USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1075 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 117 ASN : amide:sc= -0.0724 K(o=1.2,f=-9.5!) USER MOD Set 1.2: A 121 LYS NZ :NH3+ 168:sc= 1.23 (180deg=0) USER MOD Set 2.1: A 111 ASN : amide:sc= 0.895 K(o=1.8,f=-11!) USER MOD Set 2.2: A 114 LYS NZ :NH3+ 163:sc= 0.93 (180deg=-1.06!) USER MOD Set 3.1: A 74 GLN : amide:sc= 0.395 K(o=1.4,f=-8.9!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 172:sc= 1.03 (180deg=-0.331) USER MOD Set 4.1: A 19 GLN :FLIP amide:sc=-0.00106 F(o=-0.63,f=1.9) USER MOD Set 4.2: A 26 SER OG : rot -153:sc= 1.22 USER MOD Set 4.3: A 66 HIS :FLIP no HD1:sc= -0.111 X(o=1.6,f=1.9) USER MOD Set 4.4: A 70 GLN : amide:sc= 0.838 K(o=1.9,f=-4.2!) USER MOD Set 5.1: A 65 ASN :FLIP amide:sc= -0.949 F(o=-6.9,f=-2.5) USER MOD Set 5.2: A 69 GLN : amide:sc= -1.53 K(o=-2.5,f=-5.7!) USER MOD Single : A 7 GLN :FLIP amide:sc= -0.0803 F(o=-1,f=-0.08) USER MOD Single : A 9 THR OG1 : rot -150:sc= -0.024 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0391) USER MOD Single : A 13 ASN : amide:sc= 0.867 K(o=0.87,f=-0.42) USER MOD Single : A 14 THR OG1 : rot 84:sc= 0.735 USER MOD Single : A 18 SER OG : rot -172:sc= 1.1 USER MOD Single : A 21 SER OG : rot 120:sc= -0.0062 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 56:sc= 1.3 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= 1.61 K(o=1.6,f=-4.7!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 179:sc= 0.995 (180deg=0.925) USER MOD Single : A 42 MET CE :methyl -136:sc= -0.25 (180deg=-1.38) USER MOD Single : A 44 LYS NZ :NH3+ 167:sc= 0.341 (180deg=-0.246) USER MOD Single : A 46 TYR OH : rot -12:sc= -0.379 USER MOD Single : A 47 MET CE :methyl -162:sc= -2.38! (180deg=-3.83!) USER MOD Single : A 51 SER OG : rot -28:sc= 0.833 USER MOD Single : A 53 ASN :FLIP amide:sc= -0.407 F(o=-5.1!,f=-0.41) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 167:sc= 2.6 (180deg=2.41) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl 146:sc= -0.186 (180deg=-0.995) USER MOD Single : A 72 LYS NZ :NH3+ -169:sc= 1.13 (180deg=1.11) USER MOD Single : A 78 GLN : amide:sc= -0.326! C(o=-0.33!,f=-5.7!) USER MOD Single : A 80 GLN : amide:sc= 0.754 K(o=0.75,f=-2.4!) USER MOD Single : A 82 SER OG : rot 105:sc= 1.23 USER MOD Single : A 85 LYS NZ :NH3+ -165:sc= 1.2 (180deg=1.14) USER MOD Single : A 95 ASN : amide:sc= -3.54! C(o=-3.5!,f=-6.5!) USER MOD Single : A 96 GLN : amide:sc= 0.669 K(o=0.67,f=-0.69) USER MOD Single : A 103 LYS NZ :NH3+ 164:sc= 1.27 (180deg=1.23) USER MOD Single : A 104 LYS NZ :NH3+ 177:sc= 1.29 (180deg=1.23) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 72:sc= 1.14 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0.46 X(o=0.46,f=-0.028) USER MOD Single : A 125 ASN : amide:sc= 1.15 K(o=1.2,f=-0.2) USER MOD Single : A 130 SER OG : rot 171:sc= 0.625 USER MOD ----------------------------------------------------------------- ATOM 87 N GLN A 7 17.031 -3.060 -1.932 1.00 0.00 N ATOM 88 CA GLN A 7 16.414 -4.378 -2.004 1.00 0.00 C ATOM 89 C GLN A 7 16.958 -5.152 -3.202 1.00 0.00 C ATOM 90 O GLN A 7 17.113 -6.371 -3.137 1.00 0.00 O ATOM 91 CB GLN A 7 14.888 -4.256 -2.118 1.00 0.00 C ATOM 92 CG GLN A 7 14.444 -3.421 -3.325 1.00 0.00 C ATOM 93 CD GLN A 7 12.930 -3.336 -3.464 1.00 0.00 C ATOM 94 OE1 GLN A 7 12.180 -3.873 -2.504 1.00 0.00 O flip ATOM 95 NE2 GLN A 7 12.432 -2.786 -4.442 1.00 0.00 N flip ATOM 0 HA GLN A 7 16.656 -4.917 -1.088 1.00 0.00 H new ATOM 0 HB2 GLN A 7 14.454 -5.253 -2.193 1.00 0.00 H new ATOM 0 HB3 GLN A 7 14.496 -3.805 -1.207 1.00 0.00 H new ATOM 0 HG2 GLN A 7 14.852 -2.414 -3.234 1.00 0.00 H new ATOM 0 HG3 GLN A 7 14.863 -3.854 -4.233 1.00 0.00 H new ATOM 0 HE21 GLN A 7 13.033 -2.384 -5.162 1.00 0.00 H new ATOM 0 HE22 GLN A 7 11.418 -2.731 -4.535 1.00 0.00 H new ATOM 104 N PHE A 8 17.252 -4.447 -4.300 1.00 0.00 N ATOM 105 CA PHE A 8 17.779 -5.082 -5.490 1.00 0.00 C ATOM 106 C PHE A 8 19.173 -5.615 -5.182 1.00 0.00 C ATOM 107 O PHE A 8 19.473 -6.775 -5.455 1.00 0.00 O ATOM 108 CB PHE A 8 17.786 -4.057 -6.628 1.00 0.00 C ATOM 109 CG PHE A 8 17.734 -4.631 -8.028 1.00 0.00 C ATOM 110 CD1 PHE A 8 17.177 -3.857 -9.053 1.00 0.00 C ATOM 111 CD2 PHE A 8 18.222 -5.913 -8.313 1.00 0.00 C ATOM 112 CE1 PHE A 8 17.073 -4.371 -10.350 1.00 0.00 C ATOM 113 CE2 PHE A 8 18.141 -6.417 -9.617 1.00 0.00 C ATOM 114 CZ PHE A 8 17.560 -5.653 -10.636 1.00 0.00 C ATOM 0 H PHE A 8 17.130 -3.437 -4.379 1.00 0.00 H new ATOM 0 HA PHE A 8 17.162 -5.924 -5.802 1.00 0.00 H new ATOM 0 HB2 PHE A 8 16.934 -3.390 -6.497 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.685 -3.448 -6.538 1.00 0.00 H new ATOM 0 HD1 PHE A 8 16.826 -2.858 -8.841 1.00 0.00 H new ATOM 0 HD2 PHE A 8 18.660 -6.512 -7.528 1.00 0.00 H new ATOM 0 HE1 PHE A 8 16.617 -3.780 -11.130 1.00 0.00 H new ATOM 0 HE2 PHE A 8 18.529 -7.400 -9.838 1.00 0.00 H new ATOM 0 HZ PHE A 8 17.488 -6.050 -11.638 1.00 0.00 H new ATOM 124 N THR A 9 20.034 -4.769 -4.609 1.00 0.00 N ATOM 125 CA THR A 9 21.400 -5.148 -4.301 1.00 0.00 C ATOM 126 C THR A 9 21.412 -6.352 -3.372 1.00 0.00 C ATOM 127 O THR A 9 22.058 -7.350 -3.685 1.00 0.00 O ATOM 128 CB THR A 9 22.136 -3.965 -3.677 1.00 0.00 C ATOM 129 OG1 THR A 9 22.229 -2.932 -4.629 1.00 0.00 O ATOM 130 CG2 THR A 9 23.543 -4.353 -3.224 1.00 0.00 C ATOM 0 H THR A 9 19.798 -3.811 -4.350 1.00 0.00 H new ATOM 0 HA THR A 9 21.914 -5.427 -5.221 1.00 0.00 H new ATOM 0 HB THR A 9 21.576 -3.637 -2.801 1.00 0.00 H new ATOM 0 HG1 THR A 9 23.042 -2.409 -4.466 1.00 0.00 H new ATOM 0 HG21 THR A 9 24.036 -3.486 -2.785 1.00 0.00 H new ATOM 0 HG22 THR A 9 23.480 -5.149 -2.482 1.00 0.00 H new ATOM 0 HG23 THR A 9 24.118 -4.702 -4.082 1.00 0.00 H new ATOM 138 N THR A 10 20.711 -6.281 -2.235 1.00 0.00 N ATOM 139 CA THR A 10 20.744 -7.395 -1.290 1.00 0.00 C ATOM 140 C THR A 10 20.218 -8.668 -1.946 1.00 0.00 C ATOM 141 O THR A 10 20.542 -9.771 -1.503 1.00 0.00 O ATOM 142 CB THR A 10 19.975 -7.054 -0.011 1.00 0.00 C ATOM 143 OG1 THR A 10 20.184 -8.077 0.938 1.00 0.00 O ATOM 144 CG2 THR A 10 18.475 -6.934 -0.259 1.00 0.00 C ATOM 0 H THR A 10 20.132 -5.489 -1.955 1.00 0.00 H new ATOM 0 HA THR A 10 21.780 -7.575 -1.003 1.00 0.00 H new ATOM 0 HB THR A 10 20.343 -6.093 0.349 1.00 0.00 H new ATOM 0 HG1 THR A 10 19.696 -7.865 1.761 1.00 0.00 H new ATOM 0 HG21 THR A 10 17.970 -6.691 0.676 1.00 0.00 H new ATOM 0 HG22 THR A 10 18.289 -6.145 -0.988 1.00 0.00 H new ATOM 0 HG23 THR A 10 18.093 -7.880 -0.643 1.00 0.00 H new ATOM 152 N LYS A 11 19.409 -8.522 -3.002 1.00 0.00 N ATOM 153 CA LYS A 11 18.980 -9.651 -3.808 1.00 0.00 C ATOM 154 C LYS A 11 20.192 -10.298 -4.479 1.00 0.00 C ATOM 155 O LYS A 11 20.396 -11.501 -4.333 1.00 0.00 O ATOM 156 CB LYS A 11 17.966 -9.167 -4.852 1.00 0.00 C ATOM 157 CG LYS A 11 16.781 -10.119 -4.985 1.00 0.00 C ATOM 158 CD LYS A 11 15.983 -10.087 -3.678 1.00 0.00 C ATOM 159 CE LYS A 11 14.497 -10.263 -3.977 1.00 0.00 C ATOM 160 NZ LYS A 11 14.218 -11.576 -4.590 1.00 0.00 N1+ ATOM 0 H LYS A 11 19.041 -7.623 -3.313 1.00 0.00 H new ATOM 0 HA LYS A 11 18.502 -10.400 -3.177 1.00 0.00 H new ATOM 0 HB2 LYS A 11 17.605 -8.176 -4.575 1.00 0.00 H new ATOM 0 HB3 LYS A 11 18.461 -9.067 -5.818 1.00 0.00 H new ATOM 0 HG2 LYS A 11 16.149 -9.822 -5.822 1.00 0.00 H new ATOM 0 HG3 LYS A 11 17.129 -11.131 -5.191 1.00 0.00 H new ATOM 0 HD2 LYS A 11 16.326 -10.879 -3.012 1.00 0.00 H new ATOM 0 HD3 LYS A 11 16.150 -9.142 -3.162 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.925 -10.163 -3.054 1.00 0.00 H new ATOM 0 HE3 LYS A 11 14.164 -9.470 -4.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 13.190 -11.717 -4.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.633 -11.609 -5.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.634 -12.328 -4.004 1.00 0.00 H new ATOM 174 N LEU A 12 20.998 -9.513 -5.210 1.00 0.00 N ATOM 175 CA LEU A 12 22.161 -10.016 -5.938 1.00 0.00 C ATOM 176 C LEU A 12 23.237 -10.551 -4.998 1.00 0.00 C ATOM 177 O LEU A 12 24.113 -11.305 -5.422 1.00 0.00 O ATOM 178 CB LEU A 12 22.744 -8.891 -6.791 1.00 0.00 C ATOM 179 CG LEU A 12 21.771 -8.508 -7.906 1.00 0.00 C ATOM 180 CD1 LEU A 12 21.543 -6.999 -7.924 1.00 0.00 C ATOM 181 CD2 LEU A 12 22.327 -8.918 -9.257 1.00 0.00 C ATOM 0 H LEU A 12 20.856 -8.508 -5.310 1.00 0.00 H new ATOM 0 HA LEU A 12 21.831 -10.843 -6.567 1.00 0.00 H new ATOM 0 HB2 LEU A 12 22.951 -8.022 -6.166 1.00 0.00 H new ATOM 0 HB3 LEU A 12 23.694 -9.208 -7.222 1.00 0.00 H new ATOM 0 HG LEU A 12 20.830 -9.024 -7.716 1.00 0.00 H new ATOM 0 HD11 LEU A 12 20.848 -6.746 -8.724 1.00 0.00 H new ATOM 0 HD12 LEU A 12 21.127 -6.683 -6.968 1.00 0.00 H new ATOM 0 HD13 LEU A 12 22.492 -6.490 -8.093 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.623 -8.638 -10.040 1.00 0.00 H new ATOM 0 HD22 LEU A 12 23.278 -8.414 -9.427 1.00 0.00 H new ATOM 0 HD23 LEU A 12 22.480 -9.997 -9.275 1.00 0.00 H new ATOM 193 N ASN A 13 23.174 -10.163 -3.722 1.00 0.00 N ATOM 194 CA ASN A 13 24.081 -10.685 -2.716 1.00 0.00 C ATOM 195 C ASN A 13 23.597 -12.050 -2.228 1.00 0.00 C ATOM 196 O ASN A 13 24.284 -12.701 -1.441 1.00 0.00 O ATOM 197 CB ASN A 13 24.239 -9.681 -1.577 1.00 0.00 C ATOM 198 CG ASN A 13 25.078 -8.488 -2.021 1.00 0.00 C ATOM 199 OD1 ASN A 13 26.278 -8.443 -1.779 1.00 0.00 O ATOM 200 ND2 ASN A 13 24.445 -7.519 -2.675 1.00 0.00 N ATOM 0 H ASN A 13 22.499 -9.486 -3.367 1.00 0.00 H new ATOM 0 HA ASN A 13 25.068 -10.831 -3.155 1.00 0.00 H new ATOM 0 HB2 ASN A 13 23.258 -9.339 -1.248 1.00 0.00 H new ATOM 0 HB3 ASN A 13 24.711 -10.165 -0.722 1.00 0.00 H new ATOM 0 HD21 ASN A 13 24.960 -6.699 -2.996 1.00 0.00 H new ATOM 0 HD22 ASN A 13 23.444 -7.595 -2.856 1.00 0.00 H new ATOM 207 N THR A 14 22.420 -12.480 -2.695 1.00 0.00 N ATOM 208 CA THR A 14 21.828 -13.756 -2.322 1.00 0.00 C ATOM 209 C THR A 14 21.728 -14.702 -3.526 1.00 0.00 C ATOM 210 O THR A 14 21.579 -15.907 -3.343 1.00 0.00 O ATOM 211 CB THR A 14 20.447 -13.486 -1.716 1.00 0.00 C ATOM 212 OG1 THR A 14 20.553 -12.549 -0.668 1.00 0.00 O ATOM 213 CG2 THR A 14 19.811 -14.763 -1.163 1.00 0.00 C ATOM 0 H THR A 14 21.851 -11.942 -3.349 1.00 0.00 H new ATOM 0 HA THR A 14 22.464 -14.252 -1.589 1.00 0.00 H new ATOM 0 HB THR A 14 19.816 -13.096 -2.514 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.543 -11.642 -1.038 1.00 0.00 H new ATOM 0 HG21 THR A 14 18.833 -14.530 -0.742 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.696 -15.490 -1.967 1.00 0.00 H new ATOM 0 HG23 THR A 14 20.450 -15.181 -0.385 1.00 0.00 H new ATOM 221 N LEU A 15 21.806 -14.176 -4.754 1.00 0.00 N ATOM 222 CA LEU A 15 21.678 -14.997 -5.949 1.00 0.00 C ATOM 223 C LEU A 15 22.909 -15.866 -6.211 1.00 0.00 C ATOM 224 O LEU A 15 23.995 -15.608 -5.701 1.00 0.00 O ATOM 225 CB LEU A 15 21.349 -14.137 -7.180 1.00 0.00 C ATOM 226 CG LEU A 15 20.038 -13.364 -7.014 1.00 0.00 C ATOM 227 CD1 LEU A 15 19.663 -12.738 -8.354 1.00 0.00 C ATOM 228 CD2 LEU A 15 18.893 -14.254 -6.541 1.00 0.00 C ATOM 0 H LEU A 15 21.957 -13.184 -4.939 1.00 0.00 H new ATOM 0 HA LEU A 15 20.847 -15.677 -5.764 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.163 -13.434 -7.358 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.282 -14.777 -8.060 1.00 0.00 H new ATOM 0 HG LEU A 15 20.196 -12.601 -6.252 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.730 -12.184 -8.249 1.00 0.00 H new ATOM 0 HD12 LEU A 15 20.454 -12.059 -8.672 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.537 -13.523 -9.100 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.987 -13.657 -6.439 1.00 0.00 H new ATOM 0 HD22 LEU A 15 18.725 -15.048 -7.269 1.00 0.00 H new ATOM 0 HD23 LEU A 15 19.148 -14.693 -5.577 1.00 0.00 H new ATOM 240 N GLU A 16 22.703 -16.905 -7.027 1.00 0.00 N ATOM 241 CA GLU A 16 23.751 -17.767 -7.555 1.00 0.00 C ATOM 242 C GLU A 16 23.542 -17.913 -9.056 1.00 0.00 C ATOM 243 O GLU A 16 22.495 -17.531 -9.578 1.00 0.00 O ATOM 244 CB GLU A 16 23.772 -19.138 -6.879 1.00 0.00 C ATOM 245 CG GLU A 16 22.425 -19.851 -6.979 1.00 0.00 C ATOM 246 CD GLU A 16 22.557 -21.366 -6.819 1.00 0.00 C ATOM 247 OE1 GLU A 16 23.685 -21.839 -6.549 1.00 0.00 O ATOM 248 OE2 GLU A 16 21.521 -22.049 -6.974 1.00 0.00 O1- ATOM 0 H GLU A 16 21.771 -17.173 -7.345 1.00 0.00 H new ATOM 0 HA GLU A 16 24.717 -17.308 -7.347 1.00 0.00 H new ATOM 0 HB2 GLU A 16 24.543 -19.756 -7.339 1.00 0.00 H new ATOM 0 HB3 GLU A 16 24.042 -19.020 -5.830 1.00 0.00 H new ATOM 0 HG2 GLU A 16 21.754 -19.464 -6.212 1.00 0.00 H new ATOM 0 HG3 GLU A 16 21.969 -19.628 -7.944 1.00 0.00 H new ATOM 255 N ASP A 17 24.537 -18.464 -9.750 1.00 0.00 N ATOM 256 CA ASP A 17 24.540 -18.589 -11.200 1.00 0.00 C ATOM 257 C ASP A 17 23.470 -19.555 -11.718 1.00 0.00 C ATOM 258 O ASP A 17 23.580 -20.014 -12.854 1.00 0.00 O ATOM 259 CB ASP A 17 25.921 -19.055 -11.676 1.00 0.00 C ATOM 260 CG ASP A 17 27.044 -18.104 -11.280 1.00 0.00 C ATOM 261 OD1 ASP A 17 26.808 -16.877 -11.313 1.00 0.00 O ATOM 262 OD2 ASP A 17 28.137 -18.606 -10.945 1.00 0.00 O1- ATOM 0 H ASP A 17 25.376 -18.841 -9.309 1.00 0.00 H new ATOM 0 HA ASP A 17 24.308 -17.604 -11.604 1.00 0.00 H new ATOM 0 HB2 ASP A 17 26.127 -20.042 -11.263 1.00 0.00 H new ATOM 0 HB3 ASP A 17 25.908 -19.160 -12.761 1.00 0.00 H new ATOM 267 N SER A 18 22.440 -19.882 -10.928 1.00 0.00 N ATOM 268 CA SER A 18 21.518 -20.952 -11.285 1.00 0.00 C ATOM 269 C SER A 18 20.172 -20.416 -11.744 1.00 0.00 C ATOM 270 O SER A 18 19.683 -19.408 -11.240 1.00 0.00 O ATOM 271 CB SER A 18 21.320 -21.916 -10.115 1.00 0.00 C ATOM 272 OG SER A 18 20.548 -21.304 -9.105 1.00 0.00 O ATOM 0 H SER A 18 22.230 -19.420 -10.043 1.00 0.00 H new ATOM 0 HA SER A 18 21.968 -21.490 -12.119 1.00 0.00 H new ATOM 0 HB2 SER A 18 20.825 -22.823 -10.462 1.00 0.00 H new ATOM 0 HB3 SER A 18 22.288 -22.215 -9.712 1.00 0.00 H new ATOM 0 HG SER A 18 20.537 -21.877 -8.310 1.00 0.00 H new ATOM 278 N GLN A 19 19.561 -21.100 -12.715 1.00 0.00 N ATOM 279 CA GLN A 19 18.283 -20.692 -13.270 1.00 0.00 C ATOM 280 C GLN A 19 17.209 -20.592 -12.197 1.00 0.00 C ATOM 281 O GLN A 19 16.312 -19.764 -12.332 1.00 0.00 O ATOM 282 CB GLN A 19 17.862 -21.707 -14.329 1.00 0.00 C ATOM 283 CG GLN A 19 18.350 -21.281 -15.713 1.00 0.00 C ATOM 284 CD GLN A 19 17.447 -20.229 -16.358 1.00 0.00 C ATOM 285 OE1 GLN A 19 16.587 -19.564 -15.586 1.00 0.00 O flip ATOM 286 NE2 GLN A 19 17.524 -20.010 -17.560 1.00 0.00 N flip ATOM 0 H GLN A 19 19.943 -21.949 -13.132 1.00 0.00 H new ATOM 0 HA GLN A 19 18.397 -19.702 -13.712 1.00 0.00 H new ATOM 0 HB2 GLN A 19 18.268 -22.688 -14.081 1.00 0.00 H new ATOM 0 HB3 GLN A 19 16.776 -21.804 -14.335 1.00 0.00 H new ATOM 0 HG2 GLN A 19 19.362 -20.884 -15.631 1.00 0.00 H new ATOM 0 HG3 GLN A 19 18.402 -22.156 -16.361 1.00 0.00 H new ATOM 0 HE21 GLN A 19 18.189 -20.531 -18.132 1.00 0.00 H new ATOM 0 HE22 GLN A 19 16.923 -19.307 -17.990 1.00 0.00 H new ATOM 295 N GLU A 20 17.281 -21.414 -11.146 1.00 0.00 N ATOM 296 CA GLU A 20 16.286 -21.366 -10.089 1.00 0.00 C ATOM 297 C GLU A 20 16.425 -20.084 -9.277 1.00 0.00 C ATOM 298 O GLU A 20 15.434 -19.415 -8.991 1.00 0.00 O ATOM 299 CB GLU A 20 16.423 -22.596 -9.191 1.00 0.00 C ATOM 300 CG GLU A 20 16.369 -23.898 -9.996 1.00 0.00 C ATOM 301 CD GLU A 20 15.126 -23.993 -10.878 1.00 0.00 C ATOM 302 OE1 GLU A 20 15.231 -24.655 -11.934 1.00 0.00 O ATOM 303 OE2 GLU A 20 14.092 -23.408 -10.484 1.00 0.00 O1- ATOM 0 H GLU A 20 18.013 -22.112 -11.011 1.00 0.00 H new ATOM 0 HA GLU A 20 15.293 -21.370 -10.539 1.00 0.00 H new ATOM 0 HB2 GLU A 20 17.366 -22.545 -8.646 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.625 -22.595 -8.449 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.259 -23.972 -10.620 1.00 0.00 H new ATOM 0 HG3 GLU A 20 16.389 -24.745 -9.311 1.00 0.00 H new ATOM 310 N SER A 21 17.662 -19.737 -8.905 