USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1077 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 34 THR OG1 : rot 8:sc= 0.859 USER MOD Set 1.2: A 39 LYS NZ :NH3+ 169:sc= 0.766 (180deg=-0.397) USER MOD Single : A 3 THR OG1 : rot -115:sc= -0.684 USER MOD Single : A 9 SER OG : rot -107:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 24 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.057) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.0348 K(o=-0.035,f=-0.63!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 47:sc= 0.291 USER MOD Single : A 37 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0224) USER MOD Single : A 41 LYS NZ :NH3+ 177:sc= 0.294 (180deg=0.267) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -2.63! K(o=-2.6!,f=-0.63) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.0236 X(o=-0.024,f=-0.025) USER MOD Single : A 75 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00546) USER MOD Single : A 84 LYS NZ :NH3+ 154:sc= -0.399 (180deg=-2) USER MOD Single : A 87 GLN : amide:sc= -0.6 X(o=-0.6,f=-0.32) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0.0326 K(o=0.033,f=-4.7!) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 164:sc= 0.467 (180deg=0.211) USER MOD Single : A 109 THR OG1 : rot -130:sc= -0.313 USER MOD Single : A 111 ASN : amide:sc= -0.278 X(o=-0.28,f=0) USER MOD Single : A 116 LYS NZ :NH3+ -142:sc= 1.79 (180deg=0.272) USER MOD Single : A 117 LYS NZ :NH3+ -179:sc= 0.162 (180deg=0.15) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -1.238 -13.612 -1.011 1.00 53.04 N ATOM 21 CA GLY A 2 -0.143 -12.689 -0.756 1.00 33.23 C ATOM 22 C GLY A 2 -0.292 -11.431 -1.580 1.00 62.11 C ATOM 23 O GLY A 2 0.305 -11.309 -2.649 1.00 71.23 O ATOM 0 HA2 GLY A 2 -0.117 -12.433 0.303 1.00 33.23 H new ATOM 0 HA3 GLY A 2 0.806 -13.171 -0.990 1.00 33.23 H new ATOM 27 N THR A 3 -1.151 -10.522 -1.109 1.00 32.31 N ATOM 28 CA THR A 3 -1.329 -9.199 -1.708 1.00 44.12 C ATOM 29 C THR A 3 -0.640 -8.156 -0.818 1.00 45.01 C ATOM 30 O THR A 3 -0.615 -8.297 0.414 1.00 3.14 O ATOM 31 CB THR A 3 -2.842 -8.856 -1.880 1.00 54.41 C ATOM 32 OG1 THR A 3 -3.490 -8.873 -0.603 1.00 33.24 O ATOM 33 CG2 THR A 3 -3.551 -9.845 -2.831 1.00 40.11 C ATOM 0 H THR A 3 -1.745 -10.686 -0.296 1.00 32.31 H new ATOM 0 HA THR A 3 -0.879 -9.194 -2.701 1.00 44.12 H new ATOM 0 HB THR A 3 -2.908 -7.861 -2.321 1.00 54.41 H new ATOM 0 HG1 THR A 3 -4.153 -9.594 -0.582 1.00 33.24 H new ATOM 0 HG21 THR A 3 -4.602 -9.571 -2.923 1.00 40.11 H new ATOM 0 HG22 THR A 3 -3.079 -9.808 -3.813 1.00 40.11 H new ATOM 0 HG23 THR A 3 -3.473 -10.855 -2.429 1.00 40.11 H new ATOM 41 N VAL A 4 -0.062 -7.126 -1.446 1.00 23.44 N ATOM 42 CA VAL A 4 0.641 -6.042 -0.748 1.00 50.23 C ATOM 43 C VAL A 4 -0.025 -4.745 -1.192 1.00 14.51 C ATOM 44 O VAL A 4 0.058 -4.386 -2.369 1.00 61.13 O ATOM 45 CB VAL A 4 2.190 -6.024 -1.103 1.00 25.11 C ATOM 46 CG1 VAL A 4 2.951 -4.922 -0.316 1.00 13.53 C ATOM 47 CG2 VAL A 4 2.832 -7.415 -0.872 1.00 73.31 C ATOM 0 H VAL A 4 -0.069 -7.020 -2.460 1.00 23.44 H new ATOM 0 HA VAL A 4 0.577 -6.177 0.332 1.00 50.23 H new ATOM 0 HB VAL A 4 2.275 -5.783 -2.163 1.00 25.11 H new ATOM 0 HG11 VAL A 4 4.006 -4.944 -0.588 1.00 13.53 H new ATOM 0 HG12 VAL A 4 2.533 -3.946 -0.561 1.00 13.53 H new ATOM 0 HG13 VAL A 4 2.848 -5.102 0.754 1.00 13.53 H new ATOM 0 HG21 VAL A 4 3.892 -7.373 -1.123 1.00 73.31 H new ATOM 0 HG22 VAL A 4 2.718 -7.699 0.174 1.00 73.31 H new ATOM 0 HG23 VAL A 4 2.339 -8.153 -1.504 1.00 73.31 H new ATOM 57 N VAL A 5 -0.698 -4.050 -0.261 1.00 5.55 N ATOM 58 CA VAL A 5 -1.455 -2.829 -0.575 1.00 54.34 C ATOM 59 C VAL A 5 -0.858 -1.639 0.192 1.00 0.33 C ATOM 60 O VAL A 5 -0.903 -1.580 1.416 1.00 31.24 O ATOM 61 CB VAL A 5 -3.010 -3.017 -0.324 1.00 75.11 C ATOM 62 CG1 VAL A 5 -3.632 -3.960 -1.390 1.00 45.15 C ATOM 63 CG2 VAL A 5 -3.321 -3.543 1.094 1.00 11.43 C ATOM 0 H VAL A 5 -0.733 -4.316 0.723 1.00 5.55 H new ATOM 0 HA VAL A 5 -1.361 -2.616 -1.640 1.00 54.34 H new ATOM 0 HB VAL A 5 -3.461 -2.029 -0.412 1.00 75.11 H new ATOM 0 HG11 VAL A 5 -4.699 -4.074 -1.197 1.00 45.15 H new ATOM 0 HG12 VAL A 5 -3.486 -3.534 -2.382 1.00 45.15 H new ATOM 0 HG13 VAL A 5 -3.148 -4.935 -1.339 1.00 45.15 H new ATOM 0 HG21 VAL A 5 -4.399 -3.654 1.213 1.00 11.43 H new ATOM 0 HG22 VAL A 5 -2.839 -4.510 1.237 1.00 11.43 H new ATOM 0 HG23 VAL A 5 -2.945 -2.837 1.835 1.00 11.43 H new ATOM 73 N ILE A 6 -0.259 -0.701 -0.558 1.00 1.04 N ATOM 74 CA ILE A 6 0.475 0.442 0.006 1.00 0.33 C ATOM 75 C ILE A 6 -0.401 1.692 -0.113 1.00 30.32 C ATOM 76 O ILE A 6 -0.599 2.193 -1.217 1.00 62.24 O ATOM 77 CB ILE A 6 1.868 0.686 -0.717 1.00 74.44 C ATOM 78 CG1 ILE A 6 2.763 -0.616 -0.772 1.00 1.34 C ATOM 79 CG2 ILE A 6 2.641 1.850 -0.034 1.00 50.40 C ATOM 80 CD1 ILE A 6 2.429 -1.599 -1.896 1.00 40.43 C ATOM 0 H ILE A 6 -0.270 -0.714 -1.578 1.00 1.04 H new ATOM 0 HA ILE A 6 0.696 0.222 1.050 1.00 0.33 H new ATOM 0 HB ILE A 6 1.645 0.960 -1.748 1.00 74.44 H new ATOM 0 HG12 ILE A 6 3.806 -0.315 -0.874 1.00 1.34 H new ATOM 0 HG13 ILE A 6 2.674 -1.137 0.181 1.00 1.34 H new ATOM 0 HG21 ILE A 6 3.593 2.003 -0.543 1.00 50.40 H new ATOM 0 HG22 ILE A 6 2.048 2.763 -0.091 1.00 50.40 H new ATOM 0 HG23 ILE A 6 2.824 1.601 1.011 1.00 50.40 H new ATOM 0 HD11 ILE A 6 3.101 -2.455 -1.842 1.00 40.43 H new ATOM 0 HD12 ILE A 6 1.399 -1.939 -1.788 1.00 40.43 H new ATOM 0 HD13 ILE A 6 2.548 -1.104 -2.860 1.00 40.43 H new ATOM 92 N VAL A 7 -0.924 2.173 1.025 1.00 54.12 N ATOM 93 CA VAL A 7 -1.814 3.341 1.074 1.00 20.04 C ATOM 94 C VAL A 7 -0.965 4.606 1.201 1.00 41.34 C ATOM 95 O VAL A 7 -0.239 4.775 2.185 1.00 72.35 O ATOM 96 CB VAL A 7 -2.821 3.251 2.276 1.00 44.14 C ATOM 97 CG1 VAL A 7 -3.888 4.378 2.224 1.00 24.41 C ATOM 98 CG2 VAL A 7 -3.465 1.856 2.329 1.00 2.24 C ATOM 0 H VAL A 7 -0.740 1.761 1.940 1.00 54.12 H new ATOM 0 HA VAL A 7 -2.400 3.369 0.155 1.00 20.04 H new ATOM 0 HB VAL A 7 -2.260 3.401 3.198 1.00 44.14 H new ATOM 0 HG11 VAL A 7 -4.564 4.278 3.073 1.00 24.41 H new ATOM 0 HG12 VAL A 7 -3.394 5.349 2.265 1.00 24.41 H new ATOM 0 HG13 VAL A 7 -4.456 4.299 1.297 1.00 24.41 H new ATOM 0 HG21 VAL A 7 -4.161 1.808 3.167 1.00 2.24 H new ATOM 0 HG22 VAL A 7 -4.003 1.668 1.400 1.00 2.24 H new ATOM 0 HG23 VAL A 7 -2.689 1.102 2.458 1.00 2.24 H new ATOM 108 N VAL A 8 -1.070 5.477 0.198 1.00 71.10 N ATOM 109 CA VAL A 8 -0.255 6.682 0.069 1.00 34.10 C ATOM 110 C VAL A 8 -1.164 7.908 -0.079 1.00 54.43 C ATOM 111 O VAL A 8 -2.188 7.854 -0.773 1.00 53.35 O ATOM 112 CB VAL A 8 0.723 6.621 -1.168 1.00 71.15 C ATOM 113 CG1 VAL A 8 1.640 7.869 -1.216 1.00 35.14 C ATOM 114 CG2 VAL A 8 1.553 5.313 -1.177 1.00 74.11 C ATOM 0 H VAL A 8 -1.739 5.361 -0.563 1.00 71.10 H new ATOM 0 HA VAL A 8 0.351 6.755 0.972 1.00 34.10 H new ATOM 0 HB VAL A 8 0.110 6.621 -2.069 1.00 71.15 H new ATOM 0 HG11 VAL A 8 2.303 7.800 -2.078 1.00 35.14 H new ATOM 0 HG12 VAL A 8 1.028 8.767 -1.300 1.00 35.14 H new ATOM 0 HG13 VAL A 8 2.235 7.919 -0.304 1.00 35.14 H new ATOM 0 HG21 VAL A 8 2.214 5.308 -2.043 1.00 74.11 H new ATOM 0 HG22 VAL A 8 2.148 5.253 -0.266 1.00 74.11 H new ATOM 0 HG23 VAL A 8 0.881 4.456 -1.228 1.00 74.11 H new ATOM 124 N SER A 9 -0.764 9.000 0.579 1.00 32.52 N ATOM 125 CA SER A 9 -1.387 10.318 0.447 1.00 31.23 C ATOM 126 C SER A 9 -0.417 11.376 0.968 1.00 65.43 C ATOM 127 O SER A 9 0.346 11.113 1.904 1.00 10.45 O ATOM 128 CB SER A 9 -2.721 10.392 1.217 1.00 24.42 C ATOM 129 OG SER A 9 -3.347 11.661 1.063 1.00 22.52 O ATOM 0 H SER A 9 0.019 8.991 1.232 1.00 32.52 H new ATOM 0 HA SER A 9 -1.608 10.498 -0.605 1.00 31.23 H new ATOM 0 HB2 SER A 9 -3.391 9.610 0.860 1.00 24.42 H new ATOM 0 HB3 SER A 9 -2.542 10.200 2.275 1.00 24.42 H new ATOM 0 HG SER A 9 -3.266 12.169 1.897 1.00 22.52 H new ATOM 135 N ASN A 10 -0.444 12.565 0.349 1.00 24.43 N ATOM 136 CA ASN A 10 0.383 13.709 0.774 1.00 34.53 C ATOM 137 C ASN A 10 -0.110 14.256 2.124 1.00 24.32 C ATOM 138 O ASN A 10 0.691 14.703 2.947 1.00 22.12 O ATOM 139 CB ASN A 10 0.354 14.832 -0.293 1.00 33.43 C ATOM 140 CG ASN A 10 1.292 16.011 0.023 1.00 34.51 C ATOM 141 OD1 ASN A 10 2.382 15.834 0.576 1.00 61.30 O ATOM 142 ND2 ASN A 10 0.881 17.219 -0.333 1.00 42.14 N ATOM 0 H ASN A 10 -1.036 12.763 -0.457 1.00 24.43 H new ATOM 0 HA ASN A 10 1.410 13.362 0.887 1.00 34.53 H new ATOM 0 HB2 ASN A 10 0.629 14.410 -1.260 1.00 33.43 H new ATOM 0 HB3 ASN A 10 -0.666 15.206 -0.387 1.00 33.43 H new ATOM 0 HD21 ASN A 10 1.470 18.032 -0.152 1.00 42.14 H new ATOM 0 HD22 ASN A 10 -0.024 17.336 -0.788 1.00 42.14 H new ATOM 149 N ASP A 11 -1.438 14.217 2.327 1.00 32.12 N ATOM 150 CA ASP A 11 -2.049 14.609 3.601 1.00 52.13 C ATOM 151 C ASP A 11 -1.957 13.402 4.545 1.00 44.34 C ATOM 152 O ASP A 11 -2.461 12.315 4.226 1.00 4.54 O ATOM 153 CB ASP A 11 -3.524 15.059 3.420 1.00 32.44 C ATOM 154 CG ASP A 11 -4.078 15.841 4.642 1.00 42.30 C ATOM 155 OD1 ASP A 11 -4.166 15.266 5.748 1.00 75.21 O ATOM 156 OD2 ASP A 11 -4.398 17.043 4.509 1.00 31.22 O ATOM 0 H ASP A 11 -2.108 13.916 1.619 1.00 32.12 H new ATOM 0 HA ASP A 11 -1.518 15.466 4.016 1.00 52.13 H new ATOM 0 HB2 ASP A 11 -3.600 15.685 2.531 1.00 32.44 H new ATOM 0 HB3 ASP A 11 -4.146 14.181 3.246 1.00 32.44 H new ATOM 161 N GLU A 12 -1.313 13.613 5.692 1.00 74.30 N ATOM 162 CA GLU A 12 -0.969 12.542 6.638 1.00 71.23 C ATOM 163 C GLU A 12 -2.143 12.225 7.591 1.00 14.12 C ATOM 164 O GLU A 12 -2.194 11.141 8.165 1.00 24.43 O ATOM 165 CB GLU A 12 0.299 12.954 7.413 1.00 44.40 C ATOM 166 CG GLU A 12 0.941 11.845 8.267 1.00 15.13 C ATOM 167 CD GLU A 12 2.168 12.343 9.040 1.00 21.04 C ATOM 168 OE1 GLU A 12 3.210 12.618 8.402 1.00 40.14 O ATOM 169 OE2 GLU A 12 2.092 12.494 10.281 1.00 14.45 O ATOM 0 H GLU A 12 -1.011 14.538 5.997 1.00 74.30 H new ATOM 0 HA GLU A 12 -0.770 11.624 6.085 1.00 71.23 H new ATOM 0 HB2 GLU A 12 1.040 13.314 6.699 1.00 44.40 H new ATOM 0 HB3 GLU A 12 0.050 13.792 8.064 1.00 44.40 H new ATOM 0 HG2 GLU A 12 0.204 11.458 8.970 1.00 15.13 H new ATOM 0 HG3 GLU A 12 1.232 11.016 7.622 1.00 15.13 H new ATOM 176 N ARG A 13 -3.097 13.167 7.722 1.00 32.40 N ATOM 177 CA ARG A 13 -4.325 12.965 8.534 1.00 12.31 C ATOM 178 C ARG A 13 -5.277 12.016 7.819 1.00 65.24 C ATOM 179 O ARG A 13 -6.032 11.288 8.459 1.00 60.14 O ATOM 180 CB ARG A 13 -5.042 14.299 8.792 1.00 42.14 C ATOM 181 CG ARG A 13 -4.198 15.349 9.542 1.00 44.44 C ATOM 182 CD ARG A 13 -4.865 16.734 9.535 1.00 23.33 C ATOM 183 NE ARG A 13 -5.093 17.231 8.157 1.00 53.53 N ATOM 184 CZ ARG A 13 -5.335 18.512 7.823 1.00 21.40 C ATOM 185 NH1 ARG A 13 -5.390 19.467 8.751 1.00 43.25 N ATOM 186 NH2 ARG A 13 -5.533 18.817 6.550 1.00 2.43 N ATOM 0 H ARG A 13 -3.045 14.082 7.275 1.00 32.40 H new ATOM 0 HA ARG A 13 -4.026 12.536 9.490 1.00 12.31 H new ATOM 0 HB2 ARG A 13 -5.354 14.719 7.836 1.00 42.14 H new ATOM 0 HB3 ARG A 13 -5.948 14.104 9.365 1.00 42.14 H new ATOM 0 HG2 ARG A 13 -4.046 15.025 10.571 1.00 44.44 H new ATOM 0 HG3 ARG A 13 -3.213 15.419 9.081 1.00 44.44 H new ATOM 0 HD2 ARG A 13 -5.817 16.681 10.064 1.00 23.33 H new ATOM 0 HD3 ARG A 13 -4.238 17.442 10.077 1.00 23.33 H new ATOM 0 HE ARG A 13 -5.064 16.547 7.401 1.00 53.53 H new ATOM 0 HH11 ARG A 13 -5.247 19.232 9.733 1.00 43.25 H new ATOM 0 HH12 ARG A 13 -5.575 20.433 8.479 1.00 43.25 H new ATOM 0 HH21 ARG A 13 -5.501 18.086 5.839 1.00 2.43 H new ATOM 0 HH22 ARG A 13 -5.718 19.783 6.280 1.00 2.43 H new ATOM 200 N ILE A 14 -5.240 12.072 6.478 1.00 41.21 N ATOM 201 CA ILE A 14 -5.912 11.104 5.607 1.00 0.11 C ATOM 202 C ILE A 14 -5.320 9.705 5.882 1.00 33.01 C ATOM 203 O ILE A 14 -6.057 8.750 6.057 1.00 5.14 O ATOM 204 CB ILE A 14 -5.777 11.535 4.080 1.00 1.20 C ATOM 205 CG1 ILE A 14 -6.851 12.614 3.676 1.00 70.04 C ATOM 206 CG2 ILE A 14 -5.854 10.319 3.110 1.00 73.10 C ATOM 207 CD1 ILE A 14 -7.002 13.825 4.581 1.00 24.13 C ATOM 0 H ILE A 14 -4.738 12.798 5.967 1.00 41.21 H new ATOM 0 HA ILE A 14 -6.980 11.075 5.822 1.00 0.11 H new ATOM 0 HB ILE A 14 -4.787 11.980 3.983 1.00 1.20 H new ATOM 0 HG12 ILE A 14 -6.610 12.970 2.674 1.00 70.04 H new ATOM 0 HG13 ILE A 14 -7.819 12.118 3.613 1.00 70.04 H new