 0 H ILE A 98 -14.081 -25.415 -3.580 1.00 0.00 H new ATOM 0 HA ILE A 98 -15.889 -24.451 -5.581 1.00 0.00 H new ATOM 0 HB ILE A 98 -15.005 -27.132 -4.581 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -14.430 -27.173 -7.198 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -14.558 -25.431 -7.047 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -16.331 -28.140 -6.468 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -17.390 -27.353 -5.274 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -17.024 -26.537 -6.813 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.224 -26.166 -6.770 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -12.833 -25.446 -5.260 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -12.703 -27.214 -5.414 1.00 0.00 H new ATOM 1522 N ASN A 99 -17.165 -25.514 -2.753 1.00 0.00 N ATOM 1523 CA ASN A 99 -18.415 -25.514 -2.015 1.00 0.00 C ATOM 1524 C ASN A 99 -18.983 -24.104 -1.883 1.00 0.00 C ATOM 1525 O ASN A 99 -20.193 -23.925 -1.962 1.00 0.00 O ATOM 1526 CB ASN A 99 -18.173 -26.114 -0.636 1.00 0.00 C ATOM 1527 CG ASN A 99 -18.161 -27.638 -0.682 1.00 0.00 C ATOM 1528 OD1 ASN A 99 -18.623 -28.246 -1.643 1.00 0.00 O ATOM 1529 ND2 ASN A 99 -17.633 -28.273 0.361 1.00 0.00 N ATOM 0 H ASN A 99 -16.340 -25.742 -2.199 1.00 0.00 H new ATOM 0 HA ASN A 99 -19.145 -26.112 -2.560 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -17.222 -25.754 -0.243 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -18.950 -25.776 0.050 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -17.604 -29.292 0.376 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -17.257 -27.740 1.145 1.00 0.00 H new ATOM 1536 N THR A 100 -18.126 -23.099 -1.679 1.00 0.00 N ATOM 1537 CA THR A 100 -18.593 -21.728 -1.546 1.00 0.00 C ATOM 1538 C THR A 100 -19.035 -21.183 -2.902 1.00 0.00 C ATOM 1539 O THR A 100 -20.007 -20.432 -2.977 1.00 0.00 O ATOM 1540 CB THR A 100 -17.468 -20.872 -0.960 1.00 0.00 C ATOM 1541 OG1 THR A 100 -17.163 -21.310 0.343 1.00 0.00 O ATOM 1542 CG2 THR A 100 -17.868 -19.398 -0.902 1.00 0.00 C ATOM 0 H THR A 100 -17.115 -23.213 -1.604 1.00 0.00 H new ATOM 0 HA THR A 100 -19.453 -21.699 -0.877 1.00 0.00 H new ATOM 0 HB THR A 100 -16.597 -20.977 -1.608 1.00 0.00 H new ATOM 0 HG1 THR A 100 -16.325 -21.819 0.329 1.00 0.00 H new ATOM 0 HG21 THR A 100 -17.049 -18.815 -0.481 1.00 0.00 H new ATOM 0 HG22 THR A 100 -18.088 -19.041 -1.908 1.00 0.00 H new ATOM 0 HG23 THR A 100 -18.753 -19.285 -0.275 1.00 0.00 H new ATOM 1550 N LEU A 101 -18.326 -21.557 -3.971 1.00 0.00 N ATOM 1551 CA LEU A 101 -18.677 -21.108 -5.306 1.00 0.00 C ATOM 1552 C LEU A 101 -19.910 -21.844 -5.827 1.00 0.00 C ATOM 1553 O LEU A 101 -20.687 -21.273 -6.588 1.00 0.00 O ATOM 1554 CB LEU A 101 -17.476 -21.339 -6.227 1.00 0.00 C ATOM 1555 CG LEU A 101 -17.749 -20.926 -7.679 1.00 0.00 C ATOM 1556 CD1 LEU A 101 -18.112 -19.446 -7.790 1.00 0.00 C ATOM 1557 CD2 LEU A 101 -16.504 -21.195 -8.523 1.00 0.00 C ATOM 0 H LEU A 101 -17.510 -22.167 -3.930 1.00 0.00 H new ATOM 0 HA LEU A 101 -18.924 -20.047 -5.280 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -16.622 -20.777 -5.849 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -17.201 -22.393 -6.200 1.00 0.00 H new ATOM 0 HG LEU A 101 -18.595 -21.512 -8.039 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -18.298 -19.194 -8.834 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -19.009 -19.246 -7.204 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -17.289 -18.840 -7.412 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -16.694 -20.903 -9.556 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -15.667 -20.618 -8.131 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -16.261 -22.257 -8.485 1.00 0.00 H new ATOM 1569 N GLY A 102 -20.098 -23.105 -5.428 1.00 0.00 N ATOM 1570 CA GLY A 102 -21.192 -23.920 -5.931 1.00 0.00 C ATOM 1571 C GLY A 102 -22.559 -23.352 -5.563 1.00 0.00 C ATOM 1572 O GLY A 102 -23.549 -23.682 -6.213 1.00 0.00 O ATOM 0 H GLY A 102 -19.499 -23.580 -4.753 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -21.114 -23.998 -7.015 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -21.102 -24.930 -5.532 1.00 0.00 H new ATOM 1576 N GLU A 103 -22.634 -22.504 -4.535 1.00 0.00 N ATOM 1577 CA GLU A 103 -23.883 -21.871 -4.137 1.00 0.00 C ATOM 1578 C GLU A 103 -24.139 -20.595 -4.932 1.00 0.00 C ATOM 1579 O GLU A 103 -25.288 -20.253 -5.210 1.00 0.00 O ATOM 1580 CB GLU A 103 -23.787 -21.513 -2.658 1.00 0.00 C ATOM 1581 CG GLU A 103 -23.354 -22.702 -1.806 1.00 0.00 C ATOM 1582 CD GLU A 103 -24.498 -23.678 -1.527 1.00 0.00 C ATOM 1583 OE1 GLU A 103 -25.267 -23.956 -2.473 1.00 0.00 O ATOM 1584 OE2 GLU A 103 -24.588 -24.132 -0.368 1.00 0.00 O1- ATOM 0 H GLU A 103 -21.833 -22.241 -3.961 1.00 0.00 H new ATOM 0 HA GLU A 103 -24.703 -22.564 -4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.076 -20.697 -2.529 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -24.754 -21.151 -2.310 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.546 -23.231 -2.312 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.953 -22.339 -0.860 1.00 0.00 H new ATOM 1591 N VAL A 104 -23.062 -19.895 -5.294 1.00 0.00 N ATOM 1592 CA VAL A 104 -23.147 -18.609 -5.970 1.00 0.00 C ATOM 1593 C VAL A 104 -23.026 -18.732 -7.491 1.00 0.00 C ATOM 1594 O VAL A 104 -23.425 -17.818 -8.209 1.00 0.00 O ATOM 1595 CB VAL A 104 -22.072 -17.675 -5.395 1.00 0.00 C ATOM 1596 CG1 VAL A 104 -22.175 -16.275 -5.998 1.00 0.00 C ATOM 1597 CG2 VAL A 104 -22.228 -17.544 -3.880 1.00 0.00 C ATOM 0 H VAL A 104 -22.107 -20.209 -5.124 1.00 0.00 H new ATOM 0 HA VAL A 104 -24.136 -18.189 -5.787 1.00 0.00 H new ATOM 0 HB VAL A 104 -21.105 -18.113 -5.642 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -21.401 -15.637 -5.571 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -22.042 -16.333 -7.078 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -23.156 -15.854 -5.775 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -21.457 -16.878 -3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -23.211 -17.134 -3.650 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -22.127 -18.526 -3.418 1.00 0.00 H new ATOM 1607 N ILE A 105 -22.483 -19.841 -8.002 1.00 0.00 N ATOM 1608 CA ILE A 105 -22.267 -20.024 -9.433 1.00 0.00 C ATOM 1609 C ILE A 105 -23.570 -19.893 -10.226 1.00 0.00 C ATOM 1610 O ILE A 105 -23.538 -19.561 -11.409 1.00 0.00 O ATOM 1611 CB ILE A 105 -21.606 -21.392 -9.657 1.00 0.00 C ATOM 1612 CG1 ILE A 105 -21.163 -21.600 -11.106 1.00 0.00 C ATOM 1613 CG2 ILE A 105 -22.566 -22.524 -9.283 1.00 0.00 C ATOM 1614 CD1 ILE A 105 -20.059 -20.611 -11.490 1.00 0.00 C ATOM 0 H ILE A 105 -22.183 -20.633 -7.434 1.00 0.00 H new ATOM 0 HA ILE A 105 -21.608 -19.237 -9.800 1.00 0.00 H new ATOM 0 HB ILE A 105 -20.724 -21.409 -9.017 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -20.803 -22.621 -11.237 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -22.016 -21.475 -11.772 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -22.078 -23.485 -9.449 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -22.843 -22.434 -8.233 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -23.462 -22.460 -9.901 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -19.762 -20.781 -12.525 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -20.430 -19.592 -11.381 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -19.198 -20.756 -10.838 1.00 0.00 H new ATOM 1626 N GLN A 106 -24.717 -20.147 -9.591 1.00 0.00 N ATOM 1627 CA GLN A 106 -25.998 -20.015 -10.261 1.00 0.00 C ATOM 1628 C GLN A 106 -26.287 -18.545 -10.570 1.00 0.00 C ATOM 1629 O GLN A 106 -27.036 -18.261 -11.501 1.00 0.00 O ATOM 1630 CB GLN A 106 -27.095 -20.634 -9.391 1.00 0.00 C ATOM 1631 CG GLN A 106 -27.152 -19.993 -8.003 1.00 0.00 C ATOM 1632 CD GLN A 106 -28.199 -20.662 -7.118 1.00 0.00 C ATOM 1633 OE1 GLN A 106 -29.195 -21.190 -7.606 1.00 0.00 O ATOM 1634 NE2 GLN A 106 -27.974 -20.643 -5.805 1.00 0.00 N ATOM 0 H GLN A 106 -24.777 -20.444 -8.617 1.00 0.00 H new ATOM 0 HA GLN A 106 -25.972 -20.549 -11.211 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -28.060 -20.517 -9.885 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -26.917 -21.705 -9.289 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -26.174 -20.065 -7.528 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -27.382 -18.932 -8.101 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -27.135 -20.194 -5.438 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -28.641 -21.077 -5.167 1.00 0.00 H new ATOM 1643 N GLU A 107 -25.707 -17.611 -9.807 1.00 0.00 N ATOM 1644 CA GLU A 107 -25.867 -16.189 -10.078 1.00 0.00 C ATOM 1645 C GLU A 107 -25.008 -15.788 -11.273 1.00 0.00 C ATOM 1646 O GLU A 107 -25.435 -14.998 -12.113 1.00 0.00 O ATOM 1647 CB GLU A 107 -25.453 -15.376 -8.851 1.00 0.00 C ATOM 1648 CG GLU A 107 -26.498 -15.522 -7.746 1.00 0.00 C ATOM 1649 CD GLU A 107 -27.788 -14.780 -8.089 1.00 0.00 C ATOM 1650 OE1 GLU A 107 -27.672 -13.640 -8.594 1.00 0.00 O ATOM 1651 OE2 