1.00 0.00 N ATOM 311 CA SER A 21 17.929 -18.534 -8.139 1.00 0.00 C ATOM 312 C SER A 21 17.672 -17.297 -8.997 1.00 0.00 C ATOM 313 O SER A 21 16.988 -16.364 -8.572 1.00 0.00 O ATOM 314 CB SER A 21 19.381 -18.577 -7.668 1.00 0.00 C ATOM 315 OG SER A 21 19.715 -17.396 -6.977 1.00 0.00 O ATOM 0 H SER A 21 18.494 -20.283 -9.129 1.00 0.00 H new ATOM 0 HA SER A 21 17.267 -18.482 -7.275 1.00 0.00 H new ATOM 0 HB2 SER A 21 19.533 -19.439 -7.019 1.00 0.00 H new ATOM 0 HB3 SER A 21 20.043 -18.703 -8.525 1.00 0.00 H new ATOM 0 HG SER A 21 19.986 -17.618 -6.062 1.00 0.00 H new ATOM 321 N ILE A 22 18.226 -17.299 -10.211 1.00 0.00 N ATOM 322 CA ILE A 22 18.096 -16.206 -11.158 1.00 0.00 C ATOM 323 C ILE A 22 16.629 -15.985 -11.520 1.00 0.00 C ATOM 324 O ILE A 22 16.156 -14.850 -11.498 1.00 0.00 O ATOM 325 CB ILE A 22 18.934 -16.537 -12.405 1.00 0.00 C ATOM 326 CG1 ILE A 22 20.438 -16.594 -12.089 1.00 0.00 C ATOM 327 CG2 ILE A 22 18.692 -15.507 -13.505 1.00 0.00 C ATOM 328 CD1 ILE A 22 21.018 -15.285 -11.562 1.00 0.00 C ATOM 0 H ILE A 22 18.785 -18.076 -10.563 1.00 0.00 H new ATOM 0 HA ILE A 22 18.463 -15.281 -10.714 1.00 0.00 H new ATOM 0 HB ILE A 22 18.617 -17.522 -12.746 1.00 0.00 H new ATOM 0 HG12 ILE A 22 20.613 -17.378 -11.353 1.00 0.00 H new ATOM 0 HG13 ILE A 22 20.977 -16.879 -12.993 1.00 0.00 H new ATOM 0 HG21 ILE A 22 19.294 -15.759 -14.378 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.637 -15.508 -13.779 1.00 0.00 H new ATOM 0 HG23 ILE A 22 18.972 -14.517 -13.145 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.082 -15.412 -11.365 1.00 0.00 H new ATOM 0 HD12 ILE A 22 20.878 -14.500 -12.305 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.509 -15.007 -10.639 1.00 0.00 H new ATOM 340 N SER A 23 15.902 -17.058 -11.853 1.00 0.00 N ATOM 341 CA SER A 23 14.503 -16.925 -12.228 1.00 0.00 C ATOM 342 C SER A 23 13.654 -16.475 -11.041 1.00 0.00 C ATOM 343 O SER A 23 12.664 -15.774 -11.236 1.00 0.00 O ATOM 344 CB SER A 23 13.972 -18.242 -12.794 1.00 0.00 C ATOM 345 OG SER A 23 12.624 -18.079 -13.179 1.00 0.00 O ATOM 0 H SER A 23 16.260 -18.013 -11.869 1.00 0.00 H new ATOM 0 HA SER A 23 14.435 -16.160 -13.001 1.00 0.00 H new ATOM 0 HB2 SER A 23 14.571 -18.550 -13.651 1.00 0.00 H new ATOM 0 HB3 SER A 23 14.055 -19.031 -12.047 1.00 0.00 H new ATOM 0 HG SER A 23 12.284 -18.923 -13.543 1.00 0.00 H new ATOM 351 N SER A 24 14.016 -16.856 -9.812 1.00 0.00 N ATOM 352 CA SER A 24 13.253 -16.433 -8.647 1.00 0.00 C ATOM 353 C SER A 24 13.313 -14.911 -8.505 1.00 0.00 C ATOM 354 O SER A 24 12.288 -14.269 -8.279 1.00 0.00 O ATOM 355 CB SER A 24 13.793 -17.113 -7.391 1.00 0.00 C ATOM 356 OG SER A 24 13.618 -18.511 -7.490 1.00 0.00 O ATOM 0 H SER A 24 14.821 -17.448 -9.605 1.00 0.00 H new ATOM 0 HA SER A 24 12.212 -16.727 -8.778 1.00 0.00 H new ATOM 0 HB2 SER A 24 14.850 -16.878 -7.265 1.00 0.00 H new ATOM 0 HB3 SER A 24 13.275 -16.734 -6.510 1.00 0.00 H new ATOM 0 HG SER A 24 14.053 -18.838 -8.305 1.00 0.00 H new ATOM 362 N ALA A 25 14.507 -14.330 -8.636 1.00 0.00 N ATOM 363 CA ALA A 25 14.644 -12.882 -8.590 1.00 0.00 C ATOM 364 C ALA A 25 14.051 -12.248 -9.844 1.00 0.00 C ATOM 365 O ALA A 25 13.576 -11.115 -9.791 1.00 0.00 O ATOM 366 CB ALA A 25 16.119 -12.521 -8.436 1.00 0.00 C ATOM 0 H ALA A 25 15.381 -14.837 -8.773 1.00 0.00 H new ATOM 0 HA ALA A 25 14.094 -12.492 -7.734 1.00 0.00 H new ATOM 0 HB1 ALA A 25 16.227 -11.437 -8.401 1.00 0.00 H new ATOM 0 HB2 ALA A 25 16.505 -12.954 -7.513 1.00 0.00 H new ATOM 0 HB3 ALA A 25 16.680 -12.914 -9.284 1.00 0.00 H new ATOM 372 N SER A 26 14.074 -12.967 -10.971 1.00 0.00 N ATOM 373 CA SER A 26 13.463 -12.475 -12.191 1.00 0.00 C ATOM 374 C SER A 26 11.961 -12.324 -11.994 1.00 0.00 C ATOM 375 O SER A 26 11.402 -11.275 -12.294 1.00 0.00 O ATOM 376 CB SER A 26 13.747 -13.436 -13.345 1.00 0.00 C ATOM 377 OG SER A 26 13.097 -12.980 -14.510 1.00 0.00 O ATOM 0 H SER A 26 14.509 -13.886 -11.055 1.00 0.00 H new ATOM 0 HA SER A 26 13.889 -11.501 -12.433 1.00 0.00 H new ATOM 0 HB2 SER A 26 14.821 -13.505 -13.519 1.00 0.00 H new ATOM 0 HB3 SER A 26 13.400 -14.438 -13.091 1.00 0.00 H new ATOM 0 HG SER A 26 12.909 -13.741 -15.099 1.00 0.00 H new ATOM 383 N LYS A 27 11.309 -13.374 -11.486 1.00 0.00 N ATOM 384 CA LYS A 27 9.878 -13.375 -11.234 1.00 0.00 C ATOM 385 C LYS A 27 9.502 -12.227 -10.301 1.00 0.00 C ATOM 386 O LYS A 27 8.464 -11.596 -10.493 1.00 0.00 O ATOM 387 CB LYS A 27 9.498 -14.732 -10.638 1.00 0.00 C ATOM 388 CG LYS A 27 9.565 -15.807 -11.723 1.00 0.00 C ATOM 389 CD LYS A 27 9.657 -17.214 -11.121 1.00 0.00 C ATOM 390 CE LYS A 27 8.509 -17.495 -10.156 1.00 0.00 C ATOM 391 NZ LYS A 27 8.607 -18.862 -9.612 1.00 0.00 N1+ ATOM 0 H LYS A 27 11.769 -14.250 -11.239 1.00 0.00 H new ATOM 0 HA LYS A 27 9.328 -13.224 -12.163 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.174 -14.984 -9.821 1.00 0.00 H new ATOM 0 HB3 LYS A 27 8.493 -14.687 -10.218 1.00 0.00 H new ATOM 0 HG2 LYS A 27 8.681 -15.740 -12.357 1.00 0.00 H new ATOM 0 HG3 LYS A 27 10.430 -15.627 -12.361 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.647 -17.953 -11.922 1.00 0.00 H new ATOM 0 HD3 LYS A 27 10.607 -17.324 -10.597 1.00 0.00 H new ATOM 0 HE2 LYS A 27 8.528 -16.772 -9.341 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.556 -17.371 -10.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 7.817 -19.033 -8.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 8.566 -19.550 -10.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 9.507 -18.969 -9.103 1.00 0.00 H new ATOM 405 N TRP A 28 10.337 -11.948 -9.293 1.00 0.00 N ATOM 406 CA TRP A 28 10.104 -10.814 -8.416 1.00 0.00 C ATOM 407 C TRP A 28 10.090 -9.512 -9.218 1.00 0.00 C ATOM 408 O TRP A 28 9.150 -8.726 -9.103 1.00 0.00 O ATOM 409 CB TRP A 28 11.177 -10.764 -7.329 1.00 0.00 C ATOM 410 CG TRP A 28 11.225 -9.475 -6.581 1.00 0.00 C ATOM 411 CD1 TRP A 28 10.231 -8.967 -5.820 1.00 0.00 C ATOM 412 CD2 TRP A 28 12.312 -8.501 -6.509 1.00 0.00 C ATOM 413 NE1 TRP A 28 10.618 -7.751 -5.299 1.00 0.00 N ATOM 414 CE2 TRP A 28 11.897 -7.413 -5.688 1.00 0.00 C ATOM 415 CE3 TRP A 28 13.608 -8.430 -7.052 1.00 0.00 C ATOM 416 CZ2 TRP A 28 12.722 -6.312 -5.426 1.00 0.00 C ATOM 417 CZ3 TRP A 28 14.440 -7.328 -6.798 1.00 0.00 C ATOM 418 CH2 TRP A 28 14.003 -6.272 -5.987 1.00 0.00 C ATOM 0 H TRP A 28 11.171 -12.492 -9.072 1.00 0.00 H new ATOM 0 HA TRP A 28 9.130 -10.932 -7.940 1.00 0.00 H new ATOM 0 HB2 TRP A 28 11.002 -11.575 -6.623 1.00 0.00 H new ATOM 0 HB3 TRP A 28 12.150 -10.943 -7.786 1.00 0.00 H new ATOM 0 HD1 TRP A 28 9.277 -9.442 -5.646 1.00 0.00 H new ATOM 0 HE1 TRP A 28 10.030 -7.172 -4.699 1.00 0.00 H new ATOM 0 HE3 TRP A 28 13.969 -9.236 -7.674 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 12.374 -5.504 -4.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 15.428 -7.294 -7.233 1.00 0.00 H new ATOM 0 HH2 TRP A 28 14.653 -5.431 -5.796 1.00 0.00 H new ATOM 429 N LEU A 29 11.125 -9.275 -10.031 1.00 0.00 N ATOM 430 CA LEU A 29 11.198 -8.058 -10.819 1.00 0.00 C ATOM 431 C LEU A 29 10.059 -8.010 -11.834 1.00 0.00 C ATOM 432 O LEU A 29 9.507 -6.942 -12.079 1.00 0.00 O ATOM 433 CB LEU A 29 12.551 -8.000 -11.535 1.00 0.00 C ATOM 434 CG LEU A 29 13.676 -7.528 -10.615 1.00 0.00 C ATOM 435 CD1 LEU A 29 15.014 -7.813 -11.286 1.00 0.00 C ATOM 436 CD2 LEU A 29 13.571 -6.035 -10.321 1.00 0.00 C ATOM 0 H LEU A 29 11.914 -9.910 -10.155 1.00 0.00 H new ATOM 0 HA LEU A 29 11.101 -7.196 -10.158 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.795 -8.988 -11.926 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.478 -7.328 -12.390 1.00 0.00 H new ATOM 0 HG LEU A 29 13.595 -8.065 -9.670 1.00 0.00 H new ATOM 0 HD11 LEU A 29 15.824 -7.480 -10.638 1.00 0.00 H new ATOM 0 HD12 LEU A 29 15.110 -8.884 -11.466 1.00 0.00 H new ATOM 0 HD13 LEU A 29 15.066 -7.280 -12.235 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.387 -5.735 -9.664 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.632 -5.475 -11.254 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.618 -5.826 -9.834 1.00 0.00 H new ATOM 448 N LEU A 30 9.699 -9.149 -12.427 1.00 0.00 N ATOM 449 CA LEU A 30 8.613 -9.206 -13.386 1.00 0.00 C ATOM 450 C LEU A 30 7.276 -8.904 -12.707 1.00 0.00 C ATOM 451 O LEU A 30 6.311 -8.584 -13.397 1.00 0.00 O ATOM 452 CB LEU A 30 8.602 -10.591 -14.042 1.00 0.00 C ATOM 453 CG LEU A 30 9.360 -10.645 -15.367 1.00 0.00 C ATOM 454 CD1 LEU A 30 8.687 -9.763 -16.422 1.00 0.00 C ATOM 455 CD2 LEU A 30 10.805 -10.210 -15.217 1.00 0.00 C ATOM 0 H LEU A 30 10.152 -10.046 -12.253 1.00 0.00 H new ATOM 0 HA LEU A 30 8.763 -8.448 -14.155 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.039 -11.314 -13.353 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.569 -10.896 -14.211 1.00 0.00 H new ATOM 0 HG LEU A 30 9.340 -11.686 -15.688 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.247 -9.820 -17.355 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.667 -10.110 -16.589 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.667 -8.730 -16.074 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.304 -10.265 -16.185 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.840 -9.185 -14.848 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.311 -10.867 -14.510 1.00 0.00 H new ATOM 467 N LEU A 31 7.210 -8.999 -11.373 1.00 0.00 N ATOM 468 CA LEU A 31 6.052 -8.534 -10.615 1.00 0.00 C ATOM 469 C LEU A 31 6.187 -7.052 -10.262 1.00 0.00 C ATOM 470 O LEU A 31 5.191 -6.412 -9.932 1.00 0.00 O ATOM 471 CB LEU A 31 5.894 -9.375 -9.347 1.00 0.00 C ATOM 472 CG LEU A 31 5.313 -10.750 -9.688 1.00 0.00 C ATOM 473 CD1 LEU A 31 5.635 -11.721 -8.552 1.00 0.00 C ATOM 474 CD2 LEU A 31 3.795 -10.662 -9.862 1.00 0.00 C ATOM 0 H LEU A 31 7.952 -9.397 -10.798 1.00 0.00 H new ATOM 0 HA LEU A 31 5.162 -8.649 -11.233 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.861 -9.493 -8.858 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.241 -8.862 -8.642 1.00 0.00 H new ATOM 0 HG LEU A 31 5.753 -11.101 -10.621 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.225 -12.703 -8.786 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.716 -11.798 -8.434 1.00 0.00 H new ATOM 0 HD13 LEU A 31 5.194 -11.355 -7.625 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.399 -11.648 -10.104 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.343 -10.306 -8.936 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.561 -9.969 -10.670 1.00 0.00 H new ATOM 486 N GLN A 32 7.400 -6.492 -10.326 1.00 0.00 N ATOM 487 CA GLN A 32 7.608 -5.054 -10.159 1.00 0.00 C ATOM 488 C GLN A 32 7.451 -4.310 -11.487 1.00 0.00 C ATOM 489 O GLN A 32 8.059 -3.261 -11.687 1.00 0.00 O ATOM 490 CB GLN A 32 8.966 -4.746 -9.516 1.00 0.00 C ATOM 491 CG GLN A 32 9.230 -5.600 -8.275 1.00 0.00 C ATOM 492 CD GLN A 32 7.952 -5.899 -7.505 1.00 0.00 C ATOM 493 OE1 GLN A 32 7.262 -4.998 -7.036 1.00 0.00 O ATOM 494 NE2 GLN A 32 7.634 -7.184 -7.373 1.00 0.00 N ATOM 0 H GLN A 32 8.257 -7.020 -10.494 1.00 0.00 H new ATOM 0 HA GLN A 32 6.834 -4.696 -9.479 1.00 0.00 H new ATOM 0 HB2 GLN A 32 9.758 -4.916 -10.246 1.00 0.00 H new ATOM 0 HB3 GLN A 32 9.005 -3.691 -9.243 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.701 -6.537 -8.573 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.934 -5.083 -7.622 1.00 0.00 H new ATOM 0 HE21 GLN A 32 8.235 -7.902 -7.778 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.790 -7.451 -6.867 1.00 0.00 H new ATOM 503 N TYR A 33 6.634 -4.854 -12.397 1.00 0.00 N ATOM 504 CA TYR A 33 6.458 -4.337 -13.752 1.00 0.00 C ATOM 505 C TYR A 33 6.114 -2.845 -13.779 1.00 0.00 C ATOM 506 O TYR A 33 6.435 -2.155 -14.746 1.00 0.00 O ATOM 507 CB TYR A 33 5.354 -5.139 -14.442 1.00 0.00 C ATOM 508 CG TYR A 33 4.088 -5.283 -13.625 1.00 0.00 C ATOM 509 CD1 TYR A 33 3.906 -6.420 -12.821 1.00 0.00 C ATOM 510 CD2 TYR A 33 3.098 -4.291 -13.665 1.00 0.00 C ATOM 511 CE1 TYR A 33 2.755 -6.565 -12.040 1.00 0.00 C ATOM 512 CE2 TYR A 33 1.939 -4.427 -12.886 1.00 0.00 C ATOM 513 CZ TYR A 33 1.762 -5.564 -12.070 1.00 0.00 C ATOM 514 OH TYR A 33 0.637 -5.697 -11.313 1.00 0.00 O ATOM 0 H TYR A 33 6.068 -5.681 -12.205 1.00 0.00 H new ATOM 0 HA TYR A 33 7.406 -4.447 -14.278 1.00 0.00 H new ATOM 0 HB2 TYR A 33 5.109 -4.658 -15.389 1.00 0.00 H new ATOM 0 HB3 TYR A 33 5.736 -6.132 -14.678 1.00 0.00 H new ATOM 0 HD1 TYR A 33 4.663 -7.190 -12.806 1.00 0.00 H new ATOM 0 HD2 TYR A 33 3.227 -3.423 -14.295 1.00 0.00 H new ATOM 0 HE1 TYR A 33 2.627 -7.438 -11.418 1.00 0.00 H new ATOM 0 HE2 TYR A 33 1.180 -3.659 -12.911 1.00 0.00 H new ATOM 0 HH TYR A 33 0.057 -4.919 -11.450 1.00 0.00 H new ATOM 524 N ARG A 34 5.467 -2.344 -12.725 1.00 0.00 N ATOM 525 CA ARG A 34 5.096 -0.938 -12.614 1.00 0.00 C ATOM 526 C ARG A 34 6.333 -0.069 -12.419 1.00 0.00 C ATOM 527 O ARG A 34 6.455 1.012 -12.992 1.00 0.00 O ATOM 528 CB ARG A 34 4.230 -0.728 -11.371 1.00 0.00 C ATOM 529 CG ARG A 34 3.128 -1.775 -11.181 1.00 0.00 C ATOM 530 CD ARG A 34 2.643 -1.720 -9.734 1.00 0.00 C ATOM 531 NE ARG A 34 3.770 -1.898 -8.813 1.00 0.00 N ATOM 532 CZ ARG A 34 4.395 -3.059 -8.591 1.00 0.00 C ATOM 533 NH1 ARG A 34 3.911 -4.199 -9.085 1.00 0.00 N1+ ATOM 534 NH2 ARG A 34 5.515 -3.071 -7.869 1.00 0.00 N ATOM 0 H ARG A 34 5.186 -2.907 -11.923 1.00 0.00 H new ATOM 0 HA ARG A 34 4.568 -0.667 -13.528 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.873 -0.732 -10.491 1.00 0.00 H new ATOM 0 HB3 ARG A 34 3.771 0.259 -11.426 1.00 0.00 H new ATOM 0 HG2 ARG A 34 2.301 -1.581 -11.864 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.508 -2.770 -11.414 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.156 -0.764 -9.543 1.00 0.00 H new ATOM 0 HD3 ARG A 34 1.898 -2.497 -9.563 1.00 0.00 H new ATOM 0 HE ARG A 34 4.101 -1.077 -8.305 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.055 -4.192 -9.639 1.00 0.00 H new ATOM 0 HH12 ARG A 34 4.397 -5.078 -8.909 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.888 -2.200 -7.492 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.999 -3.951 -7.694 1.00 0.00 H new ATOM 548 N ASP A 35 7.249 -0.575 -11.591 1.00 0.00 N ATOM 549 CA ASP A 35 8.394 0.148 -11.071 1.00 0.00 C ATOM 550 C ASP A 35 9.669 -0.085 -11.878 1.00 0.00 C ATOM 551 O ASP A 35 10.748 0.301 -11.444 1.00 0.00 O ATOM 552 CB ASP A 35 8.560 -0.215 -9.593 1.00 0.00 C ATOM 553 CG ASP A 35 7.289 0.122 -8.822 1.00 0.00 C ATOM 554 OD1 ASP A 35 6.826 -0.744 -8.049 1.00 0.00 O ATOM 555 OD2 ASP A 35 6.798 1.256 -9.023 1.00 0.00 O1- ATOM 0 H ASP A 35 7.205 -1.537 -11.256 1.00 0.00 H new ATOM 0 HA ASP A 35 8.208 1.218 -11.165 1.00 0.00 H new ATOM 0 HB2 ASP A 35 8.783 -1.277 -9.495 1.00 0.00 H new ATOM 0 HB3 ASP A 35 9.405 0.328 -9.170 1.00 0.00 H new ATOM 560 N ALA A 36 9.541 -0.714 -13.046 1.00 0.00 N ATOM 561 CA ALA A 36 10.661 -1.114 -13.882 1.00 0.00 C ATOM 562 C ALA A 36 11.743 -0.036 -14.037 1.00 0.00 C ATOM 563 O ALA A 36 12.916 -0.373 -13.898 1.00 0.00 O ATOM 564 CB ALA A 36 10.120 -1.523 -15.249 1.00 0.00 C ATOM 0 H ALA A 36 8.634 -0.963 -13.441 1.00 0.00 H new ATOM 0 HA ALA A 36 11.156 -1.949 -13.386 1.00 0.00 H new ATOM 0 HB1 ALA A 36 10.947 -1.827 -15.891 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.427 -2.356 -15.132 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.600 -0.679 -15.702 1.00 0.00 H new ATOM 570 N PRO A 37 11.414 1.237 -14.316 1.00 0.00 N ATOM 571 CA PRO A 37 12.432 2.265 -14.440 1.00 0.00 C ATOM 572 C PRO A 37 13.104 2.547 -13.098 1.00 0.00 C ATOM 573 O PRO A 37 14.285 2.875 -13.069 1.00 0.00 O ATOM 574 CB PRO A 37 11.703 3.499 -14.975 1.00 0.00 C ATOM 575 CG PRO A 37 10.272 3.310 -14.476 1.00 0.00 C ATOM 576 CD PRO A 37 10.091 1.796 -14.543 1.00 0.00 C ATOM 0 HA PRO A 37 13.235 1.956 -15.109 1.00 0.00 H new ATOM 0 HB2 PRO A 37 12.142 4.421 -14.595 1.00 0.00 H new ATOM 0 HB3 PRO A 37 11.746 3.550 -16.063 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.143 3.689 -13.462 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.551 3.832 -15.105 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.384 1.451 -13.788 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.697 1.490 -15.512 1.00 0.00 H new ATOM 584 N LYS A 38 12.374 2.423 -11.983 1.00 0.00 N ATOM 585 CA LYS A 38 12.956 2.632 -10.666 1.00 0.00 C ATOM 586 C LYS A 38 13.972 1.532 -10.373 1.00 0.00 C ATOM 587 O LYS A 38 15.099 1.816 -9.965 1.00 0.00 O ATOM 588 CB LYS A 38 11.864 2.630 -9.588 1.00 0.00 C ATOM 589 CG LYS A 38 11.250 4.019 -9.371 1.00 0.00 C ATOM 590 CD LYS A 38 10.312 4.456 -10.499 1.00 0.00 C ATOM 591 CE LYS A 38 9.132 3.493 -10.640 1.00 0.00 C ATOM 592 NZ LYS A 38 8.342 3.417 -9.397 1.00 0.00 N1+ ATOM 0 H LYS A 38 11.383 2.180 -11.974 1.00 0.00 H new ATOM 0 HA LYS A 38 13.455 3.601 -10.654 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.079 1.930 -9.872 1.00 0.00 H new ATOM 0 HB3 LYS A 38 12.286 2.272 -8.649 1.00 0.00 H new ATOM 0 HG2 LYS A 38 10.699 4.021 -8.430 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.052 4.751 -9.272 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.942 5.462 -10.299 1.00 0.00 H new ATOM 0 HD3 LYS A 38 10.864 4.500 -11.438 1.00 0.00 H new ATOM 0 HE2 LYS A 38 8.492 3.819 -11.460 1.00 0.00 H new ATOM 0 HE3 LYS A 38 9.501 2.500 -10.