ATOM 0 HG21 ILE A 14 -5.757 10.667 2.082 1.00 73.10 H new ATOM 0 HG22 ILE A 14 -5.047 9.622 3.335 1.00 73.10 H new ATOM 0 HG23 ILE A 14 -6.813 9.815 3.233 1.00 73.10 H new ATOM 0 HD11 ILE A 14 -7.775 14.483 4.183 1.00 24.13 H new ATOM 0 HD12 ILE A 14 -7.284 13.498 5.582 1.00 24.13 H new ATOM 0 HD13 ILE A 14 -6.056 14.364 4.628 1.00 24.13 H new ATOM 219 N LEU A 15 -3.983 9.627 5.987 1.00 72.04 N ATOM 220 CA LEU A 15 -3.279 8.369 6.315 1.00 3.11 C ATOM 221 C LEU A 15 -3.644 7.862 7.724 1.00 22.13 C ATOM 222 O LEU A 15 -3.789 6.662 7.915 1.00 15.01 O ATOM 223 CB LEU A 15 -1.752 8.565 6.194 1.00 51.54 C ATOM 224 CG LEU A 15 -1.235 8.854 4.756 1.00 11.11 C ATOM 225 CD1 LEU A 15 0.255 9.245 4.781 1.00 55.34 C ATOM 226 CD2 LEU A 15 -1.506 7.647 3.817 1.00 22.41 C ATOM 0 H LEU A 15 -3.362 10.424 5.849 1.00 72.04 H new ATOM 0 HA LEU A 15 -3.601 7.612 5.599 1.00 3.11 H new ATOM 0 HB2 LEU A 15 -1.455 9.389 6.843 1.00 51.54 H new ATOM 0 HB3 LEU A 15 -1.256 7.670 6.569 1.00 51.54 H new ATOM 0 HG LEU A 15 -1.786 9.704 4.353 1.00 11.11 H new ATOM 0 HD11 LEU A 15 0.596 9.443 3.765 1.00 55.34 H new ATOM 0 HD12 LEU A 15 0.386 10.140 5.389 1.00 55.34 H new ATOM 0 HD13 LEU A 15 0.838 8.429 5.207 1.00 55.34 H new ATOM 0 HD21 LEU A 15 -1.135 7.873 2.817 1.00 22.41 H new ATOM 0 HD22 LEU A 15 -0.995 6.765 4.202 1.00 22.41 H new ATOM 0 HD23 LEU A 15 -2.578 7.455 3.772 1.00 22.41 H new ATOM 238 N GLU A 16 -3.794 8.794 8.688 1.00 44.25 N ATOM 239 CA GLU A 16 -4.124 8.467 10.093 1.00 31.44 C ATOM 240 C GLU A 16 -5.561 7.931 10.221 1.00 43.44 C ATOM 241 O GLU A 16 -5.783 6.887 10.838 1.00 42.23 O ATOM 242 CB GLU A 16 -3.930 9.708 11.008 1.00 71.51 C ATOM 243 CG GLU A 16 -2.463 10.137 11.192 1.00 23.43 C ATOM 244 CD GLU A 16 -2.327 11.385 12.073 1.00 34.41 C ATOM 245 OE1 GLU A 16 -2.793 12.464 11.648 1.00 54.31 O ATOM 246 OE2 GLU A 16 -1.799 11.290 13.201 1.00 40.54 O ATOM 0 H GLU A 16 -3.690 9.794 8.516 1.00 44.25 H new ATOM 0 HA GLU A 16 -3.440 7.683 10.417 1.00 31.44 H new ATOM 0 HB2 GLU A 16 -4.491 10.544 10.590 1.00 71.51 H new ATOM 0 HB3 GLU A 16 -4.359 9.494 11.987 1.00 71.51 H new ATOM 0 HG2 GLU A 16 -1.900 9.317 11.638 1.00 23.43 H new ATOM 0 HG3 GLU A 16 -2.019 10.334 10.216 1.00 23.43 H new ATOM 253 N GLU A 17 -6.519 8.658 9.625 1.00 31.45 N ATOM 254 CA GLU A 17 -7.947 8.293 9.646 1.00 63.32 C ATOM 255 C GLU A 17 -8.179 6.952 8.919 1.00 42.11 C ATOM 256 O GLU A 17 -8.831 6.041 9.452 1.00 0.34 O ATOM 257 CB GLU A 17 -8.778 9.423 8.989 1.00 51.44 C ATOM 258 CG GLU A 17 -10.307 9.175 8.963 1.00 35.20 C ATOM 259 CD GLU A 17 -11.138 10.312 8.342 1.00 62.20 C ATOM 260 OE1 GLU A 17 -10.563 11.321 7.886 1.00 13.01 O ATOM 261 OE2 GLU A 17 -12.377 10.187 8.301 1.00 44.42 O ATOM 0 H GLU A 17 -6.326 9.519 9.113 1.00 31.45 H new ATOM 0 HA GLU A 17 -8.268 8.170 10.681 1.00 63.32 H new ATOM 0 HB2 GLU A 17 -8.584 10.354 9.522 1.00 51.44 H new ATOM 0 HB3 GLU A 17 -8.430 9.563 7.966 1.00 51.44 H new ATOM 0 HG2 GLU A 17 -10.502 8.257 8.408 1.00 35.20 H new ATOM 0 HG3 GLU A 17 -10.651 9.009 9.984 1.00 35.20 H new ATOM 268 N LEU A 18 -7.591 6.838 7.716 1.00 50.11 N ATOM 269 CA LEU A 18 -7.698 5.636 6.863 1.00 55.03 C ATOM 270 C LEU A 18 -6.958 4.444 7.492 1.00 15.35 C ATOM 271 O LEU A 18 -7.357 3.299 7.272 1.00 44.40 O ATOM 272 CB LEU A 18 -7.178 5.931 5.417 1.00 14.21 C ATOM 273 CG LEU A 18 -8.211 6.568 4.409 1.00 44.23 C ATOM 274 CD1 LEU A 18 -8.858 7.867 4.941 1.00 61.01 C ATOM 275 CD2 LEU A 18 -7.553 6.798 3.028 1.00 21.05 C ATOM 0 H LEU A 18 -7.025 7.579 7.304 1.00 50.11 H new ATOM 0 HA LEU A 18 -8.752 5.366 6.789 1.00 55.03 H new ATOM 0 HB2 LEU A 18 -6.321 6.600 5.494 1.00 14.21 H new ATOM 0 HB3 LEU A 18 -6.816 4.996 4.988 1.00 14.21 H new ATOM 0 HG LEU A 18 -9.023 5.849 4.298 1.00 44.23 H new ATOM 0 HD11 LEU A 18 -9.558 8.254 4.201 1.00 61.01 H new ATOM 0 HD12 LEU A 18 -9.391 7.655 5.868 1.00 61.01 H new ATOM 0 HD13 LEU A 18 -8.082 8.609 5.130 1.00 61.01 H new ATOM 0 HD21 LEU A 18 -8.281 7.238 2.347 1.00 21.05 H new ATOM 0 HD22 LEU A 18 -6.704 7.473 3.137 1.00 21.05 H new ATOM 0 HD23 LEU A 18 -7.209 5.845 2.626 1.00 21.05 H new ATOM 287 N LEU A 19 -5.889 4.731 8.279 1.00 74.22 N ATOM 288 CA LEU A 19 -5.153 3.710 9.064 1.00 55.34 C ATOM 289 C LEU A 19 -6.122 2.973 9.974 1.00 50.31 C ATOM 290 O LEU A 19 -6.267 1.755 9.904 1.00 75.41 O ATOM 291 CB LEU A 19 -4.032 4.368 9.922 1.00 51.10 C ATOM 292 CG LEU A 19 -3.167 3.410 10.808 1.00 63.40 C ATOM 293 CD1 LEU A 19 -2.115 2.643 9.978 1.00 73.12 C ATOM 294 CD2 LEU A 19 -2.533 4.160 11.996 1.00 61.15 C ATOM 0 H LEU A 19 -5.515 5.674 8.386 1.00 74.22 H new ATOM 0 HA LEU A 19 -4.690 3.009 8.369 1.00 55.34 H new ATOM 0 HB2 LEU A 19 -3.363 4.907 9.251 1.00 51.10 H new ATOM 0 HB3 LEU A 19 -4.494 5.109 10.574 1.00 51.10 H new ATOM 0 HG LEU A 19 -3.840 2.660 11.223 1.00 63.40 H new ATOM 0 HD11 LEU A 19 -1.539 1.991 10.634 1.00 73.12 H new ATOM 0 HD12 LEU A 19 -2.617 2.042 9.220 1.00 73.12 H new ATOM 0 HD13 LEU A 19 -1.445 3.353 9.493 1.00 73.12 H new ATOM 0 HD21 LEU A 19 -1.939 3.465 12.590 1.00 61.15 H new ATOM 0 HD22 LEU A 19 -1.891 4.958 11.622 1.00 61.15 H new ATOM 0 HD23 LEU A 19 -3.319 4.588 12.617 1.00 61.15 H new ATOM 306 N GLU A 20 -6.848 3.778 10.750 1.00 52.11 N ATOM 307 CA GLU A 20 -7.767 3.311 11.781 1.00 61.13 C ATOM 308 C GLU A 20 -8.936 2.508 11.194 1.00 44.53 C ATOM 309 O GLU A 20 -9.412 1.587 11.846 1.00 4.25 O ATOM 310 CB GLU A 20 -8.265 4.521 12.593 1.00 41.31 C ATOM 311 CG GLU A 20 -7.122 5.315 13.257 1.00 43.41 C ATOM 312 CD GLU A 20 -7.615 6.595 13.937 1.00 42.13 C ATOM 313 OE1 GLU A 20 -7.998 6.544 15.120 1.00 0.13 O ATOM 314 OE2 GLU A 20 -7.637 7.658 13.284 1.00 22.25 O ATOM 0 H GLU A 20 -6.811 4.795 10.675 1.00 52.11 H new ATOM 0 HA GLU A 20 -7.233 2.627 12.441 1.00 61.13 H new ATOM 0 HB2 GLU A 20 -8.827 5.185 11.937 1.00 41.31 H new ATOM 0 HB3 GLU A 20 -8.955 4.175 13.363 1.00 41.31 H new ATOM 0 HG2 GLU A 20 -6.626 4.684 13.994 1.00 43.41 H new ATOM 0 HG3 GLU A 20 -6.377 5.571 12.504 1.00 43.41 H new ATOM 321 N VAL A 21 -9.363 2.859 9.956 1.00 71.51 N ATOM 322 CA VAL A 21 -10.411 2.111 9.218 1.00 71.31 C ATOM 323 C VAL A 21 -9.965 0.648 9.005 1.00 72.34 C ATOM 324 O VAL A 21 -10.721 -0.287 9.290 1.00 74.31 O ATOM 325 CB VAL A 21 -10.744 2.781 7.822 1.00 34.03 C ATOM 326 CG1 VAL A 21 -11.770 1.951 6.997 1.00 3.42 C ATOM 327 CG2 VAL A 21 -11.243 4.228 8.009 1.00 62.11 C ATOM 0 H VAL A 21 -8.995 3.661 9.445 1.00 71.51 H new ATOM 0 HA VAL A 21 -11.318 2.135 9.822 1.00 71.31 H new ATOM 0 HB VAL A 21 -9.814 2.803 7.253 1.00 34.03 H new ATOM 0 HG11 VAL A 21 -11.965 2.452 6.049 1.00 3.42 H new ATOM 0 HG12 VAL A 21 -11.364 0.958 6.806 1.00 3.42 H new ATOM 0 HG13 VAL A 21 -12.700 1.861 7.558 1.00 3.42 H new ATOM 0 HG21 VAL A 21 -11.465 4.665 7.035 1.00 62.11 H new ATOM 0 HG22 VAL A 21 -12.146 4.225 8.620 1.00 62.11 H new ATOM 0 HG23 VAL A 21 -10.472 4.818 8.504 1.00 62.11 H new ATOM 337 N VAL A 22 -8.703 0.485 8.567 1.00 52.42 N ATOM 338 CA VAL A 22 -8.103 -0.829 8.277 1.00 1.34 C ATOM 339 C VAL A 22 -7.832 -1.607 9.593 1.00 52.31 C ATOM 340 O VAL A 22 -8.029 -2.824 9.651 1.00 71.33 O ATOM 341 CB VAL A 22 -6.768 -0.675 7.452 1.00 31.20 C ATOM 342 CG1 VAL A 22 -6.247 -2.032 6.942 1.00 53.31 C ATOM 343 CG2 VAL A 22 -6.950 0.302 6.277 1.00 30.23 C ATOM 0 H VAL A 22 -8.068 1.266 8.404 1.00 52.42 H new ATOM 0 HA VAL A 22 -8.813 -1.394 7.674 1.00 1.34 H new ATOM 0 HB VAL A 22 -6.022 -0.266 8.133 1.00 31.20 H new ATOM 0 HG11 VAL A 22 -5.326 -1.880 6.379 1.00 53.31 H new ATOM 0 HG12 VAL A 22 -6.050 -2.688 7.790 1.00 53.31 H new ATOM 0 HG13 VAL A 22 -6.996 -2.490 6.296 1.00 53.31 H new ATOM 0 HG21 VAL A 22 -6.013 0.388 5.727 1.00 30.23 H new ATOM 0 HG22 VAL A 22 -7.729 -0.070 5.612 1.00 30.23 H new ATOM 0 HG23 VAL A 22 -7.237 1.281 6.659 1.00 30.23 H new ATOM 353 N LEU A 23 -7.389 -0.871 10.648 1.00 63.14 N ATOM 354 CA LEU A 23 -7.090 -1.443 11.988 1.00 70.34 C ATOM 355 C LEU A 23 -8.336 -2.073 12.649 1.00 71.22 C ATOM 356 O LEU A 23 -8.284 -3.218 13.104 1.00 34.20 O ATOM 357 CB LEU A 23 -6.451 -0.362 12.933 1.00 13.12 C ATOM 358 CG LEU A 23 -4.887 -0.296 12.949 1.00 40.04 C ATOM 359 CD1 LEU A 23 -4.306 -0.012 11.558 1.00 4.30 C ATOM 360 CD2 LEU A 23 -4.381 0.730 13.991 1.00 12.44 C ATOM 0 H LEU A 23 -7.230 0.135 10.592 1.00 63.14 H new ATOM 0 HA LEU A 23 -6.366 -2.243 11.834 1.00 70.34 H new ATOM 0 HB2 LEU A 23 -6.832 0.617 12.641 1.00 13.12 H new ATOM 0 HB3 LEU A 23 -6.797 -0.548 13.950 1.00 13.12 H new ATOM 0 HG LEU A 23 -4.528 -1.281 13.247 1.00 40.04 H new ATOM 0 HD11 LEU A 23 -3.218 0.025 11.619 1.00 4.30 H new ATOM 0 HD12 LEU A 23 -4.605 -0.803 10.870 1.00 4.30 H new ATOM 0 HD13 LEU A 23 -4.682 0.945 11.195 1.00 4.30 H new ATOM 0 HD21 LEU A 23 -3.291 0.754 13.979 1.00 12.44 H new ATOM 0 HD22 LEU A 23 -4.768 1.719 13.746 1.00 12.44 H new ATOM 0 HD23 LEU A 23 -4.727 0.441 14.984 1.00 12.44 H new ATOM 372 N LYS A 24 -9.444 -1.313 12.698 1.00 54.31 N ATOM 373 CA LYS A 24 -10.684 -1.754 13.384 1.00 60.13 C ATOM 374 C LYS A 24 -11.424 -2.819 12.552 1.00 74.04 C ATOM 375 O LYS A 24 -12.123 -3.665 13.113 1.00 5.10 O ATOM 376 CB LYS A 24 -11.594 -0.528 13.739 1.00 0.12 C ATOM 377 CG LYS A 24 -12.110 0.338 12.554 1.00 15.32 C ATOM 378 CD LYS A 24 -13.384 -0.209 11.863 1.00 64.02 C ATOM 379 CE LYS A 24 -13.866 0.693 10.716 1.00 21.20 C ATOM 380 NZ LYS A 24 -14.328 2.014 11.207 1.00 61.22 N ATOM 0 H LYS A 24 -9.512 -0.389 12.272 1.00 54.31 H new ATOM 0 HA LYS A 24 -10.410 -2.226 14.328 1.00 60.13 H new ATOM 0 HB2 LYS A 24 -12.459 -0.897 14.290 1.00 0.12 H new ATOM 0 HB3 LYS A 24 -11.038 0.121 14.416 1.00 0.12 H new ATOM 0 HG2 LYS A 24 -12.314 1.345 12.919 1.00 15.32 H new ATOM 0 HG3 LYS A 24 -11.317 0.423 11.811 1.00 15.32 H new ATOM 0 HD2 LYS A 24 -13.183 -1.208 11.475 1.00 64.02 H new ATOM 0 HD3 LYS A 24 -14.180 -0.308 12.601 1.00 64.02 H new ATOM 0 HE2 LYS A 24 -13.056 0.835 10.001 1.00 21.20 H new ATOM 0 HE3 LYS A 24 -14.679 0.199 10.183 1.00 21.20 H new ATOM 0 HZ1 LYS A 24 -14.769 2.540 10.426 1.00 61.22 H new ATOM 0 HZ2 LYS A 24 -15.023 1.878 11.968 1.00 61.22 H new ATOM 0 HZ3 LYS A 24 -13.516 2.552 11.572 1.00 61.22 H new ATOM 394 N SER A 25 -11.263 -2.757 11.210 1.00 23.21 N ATOM 395 CA SER A 25 -11.843 -3.746 10.286 1.00 23.20 C ATOM 396 C SER A 25 -11.150 -5.105 10.489 1.00 20.01 C ATOM 397 O SER A 25 -11.827 -6.149 10.554 1.00 33.03 O ATOM 398 CB SER A 25 -11.732 -3.257 8.823 1.00 12.32 C ATOM 399 OG SER A 25 -12.370 -4.144 7.912 1.00 42.31 O ATOM 0 H SER A 25 -10.730 -2.023 10.744 1.00 23.21 H new ATOM 0 HA SER A 25 -12.904 -3.867 10.502 1.00 23.20 H new ATOM 0 HB2 SER A 25 -12.179 -2.267 8.737 1.00 12.32 H new ATOM 0 HB3 SER A 25 -10.681 -3.156 8.554 1.00 12.32 H new ATOM 0 HG SER A 25 -12.278 -3.798 7.000 1.00 42.31 H new ATOM 405 N ASP A 26 -9.807 -5.073 10.652 1.00 64.50 N ATOM 406 CA ASP A 26 -9.010 -6.275 10.968 1.00 54.31 C ATOM 407 C ASP A 26 -7.572 -5.888 11.414 1.00 13.21 C ATOM 408 O ASP A 26 -6.762 -5.455 10.584 1.00 4.25 O ATOM 409 CB ASP A 26 -8.961 -7.258 9.767 1.00 1.32 C ATOM 410 CG ASP A 26 -8.388 -8.624 10.163 1.00 33.44 C ATOM 411 OD1 ASP A 26 -9.106 -9.413 10.827 1.00 64.42 O ATOM 412 OD2 ASP A 26 -7.225 -8.917 9.835 1.00 24.41 O ATOM 0 H ASP A 26 -9.253 -4.221 10.569 1.00 64.50 H new ATOM 0 HA ASP A 26 -9.503 -6.784 11.797 1.00 54.31 H new ATOM 0 HB2 ASP A 26 -9.966 -7.389 9.365 1.00 1.32 H new ATOM 0 HB3 ASP A 26 -8.353 -6.827 8.971 1.00 1.32 H new ATOM 417 N PRO A 27 -7.239 -6.019 12.749 1.00 24.01 N ATOM 418 CA PRO A 27 -5.867 -5.756 13.274 1.00 63.32 C ATOM 419 C PRO A 27 -4.878 -6.933 13.062 1.00 0.52 C ATOM 420 O PRO A 27 -3.694 -6.821 13.421 1.00 1.05 O ATOM 421 CB PRO A 27 -6.138 -5.512 14.782 1.00 13.11 C ATOM 422 CG PRO A 27 -7.320 -6.381 15.100 1.00 44.12 C ATOM 423 CD PRO A 27 -8.185 -6.378 13.854 1.00 63.41 C ATOM 0 HA PRO A 27 -5.380 -4.928 12.759 1.00 63.32 H new ATOM 0 HB2 PRO A 27 -5.273 -5.781 15.389 1.00 13.11 H new ATOM 0 HB3 PRO A 27 -6.353 -4.462 14.981 1.00 13.11 H new ATOM 0 HG2 PRO A 27 -7.004 -7.393 15.354 1.00 44.12 H new ATOM 0 HG3 PRO A 27 -7.870 -5.994 