GLU A 107 -28.866 -15.361 -7.844 1.00 0.00 O1- ATOM 0 H GLU A 107 -25.123 -17.821 -8.997 1.00 0.00 H new ATOM 0 HA GLU A 107 -26.914 -15.987 -10.306 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -24.482 -15.716 -8.491 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -25.343 -14.326 -9.121 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -26.716 -16.578 -7.588 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -26.094 -15.137 -6.810 1.00 0.00 H new ATOM 1658 N LEU A 108 -23.790 -16.337 -11.353 1.00 0.00 N ATOM 1659 CA LEU A 108 -22.870 -16.010 -12.427 1.00 0.00 C ATOM 1660 C LEU A 108 -23.371 -16.608 -13.734 1.00 0.00 C ATOM 1661 O LEU A 108 -23.301 -15.960 -14.776 1.00 0.00 O ATOM 1662 CB LEU A 108 -21.476 -16.566 -12.116 1.00 0.00 C ATOM 1663 CG LEU A 108 -20.725 -15.770 -11.045 1.00 0.00 C ATOM 1664 CD1 LEU A 108 -21.313 -15.940 -9.647 1.00 0.00 C ATOM 1665 CD2 LEU A 108 -19.280 -16.260 -11.026 1.00 0.00 C ATOM 0 H LEU A 108 -23.426 -17.011 -10.680 1.00 0.00 H new ATOM 0 HA LEU A 108 -22.811 -14.926 -12.520 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -21.571 -17.601 -11.788 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -20.885 -16.575 -13.032 1.00 0.00 H new ATOM 0 HG LEU A 108 -20.804 -14.713 -11.299 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -20.735 -15.350 -8.935 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.349 -15.600 -9.644 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -21.276 -16.991 -9.362 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -18.719 -15.710 -10.271 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -19.260 -17.324 -10.790 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -18.828 -16.097 -12.004 1.00 0.00 H new ATOM 1677 N LEU A 109 -23.878 -17.845 -13.681 1.00 0.00 N ATOM 1678 CA LEU A 109 -24.413 -18.492 -14.866 1.00 0.00 C ATOM 1679 C LEU A 109 -25.684 -17.785 -15.325 1.00 0.00 C ATOM 1680 O LEU A 109 -25.716 -17.268 -16.435 1.00 0.00 O ATOM 1681 CB LEU A 109 -24.672 -19.973 -14.587 1.00 0.00 C ATOM 1682 CG LEU A 109 -23.370 -20.766 -14.427 1.00 0.00 C ATOM 1683 CD1 LEU A 109 -23.699 -22.185 -13.974 1.00 0.00 C ATOM 1684 CD2 LEU A 109 -22.600 -20.848 -15.744 1.00 0.00 C ATOM 0 H LEU A 109 -23.925 -18.408 -12.832 1.00 0.00 H new ATOM 0 HA LEU A 109 -23.681 -18.423 -15.671 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -25.270 -20.072 -13.681 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -25.257 -20.398 -15.403 1.00 0.00 H new ATOM 0 HG LEU A 109 -22.752 -20.252 -13.690 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -22.776 -22.753 -13.859 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -24.225 -22.150 -13.020 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -24.331 -22.667 -14.719 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -21.682 -21.417 -15.594 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -23.215 -21.343 -16.495 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -22.352 -19.842 -16.084 1.00 0.00 H new ATOM 1696 N SER A 110 -26.727 -17.756 -14.491 1.00 0.00 N ATOM 1697 CA SER A 110 -28.007 -17.144 -14.839 1.00 0.00 C ATOM 1698 C SER A 110 -27.834 -15.796 -15.519 1.00 0.00 C ATOM 1699 O SER A 110 -28.402 -15.559 -16.584 1.00 0.00 O ATOM 1700 CB SER A 110 -28.825 -16.917 -13.570 1.00 0.00 C ATOM 1701 OG SER A 110 -28.067 -16.259 -12.585 1.00 0.00 O ATOM 0 H SER A 110 -26.705 -18.158 -13.554 1.00 0.00 H new ATOM 0 HA SER A 110 -28.509 -17.825 -15.526 1.00 0.00 H new ATOM 0 HB2 SER A 110 -29.710 -16.326 -13.806 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.175 -17.874 -13.184 1.00 0.00 H new ATOM 0 HG SER A 110 -27.764 -16.909 -11.917 1.00 0.00 H new ATOM 1707 N ASP A 111 -27.048 -14.918 -14.897 1.00 0.00 N ATOM 1708 CA ASP A 111 -26.819 -13.579 -15.399 1.00 0.00 C ATOM 1709 C ASP A 111 -26.111 -13.630 -16.745 1.00 0.00 C ATOM 1710 O ASP A 111 -26.446 -12.884 -17.661 1.00 0.00 O ATOM 1711 CB ASP A 111 -25.950 -12.895 -14.349 1.00 0.00 C ATOM 1712 CG ASP A 111 -25.700 -11.409 -14.602 1.00 0.00 C ATOM 1713 OD1 ASP A 111 -26.257 -10.868 -15.580 1.00 0.00 O ATOM 1714 OD2 ASP A 111 -24.939 -10.827 -13.798 1.00 0.00 O1- ATOM 0 H ASP A 111 -26.554 -15.124 -14.029 1.00 0.00 H new ATOM 0 HA ASP A 111 -27.751 -13.037 -15.559 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -26.423 -13.010 -13.374 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -24.990 -13.409 -14.300 1.00 0.00 H new ATOM 1719 N ALA A 112 -25.120 -14.518 -16.870 1.00 0.00 N ATOM 1720 