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 7.541 2.768 -9.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.943 3.066 -8.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 7.984 4.363 -9.155 1.00 0.00 H new ATOM 606 N VAL A 39 13.580 0.270 -10.579 1.00 0.00 N ATOM 607 CA VAL A 39 14.466 -0.852 -10.308 1.00 0.00 C ATOM 608 C VAL A 39 15.646 -0.842 -11.281 1.00 0.00 C ATOM 609 O VAL A 39 16.727 -1.308 -10.931 1.00 0.00 O ATOM 610 CB VAL A 39 13.718 -2.198 -10.349 1.00 0.00 C ATOM 611 CG1 VAL A 39 13.730 -2.816 -8.952 1.00 0.00 C ATOM 612 CG2 VAL A 39 12.256 -2.076 -10.758 1.00 0.00 C ATOM 0 H VAL A 39 12.659 0.007 -10.931 1.00 0.00 H new ATOM 0 HA VAL A 39 14.851 -0.737 -9.295 1.00 0.00 H new ATOM 0 HB VAL A 39 14.234 -2.805 -11.093 1.00 0.00 H new ATOM 0 HG11 VAL A 39 13.202 -3.770 -8.971 1.00 0.00 H new ATOM 0 HG12 VAL A 39 14.760 -2.978 -8.634 1.00 0.00 H new ATOM 0 HG13 VAL A 39 13.236 -2.142 -8.252 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.796 -3.064 -10.764 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.732 -1.436 -10.048 1.00 0.00 H new ATOM 0 HG23 VAL A 39 12.192 -1.640 -11.755 1.00 0.00 H new ATOM 622 N ALA A 40 15.460 -0.318 -12.499 1.00 0.00 N ATOM 623 CA ALA A 40 16.542 -0.214 -13.463 1.00 0.00 C ATOM 624 C ALA A 40 17.598 0.782 -13.006 1.00 0.00 C ATOM 625 O ALA A 40 18.789 0.536 -13.199 1.00 0.00 O ATOM 626 CB ALA A 40 15.981 0.191 -14.823 1.00 0.00 C ATOM 0 H ALA A 40 14.565 0.039 -12.833 1.00 0.00 H new ATOM 0 HA ALA A 40 17.023 -1.189 -13.546 1.00 0.00 H new ATOM 0 HB1 ALA A 40 16.795 0.268 -15.544 1.00 0.00 H new ATOM 0 HB2 ALA A 40 15.267 -0.560 -15.161 1.00 0.00 H new ATOM 0 HB3 ALA A 40 15.480 1.155 -14.737 1.00 0.00 H new ATOM 632 N GLU A 41 17.186 1.902 -12.405 1.00 0.00 N ATOM 633 CA GLU A 41 18.164 2.841 -11.893 1.00 0.00 C ATOM 634 C GLU A 41 18.941 2.216 -10.737 1.00 0.00 C ATOM 635 O GLU A 41 20.136 2.468 -10.603 1.00 0.00 O ATOM 636 CB GLU A 41 17.501 4.149 -11.453 1.00 0.00 C ATOM 637 CG GLU A 41 16.838 4.942 -12.587 1.00 0.00 C ATOM 638 CD GLU A 41 17.387 4.628 -13.976 1.00 0.00 C ATOM 639 OE1 GLU A 41 16.576 4.270 -14.855 1.00 0.00 O ATOM 640 OE2 GLU A 41 18.619 4.753 -14.133 1.00 0.00 O1- ATOM 0 H GLU A 41 16.211 2.168 -12.268 1.00 0.00 H new ATOM 0 HA GLU A 41 18.861 3.077 -12.697 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.749 3.923 -10.697 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.252 4.780 -10.977 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.767 4.740 -12.578 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.963 6.007 -12.392 1.00 0.00 H new ATOM 647 N MET A 42 18.288 1.408 -9.898 1.00 0.00 N ATOM 648 CA MET A 42 19.025 0.720 -8.847 1.00 0.00 C ATOM 649 C MET A 42 19.929 -0.356 -9.441 1.00 0.00 C ATOM 650 O MET A 42 21.024 -0.578 -8.930 1.00 0.00 O ATOM 651 CB MET A 42 18.078 0.099 -7.822 1.00 0.00 C ATOM 652 CG MET A 42 17.094 1.122 -7.258 1.00 0.00 C ATOM 653 SD MET A 42 16.713 0.900 -5.498 1.00 0.00 S ATOM 654 CE MET A 42 16.266 -0.856 -5.490 1.00 0.00 C ATOM 0 H MET A 42 17.286 1.221 -9.925 1.00 0.00 H new ATOM 0 HA MET A 42 19.642 1.460 -8.338 1.00 0.00 H new ATOM 0 HB2 MET A 42 17.525 -0.717 -8.287 1.00 0.00 H new ATOM 0 HB3 MET A 42 18.659 -0.333 -7.007 1.00 0.00 H new ATOM 0 HG2 MET A 42 17.503 2.122 -7.406 1.00 0.00 H new ATOM 0 HG3 MET A 42 16.166 1.069 -7.828 1.00 0.00 H new ATOM 0 HE1 MET A 42 15.370 -1.001 -4.887 1.00 0.00 H new ATOM 0 HE2 MET A 42 16.074 -1.187 -6.511 1.00 0.00 H new ATOM 0 HE3 MET A 42 17.085 -1.438 -5.068 1.00 0.00 H new ATOM 664 N TRP A 43 19.487 -1.026 -10.512 1.00 0.00 N ATOM 665 CA TRP A 43 20.276 -2.070 -11.148 1.00 0.00 C ATOM 666 C TRP A 43 21.585 -1.507 -11.683 1.00 0.00 C ATOM 667 O TRP A 43 22.653 -2.035 -11.371 1.00 0.00 O ATOM 668 CB TRP A 43 19.470 -2.728 -12.268 1.00 0.00 C ATOM 669 CG TRP A 43 20.163 -3.850 -12.979 1.00 0.00 C ATOM 670 CD1 TRP A 43 20.384 -5.085 -12.470 1.00 0.00 C ATOM 671 CD2 TRP A 43 20.735 -3.870 -14.323 1.00 0.00 C ATOM 672 NE1 TRP A 43 21.046 -5.862 -13.400 1.00 0.00 N ATOM 673 CE2 TRP A 43 21.301 -5.155 -14.556 1.00 0.00 C ATOM 674 CE3 TRP A 43 20.825 -2.932 -15.371 1.00 0.00 C ATOM 675 CZ2 TRP A 43 21.949 -5.487 -15.751 1.00 0.00 C ATOM 676 CZ3 TRP A 43 21.465 -3.260 -16.576 1.00 0.00 C ATOM 677 CH2 TRP A 43 22.035 -4.526 -16.767 1.00 0.00 C ATOM 0 H TRP A 43 18.583 -0.858 -10.953 1.00 0.00 H new ATOM 0 HA TRP A 43 20.517 -2.827 -10.402 1.00 0.00 H new ATOM 0 HB2 TRP A 43 18.537 -3.106 -11.849 1.00 0.00 H new ATOM 0 HB3 TRP A 43 19.205 -1.965 -12.999 1.00 0.00 H new ATOM 0 HD1 TRP A 43 20.087 -5.413 -11.485 1.00 0.00 H new ATOM 0 HE1 TRP A 43 21.312 -6.835 -13.251 1.00 0.00 H new ATOM 0 HE3 TRP A 43 20.396 -1.949 -15.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 22.376 -6.469 -15.888 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 21.519 -2.527 -17.367 1.00 0.00 H new ATOM 0 HH2 TRP A 43 22.538 -4.760 -17.693 1.00 0.00 H new ATOM 688 N LYS A 44 21.515 -0.439 -12.487 1.00 0.00 N ATOM 689 CA LYS A 44 22.731 0.156 -13.022 1.00 0.00 C ATOM 690 C LYS A 44 23.646 0.601 -11.885 1.00 0.00 C ATOM 691 O LYS A 44 24.835 0.310 -11.928 1.00 0.00 O ATOM 692 CB LYS A 44 22.411 1.299 -13.997 1.00 0.00 C ATOM 693 CG LYS A 44 21.918 2.559 -13.295 1.00 0.00 C ATOM 694 CD LYS A 44 21.630 3.668 -14.305 1.00 0.00 C ATOM 695 CE LYS A 44 21.577 5.007 -13.572 1.00 0.00 C ATOM 696 NZ LYS A 44 20.631 4.982 -12.446 1.00 0.00 N1+ ATOM 0 H LYS A 44 20.648 0.017 -12.772 1.00 0.00 H new ATOM 0 HA LYS A 44 23.266 -0.599 -13.598 1.00 0.00 H new ATOM 0 HB2 LYS A 44 23.304 1.537 -14.575 1.00 0.00 H new ATOM 0 HB3 LYS A 44 21.653 0.964 -14.705 1.00 0.00 H new ATOM 0 HG2 LYS A 44 21.015 2.334 -12.728 1.00 0.00 H new ATOM 0 HG3 LYS A 44 22.667 2.898 -12.580 1.00 0.00 H new ATOM 0 HD2 LYS A 44 22.404 3.689 -15.072 1.00 0.00 H new ATOM 0 HD3 LYS A 44 20.684 3.479 -14.812 1.00 0.00 H new ATOM 0 HE2 LYS A 44 22.572 5.258 -13.204 1.00 0.00 H new ATOM 0 HE3 LYS A 44 21.288 5.792 -14.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 20.782 5.819 -11.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 19.657 4.988 -12.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.784 4.121 -11.883 1.00 0.00 H new ATOM 710 N GLU A 45 23.121 1.299 -10.870 1.00 0.00 N ATOM 711 CA GLU A 45 23.976 1.785 -9.799 1.00 0.00 C ATOM 712 C GLU A 45 24.616 0.618 -9.052 1.00 0.00 C ATOM 713 O GLU A 45 25.795 0.682 -8.711 1.00 0.00 O ATOM 714 CB GLU A 45 23.180 2.676 -8.842 1.00 0.00 C ATOM 715 CG GLU A 45 22.731 3.975 -9.520 1.00 0.00 C ATOM 716 CD GLU A 45 23.878 4.730 -10.184 1.00 0.00 C ATOM 717 OE1 GLU A 45 25.006 4.656 -9.646 1.00 0.00 O ATOM 718 OE2 GLU A 45 23.601 5.368 -11.223 1.00 0.00 O1- ATOM 0 H GLU A 45 22.132 1.532 -10.775 1.00 0.00 H new ATOM 0 HA GLU A 45 24.774 2.384 -10.237 1.00 0.00 H new ATOM 0 HB2 GLU A 45 22.307 2.133 -8.481 1.00 0.00 H new ATOM 0 HB3 GLU A 45 23.791 2.912 -7.971 1.00 0.00 H new ATOM 0 HG2 GLU A 45 21.974 3.744 -10.269 1.00 0.00 H new ATOM 0 HG3 GLU A 45 22.260 4.621 -8.779 1.00 0.00 H new ATOM 725 N TYR A 46 23.851 -0.447 -8.797 1.00 0.00 N ATOM 726 CA TYR A 46 24.363 -1.593 -8.064 1.00 0.00 C ATOM 727 C TYR A 46 25.631 -2.133 -8.714 1.00 0.00 C ATOM 728 O TYR A 46 26.657 -2.271 -8.053 1.00 0.00 O ATOM 729 CB TYR A 46 23.299 -2.695 -8.013 1.00 0.00 C ATOM 730 CG TYR A 46 23.903 -4.073 -8.139 1.00 0.00 C ATOM 731 CD1 TYR A 46 23.814 -4.749 -9.365 1.00 0.00 C ATOM 732 CD2 TYR A 46 24.562 -4.661 -7.050 1.00 0.00 C ATOM 733 CE1 TYR A 46 24.417 -6.000 -9.523 1.00 0.00 C ATOM 734 CE2 TYR A 46 25.167 -5.913 -7.200 1.00 0.00 C ATOM 735 CZ TYR A 46 25.105 -6.580 -8.437 1.00 0.00 C ATOM 736 OH TYR A 46 25.715 -7.787 -8.570 1.00 0.00 O ATOM 0 H TYR A 46 22.878 -0.533 -9.089 1.00 0.00 H new ATOM 0 HA TYR A 46 24.605 -1.271 -7.051 1.00 0.00 H new ATOM 0 HB2 TYR A 46 22.750 -2.625 -7.074 1.00 0.00 H new ATOM 0 HB3 TYR A 46 22.579 -2.540 -8.816 1.00 0.00 H new ATOM 0 HD1 TYR A 46 23.278 -4.302 -10.189 1.00 0.00 H new ATOM 0 HD2 TYR A 46 24.602 -4.149 -6.100 1.00 0.00 H new ATOM 0 HE1 TYR A 46 24.357 -6.518 -10.469 1.00 0.00 H new ATOM 0 HE2 TYR A 46 25.682 -6.368 -6.366 1.00 0.00 H new ATOM 0 HH TYR A 46 25.424 -8.210 -9.405 1.00 0.00 H new ATOM 746 N MET A 47 25.564 -2.444 -10.011 1.00 0.00 N ATOM 747 CA MET A 47 26.687 -3.041 -10.708 1.00 0.00 C ATOM 748 C MET A 47 27.755 -2.020 -11.086 1.00 0.00 C ATOM 749 O MET A 47 28.930 -2.377 -11.174 1.00 0.00 O ATOM 750 CB MET A 47 26.163 -3.793 -11.921 1.00 0.00 C ATOM 751 CG MET A 47 25.388 -2.892 -12.876 1.00 0.00 C ATOM 752 SD MET A 47 24.150 -3.824 -13.801 1.00 0.00 S ATOM 753 CE MET A 47 25.238 -5.121 -14.423 1.00 0.00 C ATOM 0 H MET A 47 24.740 -2.289 -10.593 1.00 0.00 H new ATOM 0 HA MET A 47 27.185 -3.739 -10.035 1.00 0.00 H new ATOM 0 HB2 MET A 47 27.000 -4.246 -12.453 1.00 0.00 H new ATOM 0 HB3 MET A 47 25.517 -4.606 -11.589 1.00 0.00 H new ATOM 0 HG2 MET A 47 24.901 -2.096 -12.313 1.00 0.00 H new ATOM 0 HG3 MET A 47 26.080 -2.414 -13.570 1.00 0.00 H new ATOM 0 HE1 MET A 47 24.762 -5.622 -15.266 1.00 0.00 H new ATOM 0 HE2 MET A 47 26.181 -4.681 -14.747 1.00 0.00 H new ATOM 0 HE3 MET A 47 25.430 -5.846 -13.632 1.00 0.00 H new ATOM 763 N LEU A 48 27.370 -0.760 -11.311 1.00 0.00 N ATOM 764 CA LEU A 48 28.343 0.304 -11.529 1.00 0.00 C ATOM 765 C LEU A 48 29.307 0.423 -10.349 1.00 0.00 C ATOM 766 O LEU A 48 30.450 0.832 -10.547 1.00 0.00 O ATOM 767 CB LEU A 48 27.619 1.635 -11.752 1.00 0.00 C ATOM 768 CG LEU A 48 27.058 1.761 -13.174 1.00 0.00 C ATOM 769 CD1 LEU A 48 26.135 2.976 -13.248 1.00 0.00 C ATOM 770 CD2 LEU A 48 28.184 1.954 -14.187 1.00 0.00 C ATOM 0 H LEU A 48 26.397 -0.457 -11.346 1.00 0.00 H new ATOM 0 HA LEU A 48 28.925 0.056 -12.416 1.00 0.00 H new ATOM 0 HB2 LEU A 48 26.805 1.728 -11.033 1.00 0.00 H new ATOM 0 HB3 LEU A 48 28.308 2.458 -11.561 1.00 0.00 H new ATOM 0 HG LEU A 48 26.514 0.846 -13.409 1.00 0.00 H new ATOM 0 HD11 LEU A 48 25.735 3.068 -14.258 1.00 0.00 H new ATOM 0 HD12 LEU A 48 25.314 2.853 -12.542 1.00 0.00 H new ATOM 0 HD13 LEU A 48 26.697 3.876 -12.997 1.00 0.00 H new ATOM 0 HD21 LEU A 48 27.762 2.041 -15.188 1.00 0.00 H new ATOM 0 HD22 LEU A 48 28.738 2.862 -13.947 1.00 0.00 H new ATOM 0 HD23 LEU A 48 28.857 1.098 -14.150 1.00 0.00 H new ATOM 782 N ARG A 49 28.868 0.071 -9.131 1.00 0.00 N ATOM 783 CA ARG A 49 29.731 0.116 -7.959 1.00 0.00 C ATOM 784 C ARG A 49 30.787 -0.983 -8.057 1.00 0.00 C ATOM 785 O ARG A 49 30.447 -2.136 -8.316 1.00 0.00 O ATOM 786 CB ARG A 49 28.900 -0.123 -6.695 1.00 0.00 C ATOM 787 CG ARG A 49 27.905 1.002 -6.403 1.00 0.00 C ATOM 788 CD ARG A 49 26.805 0.458 -5.488 1.00 0.00 C ATOM 789 NE ARG A 49 25.747 1.448 -5.253 1.00 0.00 N ATOM 790 CZ ARG A 49 24.538 1.137 -4.762 1.00 0.00 C ATOM 791 NH1 ARG A 49 24.222 -0.124 -4.467 1.00 0.00 N1+ ATOM 792 NH2 ARG A 49 23.628 2.092 -4.560 1.00 0.00 N ATOM 0 H ARG A 49 27.918 -0.247 -8.940 1.00 0.00 H new ATOM 0 HA ARG A 49 30.210 1.094 -7.912 1.00 0.00 H new ATOM 0 HB2 ARG A 49 28.356 -1.062 -6.798 1.00 0.00 H new ATOM 0 HB3 ARG A 49 29.571 -0.235 -5.843 1.00 0.00 H new ATOM 0 HG2 ARG A 49 28.412 1.841 -5.927 1.00 0.00 H new ATOM 0 HG3 ARG A 49 27.474 1.376 -7.332 1.00 0.00 H new ATOM 0 HD2 ARG A 49 26.372 -0.437 -5.934 1.00 0.00 H new ATOM 0 HD3 ARG A 49 27.241 0.160 -4.535 1.00 0.00 H new ATOM 0 HE ARG A 49 25.941 2.424 -5.475 1.00 0.00 H new ATOM 0 HH11 ARG A 49 24.904 -0.868 -4.614 1.00 0.00 H new ATOM 0 HH12 ARG A 49 23.298 -0.345 -4.094 1.00 0.00 H new ATOM 0 HH21 ARG A 49 23.850 3.063 -4.779 1.00 0.00 H new ATOM 0 HH22 ARG A 49 22.710 1.851 -4.186 1.00 0.00 H new ATOM 806 N PRO A 50 32.067 -0.653 -7.854 1.00 0.00 N ATOM 807 CA PRO A 50 33.121 -1.642 -7.720 1.00 0.00 C ATOM 808 C PRO A 50 33.124 -2.221 -6.310 1.00 0.00 C ATOM 809 O PRO A 50 33.945 -3.079 -5.995 1.00 0.00 O ATOM 810 CB PRO A 50 34.408 -0.866 -7.993 1.00 0.00 C ATOM 811 CG PRO A 50 34.087 0.510 -7.413 1.00 0.00 C ATOM 812 CD PRO A 50 32.604 0.691 -7.736 1.00 0.00 C ATOM 0 HA PRO A 50 32.998 -2.484 -8.401 1.00 0.00 H new ATOM 0 HB2 PRO A 50 35.269 -1.322 -7.505 1.00 0.00 H new ATOM 0 HB3 PRO A 50 34.635 -0.816 -9.058 1.00 0.00 H new ATOM 0 HG2 PRO A 50 34.272 0.547 -6.339 1.00 0.00 H new ATOM 0 HG3 PRO A 50 34.696 1.291 -7.869 1.00 0.00 H new ATOM 0 HD2 PRO A 50 32.096 1.249 -6.949 1.00 0.00 H new ATOM 0 HD3 PRO A 50 32.469 1.250 -8.662 1.00 0.00 H new ATOM 820 N SER A 51 32.208 -1.757 -5.453 1.00 0.00 N ATOM 821 CA SER A 51 32.058 -2.299 -4.114 1.00 0.00 C ATOM 822 C SER A 51 31.515 -3.725 -4.169 1.00 0.00 C ATOM 823 O SER A 51 31.327 -4.355 -3.130 1.00 0.00 O ATOM 824 CB SER A 51 31.133 -1.398 -3.296 1.00 0.00 C ATOM 825 OG SER A 51 31.019 -1.906 -1.985 1.00 0.00 O ATOM 0 H SER A 51 31.559 -1.002 -5.673 1.00 0.00 H new ATOM 0 HA SER A 51 33.035 -2.332 -3.632 1.00 0.00 H new ATOM 0 HB2 SER A 51 31.527 -0.382 -3.271 1.00 0.00 H new ATOM 0 HB3 SER A 51 30.150 -1.347 -3.764 1.00 0.00 H new ATOM 0 HG SER A 51 31.154 -2.877 -1.997 1.00 0.00 H new ATOM 831 N VAL A 52 31.266 -4.233 -5.381 1.00 0.00 N ATOM 832 CA VAL A 52 30.864 -5.612 -5.593 1.00 0.00 C ATOM 833 C VAL A 52 31.680 -6.231 -6.723 1.00 0.00 C ATOM 834 O VAL A 52 32.001 -5.570 -7.709 1.00 0.00 O ATOM 835 CB VAL A 52 29.363 -5.725 -5.882 1.00 0.00 C ATOM 836 CG1 VAL A 52 28.653 -6.317 -4.664 1.00 0.00 C ATOM 837 CG2 VAL A 52 28.703 -4.383 -6.220 1.00 0.00 C ATOM 0 H VAL A 52 31.340 -3.690 -6.241 1.00 0.00 H new ATOM 0 HA VAL A 52 31.060 -6.164 -4.674 1.00 0.00 H new ATOM 0 HB VAL A 52 29.266 -6.368 -6.757 1.00 0.00 H new ATOM 0 HG11 VAL A 52 27.585 -6.398 -4.869 1.00 0.00 H new ATOM 0 HG12 VAL A 52 29.058 -7.307 -4.452 1.00 0.00 H new ATOM 0 HG13 VAL A 52 28.809 -5.669 -3.801 1.00 0.00 H new ATOM 0 HG21 VAL A 52 27.641 -4.538 -6.413 1.00 0.00 H new ATOM 0 HG22 VAL A 52 28.823 -3.697 -5.381 1.00 0.00 H new ATOM 0 HG23 VAL A 52 29.175 -3.959 -7.106 1.00 0.00 H new ATOM 847 N ASN A 53 32.010 -7.518 -6.558 1.00 0.00 N ATOM 848 CA ASN A 53 32.855 -8.268 -7.470 1.00 0.00 C ATOM 849 C ASN A 53 32.123 -8.743 -8.725 1.00 0.00 C ATOM 850 O ASN A 53 30.891 -8.801 -8.763 1.00 0.00 O ATOM 851 CB ASN A 53 33.472 -9.453 -6.725 1.00 0.00 C ATOM 852 CG ASN A 53 32.451 -10.397 -6.099 1.00 0.00 C ATOM 853 OD1 ASN A 53 31.160 -10.164 -6.323 1.00 0.00 O flip