15.958 1.00 44.12 H new ATOM 0 HD2 PRO A 27 -8.643 -7.353 13.685 1.00 63.41 H new ATOM 0 HD3 PRO A 27 -8.996 -5.654 13.934 1.00 63.41 H new ATOM 431 N ASN A 28 -5.372 -8.049 12.502 1.00 5.33 N ATOM 432 CA ASN A 28 -4.573 -9.264 12.251 1.00 41.10 C ATOM 433 C ASN A 28 -3.715 -9.082 10.976 1.00 14.52 C ATOM 434 O ASN A 28 -2.590 -9.598 10.894 1.00 34.24 O ATOM 435 CB ASN A 28 -5.548 -10.469 12.156 1.00 44.21 C ATOM 436 CG ASN A 28 -4.896 -11.854 12.163 1.00 64.21 C ATOM 437 OD1 ASN A 28 -3.779 -12.051 11.694 1.00 1.14 O ATOM 438 ND2 ASN A 28 -5.616 -12.837 12.664 1.00 54.42 N ATOM 0 H ASN A 28 -6.345 -8.136 12.208 1.00 5.33 H new ATOM 0 HA ASN A 28 -3.873 -9.452 13.065 1.00 41.10 H new ATOM 0 HB2 ASN A 28 -6.248 -10.413 12.990 1.00 44.21 H new ATOM 0 HB3 ASN A 28 -6.133 -10.368 11.242 1.00 44.21 H new ATOM 0 HD21 ASN A 28 -5.248 -13.788 12.668 1.00 54.42 H new ATOM 0 HD22 ASN A 28 -6.542 -12.647 13.048 1.00 54.42 H new ATOM 445 N VAL A 29 -4.257 -8.322 10.004 1.00 31.21 N ATOM 446 CA VAL A 29 -3.512 -7.875 8.808 1.00 32.20 C ATOM 447 C VAL A 29 -2.364 -6.928 9.236 1.00 52.53 C ATOM 448 O VAL A 29 -2.580 -6.059 10.098 1.00 40.22 O ATOM 449 CB VAL A 29 -4.473 -7.145 7.786 1.00 70.11 C ATOM 450 CG1 VAL A 29 -3.698 -6.453 6.643 1.00 22.34 C ATOM 451 CG2 VAL A 29 -5.507 -8.130 7.207 1.00 32.42 C ATOM 0 H VAL A 29 -5.225 -8.000 10.025 1.00 31.21 H new ATOM 0 HA VAL A 29 -3.092 -8.749 8.310 1.00 32.20 H new ATOM 0 HB VAL A 29 -4.995 -6.368 8.345 1.00 70.11 H new ATOM 0 HG11 VAL A 29 -4.402 -5.966 5.968 1.00 22.34 H new ATOM 0 HG12 VAL A 29 -3.022 -5.707 7.061 1.00 22.34 H new ATOM 0 HG13 VAL A 29 -3.122 -7.196 6.092 1.00 22.34 H new ATOM 0 HG21 VAL A 29 -6.157 -7.605 6.507 1.00 32.42 H new ATOM 0 HG22 VAL A 29 -4.990 -8.937 6.687 1.00 32.42 H new ATOM 0 HG23 VAL A 29 -6.107 -8.546 8.017 1.00 32.42 H new ATOM 461 N LYS A 30 -1.160 -7.108 8.630 1.00 2.25 N ATOM 462 CA LYS A 30 0.043 -6.312 8.957 1.00 14.11 C ATOM 463 C LYS A 30 -0.101 -4.865 8.456 1.00 11.43 C ATOM 464 O LYS A 30 0.319 -4.523 7.351 1.00 13.40 O ATOM 465 CB LYS A 30 1.328 -6.987 8.379 1.00 20.31 C ATOM 466 CG LYS A 30 1.683 -8.340 9.022 1.00 64.32 C ATOM 467 CD LYS A 30 2.024 -8.227 10.521 1.00 34.41 C ATOM 468 CE LYS A 30 3.320 -7.441 10.786 1.00 22.10 C ATOM 469 NZ LYS A 30 3.632 -7.390 12.237 1.00 11.23 N ATOM 0 H LYS A 30 -1.002 -7.807 7.905 1.00 2.25 H new ATOM 0 HA LYS A 30 0.143 -6.277 10.042 1.00 14.11 H new ATOM 0 HB2 LYS A 30 1.196 -7.132 7.307 1.00 20.31 H new ATOM 0 HB3 LYS A 30 2.170 -6.306 8.507 1.00 20.31 H new ATOM 0 HG2 LYS A 30 0.845 -9.026 8.897 1.00 64.32 H new ATOM 0 HG3 LYS A 30 2.532 -8.775 8.494 1.00 64.32 H new ATOM 0 HD2 LYS A 30 1.198 -7.740 11.040 1.00 34.41 H new ATOM 0 HD3 LYS A 30 2.120 -9.228 10.942 1.00 34.41 H new ATOM 0 HE2 LYS A 30 4.147 -7.907 10.250 1.00 22.10 H new ATOM 0 HE3 LYS A 30 3.219 -6.428 10.397 1.00 22.10 H new ATOM 0 HZ1 LYS A 30 4.511 -6.854 12.384 1.00 11.23 H new ATOM 0 HZ2 LYS A 30 2.853 -6.923 12.743 1.00 11.23 H new ATOM 0 HZ3 LYS A 30 3.751 -8.357 12.601 1.00 11.23 H new ATOM 483 N THR A 31 -0.737 -4.043 9.290 1.00 63.54 N ATOM 484 CA THR A 31 -1.008 -2.636 9.011 1.00 54.42 C ATOM 485 C THR A 31 0.097 -1.768 9.628 1.00 31.31 C ATOM 486 O THR A 31 0.032 -1.360 10.798 1.00 70.11 O ATOM 487 CB THR A 31 -2.406 -2.262 9.564 1.00 34.22 C ATOM 488 OG1 THR A 31 -2.509 -2.646 10.951 1.00 10.05 O ATOM 489 CG2 THR A 31 -3.523 -2.957 8.788 1.00 33.31 C ATOM 0 H THR A 31 -1.086 -4.346 10.200 1.00 63.54 H new ATOM 0 HA THR A 31 -1.012 -2.458 7.936 1.00 54.42 H new ATOM 0 HB THR A 31 -2.518 -1.183 9.456 1.00 34.22 H new ATOM 0 HG1 THR A 31 -1.708 -2.351 11.432 1.00 10.05 H new ATOM 0 HG21 THR A 31 -4.488 -2.670 9.205 1.00 33.31 H new ATOM 0 HG22 THR A 31 -3.477 -2.660 7.740 1.00 33.31 H new ATOM 0 HG23 THR A 31 -3.401 -4.037 8.864 1.00 33.31 H new ATOM 497 N VAL A 32 1.139 -1.530 8.834 1.00 52.55 N ATOM 498 CA VAL A 32 2.405 -0.958 9.298 1.00 54.11 C ATOM 499 C VAL A 32 2.757 0.300 8.480 1.00 43.13 C ATOM 500 O VAL A 32 2.956 0.217 7.267 1.00 63.10 O ATOM 501 CB VAL A 32 3.561 -2.030 9.175 1.00 65.44 C ATOM 502 CG1 VAL A 32 4.909 -1.467 9.668 1.00 73.33 C ATOM 503 CG2 VAL A 32 3.212 -3.350 9.916 1.00 0.15 C ATOM 0 H VAL A 32 1.129 -1.732 7.834 1.00 52.55 H new ATOM 0 HA VAL A 32 2.298 -0.673 10.344 1.00 54.11 H new ATOM 0 HB VAL A 32 3.660 -2.264 8.115 1.00 65.44 H new ATOM 0 HG11 VAL A 32 5.680 -2.231 9.569 1.00 73.33 H new ATOM 0 HG12 VAL A 32 5.181 -0.597 9.070 1.00 73.33 H new ATOM 0 HG13 VAL A 32 4.820 -1.174 10.714 1.00 73.33 H new ATOM 0 HG21 VAL A 32 4.034 -4.058 9.805 1.00 0.15 H new ATOM 0 HG22 VAL A 32 3.052 -3.142 10.974 1.00 0.15 H new ATOM 0 HG23 VAL A 32 2.305 -3.778 9.489 1.00 0.15 H new ATOM 513 N ARG A 33 2.810 1.466 9.146 1.00 70.23 N ATOM 514 CA ARG A 33 3.312 2.716 8.549 1.00 1.44 C ATOM 515 C ARG A 33 4.841 2.687 8.650 1.00 4.40 C ATOM 516 O ARG A 33 5.395 2.905 9.734 1.00 30.15 O ATOM 517 CB ARG A 33 2.697 3.963 9.277 1.00 52.14 C ATOM 518 CG ARG A 33 2.999 5.363 8.618 1.00 72.02 C ATOM 519 CD ARG A 33 3.989 6.258 9.404 1.00 62.33 C ATOM 520 NE ARG A 33 5.360 5.706 9.468 1.00 13.32 N ATOM 521 CZ ARG A 33 6.396 6.065 8.676 1.00 53.45 C ATOM 522 NH1 ARG A 33 6.263 6.981 7.718 1.00 52.51 N ATOM 523 NH2 ARG A 33 7.570 5.488 8.856 1.00 60.53 N ATOM 0 H ARG A 33 2.506 1.569 10.114 1.00 70.23 H new ATOM 0 HA ARG A 33 3.015 2.797 7.503 1.00 1.44 H new ATOM 0 HB2 ARG A 33 1.616 3.833 9.328 1.00 52.14 H new ATOM 0 HB3 ARG A 33 3.065 3.979 10.303 1.00 52.14 H new ATOM 0 HG2 ARG A 33 3.398 5.198 7.617 1.00 72.02 H new ATOM 0 HG3 ARG A 33 2.059 5.903 8.501 1.00 72.02 H new ATOM 0 HD2 ARG A 33 4.024 7.243 8.939 1.00 62.33 H new ATOM 0 HD3 ARG A 33 3.614 6.397 10.418 1.00 62.33 H new ATOM 0 HE ARG A 33 5.540 4.991 10.172 1.00 13.32 H new ATOM 0 HH11 ARG A 33 5.361 7.433 7.566 1.00 52.51 H new ATOM 0 HH12 ARG A 33 7.063 7.231 7.137 1.00 52.51 H new ATOM 0 HH21 ARG A 33 7.685 4.783 9.584 1.00 60.53 H new ATOM 0 HH22 ARG A 33 8.361 5.747 8.267 1.00 60.53 H new ATOM 537 N THR A 34 5.517 2.341 7.542 1.00 12.30 N ATOM 538 CA THR A 34 6.979 2.182 7.496 1.00 40.20 C ATOM 539 C THR A 34 7.488 2.431 6.064 1.00 35.41 C ATOM 540 O THR A 34 7.123 1.708 5.136 1.00 14.31 O ATOM 541 CB THR A 34 7.410 0.750 8.003 1.00 31.03 C ATOM 542 OG1 THR A 34 7.204 0.639 9.421 1.00 23.23 O ATOM 543 CG2 THR A 34 8.874 0.412 7.715 1.00 23.10 C ATOM 0 H THR A 34 5.061 2.163 6.647 1.00 12.30 H new ATOM 0 HA THR A 34 7.429 2.917 8.163 1.00 40.20 H new ATOM 0 HB THR A 34 6.786 0.047 7.452 1.00 31.03 H new ATOM 0 HG1 THR A 34 6.718 1.427 9.744 1.00 23.23 H new ATOM 0 HG21 THR A 34 9.098 -0.586 8.091 1.00 23.10 H new ATOM 0 HG22 THR A 34 9.050 0.442 6.640 1.00 23.10 H new ATOM 0 HG23 THR A 34 9.519 1.139 8.209 1.00 23.10 H new ATOM 551 N ASP A 35 8.319 3.479 5.898 1.00 75.32 N ATOM 552 CA ASP A 35 8.965 3.819 4.606 1.00 63.12 C ATOM 553 C ASP A 35 10.365 3.188 4.507 1.00 42.42 C ATOM 554 O ASP A 35 11.057 3.357 3.501 1.00 1.44 O ATOM 555 CB ASP A 35 9.029 5.362 4.422 1.00 5.15 C ATOM 556 CG ASP A 35 9.846 6.072 5.519 1.00 71.32 C ATOM 557 OD1 ASP A 35 9.314 6.254 6.639 1.00 43.34 O ATOM 558 OD2 ASP A 35 11.015 6.444 5.269 1.00 72.23 O ATOM 0 H ASP A 35 8.564 4.117 6.655 1.00 75.32 H new ATOM 0 HA ASP A 35 8.360 3.405 3.799 1.00 63.12 H new ATOM 0 HB2 ASP A 35 9.466 5.587 3.449 1.00 5.15 H new ATOM 0 HB3 ASP A 35 8.015 5.763 4.416 1.00 5.15 H new ATOM 563 N ASP A 36 10.772 2.469 5.569 1.00 23.32 N ATOM 564 CA ASP A 36 12.006 1.672 5.585 1.00 12.34 C ATOM 565 C ASP A 36 11.829 0.456 4.652 1.00 1.34 C ATOM 566 O ASP A 36 11.251 -0.563 5.048 1.00 43.22 O ATOM 567 CB ASP A 36 12.354 1.205 7.024 1.00 13.34 C ATOM 568 CG ASP A 36 12.462 2.350 8.030 1.00 30.33 C ATOM 569 OD1 ASP A 36 11.412 2.912 8.413 1.00 24.35 O ATOM 570 OD2 ASP A 36 13.582 2.690 8.458 1.00 74.34 O ATOM 0 H ASP A 36 10.249 2.426 6.444 1.00 23.32 H new ATOM 0 HA ASP A 36 12.832 2.290 5.233 1.00 12.34 H new ATOM 0 HB2 ASP A 36 11.591 0.505 7.364 1.00 13.34 H new ATOM 0 HB3 ASP A 36 13.299 0.662 7.002 1.00 13.34 H new ATOM 575 N LYS A 37 12.298 0.620 3.410 1.00 10.03 N ATOM 576 CA LYS A 37 12.175 -0.368 2.310 1.00 34.31 C ATOM 577 C LYS A 37 12.610 -1.801 2.709 1.00 13.00 C ATOM 578 O LYS A 37 11.912 -2.777 2.397 1.00 30.21 O ATOM 579 CB LYS A 37 12.958 0.143 1.053 1.00 31.25 C ATOM 580 CG LYS A 37 14.318 0.801 1.383 1.00 43.23 C ATOM 581 CD LYS A 37 15.028 1.428 0.155 1.00 33.42 C ATOM 582 CE LYS A 37 15.984 2.575 0.546 1.00 54.10 C ATOM 583 NZ LYS A 37 16.971 2.181 1.588 1.00 24.23 N ATOM 0 H LYS A 37 12.790 1.467 3.125 1.00 10.03 H new ATOM 0 HA LYS A 37 11.115 -0.451 2.069 1.00 34.31 H new ATOM 0 HB2 LYS A 37 13.126 -0.695 0.377 1.00 31.25 H new ATOM 0 HB3 LYS A 37 12.338 0.863 0.519 1.00 31.25 H new ATOM 0 HG2 LYS A 37 14.163 1.575 2.135 1.00 43.23 H new ATOM 0 HG3 LYS A 37 14.974 0.052 1.827 1.00 43.23 H new ATOM 0 HD2 LYS A 37 15.589 0.655 -0.370 1.00 33.42 H new ATOM 0 HD3 LYS A 37 14.278 1.805 -0.540 1.00 33.42 H new ATOM 0 HE2 LYS A 37 16.518 2.914 -0.342 1.00 54.10 H new ATOM 0 HE3 LYS A 37 15.399 3.420 0.909 1.00 54.10 H new ATOM 0 HZ1 LYS A 37 17.648 2.957 1.736 1.00 24.23 H new ATOM 0 HZ2 LYS A 37 16.474 1.981 2.479 1.00 24.23 H new ATOM 0 HZ3 LYS A 37 17.482 1.330 1.278 1.00 24.23 H new ATOM 597 N GLU A 38 13.742 -1.896 3.409 1.00 64.42 N ATOM 598 CA GLU A 38 14.346 -3.181 3.851 1.00 3.22 C ATOM 599 C GLU A 38 13.589 -3.787 5.054 1.00 23.11 C ATOM 600 O GLU A 38 13.495 -5.021 5.169 1.00 31.23 O ATOM 601 CB GLU A 38 15.876 -3.024 4.161 1.00 74.30 C ATOM 602 CG GLU A 38 16.263 -2.011 5.269 1.00 63.12 C ATOM 603 CD GLU A 38 16.011 -0.536 4.898 1.00 24.10 C ATOM 604 OE1 GLU A 38 16.584 -0.054 3.893 1.00 65.54 O ATOM 605 OE2 GLU A 38 15.198 0.130 5.563 1.00 43.20 O ATOM 0 H GLU A 38 14.282 -1.079 3.695 1.00 64.42 H new ATOM 0 HA GLU A 38 14.249 -3.881 3.021 1.00 3.22 H new ATOM 0 HB2 GLU A 38 16.268 -4.001 4.442 1.00 74.30 H new ATOM 0 HB3 GLU A 38 16.381 -2.731 3.241 1.00 74.30 H new ATOM 0 HG2 GLU A 38 15.701 -2.247 6.173 1.00 63.12 H new ATOM 0 HG3 GLU A 38 17.319 -2.138 5.508 1.00 63.12 H new ATOM 612 N LYS A 39 13.035 -2.922 5.934 1.00 72.44 N ATOM 613 CA LYS A 39 12.249 -3.366 7.114 1.00 10.24 C ATOM 614 C LYS A 39 10.929 -4.030 6.684 1.00 41.32 C ATOM 615 O LYS A 39 10.560 -5.097 7.201 1.00 44.50 O ATOM 616 CB LYS A 39 11.961 -2.180 8.074 1.00 62.03 C ATOM 617 CG LYS A 39 11.011 -2.512 9.259 1.00 54.51 C ATOM 618 CD LYS A 39 10.884 -1.350 10.279 1.00 72.22 C ATOM 619 CE LYS A 39 9.793 -1.606 11.336 1.00 71.03 C ATOM 620 NZ LYS A 39 8.435 -1.593 10.736 1.00 73.43 N ATOM 0 H LYS A 39 13.117 -1.909 5.851 1.00 72.44 H new ATOM 0 HA LYS A 39 12.850 -4.104 7.646 1.00 10.24 H new ATOM 0 HB2 LYS A 39 12.908 -1.819 8.476 1.00 62.03 H new ATOM 0 HB3 LYS A 39 11.527 -1.362 7.498 1.00 62.03 H new ATOM 0 HG2 LYS A 39 10.023 -2.754 8.868 1.00 54.51 H new ATOM 0 HG3 LYS A 39 11.377 -3.401 9.773 1.00 54.51 H new ATOM 0 HD2 LYS A 39 11.842 -1.204 10.779 1.00 72.22 H new ATOM 0 HD3 LYS A 39 10.658 -0.426 9.746 1.00 72.22 H new ATOM 0 HE2 LYS A 39 9.970 -2.568 11.816 1.00 71.03 H new ATOM 0 HE3 LYS A 39 9.854 -0.845 12.114 1.00 71.03 H new ATOM 0 HZ1 LYS A 39 7.746 -1.949 11.429 1.00 73.43 H new ATOM 0 HZ2 LYS A 39 8.184 -0.620 10.467 1.00 73.43 H new ATOM 0 HZ3 LYS A 39 8.423 -2.200 9.892 1.00 73.43 H new ATOM 634 N VAL A 40 10.245 -3.383 5.719 1.00 54.41 N ATOM 635 CA VAL A 40 8.963 -3.864 5.166 1.00 61.42 C ATOM 636 C VAL A 40 9.106 -5.282 4.584 1.00 73.34 C ATOM 637 O VAL A 40 8.220 -6.101 4.758 1.00 51.30 O ATOM 638 CB VAL A 40 8.394 -2.887 4.062 1.00 24.54 C ATOM 639 CG1 VAL A 40 7.108 -3.449 3.396 1.00 43.34 C ATOM 640 CG2 VAL A 40 8.133 -1.486 4.649 1.00 52.14 C ATOM 0 H VAL A 40 10.567 -2.510 5.300 1.00 54.41 H new ATOM 0 HA VAL A 40 8.254 -3.891 5.994 1.00 61.42 H new ATOM 0 HB VAL A 40 9.154 -2.802 3.285 1.00 24.54 H new ATOM 0 HG11 VAL A 40 6.751 -2.746 2.644 1.00 43.34 H new ATOM 0 HG12 VAL A 40 7.332 -4.405 2.922 1.00 43.34 H new ATOM 0 HG13 VAL A 40 6.338 -3.591 4.154 1.00 43.34 H