CA ALA A 112 -24.360 -14.611 -18.098 1.00 0.00 C ATOM 1721 C ALA A 112 -25.187 -15.247 -19.215 1.00 0.00 C ATOM 1722 O ALA A 112 -25.047 -14.853 -20.370 1.00 0.00 O ATOM 1723 CB ALA A 112 -23.088 -15.418 -17.842 1.00 0.00 C ATOM 0 H ALA A 112 -24.836 -15.171 -16.140 1.00 0.00 H new ATOM 0 HA ALA A 112 -24.093 -13.606 -18.424 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -22.512 -15.491 -18.764 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -22.489 -14.921 -17.078 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -23.354 -16.418 -17.500 1.00 0.00 H new ATOM 1729 N ILE A 113 -26.049 -16.223 -18.913 1.00 0.00 N ATOM 1730 CA ILE A 113 -26.807 -16.879 -19.968 1.00 0.00 C ATOM 1731 C ILE A 113 -27.812 -15.899 -20.559 1.00 0.00 C ATOM 1732 O ILE A 113 -28.034 -15.904 -21.767 1.00 0.00 O ATOM 1733 CB ILE A 113 -27.557 -18.108 -19.435 1.00 0.00 C ATOM 1734 CG1 ILE A 113 -26.653 -19.202 -18.853 1.00 0.00 C ATOM 1735 CG2 ILE A 113 -28.391 -18.695 -20.573 1.00 0.00 C ATOM 1736 CD1 ILE A 113 -25.541 -19.661 -19.793 1.00 0.00 C ATOM 0 H ILE A 113 -26.233 -16.565 -17.970 1.00 0.00 H new ATOM 0 HA ILE A 113 -26.104 -17.208 -20.734 1.00 0.00 H new ATOM 0 HB ILE A 113 -28.176 -17.763 -18.607 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -26.204 -18.834 -17.930 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -27.267 -20.062 -18.588 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -28.932 -19.570 -20.214 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -29.102 -17.948 -20.925 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -27.734 -18.986 -21.393 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -24.949 -20.435 -19.305 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -25.979 -20.062 -20.707 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -24.900 -18.814 -20.039 1.00 0.00 H new ATOM 1748 N ALA A 114 -28.422 -15.060 -19.718 1.00 0.00 N ATOM 1749 CA ALA A 114 -29.391 -14.087 -20.187 1.00 0.00 C ATOM 1750 C ALA A 114 -28.705 -12.919 -20.894 1.00 0.00 C ATOM 1751 O ALA A 114 -29.144 -12.499 -21.964 1.00 0.00 O ATOM 1752 CB ALA A 114 -30.196 -13.590 -18.989 1.00 0.00 C ATOM 0 H ALA A 114 -28.257 -15.041 -18.712 1.00 0.00 H new ATOM 0 HA ALA A 114 -30.054 -14.559 -20.913 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -30.930 -12.857 -19.323 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -30.709 -14.430 -18.521 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -29.524 -13.127 -18.266 1.00 0.00 H new ATOM 1758 N LYS A 115 -27.628 -12.386 -20.304 1.00 0.00 N ATOM 1759 CA LYS A 115 -26.991 -11.182 -20.815 1.00 0.00 C ATOM 1760 C LYS A 115 -26.029 -11.436 -21.974 1.00 0.00 C ATOM 1761 O LYS A 115 -25.881 -10.576 -22.838 1.00 0.00 O ATOM 1762 CB LYS A 115 -26.241 -10.515 -19.663 1.00 0.00 C ATOM 1763 CG LYS A 115 -25.761 -9.088 -19.964 1.00 0.00 C ATOM 1764 CD LYS A 115 -26.892 -8.108 -20.289 1.00 0.00 C ATOM 1765 CE LYS A 115 -27.269 -8.090 -21.774 1.00 0.00 C ATOM 1766 NZ LYS A 115 -26.186 -7.542 -22.611 1.00 0.00 N1+ ATOM 0 H LYS A 115 -27.185 -12.775 -19.472 1.00 0.00 H new ATOM 0 HA LYS A 115 -27.777 -10.541 -21.214 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -26.890 -10.490 -18.788 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -25.379 -11.129 -19.403 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -25.205 -8.713 -19.105 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -25.067 -9.118 -20.804 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -27.771 -8.371 -19.701 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -26.593 -7.105 -19.985 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -27.503 -9.103 -22.101 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -28.171 -7.494 -21.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -26.523 -7.437 -23.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -25.898 -6.613 -22.