ATOM 854 ND2 ASN A 53 32.822 -11.341 -5.410 1.00 0.00 N flip ATOM 0 H ASN A 53 31.685 -8.071 -5.765 1.00 0.00 H new ATOM 0 HA ASN A 53 33.636 -7.592 -7.819 1.00 0.00 H new ATOM 0 HB2 ASN A 53 34.096 -10.018 -7.417 1.00 0.00 H new ATOM 0 HB3 ASN A 53 34.128 -9.074 -5.941 1.00 0.00 H new ATOM 0 HD21 ASN A 53 33.818 -11.498 -5.253 1.00 0.00 H new ATOM 0 HD22 ASN A 53 32.135 -11.969 -4.993 1.00 0.00 H new ATOM 861 N THR A 54 32.907 -9.084 -9.752 1.00 0.00 N ATOM 862 CA THR A 54 32.416 -9.511 -11.052 1.00 0.00 C ATOM 863 C THR A 54 31.452 -10.685 -10.941 1.00 0.00 C ATOM 864 O THR A 54 30.561 -10.837 -11.775 1.00 0.00 O ATOM 865 CB THR A 54 33.611 -9.940 -11.907 1.00 0.00 C ATOM 866 OG1 THR A 54 34.267 -11.039 -11.307 1.00 0.00 O ATOM 867 CG2 THR A 54 34.614 -8.798 -12.065 1.00 0.00 C ATOM 0 H THR A 54 33.925 -9.068 -9.694 1.00 0.00 H new ATOM 0 HA THR A 54 31.880 -8.676 -11.503 1.00 0.00 H new ATOM 0 HB THR A 54 33.231 -10.219 -12.890 1.00 0.00 H new ATOM 0 HG1 THR A 54 35.029 -11.308 -11.862 1.00 0.00 H new ATOM 0 HG21 THR A 54 35.452 -9.132 -12.677 1.00 0.00 H new ATOM 0 HG22 THR A 54 34.127 -7.950 -12.548 1.00 0.00 H new ATOM 0 HG23 THR A 54 34.979 -8.496 -11.083 1.00 0.00 H new ATOM 875 N ARG A 55 31.627 -11.519 -9.913 1.00 0.00 N ATOM 876 CA ARG A 55 30.785 -12.687 -9.703 1.00 0.00 C ATOM 877 C ARG A 55 29.328 -12.258 -9.524 1.00 0.00 C ATOM 878 O ARG A 55 28.426 -12.873 -10.092 1.00 0.00 O ATOM 879 CB ARG A 55 31.367 -13.508 -8.540 1.00 0.00 C ATOM 880 CG ARG A 55 30.595 -13.484 -7.215 1.00 0.00 C ATOM 881 CD ARG A 55 29.300 -14.296 -7.258 1.00 0.00 C ATOM 882 NE ARG A 55 29.553 -15.708 -7.559 1.00 0.00 N ATOM 883 CZ ARG A 55 29.074 -16.341 -8.635 1.00 0.00 C ATOM 884 NH1 ARG A 55 28.362 -15.690 -9.556 1.00 0.00 N1+ ATOM 885 NH2 ARG A 55 29.308 -17.643 -8.795 1.00 0.00 N ATOM 0 H ARG A 55 32.355 -11.400 -9.208 1.00 0.00 H new ATOM 0 HA ARG A 55 30.780 -13.343 -10.573 1.00 0.00 H new ATOM 0 HB2 ARG A 55 31.449 -14.545 -8.865 1.00 0.00 H new ATOM 0 HB3 ARG A 55 32.380 -13.153 -8.348 1.00 0.00 H new ATOM 0 HG2 ARG A 55 31.234 -13.873 -6.422 1.00 0.00 H new ATOM 0 HG3 ARG A 55 30.360 -12.451 -6.957 1.00 0.00 H new ATOM 0 HD2 ARG A 55 28.788 -14.215 -6.299 1.00 0.00 H new ATOM 0 HD3 ARG A 55 28.633 -13.877 -8.012 1.00 0.00 H new ATOM 0 HE ARG A 55 30.130 -16.240 -6.908 1.00 0.00 H new ATOM 0 HH11 ARG A 55 28.175 -14.693 -9.446 1.00 0.00 H new ATOM 0 HH12 ARG A 55 28.004 -16.189 -10.371 1.00 0.00 H new ATOM 0 HH21 ARG A 55 29.851 -18.153 -8.098 1.00 0.00 H new ATOM 0 HH22 ARG A 55 28.944 -18.130 -9.614 1.00 0.00 H new ATOM 899 N ARG A 56 29.084 -11.207 -8.736 1.00 0.00 N ATOM 900 CA ARG A 56 27.724 -10.720 -8.540 1.00 0.00 C ATOM 901 C ARG A 56 27.255 -9.929 -9.753 1.00 0.00 C ATOM 902 O ARG A 56 26.067 -9.946 -10.070 1.00 0.00 O ATOM 903 CB ARG A 56 27.608 -9.910 -7.248 1.00 0.00 C ATOM 904 CG ARG A 56 27.815 -10.850 -6.059 1.00 0.00 C ATOM 905 CD ARG A 56 27.493 -10.131 -4.749 1.00 0.00 C ATOM 906 NE ARG A 56 27.812 -10.971 -3.588 1.00 0.00 N ATOM 907 CZ ARG A 56 27.226 -12.142 -3.289 1.00 0.00 C ATOM 908 NH1 ARG A 56 26.252 -12.648 -4.047 1.00 0.00 N1+ ATOM 909 NH2 ARG A 56 27.623 -12.821 -2.210 1.00 0.00 N ATOM 0 H ARG A 56 29.802 -10.686 -8.232 1.00 0.00 H new ATOM 0 HA ARG A 56 27.063 -11.581 -8.436 1.00 0.00 H new ATOM 0 HB2 ARG A 56 28.352 -9.113 -7.234 1.00 0.00 H new ATOM 0 HB3 ARG A 56 26.629 -9.434 -7.187 1.00 0.00 H new ATOM 0 HG2 ARG A 56 27.177 -11.728 -6.166 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.846 -11.205 -6.043 1.00 0.00 H new ATOM 0 HD2 ARG A 56 28.058 -9.201 -4.694 1.00 0.00 H new ATOM 0 HD3 ARG A 56 26.436 -9.864 -4.728 1.00 0.00 H new ATOM 0 HE ARG A 56 28.539 -10.637 -2.956 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.936 -12.144 -4.875 1.00 0.00 H new ATOM 0 HH12 ARG A 56 25.823 -13.539 -3.798 1.00 0.00 H new ATOM 0 HH21 ARG A 56 28.367 -12.450 -1.619 1.00 0.00 H new ATOM 0 HH22 ARG A 56 27.182 -13.711 -1.977 1.00 0.00 H new ATOM 923 N LYS A 57 28.172 -9.238 -10.437 1.00 0.00 N ATOM 924 CA LYS A 57 27.817 -8.572 -11.683 1.00 0.00 C ATOM 925 C LYS A 57 27.317 -9.609 -12.683 1.00 0.00 C ATOM 926 O LYS A 57 26.430 -9.307 -13.475 1.00 0.00 O ATOM 927 CB LYS A 57 29.014 -7.795 -12.232 1.00 0.00 C ATOM 928 CG LYS A 57 29.120 -6.393 -11.624 1.00 0.00 C ATOM 929 CD LYS A 57 29.538 -6.426 -10.154 1.00 0.00 C ATOM 930 CE LYS A 57 29.624 -5.007 -9.601 1.00 0.00 C ATOM 931 NZ LYS A 57 30.873 -4.338 -9.992 1.00 0.00 N1+ ATOM 0 H LYS A 57 29.145 -9.129 -10.152 1.00 0.00 H new ATOM 0 HA LYS A 57 27.018 -7.853 -11.501 1.00 0.00 H new ATOM 0 HB2 LYS A 57 29.930 -8.349 -12.026 1.00 0.00 H new ATOM 0 HB3 LYS A 57 28.927 -7.714 -13.315 1.00 0.00 H new ATOM 0 HG2 LYS A 57 29.843 -5.807 -12.192 1.00 0.00 H new ATOM 0 HG3 LYS A 57 28.159 -5.887 -11.714 1.00 0.00 H new ATOM 0 HD2 LYS A 57 28.819 -7.007 -9.576 1.00 0.00 H new ATOM 0 HD3 LYS A 57 30.503 -6.923 -10.053 1.00 0.00 H new ATOM 0 HE2 LYS A 57 28.774 -4.426 -9.959 1.00 0.00 H new ATOM 0 HE3 LYS A 57 29.554 -5.037 -8.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 30.800 -3.320 -9.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 31.666 -4.742 -9.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 31.038 -4.478 -11.009 1.00 0.00 H new ATOM 945 N LEU A 58 27.879 -10.821 -12.655 1.00 0.00 N ATOM 946 CA LEU A 58 27.454 -11.906 -13.524 1.00 0.00 C ATOM 947 C LEU A 58 26.049 -12.382 -13.158 1.00 0.00 C ATOM 948 O LEU A 58 25.243 -12.648 -14.049 1.00 0.00 O ATOM 949 CB LEU A 58 28.470 -13.044 -13.425 1.00 0.00 C ATOM 950 CG LEU A 58 28.151 -14.190 -14.391 1.00 0.00 C ATOM 951 CD1 LEU A 58 28.425 -13.763 -15.834 1.00 0.00 C ATOM 952 CD2 LEU A 58 29.035 -15.386 -14.037 1.00 0.00 C ATOM 0 H LEU A 58 28.642 -11.071 -12.026 1.00 0.00 H new ATOM 0 HA LEU A 58 27.411 -11.553 -14.554 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.467 -12.658 -13.638 1.00 0.00 H new ATOM 0 HB3 LEU A 58 28.487 -13.426 -12.404 1.00 0.00 H new ATOM 0 HG LEU A 58 27.098 -14.457 -14.302 1.00 0.00 H new ATOM 0 HD11 LEU A 58 28.194 -14.588 -16.508 1.00 0.00 H new ATOM 0 HD12 LEU A 58 27.802 -12.904 -16.084 1.00 0.00 H new ATOM 0 HD13 LEU A 58 29.475 -13.492 -15.940 1.00 0.00 H new ATOM 0 HD21 LEU A 58 28.820 -16.211 -14.716 1.00 0.00 H new ATOM 0 HD22 LEU A 58 30.084 -15.103 -14.130 1.00 0.00 H new ATOM 0 HD23 LEU A 58 28.833 -15.697 -13.012 1.00 0.00 H new ATOM 964 N LEU A 59 25.746 -12.494 -11.857 1.00 0.00 N ATOM 965 CA LEU A 59 24.401 -12.861 -11.427 1.00 0.00 C ATOM 966 C LEU A 59 23.400 -11.853 -11.957 1.00 0.00 C ATOM 967 O LEU A 59 22.433 -12.212 -12.624 1.00 0.00 O ATOM 968 CB LEU A 59 24.306 -12.871 -9.903 1.00 0.00 C ATOM 969 CG LEU A 59 25.276 -13.883 -9.320 1.00 0.00 C ATOM 970 CD1 LEU A 59 25.349 -13.706 -7.803 1.00 0.00 C ATOM 971 CD2 LEU A 59 24.807 -15.295 -9.633 1.00 0.00 C ATOM 0 H LEU A 59 26.408 -12.337 -11.097 1.00 0.00 H new ATOM 0 HA LEU A 59 24.183 -13.856 -11.814 1.00 0.00 H new ATOM 0 HB2 LEU A 59 24.527 -11.878 -9.512 1.00 0.00 H new ATOM 0 HB3 LEU A 59 23.289 -13.115 -9.597 1.00 0.00 H new ATOM 0 HG LEU A 59 26.260 -13.723 -9.760 1.00 0.00 H new ATOM 0 HD11 LEU A 59 26.046 -14.433 -7.385 1.00 0.00 H new ATOM 0 HD12 LEU A 59 25.693 -12.698 -7.570 1.00 0.00 H new ATOM 0 HD13 LEU A 59 24.360 -13.861 -7.371 1.00 0.00 H new ATOM 0 HD21 LEU A 59 25.509 -16.014 -9.211 1.00 0.00 H new ATOM 0 HD22 LEU A 59 23.820 -15.455 -9.200 1.00 0.00 H new ATOM 0 HD23 LEU A 59 24.755 -15.430 -10.713 1.00 0.00 H new ATOM 983 N GLY A 60 23.649 -10.580 -11.649 1.00 0.00 N ATOM 984 CA GLY A 60 22.811 -9.494 -12.124 1.00 0.00 C ATOM 985 C GLY A 60 22.673 -9.467 -13.645 1.00 0.00 C ATOM 986 O GLY A 60 21.630 -9.062 -14.155 1.00 0.00 O ATOM 0 H GLY A 60 24.432 -10.281 -11.068 1.00 0.00 H new ATOM 0 HA2 GLY A 60 21.821 -9.584 -11.677 1.00 0.00 H new ATOM 0 HA3 GLY A 60 23.229 -8.546 -11.786 1.00 0.00 H new ATOM 990 N LEU A 61 23.714 -9.894 -14.364 1.00 0.00 N ATOM 991 CA LEU A 61 23.686 -10.004 -15.812 1.00 0.00 C ATOM 992 C LEU A 61 22.662 -11.068 -16.226 1.00 0.00 C ATOM 993 O LEU A 61 21.797 -10.808 -17.060 1.00 0.00 O ATOM 994 CB LEU A 61 25.102 -10.345 -16.287 1.00 0.00 C ATOM 995 CG LEU A 61 25.410 -9.971 -17.739 1.00 0.00 C ATOM 996 CD1 LEU A 61 26.820 -10.451 -18.066 1.00 0.00 C ATOM 997 CD2 LEU A 61 24.450 -10.613 -18.733 1.00 0.00 C ATOM 0 H LEU A 61 24.603 -10.173 -13.949 1.00 0.00 H new ATOM 0 HA LEU A 61 23.379 -9.067 -16.277 1.00 0.00 H new ATOM 0 HB2 LEU A 61 25.817 -9.839 -15.639 1.00 0.00 H new ATOM 0 HB3 LEU A 61 25.262 -11.416 -16.163 1.00 0.00 H new ATOM 0 HG LEU A 61 25.307 -8.890 -17.829 1.00 0.00 H new ATOM 0 HD11 LEU A 61 27.061 -10.195 -19.098 1.00 0.00 H new ATOM 0 HD12 LEU A 61 27.533 -9.970 -17.396 1.00 0.00 H new ATOM 0 HD13 LEU A 61 26.875 -11.532 -17.938 1.00 0.00 H new ATOM 0 HD21 LEU A 61 24.719 -10.311 -19.745 1.00 0.00 H new ATOM 0 HD22 LEU A 61 24.512 -11.698 -18.650 1.00 0.00 H new ATOM 0 HD23 LEU A 61 23.432 -10.290 -18.516 1.00 0.00 H new ATOM 1009 N TYR A 62 22.751 -12.270 -15.645 1.00 0.00 N ATOM 1010 CA TYR A 62 21.808 -13.347 -15.929 1.00 0.00 C ATOM 1011 C TYR A 62 20.400 -12.957 -15.488 1.00 0.00 C ATOM 1012 O TYR A 62 19.426 -13.292 -16.158 1.00 0.00 O ATOM 1013 CB TYR A 62 22.237 -14.617 -15.190 1.00 0.00 C ATOM 1014 CG TYR A 62 23.558 -15.234 -15.604 1.00 0.00 C ATOM 1015 CD1 TYR A 62 24.218 -16.087 -14.709 1.00 0.00 C ATOM 1016 CD2 TYR A 62 24.118 -14.972 -16.866 1.00 0.00 C ATOM 1017 CE1 TYR A 62 25.426 -16.698 -15.068 1.00 0.00 C ATOM 1018 CE2 TYR A 62 25.326 -15.582 -17.235 1.00 0.00 C ATOM 1019 CZ TYR A 62 25.981 -16.457 -16.342 1.00 0.00 C ATOM 1020 OH TYR A 62 27.145 -17.068 -16.709 1.00 0.00 O ATOM 0 H TYR A 62 23.475 -12.518 -14.970 1.00 0.00 H new ATOM 0 HA TYR A 62 21.804 -13.529 -17.004 1.00 0.00 H new ATOM 0 HB2 TYR A 62 22.287 -14.390 -14.125 1.00 0.00 H new ATOM 0 HB3 TYR A 62 21.456 -15.366 -15.320 1.00 0.00 H new ATOM 0 HD1 TYR A 62 23.792 -16.275 -13.735 1.00 0.00 H new ATOM 0 HD2 TYR A 62 23.619 -14.302 -17.551 1.00 0.00 H new ATOM 0 HE1 TYR A 62 25.931 -17.351 -14.372 1.00 0.00 H new ATOM 0 HE2 TYR A 62 25.756 -15.382 -18.205 1.00 0.00 H new ATOM 0 HH TYR A 62 27.386 -16.793 -17.618 1.00 0.00 H new ATOM 1030 N LEU A 63 20.294 -12.246 -14.362 1.00 0.00 N ATOM 1031 CA LEU A 63 19.020 -11.773 -13.858 1.00 0.00 C ATOM 1032 C LEU A 63 18.389 -10.819 -14.857 1.00 0.00 C ATOM 1033 O LEU A 63 17.219 -10.972 -15.201 1.00 0.00 O ATOM 1034 CB LEU A 63 19.244 -11.084 -12.513 1.00 0.00 C ATOM 1035 CG LEU A 63 17.968 -10.456 -11.958 1.00 0.00 C ATOM 1036 CD1 LEU A 63 16.849 -11.486 -11.834 1.00 0.00 C ATOM 1037 CD2 LEU A 63 18.275 -9.907 -10.569 1.00 0.00 C ATOM 0 H LEU A 63 21.092 -11.987 -13.782 1.00 0.00 H new ATOM 0 HA LEU A 63 18.339 -12.613 -13.718 1.00 0.00 H new ATOM 0 HB2 LEU A 63 19.629 -11.809 -11.797 1.00 0.00 H new ATOM 0 HB3 LEU A 63 20.005 -10.312 -12.626 1.00 0.00 H new ATOM 0 HG LEU A 63 17.639 -9.670 -12.638 1.00 0.00 H new ATOM 0 HD11 LEU A 63 15.955 -11.006 -11.436 1.00 0.00 H new ATOM 0 HD12 LEU A 63 16.629 -11.905 -12.816 1.00 0.00 H new ATOM 0 HD13 LEU A 63 17.162 -12.284 -11.161 1.00 0.00 H new ATOM 0 HD21 LEU A 63 17.377 -9.452 -10.151 1.00 0.00 H new ATOM 0 HD22 LEU A 63 18.606 -10.719 -9.922 1.00 0.00 H new ATOM 0 HD23 LEU A 63 19.062 -9.156 -10.640 1.00 0.00 H new ATOM 1049 N MET A 64 19.166 -9.838 -15.322 1.00 0.00 N ATOM 1050 CA MET A 64 18.678 -8.903 -16.314 1.00 0.00 C ATOM 1051 C MET A 64 18.205 -9.679 -17.534 1.00 0.00 C ATOM 1052 O MET A 64 17.119 -9.424 -18.049 1.00 0.00 O ATOM 1053 CB MET A 64 19.800 -7.935 -16.713 1.00 0.00 C ATOM 1054 CG MET A 64 19.408 -7.086 -17.931 1.00 0.00 C ATOM 1055 SD MET A 64 20.790 -6.419 -18.894 1.00 0.00 S ATOM 1056 CE MET A 64 21.571 -7.963 -19.426 1.00 0.00 C ATOM 0 H MET A 64 20.128 -9.679 -15.024 1.00 0.00 H new ATOM 0 HA MET A 64 17.849 -8.328 -15.901 1.00 0.00 H new ATOM 0 HB2 MET A 64 20.033 -7.281 -15.873 1.00 0.00 H new ATOM 0 HB3 MET A 64 20.705 -8.499 -16.938 1.00 0.00 H new ATOM 0 HG2 MET A 64 18.788 -7.693 -18.591 1.00 0.00 H new ATOM 0 HG3 MET A 64 18.791 -6.255 -17.589 1.00 0.00 H new ATOM 0 HE1 MET A 64 21.996 -7.832 -20.421 1.00 0.00 H new ATOM 0 HE2 MET A 64 22.362 -8.231 -18.726 1.00 0.00 H new ATOM 0 HE3 MET A 64 20.825 -8.758 -19.452 1.00 0.00 H new ATOM 1066 N ASN A 65 19.031 -10.629 -17.987 1.00 0.00 N ATOM 1067 CA ASN A 65 18.761 -11.400 -19.184 1.00 0.00 C ATOM 1068 C ASN A 65 17.411 -12.110 -19.099 1.00 0.00 C ATOM 1069 O ASN A 65 16.610 -11.994 -20.025 1.00 0.00 O ATOM 1070 CB ASN A 65 19.902 -12.398 -19.387 1.00 0.00 C ATOM 1071 CG ASN A 65 19.746 -13.229 -20.653 1.00 0.00 C ATOM 1072 OD1 ASN A 65 18.921 -12.784 -21.600 1.00 0.00 O flip ATOM 1073 ND2 ASN A 65 20.373 -14.275 -20.778 1.00 0.00 N flip ATOM 0 H ASN A 65 19.906 -10.878 -17.525 1.00 0.00 H new ATOM 0 HA ASN A 65 18.705 -10.730 -20.042 1.00 0.00 H new ATOM 0 HB2 ASN A 65 20.848 -11.857 -19.428 1.00 0.00 H new ATOM 0 HB3 ASN A 65 19.953 -13.064 -18.526 1.00 0.00 H new ATOM 0 HD21 ASN A 65 20.997 -14.588 -20.034 1.00 0.00 H new ATOM 0 HD22 ASN A 65 20.271 -14.832 -21.626 1.00 0.00 H new ATOM 1080 N HIS A 66 17.149 -12.841 -18.008 1.00 0.00 N ATOM 1081 CA HIS A 66 15.900 -13.578 -17.907 1.00 0.00 C ATOM 1082 C HIS A 66 14.716 -12.632 -17.717 1.00 0.00 C ATOM 1083 O HIS A 66 13.638 -12.879 -18.252 1.00 0.00 O ATOM 1084 CB HIS A 66 15.984 -14.616 -16.785 1.00 0.00 C ATOM 1085 CG HIS A 66 15.061 -15.791 -16.995 1.00 0.00 C ATOM 1086 ND1 HIS A 66 14.271 -16.001 -18.088 1.00 0.00 N flip ATOM 1087 CD2 HIS A 66 14.882 -16.848 -16.095 1.00 0.00 C flip ATOM 1088 CE1 HIS A 66 13.614 -17.189 -17.881 1.00 0.00 C flip ATOM 1089 NE2 HIS A 66 13.991 -17.668 -16.683 1.00 0.00 N flip ATOM 0 H HIS A 66 17.772 -12.932 -17.206 1.00 0.00 H new ATOM 0 HA HIS A 66 15.735 -14.111 -18.843 1.00 0.00 H new ATOM 0 HB2 HIS A 66 17.010 -14.977 -16.708 1.00 0.00 H new ATOM 0 HB3 HIS A 66 15.742 -14.137 -15.836 1.00 0.00 H new ATOM 0 HD2 HIS A 66 15.357 -16.978 -15.134 1.00 0.00 H new ATOM 0 HE1 HIS A 66 12.917 -17.656 -18.561 1.00 0.00 H new ATOM 0 HE2 HIS A 66 13.648 -18.537 -16.274 1.00 0.00 H new ATOM 1097 N VAL A 67 14.904 -11.547 -16.965 1.00 0.00 N ATOM 1098 CA VAL A 67 13.859 -10.554 -16.746 1.00 0.00 C ATOM 1099 C VAL A 67 13.382 -9.977 -18.075 1.00 0.00 C ATOM 1100 O VAL A 67 12.185 -9.983 -18.359 1.00 0.00 O ATOM 1101 CB VAL A 67 14.420 -9.448 -15.845 1.00 0.00 C ATOM 1102 CG1 VAL A 67 13.609 -8.157 -15.936 1.00 0.00 C ATOM 1103 CG2 VAL A 67 14.419 -9.916 -14.394 1.00 0.00 C ATOM 0 H VAL A 67 15.783 -11.335 -16.493 1.00 0.00 H new ATOM 0 HA VAL A 67 13.001 -11.021 -16.263 1.00 0.00 H new ATOM 0 HB VAL A 67 15.434 -9.241 -16.189 1.00 0.00 H new ATOM 0 HG11 VAL A 67 14.047 -7.405 -15.279 1.00 0.00 H new ATOM 0 HG12 VAL A 67 13.620 -7.792 -16.963 1.00 0.00 H new ATOM 0 HG13 VAL A 67 12.581 -8.351 -15.630 1.00 0.00 H new ATOM 0 HG21 VAL A 67 14.819 -9.127 -13.757 1.00 0.00 H new ATOM 0 HG22 VAL A 67 13.399 -10.148 -14.087 1.00 0.00 H new ATOM 0 HG23 VAL A 67 15.039 -10.808 -14.299 1.00 0.00 H new ATOM 1113 N VAL A 68 14.306 -9.475 -18.903 1.00 0.00 N ATOM 1114 CA VAL A 68 13.921 -8.851 -20.159 1.00 0.00 C ATOM 1115 C VAL A 68 13.349 -9.887 -21.119 1.00 0.00 C ATOM 1116 O VAL A 68 12.514 -9.550 -21.955 1.00 0.00 O ATOM 1117 CB VAL A 68 15.104 -8.109 -20.777 1.00 0.00 C ATOM 1118 CG1 VAL A 68 15.617 -7.045 -19.811 1.00 0.00 C ATOM 1119 CG2 VAL A 68 16.246 -9.054 -21.160 1.00 0.00 C ATOM 0 H VAL A 68 15.310 -9.491 -18.723 1.00 0.00 H new ATOM 0 HA VAL A 68 13.140 -8.118 -19.958 1.00 0.00 H new ATOM 0 HB VAL A 68 14.747 -7.637 -21.692 1.00 0.00 H new ATOM 0 HG11 VAL A 68 16.461 -6.521 -20.261 1.00 0.00 H new ATOM 0 HG12 VAL A 68 14.820 -6.333 -19.597 1.00 0.00 H new ATOM 0 HG13 VAL A 68 15.937 -7.520 -18.884 1.00 0.00 H new ATOM 0 HG21 VAL A 68 17.064 -8.479 -21.595 1.00 0.00 H new ATOM 0 HG22 VAL A 68 16.601 -9.574 -20.271 1.00 0.00 H new ATOM 0 HG23 VAL A 68 15.887 -9.782 -21.887 1.00 0.00 H new ATOM 1129 N GLN A 69 13.789 -11.143 -21.003 1.00 0.00 N ATOM 1130 CA GLN A 69 13.229 -12.230 -21.789 1.00 0.00 C ATOM 1131 C GLN A 69 11.783 -12.507 -21.394 1.00 0.00 C ATOM 1132 O GLN A 69 10.931 -12.643 -22.270 1.00 0.00 O ATOM 1133 CB GLN A 69 14.074 -13.489 -21.611 1.00 0.00 C ATOM 1134 CG GLN A 69 15.325 -13.415 -22.495 1.00 0.00 C ATOM 1135 CD GLN A 69 16.376 -14.443 -22.089 1.00 0.00 C ATOM 1136 OE1 GLN A 69 16.403 -14.903 -20.954 1.00 0.00 O ATOM 1137 NE2 GLN A 69 17.259 -14.813 -23.018 1.00 0.00 N ATOM 0 H GLN A 69 14.535 -11.426 -20.368 1.00 0.00 H new ATOM 0 HA GLN A 69 13.240 -11.934 -22.838 1.00 0.00 H new ATOM 0 HB2 GLN A 69 14.364 -13.597 -20.566 1.00 0.00 H new ATOM 0 HB3 GLN A 69 13.487 -14.370 -21.871 1.00 0.00 H new ATOM 0 HG2 GLN A 69 15.043 -13.577 -23.535 1.00 0.00 H new ATOM 0 HG3 GLN A 69 15.754 -12.415 -22.433 1.00 0.00 H new ATOM 0 HE21 GLN A 69 17.212 -14.413 -23.955 1.00 0.00 H new ATOM 0 HE22 GLN A 69 17.982 -15.496 -22.791 1.00 0.00 H new ATOM 1146 N GLN A 70 11.483 -12.594 -20.094 1.00 0.00 N ATOM 1147 CA GLN A 70 10.108 -12.836 -19.677 1.00 0.00 C ATOM 1148 C GLN A 70 9.240 -11.631 -20.026 1.00 0.00 C ATOM 1149 O GLN A 70 8.078 -11.791 -20.392 1.00 0.00 O ATOM 1150 CB GLN A 70 10.026 -13.120 -18.173 1.00 0.00 C ATOM 1151 CG GLN A 70 10.809 -14.379 -17.793 1.00 0.00 C ATOM 1152 CD GLN A 70 10.873 -14.570 -16.283 1.00 0.00 C ATOM 1153 OE1 GLN A 70 11.929 -14.868 -15.730 1.00 0.00 O ATOM 1154 NE2 GLN A 70 9.748 -14.401 -15.593 1.00 0.00 N ATOM 0 H GLN A 70 12.157 -12.503 -19.334 1.00 0.00 H new ATOM 0 HA GLN A 70 9.742 -13.714 -20.208 1.00 0.00 H new ATOM 0 HB2 GLN A 70 10.417 -12.267 -17.619 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.983 -13.238 -17.881 1.00 0.00 H new ATOM 0 HG2 GLN A 70 10.340 -15.250 -18.250 1.00 0.00 H new ATOM 0 HG3 GLN A 70 11.820 -14.313 -18.194 1.00 0.00 H new ATOM 0 HE21 GLN A 70 8.885 -14.154 -16.077 1.00 0.00 H new ATOM 0 HE22 GLN A 70 9.749 -14.519 -14.580 1.00 0.00 H new ATOM 1163 N ALA A 71 9.807 -10.424 -19.915 1.00 0.00 N ATOM 1164 CA ALA A 71 9.107 -9.201 -20.270 1.00 0.00 C ATOM 1165 C ALA A 71 8.727 -9.233 -21.746 1.00 0.00 C ATOM 1166 O ALA A 71 7.575 -8.991 -22.099 1.00 0.00 O ATOM 1167 CB ALA A 71 10.020 -8.012 -19.980 1.00 0.00 C ATOM 0 H ALA A 71 10.758 -10.276 -19.578 1.00 0.00 H new ATOM 0 HA ALA A 71 8.193 -9.109 -19.683 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.507 -7.087 -20.242 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.274 -7.998 -18.920 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.932 -8.101 -20.571 1.00 0.00 H new ATOM 1173 N LYS A 72 9.721 -9.536 -22.591 1.00 0.00 N ATOM 1174 CA LYS A 72 9.553 -9.723 -24.025 1.00 0.00 C ATOM 1175 C LYS A 72 8.515 -10.801 -24.325 1.00 0.00 C ATOM 1176 O LYS A 72 7.773 -10.690 -25.299 1.00 0.00 O ATOM 1177 CB LYS A 72 10.915 -10.134 -24.596 1.00 0.00 C ATOM 1178 CG LYS A 72 10.867 -10.494 -26.082 1.00 0.00 C ATOM 1179 CD LYS A 72 10.742 -9.233 -26.936 1.00 0.00 C ATOM 1180 CE LYS A 72 10.690 -9.609 -28.413 1.00 0.00 C ATOM 1181 NZ LYS A 72 10.736 -8.405 -29.256 1.00 0.00 N1+ ATOM 0 H LYS A 72 10.685 -9.659 -22.282 1.00 0.00 H new ATOM 0 HA LYS A 72 9.199 -8.798 -24.480 1.00 0.00 H new ATOM 0 HB2 LYS A 72 11.623 -9.318 -24.450 1.00 0.00 H new ATOM 0 HB3 LYS A 72 11.293 -10.988 -24.035 1.00 0.00 H new ATOM 0 HG2 LYS A 72 11.769 -11.040 -26.359 1.00 0.00 H new ATOM 0 HG3 LYS A 72 10.022 -11.156 -26.275 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.842 -8.684 -26.660 1.00 0.00 H new ATOM 0 HD3 LYS A 72 11.588 -8.572 -26.750 1.00 0.00 H new ATOM 0 HE2 LYS A 72 11.528 -10.262 -28.657 1.00 0.00 H new ATOM 0 HE3 LYS A 72 9.778 -10.169 -28.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 10.514 -8.661 -30.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 10.039 -7.714 -28.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 11.688 -7.988 -29.214 1.00 0.00 H new ATOM 1195 N GLY A 73 8.466 -11.842 -23.486 1.00 0.00 N ATOM 1196 CA GLY A 73 7.560 -12.964 -23.667 1.00 0.00 C ATOM 1197 C GLY A 73 6.100 -12.535 -23.625 1.00 0.00 C ATOM 1198 O GLY A 73 5.361 -12.743 -24.582 1.00 0.00 O ATOM 0 H GLY A 73 9.060 -11.923 -22.661 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.768 -13.447 -24.622 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.742 -13.705 -22.889 1.00 0.00 H new ATOM 1202 N GLN A 74 5.687 -11.932 -22.507 1.00 0.00 N ATOM 1203 CA GLN A 74 4.311 -11.494 -22.328 1.00 0.00 C ATOM 1204 C GLN A 74 4.089 -10.123 -22.962 1.00 0.00 C ATOM 1205 O GLN A 74 3.677 -10.039 -24.115 1.00 0.00 O ATOM 1206 CB GLN A 74 3.912 -11.529 -20.842 1.00 0.00 C ATOM 1207 CG GLN A 74 5.115 -11.263 -19.933 1.00 0.00 C ATOM 1208 CD GLN A 74 4.730 -11.029 -18.481 1.00 0.00 C ATOM 1209 OE1 GLN A 74 3.631 -10.577 -18.174 1.00 0.00 O ATOM 1210 NE2 GLN A 74 5.654 -11.344 -17.576 1.00 0.00 N ATOM 0 H GLN A 74 6.294 -11.738 -21.711 1.00 0.00 H new ATOM 0 HA GLN A 74 3.654 -12.192 -22.847 1.00 0.00 H new ATOM 0 HB2 GLN A 74 3.140 -10.783 -20.654 1.00 0.00 H new ATOM 0 HB3 GLN A 74 3.481 -12.501 -20.602 1.00 0.00 H new ATOM 0 HG2 GLN A 74 5.798 -12.110 -19.989 1.00 0.00 H new ATOM 0 HG3 GLN A 74 5.656 -10.392 -20.303 1.00 0.00 H new ATOM 0 HE21 GLN A 74 6.555 -11.717 -17.875 1.00 0.00 H new ATOM 0 HE22 GLN A 74 5.461 -11.212 -16.583 1.00 0.00 H new ATOM 1219 N LYS A 75 4.359 -9.052 -22.209 1.00 0.00 N ATOM 1220 CA LYS A 75 4.071 -7.692 -22.656 1.00 0.00 C ATOM 1221 C LYS A 75 4.641 -6.620 -21.721 1.00 0.00 C ATOM 1222 O LYS A 75 4.215 -5.469 -21.788 1.00 0.00 O ATOM 1223 CB LYS A 75 2.554 -7.495 -22.835 1.00 0.00 C ATOM 1224 CG LYS A 75 1.666 -8.248 -21.838 1.00 0.00 C ATOM 1225 CD LYS A 75 2.022 -8.015 -20.367 1.00 0.00 C ATOM 1226 CE LYS A 75 1.044 -8.826 -19.517 1.00 0.00 C ATOM 1227 NZ LYS A 75 1.465 -8.869 -18.108 1.00 0.00 N1+ ATOM 0 H LYS A 75 4.780 -9.105 -21.281 1.00 0.00 H new ATOM 0 HA LYS A 75 4.570 -7.567 -23.617 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.333 -6.430 -22.759 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.282 -7.806 -23.844 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.629 -7.952 -21.999 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.729 -9.315 -22.049 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.048 -8.324 -20.168 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.955 -6.955 -20.121 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.048 -8.388 -19.588 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.974 -9.841 -19.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.716 -9.308 -17.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.338 -9.428 -18.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.639 -7.902 -17.768 1.00 0.00 H new ATOM 1241 N ILE A 76 5.595 -6.968 -20.852 1.00 0.00 N ATOM 1242 CA ILE A 76 6.148 -6.011 -19.897 1.00 0.00 C ATOM 1243 C ILE A 76 7.206 -5.143 -20.582 1.00 0.00 C ATOM 1244 O ILE A 76 8.357 -5.096 -20.154 1.00 0.00 O ATOM 1245 CB ILE A 76 6.705 -6.719 -18.652 1.00 0.00 C ATOM 1246 CG1 ILE A 76 5.740 -7.781 -18.108 1.00 0.00 C ATOM 1247 CG2 ILE A 76 6.999 -5.687 -17.559 1.00 0.00 C ATOM 1248 CD1 ILE A 76 4.387 -7.211 -17.681 1.00 0.00 C ATOM 0 H ILE A 76 5.998 -7.903 -20.792 1.00 0.00 H new ATOM 0 HA ILE A 76 5.346 -5.359 -19.551 1.00 0.00 H new ATOM 0 HB ILE A 76 7.623 -7.227 -18.948 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.580 -8.542 -18.872 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.202 -8.278 -17.255 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.394 -6.193 -16.678 1.00 0.00 H new ATOM 0 HG22 ILE A 76 7.733 -4.969 -17.925 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.080 -5.164 -17.296 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.755 -8.016 -17.307 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.536 -6.471 -16.895 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.905 -6.739 -18.537 1.00 0.00 H new ATOM 1260 N ILE A 77 6.815 -4.451 -21.659 1.00 0.00 N ATOM 1261 CA ILE A 77 7.741 -3.647 -22.449 1.00 0.00 C ATOM 1262 C ILE A 77 8.480 -2.617 -21.595 1.00 0.00 C ATOM 1263 O ILE A 77 9.514 -2.102 -22.016 1.00 0.00 O ATOM 1264 CB ILE A 77 6.997 -2.992 -23.621 1.00 0.00 C ATOM 1265 CG1 ILE A 77 5.912 -2.000 -23.172 1.00 0.00 C ATOM 1266 CG2 ILE A 77 6.353 -4.081 -24.483 1.00 0.00 C ATOM 1267 CD1 ILE A 77 6.464 -0.588 -22.992 1.00 0.00 C ATOM 0 H ILE A 77 5.854 -4.435 -22.001 1.00 0.00 H new ATOM 0 HA ILE A 77 8.507 -4.308 -22.854 1.00 0.00 H new ATOM 0 HB ILE A 77 7.736 -2.425 -24.188 1.00 0.00 H new ATOM 0 HG12 ILE A 77 5.109 -1.984 -23.909 1.00 0.00 H new ATOM 0 HG13 ILE A 77 5.476 -2.341 -22.233 1.00 0.00 H new ATOM 0 HG21 ILE A 77 5.824 -3.620 -25.317 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.127 -4.745 -24.868 1.00 0.00 H new ATOM 0 HG23 ILE A 77 5.650 -4.654 -23.879 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.662 0.078 -22.674 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.249 -0.598 -22.236 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.876 -0.235 -23.937 1.00 0.00 H new ATOM 1279 N GLN A 78 7.965 -2.314 -20.399 1.00 0.00 N ATOM 1280 CA GLN A 78 8.592 -1.366 -19.498 1.00 0.00 C ATOM 1281 C GLN A 78 9.941 -1.888 -19.010 1.00 0.00 C ATOM 1282 O GLN A 78 10.862 -1.102 -18.801 1.00 0.00 O ATOM 1283 CB GLN A 78 7.677 -1.109 -18.297 1.00 0.00 C ATOM 1284 CG GLN A 78 6.335 -0.502 -18.708 1.00 0.00 C ATOM 1285 CD GLN A 78 5.374 -1.521 -19.315 1.00 0.00 C ATOM 1286 OE1 GLN A 78 5.560 -2.729 -19.192 1.00 0.00 O ATOM 1287 NE2 GLN A 78 4.329 -1.035 -19.980 1.00 0.00 N ATOM 0 H GLN A 78 7.103 -2.723 -20.037 1.00 0.00 H new ATOM 0 HA GLN A 78 8.756 -0.435 -20.041 1.00 0.00 H new ATOM 0 HB2 GLN A 78 7.503 -2.047 -17.769 1.00 0.00 H new ATOM 0 HB3 GLN A 78 8.178 -0.438 -17.599 1.00 0.00 H new ATOM 0 HG2 GLN A 78 5.867 -0.046 -17.835 1.00 0.00 H new ATOM 0 HG3 GLN A 78 6.510 0.296 -19.429 1.00 0.00 H new ATOM 0 HE21 GLN A 78 4.202 -0.026 -20.064 1.00 0.00 H new ATOM 0 HE22 GLN A 78 3.654 -1.671 -20.405 1.00 0.00 H new ATOM 1296 N PHE A 79 10.064 -3.206 -18.828 1.00 0.00 N ATOM 1297 CA PHE A 79 11.275 -3.799 -18.280 1.00 0.00 C ATOM 1298 C PHE A 79 12.377 -3.914 -19.322 1.00 0.00 C ATOM 1299 O PHE A 79 13.526 -3.587 -19.028 1.00 0.00 O ATOM 1300 CB PHE A 79 10.951 -5.158 -17.661 1.00 0.00 C ATOM 1301 CG PHE A 79 11.099 -5.137 -16.153 1.00 0.00 C ATOM 1302 CD1 PHE A 79 9.987 -4.885 -15.334 1.00 0.00 C ATOM 1303 CD2 PHE A 79 12.354 -5.363 -15.566 1.00 0.00 C ATOM 1304 CE1 PHE A 79 10.136 -4.866 -13.942 1.00 0.00 C ATOM 1305 CE2 PHE A 79 12.495 -5.366 -14.170 1.00 0.00 C ATOM 1306 CZ PHE A 79 11.386 -5.111 -13.359 1.00 0.00 C ATOM 0 H PHE A 79 9.333 -3.880 -19.055 1.00 0.00 H new ATOM 0 HA PHE A 79 11.654 -3.137 -17.501 1.00 0.00 H new ATOM 0 HB2 PHE A 79 9.932 -5.443 -17.923 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.612 -5.916 -18.081 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.018 -4.706 -15.777 1.00 0.00 H new ATOM 0 HD2 PHE A 79 13.216 -5.536 -16.193 1.00 0.00 H new ATOM 0 HE1 PHE A 79 9.282 -4.661 -13.314 1.00 0.00 H new ATOM 0 HE2 PHE A 79 13.458 -5.565 -13.723 1.00 0.00 H new ATOM 0 HZ PHE A 79 11.492 -5.103 -12.284 1.00 0.00 H new ATOM 1316 N GLN A 80 12.052 -4.373 -20.534 1.00 0.00 N ATOM 1317 CA GLN A 80 13.049 -4.474 -21.584 1.00 0.00 C ATOM 1318 C GLN A 80 13.517 -3.077 -21.993 1.00 0.00 C ATOM 1319 O GLN A 80 14.666 -2.916 -22.400 1.00 0.00 O ATOM 1320 CB GLN A 80 12.505 -5.294 -22.756 1.00 0.00 C ATOM 1321 CG GLN A 80 11.245 -4.684 -23.371 1.00 0.00 C ATOM 1322 CD GLN A 80 10.525 -5.702 -24.249 1.00 0.00 C ATOM 1323 OE1 GLN A 80 9.460 -6.197 -23.892 1.00 0.00 O ATOM 1324 NE2 GLN A 80 11.094 -6.027 -25.404 1.00 0.00 N ATOM 0 H GLN A 80 11.116 -4.675 -20.803 1.00 0.00 H new ATOM 0 HA GLN A 80 13.926 -5.007 -21.215 1.00 0.00 H new ATOM 0 HB2 GLN A 80 13.275 -5.378 -23.523 1.00 0.00 H new ATOM 0 HB3 GLN A 80 12.284 -6.305 -22.415 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.577 -4.342 -22.580 1.00 0.00 H new ATOM 0 HG3 GLN A 80 11.511 -3.809 -23.964 1.00 0.00 H new ATOM 0 HE21 GLN A 80 11.980 -5.599 -25.674 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.645 -6.704 -26.021 1.00 0.00 H new ATOM 1333 N ASP A 81 12.645 -2.068 -21.887 1.00 0.00 N ATOM 1334 CA ASP A 81 13.044 -0.685 -22.091 1.00 0.00 C ATOM 1335 C ASP A 81 13.978 -0.246 -20.970 1.00 0.00 C ATOM 1336 O ASP A 81 15.108 0.169 -21.216 1.00 0.00 O ATOM 1337 CB ASP A 81 11.811 0.222 -22.089 1.00 0.00 C ATOM 1338 CG ASP A 81 12.203 1.697 -22.114 1.00 0.00 C ATOM 1339 OD1 ASP A 81 13.216 2.015 -22.773 1.00 0.00 O ATOM 1340 OD2 ASP A 81 11.482 2.490 -21.470 1.00 0.00 O1- ATOM 0 H ASP A 81 11.658 -2.191 -21.660 1.00 0.00 H new ATOM 0 HA ASP A 81 13.555 -0.608 -23.051 1.00 0.00 H new ATOM 0 HB2 ASP A 81 11.189 -0.005 -22.955 1.00 0.00 H new ATOM 0 HB3 ASP A 81 11.210 0.019 -21.203 1.00 0.00 H new ATOM 1345 N SER A 82 13.500 -0.338 -19.725 1.00 0.00 N ATOM 1346 CA SER A 82 14.219 0.190 -18.578 1.00 0.00 C ATOM 1347 C SER A 82 15.609 -0.411 -18.440 1.00 0.00 C ATOM 1348 O SER A 82 16.515 0.277 -17.980 1.00 0.00 O ATOM 1349 CB SER A 82 13.402 -0.029 -17.304 1.00 0.00 C ATOM 1350 OG SER A 82 12.133 0.576 -17.426 1.00 0.00 O ATOM 0 H SER A 82 12.610 -0.778 -19.493 1.00 0.00 H new ATOM 0 HA SER A 82 14.355 1.260 -18.738 1.00 0.00 H new ATOM 0 HB2 SER A 82 13.287 -1.097 -17.117 1.00 0.00 H new ATOM 0 HB3 SER A 82 13.931 0.390 -16.448 1.00 0.00 H new ATOM 0 HG SER A 82 11.455 -0.114 -17.582 1.00 0.00 H new ATOM 1356 N PHE A 83 15.800 -1.673 -18.824 1.00 0.00 N ATOM 1357 CA PHE A 83 17.129 -2.255 -18.782 1.00 0.00 C ATOM 1358 C PHE A 83 17.893 -2.013 -20.076 1.00 0.00 C ATOM 1359 O PHE A 83 19.097 -1.776 -20.023 1.00 0.00 O ATOM 1360 CB PHE A 83 17.049 -3.748 -18.463 1.00 0.00 C ATOM 1361 CG PHE A 83 16.649 -4.110 -17.043 1.00 0.00 C ATOM 1362 CD1 PHE A 83 16.540 -5.462 -16.686 1.00 0.00 C ATOM 1363 CD2 PHE A 83 16.394 -3.123 -16.077 1.00 0.00 C ATOM 1364 CE1 PHE A 83 16.213 -5.828 -15.373 1.00 0.00 C ATOM 1365 CE2 PHE A 83 16.054 -3.488 -14.767 1.00 0.00 C ATOM 1366 CZ PHE A 83 15.971 -4.840 -14.410 1.00 0.00 C ATOM 0 H PHE A 83 15.065 -2.296 -19.160 1.00 0.00 H new ATOM 0 HA PHE A 83 17.683 -1.760 -17.985 1.00 0.00 H new ATOM 0 HB2 PHE A 83 16.335 -4.207 -19.147 1.00 0.00 H new ATOM 0 HB3 PHE A 83 18.021 -4.195 -18.670 1.00 0.00 H new ATOM 0 HD1 PHE A 83 16.709 -6.227 -17.429 1.00 0.00 H new ATOM 0 HD2 PHE A 83 16.460 -2.079 -16.344 1.00 0.00 H new ATOM 0 HE1 PHE A 83 16.148 -6.872 -15.104 1.00 0.00 H new ATOM 0 HE2 PHE A 83 15.855 -2.724 -14.030 1.00 0.00 H new ATOM 0 HZ PHE A 83 15.722 -5.119 -13.397 1.00 0.00 H new ATOM 1376 N GLY A 84 17.233 -2.065 -21.234 1.00 0.00 N ATOM 1377 CA GLY A 84 17.919 -1.814 -22.488 1.00 0.00 C ATOM 1378 C GLY A 84 18.477 -0.395 -22.532 1.00 0.00 C ATOM 1379 O GLY A 84 19.573 -0.172 -23.038 1.00 0.00 O ATOM 0 H GLY A 84 16.239 -2.276 -21.323 1.00 0.00 H new ATOM 0 HA2 GLY A 84 18.730 -2.531 -22.613 1.00 0.00 H new ATOM 0 HA3 GLY A 84 17.230 -1.964 -23.320 1.00 0.00 H new ATOM 1383 N LYS A 85 17.723 0.569 -22.001 1.00 0.00 N ATOM 1384 CA LYS A 85 18.099 1.973 -22.053 1.00 0.00 C ATOM 1385 C LYS A 85 19.384 2.262 -21.289 1.00 0.00 C ATOM 1386 O LYS A 85 20.142 3.153 -21.666 1.00 0.00 O ATOM 1387 CB LYS A 85 16.917 2.803 -21.561 1.00 0.00 C ATOM 1388 CG LYS A 85 16.870 2.939 -20.045 1.00 0.00 C ATOM 1389 CD LYS A 85 15.665 3.779 -19.617 1.00 0.00 C ATOM 1390 CE LYS A 85 14.424 3.227 -20.314 1.00 0.00 C ATOM 1391 NZ LYS A 85 13.172 3.789 -19.784 1.00 0.00 N1+ ATOM 0 H LYS A 85 16.838 0.394 -21.525 1.00 0.00 H new ATOM 0 HA LYS A 85 18.326 2.250 -23.083 1.00 0.00 H new ATOM 0 HB2 LYS A 85 16.968 3.796 -22.007 1.00 0.00 H new ATOM 0 HB3 LYS A 85 15.990 2.345 -21.907 1.00 0.00 H new ATOM 0 HG2 LYS A 85 16.813 1.951 -19.587 1.00 0.00 H new ATOM 0 HG3 LYS A 85 17.789 3.403 -19.687 1.00 0.00 H new ATOM 0 HD2 LYS A 85 15.541 3.741 -18.535 1.00 0.00 H new ATOM 0 HD3 LYS A 85 15.817 4.825 -19.884 1.00 0.00 H new ATOM 0 HE2 LYS A 85 14.488 3.439 -21.381 1.00 0.00 H new ATOM 0 HE3 LYS A 85 14.404 2.143 -20.