new ATOM 0 HG21 VAL A 40 7.742 -0.832 3.870 1.00 52.14 H new ATOM 0 HG22 VAL A 40 7.407 -1.560 5.459 1.00 52.14 H new ATOM 0 HG23 VAL A 40 9.065 -1.074 5.034 1.00 52.14 H new ATOM 650 N LYS A 41 10.257 -5.549 3.931 1.00 40.14 N ATOM 651 CA LYS A 41 10.565 -6.853 3.294 1.00 31.10 C ATOM 652 C LYS A 41 10.520 -8.029 4.300 1.00 23.13 C ATOM 653 O LYS A 41 10.138 -9.154 3.946 1.00 51.40 O ATOM 654 CB LYS A 41 11.958 -6.782 2.620 1.00 62.12 C ATOM 655 CG LYS A 41 12.036 -5.784 1.445 1.00 24.33 C ATOM 656 CD LYS A 41 13.457 -5.675 0.838 1.00 65.34 C ATOM 657 CE LYS A 41 13.491 -4.783 -0.417 1.00 1.31 C ATOM 658 NZ LYS A 41 13.036 -3.397 -0.136 1.00 4.01 N ATOM 0 H LYS A 41 11.005 -4.863 3.829 1.00 40.14 H new ATOM 0 HA LYS A 41 9.796 -7.045 2.546 1.00 31.10 H new ATOM 0 HB2 LYS A 41 12.699 -6.504 3.369 1.00 62.12 H new ATOM 0 HB3 LYS A 41 12.227 -7.775 2.259 1.00 62.12 H new ATOM 0 HG2 LYS A 41 11.337 -6.091 0.667 1.00 24.33 H new ATOM 0 HG3 LYS A 41 11.717 -4.800 1.789 1.00 24.33 H new ATOM 0 HD2 LYS A 41 14.139 -5.271 1.586 1.00 65.34 H new ATOM 0 HD3 LYS A 41 13.818 -6.671 0.582 1.00 65.34 H new ATOM 0 HE2 LYS A 41 14.506 -4.756 -0.814 1.00 1.31 H new ATOM 0 HE3 LYS A 41 12.858 -5.221 -1.189 1.00 1.31 H new ATOM 0 HZ1 LYS A 41 13.124 -2.821 -0.998 1.00 4.01 H new ATOM 0 HZ2 LYS A 41 12.042 -3.413 0.169 1.00 4.01 H new ATOM 0 HZ3 LYS A 41 13.623 -2.985 0.617 1.00 4.01 H new ATOM 672 N GLU A 42 10.913 -7.737 5.545 1.00 0.33 N ATOM 673 CA GLU A 42 10.924 -8.710 6.651 1.00 12.04 C ATOM 674 C GLU A 42 9.483 -8.990 7.138 1.00 25.41 C ATOM 675 O GLU A 42 9.108 -10.139 7.410 1.00 43.12 O ATOM 676 CB GLU A 42 11.804 -8.152 7.800 1.00 70.53 C ATOM 677 CG GLU A 42 12.099 -9.156 8.923 1.00 62.54 C ATOM 678 CD GLU A 42 12.946 -8.542 10.045 1.00 11.21 C ATOM 679 OE1 GLU A 42 14.169 -8.357 9.844 1.00 53.42 O ATOM 680 OE2 GLU A 42 12.393 -8.227 11.116 1.00 14.23 O ATOM 0 H GLU A 42 11.236 -6.809 5.819 1.00 0.33 H new ATOM 0 HA GLU A 42 11.343 -9.656 6.307 1.00 12.04 H new ATOM 0 HB2 GLU A 42 12.749 -7.807 7.381 1.00 70.53 H new ATOM 0 HB3 GLU A 42 11.309 -7.281 8.230 1.00 70.53 H new ATOM 0 HG2 GLU A 42 11.159 -9.520 9.338 1.00 62.54 H new ATOM 0 HG3 GLU A 42 12.620 -10.019 8.508 1.00 62.54 H new ATOM 687 N GLU A 43 8.683 -7.917 7.191 1.00 5.43 N ATOM 688 CA GLU A 43 7.278 -7.959 7.651 1.00 42.21 C ATOM 689 C GLU A 43 6.356 -8.558 6.563 1.00 10.21 C ATOM 690 O GLU A 43 5.301 -9.123 6.877 1.00 42.14 O ATOM 691 CB GLU A 43 6.841 -6.533 8.055 1.00 31.23 C ATOM 692 CG GLU A 43 7.781 -5.883 9.095 1.00 20.34 C ATOM 693 CD GLU A 43 7.403 -4.432 9.419 1.00 75.44 C ATOM 694 OE1 GLU A 43 7.647 -3.546 8.571 1.00 23.12 O ATOM 695 OE2 GLU A 43 6.878 -4.165 10.529 1.00 64.44 O ATOM 0 H GLU A 43 8.990 -6.984 6.915 1.00 5.43 H new ATOM 0 HA GLU A 43 7.196 -8.611 8.521 1.00 42.21 H new ATOM 0 HB2 GLU A 43 6.804 -5.905 7.165 1.00 31.23 H new ATOM 0 HB3 GLU A 43 5.830 -6.570 8.461 1.00 31.23 H new ATOM 0 HG2 GLU A 43 7.761 -6.471 10.012 1.00 20.34 H new ATOM 0 HG3 GLU A 43 8.804 -5.911 8.720 1.00 20.34 H new ATOM 702 N ILE A 44 6.795 -8.413 5.288 1.00 55.02 N ATOM 703 CA ILE A 44 6.154 -8.998 4.093 1.00 74.34 C ATOM 704 C ILE A 44 6.097 -10.532 4.218 1.00 4.01 C ATOM 705 O ILE A 44 5.033 -11.139 4.011 1.00 15.45 O ATOM 706 CB ILE A 44 6.940 -8.564 2.767 1.00 15.23 C ATOM 707 CG1 ILE A 44 6.480 -7.150 2.263 1.00 14.53 C ATOM 708 CG2 ILE A 44 6.860 -9.615 1.633 1.00 30.32 C ATOM 709 CD1 ILE A 44 7.201 -6.658 1.014 1.00 60.34 C ATOM 0 H ILE A 44 7.628 -7.870 5.061 1.00 55.02 H new ATOM 0 HA ILE A 44 5.134 -8.620 4.021 1.00 74.34 H new ATOM 0 HB ILE A 44 7.991 -8.502 3.050 1.00 15.23 H new ATOM 0 HG12 ILE A 44 5.409 -7.181 2.060 1.00 14.53 H new ATOM 0 HG13 ILE A 44 6.632 -6.426 3.064 1.00 14.53 H new ATOM 0 HG21 ILE A 44 7.414 -9.257 0.765 1.00 30.32 H new ATOM 0 HG22 ILE A 44 7.292 -10.555 1.977 1.00 30.32 H new ATOM 0 HG23 ILE A 44 5.817 -9.775 1.358 1.00 30.32 H new ATOM 0 HD11 ILE A 44 6.820 -5.675 0.738 1.00 60.34 H new ATOM 0 HD12 ILE A 44 8.270 -6.590 1.214 1.00 60.34 H new ATOM 0 HD13 ILE A 44 7.029 -7.357 0.195 1.00 60.34 H new ATOM 721 N GLU A 45 7.260 -11.124 4.583 1.00 12.41 N ATOM 722 CA GLU A 45 7.423 -12.573 4.785 1.00 41.25 C ATOM 723 C GLU A 45 6.388 -13.104 5.794 1.00 70.31 C ATOM 724 O GLU A 45 5.685 -14.078 5.520 1.00 70.54 O ATOM 725 CB GLU A 45 8.858 -12.875 5.292 1.00 4.23 C ATOM 726 CG GLU A 45 9.125 -14.365 5.579 1.00 21.33 C ATOM 727 CD GLU A 45 10.494 -14.605 6.230 1.00 41.45 C ATOM 728 OE1 GLU A 45 11.512 -14.561 5.512 1.00 14.45 O ATOM 729 OE2 GLU A 45 10.552 -14.841 7.457 1.00 31.55 O ATOM 0 H GLU A 45 8.118 -10.597 4.746 1.00 12.41 H new ATOM 0 HA GLU A 45 7.263 -13.075 3.831 1.00 41.25 H new ATOM 0 HB2 GLU A 45 9.575 -12.525 4.549 1.00 4.23 H new ATOM 0 HB3 GLU A 45 9.038 -12.303 6.202 1.00 4.23 H new ATOM 0 HG2 GLU A 45 8.343 -14.751 6.233 1.00 21.33 H new ATOM 0 HG3 GLU A 45 9.067 -14.927 4.647 1.00 21.33 H new ATOM 736 N LYS A 46 6.281 -12.385 6.926 1.00 20.21 N ATOM 737 CA LYS A 46 5.385 -12.725 8.049 1.00 22.32 C ATOM 738 C LYS A 46 3.899 -12.683 7.625 1.00 1.50 C ATOM 739 O LYS A 46 3.103 -13.541 8.028 1.00 34.23 O ATOM 740 CB LYS A 46 5.626 -11.738 9.222 1.00 2.54 C ATOM 741 CG LYS A 46 7.094 -11.662 9.709 1.00 15.40 C ATOM 742 CD LYS A 46 7.300 -10.583 10.800 1.00 35.02 C ATOM 743 CE LYS A 46 8.769 -10.461 11.245 1.00 32.14 C ATOM 744 NZ LYS A 46 8.933 -9.423 12.297 1.00 25.04 N ATOM 0 H LYS A 46 6.823 -11.537 7.090 1.00 20.21 H new ATOM 0 HA LYS A 46 5.612 -13.743 8.367 1.00 22.32 H new ATOM 0 HB2 LYS A 46 5.307 -10.742 8.913 1.00 2.54 H new ATOM 0 HB3 LYS A 46 4.993 -12.029 10.060 1.00 2.54 H new ATOM 0 HG2 LYS A 46 7.394 -12.633 10.102 1.00 15.40 H new ATOM 0 HG3 LYS A 46 7.744 -11.446 8.861 1.00 15.40 H new ATOM 0 HD2 LYS A 46 6.958 -9.620 10.422 1.00 35.02 H new ATOM 0 HD3 LYS A 46 6.681 -10.824 11.665 1.00 35.02 H new ATOM 0 HE2 LYS A 46 9.117 -11.422 11.623 1.00 32.14 H new ATOM 0 HE3 LYS A 46 9.392 -10.212 10.386 1.00 32.14 H new ATOM 0 HZ1 LYS A 46 9.934 -9.366 12.575 1.00 25.04 H new ATOM 0 HZ2 LYS A 46 8.623 -8.502 11.927 1.00 25.04 H new ATOM 0 HZ3 LYS A 46 8.357 -9.675 13.126 1.00 25.04 H new ATOM 758 N ALA A 47 3.555 -11.683 6.790 1.00 32.20 N ATOM 759 CA ALA A 47 2.176 -11.453 6.327 1.00 31.44 C ATOM 760 C ALA A 47 1.698 -12.579 5.397 1.00 33.21 C ATOM 761 O ALA A 47 0.655 -13.203 5.640 1.00 70.53 O ATOM 762 CB ALA A 47 2.081 -10.099 5.617 1.00 13.22 C ATOM 0 H ALA A 47 4.228 -11.012 6.418 1.00 32.20 H new ATOM 0 HA ALA A 47 1.524 -11.447 7.200 1.00 31.44 H new ATOM 0 HB1 ALA A 47 1.058 -9.937 5.278 1.00 13.22 H new ATOM 0 HB2 ALA A 47 2.364 -9.305 6.308 1.00 13.22 H new ATOM 0 HB3 ALA A 47 2.753 -10.090 4.759 1.00 13.22 H new ATOM 768 N ARG A 48 2.484 -12.857 4.348 1.00 15.31 N ATOM 769 CA ARG A 48 2.138 -13.891 3.356 1.00 73.53 C ATOM 770 C ARG A 48 2.200 -15.300 3.985 1.00 1.13 C ATOM 771 O ARG A 48 1.485 -16.203 3.560 1.00 35.23 O ATOM 772 CB ARG A 48 3.013 -13.741 2.064 1.00 34.53 C ATOM 773 CG ARG A 48 4.562 -13.830 2.224 1.00 20.33 C ATOM 774 CD ARG A 48 5.109 -15.270 2.354 1.00 63.12 C ATOM 775 NE ARG A 48 6.579 -15.320 2.406 1.00 22.24 N ATOM 776 CZ ARG A 48 7.394 -15.350 1.342 1.00 53.21 C ATOM 777 NH1 ARG A 48 6.928 -15.333 0.097 1.00 1.43 N ATOM 778 NH2 ARG A 48 8.690 -15.427 1.536 1.00 13.12 N ATOM 0 H ARG A 48 3.366 -12.380 4.162 1.00 15.31 H new ATOM 0 HA ARG A 48 1.105 -13.748 3.038 1.00 73.53 H new ATOM 0 HB2 ARG A 48 2.704 -14.512 1.358 1.00 34.53 H new ATOM 0 HB3 ARG A 48 2.777 -12.779 1.609 1.00 34.53 H new ATOM 0 HG2 ARG A 48 5.032 -13.352 1.364 1.00 20.33 H new ATOM 0 HG3 ARG A 48 4.857 -13.261 3.106 1.00 20.33 H new ATOM 0 HD2 ARG A 48 4.702 -15.728 3.256 1.00 63.12 H new ATOM 0 HD3 ARG A 48 4.760 -15.864 1.509 1.00 63.12 H new ATOM 0 HE ARG A 48 7.014 -15.333 3.329 1.00 22.24 H new ATOM 0 HH11 ARG A 48 5.923 -15.296 -0.071 1.00 1.43 H new ATOM 0 HH12 ARG A 48 7.576 -15.357 -0.690 1.00 1.43 H new ATOM 0 HH21 ARG A 48 9.062 -15.463 2.485 1.00 13.12 H new ATOM 0 HH22 ARG A 48 9.325 -15.451 0.738 1.00 13.12 H new ATOM 792 N LYS A 49 3.053 -15.458 5.018 1.00 24.41 N ATOM 793 CA LYS A 49 3.196 -16.720 5.776 1.00 51.43 C ATOM 794 C LYS A 49 1.928 -17.012 6.605 1.00 63.30 C ATOM 795 O LYS A 49 1.459 -18.156 6.654 1.00 24.43 O ATOM 796 CB LYS A 49 4.441 -16.643 6.698 1.00 5.52 C ATOM 797 CG LYS A 49 4.760 -17.936 7.481 1.00 44.41 C ATOM 798 CD LYS A 49 5.993 -17.775 8.401 1.00 42.31 C ATOM 799 CE LYS A 49 6.250 -19.011 9.273 1.00 51.35 C ATOM 800 NZ LYS A 49 7.341 -18.774 10.250 1.00 14.43 N ATOM 0 H LYS A 49 3.664 -14.712 5.351 1.00 24.41 H new ATOM 0 HA LYS A 49 3.329 -17.537 5.067 1.00 51.43 H new ATOM 0 HB2 LYS A 49 5.308 -16.382 6.091 1.00 5.52 H new ATOM 0 HB3 LYS A 49 4.296 -15.832 7.411 1.00 5.52 H new ATOM 0 HG2 LYS A 49 3.895 -18.217 8.082 1.00 44.41 H new ATOM 0 HG3 LYS A 49 4.938 -18.750 6.778 1.00 44.41 H new ATOM 0 HD2 LYS A 49 6.874 -17.578 7.790 1.00 42.31 H new ATOM 0 HD3 LYS A 49 5.850 -16.906 9.043 1.00 42.31 H new ATOM 0 HE2 LYS A 49 5.337 -19.278 9.805 1.00 51.35 H new ATOM 0 HE3 LYS A 49 6.508 -19.858 8.637 1.00 51.35 H new ATOM 0 HZ1 LYS A 49 7.487 -19.630 10.822 1.00 14.43 H new ATOM 0 HZ2 LYS A 49 8.218 -18.544 9.741 1.00 14.43 H new ATOM 0 HZ3 LYS A 49 7.083 -17.982 10.873 1.00 14.43 H new ATOM 814 N GLN A 50 1.376 -15.953 7.239 1.00 10.14 N ATOM 815 CA GLN A 50 0.129 -16.056 8.037 1.00 1.51 C ATOM 816 C GLN A 50 -1.111 -16.087 7.113 1.00 44.20 C ATOM 817 O GLN A 50 -2.230 -16.351 7.573 1.00 43.02 O ATOM 818 CB GLN A 50 0.041 -14.893 9.084 1.00 41.33 C ATOM 819 CG GLN A 50 -0.440 -13.522 8.544 1.00 54.21 C ATOM 820 CD GLN A 50 -0.273 -12.359 9.531 1.00 70.20 C ATOM 821 OE1 GLN A 50 -0.288 -12.538 10.750 1.00 52.41 O ATOM 822 NE2 GLN A 50 -0.158 -11.152 9.009 1.00 63.52 N ATOM 0 H GLN A 50 1.774 -15.014 7.214 1.00 10.14 H new ATOM 0 HA GLN A 50 0.150 -16.995 8.591 1.00 1.51 H new ATOM 0 HB2 GLN A 50 -0.632 -15.202 9.884 1.00 41.33 H new ATOM 0 HB3 GLN A 50 1.026 -14.759 9.531 1.00 41.33 H new ATOM 0 HG2 GLN A 50 0.111 -13.291 7.632 1.00 54.21 H new ATOM 0 HG3 GLN A 50 -1.492 -13.602 8.270 1.00 54.21 H new ATOM 0 HE21 GLN A 50 -0.148 -11.033 7.996 1.00 63.52 H new ATOM 0 HE22 GLN A 50 -0.079 -10.338 9.619 1.00 63.52 H new ATOM 831 N GLY A 51 -0.890 -15.806 5.805 1.00 52.03 N ATOM 832 CA GLY A 51 -1.921 -15.939 4.770 1.00 34.34 C ATOM 833 C GLY A 51 -2.661 -14.642 4.463 1.00 71.35 C ATOM 834 O GLY A 51 -3.424 -14.581 3.492 1.00 21.53 O ATOM 0 H GLY A 51 0.009 -15.482 5.448 1.00 52.03 H new ATOM 0 HA2 GLY A 51 -1.457 -16.306 3.855 1.00 34.34 H new ATOM 0 HA3 GLY A 51 -2.643 -16.692 5.086 1.00 34.34 H new ATOM 838 N ARG A 52 -2.439 -13.598 5.284 1.00 33.11 N ATOM 839 CA ARG A 52 -3.170 -12.314 5.191 1.00 14.10 C ATOM 840 C ARG A 52 -2.292 -11.222 4.550 1.00 74.24 C ATOM 841 O ARG A 52 -1.069 -11.325 4.593 1.00 51.23 O ATOM 842 CB ARG A 52 -3.644 -11.887 6.612 1.00 62.41 C ATOM 843 CG ARG A 52 -4.617 -12.893 7.260 1.00 74.53 C ATOM 844 CD ARG A 52 -5.286 -12.356 8.530 1.00 64.22 C ATOM 845 NE ARG A 52 -6.272 -13.312 9.077 1.00 34.34 N ATOM 846 CZ ARG A 52 -7.417 -12.981 9.704 1.00 74.34 C ATOM 847 NH1 ARG A 52 -7.755 -11.715 9.870 1.00 4.21 N ATOM 848 NH2 ARG A 52 -8.215 -13.927 10.173 1.00 42.22 N ATOM 0 H ARG A 52 -1.747 -13.618 6.033 1.00 33.11 H new ATOM 0 HA ARG A 52 -4.041 -12.447 4.549 1.00 14.10 H new ATOM 0 HB2 ARG A 52 -2.773 -11.768 7.257 1.00 62.41 H new ATOM 0 HB3 ARG A 52 -4.129 -10.913 6.548 1.00 62.41 H new ATOM 0 HG2 ARG A 52 -5.388 -13.160 6.537 1.00 74.53 H new ATOM 0 HG3 ARG A 52 -4.076 -13.808 7.502 1.00 74.53 H new ATOM 0 HD2 ARG A 52 -4.525 -12.149 9.282 1.00 64.22 H new ATOM 0 HD3 ARG A 52 -5.781 -11.410 8.308 1.00 64.22 H new ATOM 0 HE ARG A 52 -6.068 -14.306 8.971 1.00 34.34 H new ATOM 0 HH11 ARG A 52 -7.146 -10.975 9.522 1.00 4.21 H new ATOM 0 HH12 ARG A 52 -8.625 -11.478 10.347 1.00 4.21 H new ATOM 0 HH21 ARG A 52 -7.963 -14.909 10.060 1.00 42.22 H new ATOM 0 HH22 ARG A 52 -9.082 -13.674 10.648 1.00 42.22 H new ATOM 862 N PRO A 53 -2.901 -10.150 