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.372 -8.189 -22.593 1.00 0.00 H new ATOM 1780 N SER A 116 -25.378 -12.600 -22.006 1.00 0.00 N ATOM 1781 CA SER A 116 -24.333 -12.854 -22.994 1.00 0.00 C ATOM 1782 C SER A 116 -24.906 -13.153 -24.379 1.00 0.00 C ATOM 1783 O SER A 116 -26.048 -13.589 -24.504 1.00 0.00 O ATOM 1784 CB SER A 116 -23.408 -13.971 -22.509 1.00 0.00 C ATOM 1785 OG SER A 116 -24.029 -15.224 -22.654 1.00 0.00 O ATOM 0 H SER A 116 -25.555 -13.374 -21.365 1.00 0.00 H new ATOM 0 HA SER A 116 -23.745 -11.943 -23.100 1.00 0.00 H new ATOM 0 HB2 SER A 116 -22.477 -13.952 -23.076 1.00 0.00 H new ATOM 0 HB3 SER A 116 -23.147 -13.807 -21.463 1.00 0.00 H new ATOM 0 HG SER A 116 -24.638 -15.376 -21.902 1.00 0.00 H new ATOM 1791 N ASN A 117 -24.106 -12.917 -25.425 1.00 0.00 N ATOM 1792 CA ASN A 117 -24.511 -13.127 -26.805 1.00 0.00 C ATOM 1793 C ASN A 117 -24.578 -14.622 -27.128 1.00 0.00 C ATOM 1794 O ASN A 117 -24.065 -15.439 -26.371 1.00 0.00 O ATOM 1795 CB ASN A 117 -23.536 -12.393 -27.726 1.00 0.00 C ATOM 1796 CG ASN A 117 -23.997 -12.442 -29.176 1.00 0.00 C ATOM 1797 OD1 ASN A 117 -25.099 -12.005 -29.496 1.00 0.00 O ATOM 1798 ND2 ASN A 117 -23.158 -12.973 -30.062 1.00 0.00 N ATOM 0 H ASN A 117 -23.151 -12.572 -25.328 1.00 0.00 H new ATOM 0 HA ASN A 117 -25.511 -12.723 -26.961 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -23.444 -11.355 -27.407 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -22.546 -12.842 -27.642 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -23.422 -13.027 -31.046 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -22.251 -13.326 -29.757 1.00 0.00 H new ATOM 1805 N GLN A 118 -25.208 -14.992 -28.248 1.00 0.00 N ATOM 1806 CA GLN A 118 -25.469 -16.388 -28.581 1.00 0.00 C ATOM 1807 C GLN A 118 -24.207 -17.254 -28.550 1.00 0.00 C ATOM 1808 O GLN A 118 -24.260 -18.405 -28.117 1.00 0.00 O ATOM 1809 CB GLN A 118 -26.098 -16.464 -29.975 1.00 0.00 C ATOM 1810 CG GLN A 118 -27.243 -15.464 -30.147 1.00 0.00 C ATOM 1811 CD GLN A 118 -28.341 -15.666 -29.108 1.00 0.00 C ATOM 1812 OE1 GLN A 118 -28.608 -14.782 -28.301 1.00 0.00 O ATOM 1813 NE2 GLN A 118 -28.984 -16.832 -29.120 1.00 0.00 N ATOM 0 H GLN A 118 -25.549 -14.330 -28.945 1.00 0.00 H new ATOM 0 HA GLN A 118 -26.148 -16.779 -27.823 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -25.334 -16.272 -30.728 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -26.470 -17.474 -30.149 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -26.853 -14.449 -30.069 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -27.666 -15.566 -31.146 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -28.735 -17.545 -29.806 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -29.725 -17.013 -28.443 1.00 0.00 H new ATOM 1822 N ASP A 119 -23.076 -16.710 -29.005 1.00 0.00 N ATOM 1823 CA ASP A 119 -21.815 -17.433 -29.008 1.00 0.00 C ATOM 1824 C ASP A 119 -21.297 -17.577 -27.584 1.00 0.00 C ATOM 1825 O ASP A 119 -20.749 -18.617 -27.220 1.00 0.00 O ATOM 1826 CB ASP A 119 -20.770 -16.698 -29.856 1.00 0.00 C ATOM 1827 CG ASP A 119 -20.707 -15.183 -29.658 1.00 0.00 C ATOM 1828 OD1 ASP A 119 -21.499 -14.652 -28.849 1.00 0.00 O ATOM 1829 OD2 ASP A 119 -19.852 -14.566 -30.328 1.00 0.00 O1- ATOM 0 H ASP A 119 -23.015 -15.763 -29.378 1.00 0.00 H new ATOM 0 HA ASP A 119 -21.988 -18.420 -29.438 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -19.788 -17.117 -29.634 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -20.973 -16.901 -30.907 1.00 0.00 H new ATOM 1834 N HIS A 120 -21.475 -16.531 -26.779 1.00 0.00 N ATOM 1835 CA HIS A 120 -21.102 -16.549 -25.377 1.00 0.00 C ATOM 1836 C HIS A 120 -21.959 -17.559 -24.621 1.00 0.00 C ATOM 1837 O HIS A 120 -21.441 -18.274 -23.766 1.00 0.00 O ATOM 1838 CB HIS A 120 -21.316 -15.160 -24.789 1.00 0.00 C ATOM 1839 CG HIS A 120 -20.619 -14.023 -25.492 1.00 0.00 C ATOM 1840 ND1 HIS A 120 -20.827 -12.674 -25.198 1.00 0.00 N ATOM 1841 CD2 HIS A 120 -19.700 -14.126 -26.495 1.00 0.00 C ATOM 1842 CE1 HIS A 120 -20.029 -11.999 -26.040 1.00 0.00 C ATOM 1843 NE2 HIS A 120 -19.344 -12.843 -26.831 1.00 0.00 N ATOM 0 H HIS A 120 -21.883 -15.648 -27.087 1.00 0.00 H new ATOM 0 HA HIS A 120 -20.054 -16.835 -25.285 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -22.386 -14.953 -24.781 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -20.986 -15.174 -23.750 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -19.326 -15.037 -26.938 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -19.948 -10.923 -26.077 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -18.676 -12.577 -27.555 1.00 0.00 H new ATOM 1851 N LYS A 121 -23.264 -17.629 -24.923 1.00 0.00 N ATOM 1852 CA LYS A 121 -24.146 -18.594 -24.274 1.00 0.00 C ATOM 1853 C LYS A 121 -23.617 -19.997 -24.533 1.00 0.00 C ATOM 1854 O LYS A 121 -23.588 -20.831 -23.629 1.00 0.00 O ATOM 1855 CB LYS A 121 -25.572 -18.504 -24.827 1.00 0.00 C ATOM 1856 CG LYS A 121 -26.256 -17.153 -24.616 1.00 0.00 C ATOM 1857 CD LYS A 121 -27.696 -17.253 -25.136 1.00 0.00 C ATOM 1858 CE LYS A 121 -28.325 -15.882 -25.401 1.00 0.00 C ATOM 1859 NZ LYS A 121 -28.269 -15.001 -24.223 1.00 0.00 N1+ ATOM 0 H LYS A 121 -23.724 -17.030 -25.609 1.00 0.00 H new ATOM 0 HA LYS A 121 -24.169 -18.373 -23.207 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -25.547 -18.720 -25.895 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -26.178 -19.280 -24.359 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -26.252 -16.887 -23.559 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -25.716 -16.368 -25.144 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -27.706 -17.837 -26.056 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -28.304 -17.793 -24.410 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -27.809 -15.404 -26.234 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -29.364 -16.014 -25.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -29.204 -14.574 -24.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -27.995 -15.556 -23.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -27.568 -14.250 -24.384 1.00 0.00 H new ATOM 1873 N GLU A 122 -23.196 -20.259 -25.772 1.00 0.00 N ATOM 1874 CA GLU A 122 -22.734 -21.580 -26.154 1.00 0.00 C ATOM 1875 C GLU A 122 -21.357 -21.879 -25.573 1.00 0.00 C ATOM 1876 O GLU A 122 -21.090 -23.018 -25.190 1.00 0.00 O ATOM 1877 CB GLU A 122 -22.740 -21.692 -27.679 1.00 0.00 C ATOM 1878 CG GLU A 122 -22.204 -23.048 -28.140 1.00 0.00 C ATOM 1879 CD GLU A 122 -22.957 -24.233 -27.530 1.00 0.00 C ATOM 1880 OE1 GLU A 122 -22.391 -25.346 -27.570 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -24.086 -24.018 -27.033 1.00 0.00 O1- ATOM 0 H GLU A 122 -23.168 -19.569 -26.523 1.00 0.00 H new ATOM 0 HA GLU A 122 -23.412 -22.328 -25.742 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -23.755 -21.554 -28.052 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -22.133 -20.894 -28.107 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -22.267 -23.106 -29.227 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -21.149 -23.123 -27.878 1.00 0.00 H new ATOM 1888 N LYS A 123 -20.474 -20.878 -25.495 1.00 0.00 N ATOM 1889 CA LYS A 123 -19.164 -21.088 -24.909 1.00 0.00 C ATOM 1890 C LYS A 123 -19.324 -21.483 -23.438 1.00 0.00 C ATOM 1891 O LYS A 123 -18.564 -22.297 -22.922 1.00 0.00 O ATOM 1892 CB LYS A 123 -18.346 -19.800 -25.066 1.00 0.00 C ATOM 1893 CG LYS A 123 -16.918 -19.982 -24.544 1.00 0.00 C ATOM 1894 CD LYS A 123 -16.061 -20.840 -25.477 1.00 0.00 C ATOM 1895 CE LYS A 123 -15.391 -19.963 -26.537 1.00 0.00 C ATOM 1896 NZ LYS A 123 -14.338 -20.705 -27.255 1.00 0.00 N1+ ATOM 0 H LYS A 123 -20.647 -19.930 -25.828 1.00 0.00 H new ATOM 0 HA LYS A 123 -18.636 -21.897 -25.414 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -18.318 -19.510 -26.116 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -18.833 -18.989 -24.525 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -16.451 -19.005 -24.423 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -16.951 -20.444 -23.557 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -15.302 -21.370 -24.901 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -16.681 -21.596 -25.959 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -16.139 -19.610 -27.247 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -14.960 -19.081 -26.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -13.971 -20.121 -28.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -13.564 -20.932 -26.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -14.735 -21.586 -27.640 1.00 0.00 H new ATOM 1910 N ILE A 124 -20.316 -20.908 -22.752 1.00 0.00 N ATOM 1911 CA ILE A 124 -20.587 -21.253 -21.366 1.00 0.00 C ATOM 1912 C ILE A 124 -21.141 -22.673 -21.283 1.00 0.00 C ATOM 1913 O ILE A 124 -20.838 -23.399 -20.341 1.00 0.00 O ATOM 1914 CB ILE A 124 -21.593 -20.254 -20.789 1.00 0.00 C ATOM 1915 CG1 ILE A 124 -20.973 -18.854 -20.756 1.00 0.00 C ATOM 1916 CG2 ILE A 124 -22.006 -20.666 -19.374 1.00 0.00 C ATOM 1917 CD1 ILE A 124 -22.062 -17.786 -20.676 1.00 0.00 C ATOM 0 H ILE A 124 -20.941 -20.202 -23.140 1.00 0.00 H new ATOM 0 HA ILE A 124 -19.664 -21.208 -20.788 1.00 0.00 H new ATOM 0 HB ILE A 124 -22.478 -20.245 -21.425 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -20.306 -18.766 -19.899 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.367 -18.697 -21.649 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -22.721 -19.945 -18.979 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -22.465 -21.654 -19.402 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -21.126 -20.693 -18.731 