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 12.369 3.209 -20.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.206 3.793 -18.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 13.055 4.763 -20.130 1.00 0.00 H new ATOM 1405 N VAL A 86 19.633 1.509 -20.213 1.00 0.00 N ATOM 1406 CA VAL A 86 20.844 1.650 -19.418 1.00 0.00 C ATOM 1407 C VAL A 86 21.929 0.674 -19.880 1.00 0.00 C ATOM 1408 O VAL A 86 23.100 0.861 -19.557 1.00 0.00 O ATOM 1409 CB VAL A 86 20.494 1.441 -17.933 1.00 0.00 C ATOM 1410 CG1 VAL A 86 19.431 2.452 -17.491 1.00 0.00 C ATOM 1411 CG2 VAL A 86 19.955 0.038 -17.673 1.00 0.00 C ATOM 0 H VAL A 86 18.998 0.787 -19.874 1.00 0.00 H new ATOM 0 HA VAL A 86 21.248 2.653 -19.552 1.00 0.00 H new ATOM 0 HB VAL A 86 21.414 1.580 -17.366 1.00 0.00 H new ATOM 0 HG11 VAL A 86 19.193 2.293 -16.439 1.00 0.00 H new ATOM 0 HG12 VAL A 86 19.812 3.464 -17.628 1.00 0.00 H new ATOM 0 HG13 VAL A 86 18.531 2.319 -18.091 1.00 0.00 H new ATOM 0 HG21 VAL A 86 19.720 -0.071 -16.614 1.00 0.00 H new ATOM 0 HG22 VAL A 86 19.053 -0.120 -18.264 1.00 0.00 H new ATOM 0 HG23 VAL A 86 20.707 -0.699 -17.955 1.00 0.00 H new ATOM 1421 N ALA A 87 21.547 -0.364 -20.634 1.00 0.00 N ATOM 1422 CA ALA A 87 22.425 -1.460 -21.020 1.00 0.00 C ATOM 1423 C ALA A 87 23.692 -1.035 -21.753 1.00 0.00 C ATOM 1424 O ALA A 87 24.743 -1.605 -21.478 1.00 0.00 O ATOM 1425 CB ALA A 87 21.634 -2.430 -21.891 1.00 0.00 C ATOM 0 H ALA A 87 20.599 -0.461 -20.997 1.00 0.00 H new ATOM 0 HA ALA A 87 22.766 -1.925 -20.095 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.277 -3.258 -22.190 1.00 0.00 H new ATOM 0 HB2 ALA A 87 20.784 -2.815 -21.327 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.275 -1.911 -22.780 1.00 0.00 H new ATOM 1431 N ALA A 88 23.640 -0.062 -22.669 1.00 0.00 N ATOM 1432 CA ALA A 88 24.833 0.319 -23.408 1.00 0.00 C ATOM 1433 C ALA A 88 25.970 0.722 -22.466 1.00 0.00 C ATOM 1434 O ALA A 88 27.085 0.214 -22.593 1.00 0.00 O ATOM 1435 CB ALA A 88 24.480 1.438 -24.380 1.00 0.00 C ATOM 0 H ALA A 88 22.799 0.463 -22.908 1.00 0.00 H new ATOM 0 HA ALA A 88 25.194 -0.539 -23.975 1.00 0.00 H new ATOM 0 HB1 ALA A 88 25.370 1.729 -24.938 1.00 0.00 H new ATOM 0 HB2 ALA A 88 23.715 1.090 -25.073 1.00 0.00 H new ATOM 0 HB3 ALA A 88 24.103 2.297 -23.825 1.00 0.00 H new ATOM 1441 N GLU A 89 25.698 1.628 -21.522 1.00 0.00 N ATOM 1442 CA GLU A 89 26.696 2.044 -20.548 1.00 0.00 C ATOM 1443 C GLU A 89 26.967 0.921 -19.557 1.00 0.00 C ATOM 1444 O GLU A 89 28.117 0.536 -19.352 1.00 0.00 O ATOM 1445 CB GLU A 89 26.192 3.269 -19.790 1.00 0.00 C ATOM 1446 CG GLU A 89 27.136 3.639 -18.639 1.00 0.00 C ATOM 1447 CD GLU A 89 28.512 4.089 -19.120 1.00 0.00 C ATOM 1448 OE1 GLU A 89 29.443 4.036 -18.287 1.00 0.00 O ATOM 1449 OE2 GLU A 89 28.612 4.478 -20.305 1.00 0.00 O1- ATOM 0 H GLU A 89 24.792 2.084 -21.417 1.00 0.00 H new ATOM 0 HA GLU A 89 27.619 2.287 -21.075 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.103 4.112 -20.475 1.00 0.00 H new ATOM 0 HB3 GLU A 89 25.195 3.071 -19.396 1.00 0.00 H new ATOM 0 HG2 GLU A 89 26.685 4.436 -18.048 1.00 0.00 H new ATOM 0 HG3 GLU A 89 27.251 2.779 -17.979 1.00 0.00 H new ATOM 1456 N VAL A 90 25.896 0.406 -18.949 1.00 0.00 N ATOM 1457 CA VAL A 90 25.996 -0.620 -17.926 1.00 0.00 C ATOM 1458 C VAL A 90 26.763 -1.841 -18.418 1.00 0.00 C ATOM 1459 O VAL A 90 27.793 -2.172 -17.840 1.00 0.00 O ATOM 1460 CB VAL A 90 24.602 -1.002 -17.432 1.00 0.00 C ATOM 1461 CG1 VAL A 90 24.698 -2.217 -16.513 1.00 0.00 C ATOM 1462 CG2 VAL A 90 24.015 0.160 -16.634 1.00 0.00 C ATOM 0 H VAL A 90 24.939 0.693 -19.156 1.00 0.00 H new ATOM 0 HA VAL A 90 26.563 -0.210 -17.090 1.00 0.00 H new ATOM 0 HB VAL A 90 23.970 -1.232 -18.289 1.00 0.00 H new ATOM 0 HG11 VAL A 90 23.702 -2.487 -16.162 1.00 0.00 H new ATOM 0 HG12 VAL A 90 25.129 -3.055 -17.061 1.00 0.00 H new ATOM 0 HG13 VAL A 90 25.331 -1.978 -15.659 1.00 0.00 H new ATOM 0 HG21 VAL A 90 23.020 -0.108 -16.279 1.00 0.00 H new ATOM 0 HG22 VAL A 90 24.658 0.377 -15.781 1.00 0.00 H new ATOM 0 HG23 VAL A 90 23.948 1.042 -17.271 1.00 0.00 H new ATOM 1472 N LEU A 91 26.292 -2.523 -19.466 1.00 0.00 N ATOM 1473 CA LEU A 91 27.005 -3.683 -19.968 1.00 0.00 C ATOM 1474 C LEU A 91 28.378 -3.243 -20.457 1.00 0.00 C ATOM 1475 O LEU A 91 29.349 -3.983 -20.314 1.00 0.00 O ATOM 1476 CB LEU A 91 26.211 -4.356 -21.087 1.00 0.00 C ATOM 1477 CG LEU A 91 24.833 -4.833 -20.634 1.00 0.00 C ATOM 1478 CD1 LEU A 91 24.062 -5.350 -21.849 1.00 0.00 C ATOM 1479 CD2 LEU A 91 24.919 -5.948 -19.598 1.00 0.00 C ATOM 0 H LEU A 91 25.436 -2.292 -19.970 1.00 0.00 H new ATOM 0 HA LEU A 91 27.128 -4.414 -19.169 1.00 0.00 H new ATOM 0 HB2 LEU A 91 26.094 -3.656 -21.914 1.00 0.00 H new ATOM 0 HB3 LEU A 91 26.777 -5.206 -21.467 1.00 0.00 H new ATOM 0 HG LEU A 91 24.324 -3.986 -20.173 1.00 0.00 H new ATOM 0 HD11 LEU A 91 23.076 -5.693 -21.535 1.00 0.00 H new ATOM 0 HD12 LEU A 91 23.952 -4.548 -22.578 1.00 0.00 H new ATOM 0 HD13 LEU A 91 24.608 -6.178 -22.301 1.00 0.00 H new ATOM 0 HD21 LEU A 91 23.914 -6.253 -19.307 1.00 0.00 H new ATOM 0 HD22 LEU A 91 25.448 -6.801 -20.024 1.00 0.00 H new ATOM 0 HD23 LEU A 91 25.457 -5.589 -18.721 1.00 0.00 H new ATOM 1491 N GLY A 92 28.466 -2.038 -21.033 1.00 0.00 N ATOM 1492 CA GLY A 92 29.729 -1.480 -21.476 1.00 0.00 C ATOM 1493 C GLY A 92 30.734 -1.409 -20.335 1.00 0.00 C ATOM 1494 O GLY A 92 31.921 -1.601 -20.572 1.00 0.00 O ATOM 0 H GLY A 92 27.662 -1.433 -21.200 1.00 0.00 H new ATOM 0 HA2 GLY A 92 30.135 -2.090 -22.283 1.00 0.00 H new ATOM 0 HA3 GLY A 92 29.565 -0.482 -21.882 1.00 0.00 H new ATOM 1498 N ARG A 93 30.260 -1.140 -19.114 1.00 0.00 N ATOM 1499 CA ARG A 93 31.075 -1.140 -17.909 1.00 0.00 C ATOM 1500 C ARG A 93 31.458 -2.556 -17.488 1.00 0.00 C ATOM 1501 O ARG A 93 32.573 -2.753 -17.009 1.00 0.00 O ATOM 1502 CB ARG A 93 30.263 -0.469 -16.796 1.00 0.00 C ATOM 1503 CG ARG A 93 30.448 1.046 -16.815 1.00 0.00 C ATOM 1504 CD ARG A 93 31.691 1.475 -16.028 1.00 0.00 C ATOM 1505 NE ARG A 93 31.588 1.118 -14.601 1.00 0.00 N ATOM 1506 CZ ARG A 93 32.100 0.013 -14.039 1.00 0.00 C ATOM 1507 NH1 ARG A 93 32.805 -0.868 -14.747 1.00 0.00 N1+ ATOM 1508 NH2 ARG A 93 31.922 -0.245 -12.741 1.00 0.00 N ATOM 0 H ARG A 93 29.281 -0.913 -18.939 1.00 0.00 H new ATOM 0 HA ARG A 93 32.002 -0.599 -18.101 1.00 0.00 H new ATOM 0 HB2 ARG A 93 29.207 -0.711 -16.916 1.00 0.00 H new ATOM 0 HB3 ARG A 93 30.572 -0.864 -15.828 1.00 0.00 H new ATOM 0 HG2 ARG A 93 30.534 1.389 -17.846 1.00 0.00 H new ATOM 0 HG3 ARG A 93 29.566 1.526 -16.392 1.00 0.00 H new ATOM 0 HD2 ARG A 93 32.574 1.002 -16.458 1.00 0.00 H new ATOM 0 HD3 ARG A 93 31.828 2.552 -16.124 1.00 0.00 H new ATOM 0 HE ARG A 93 31.086 1.764 -13.992 1.00 0.00 H new ATOM 0 HH11 ARG A 93 32.967 -0.710 -15.742 1.00 0.00 H new ATOM 0 HH12 ARG A 93 33.183 -1.700 -14.294 1.00 0.00 H new ATOM 0 HH21 ARG A 93 31.390 0.403 -12.161 1.00 0.00 H new ATOM 0 HH22 ARG A 93 32.318 -1.090 -12.330 1.00 0.00 H new ATOM 1522 N ILE A 94 30.560 -3.534 -17.660 1.00 0.00 N ATOM 1523 CA ILE A 94 30.832 -4.902 -17.237 1.00 0.00 C ATOM 1524 C ILE A 94 32.042 -5.452 -17.976 1.00 0.00 C ATOM 1525 O ILE A 94 32.918 -6.060 -17.362 1.00 0.00 O ATOM 1526 CB ILE A 94 29.616 -5.801 -17.476 1.00 0.00 C ATOM 1527 CG1 ILE A 94 28.400 -5.208 -16.781 1.00 0.00 C ATOM 1528 CG2 ILE A 94 29.871 -7.200 -16.918 1.00 0.00 C ATOM 1529 CD1 ILE A 94 27.177 -6.099 -16.993 1.00 0.00 C ATOM 0 H ILE A 94 29.644 -3.399 -18.088 1.00 0.00 H new ATOM 0 HA ILE A 94 31.044 -4.890 -16.168 1.00 0.00 H new ATOM 0 HB ILE A 94 29.439 -5.868 -18.549 1.00 0.00 H new ATOM 0 HG12 ILE A 94 28.599 -5.101 -15.715 1.00 0.00 H new ATOM 0 HG13 ILE A 94 28.202 -4.209 -17.170 1.00 0.00 H new ATOM 0 HG21 ILE A 94 28.997 -7.827 -17.096 1.00 0.00 H new ATOM 0 HG22 ILE A 94 30.738 -7.637 -17.413 1.00 0.00 H new ATOM 0 HG23 ILE A 94 30.060 -7.135 -15.846 1.00 0.00 H new ATOM 0 HD11 ILE A 94 26.316 -5.660 -16.489 1.00 0.00 H new ATOM 0 HD12 ILE A 94 26.969 -6.184 -18.060 1.00 0.00 H new ATOM 0 HD13 ILE A 94 27.373 -7.089 -16.581 1.00 0.00 H new ATOM 1541 N ASN A 95 32.103 -5.242 -19.294 1.00 0.00 N ATOM 1542 CA ASN A 95 33.258 -5.674 -20.061 1.00 0.00 C ATOM 1543 C ASN A 95 34.563 -5.043 -19.579 1.00 0.00 C ATOM 1544 O ASN A 95 35.630 -5.530 -19.945 1.00 0.00 O ATOM 1545 CB ASN A 95 33.071 -5.318 -21.538 1.00 0.00 C ATOM 1546 CG ASN A 95 32.595 -6.490 -22.376 1.00 0.00 C ATOM 1547 OD1 ASN A 95 32.123 -7.497 -21.858 1.00 0.00 O ATOM 1548 ND2 ASN A 95 32.724 -6.357 -23.694 1.00 0.00 N ATOM 0 H ASN A 95 31.374 -4.782 -19.839 1.00 0.00 H new ATOM 0 HA ASN A 95 33.330 -6.753 -19.922 1.00 0.00 H new ATOM 0 HB2 ASN A 95 32.352 -4.503 -21.621 1.00 0.00 H new ATOM 0 HB3 ASN A 95 34.016 -4.951 -21.940 1.00 0.00 H new ATOM 0 HD21 ASN A 95 32.425 -7.110 -24.314 1.00 0.00 H new ATOM 0 HD22 ASN A 95 33.122 -5.503 -24.084 1.00 0.00 H new ATOM 1555 N GLN A 96 34.517 -3.977 -18.773 1.00 0.00 N ATOM 1556 CA GLN A 96 35.740 -3.301 -18.354 1.00 0.00 C ATOM 1557 C GLN A 96 36.238 -3.821 -17.013 1.00 0.00 C ATOM 1558 O GLN A 96 37.301 -3.414 -16.552 1.00 0.00 O ATOM 1559 CB GLN A 96 35.533 -1.786 -18.310 1.00 0.00 C ATOM 1560 CG GLN A 96 34.878 -1.332 -19.607 1.00 0.00 C ATOM 1561 CD GLN A 96 34.708 0.178 -19.678 1.00 0.00 C ATOM 1562 OE1 GLN A 96 35.487 0.933 -19.105 1.00 0.00 O ATOM 1563 NE2 GLN A 96 33.675 0.627 -20.389 1.00 0.00 N ATOM 0 H GLN A 96 33.657 -3.571 -18.404 1.00 0.00 H new ATOM 0 HA GLN A 96 36.509 -3.521 -19.094 1.00 0.00 H new ATOM 0 HB2 GLN A 96 34.907 -1.517 -17.459 1.00 0.00 H new ATOM 0 HB3 GLN A 96 36.489 -1.280 -18.175 1.00 0.00 H new ATOM 0 HG2 GLN A 96 35.481 -1.666 -20.451 1.00 0.00 H new ATOM 0 HG3 GLN A 96 33.903 -1.809 -19.704 1.00 0.00 H new ATOM 0 HE21 GLN A 96 33.049 -0.032 -20.851 1.00 0.00 H new ATOM 0 HE22 GLN A 96 33.510 1.630 -20.471 1.00 0.00 H new ATOM 1572 N GLU A 97 35.472 -4.718 -16.390 1.00 0.00 N ATOM 1573 CA GLU A 97 35.865 -5.318 -15.128 1.00 0.00 C ATOM 1574 C GLU A 97 35.749 -6.840 -15.154 1.00 0.00 C ATOM 1575 O GLU A 97 36.254 -7.503 -14.251 1.00 0.00 O ATOM 1576 CB GLU A 97 35.061 -4.666 -14.004 1.00 0.00 C ATOM 1577 CG GLU A 97 33.561 -4.962 -14.085 1.00 0.00 C ATOM 1578 CD GLU A 97 32.786 -4.112 -13.078 1.00 0.00 C ATOM 1579 OE1 GLU A 97 31.947 -4.702 -12.361 1.00 0.00 O ATOM 1580 OE2 GLU A 97 33.040 -2.887 -13.031 1.00 0.00 O1- ATOM 0 H GLU A 97 34.573 -5.042 -16.746 1.00 0.00 H new ATOM 0 HA GLU A 97 36.923 -5.128 -14.945 1.00 0.00 H new ATOM 0 HB2 GLU A 97 35.442 -5.014 -13.044 1.00 0.00 H new ATOM 0 HB3 GLU A 97 35.214 -3.587 -14.035 1.00 0.00 H new ATOM 0 HG2 GLU A 97 33.200 -4.760 -15.093 1.00 0.00 H new ATOM 0 HG3 GLU A 97 33.383 -6.019 -13.889 1.00 0.00 H new ATOM 1587 N PHE A 98 35.093 -7.407 -16.173 1.00 0.00 N ATOM 1588 CA PHE A 98 35.052 -8.852 -16.345 1.00 0.00 C ATOM 1589 C PHE A 98 36.360 -9.354 -16.956 1.00 0.00 C ATOM 1590 O PHE A 98 36.992 -8.648 -17.741 1.00 0.00 O ATOM 1591 CB PHE A 98 33.897 -9.255 -17.261 1.00 0.00 C ATOM 1592 CG PHE A 98 32.558 -9.471 -16.595 1.00 0.00 C ATOM 1593 CD1 PHE A 98 32.316 -9.036 -15.284 1.00 0.00 C ATOM 1594 CD2 PHE A 98 31.550 -10.134 -17.311 1.00 0.00 C ATOM 1595 CE1 PHE A 98 31.078 -9.297 -14.687 1.00 0.00 C ATOM 1596 CE2 PHE A 98 30.316 -10.398 -16.709 1.00 0.00 C ATOM 1597 CZ PHE A 98 30.079 -9.979 -15.394 1.00 0.00 C ATOM 0 H PHE A 98 34.586 -6.883 -16.886 1.00 0.00 H new ATOM 0 HA PHE A 98 34.909 -9.299 -15.361 1.00 0.00 H new ATOM 0 HB2 PHE A 98 33.780 -8.484 -18.023 1.00 0.00 H new ATOM 0 HB3 PHE A 98 34.174 -10.174 -17.777 1.00 0.00 H new ATOM 0 HD1 PHE A 98 33.081 -8.503 -14.739 1.00 0.00 H new ATOM 0 HD2 PHE A 98 31.728 -10.442 -18.331 1.00 0.00 H new ATOM 0 HE1 PHE A 98 30.891 -8.971 -13.675 1.00 0.00 H new ATOM 0 HE2 PHE A 98 29.548 -10.924 -17.257 1.00 0.00 H new ATOM 0 HZ PHE A 98 29.127 -10.181 -14.925 1.00 0.00 H new ATOM 1607 N PRO A 99 36.772 -10.577 -16.599 1.00 0.00 N ATOM 1608 CA PRO A 99 37.856 -11.275 -17.254 1.00 0.00 C ATOM 1609 C PRO A 99 37.361 -11.723 -18.622 1.00 0.00 C ATOM 1610 O PRO A 99 36.154 -11.823 -18.840 1.00 0.00 O ATOM 1611 CB PRO A 99 38.173 -12.466 -16.350 1.00 0.00 C ATOM 1612 CG PRO A 99 36.811 -12.772 -15.727 1.00 0.00 C ATOM 1613 CD PRO A 99 36.207 -11.384 -15.537 1.00 0.00 C ATOM 0 HA PRO A 99 38.748 -10.667 -17.404 1.00 0.00 H new ATOM 0 HB2 PRO A 99 38.562 -13.313 -16.915 1.00 0.00 H new ATOM 0 HB3 PRO A 99 38.919 -12.217 -15.595 1.00 0.00 H new ATOM 0 HG2 PRO A 99 36.198 -13.394 -16.380 1.00 0.00 H new ATOM 0 HG3 PRO A 99 36.909 -13.303 -14.780 1.00 0.00 H new ATOM 0 HD2 PRO A 99 35.119 -11.415 -15.602 1.00 0.00 H new ATOM 0 HD3 PRO A 99 36.456 -10.977 -14.557 1.00 0.00 H new ATOM 1621 N ARG A 100 38.278 -11.998 -19.553 1.00 0.00 N ATOM 1622 CA ARG A 100 37.896 -12.343 -20.914 1.00 0.00 C ATOM 1623 C ARG A 100 36.946 -13.539 -20.959 1.00 0.00 C ATOM 1624 O ARG A 100 36.222 -13.705 -21.936 1.00 0.00 O ATOM 1625 CB ARG A 100 39.153 -12.605 -21.755 1.00 0.00 C ATOM 1626 CG ARG A 100 40.103 -11.403 -21.789 1.00 0.00 C ATOM 1627 CD ARG A 100 39.351 -10.114 -22.127 1.00 0.00 C ATOM 1628 NE ARG A 100 40.263 -9.000 -22.412 1.00 0.00 N ATOM 1629 CZ ARG A 100 40.714 -8.673 -23.629 1.00 0.00 C ATOM 1630 NH1 ARG A 100 40.366 -9.382 -24.705 1.00 0.00 N1+ ATOM 1631 NH2 ARG A 100 41.523 -7.627 -23.771 1.00 0.00 N ATOM 0 H ARG A 100 39.284 -11.987 -19.385 1.00 0.00 H new ATOM 0 HA ARG A 100 37.353 -11.497 -21.337 1.00 0.00 H new ATOM 0 HB2 ARG A 100 39.681 -13.469 -21.352 1.00 0.00 H new ATOM 0 HB3 ARG A 100 38.858 -12.858 -22.773 1.00 0.00 H new ATOM 0 HG2 ARG A 100 40.595 -11.297 -20.822 1.00 0.00 H new ATOM 0 HG3 ARG A 100 40.886 -11.575 -22.528 1.00 0.00 H new ATOM 0 HD2 ARG A 100 38.709 -10.286 -22.991 1.00 0.00 H new ATOM 0 HD3 ARG A 100 38.701 -9.845 -21.294 1.00 0.00 H new ATOM 0 HE ARG A 100 40.576 -8.433 -21.624 1.00 0.00 H new ATOM 0 HH11 ARG A 100 39.747 -10.187 -24.607 1.00 0.00 H new ATOM 0 HH12 ARG A 100 40.719 -9.119 -25.625 1.00 0.00 H new ATOM 0 HH21 ARG A 100 41.796 -7.079 -22.955 1.00 0.00 H new ATOM 0 HH22 ARG A 100 41.870 -7.373 -24.696 1.00 0.00 H new ATOM 1645 N ASP A 101 36.936 -14.374 -19.918 1.00 0.00 N ATOM 1646 CA ASP A 101 36.019 -15.501 -19.845 1.00 0.00 C ATOM 1647 C ASP A 101 34.589 -15.075 -19.520 1.00 0.00 C ATOM 1648 O ASP A 101 33.659 -15.486 -20.210 1.00 0.00 O ATOM 1649 CB ASP A 101 36.553 -16.521 -18.846 1.00 0.00 C ATOM 1650 CG ASP A 101 37.907 -17.065 -19.295 1.00 0.00 C ATOM 1651 OD1 ASP A 101 38.579 -17.685 -18.443 1.00 0.00 O ATOM 1652 OD2 ASP A 101 38.248 -16.853 -20.481 1.00 0.00 O1- ATOM 0 H ASP A 101 37.557 -14.286 -19.114 1.00 0.00 H new ATOM 0 HA ASP A 101 35.966 -15.964 -20.830 1.00 0.00 H new ATOM 0 HB2 ASP A 101 36.650 -16.058 -17.864 1.00 0.00 H new ATOM 0 HB3 ASP A 101 35.843 -17.341 -18.743 1.00 0.00 H new ATOM 1657 N LEU A 102 34.393 -14.255 -18.480 1.00 0.00 N ATOM 1658 CA LEU A 102 33.057 -13.771 -18.176 1.00 0.00 C ATOM 1659 C LEU A 102 32.581 -12.849 -19.297 1.00 0.00 C ATOM 1660 O LEU A 102 31.386 -12.790 -19.579 1.00 0.00 O ATOM 1661 CB LEU A 102 33.033 -13.073 -16.813 1.00 0.00 C ATOM 1662 CG LEU A 102 33.326 -14.023 -15.644 1.00 0.00 C ATOM 1663 CD1 LEU A 102 33.061 -13.290 -14.325 1.00 0.00 C ATOM 1664 CD2 LEU A 102 32.426 -15.259 -15.690 1.00 0.00 C ATOM 0 H LEU A 102 35.127 -13.924 -17.854 1.00 0.00 H new ATOM 0 HA LEU A 102 32.369 -14.614 -18.114 1.00 0.00 H new ATOM 0 HB2 LEU A 102 33.767 -12.267 -16.811 1.00 0.00 H new ATOM 0 HB3 LEU A 102 32.056 -12.614 -16.664 1.00 0.00 H new ATOM 0 HG LEU A 102 34.366 -14.339 -15.719 1.00 0.00 H new ATOM 0 HD11 LEU A 102 33.267 -13.959 -13.489 1.00 0.00 H new ATOM 0 HD12 LEU A 102 33.708 -12.416 -14.258 1.00 0.00 H new ATOM 0 HD13 LEU A 102 32.019 -12.973 -14.288 1.00 0.00 H new ATOM 0 HD21 LEU A 102 32.660 -15.911 -14.848 1.00 0.00 H new ATOM 0 HD22 LEU A 102 31.382 -14.951 -15.632 1.00 0.00 H new ATOM 0 HD23 LEU A 102 32.594 -15.797 -16.623 1.00 0.00 H new ATOM 1676 N LYS A 103 33.509 -12.128 -19.945 1.00 0.00 N ATOM 1677 CA LYS A 103 33.179 -11.344 -21.133 1.00 0.00 C ATOM 1678 C LYS A 103 32.647 -12.216 -22.270 1.00 0.00 C ATOM 1679 O LYS A 103 31.739 -11.786 -22.978 1.00 0.00 O ATOM 1680 CB LYS A 103 34.397 -10.545 -21.598 1.00 0.00 C ATOM 1681 CG LYS A 103 34.710 -9.493 -20.534 1.00 0.00 C ATOM 1682 CD LYS A 103 35.960 -8.667 -20.823 1.00 0.00 C ATOM 1683 CE LYS A 103 35.828 -7.855 -22.109 1.00 0.00 C ATOM 1684 NZ LYS A 103 36.756 -6.713 -22.087 1.00 0.00 N1+ ATOM 0 H LYS A 103 34.488 -12.075 -19.664 1.00 0.00 H new ATOM 0 HA LYS A 103 32.383 -10.654 -20.856 1.00 0.00 H new ATOM 0 HB2 LYS A 103 35.252 -11.205 -21.744 1.00 0.00 H new ATOM 0 HB3 LYS A 103 34.196 -10.068 -22.557 1.00 0.00 H new ATOM 0 HG2 LYS A 103 33.857 -8.821 -20.441 1.00 0.00 H new ATOM 0 HG3 LYS A 103 34.831 -9.990 -19.571 1.00 0.00 H new ATOM 0 HD2 LYS A 103 36.150 -7.993 -19.987 1.00 0.00 H new ATOM 0 HD3 LYS A 103 36.822 -9.330 -20.900 1.00 0.00 H new ATOM 0 HE2 LYS A 103 36.039 -8.488 -22.971 1.00 0.00 H new ATOM 0 HE3 LYS A 103 34.804 -7.499 -22.