3.927 1.00 71.13 N ATOM 863 CA PRO A 53 -2.129 -9.068 3.266 1.00 33.33 C ATOM 864 C PRO A 53 -1.280 -8.218 4.244 1.00 51.33 C ATOM 865 O PRO A 53 -1.315 -8.403 5.472 1.00 14.43 O ATOM 866 CB PRO A 53 -3.232 -8.208 2.579 1.00 41.23 C ATOM 867 CG PRO A 53 -4.479 -8.482 3.359 1.00 60.33 C ATOM 868 CD PRO A 53 -4.373 -9.927 3.784 1.00 31.44 C ATOM 0 HA PRO A 53 -1.390 -9.472 2.575 1.00 33.33 H new ATOM 0 HB2 PRO A 53 -2.977 -7.148 2.601 1.00 41.23 H new ATOM 0 HB3 PRO A 53 -3.353 -8.485 1.532 1.00 41.23 H new ATOM 0 HG2 PRO A 53 -4.555 -7.822 4.223 1.00 60.33 H new ATOM 0 HG3 PRO A 53 -5.368 -8.315 2.751 1.00 60.33 H new ATOM 0 HD2 PRO A 53 -4.898 -10.108 4.722 1.00 31.44 H new ATOM 0 HD3 PRO A 53 -4.809 -10.595 3.041 1.00 31.44 H new ATOM 876 N ILE A 54 -0.505 -7.289 3.667 1.00 53.21 N ATOM 877 CA ILE A 54 0.285 -6.309 4.418 1.00 64.21 C ATOM 878 C ILE A 54 -0.028 -4.903 3.870 1.00 44.41 C ATOM 879 O ILE A 54 0.216 -4.611 2.689 1.00 62.34 O ATOM 880 CB ILE A 54 1.831 -6.646 4.377 1.00 72.13 C ATOM 881 CG1 ILE A 54 2.671 -5.568 5.136 1.00 45.33 C ATOM 882 CG2 ILE A 54 2.352 -6.869 2.933 1.00 11.33 C ATOM 883 CD1 ILE A 54 4.151 -5.887 5.289 1.00 62.20 C ATOM 0 H ILE A 54 -0.409 -7.198 2.656 1.00 53.21 H new ATOM 0 HA ILE A 54 0.008 -6.345 5.472 1.00 64.21 H new ATOM 0 HB ILE A 54 1.960 -7.593 4.901 1.00 72.13 H new ATOM 0 HG12 ILE A 54 2.573 -4.618 4.610 1.00 45.33 H new ATOM 0 HG13 ILE A 54 2.242 -5.429 6.128 1.00 45.33 H new ATOM 0 HG21 ILE A 54 3.418 -7.097 2.962 1.00 11.33 H new ATOM 0 HG22 ILE A 54 1.815 -7.701 2.477 1.00 11.33 H new ATOM 0 HG23 ILE A 54 2.190 -5.966 2.344 1.00 11.33 H new ATOM 0 HD11 ILE A 54 4.644 -5.078 5.828 1.00 62.20 H new ATOM 0 HD12 ILE A 54 4.267 -6.817 5.845 1.00 62.20 H new ATOM 0 HD13 ILE A 54 4.604 -5.994 4.303 1.00 62.20 H new ATOM 895 N VAL A 55 -0.651 -4.063 4.719 1.00 20.31 N ATOM 896 CA VAL A 55 -1.062 -2.705 4.347 1.00 72.11 C ATOM 897 C VAL A 55 -0.024 -1.706 4.878 1.00 40.11 C ATOM 898 O VAL A 55 0.054 -1.478 6.083 1.00 54.33 O ATOM 899 CB VAL A 55 -2.494 -2.342 4.902 1.00 62.43 C ATOM 900 CG1 VAL A 55 -3.026 -1.049 4.249 1.00 75.30 C ATOM 901 CG2 VAL A 55 -3.493 -3.505 4.708 1.00 14.42 C ATOM 0 H VAL A 55 -0.881 -4.312 5.681 1.00 20.31 H new ATOM 0 HA VAL A 55 -1.118 -2.653 3.260 1.00 72.11 H new ATOM 0 HB VAL A 55 -2.394 -2.170 5.974 1.00 62.43 H new ATOM 0 HG11 VAL A 55 -4.014 -0.820 4.648 1.00 75.30 H new ATOM 0 HG12 VAL A 55 -2.347 -0.225 4.467 1.00 75.30 H new ATOM 0 HG13 VAL A 55 -3.093 -1.187 3.170 1.00 75.30 H new ATOM 0 HG21 VAL A 55 -4.468 -3.217 5.102 1.00 14.42 H new ATOM 0 HG22 VAL A 55 -3.584 -3.733 3.646 1.00 14.42 H new ATOM 0 HG23 VAL A 55 -3.133 -4.386 5.239 1.00 14.42 H new ATOM 911 N ILE A 56 0.776 -1.123 3.971 1.00 54.43 N ATOM 912 CA ILE A 56 1.855 -0.189 4.333 1.00 23.45 C ATOM 913 C ILE A 56 1.404 1.258 4.086 1.00 33.15 C ATOM 914 O ILE A 56 1.055 1.609 2.965 1.00 40.20 O ATOM 915 CB ILE A 56 3.173 -0.518 3.527 1.00 43.51 C ATOM 916 CG1 ILE A 56 3.673 -1.962 3.858 1.00 0.34 C ATOM 917 CG2 ILE A 56 4.293 0.515 3.805 1.00 15.00 C ATOM 918 CD1 ILE A 56 4.135 -2.162 5.304 1.00 70.12 C ATOM 0 H ILE A 56 0.694 -1.285 2.967 1.00 54.43 H new ATOM 0 HA ILE A 56 2.077 -0.304 5.394 1.00 23.45 H new ATOM 0 HB ILE A 56 2.928 -0.461 2.466 1.00 43.51 H new ATOM 0 HG12 ILE A 56 2.870 -2.668 3.646 1.00 0.34 H new ATOM 0 HG13 ILE A 56 4.498 -2.209 3.190 1.00 0.34 H new ATOM 0 HG21 ILE A 56 5.182 0.252 3.231 1.00 15.00 H new ATOM 0 HG22 ILE A 56 3.953 1.508 3.512 1.00 15.00 H new ATOM 0 HG23 ILE A 56 4.534 0.513 4.868 1.00 15.00 H new ATOM 0 HD11 ILE A 56 4.464 -3.192 5.442 1.00 70.12 H new ATOM 0 HD12 ILE A 56 4.962 -1.485 5.519 1.00 70.12 H new ATOM 0 HD13 ILE A 56 3.308 -1.951 5.983 1.00 70.12 H new ATOM 930 N PHE A 57 1.401 2.089 5.144 1.00 42.43 N ATOM 931 CA PHE A 57 0.997 3.509 5.050 1.00 75.22 C ATOM 932 C PHE A 57 2.232 4.391 4.832 1.00 30.24 C ATOM 933 O PHE A 57 3.229 4.283 5.556 1.00 61.42 O ATOM 934 CB PHE A 57 0.192 3.942 6.305 1.00 32.00 C ATOM 935 CG PHE A 57 -1.263 3.482 6.255 1.00 42.11 C ATOM 936 CD1 PHE A 57 -1.595 2.140 6.434 1.00 12.10 C ATOM 937 CD2 PHE A 57 -2.292 4.388 5.987 1.00 60.21 C ATOM 938 CE1 PHE A 57 -2.907 1.722 6.348 1.00 71.22 C ATOM 939 CE2 PHE A 57 -3.598 3.964 5.891 1.00 13.40 C ATOM 940 CZ PHE A 57 -3.904 2.632 6.073 1.00 73.41 C ATOM 0 H PHE A 57 1.676 1.801 6.083 1.00 42.43 H new ATOM 0 HA PHE A 57 0.338 3.633 4.191 1.00 75.22 H new ATOM 0 HB2 PHE A 57 0.668 3.534 7.196 1.00 32.00 H new ATOM 0 HB3 PHE A 57 0.223 5.028 6.396 1.00 32.00 H new ATOM 0 HD1 PHE A 57 -0.817 1.420 6.642 1.00 12.10 H new ATOM 0 HD2 PHE A 57 -2.060 5.434 5.853 1.00 60.21 H new ATOM 0 HE1 PHE A 57 -3.153 0.681 6.496 1.00 71.22 H new ATOM 0 HE2 PHE A 57 -4.382 4.674 5.673 1.00 13.40 H new ATOM 0 HZ PHE A 57 -4.929 2.301 6.000 1.00 73.41 H new ATOM 950 N ILE A 58 2.138 5.250 3.808 1.00 32.34 N ATOM 951 CA ILE A 58 3.256 6.034 3.259 1.00 13.45 C ATOM 952 C ILE A 58 2.747 7.431 2.870 1.00 4.22 C ATOM 953 O ILE A 58 1.625 7.568 2.399 1.00 50.34 O ATOM 954 CB ILE A 58 3.862 5.323 1.977 1.00 72.25 C ATOM 955 CG1 ILE A 58 4.451 3.920 2.315 1.00 52.12 C ATOM 956 CG2 ILE A 58 4.929 6.193 1.287 1.00 62.00 C ATOM 957 CD1 ILE A 58 5.634 3.942 3.260 1.00 64.11 C ATOM 0 H ILE A 58 1.257 5.425 3.324 1.00 32.34 H new ATOM 0 HA ILE A 58 4.036 6.113 4.016 1.00 13.45 H new ATOM 0 HB ILE A 58 3.033 5.187 1.283 1.00 72.25 H new ATOM 0 HG12 ILE A 58 3.664 3.307 2.754 1.00 52.12 H new ATOM 0 HG13 ILE A 58 4.753 3.435 1.387 1.00 52.12 H new ATOM 0 HG21 ILE A 58 5.318 5.668 0.414 1.00 62.00 H new ATOM 0 HG22 ILE A 58 4.482 7.137 0.974 1.00 62.00 H new ATOM 0 HG23 ILE A 58 5.744 6.391 1.984 1.00 62.00 H new ATOM 0 HD11 ILE A 58 5.977 2.923 3.438 1.00 64.11 H new ATOM 0 HD12 ILE A 58 6.442 4.525 2.818 1.00 64.11 H new ATOM 0 HD13 ILE A 58 5.336 4.395 4.206 1.00 64.11 H new ATOM 969 N ARG A 59 3.573 8.464 3.071 1.00 44.00 N ATOM 970 CA ARG A 59 3.249 9.833 2.633 1.00 5.24 C ATOM 971 C ARG A 59 3.843 10.075 1.224 1.00 20.33 C ATOM 972 O ARG A 59 4.828 9.435 0.861 1.00 74.12 O ATOM 973 CB ARG A 59 3.759 10.847 3.689 1.00 14.13 C ATOM 974 CG ARG A 59 3.149 12.258 3.573 1.00 32.32 C ATOM 975 CD ARG A 59 3.584 13.199 4.715 1.00 12.23 C ATOM 976 NE ARG A 59 2.953 14.520 4.594 1.00 42.50 N ATOM 977 CZ ARG A 59 2.711 15.365 5.607 1.00 42.54 C ATOM 978 NH1 ARG A 59 3.035 15.056 6.860 1.00 73.13 N ATOM 979 NH2 ARG A 59 2.110 16.511 5.352 1.00 24.23 N ATOM 0 H ARG A 59 4.477 8.380 3.537 1.00 44.00 H new ATOM 0 HA ARG A 59 2.171 9.970 2.554 1.00 5.24 H new ATOM 0 HB2 ARG A 59 3.546 10.454 4.683 1.00 14.13 H new ATOM 0 HB3 ARG A 59 4.843 10.926 3.603 1.00 14.13 H new ATOM 0 HG2 ARG A 59 3.440 12.696 2.618 1.00 32.32 H new ATOM 0 HG3 ARG A 59 2.062 12.179 3.569 1.00 32.32 H new ATOM 0 HD2 ARG A 59 3.319 12.755 5.675 1.00 12.23 H new ATOM 0 HD3 ARG A 59 4.668 13.310 4.703 1.00 12.23 H new ATOM 0 HE ARG A 59 2.675 14.820 3.660 1.00 42.50 H new ATOM 0 HH11 ARG A 59 3.477 14.160 7.066 1.00 73.13 H new ATOM 0 HH12 ARG A 59 2.841 15.715 7.614 1.00 73.13 H new ATOM 0 HH21 ARG A 59 1.837 16.742 4.397 1.00 24.23 H new ATOM 0 HH22 ARG A 59 1.918 17.166 6.110 1.00 24.23 H new ATOM 993 N GLY A 60 3.232 11.018 0.466 1.00 33.24 N ATOM 994 CA GLY A 60 3.551 11.271 -0.958 1.00 3.44 C ATOM 995 C GLY A 60 5.040 11.433 -1.302 1.00 72.15 C ATOM 996 O GLY A 60 5.487 10.956 -2.350 1.00 10.25 O ATOM 0 H GLY A 60 2.499 11.628 0.829 1.00 33.24 H new ATOM 0 HA2 GLY A 60 3.150 10.448 -1.550 1.00 3.44 H new ATOM 0 HA3 GLY A 60 3.027 12.174 -1.271 1.00 3.44 H new ATOM 1000 N ALA A 61 5.804 12.084 -0.400 1.00 20.44 N ATOM 1001 CA ALA A 61 7.265 12.301 -0.570 1.00 3.34 C ATOM 1002 C ALA A 61 8.050 10.975 -0.452 1.00 21.35 C ATOM 1003 O ALA A 61 9.004 10.719 -1.198 1.00 32.43 O ATOM 1004 CB ALA A 61 7.760 13.297 0.485 1.00 13.21 C ATOM 0 H ALA A 61 5.432 12.475 0.465 1.00 20.44 H new ATOM 0 HA ALA A 61 7.437 12.703 -1.568 1.00 3.34 H new ATOM 0 HB1 ALA A 61 8.831 13.456 0.361 1.00 13.21 H new ATOM 0 HB2 ALA A 61 7.236 14.245 0.365 1.00 13.21 H new ATOM 0 HB3 ALA A 61 7.566 12.899 1.481 1.00 13.21 H new ATOM 1010 N TYR A 62 7.600 10.147 0.491 1.00 55.24 N ATOM 1011 CA TYR A 62 8.209 8.848 0.844 1.00 63.34 C ATOM 1012 C TYR A 62 7.895 7.764 -0.202 1.00 0.43 C ATOM 1013 O TYR A 62 8.604 6.758 -0.263 1.00 12.32 O ATOM 1014 CB TYR A 62 7.748 8.406 2.256 1.00 2.04 C ATOM 1015 CG TYR A 62 8.147 9.393 3.367 1.00 41.21 C ATOM 1016 CD1 TYR A 62 7.364 10.511 3.656 1.00 72.14 C ATOM 1017 CD2 TYR A 62 9.313 9.215 4.106 1.00 32.43 C ATOM 1018 CE1 TYR A 62 7.732 11.411 4.634 1.00 62.30 C ATOM 1019 CE2 TYR A 62 9.681 10.108 5.090 1.00 63.24 C ATOM 1020 CZ TYR A 62 8.889 11.205 5.351 1.00 42.34 C ATOM 1021 OH TYR A 62 9.256 12.101 6.329 1.00 1.21 O ATOM 0 H TYR A 62 6.776 10.361 1.053 1.00 55.24 H new ATOM 0 HA TYR A 62 9.291 8.979 0.853 1.00 63.34 H new ATOM 0 HB2 TYR A 62 6.664 8.289 2.256 1.00 2.04 H new ATOM 0 HB3 TYR A 62 8.174 7.428 2.479 1.00 2.04 H new ATOM 0 HD1 TYR A 62 6.451 10.675 3.103 1.00 72.14 H new ATOM 0 HD2 TYR A 62 9.942 8.360 3.905 1.00 32.43 H new ATOM 0 HE1 TYR A 62 7.115 12.274 4.837 1.00 62.30 H new ATOM 0 HE2 TYR A 62 10.588 9.948 5.655 1.00 63.24 H new ATOM 0 HH TYR A 62 10.096 11.810 6.741 1.00 1.21 H new ATOM 1031 N GLU A 63 6.782 7.950 -0.950 1.00 74.34 N ATOM 1032 CA GLU A 63 6.248 6.966 -1.920 1.00 2.53 C ATOM 1033 C GLU A 63 7.304 6.461 -2.925 1.00 64.50 C ATOM 1034 O GLU A 63 7.240 5.304 -3.353 1.00 13.32 O ATOM 1035 CB GLU A 63 5.035 7.561 -2.672 1.00 42.22 C ATOM 1036 CG GLU A 63 4.300 6.549 -3.583 1.00 32.22 C ATOM 1037 CD GLU A 63 3.201 7.162 -4.464 1.00 41.10 C ATOM 1038 OE1 GLU A 63 3.480 8.137 -5.201 1.00 40.01 O ATOM 1039 OE2 GLU A 63 2.054 6.663 -4.448 1.00 21.33 O ATOM 0 H GLU A 63 6.222 8.801 -0.895 1.00 74.34 H new ATOM 0 HA GLU A 63 5.935 6.098 -1.339 1.00 2.53 H new ATOM 0 HB2 GLU A 63 4.328 7.958 -1.943 1.00 42.22 H new ATOM 0 HB3 GLU A 63 5.373 8.401 -3.279 1.00 42.22 H new ATOM 0 HG2 GLU A 63 5.032 6.060 -4.226 1.00 32.22 H new ATOM 0 HG3 GLU A 63 3.856 5.774 -2.958 1.00 32.22 H new ATOM 1046 N GLU A 64 8.288 7.318 -3.254 1.00 33.41 N ATOM 1047 CA GLU A 64 9.406 6.946 -4.138 1.00 5.23 C ATOM 1048 C GLU A 64 10.165 5.698 -3.611 1.00 63.21 C ATOM 1049 O GLU A 64 10.430 4.761 -4.372 1.00 41.03 O ATOM 1050 CB GLU A 64 10.374 8.140 -4.314 1.00 43.14 C ATOM 1051 CG GLU A 64 11.588 7.845 -5.224 1.00 60.23 C ATOM 1052 CD GLU A 64 11.204 7.406 -6.658 1.00 53.34 C ATOM 1053 OE1 GLU A 64 10.842 8.279 -7.479 1.00 32.31 O ATOM 1054 OE2 GLU A 64 11.277 6.198 -6.974 1.00 24.13 O ATOM 0 H GLU A 64 8.330 8.280 -2.917 1.00 33.41 H new ATOM 0 HA GLU A 64 8.987 6.686 -5.110 1.00 5.23 H new ATOM 0 HB2 GLU A 64 9.821 8.983 -4.728 1.00 43.14 H new ATOM 0 HB3 GLU A 64 10.736 8.447 -3.333 1.00 43.14 H new ATOM 0 HG2 GLU A 64 12.211 8.737 -5.282 1.00 60.23 H new ATOM 0 HG3 GLU A 64 12.193 7.063 -4.765 1.00 60.23 H new ATOM 1061 N VAL A 65 10.440 5.690 -2.294 1.00 24.15 N ATOM 1062 CA VAL A 65 11.196 4.618 -1.608 1.00 44.14 C ATOM 1063 C VAL A 65 10.484 3.233 -1.738 1.00 11.40 C ATOM 1064 O VAL A 65 11.141 2.178 -1.771 1.00 22.32 O ATOM 1065 CB VAL A 65 11.414 4.983 -0.087 1.00 22.23 C ATOM 1066 CG1 VAL A 65 12.298 3.945 0.631 1.00 12.33 C ATOM 1067 CG2 VAL A 65 11.991 6.416 0.086 1.00 11.23 C ATOM 0 H VAL A 65 10.141 6.436 -1.666 1.00 24.15 H new ATOM 0 HA VAL A 65 12.167 4.537 -2.096 1.00 44.14 H new ATOM 0 HB VAL A 65 10.431 4.962 0.383 1.00 22.23 H new ATOM 0 HG11 VAL A 65 12.423 4.233 1.675 1.00 12.33 H new ATOM 0 HG12 VAL A 65 11.823 2.965 0.580 1.00 12.33 H new ATOM 0 HG13 VAL A 65 13.274 3.901 0.147 1.00 12.33 H new ATOM 0 HG21 VAL A 65 12.126 6.628 1.147 1.00 11.23 H new ATOM 0 HG22 VAL A 65 12.952 6.485 -0.423 1.00 11.23 H new ATOM 0 HG23 VAL A 65 11.300 7.141 -0.344 1.00 11.23 H new ATOM 1077 N VAL A 66 9.135 3.270 -1.848 1.00 12.24 N ATOM 1078 CA VAL A 66 8.269 2.071 -1.967 1.00 21.04 C ATOM 1079 C VAL A 66 8.594 1.221 -3.220 1.00 12.45 C ATOM 1080 O VAL A 66 8.451 0.001 -3.187 1.00 52.43 O ATOM 1081 CB VAL A 66 6.741 2.465 -1.972 1.00 4.22 C ATOM 1082 CG1 VAL A 66 5.812 1.227 -2.097 1.00 35.54 C ATOM 1083 CG2 VAL A 66 6.391 3.298 -0.721 1.00 53.40 C ATOM 0 H VAL A 66 8.610 4.144 -1.857 1.00 12.24 H new ATOM 0 HA VAL A 66 8.479 1.461 -1.089 1.00 21.04 H new ATOM 0 HB VAL A 66 6.568 3.077 -2.857 1.00 4.22 H new ATOM 0 HG11 VAL A 66 4.771 1.551 -2.096 1.00 35.54 H new ATOM 0 HG12 VAL A 66 6.028 0.703 -3.028 1.00 35.54 H new ATOM 0 HG13 VAL A 66 5.984 0.557 -1.255 1.00 35.54 H new ATOM 0 HG21 VAL A 66 5.333 3.560 -0.743 1.00 53.40 H new ATOM 0 HG22 VAL A 66 6.602 2.715 0.175 1.00 53.40 H new ATOM 0 HG23 VAL A 66 6.990 4.208 -0.711 1.00 53.40 H new ATOM 1093 N ARG A 67 9.031 1.876 -4.314 1.00 12.32 N ATOM 1094 CA ARG A 67 9.329 1.200 -5.606 1.00 15.32 C ATOM 1095 C ARG A 67 10.408 0.093 -5.450 1.00 64.52 C ATOM 1096 O ARG A 67 10.389 -0.912 -6.174 1.00 12.20 O ATOM 1097 CB ARG A 67 9.736 2.244 -6.676 1.00 20.44 C ATOM 1098 CG ARG A 67 9.852 1.697 -8.120 1.00 31.41 C ATOM 1099 CD ARG A 67 9.791 2.813 -9.188 1.00 72.34 C ATOM 1100 NE ARG A 67 10.785 3.889 -8.958 1.00 73.10 N ATOM 1101 CZ ARG A 67 11.641 4.376 -9.871 1.00 50.35 C ATOM 1102 NH1 ARG A 67 11.664 3.906 -11.114 1.00 40.31 N ATOM 1103 NH2 ARG A 67 12.459 5.358 -9.530 1.00 50.41 N ATOM 0 H ARG A 67 9.189 2.884 -4.334 1.00 12.32 H new ATOM 0 HA ARG A 67 8.419 0.701 -5.940 1.00 15.32 H new ATOM 0 HB2 ARG A 67 9.005 3.052 -6.668 1.00 20.44 H new ATOM 0 HB3 ARG A 67 10.694 2.678 -6.391 1.00 20.44 H new ATOM 0 HG2 ARG A 67 10.790 1.152 -8.223 1.00 31.41 H new ATOM 0 HG3 ARG A 67 9.048 0.984 -8.300 1.00 31.41 H new ATOM 0 HD2 ARG A 67 9.958 2.376 -10.172 1.00 72.34 H new ATOM 0 HD3 ARG A 67 8.791 3.246 -9.197 1.00 72.34 H new ATOM 0 HE ARG A 67 10.822 4.295 -8.023 1.00 73.10 H new ATOM 0 HH11 ARG A 67 11.024 3.162 -11.390 1.00 40.31 H new ATOM 0 HH12 ARG A 67 12.322 4.290 -11.792 1.00 40.31 H new ATOM 0 HH21 ARG A 67 12.435 5.736 -8.583 1.00 50.41 H new ATOM 0 HH22 ARG A 67 13.114 5.737 -10.214 1.00 50.41 H new ATOM 1117 N ASP A 68 11.317 0.291 -4.476 1.00 34.21 N ATOM 1118 CA ASP A 68 12.350 -0.700 -4.105 1.00 74.13 C ATOM 1119 C ASP A 68 11.705 -1.956 -3.448 1.00 14.00 C ATOM 1120 O ASP A 68 12.119 -3.094 -3.710 1.00 74.22 O ATOM 1121 CB ASP A 68 13.379 -0.035 -3.149 1.00 71.12 C ATOM 1122 CG ASP A 68 14.558 -0.957 -2.783 1.00 52.53 C ATOM 1123 OD1 ASP A 68 15.516 -1.069 -3.578 1.00 54.34 O ATOM 1124 OD2 ASP A 68 14.528 -1.580 -1.704 1.00 25.25 O ATOM 0 H ASP A 68 11.357 1.146 -3.921 1.00 34.21 H new ATOM 0 HA ASP A 68 12.866 -1.034 -5.005 1.00 74.13 H new ATOM 0 HB2 ASP A 68 13.767 0.870 -3.617 1.00 71.12 H new ATOM 0 HB3 ASP A 68 12.870 0.272 -2.235 1.00 71.12 H new ATOM 1129 N ILE A 69 10.674 -1.719 -2.602 1.00 45.24 N ATOM 1130 CA ILE A 69 9.887 -2.788 -1.930 1.00 32.23 C ATOM 1131 C ILE A 69 9.129 -3.630 -2.981 1.00 74.13 C ATOM 1132 O ILE A 69 9.077 -4.864 -2.889 1.00 43.34 O ATOM 1133 CB ILE A 69 8.828 -2.195 -0.914 1.00 21.11 C ATOM 1134 CG1 ILE A 69 9.473 -1.142 0.037 1.00 33.52 C ATOM 1135 CG2 ILE A 69 8.144 -3.324 -0.103 1.00 63.24 C ATOM 1136 CD1 ILE A 69 8.489 -0.416 0.945 1.00 35.03 C ATOM 0 H ILE A 69 10.361 -0.778 -2.364 1.00 45.24 H new ATOM 0 HA ILE A 69 10.597 -3.405 -1.379 1.00 32.23 H new ATOM 0 HB ILE A 69 8.063 -1.685 -1.500 1.00 21.11 H new ATOM 0 HG12 ILE A 69 10.218 -1.641 0.657 1.00 33.52 H new ATOM 0 HG13 ILE A 69 10.002 -0.404 -0.566 1.00 33.52 H new ATOM 0 HG21 ILE A 69 7.421 -2.889 0.587 1.00 63.24 H new ATOM 0 HG22 ILE A 69 7.632 -4.003 -0.785 1.00 63.24 H new ATOM 0 HG23 ILE A 69 8.897 -3.875 0.460 1.00 63.24 H new ATOM 0 HD11 ILE A 69 9.028 0.296 1.570 1.00 35.03 H new ATOM 0 HD12 ILE A 69 7.757 0.116 0.337 1.00 35.03 H new ATOM 0 HD13 ILE A 69 7.977 -1.140 1.579 1.00 35.03 H new ATOM 1148 N VAL A 70 8.558 -2.911 -3.973 1.00 2.13 N ATOM 1149 CA VAL A 70 7.724 -3.474 -5.053 1.00 54.35 C ATOM 1150 C VAL A 70 8.459 -4.591 -5.831 1.00 11.05 C ATOM 1151 O VAL A 70 7.852 -5.618 -6.162 1.00 61.32 O ATOM 1152 CB VAL A 70 7.266 -2.328 -6.040 1.00 3.03 C ATOM 1153 CG1 VAL A 70 6.572 -2.881 -7.301 1.00 14.40 C ATOM 1154 CG2 VAL A 70 6.351 -1.309 -5.314 1.00 41.22 C ATOM 0 H VAL A 70 8.668 -1.900 -4.045 1.00 2.13 H new ATOM 0 HA VAL A 70 6.846 -3.924 -4.590 1.00 54.35 H new ATOM 0 HB VAL A 70 8.169 -1.815 -6.371 1.00 3.03 H new ATOM 0 HG11 VAL A 70 6.277 -2.054 -7.946 1.00 14.40 H new ATOM 0 HG12 VAL A 70 7.260 -3.533 -7.839 1.00 14.40 H new ATOM 0 HG13 VAL A 70 5.688 -3.448 -7.010 1.00 14.40 H new ATOM 0 HG21 VAL A 70 6.048 -0.529 -6.013 1.00 41.22 H new ATOM 0 HG22 VAL A 70 5.466 -1.820 -4.935 1.00 41.22 H new ATOM 0 HG23 VAL A 70 6.894 -0.860 -4.483 1.00 41.22 H new ATOM 1164 N GLU A 71 9.770 -4.373 -6.095 1.00 75.34 N ATOM 1165 CA GLU A 71 10.619 -5.355 -6.809 1.00 64.31 C ATOM 1166 C GLU A 71 10.678 -6.689 -6.050 1.00 23.23 C ATOM 1167 O GLU A 71 10.395 -7.746 -6.622 1.00 55.22 O ATOM 1168 CB GLU A 71 12.060 -4.825 -7.019 1.00 52.44 C ATOM 1169 CG GLU A 71 12.159 -3.513 -7.814 1.00 0.51 C ATOM 1170 CD GLU A 71 13.613 -3.158 -8.148 1.00 14.42 C ATOM 1171 OE1 GLU A 71 14.314 -2.595 -7.280 1.00 62.32 O ATOM 1172 OE2 GLU A 71 14.076 -3.468 -9.274 1.00 12.22 O ATOM 0 H GLU A 71 10.263 -3.523 -5.823 1.00 75.34 H new ATOM 0 HA GLU A 71 10.160 -5.513 -7.785 1.00 64.31 H new ATOM 0 HB2 GLU A 71 12.523 -4.677 -6.043 1.00 52.44 H new ATOM 0 HB3 GLU A 71 12.641 -5.590 -7.535 1.00 52.44 H new ATOM 0 HG2 GLU A 71 11.586 -3.603 -8.737 1.00 0.51 H new ATOM 0 HG3 GLU A 71 11.710 -2.704 -7.238 1.00 0.51 H new ATOM 1179 N TYR A 72 10.995 -6.589 -4.747 1.00 15.24 N ATOM 1180 CA TYR A 72 11.116 -7.742 -3.834 1.00 15.02 C ATOM 1181 C TYR A 72 9.783 -8.485 -3.701 1.00 64.32 C ATOM 1182 O TYR A 72 9.755 -9.713 -3.641 1.00 52.42 O ATOM 1183 CB TYR A 72 11.595 -7.256 -2.440 1.00 51.45 C ATOM 1184 CG TYR A 72 11.692 -8.343 -1.341 1.00 54.25 C ATOM 1185 CD1 TYR A 72 12.867 -9.080 -1.144 1.00 72.42 C ATOM 1186 CD2 TYR A 72 10.612 -8.607 -0.487 1.00 2.14 C ATOM 1187 CE1 TYR A 72 12.954 -10.026 -0.139 1.00 54.11 C ATOM 1188 CE2 TYR A 72 10.695 -9.556 0.505 1.00 45.33 C ATOM 1189 CZ TYR A 72 11.867 -10.258 0.678 1.00 13.34 C ATOM 1190 OH TYR A 72 11.963 -11.181 1.688 1.00 43.11 O ATOM 0 H TYR A 72 11.177 -5.695 -4.292 1.00 15.24 H new ATOM 0 HA TYR A 72 11.847 -8.435 -4.250 1.00 15.02 H new ATOM 0 HB2 TYR A 72 12.576 -6.794 -2.555 1.00 51.45 H new ATOM 0 HB3 TYR A 72 10.915 -6.477 -2.095 1.00 51.45 H new ATOM 0 HD1 TYR A 72 13.718 -8.907 -1.787 1.00 72.42 H new ATOM 0 HD2 TYR A 72 9.694 -8.052 -0.611 1.00 2.14 H new ATOM 0 HE1 TYR A 72 13.869 -10.581 0.006 1.00 54.11 H new ATOM 0 HE2 TYR A 72 9.846 -9.749 1.144 1.00 45.33 H new ATOM 0 HH TYR A 72 11.112 -11.226 2.172 1.00 43.11 H new ATOM 1200 N ALA A 73 8.683 -7.720 -3.641 1.00 13.55 N ATOM 1201 CA ALA A 73 7.340 -8.281 -3.463 1.00 44.45 C ATOM 1202 C ALA A 73 6.932 -9.123 -4.691 1.00 13.21 C ATOM 1203 O ALA A 73 6.460 -10.245 -4.538 1.00 51.10 O ATOM 1204 CB ALA A 73 6.343 -7.158 -3.165 1.00 4.12 C ATOM 0 H ALA A 73 8.701 -6.703 -3.714 1.00 13.55 H new ATOM 0 HA ALA A 73 7.340 -8.957 -2.608 1.00 44.45 H new ATOM 0 HB1 ALA A 73 5.347 -7.581 -3.034 1.00 4.12 H new ATOM 0 HB2 ALA A 73 6.640 -6.640 -2.253 1.00 4.12 H new ATOM 0 HB3 ALA A 73 6.331 -6.452 -3.996 1.00 4.12 H new ATOM 1210 N GLN A 74 7.183 -8.597 -5.906 1.00 4.45 N ATOM 1211 CA GLN A 74 6.909 -9.329 -7.170 1.00 75.34 C ATOM 1212 C GLN A 74 7.880 -10.515 -7.347 1.00 61.11 C ATOM 1213 O GLN A 74 7.539 -11.499 -8.002 1.00 13.45 O ATOM 1214 CB GLN A 74 6.950 -8.376 -8.393 1.00 23.50 C ATOM 1215 CG GLN A 74 5.915 -7.234 -8.327 1.00 24.54 C ATOM 1216 CD GLN A 74 5.828 -6.406 -9.609 1.00 14.34 C ATOM 1217 OE1 GLN A 74 5.013 -6.687 -10.489 1.00 30.12 O ATOM 1218 NE2 GLN A 74 6.662 -5.385 -9.729 1.00 21.23 N ATOM 0 H GLN A 74 7.576 -7.666 -6.044 1.00 4.45 H new ATOM 0 HA GLN A 74 5.900 -9.736 -7.107 1.00 75.34 H new ATOM 0 HB2 GLN A 74 7.948 -7.945 -8.473 1.00 23.50 H new ATOM 0 HB3 GLN A 74 6.780 -8.956 -9.300 1.00 23.50 H new ATOM 0 HG2 GLN A 74 4.934 -7.657 -8.112 1.00 24.54 H new ATOM 0 HG3 GLN A 74 6.167 -6.575 -7.496 1.00 24.54 H new ATOM 0 HE21 GLN A 74 7.325 -5.178 -8.982 1.00 21.23 H new ATOM 0 HE22 GLN A 74 6.641 -4.805 -10.568 1.00 21.23 H new ATOM 1227 N LYS A 75 9.094 -10.405 -6.765 1.00 5.02 N ATOM 1228 CA LYS A 75 10.042 -11.536 -6.657 1.00 34.02 C ATOM 1229 C LYS A 75 9.426 -12.672 -5.815 1.00 71.04 C ATOM 1230 O LYS A 75 9.505 -13.844 -6.187 1.00 72.23 O ATOM 1231 CB LYS A 75 11.392 -11.089 -6.030 1.00 32.45 C ATOM 1232 CG LYS A 75 12.335 -10.291 -6.962 1.00 75.31 C ATOM 1233 CD LYS A 75 12.845 -11.111 -8.176 1.00 64.13 C ATOM 1234 CE LYS A 75 13.526 -12.443 -7.780 1.00 4.01 C ATOM 1235 NZ LYS A 75 14.632 -12.251 -6.802 1.00 55.14 N ATOM 0 H LYS A 75 9.443 -9.537 -6.359 1.00 5.02 H new ATOM 0 HA LYS A 75 10.239 -11.899 -7.666 1.00 34.02 H new ATOM 0 HB2 LYS A 75 11.179 -10.480 -5.152 1.00 32.45 H new ATOM 0 HB3 LYS A 75 11.921 -11.976 -5.682 1.00 32.45 H new ATOM 0 HG2 LYS A 75 11.811 -9.407 -7.325 1.00 75.31 H new ATOM 0 HG3 LYS A 75 13.191 -9.940 -6.386 1.00 75.31 H new ATOM 0 HD2 LYS A 75 12.006 -11.324 -8.838 1.00 64.13 H new ATOM 0 HD3 LYS A 75 13.552 -10.505 -8.742 1.00 64.13 H new ATOM 0 HE2 LYS A 75 12.781 -13.115 -7.354 1.00 4.01 H new ATOM 0 HE3 LYS A 75 13.917 -12.927 -8.675 1.00 4.01 H new ATOM 0 HZ1 LYS A 75 15.076 -13.168 -6.596 1.00 55.14 H new ATOM 0 HZ2 LYS A 75 15.342 -11.605 -7.203 1.00 55.14 H new ATOM 0 HZ3 LYS A 75 14.252 -11.845 -5.923 1.00 55.14 H new ATOM 1249 N GLU A 76 8.777 -12.294 -4.693 1.00 4.35 N ATOM 1250 CA GLU A 76 8.070 -13.240 -3.804 1.00 2.12 C ATOM 1251 C GLU A 76 6.691 -13.639 -4.381 1.00 42.44 C ATOM 1252 O GLU A 76 5.896 -14.275 -3.685 1.00 40.33 O ATOM 1253 CB GLU A 76 7.917 -12.625 -2.377 1.00 72.34 C ATOM 1254 CG GLU A 76 9.240 -12.255 -1.672 1.00 24.35 C ATOM 1255 CD GLU A 76 10.244 -13.423 -1.580 1.00 31.34 C ATOM 1256 OE1 GLU A 76 10.055 -14.321 -0.733 1.00 44.23 O ATOM 1257 OE2 GLU A 76 11.212 -13.460 -2.375 1.00 32.20 O ATOM 0 H GLU A 76 8.729 -11.325 -4.378 1.00 4.35 H new ATOM 0 HA GLU A 76 8.668 -14.148 -3.733 1.00 2.12 H new ATOM 0 HB2 GLU A 76 7.300 -11.729 -2.450 1.00 72.34 H new ATOM 0 HB3 GLU A 76 7.376 -13.334 -1.750 1.00 72.34 H new ATOM 0 HG2 GLU A 76 9.707 -11.428 -2.207 1.00 24.35 H new ATOM 0 HG3 GLU A 76 9.018 -11.899 -0.666 1.00 24.35 H new ATOM 1264 N GLY A 77 6.423 -13.244 -5.652 1.00 51.41 N ATOM 1265 CA GLY A 77 5.225 -13.656 -6.391 1.00 72.40 C ATOM 1266 C GLY A 77 3.949 -13.040 -5.855 1.00 34.00 C ATOM 1267 O GLY A 77 2.862 -13.601 -6.020 1.00 42.31 O ATOM 0 H GLY A 77 7.039 -12.630 -6.185 1.00 51.41 H new ATOM 0 HA2 GLY A 77 5.341 -13.381 -7.439 1.00 72.40 H new ATOM 0 HA3 GLY A 77 5.139 -14.742 -6.354 1.00 72.40 H new ATOM 1271 N LEU A 78 4.092 -11.884 -5.199 1.00 53.10 N ATOM 1272 CA LEU A 78 2.998 -11.202 -4.498 1.00 4.10 C ATOM 1273 C LEU A 78 2.290 -10.216 -5.430 1.00 71.11 C ATOM 1274 O LEU A 78 2.943 -9.517 -6.215 1.00 65.23 O ATOM 1275 CB LEU A 78 3.548 -10.460 -3.252 1.00 11.43 C ATOM 1276 CG LEU A 78 4.360 -11.329 -2.241 1.00 52.03 C ATOM 1277 CD1 LEU A 78 4.987 -10.462 -1.146 1.00 32.13 C ATOM 1278 CD2 LEU A 78 3.502 -12.455 -1.635 1.00 44.21 C ATOM 0 H LEU A 78 4.982 -11.389 -5.139 1.00 53.10 H new ATOM 0 HA LEU A 78 2.273 -11.950 -4.176 1.00 4.10 H new ATOM 0 HB2 LEU A 78 4.185 -9.643 -3.592 1.00 11.43 H new ATOM 0 HB3 LEU A 78 2.709 -10.010 -2.722 1.00 11.43 H new ATOM 0 HG LEU A 78 5.168 -11.803 -2.799 1.00 52.03 H new ATOM 0 HD11 LEU A 78 5.546 -11.095 -0.457 1.00 32.13 H new ATOM 0 HD12 LEU A 78 5.661 -9.735 -1.599 1.00 32.13 H new ATOM 0 HD13 LEU A 78 4.201 -9.939 -0.602 1.00 32.13 H new ATOM 0 HD21 LEU A 78 4.105 -13.036 -0.937 1.00 44.21 H new ATOM 0 HD22 LEU A 78 2.653 -12.021 -1.107 1.00 44.21 H new ATOM 0 HD23 LEU A 78 3.141 -13.106 -2.431 1.00 44.21 H new ATOM 1290 N ARG A 79 0.954 -10.179 -5.323 1.00 52.53 N ATOM 1291 CA ARG A 79 0.082 -9.251 -6.055 1.00 62.14 C ATOM 1292 C ARG A 79 0.297 -7.845 -5.452 1.00 43.53 C ATOM 1293 O ARG A 79 -0.168 -7.590 -4.343 1.00 73.14 O ATOM 1294 CB