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -21.602 -16.798 -20.653 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -22.712 -17.864 -21.547 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -22.650 -17.933 -19.770 1.00 0.00 H new ATOM 1929 N ARG A 125 -21.953 -23.075 -22.267 1.00 0.00 N ATOM 1930 CA ARG A 125 -22.559 -24.400 -22.262 1.00 0.00 C ATOM 1931 C ARG A 125 -21.513 -25.495 -22.461 1.00 0.00 C ATOM 1932 O ARG A 125 -21.644 -26.570 -21.878 1.00 0.00 O ATOM 1933 CB ARG A 125 -23.656 -24.461 -23.315 1.00 0.00 C ATOM 1934 CG ARG A 125 -24.790 -23.573 -22.806 1.00 0.00 C ATOM 1935 CD ARG A 125 -25.748 -23.220 -23.934 1.00 0.00 C ATOM 1936 NE ARG A 125 -26.838 -24.193 -24.048 1.00 0.00 N ATOM 1937 CZ ARG A 125 -26.948 -25.167 -24.957 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -26.027 -25.371 -25.901 1.00 0.00 N1+ ATOM 1939 NH2 ARG A 125 -28.019 -25.958 -24.911 1.00 0.00 N ATOM 0 H ARG A 125 -22.202 -22.500 -23.072 1.00 0.00 H new ATOM 0 HA ARG A 125 -23.008 -24.580 -21.285 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -23.289 -24.109 -24.279 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -23.999 -25.485 -23.460 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -25.331 -24.086 -22.011 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -24.378 -22.661 -22.374 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -26.164 -22.227 -23.760 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -25.200 -23.176 -24.875 1.00 0.00 H new ATOM 0 HE ARG A 125 -27.590 -24.119 -23.363 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -25.202 -24.772 -25.947 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -26.148 -26.125 -26.577 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -28.730 -25.813 -24.194 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -28.128 -26.709 -25.593 1.00 0.00 H new ATOM 1953 N MET A 126 -20.477 -25.248 -23.270 1.00 0.00 N ATOM 1954 CA MET A 126 -19.408 -26.229 -23.385 1.00 0.00 C ATOM 1955 C MET A 126 -18.568 -26.217 -22.111 1.00 0.00 C ATOM 1956 O MET A 126 -17.980 -27.235 -21.757 1.00 0.00 O ATOM 1957 CB MET A 126 -18.555 -25.976 -24.633 1.00 0.00 C ATOM 1958 CG MET A 126 -17.850 -24.623 -24.606 1.00 0.00 C ATOM 1959 SD MET A 126 -16.674 -24.365 -25.959 1.00 0.00 S ATOM 1960 CE MET A 126 -15.378 -25.527 -25.461 1.00 0.00 C ATOM 0 H MET A 126 -20.362 -24.406 -23.834 1.00 0.00 H new ATOM 0 HA MET A 126 -19.844 -27.221 -23.502 1.00 0.00 H new ATOM 0 HB2 MET A 126 -17.810 -26.766 -24.724 1.00 0.00 H new ATOM 0 HB3 MET A 126 -19.189 -26.032 -25.518 1.00 0.00 H new ATOM 0 HG2 MET A 126 -18.602 -23.835 -24.639 1.00 0.00 H new ATOM 0 HG3 MET A 126 -17.322 -24.521 -23.658 1.00 0.00 H new ATOM 0 HE1 MET A 126 -14.461 -25.305 -26.007 1.00 0.00 H new ATOM 0 HE2 MET A 126 -15.196 -25.432 -24.391 1.00 0.00 H new ATOM 0 HE3 MET A 126 -15.696 -26.545 -25.686 1.00 0.00 H new ATOM 1970 N LEU A 127 -18.500 -25.078 -21.412 1.00 0.00 N ATOM 1971 CA LEU A 127 -17.845 -25.030 -20.112 1.00 0.00 C ATOM 1972 C LEU A 127 -18.619 -25.877 -19.101 1.00 0.00 C ATOM 1973 O LEU A 127 -18.010 -26.443 -18.198 1.00 0.00 O ATOM 1974 CB LEU A 127 -17.735 -23.577 -19.640 1.00 0.00 C ATOM 1975 CG LEU A 127 -16.313 -23.034 -19.800 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -15.832 -23.050 -21.252 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -16.269 -21.598 -19.281 1.00 0.00 C ATOM 0 H LEU A 127 -18.888 -24.189 -21.726 1.00 0.00 H new ATOM 0 HA LEU A 127 -16.839 -25.442 -20.199 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.427 -22.956 -20.209 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -18.034 -23.511 -18.594 1.00 0.00 H new ATOM 0 HG LEU A 127 -15.650 -23.684 -19.229 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -14.818 -22.654 -21.304 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -15.841 -24.073 -21.627 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -16.494 -22.434 -21.861 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -15.259 -21.202 -19.391 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -16.964 -20.983 -19.853 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -16.552 -21.583 -18.229 1.00 0.00 H new ATOM 1989 N LEU A 128 -19.949 -25.981 -19.231 1.00 0.00 N ATOM 1990 CA LEU A 128 -20.714 -26.843 -18.339 1.00 0.00 C ATOM 1991 C LEU A 128 -20.411 -28.306 -18.646 1.00 0.00 C ATOM 1992 O LEU A 128 -20.316 -29.110 -17.723 1.00 0.00 O ATOM 1993 CB LEU A 128 -22.216 -26.560 -18.473 1.00 0.00 C ATOM 1994 CG