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 36.860 -6.331 -23.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 36.381 -5.973 -21.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 37.684 -7.026 -21.737 1.00 0.00 H new ATOM 1698 N LYS A 104 33.181 -13.430 -22.468 1.00 0.00 N ATOM 1699 CA LYS A 104 32.621 -14.341 -23.456 1.00 0.00 C ATOM 1700 C LYS A 104 31.190 -14.730 -23.087 1.00 0.00 C ATOM 1701 O LYS A 104 30.334 -14.772 -23.969 1.00 0.00 O ATOM 1702 CB LYS A 104 33.505 -15.583 -23.601 1.00 0.00 C ATOM 1703 CG LYS A 104 34.750 -15.246 -24.426 1.00 0.00 C ATOM 1704 CD LYS A 104 35.605 -16.489 -24.689 1.00 0.00 C ATOM 1705 CE LYS A 104 36.238 -17.045 -23.411 1.00 0.00 C ATOM 1706 NZ LYS A 104 37.283 -16.144 -22.892 1.00 0.00 N1+ ATOM 0 H LYS A 104 33.988 -13.793 -21.961 1.00 0.00 H new ATOM 0 HA LYS A 104 32.591 -13.829 -24.418 1.00 0.00 H new ATOM 0 HB2 LYS A 104 33.799 -15.947 -22.617 1.00 0.00 H new ATOM 0 HB3 LYS A 104 32.945 -16.384 -24.083 1.00 0.00 H new ATOM 0 HG2 LYS A 104 34.449 -14.803 -25.375 1.00 0.00 H new ATOM 0 HG3 LYS A 104 35.345 -14.499 -23.900 1.00 0.00 H new ATOM 0 HD2 LYS A 104 34.988 -17.260 -25.150 1.00 0.00 H new ATOM 0 HD3 LYS A 104 36.391 -16.241 -25.402 1.00 0.00 H new ATOM 0 HE2 LYS A 104 35.467 -17.186 -22.653 1.00 0.00 H new ATOM 0 HE3 LYS A 104 36.669 -18.026 -23.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 37.657 -16.524 -21.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 38.054 -16.070 -23.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 36.877 -15.201 -22.724 1.00 0.00 H new ATOM 1720 N LYS A 105 30.923 -15.013 -21.807 1.00 0.00 N ATOM 1721 CA LYS A 105 29.568 -15.329 -21.372 1.00 0.00 C ATOM 1722 C LYS A 105 28.657 -14.127 -21.580 1.00 0.00 C ATOM 1723 O LYS A 105 27.544 -14.275 -22.084 1.00 0.00 O ATOM 1724 CB LYS A 105 29.578 -15.735 -19.899 1.00 0.00 C ATOM 1725 CG LYS A 105 30.343 -17.041 -19.681 1.00 0.00 C ATOM 1726 CD LYS A 105 29.685 -18.237 -20.388 1.00 0.00 C ATOM 1727 CE LYS A 105 28.221 -18.377 -19.962 1.00 0.00 C ATOM 1728 NZ LYS A 105 27.592 -19.574 -20.551 1.00 0.00 N1+ ATOM 0 H LYS A 105 31.623 -15.028 -21.065 1.00 0.00 H new ATOM 0 HA LYS A 105 29.189 -16.161 -21.966 1.00 0.00 H new ATOM 0 HB2 LYS A 105 30.033 -14.942 -19.305 1.00 0.00 H new ATOM 0 HB3 LYS A 105 28.553 -15.849 -19.545 1.00 0.00 H new ATOM 0 HG2 LYS A 105 31.364 -16.925 -20.045 1.00 0.00 H new ATOM 0 HG3 LYS A 105 30.407 -17.246 -18.612 1.00 0.00 H new ATOM 0 HD2 LYS A 105 29.744 -18.105 -21.468 1.00 0.00 H new ATOM 0 HD3 LYS A 105 30.228 -19.151 -20.149 1.00 0.00 H new ATOM 0 HE2 LYS A 105 28.162 -18.433 -18.875 1.00 0.00 H new ATOM 0 HE3 LYS A 105 27.667 -17.489 -20.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 26.602 -19.635 -20.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 27.625 -19.509 -21.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 28.105 -20.424 -20.241 1.00 0.00 H new ATOM 1742 N LEU A 106 29.129 -12.938 -21.193 1.00 0.00 N ATOM 1743 CA LEU A 106 28.385 -11.706 -21.393 1.00 0.00 C ATOM 1744 C LEU A 106 28.056 -11.531 -22.869 1.00 0.00 C ATOM 1745 O LEU A 106 26.914 -11.260 -23.228 1.00 0.00 O ATOM 1746 CB LEU A 106 29.221 -10.526 -20.887 1.00 0.00 C ATOM 1747 CG LEU A 106 28.565 -9.182 -21.220 1.00 0.00 C ATOM 1748 CD1 LEU A 106 28.945 -8.154 -20.156 1.00 0.00 C ATOM 1749 CD2 LEU A 106 29.012 -8.623 -22.573 1.00 0.00 C ATOM 0 H LEU A 106 30.032 -12.810 -20.736 1.00 0.00 H new ATOM 0 HA LEU A 106 27.449 -11.747 -20.835 1.00 0.00 H new ATOM 0 HB2 LEU A 106 29.352 -10.609 -19.808 1.00 0.00 H new ATOM 0 HB3 LEU A 106 30.215 -10.566 -21.333 1.00 0.00 H new ATOM 0 HG LEU A 106 27.490 -9.361 -21.253 1.00 0.00 H new ATOM 0 HD11 LEU A 106 28.479 -7.197 -20.392 1.00 0.00 H new ATOM 0 HD12 LEU A 106 28.599 -8.495 -19.180 1.00 0.00 H new ATOM 0 HD13 LEU A 106 30.028 -8.035 -20.136 1.00 0.00 H new ATOM 0 HD21 LEU A 106 28.515 -7.670 -22.755 1.00 0.00 H new ATOM 0 HD22 LEU A 106 30.092 -8.474 -22.566 1.00 0.00 H new ATOM 0 HD23 LEU A 106 28.748 -9.327 -23.363 1.00 0.00 H new ATOM 1761 N SER A 107 29.069 -11.689 -23.719 1.00 0.00 N ATOM 1762 CA SER A 107 28.919 -11.543 -25.157 1.00 0.00 C ATOM 1763 C SER A 107 27.844 -12.484 -25.687 1.00 0.00 C ATOM 1764 O SER A 107 27.041 -12.078 -26.521 1.00 0.00 O ATOM 1765 CB SER A 107 30.263 -11.803 -25.830 1.00 0.00 C ATOM 1766 OG SER A 107 31.227 -10.898 -25.343 1.00 0.00 O ATOM 0 H SER A 107 30.017 -11.922 -23.424 1.00 0.00 H new ATOM 0 HA SER A 107 28.600 -10.526 -25.387 1.00 0.00 H new ATOM 0 HB2 SER A 107 30.583 -12.827 -25.638 1.00 0.00 H new ATOM 0 HB3 SER A 107 30.165 -11.697 -26.910 1.00 0.00 H new ATOM 0 HG SER A 107 31.464 -11.137 -24.423 1.00 0.00 H new ATOM 1772 N ARG A 108 27.814 -13.736 -25.215 1.00 0.00 N ATOM 1773 CA ARG A 108 26.787 -14.683 -25.633 1.00 0.00 C ATOM 1774 C ARG A 108 25.412 -14.185 -25.203 1.00 0.00 C ATOM 1775 O ARG A 108 24.472 -14.245 -25.993 1.00 0.00 O ATOM 1776 CB ARG A 108 27.063 -16.061 -25.035 1.00 0.00 C ATOM 1777 CG ARG A 108 28.374 -16.655 -25.557 1.00 0.00 C ATOM 1778 CD ARG A 108 28.130 -17.907 -26.398 1.00 0.00 C ATOM 1779 NE ARG A 108 27.617 -19.014 -25.580 1.00 0.00 N ATOM 1780 CZ ARG A 108 27.625 -20.296 -25.962 1.00 0.00 C ATOM 1781 NH1 ARG A 108 28.087 -20.651 -27.163 1.00 0.00 N1+ ATOM 1782 NH2 ARG A 108 27.167 -21.229 -25.131 1.00 0.00 N ATOM 0 H ARG A 108 28.488 -14.111 -24.547 1.00 0.00 H new ATOM 0 HA ARG A 108 26.806 -14.767 -26.720 1.00 0.00 H new ATOM 0 HB2 ARG A 108 27.106 -15.984 -23.949 1.00 0.00 H new ATOM 0 HB3 ARG A 108 26.239 -16.733 -25.274 1.00 0.00 H new ATOM 0 HG2 ARG A 108 28.898 -15.910 -26.156 1.00 0.00 H new ATOM 0 HG3 ARG A 108 29.022 -16.902 -24.716 1.00 0.00 H new ATOM 0 HD2 ARG A 108 27.419 -17.680 -27.192 1.00 0.00 H new ATOM 0 HD3 ARG A 108 29.060 -18.210 -26.880 1.00 0.00 H new ATOM 0 HE ARG A 108 27.230 -18.791 -24.663 1.00 0.00 H new ATOM 0 HH11 ARG A 108 28.441 -19.941 -27.804 1.00 0.00 H new ATOM 0 HH12 ARG A 108 28.087 -21.633 -27.440 1.00 0.00 H new ATOM 0 HH21 ARG A 108 26.814 -20.964 -24.212 1.00 0.00 H new ATOM 0 HH22 ARG A 108 27.169 -22.209 -25.414 1.00 0.00 H new ATOM 1796 N VAL A 109 25.283 -13.695 -23.965 1.00 0.00 N ATOM 1797 CA VAL A 109 24.019 -13.141 -23.500 1.00 0.00 C ATOM 1798 C VAL A 109 23.606 -11.992 -24.411 1.00 0.00 C ATOM 1799 O VAL A 109 22.473 -11.948 -24.885 1.00 0.00 O ATOM 1800 CB VAL A 109 24.146 -12.647 -22.050 1.00 0.00 C ATOM 1801 CG1 VAL A 109 22.864 -11.921 -21.643 1.00 0.00 C ATOM 1802 CG2 VAL A 109 24.384 -13.798 -21.073 1.00 0.00 C ATOM 0 H VAL A 109 26.035 -13.673 -23.276 1.00 0.00 H new ATOM 0 HA VAL A 109 23.257 -13.920 -23.529 1.00 0.00 H new ATOM 0 HB VAL A 109 25.004 -11.976 -22.008 1.00 0.00 H new ATOM 0 HG11 VAL A 109 22.955 -11.571 -20.615 1.00 0.00 H new ATOM 0 HG12 VAL A 109 22.703 -11.069 -22.303 1.00 0.00 H new ATOM 0 HG13 VAL A 109 22.019 -12.605 -21.720 1.00 0.00 H new ATOM 0 HG21 VAL A 109 24.468 -13.404 -20.060 1.00 0.00 H new ATOM 0 HG22 VAL A 109 23.549 -14.496 -21.123 1.00 0.00 H new ATOM 0 HG23 VAL A 109 25.306 -14.316 -21.338 1.00 0.00 H new ATOM 1812 N VAL A 110 24.533 -11.062 -24.658 1.00 0.00 N ATOM 1813 CA VAL A 110 24.293 -9.908 -25.503 1.00 0.00 C ATOM 1814 C VAL A 110 23.833 -10.338 -26.892 1.00 0.00 C ATOM 1815 O VAL A 110 22.887 -9.762 -27.425 1.00 0.00 O ATOM 1816 CB VAL A 110 25.562 -9.049 -25.544 1.00 0.00 C ATOM 1817 CG1 VAL A 110 25.502 -7.981 -26.632 1.00 0.00 C ATOM 1818 CG2 VAL A 110 25.738 -8.342 -24.201 1.00 0.00 C ATOM 0 H VAL A 110 25.476 -11.097 -24.270 1.00 0.00 H new ATOM 0 HA VAL A 110 23.486 -9.304 -25.089 1.00 0.00 H new ATOM 0 HB VAL A 110 26.396 -9.717 -25.758 1.00 0.00 H new ATOM 0 HG11 VAL A 110 26.423 -7.399 -26.621 1.00 0.00 H new ATOM 0 HG12 VAL A 110 25.386 -8.459 -27.605 1.00 0.00 H new ATOM 0 HG13 VAL A 110 24.654 -7.322 -26.448 1.00 0.00 H new ATOM 0 HG21 VAL A 110 26.640 -7.730 -24.227 1.00 0.00 H new ATOM 0 HG22 VAL A 110 24.874 -7.706 -24.008 1.00 0.00 H new ATOM 0 HG23 VAL A 110 25.826 -9.084 -23.408 1.00 0.00 H new ATOM 1828 N ASN A 111 24.485 -11.343 -27.484 1.00 0.00 N ATOM 1829 CA ASN A 111 24.103 -11.817 -28.804 1.00 0.00 C ATOM 1830 C ASN A 111 22.661 -12.314 -28.821 1.00 0.00 C ATOM 1831 O ASN A 111 21.880 -11.934 -29.691 1.00 0.00 O ATOM 1832 CB ASN A 111 25.065 -12.910 -29.231 1.00 0.00 C ATOM 1833 CG ASN A 111 26.414 -12.302 -29.497 1.00 0.00 C ATOM 1834 OD1 ASN A 111 26.545 -11.163 -29.935 1.00 0.00 O ATOM 1835 ND2 ASN A 111 27.433 -13.089 -29.219 1.00 0.00 N ATOM 0 H ASN A 111 25.274 -11.837 -27.068 1.00 0.00 H new ATOM 0 HA ASN A 111 24.159 -10.990 -29.511 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.142 -13.669 -28.452 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.694 -13.409 -30.127 1.00 0.00 H new ATOM 0 HD21 ASN A 111 28.387 -12.759 -29.366 1.00 0.00 H new ATOM 0 HD22 ASN A 111 27.268 -14.028 -28.857 1.00 0.00 H new ATOM 1842 N ILE A 112 22.317 -13.169 -27.853 1.00 0.00 N ATOM 1843 CA ILE A 112 21.002 -13.782 -27.774 1.00 0.00 C ATOM 1844 C ILE A 112 19.923 -12.737 -27.489 1.00 0.00 C ATOM 1845 O ILE A 112 18.779 -12.894 -27.907 1.00 0.00 O ATOM 1846 CB ILE A 112 21.062 -14.885 -26.716 1.00 0.00 C ATOM 1847 CG1 ILE A 112 21.963 -16.004 -27.254 1.00 0.00 C ATOM 1848 CG2 ILE A 112 19.669 -15.435 -26.407 1.00 0.00 C ATOM 1849 CD1 ILE A 112 22.526 -16.857 -26.123 1.00 0.00 C ATOM 0 H ILE A 112 22.949 -13.451 -27.104 1.00 0.00 H new ATOM 0 HA ILE A 112 20.725 -14.228 -28.729 1.00 0.00 H new ATOM 0 HB ILE A 112 21.463 -14.478 -25.788 1.00 0.00 H new ATOM 0 HG12 ILE A 112 21.394 -16.634 -27.938 1.00 0.00 H new ATOM 0 HG13 ILE A 112 22.782 -15.570 -27.827 1.00 0.00 H new ATOM 0 HG21 ILE A 112 19.746 -16.217 -25.652 1.00 0.00 H new ATOM 0 HG22 ILE A 112 19.035 -14.631 -26.034 1.00 0.00 H new ATOM 0 HG23 ILE A 112 19.232 -15.850 -27.315 1.00 0.00 H new ATOM 0 HD11 ILE A 112 23.160 -17.640 -26.539 1.00 0.00 H new ATOM 0 HD12 ILE A 112 23.115 -16.231 -25.454 1.00 0.00 H new ATOM 0 HD13 ILE A 112 21.706 -17.311 -25.567 1.00 0.00 H new ATOM 1861 N LEU A 113 20.273 -11.659 -26.780 1.00 0.00 N ATOM 1862 CA LEU A 113 19.345 -10.567 -26.536 1.00 0.00 C ATOM 1863 C LEU A 113 18.958 -9.890 -27.851 1.00 0.00 C ATOM 1864 O LEU A 113 17.793 -9.550 -28.050 1.00 0.00 O ATOM 1865 CB LEU A 113 20.002 -9.558 -25.600 1.00 0.00 C ATOM 1866 CG LEU A 113 20.017 -10.061 -24.150 1.00 0.00 C ATOM 1867 CD1 LEU A 113 20.921 -9.169 -23.305 1.00 0.00 C ATOM 1868 CD2 LEU A 113 18.609 -10.040 -23.555 1.00 0.00 C ATOM 0 H LEU A 113 21.196 -11.526 -26.367 1.00 0.00 H new ATOM 0 HA LEU A 113 18.438 -10.959 -26.076 1.00 0.00 H new ATOM 0 HB2 LEU A 113 21.023 -9.366 -25.930 1.00 0.00 H new ATOM 0 HB3 LEU A 113 19.466 -8.610 -25.652 1.00 0.00 H new ATOM 0 HG LEU A 113 20.391 -11.085 -24.148 1.00 0.00 H new ATOM 0 HD11 LEU A 113 20.929 -9.529 -22.276 1.00 0.00 H new ATOM 0 HD12 LEU A 113 21.934 -9.194 -23.706 1.00 0.00 H new ATOM 0 HD13 LEU A 113 20.547 -8.146 -23.328 1.00 0.00 H new ATOM 0 HD21 LEU A 113 18.643 -10.400 -22.527 1.00 0.00 H new ATOM 0 HD22 LEU A 113 18.223 -9.021 -23.570 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.956 -10.684 -24.144 1.00 0.00 H new ATOM 1880 N LYS A 114 19.931 -9.691 -28.744 1.00 0.00 N ATOM 1881 CA LYS A 114 19.652 -9.155 -30.074 1.00 0.00 C ATOM 1882 C LYS A 114 18.698 -10.075 -30.828 1.00 0.00 C ATOM 1883 O LYS A 114 17.740 -9.607 -31.439 1.00 0.00 O ATOM 1884 CB LYS A 114 20.936 -9.060 -30.900 1.00 0.00 C ATOM 1885 CG LYS A 114 22.034 -8.270 -30.200 1.00 0.00 C ATOM 1886 CD LYS A 114 23.363 -8.553 -30.898 1.00 0.00 C ATOM 1887 CE LYS A 114 24.498 -8.163 -29.956 1.00 0.00 C ATOM 1888 NZ LYS A 114 25.806 -8.578 -30.488 1.00 0.00 N1+ ATOM 0 H LYS A 114 20.915 -9.893 -28.569 1.00 0.00 H new ATOM 0 HA LYS A 114 19.212 -8.167 -29.939 1.00 0.00 H new ATOM 0 HB2 LYS A 114 21.299 -10.065 -31.115 1.00 0.00 H new ATOM 0 HB3 LYS A 114 20.712 -8.591 -31.858 1.00 0.00 H new ATOM 0 HG2 LYS A 114 21.811 -7.204 -30.231 1.00 0.00 H new ATOM 0 HG3 LYS A 114 22.092 -8.553 -29.149 1.00 0.00 H new ATOM 0 HD2 LYS A 114 23.435 -9.608 -31.161 1.00 0.00 H new ATOM 0 HD3 LYS A 114 23.431 -7.987 -31.827 1.00 0.00 H new ATOM 0 HE2 LYS A 114 24.492 -7.084 -29.804 1.00 0.00 H new ATOM 0 HE3 LYS A 114 24.338 -8.623 -28.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 26.562 -8.063 -29.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 25.931 -9.600 -30.