ARG A 79 -1.401 -9.755 -5.884 1.00 74.41 C ATOM 1295 CG ARG A 79 -2.457 -9.321 -6.942 1.00 41.20 C ATOM 1296 CD ARG A 79 -2.864 -7.823 -6.925 1.00 73.15 C ATOM 1297 NE ARG A 79 -1.854 -6.937 -7.543 1.00 44.35 N ATOM 1298 CZ ARG A 79 -1.531 -6.911 -8.853 1.00 24.54 C ATOM 1299 NH1 ARG A 79 -2.118 -7.709 -9.736 1.00 12.13 N ATOM 1300 NH2 ARG A 79 -0.598 -6.090 -9.276 1.00 35.54 N ATOM 0 H ARG A 79 0.438 -10.810 -4.710 1.00 52.53 H new ATOM 0 HA ARG A 79 0.305 -9.207 -7.121 1.00 62.14 H new ATOM 0 HB2 ARG A 79 -1.381 -10.845 -5.863 1.00 74.41 H new ATOM 0 HB3 ARG A 79 -1.754 -9.423 -4.907 1.00 74.41 H new ATOM 0 HG2 ARG A 79 -2.069 -9.560 -7.932 1.00 41.20 H new ATOM 0 HG3 ARG A 79 -3.355 -9.922 -6.798 1.00 41.20 H new ATOM 0 HD2 ARG A 79 -3.812 -7.705 -7.451 1.00 73.15 H new ATOM 0 HD3 ARG A 79 -3.030 -7.510 -5.894 1.00 73.15 H new ATOM 0 HE ARG A 79 -1.360 -6.291 -6.927 1.00 44.35 H new ATOM 0 HH11 ARG A 79 -2.836 -8.366 -9.431 1.00 12.13 H new ATOM 0 HH12 ARG A 79 -1.851 -7.665 -10.720 1.00 12.13 H new ATOM 0 HH21 ARG A 79 -0.121 -5.476 -8.616 1.00 35.54 H new ATOM 0 HH22 ARG A 79 -0.350 -6.066 -10.265 1.00 35.54 H new ATOM 1314 N VAL A 80 0.994 -6.931 -6.167 1.00 32.44 N ATOM 1315 CA VAL A 80 1.380 -5.622 -5.601 1.00 63.31 C ATOM 1316 C VAL A 80 0.441 -4.557 -6.158 1.00 51.25 C ATOM 1317 O VAL A 80 0.390 -4.317 -7.369 1.00 52.23 O ATOM 1318 CB VAL A 80 2.877 -5.244 -5.918 1.00 53.13 C ATOM 1319 CG1 VAL A 80 3.272 -3.895 -5.258 1.00 55.41 C ATOM 1320 CG2 VAL A 80 3.818 -6.380 -5.479 1.00 61.22 C ATOM 0 H VAL A 80 1.298 -7.077 -7.130 1.00 32.44 H new ATOM 0 HA VAL A 80 1.297 -5.682 -4.516 1.00 63.31 H new ATOM 0 HB VAL A 80 2.976 -5.115 -6.996 1.00 53.13 H new ATOM 0 HG11 VAL A 80 4.310 -3.664 -5.496 1.00 55.41 H new ATOM 0 HG12 VAL A 80 2.627 -3.102 -5.637 1.00 55.41 H new ATOM 0 HG13 VAL A 80 3.156 -3.971 -4.177 1.00 55.41 H new ATOM 0 HG21 VAL A 80 4.849 -6.106 -5.704 1.00 61.22 H new ATOM 0 HG22 VAL A 80 3.712 -6.546 -4.407 1.00 61.22 H new ATOM 0 HG23 VAL A 80 3.560 -7.293 -6.015 1.00 61.22 H new ATOM 1330 N LEU A 81 -0.285 -3.924 -5.253 1.00 22.11 N ATOM 1331 CA LEU A 81 -1.362 -3.002 -5.565 1.00 40.42 C ATOM 1332 C LEU A 81 -1.135 -1.739 -4.740 1.00 24.32 C ATOM 1333 O LEU A 81 -1.271 -1.755 -3.517 1.00 40.32 O ATOM 1334 CB LEU A 81 -2.708 -3.692 -5.214 1.00 13.13 C ATOM 1335 CG LEU A 81 -4.011 -2.900 -5.517 1.00 4.02 C ATOM 1336 CD1 LEU A 81 -4.091 -2.543 -7.000 1.00 24.15 C ATOM 1337 CD2 LEU A 81 -5.258 -3.694 -5.060 1.00 2.41 C ATOM 0 H LEU A 81 -0.136 -4.041 -4.251 1.00 22.11 H new ATOM 0 HA LEU A 81 -1.388 -2.731 -6.621 1.00 40.42 H new ATOM 0 HB2 LEU A 81 -2.754 -4.638 -5.754 1.00 13.13 H new ATOM 0 HB3 LEU A 81 -2.698 -3.932 -4.151 1.00 13.13 H new ATOM 0 HG LEU A 81 -3.987 -1.969 -4.950 1.00 4.02 H new ATOM 0 HD11 LEU A 81 -5.010 -1.989 -7.192 1.00 24.15 H new ATOM 0 HD12 LEU A 81 -3.233 -1.929 -7.273 1.00 24.15 H new ATOM 0 HD13 LEU A 81 -4.087 -3.456 -7.595 1.00 24.15 H new ATOM 0 HD21 LEU A 81 -6.157 -3.119 -5.283 1.00 2.41 H new ATOM 0 HD22 LEU A 81 -5.296 -4.647 -5.588 1.00 2.41 H new ATOM 0 HD23 LEU A 81 -5.200 -3.876 -3.987 1.00 2.41 H new ATOM 1349 N VAL A 82 -0.756 -0.654 -5.405 1.00 1.23 N ATOM 1350 CA VAL A 82 -0.450 0.615 -4.735 1.00 55.34 C ATOM 1351 C VAL A 82 -1.702 1.513 -4.753 1.00 74.35 C ATOM 1352 O VAL A 82 -2.233 1.851 -5.812 1.00 74.11 O ATOM 1353 CB VAL A 82 0.795 1.326 -5.393 1.00 22.25 C ATOM 1354 CG1 VAL A 82 2.101 0.538 -5.103 1.00 70.15 C ATOM 1355 CG2 VAL A 82 0.597 1.509 -6.910 1.00 41.35 C ATOM 0 H VAL A 82 -0.651 -0.623 -6.419 1.00 1.23 H new ATOM 0 HA VAL A 82 -0.178 0.417 -3.698 1.00 55.34 H new ATOM 0 HB VAL A 82 0.885 2.315 -4.944 1.00 22.25 H new ATOM 0 HG11 VAL A 82 2.945 1.049 -5.567 1.00 70.15 H new ATOM 0 HG12 VAL A 82 2.260 0.480 -4.026 1.00 70.15 H new ATOM 0 HG13 VAL A 82 2.017 -0.469 -5.512 1.00 70.15 H new ATOM 0 HG21 VAL A 82 1.472 2.002 -7.334 1.00 41.35 H new ATOM 0 HG22 VAL A 82 0.466 0.534 -7.380 1.00 41.35 H new ATOM 0 HG23 VAL A 82 -0.287 2.121 -7.090 1.00 41.35 H new ATOM 1365 N ILE A 83 -2.190 1.845 -3.556 1.00 13.14 N ATOM 1366 CA ILE A 83 -3.376 2.688 -3.360 1.00 74.51 C ATOM 1367 C ILE A 83 -2.868 4.104 -3.076 1.00 12.33 C ATOM 1368 O ILE A 83 -2.287 4.342 -2.035 1.00 1.55 O ATOM 1369 CB ILE A 83 -4.231 2.171 -2.142 1.00 3.01 C ATOM 1370 CG1 ILE A 83 -4.530 0.648 -2.292 1.00 23.30 C ATOM 1371 CG2 ILE A 83 -5.544 2.991 -1.973 1.00 25.40 C ATOM 1372 CD1 ILE A 83 -5.145 0.009 -1.067 1.00 54.02 C ATOM 0 H ILE A 83 -1.768 1.532 -2.682 1.00 13.14 H new ATOM 0 HA ILE A 83 -4.015 2.664 -4.243 1.00 74.51 H new ATOM 0 HB ILE A 83 -3.644 2.316 -1.235 1.00 3.01 H new ATOM 0 HG12 ILE A 83 -5.202 0.504 -3.138 1.00 23.30 H new ATOM 0 HG13 ILE A 83 -3.601 0.129 -2.530 1.00 23.30 H new ATOM 0 HG21 ILE A 83 -6.107 2.605 -1.123 1.00 25.40 H new ATOM 0 HG22 ILE A 83 -5.299 4.039 -1.800 1.00 25.40 H new ATOM 0 HG23 ILE A 83 -6.146 2.904 -2.877 1.00 25.40 H new ATOM 0 HD11 ILE A 83 -5.320 -1.050 -1.258 1.00 54.02 H new ATOM 0 HD12 ILE A 83 -4.467 0.118 -0.221 1.00 54.02 H new ATOM 0 HD13 ILE A 83 -6.092 0.498 -0.838 1.00 54.02 H new ATOM 1384 N LYS A 84 -3.068 5.023 -4.013 1.00 65.42 N ATOM 1385 CA LYS A 84 -2.523 6.386 -3.937 1.00 22.52 C ATOM 1386 C LYS A 84 -3.632 7.409 -4.210 1.00 64.15 C ATOM 1387 O LYS A 84 -4.422 7.257 -5.154 1.00 35.14 O ATOM 1388 CB LYS A 84 -1.318 6.530 -4.920 1.00 75.44 C ATOM 1389 CG LYS A 84 -1.564 5.955 -6.340 1.00 21.23 C ATOM 1390 CD LYS A 84 -0.302 5.924 -7.251 1.00 35.21 C ATOM 1391 CE LYS A 84 0.187 7.313 -7.706 1.00 13.13 C ATOM 1392 NZ LYS A 84 1.026 7.986 -6.677 1.00 64.42 N ATOM 0 H LYS A 84 -3.616 4.849 -4.856 1.00 65.42 H new ATOM 0 HA LYS A 84 -2.146 6.582 -2.933 1.00 22.52 H new ATOM 0 HB2 LYS A 84 -1.065 7.586 -5.010 1.00 75.44 H new ATOM 0 HB3 LYS A 84 -0.452 6.031 -4.486 1.00 75.44 H new ATOM 0 HG2 LYS A 84 -1.953 4.941 -6.245 1.00 21.23 H new ATOM 0 HG3 LYS A 84 -2.336 6.549 -6.830 1.00 21.23 H new ATOM 0 HD2 LYS A 84 0.506 5.425 -6.716 1.00 35.21 H new ATOM 0 HD3 LYS A 84 -0.520 5.322 -8.133 1.00 35.21 H new ATOM 0 HE2 LYS A 84 0.761 7.209 -8.627 1.00 13.13 H new ATOM 0 HE3 LYS A 84 -0.674 7.941 -7.936 1.00 13.13 H new ATOM 0 HZ1 LYS A 84 1.671 8.658 -7.140 1.00 64.42 H new ATOM 0 HZ2 LYS A 84 0.414 8.497 -6.010 1.00 64.42 H new ATOM 0 HZ3 LYS A 84 1.581 7.273 -6.161 1.00 64.42 H new ATOM 1406 N VAL A 85 -3.689 8.430 -3.351 1.00 0.23 N ATOM 1407 CA VAL A 85 -4.686 9.497 -3.409 1.00 54.25 C ATOM 1408 C VAL A 85 -4.199 10.587 -4.381 1.00 52.21 C ATOM 1409 O VAL A 85 -3.171 11.243 -4.143 1.00 33.14 O ATOM 1410 CB VAL A 85 -4.959 10.065 -1.958 1.00 65.40 C ATOM 1411 CG1 VAL A 85 -5.857 11.322 -1.968 1.00 23.45 C ATOM 1412 CG2 VAL A 85 -5.562 8.964 -1.039 1.00 11.53 C ATOM 0 H VAL A 85 -3.029 8.538 -2.581 1.00 0.23 H new ATOM 0 HA VAL A 85 -5.634 9.110 -3.783 1.00 54.25 H new ATOM 0 HB VAL A 85 -3.994 10.372 -1.554 1.00 65.40 H new ATOM 0 HG11 VAL A 85 -6.010 11.668 -0.946 1.00 23.45 H new ATOM 0 HG12 VAL A 85 -5.375 12.109 -2.549 1.00 23.45 H new ATOM 0 HG13 VAL A 85 -6.820 11.078 -2.417 1.00 23.45 H new ATOM 0 HG21 VAL A 85 -5.742 9.377 -0.046 1.00 11.53 H new ATOM 0 HG22 VAL A 85 -6.503 8.613 -1.462 1.00 11.53 H new ATOM 0 HG23 VAL A 85 -4.864 8.130 -0.964 1.00 11.53 H new ATOM 1422 N ALA A 86 -4.928 10.717 -5.503 1.00 34.41 N ATOM 1423 CA ALA A 86 -4.619 11.658 -6.583 1.00 61.14 C ATOM 1424 C ALA A 86 -5.083 13.078 -6.240 1.00 12.04 C ATOM 1425 O ALA A 86 -6.082 13.255 -5.541 1.00 12.31 O ATOM 1426 CB ALA A 86 -5.259 11.170 -7.891 1.00 1.53 C ATOM 0 H ALA A 86 -5.763 10.159 -5.684 1.00 34.41 H new ATOM 0 HA ALA A 86 -3.537 11.697 -6.710 1.00 61.14 H new ATOM 0 HB1 ALA A 86 -5.028 11.871 -8.693 1.00 1.53 H new ATOM 0 HB2 ALA A 86 -4.864 10.186 -8.144 1.00 1.53 H new ATOM 0 HB3 ALA A 86 -6.340 11.106 -7.765 1.00 1.53 H new ATOM 1432 N GLN A 87 -4.317 14.071 -6.725 1.00 33.23 N ATOM 1433 CA GLN A 87 -4.661 15.500 -6.624 1.00 70.13 C ATOM 1434 C GLN A 87 -3.768 16.316 -7.572 1.00 52.31 C ATOM 1435 O GLN A 87 -4.252 17.208 -8.278 1.00 12.25 O ATOM 1436 CB GLN A 87 -4.566 16.021 -5.158 1.00 2.32 C ATOM 1437 CG GLN A 87 -3.199 15.821 -4.461 1.00 51.42 C ATOM 1438 CD GLN A 87 -3.191 16.261 -3.000 1.00 32.10 C ATOM 1439 OE1 GLN A 87 -3.911 17.173 -2.597 1.00 25.03 O ATOM 1440 NE2 GLN A 87 -2.361 15.620 -2.198 1.00 64.12 N ATOM 0 H GLN A 87 -3.432 13.902 -7.203 1.00 33.23 H new ATOM 0 HA GLN A 87 -5.701 15.624 -6.927 1.00 70.13 H new ATOM 0 HB2 GLN A 87 -4.803 17.085 -5.154 1.00 2.32 H new ATOM 0 HB3 GLN A 87 -5.332 15.522 -4.564 1.00 2.32 H new ATOM 0 HG2 GLN A 87 -2.922 14.768 -4.517 1.00 51.42 H new ATOM 0 HG3 GLN A 87 -2.438 16.380 -5.005 1.00 51.42 H new ATOM 0 HE21 GLN A 87 -1.777 14.868 -2.564 1.00 64.12 H new ATOM 0 HE22 GLN A 87 -2.304 15.877 -1.213 1.00 64.12 H new ATOM 1449 N ASP A 88 -2.455 16.001 -7.573 1.00 52.30 N ATOM 1450 CA ASP A 88 -1.475 16.619 -8.483 1.00 13.33 C ATOM 1451 C ASP A 88 -1.761 16.171 -9.919 1.00 44.02 C ATOM 1452 O ASP A 88 -1.713 16.976 -10.852 1.00 54.15 O ATOM 1453 CB ASP A 88 -0.024 16.202 -8.113 1.00 35.50 C ATOM 1454 CG ASP A 88 0.286 16.438 -6.634 1.00 0.55 C ATOM 1455 OD1 ASP A 88 0.682 17.567 -6.262 1.00 3.33 O ATOM 1456 OD2 ASP A 88 0.080 15.500 -5.830 1.00 60.14 O ATOM 0 H ASP A 88 -2.048 15.311 -6.942 1.00 52.30 H new ATOM 0 HA ASP A 88 -1.565 17.701 -8.392 1.00 13.33 H new ATOM 0 HB2 ASP A 88 0.120 15.148 -8.349 1.00 35.50 H new ATOM 0 HB3 ASP A 88 0.681 16.765 -8.725 1.00 35.50 H new ATOM 1461 N GLN A 89 -2.068 14.853 -10.032 1.00 64.50 N ATOM 1462 CA GLN A 89 -2.214 14.113 -11.293 1.00 74.23 C ATOM 1463 C GLN A 89 -0.880 14.053 -12.063 1.00 21.13 C ATOM 1464 O GLN A 89 -0.242 13.014 -12.076 1.00 54.05 O ATOM 1465 CB GLN A 89 -3.361 14.652 -12.195 1.00 42.40 C ATOM 1466 CG GLN A 89 -4.785 14.430 -11.651 1.00 62.35 C ATOM 1467 CD GLN A 89 -5.877 14.950 -12.603 1.00 34.10 C ATOM 1468 OE1 GLN A 89 -5.681 15.927 -13.326 1.00 2.23 O ATOM 1469 NE2 GLN A 89 -7.025 14.296 -12.616 1.00 64.35 N ATOM 0 H GLN A 89 -2.224 14.264 -9.214 1.00 64.50 H new ATOM 0 HA GLN A 89 -2.499 13.098 -11.016 1.00 74.23 H new ATOM 0 HB2 GLN A 89 -3.210 15.721 -12.347 1.00 42.40 H new ATOM 0 HB3 GLN A 89 -3.285 14.177 -13.173 1.00 42.40 H new ATOM 0 HG2 GLN A 89 -4.940 13.365 -11.476 1.00 62.35 H new ATOM 0 HG3 GLN A 89 -4.882 14.929 -10.687 1.00 62.35 H new ATOM 0 HE21 GLN A 89 -7.160 13.490 -12.006 1.00 64.35 H new ATOM 0 HE22 GLN A 89 -7.777 14.597 -13.236 1.00 64.35 H new ATOM 1478 N GLU A 90 -0.467 15.191 -12.653 1.00 11.21 N ATOM 1479 CA GLU A 90 0.686 15.281 -13.577 1.00 72.05 C ATOM 1480 C GLU A 90 2.033 14.981 -12.878 1.00 73.50 C ATOM 1481 O GLU A 90 2.844 14.200 -13.394 1.00 34.03 O ATOM 1482 CB GLU A 90 0.702 16.684 -14.241 1.00 22.32 C ATOM 1483 CG GLU A 90 -0.614 17.053 -14.957 1.00 24.31 C ATOM 1484 CD GLU A 90 -0.565 18.428 -15.646 1.00 33.33 C ATOM 1485 OE1 GLU A 90 -0.806 19.455 -14.971 1.00 3.11 O ATOM 1486 OE2 GLU A 90 -0.278 18.491 -16.860 1.00 64.21 O ATOM 0 H GLU A 90 -0.929 16.087 -12.501 1.00 11.21 H new ATOM 0 HA GLU A 90 0.565 14.515 -14.343 1.00 72.05 H new ATOM 0 HB2 GLU A 90 0.911 17.434 -13.478 1.00 22.32 H new ATOM 0 HB3 GLU A 90 1.519 16.725 -14.961 1.00 22.32 H new ATOM 0 HG2 GLU A 90 -0.842 16.289 -15.701 1.00 24.31 H new ATOM 0 HG3 GLU A 90 -1.428 17.046 -14.233 1.00 24.31 H new ATOM 1493 N LEU A 91 2.273 15.606 -11.712 1.00 22.03 N ATOM 1494 CA LEU A 91 3.495 15.352 -10.909 1.00 72.53 C ATOM 1495 C LEU A 91 3.430 13.944 -10.295 1.00 4.52 C ATOM 1496 O LEU A 91 4.425 13.211 -10.259 1.00 63.43 O ATOM 1497 CB LEU A 91 3.667 16.417 -9.793 1.00 22.23 C ATOM 1498 CG LEU A 91 4.933 16.240 -8.883 1.00 12.23 C ATOM 1499 CD1 LEU A 91 6.245 16.293 -9.709 1.00 64.00 C ATOM 1500 CD2 LEU A 91 4.942 17.265 -7.726 1.00 74.53 C ATOM 0 H LEU A 91 1.640 16.292 -11.300 1.00 22.03 H new ATOM 0 HA LEU A 91 4.359 15.419 -11.570 1.00 72.53 H new ATOM 0 HB2 LEU A 91 3.709 17.402 -10.258 1.00 22.23 H new ATOM 0 HB3 LEU A 91 2.780 16.401 -9.160 1.00 22.23 H new ATOM 0 HG LEU A 91 4.878 15.247 -8.437 1.00 12.23 