LEU A 128 -22.590 -25.151 -18.002 1.00 0.00 C ATOM 1995 CD1 LEU A 128 -24.071 -24.908 -18.272 1.00 0.00 C ATOM 1996 CD2 LEU A 128 -22.332 -24.976 -16.505 1.00 0.00 C ATOM 0 H LEU A 128 -20.502 -25.488 -19.932 1.00 0.00 H new ATOM 0 HA LEU A 128 -20.422 -26.634 -17.310 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -22.515 -26.683 -19.514 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -22.774 -27.294 -17.892 1.00 0.00 H new ATOM 0 HG LEU A 128 -21.973 -24.437 -18.548 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -24.342 -23.906 -17.938 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -24.266 -25.000 -19.340 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -24.665 -25.644 -17.730 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -22.608 -23.965 -16.204 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -22.929 -25.697 -15.946 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -21.275 -25.141 -16.296 1.00 0.00 H new ATOM 2008 N ASP A 129 -20.260 -28.663 -19.929 1.00 0.00 N ATOM 2009 CA ASP A 129 -19.876 -30.018 -20.292 1.00 0.00 C ATOM 2010 C ASP A 129 -18.518 -30.335 -19.678 1.00 0.00 C ATOM 2011 O ASP A 129 -18.316 -31.413 -19.129 1.00 0.00 O ATOM 2012 CB ASP A 129 -19.801 -30.130 -21.817 1.00 0.00 C ATOM 2013 CG ASP A 129 -19.121 -31.430 -22.238 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -18.034 -31.337 -22.851 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -19.700 -32.495 -21.940 1.00 0.00 O1- ATOM 0 H ASP A 129 -20.398 -28.034 -20.720 1.00 0.00 H new ATOM 0 HA ASP A 129 -20.614 -30.728 -19.917 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -20.806 -30.088 -22.238 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -19.251 -29.280 -22.221 1.00 0.00 H new ATOM 2020 N ILE A 130 -17.587 -29.384 -19.773 1.00 0.00 N ATOM 2021 CA ILE A 130 -16.247 -29.551 -19.243 1.00 0.00 C ATOM 2022 C ILE A 130 -16.288 -29.752 -17.733 1.00 0.00 C ATOM 2023 O ILE A 130 -15.529 -30.557 -17.194 1.00 0.00 O ATOM 2024 CB ILE A 130 -15.430 -28.317 -19.628 1.00 0.00 C ATOM 2025 CG1 ILE A 130 -15.154 -28.371 -21.130 1.00 0.00 C ATOM 2026 CG2 ILE A 130 -14.113 -28.288 -18.862 1.00 0.00 C ATOM 2027 CD1 ILE A 130 -14.615 -27.036 -21.628 1.00 0.00 C ATOM 0 H ILE A 130 -17.747 -28.481 -20.220 1.00 0.00 H new ATOM 0 HA ILE A 130 -15.778 -30.441 -19.664 1.00 0.00 H new ATOM 0 HB ILE A 130 -15.989 -27.415 -19.378 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -14.435 -29.162 -21.344 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -16.071 -28.621 -21.664 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.545 -27.403 -19.149 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -14.315 -28.258 -17.791 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -13.535 -29.182 -19.097 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -14.426 -27.097 -22.700 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -15.347 -26.252 -21.433 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -13.686 -26.802 -21.108 1.00 0.00 H new ATOM 2039 N TRP A 131 -17.170 -29.026 -17.045 1.00 0.00 N ATOM 2040 CA TRP A 131 -17.258 -29.143 -15.602 1.00 0.00 C ATOM 2041 C TRP A 131 -17.957 -30.425 -15.166 1.00 0.00 C ATOM 2042 O TRP A 131 -17.609 -30.969 -14.120 1.00 0.00 O ATOM 2043 CB TRP A 131 -17.956 -27.908 -15.029 1.00 0.00 C ATOM 2044 CG TRP A 131 -17.269 -26.608 -15.306 1.00 0.00 C ATOM 2045 CD1 TRP A 131 -16.037 -26.473 -15.841 1.00 0.00 C ATOM 2046 CD2 TRP A 131 -17.744 -25.243 -15.076 1.00 0.00 C ATOM 2047 NE1 TRP A 131 -15.724 -25.141 -15.978 1.00 0.00 N ATOM 2048 CE2 TRP A 131 -16.740 -24.333 -15.512 1.00 0.00 C ATOM 2049 CE3 TRP A 131 -18.925 -24.684 -14.553 1.00 0.00 C ATOM 2050 CZ2 TRP A 131 -16.899 -22.945 -15.433 1.00 0.00 C ATOM 2051 CZ3 TRP A 131 -19.093 -23.295 -14.464 1.00 0.00 C ATOM 2052 CH2 TRP A 131 -18.083 -22.425 -14.900 1.00 0.00 C ATOM 0 H TRP A 131 -17.822 -28.362 -17.462 1.00 0.00 H new ATOM 0 HA TRP A 131 -16.244 -29.198 -15.205 1.00 0.00 H new ATOM 0 HB2 TRP A 131 -18.967 -27.861 -15.433 1.00 0.00 H new ATOM 0 HB3 TRP A 131 -18.049 -28.030 -13.950 1.00 0.00 H new ATOM 0 HD1 TRP A 131 -15.391 -27.292 -16.121 1.00 0.00 H new ATOM 0 HE1 TRP A 131 -14.850 -24.794 -16.374 1.00 0.00 H new ATOM 0 HE3 TRP A 131 -19.716 -25.337 -14.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 -16.118 -22.284 -15.779 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 -20.008 -22.891 -14.056 1.00 0.00 H new ATOM 0 HH2 TRP A 131 -18.219 -21.356 -14.824 1.00 0.00 H new