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 25.851 -8.365 -31.505 1.00 0.00 H new ATOM 1902 N GLU A 115 18.972 -11.385 -30.776 1.00 0.00 N ATOM 1903 CA GLU A 115 18.204 -12.402 -31.481 1.00 0.00 C ATOM 1904 C GLU A 115 16.769 -12.476 -30.970 1.00 0.00 C ATOM 1905 O GLU A 115 15.850 -12.739 -31.746 1.00 0.00 O ATOM 1906 CB GLU A 115 18.888 -13.763 -31.303 1.00 0.00 C ATOM 1907 CG GLU A 115 20.282 -13.772 -31.940 1.00 0.00 C ATOM 1908 CD GLU A 115 21.175 -14.854 -31.334 1.00 0.00 C ATOM 1909 OE1 GLU A 115 22.410 -14.704 -31.444 1.00 0.00 O ATOM 1910 OE2 GLU A 115 20.615 -15.818 -30.768 1.00 0.00 O1- ATOM 0 H GLU A 115 19.746 -11.767 -30.233 1.00 0.00 H new ATOM 0 HA GLU A 115 18.167 -12.134 -32.537 1.00 0.00 H new ATOM 0 HB2 GLU A 115 18.969 -13.996 -30.241 1.00 0.00 H new ATOM 0 HB3 GLU A 115 18.274 -14.543 -31.754 1.00 0.00 H new ATOM 0 HG2 GLU A 115 20.190 -13.936 -33.014 1.00 0.00 H new ATOM 0 HG3 GLU A 115 20.750 -12.797 -31.805 1.00 0.00 H new ATOM 1917 N ARG A 116 16.572 -12.248 -29.668 1.00 0.00 N ATOM 1918 CA ARG A 116 15.247 -12.195 -29.064 1.00 0.00 C ATOM 1919 C ARG A 116 14.615 -10.822 -29.260 1.00 0.00 C ATOM 1920 O ARG A 116 13.476 -10.618 -28.849 1.00 0.00 O ATOM 1921 CB ARG A 116 15.343 -12.588 -27.595 1.00 0.00 C ATOM 1922 CG ARG A 116 15.730 -14.060 -27.534 1.00 0.00 C ATOM 1923 CD ARG A 116 15.936 -14.523 -26.099 1.00 0.00 C ATOM 1924 NE ARG A 116 16.443 -15.897 -26.118 1.00 0.00 N ATOM 1925 CZ ARG A 116 16.014 -16.890 -25.329 1.00 0.00 C ATOM 1926 NH1 ARG A 116 15.033 -16.696 -24.449 1.00 0.00 N1+ ATOM 1927 NH2 ARG A 116 16.567 -18.099 -25.414 1.00 0.00 N ATOM 0 H ARG A 116 17.332 -12.095 -29.005 1.00 0.00 H new ATOM 0 HA ARG A 116 14.590 -12.910 -29.560 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.085 -11.976 -27.083 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.391 -12.422 -27.092 1.00 0.00 H new ATOM 0 HG2 ARG A 116 14.952 -14.662 -28.003 1.00 0.00 H new ATOM 0 HG3 ARG A 116 16.645 -14.221 -28.104 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.641 -13.867 -25.588 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.997 -14.474 -25.548 1.00 0.00 H new ATOM 0 HE ARG A 116 17.182 -16.115 -26.786 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.595 -15.778 -24.368 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.720 -17.465 -23.857 1.00 0.00 H new ATOM 0 HH21 ARG A 116 17.319 -18.270 -26.081 1.00 0.00 H new ATOM 0 HH22 ARG A 116 16.238 -18.854 -24.812 1.00 0.00 H new ATOM 1941 N ASN A 117 15.333 -9.878 -29.880 1.00 0.00 N ATOM 1942 CA ASN A 117 14.801 -8.557 -30.201 1.00 0.00 C ATOM 1943 C ASN A 117 14.287 -7.872 -28.942 1.00 0.00 C ATOM 1944 O ASN A 117 13.265 -7.191 -28.966 1.00 0.00 O ATOM 1945 CB ASN A 117 13.737 -8.677 -31.294 1.00 0.00 C ATOM 1946 CG ASN A 117 14.085 -9.798 -32.245 1.00 0.00 C ATOM 1947 OD1 ASN A 117 14.850 -9.620 -33.190 1.00 0.00 O ATOM 1948 ND2 ASN A 117 13.503 -10.961 -31.968 1.00 0.00 N ATOM 0 H ASN A 117 16.301 -10.013 -30.172 1.00 0.00 H new ATOM 0 HA ASN A 117 15.595 -7.923 -30.596 1.00 0.00 H new ATOM 0 HB2 ASN A 117 12.762 -8.863 -30.843 1.00 0.00 H new ATOM 0 HB3 ASN A 117 13.661 -7.737 -31.841 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.682 -11.774 -32.557 1.00 0.00 H new ATOM 0 HD22 ASN A 117 12.877 -11.040 -31.166 1.00 0.00 H new ATOM 1955 N ILE A 118 15.019 -8.069 -27.845 1.00 0.00 N ATOM 1956 CA ILE A 118 14.634 -7.564 -26.543 1.00 0.00 C ATOM 1957 C ILE A 118 14.641 -6.042 -26.539 1.00 0.00 C ATOM 1958 O ILE A 118 13.590 -5.414 -26.415 1.00 0.00 O ATOM 1959 CB ILE A 118 15.602 -8.126 -25.499 1.00 0.00 C ATOM 1960 CG1 ILE A 118 15.621 -9.661 -25.509 1.00 0.00 C ATOM 1961 CG2 ILE A 118 15.214 -7.605 -24.121 1.00 0.00 C ATOM 1962 CD1 ILE A 118 14.227 -10.284 -25.583 1.00 0.00 C ATOM 0 H ILE A 118 15.898 -8.587 -27.843 1.00 0.00 H new ATOM 0 HA ILE A 118 13.620 -7.883 -26.303 1.00 0.00 H new ATOM 0 HB ILE A 118 16.609 -7.791 -25.748 1.00 0.00 H new ATOM 0 HG12 ILE A 118 16.210 -10.004 -26.359 1.00 0.00 H new ATOM 0 HG13 ILE A 118 16.123 -10.017 -24.609 1.00 0.00 H new ATOM 0 HG21 ILE A 118 15.901 -8.003 -23.375 1.00 0.00 H new ATOM 0 HG22 ILE A 118 15.264 -6.516 -24.116 1.00 0.00 H new ATOM 0 HG23 ILE A 118 14.198 -7.922 -23.885 1.00 0.00 H new ATOM 0 HD11 ILE A 118 14.314 -11.371 -25.586 1.00 0.00 H new ATOM 0 HD12 ILE A 118 13.642 -9.969 -24.719 1.00 0.00 H new ATOM 0 HD13 ILE A 118 13.730 -9.957 -26.496 1.00 0.00 H new ATOM 1974 N PHE A 119 15.828 -5.455 -26.676 1.00 0.00 N ATOM 1975 CA PHE A 119 15.979 -4.019 -26.832 1.00 0.00 C ATOM 1976 C PHE A 119 15.657 -3.595 -28.260 1.00 0.00 C ATOM 1977 O PHE A 119 15.541 -4.431 -29.157 1.00 0.00 O ATOM 1978 CB PHE A 119 17.411 -3.636 -26.482 1.00 0.00 C ATOM 1979 CG PHE A 119 17.960 -4.426 -25.319 1.00 0.00 C ATOM 1980 CD1 PHE A 119 19.168 -5.121 -25.459 1.00 0.00 C ATOM 1981 CD2 PHE A 119 17.261 -4.470 -24.104 1.00 0.00 C ATOM 1982 CE1 PHE A 119 19.676 -5.857 -24.383 1.00 0.00 C ATOM 1983 CE2 PHE A 119 17.768 -5.213 -23.033 1.00 0.00 C ATOM 1984 CZ PHE A 119 18.978 -5.906 -23.168 1.00 0.00 C ATOM 0 H PHE A 119 16.710 -5.967 -26.681 1.00 0.00 H new ATOM 0 HA PHE A 119 15.284 -3.509 -26.165 1.00 0.00 H new ATOM 0 HB2 PHE A 119 18.047 -3.791 -27.353 1.00 0.00 H new ATOM 0 HB3 PHE A 119 17.450 -2.573 -26.244 1.00 0.00 H new ATOM 0 HD1 PHE A 119 19.706 -5.089 -26.395 1.00 0.00 H new ATOM 0 HD2 PHE A 119 16.332 -3.930 -23.995 1.00 0.00 H new ATOM 0 HE1 PHE A 119 20.610 -6.390 -24.489 1.00 0.00 H new ATOM 0 HE2 PHE A 119 17.226 -5.253 -22.100 1.00 0.00 H new ATOM 0 HZ PHE A 119 19.372 -6.476 -22.339 1.00 0.00 H new ATOM 1994 N SER A 120 15.510 -2.286 -28.477 1.00 0.00 N ATOM 1995 CA SER A 120 15.315 -1.763 -29.815 1.00 0.00 C ATOM 1996 C SER A 120 16.615 -1.939 -30.590 1.00 0.00 C ATOM 1997 O SER A 120 17.692 -1.931 -29.995 1.00 0.00 O ATOM 1998 CB SER A 120 14.912 -0.290 -29.746 1.00 0.00 C ATOM 1999 OG SER A 120 14.904 0.260 -31.047 1.00 0.00 O ATOM 0 H SER A 120 15.523 -1.579 -27.742 1.00 0.00 H new ATOM 0 HA SER A 120 14.515 -2.302 -30.323 1.00 0.00 H new ATOM 0 HB2 SER A 120 13.925 -0.193 -29.293 1.00 0.00 H new ATOM 0 HB3 SER A 120 15.609 0.259 -29.112 1.00 0.00 H new ATOM 0 HG SER A 120 14.644 1.204 -31.002 1.00 0.00 H new ATOM 2005 N LYS A 121 16.535 -2.099 -31.914 1.00 0.00 N ATOM 2006 CA LYS A 121 17.734 -2.266 -32.725 1.00 0.00 C ATOM 2007 C LYS A 121 18.650 -1.050 -32.566 1.00 0.00 C ATOM 2008 O LYS A 121 19.860 -1.163 -32.748 1.00 0.00 O ATOM 2009 CB LYS A 121 17.341 -2.518 -34.180 1.00 0.00 C ATOM 2010 CG LYS A 121 16.419 -3.742 -34.327 1.00 0.00 C ATOM 2011 CD LYS A 121 17.054 -5.039 -33.809 1.00 0.00 C ATOM 2012 CE LYS A 121 16.070 -6.200 -33.971 1.00 0.00 C ATOM 2013 NZ LYS A 121 16.650 -7.479 -33.514 1.00 0.00 N1+ ATOM 0 H LYS A 121 15.660 -2.116 -32.438 1.00 0.00 H new ATOM 0 HA LYS A 121 18.297 -3.135 -32.384 1.00 0.00 H new ATOM 0 HB2 LYS A 121 16.838 -1.636 -34.577 1.00 0.00 H new ATOM 0 HB3 LYS A 121 18.240 -2.668 -34.777 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.491 -3.557 -33.786 1.00 0.00 H new ATOM 0 HG3 LYS A 121 16.156 -3.867 -35.377 1.00 0.00 H new ATOM 0 HD2 LYS A 121 17.972 -5.249 -34.358 1.00 0.00 H new ATOM 0 HD3 LYS A 121 17.328 -4.927 -32.760 1.00 0.00 H new ATOM 0 HE2 LYS A 121 15.163 -5.989 -33.404 1.00 0.00 H new ATOM 0 HE3 LYS A 121 15.779 -6.286 -35.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 15.900 -8.196 -33.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 17.372 -7.795 -34.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 17.088 -7.348 -32.580 1.00 0.00 H new ATOM 2027 N GLN A 122 18.086 0.113 -32.225 1.00 0.00 N ATOM 2028 CA GLN A 122 18.874 1.292 -31.900 1.00 0.00 C ATOM 2029 C GLN A 122 19.723 1.017 -30.661 1.00 0.00 C ATOM 2030 O GLN A 122 20.939 1.197 -30.685 1.00 0.00 O ATOM 2031 CB GLN A 122 17.928 2.477 -31.665 1.00 0.00 C ATOM 2032 CG GLN A 122 18.618 3.649 -30.971 1.00 0.00 C ATOM 2033 CD GLN A 122 19.831 4.131 -31.748 1.00 0.00 C ATOM 2034 OE1 GLN A 122 19.758 4.378 -32.948 1.00 0.00 O ATOM 2035 NE2 GLN A 122 20.961 4.266 -31.062 1.00 0.00 N ATOM 0 H GLN A 122 17.078 0.257 -32.169 1.00 0.00 H new ATOM 0 HA GLN A 122 19.544 1.535 -32.725 1.00 0.00 H new ATOM 0 HB2 GLN A 122 17.526 2.811 -32.621 1.00 0.00 H new ATOM 0 HB3 GLN A 122 17.082 2.148 -31.061 1.00 0.00 H new ATOM 0 HG2 GLN A 122 17.911 4.470 -30.855 1.00 0.00 H new ATOM 0 HG3 GLN A 122 18.924 3.349 -29.969 1.00 0.00 H new ATOM 0 HE21 GLN A 122 20.981 4.051 -30.065 1.00 0.00 H new ATOM 0 HE22 GLN A 122 21.808 4.585 -31.532 1.00 0.00 H new ATOM 2044 N VAL A 123 19.071 0.580 -29.576 1.00 0.00 N ATOM 2045 CA VAL A 123 19.737 0.285 -28.318 1.00 0.00 C ATOM 2046 C VAL A 123 20.749 -0.837 -28.518 1.00 0.00 C ATOM 2047 O VAL A 123 21.799 -0.846 -27.879 1.00 0.00 O ATOM 2048 CB VAL A 123 18.683 -0.098 -27.275 1.00 0.00 C ATOM 2049 CG1 VAL A 123 19.335 -0.606 -25.990 1.00 0.00 C ATOM 2050 CG2 VAL A 123 17.806 1.112 -26.940 1.00 0.00 C ATOM 0 H VAL A 123 18.063 0.423 -29.554 1.00 0.00 H new ATOM 0 HA VAL A 123 20.278 1.163 -27.964 1.00 0.00 H new ATOM 0 HB VAL A 123 18.073 -0.894 -27.701 1.00 0.00 H new ATOM 0 HG11 VAL A 123 18.561 -0.870 -25.269 1.00 0.00 H new ATOM 0 HG12 VAL A 123 19.939 -1.486 -26.212 1.00 0.00 H new ATOM 0 HG13 VAL A 123 19.970 0.175 -25.571 1.00 0.00 H new ATOM 0 HG21 VAL A 123 17.061 0.827 -26.198 1.00 0.00 H new ATOM 0 HG22 VAL A 123 18.428 1.913 -26.541 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.304 1.459 -27.843 1.00 0.00 H new ATOM 2060 N VAL A 124 20.442 -1.789 -29.407 1.00 0.00 N ATOM 2061 CA VAL A 124 21.385 -2.850 -29.728 1.00 0.00 C ATOM 2062 C VAL A 124 22.690 -2.265 -30.266 1.00 0.00 C ATOM 2063 O VAL A 124 23.754 -2.668 -29.812 1.00 0.00 O ATOM 2064 CB VAL A 124 20.767 -3.832 -30.725 1.00 0.00 C ATOM 2065 CG1 VAL A 124 21.839 -4.733 -31.337 1.00 0.00 C ATOM 2066 CG2 VAL A 124 19.734 -4.706 -30.016 1.00 0.00 C ATOM 0 H VAL A 124 19.556 -1.841 -29.909 1.00 0.00 H new ATOM 0 HA VAL A 124 21.616 -3.398 -28.815 1.00 0.00 H new ATOM 0 HB VAL A 124 20.291 -3.256 -31.518 1.00 0.00 H new ATOM 0 HG11 VAL A 124 21.375 -5.423 -32.042 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.575 -4.121 -31.858 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.333 -5.299 -30.547 1.00 0.00 H new ATOM 0 HG21 VAL A 124 19.296 -5.404 -30.730 1.00 0.00 H new ATOM 0 HG22 VAL A 124 20.218 -5.263 -29.214 1.00 0.00 H new ATOM 0 HG23 VAL A 124 18.950 -4.075 -29.598 1.00 0.00 H new ATOM 2076 N ASN A 125 22.632 -1.328 -31.218 1.00 0.00 N ATOM 2077 CA ASN A 125 23.846 -0.746 -31.778 1.00 0.00 C ATOM 2078 C ASN A 125 24.628 0.033 -30.719 1.00 0.00 C ATOM 2079 O ASN A 125 25.857 0.065 -30.761 1.00 0.00 O ATOM 2080 CB ASN A 125 23.495 0.141 -32.975 1.00 0.00 C ATOM 2081 CG ASN A 125 23.201 -0.694 -34.218 1.00 0.00 C ATOM 2082 OD1 ASN A 125 24.089 -0.922 -35.034 1.00 0.00 O ATOM 2083 ND2 ASN A 125 21.963 -1.152 -34.375 1.00 0.00 N ATOM 0 H ASN A 125 21.765 -0.962 -31.611 1.00 0.00 H new ATOM 0 HA ASN A 125 24.491 -1.554 -32.123 1.00 0.00 H new ATOM 0 HB2 ASN A 125 22.627 0.755 -32.733 1.00 0.00 H new ATOM 0 HB3 ASN A 125 24.321 0.823 -33.179 1.00 0.00 H new ATOM 0 HD21 ASN A 125 21.727 -1.712 -35.194 1.00 0.00 H new ATOM 0 HD22 ASN A 125 21.250 -0.943 -33.677 1.00 0.00 H new ATOM 2090 N ASP A 126 23.925 0.661 -29.772 1.00 0.00 N ATOM 2091 CA ASP A 126 24.555 1.341 -28.650 1.00 0.00 C ATOM 2092 C ASP A 126 25.323 0.342 -27.788 1.00 0.00 C ATOM 2093 O ASP A 126 26.467 0.603 -27.413 1.00 0.00 O ATOM 2094 CB ASP A 126 23.482 2.082 -27.844 1.00 0.00 C ATOM 2095 CG ASP A 126 22.754 3.129 -28.687 1.00 0.00 C ATOM 2096 OD1 ASP A 126 21.549 3.335 -28.432 1.00 0.00 O ATOM 2097 OD2 ASP A 126 23.407 3.714 -29.580 1.00 0.00 O1- ATOM 0 H ASP A 126 22.906 0.709 -29.767 1.00 0.00 H new ATOM 0 HA ASP A 126 25.276 2.072 -29.016 1.00 0.00 H new ATOM 0 HB2 ASP A 126 22.760 1.364 -27.455 1.00 0.00 H new ATOM 0 HB3 ASP A 126 23.944 2.567 -26.984 1.00 0.00 H new ATOM 2102 N ILE A 127 24.708 -0.801 -27.472 1.00 0.00 N ATOM 2103 CA ILE A 127 25.377 -1.856 -26.725 1.00 0.00 C ATOM 2104 C ILE A 127 26.534 -2.427 -27.544 1.00 0.00 C ATOM 2105 O ILE A 127 27.627 -2.621 -27.015 1.00 0.00 O ATOM 2106 CB ILE A 127 24.367 -2.950 -26.359 1.00 0.00 C ATOM 2107 CG1 ILE A 127 23.299 -2.378 -25.418 1.00 0.00 C ATOM 2108 CG2 ILE A 127 25.072 -4.128 -25.680 1.00 0.00 C ATOM 2109 CD1 ILE A 127 22.085 -3.302 -25.346 1.00 0.00 C ATOM 0 H ILE A 127 23.743 -1.015 -27.726 1.00 0.00 H new ATOM 0 HA ILE A 127 25.788 -1.444 -25.803 1.00 0.00 H new ATOM 0 HB ILE A 127 23.894 -3.305 -27.274 1.00 0.00 H new ATOM 0 HG12 ILE A 127 23.720 -2.246 -24.421 1.00 0.00 H new ATOM 0 HG13 ILE A 127 22.991 -1.393 -25.767 1.00 0.00 H new ATOM 0 HG21 ILE A 127 24.339 -4.894 -25.428 1.00 0.00 H new ATOM 0 HG22 ILE A 127 25.816 -4.547 -26.358 1.00 0.00 H new ATOM 0 HG23 ILE A 127 25.564 -3.783 -24.770 1.00 0.00 H new ATOM 0 HD11 ILE A 127 21.342 -2.875 -24.673 1.00 0.00 H new ATOM 0 HD12 ILE A 127 21.653 -3.413 -26.340 1.00 0.00 H new ATOM 0 HD13 ILE A 127 22.393 -4.279 -24.973 1.00 0.00 H new ATOM 2121 N GLU A 128 26.312 -2.700 -28.833 1.00 0.00 N ATOM 2122 CA GLU A 128 27.330 -3.301 -29.681 1.00 0.00 C ATOM 2123 C GLU A 128 28.602 -2.463 -29.673 1.00 0.00 C ATOM 2124 O GLU A 128 29.680 -2.988 -29.404 1.00 0.00 O ATOM 2125 CB GLU A 128 26.819 -3.428 -31.121 1.00 0.00 C ATOM 2126 CG GLU A 128 25.776 -4.536 -31.295 1.00 0.00 C ATOM 2127 CD GLU A 128 26.414 -5.918 -31.372 1.00 0.00 C ATOM 2128 OE1 GLU A 128 26.032 -6.672 -32.293 1.00 0.00 O ATOM 2129 OE2 GLU A 128 27.276 -6.213 -30.517 1.00 0.00 O1- ATOM 0 H GLU A 128 25.430 -2.511 -29.308 1.00 0.00 H new ATOM 0 HA GLU A 128 27.553 -4.292 -29.286 1.00 0.00 H new ATOM 0 HB2 GLU A 128 26.385 -2.477 -31.431 1.00 0.00 H new ATOM 0 HB3 GLU A 128 27.662 -3.624 -31.783 1.00 0.00 H new ATOM 0 HG2 GLU A 128 25.075 -4.507 -30.461 1.00 0.00 H new ATOM 0 HG3 GLU A 128 25.200 -4.352 -32.202 1.00 0.00 H new ATOM 2136 N ARG A 129 28.489 -1.163 -29.963 1.00 0.00 N ATOM 2137 CA ARG A 129 29.660 -0.309 -30.046 1.00 0.00 C ATOM 2138 C ARG A 129 30.306 -0.134 -28.672 1.00 0.00 C ATOM 2139 O ARG A 129 31.523 -0.001 -28.574 1.00 0.00 O ATOM 2140 CB ARG A 129 29.260 1.027 -30.682 1.00 0.00 C ATOM 2141 CG ARG A 129 29.042 2.119 -29.635 1.00 0.00 C ATOM 2142 CD ARG A 129 28.640 3.424 -30.320 1.00 0.00 C ATOM 2143 NE ARG A 129 27.440 3.247 -31.145 1.00 0.00 N ATOM 2144 CZ ARG A 129 26.212 3.606 -30.761 1.00 0.00 C ATOM 2145 NH1 ARG A 129 26.000 4.224 -29.598 1.00 0.00 N1+ ATOM 2146 NH2 ARG A 129 25.161 3.351 -31.539 1.00 0.00 N ATOM 0 H ARG A 129 27.603 -0.690 -30.141 1.00 0.00 H new ATOM 0 HA ARG A 129 30.415 -0.775 -30.680 1.00 0.00 H new ATOM 0 HB2 ARG A 129 30.036 1.343 -31.379 1.00 0.00 H new ATOM 0 HB3 ARG A 129 28.347 0.893 -31.261 1.00 0.00 H new ATOM 0 HG2 ARG A 129 28.266 1.812 -28.933 1.00 0.00 H new ATOM 0 HG3 ARG A 129 29.954 2.268 -29.057 1.00 0.00 H new ATOM 0 HD2 ARG A 129 28.456 4.190 -29.567 1.00 0.00 H new ATOM 0 HD3 ARG A 129 29.462 3.779 -30.942 1.00 0.00 H new ATOM 0 HE ARG A 129 27.550 2.825 -32.067 1.00 0.00 H new ATOM 0 HH11 ARG A 129 26.785 4.432 -28.981 1.00 0.00 H new ATOM 0 HH12 ARG A 129 25.053 4.489 -29.326 1.00 0.00 H new ATOM 0 HH21 ARG A 129 25.291 2.879 -32.434 1.00 0.00 H new ATOM 0 HH22 ARG A 129 24.226 3.628 -31.240 1.00 0.00 H new ATOM 2160 N SER A 130 29.487 -0.137 -27.616 1.00 0.00 N ATOM 2161 CA SER A 130 29.968 0.039 -26.258 1.00 0.00 C ATOM 2162 C SER A 130 30.813 -1.155 -25.828 1.00 0.00 C ATOM 2163 O SER A 130 31.974 -0.994 -25.452 1.00 0.00 O ATOM 2164 CB SER A 130 28.776 0.229 -25.325 1.00 0.00 C ATOM 2165 OG SER A 130 29.224 0.370 -23.998 1.00 0.00 O ATOM 0 H SER A 130 28.477 -0.262 -27.686 1.00 0.00 H new ATOM 0 HA SER A 130 30.602 0.924 -26.210 1.00 0.00 H new ATOM 0 HB2 SER A 130 28.208 1.111 -25.622 1.00 0.00 H new ATOM 0 HB3 SER A 130 28.103 -0.625 -25.402 1.00 0.00 H new ATOM 0 HG SER A 130 28.475 0.641 -23.427 1.00 0.00 H new ATOM 2171 N LEU A 131 30.235 -2.358 -25.879 1.00 0.00 N ATOM 2172 CA LEU A 131 30.944 -3.573 -25.531 1.00 0.00 C ATOM 2173 C LEU A 131 32.093 -3.815 -26.506 1.00 0.00 C ATOM 2174 O LEU A 131 33.095 -4.409 -26.108 1.00 0.00 O ATOM 2175 CB LEU A 131 29.944 -4.728 -25.550 1.00 0.00 C ATOM 2176 CG LEU A 131 29.024 -4.754 -24.323 1.00 0.00 C ATOM 2177 CD1 LEU A 131 29.793 -5.185 -23.084 1.00 0.00 C ATOM 2178 CD2 LEU A 131 28.314 -3.439 -24.011 1.00 0.00 C ATOM 0 H LEU A 131 29.267 -2.508 -26.162 1.00 0.00 H new ATOM 0 HA LEU A 131 31.380 -3.488 -24.536 1.00 0.00 H new ATOM 0 HB2 LEU A 131 29.335 -4.657 -26.451 1.00 0.00 H new ATOM 0 HB3 LEU A 131 30.489 -5.670 -25.607 1.00 0.00 H new ATOM 0 HG LEU A 131 28.249 -5.474 -24.588 1.00 0.00 H new ATOM 0 HD11 LEU A 131 29.122 -5.197 -22.225 1.00 0.00 H new ATOM 0 HD12 LEU A 131 30.202 -6.183 -23.239 1.00 0.00 H new ATOM 0 HD13 LEU A 131 30.607 -4.484 -22.899 1.00 0.00 H new ATOM 0 HD21 LEU A 131 27.689 -3.564 -23.127 1.00 0.00 H new ATOM 0 HD22 LEU A 131 29.054 -2.661 -23.825 1.00 0.00 H new ATOM 0 HD23 LEU A 131 27.691 -3.152 -24.858 1.00 0.00 H new