H new ATOM 0 HD11 LEU A 91 7.099 16.167 -9.044 1.00 64.00 H new ATOM 0 HD12 LEU A 91 6.241 15.494 -10.450 1.00 64.00 H new ATOM 0 HD13 LEU A 91 6.318 17.256 -10.214 1.00 64.00 H new ATOM 0 HD21 LEU A 91 5.832 17.116 -7.114 1.00 74.53 H new ATOM 0 HD22 LEU A 91 4.948 18.275 -8.135 1.00 74.53 H new ATOM 0 HD23 LEU A 91 4.052 17.128 -7.112 1.00 74.53 H new ATOM 1512 N LEU A 92 2.218 13.584 -9.846 1.00 63.04 N ATOM 1513 CA LEU A 92 1.907 12.261 -9.273 1.00 45.04 C ATOM 1514 C LEU A 92 2.139 11.132 -10.315 1.00 71.41 C ATOM 1515 O LEU A 92 2.470 9.989 -9.963 1.00 42.12 O ATOM 1516 CB LEU A 92 0.424 12.256 -8.822 1.00 32.42 C ATOM 1517 CG LEU A 92 -0.016 11.051 -7.931 1.00 14.12 C ATOM 1518 CD1 LEU A 92 0.398 11.269 -6.458 1.00 10.43 C ATOM 1519 CD2 LEU A 92 -1.522 10.758 -8.073 1.00 32.22 C ATOM 0 H LEU A 92 1.414 14.211 -9.870 1.00 63.04 H new ATOM 0 HA LEU A 92 2.566 12.076 -8.425 1.00 45.04 H new ATOM 0 HB2 LEU A 92 0.228 13.178 -8.274 1.00 32.42 H new ATOM 0 HB3 LEU A 92 -0.206 12.274 -9.711 1.00 32.42 H new ATOM 0 HG LEU A 92 0.509 10.165 -8.287 1.00 14.12 H new ATOM 0 HD11 LEU A 92 0.079 10.415 -5.860 1.00 10.43 H new ATOM 0 HD12 LEU A 92 1.481 11.371 -6.396 1.00 10.43 H new ATOM 0 HD13 LEU A 92 -0.074 12.175 -6.078 1.00 10.43 H new ATOM 0 HD21 LEU A 92 -1.790 9.913 -7.438 1.00 32.22 H new ATOM 0 HD22 LEU A 92 -2.094 11.635 -7.770 1.00 32.22 H new ATOM 0 HD23 LEU A 92 -1.750 10.518 -9.112 1.00 32.22 H new ATOM 1531 N GLU A 93 1.970 11.511 -11.604 1.00 52.11 N ATOM 1532 CA GLU A 93 2.025 10.615 -12.774 1.00 41.14 C ATOM 1533 C GLU A 93 3.453 10.103 -13.008 1.00 51.11 C ATOM 1534 O GLU A 93 3.629 9.050 -13.595 1.00 54.31 O ATOM 1535 CB GLU A 93 1.457 11.368 -14.020 1.00 31.10 C ATOM 1536 CG GLU A 93 1.008 10.505 -15.231 1.00 24.04 C ATOM 1537 CD GLU A 93 2.140 10.019 -16.152 1.00 4.14 C ATOM 1538 OE1 GLU A 93 3.009 10.840 -16.515 1.00 4.42 O ATOM 1539 OE2 GLU A 93 2.140 8.839 -16.549 1.00 22.34 O ATOM 0 H GLU A 93 1.786 12.481 -11.862 1.00 52.11 H new ATOM 0 HA GLU A 93 1.408 9.735 -12.592 1.00 41.14 H new ATOM 0 HB2 GLU A 93 0.603 11.962 -13.695 1.00 31.10 H new ATOM 0 HB3 GLU A 93 2.218 12.067 -14.368 1.00 31.10 H new ATOM 0 HG2 GLU A 93 0.470 9.635 -14.855 1.00 24.04 H new ATOM 0 HG3 GLU A 93 0.302 11.084 -15.826 1.00 24.04 H new ATOM 1546 N ARG A 94 4.456 10.855 -12.521 1.00 62.13 N ATOM 1547 CA ARG A 94 5.881 10.503 -12.669 1.00 61.21 C ATOM 1548 C ARG A 94 6.195 9.123 -12.034 1.00 74.21 C ATOM 1549 O ARG A 94 6.816 8.260 -12.672 1.00 30.02 O ATOM 1550 CB ARG A 94 6.746 11.619 -12.031 1.00 54.40 C ATOM 1551 CG ARG A 94 8.261 11.528 -12.314 1.00 34.10 C ATOM 1552 CD ARG A 94 8.603 11.633 -13.818 1.00 65.50 C ATOM 1553 NE ARG A 94 8.041 12.855 -14.444 1.00 14.24 N ATOM 1554 CZ ARG A 94 8.721 13.991 -14.702 1.00 53.24 C ATOM 1555 NH1 ARG A 94 10.012 14.105 -14.398 1.00 45.14 N ATOM 1556 NH2 ARG A 94 8.104 15.007 -15.281 1.00 34.05 N ATOM 0 H ARG A 94 4.302 11.726 -12.013 1.00 62.13 H new ATOM 0 HA ARG A 94 6.117 10.423 -13.730 1.00 61.21 H new ATOM 0 HB2 ARG A 94 6.385 12.584 -12.388 1.00 54.40 H new ATOM 0 HB3 ARG A 94 6.594 11.601 -10.952 1.00 54.40 H new ATOM 0 HG2 ARG A 94 8.774 12.324 -11.774 1.00 34.10 H new ATOM 0 HG3 ARG A 94 8.641 10.583 -11.926 1.00 34.10 H new ATOM 0 HD2 ARG A 94 9.686 11.630 -13.942 1.00 65.50 H new ATOM 0 HD3 ARG A 94 8.220 10.754 -14.337 1.00 65.50 H new ATOM 0 HE ARG A 94 7.054 12.834 -14.702 1.00 14.24 H new ATOM 0 HH11 ARG A 94 10.504 13.325 -13.962 1.00 45.14 H new ATOM 0 HH12 ARG A 94 10.509 14.972 -14.601 1.00 45.14 H new ATOM 0 HH21 ARG A 94 7.118 14.930 -15.531 1.00 34.05 H new ATOM 0 HH22 ARG A 94 8.614 15.868 -15.478 1.00 34.05 H new ATOM 1570 N PHE A 95 5.740 8.935 -10.779 1.00 64.44 N ATOM 1571 CA PHE A 95 5.888 7.658 -10.051 1.00 14.14 C ATOM 1572 C PHE A 95 4.853 6.632 -10.561 1.00 21.42 C ATOM 1573 O PHE A 95 5.175 5.450 -10.736 1.00 33.41 O ATOM 1574 CB PHE A 95 5.732 7.884 -8.521 1.00 72.12 C ATOM 1575 CG PHE A 95 6.051 6.639 -7.688 1.00 44.01 C ATOM 1576 CD1 PHE A 95 7.369 6.280 -7.424 1.00 71.15 C ATOM 1577 CD2 PHE A 95 5.037 5.809 -7.200 1.00 1.12 C ATOM 1578 CE1 PHE A 95 7.661 5.146 -6.701 1.00 12.55 C ATOM 1579 CE2 PHE A 95 5.337 4.667 -6.480 1.00 2.24 C ATOM 1580 CZ PHE A 95 6.648 4.336 -6.230 1.00 55.53 C ATOM 0 H PHE A 95 5.262 9.660 -10.244 1.00 64.44 H new ATOM 0 HA PHE A 95 6.887 7.262 -10.236 1.00 14.14 H new ATOM 0 HB2 PHE A 95 6.389 8.697 -8.212 1.00 72.12 H new ATOM 0 HB3 PHE A 95 4.711 8.202 -8.310 1.00 72.12 H new ATOM 0 HD1 PHE A 95 8.174 6.900 -7.791 1.00 71.15 H new ATOM 0 HD2 PHE A 95 4.004 6.063 -7.388 1.00 1.12 H new ATOM 0 HE1 PHE A 95 8.690 4.888 -6.501 1.00 12.55 H new ATOM 0 HE2 PHE A 95 4.541 4.035 -6.114 1.00 2.24 H new ATOM 0 HZ PHE A 95 6.884 3.445 -5.667 1.00 55.53 H new ATOM 1590 N TYR A 96 3.620 7.125 -10.799 1.00 75.42 N ATOM 1591 CA TYR A 96 2.475 6.333 -11.302 1.00 71.25 C ATOM 1592 C TYR A 96 2.814 5.557 -12.601 1.00 72.34 C ATOM 1593 O TYR A 96 2.398 4.402 -12.779 1.00 63.11 O ATOM 1594 CB TYR A 96 1.291 7.306 -11.529 1.00 72.22 C ATOM 1595 CG TYR A 96 0.085 6.750 -12.295 1.00 20.21 C ATOM 1596 CD1 TYR A 96 -0.925 6.071 -11.634 1.00 61.15 C ATOM 1597 CD2 TYR A 96 -0.045 6.915 -13.685 1.00 34.44 C ATOM 1598 CE1 TYR A 96 -2.015 5.568 -12.311 1.00 35.32 C ATOM 1599 CE2 TYR A 96 -1.136 6.412 -14.367 1.00 25.11 C ATOM 1600 CZ TYR A 96 -2.119 5.737 -13.674 1.00 53.23 C ATOM 1601 OH TYR A 96 -3.209 5.229 -14.345 1.00 42.41 O ATOM 0 H TYR A 96 3.386 8.106 -10.644 1.00 75.42 H new ATOM 0 HA TYR A 96 2.214 5.574 -10.564 1.00 71.25 H new ATOM 0 HB2 TYR A 96 0.945 7.655 -10.556 1.00 72.22 H new ATOM 0 HB3 TYR A 96 1.664 8.178 -12.067 1.00 72.22 H new ATOM 0 HD1 TYR A 96 -0.857 5.933 -10.565 1.00 61.15 H new ATOM 0 HD2 TYR A 96 0.722 7.445 -14.230 1.00 34.44 H new ATOM 0 HE1 TYR A 96 -2.788 5.041 -11.772 1.00 35.32 H new ATOM 0 HE2 TYR A 96 -1.219 6.546 -15.435 1.00 25.11 H new ATOM 0 HH TYR A 96 -3.130 5.435 -15.300 1.00 42.41 H new ATOM 1611 N GLU A 97 3.578 6.220 -13.475 1.00 2.45 N ATOM 1612 CA GLU A 97 3.956 5.707 -14.797 1.00 42.34 C ATOM 1613 C GLU A 97 4.938 4.545 -14.651 1.00 13.44 C ATOM 1614 O GLU A 97 4.779 3.507 -15.289 1.00 72.12 O ATOM 1615 CB GLU A 97 4.616 6.834 -15.626 1.00 32.11 C ATOM 1616 CG GLU A 97 5.114 6.403 -17.035 1.00 74.42 C ATOM 1617 CD GLU A 97 6.473 7.019 -17.405 1.00 73.42 C ATOM 1618 OE1 GLU A 97 7.508 6.417 -17.052 1.00 74.43 O ATOM 1619 OE2 GLU A 97 6.522 8.091 -18.043 1.00 55.13 O ATOM 0 H GLU A 97 3.959 7.146 -13.280 1.00 2.45 H new ATOM 0 HA GLU A 97 3.059 5.356 -15.306 1.00 42.34 H new ATOM 0 HB2 GLU A 97 3.899 7.647 -15.743 1.00 32.11 H new ATOM 0 HB3 GLU A 97 5.461 7.232 -15.064 1.00 32.11 H new ATOM 0 HG2 GLU A 97 5.192 5.316 -17.070 1.00 74.42 H new ATOM 0 HG3 GLU A 97 4.374 6.694 -17.781 1.00 74.42 H new ATOM 1626 N GLN A 98 5.936 4.748 -13.775 1.00 70.20 N ATOM 1627 CA GLN A 98 6.985 3.756 -13.477 1.00 20.31 C ATOM 1628 C GLN A 98 6.382 2.421 -12.994 1.00 71.44 C ATOM 1629 O GLN A 98 6.909 1.354 -13.302 1.00 44.20 O ATOM 1630 CB GLN A 98 7.952 4.346 -12.419 1.00 50.53 C ATOM 1631 CG GLN A 98 8.789 5.548 -12.907 1.00 51.14 C ATOM 1632 CD GLN A 98 9.838 5.178 -13.966 1.00 55.12 C ATOM 1633 OE1 GLN A 98 10.983 4.861 -13.642 1.00 4.23 O ATOM 1634 NE2 GLN A 98 9.457 5.216 -15.233 1.00 22.40 N ATOM 0 H GLN A 98 6.039 5.615 -13.247 1.00 70.20 H new ATOM 0 HA GLN A 98 7.537 3.539 -14.392 1.00 20.31 H new ATOM 0 HB2 GLN A 98 7.372 4.654 -11.549 1.00 50.53 H new ATOM 0 HB3 GLN A 98 8.630 3.559 -12.088 1.00 50.53 H new ATOM 0 HG2 GLN A 98 8.119 6.303 -13.319 1.00 51.14 H new ATOM 0 HG3 GLN A 98 9.292 6.001 -12.052 1.00 51.14 H new ATOM 0 HE21 GLN A 98 8.501 5.482 -15.470 1.00 22.40 H new ATOM 0 HE22 GLN A 98 10.119 4.979 -15.972 1.00 22.40 H new ATOM 1643 N LEU A 99 5.257 2.516 -12.259 1.00 33.35 N ATOM 1644 CA LEU A 99 4.483 1.355 -11.776 1.00 41.45 C ATOM 1645 C LEU A 99 3.819 0.612 -12.949 1.00 14.03 C ATOM 1646 O LEU A 99 4.034 -0.581 -13.148 1.00 61.41 O ATOM 1647 CB LEU A 99 3.398 1.862 -10.793 1.00 22.42 C ATOM 1648 CG LEU A 99 3.931 2.566 -9.511 1.00 30.34 C ATOM 1649 CD1 LEU A 99 2.844 3.455 -8.872 1.00 51.23 C ATOM 1650 CD2 LEU A 99 4.479 1.528 -8.508 1.00 3.32 C ATOM 0 H LEU A 99 4.855 3.411 -11.981 1.00 33.35 H new ATOM 0 HA LEU A 99 5.154 0.658 -11.274 1.00 41.45 H new ATOM 0 HB2 LEU A 99 2.748 2.557 -11.324 1.00 22.42 H new ATOM 0 HB3 LEU A 99 2.781 1.015 -10.492 1.00 22.42 H new ATOM 0 HG LEU A 99 4.755 3.219 -9.797 1.00 30.34 H new ATOM 0 HD11 LEU A 99 3.245 3.934 -7.979 1.00 51.23 H new ATOM 0 HD12 LEU A 99 2.533 4.219 -9.585 1.00 51.23 H new ATOM 0 HD13 LEU A 99 1.985 2.841 -8.600 1.00 51.23 H new ATOM 0 HD21 LEU A 99 4.847 2.040 -7.619 1.00 3.32 H new ATOM 0 HD22 LEU A 99 3.683 0.839 -8.227 1.00 3.32 H new ATOM 0 HD23 LEU A 99 5.295 0.971 -8.970 1.00 3.32 H new ATOM 1662 N LYS A 100 3.068 1.375 -13.753 1.00 41.55 N ATOM 1663 CA LYS A 100 2.232 0.850 -14.856 1.00 34.33 C ATOM 1664 C LYS A 100 3.075 0.307 -16.024 1.00 54.01 C ATOM 1665 O LYS A 100 2.645 -0.601 -16.744 1.00 51.23 O ATOM 1666 CB LYS A 100 1.276 1.980 -15.331 1.00 1.13 C ATOM 1667 CG LYS A 100 0.185 2.348 -14.299 1.00 70.22 C ATOM 1668 CD LYS A 100 -0.874 1.230 -14.126 1.00 1.12 C ATOM 1669 CE LYS A 100 -1.634 0.924 -15.431 1.00 23.24 C ATOM 1670 NZ LYS A 100 -2.586 -0.204 -15.272 1.00 75.54 N ATOM 0 H LYS A 100 3.019 2.390 -13.660 1.00 41.55 H new ATOM 0 HA LYS A 100 1.654 0.003 -14.485 1.00 34.33 H new ATOM 0 HB2 LYS A 100 1.864 2.870 -15.557 1.00 1.13 H new ATOM 0 HB3 LYS A 100 0.796 1.671 -16.259 1.00 1.13 H new ATOM 0 HG2 LYS A 100 0.654 2.551 -13.336 1.00 70.22 H new ATOM 0 HG3 LYS A 100 -0.310 3.267 -14.612 1.00 70.22 H new ATOM 0 HD2 LYS A 100 -0.384 0.322 -13.774 1.00 1.12 H new ATOM 0 HD3 LYS A 100 -1.587 1.526 -13.356 1.00 1.12 H new ATOM 0 HE2 LYS A 100 -2.177 1.813 -15.751 1.00 23.24 H new ATOM 0 HE3 LYS A 100 -0.919 0.686 -16.219 1.00 23.24 H new ATOM 0 HZ1 LYS A 100 -3.075 -0.375 -16.174 1.00 75.54 H new ATOM 0 HZ2 LYS A 100 -2.066 -1.060 -14.992 1.00 75.54 H new ATOM 0 HZ3 LYS A 100 -3.285 0.032 -14.539 1.00 75.54 H new ATOM 1684 N LYS A 101 4.269 0.883 -16.184 1.00 22.22 N ATOM 1685 CA LYS A 101 5.232 0.519 -17.238 1.00 24.31 C ATOM 1686 C LYS A 101 6.015 -0.743 -16.829 1.00 1.54 C ATOM 1687 O LYS A 101 6.334 -1.590 -17.670 1.00 71.23 O ATOM 1688 CB LYS A 101 6.181 1.723 -17.480 1.00 62.32 C ATOM 1689 CG LYS A 101 7.278 1.511 -18.547 1.00 62.42 C ATOM 1690 CD LYS A 101 8.087 2.803 -18.831 1.00 23.12 C ATOM 1691 CE LYS A 101 7.227 3.918 -19.455 1.00 14.32 C ATOM 1692 NZ LYS A 101 8.003 5.164 -19.698 1.00 54.44 N ATOM 0 H LYS A 101 4.604 1.630 -15.576 1.00 22.22 H new ATOM 0 HA LYS A 101 4.708 0.290 -18.166 1.00 24.31 H new ATOM 0 HB2 LYS A 101 5.579 2.583 -17.772 1.00 62.32 H new ATOM 0 HB3 LYS A 101 6.663 1.977 -16.536 1.00 62.32 H new ATOM 0 HG2 LYS A 101 7.957 0.726 -18.214 1.00 62.42 H new ATOM 0 HG3 LYS A 101 6.818 1.163 -19.472 1.00 62.42 H new ATOM 0 HD2 LYS A 101 8.524 3.165 -17.900 1.00 23.12 H new ATOM 0 HD3 LYS A 101 8.914 2.569 -19.502 1.00 23.12 H new ATOM 0 HE2 LYS A 101 6.807 3.565 -20.397 1.00 14.32 H new ATOM 0 HE3 LYS A 101 6.388 4.139 -18.795 1.00 14.32 H new ATOM 0 HZ1 LYS A 101 7.477 5.779 -20.351 1.00 54.44 H new ATOM 0 HZ2 LYS A 101 8.151 5.662 -18.797 1.00 54.44 H new ATOM 0 HZ3 LYS A 101 8.924 4.923 -20.116 1.00 54.44 H new ATOM 1706 N ASP A 102 6.311 -0.851 -15.519 1.00 55.22 N ATOM 1707 CA ASP A 102 6.981 -2.028 -14.933 1.00 21.52 C ATOM 1708 C ASP A 102 6.061 -3.264 -15.045 1.00 14.34 C ATOM 1709 O ASP A 102 6.451 -4.296 -15.599 1.00 11.52 O ATOM 1710 CB ASP A 102 7.353 -1.736 -13.450 1.00 24.14 C ATOM 1711 CG ASP A 102 8.111 -2.885 -12.760 1.00 42.34 C ATOM 1712 OD1 ASP A 102 9.359 -2.926 -12.850 1.00 2.23 O ATOM 1713 OD2 ASP A 102 7.466 -3.754 -12.134 1.00 62.24 O ATOM 0 H ASP A 102 6.092 -0.124 -14.837 1.00 55.22 H new ATOM 0 HA ASP A 102 7.900 -2.238 -15.481 1.00 21.52 H new ATOM 0 HB2 ASP A 102 7.964 -0.834 -13.410 1.00 24.14 H new ATOM 0 HB3 ASP A 102 6.441 -1.528 -12.891 1.00 24.14 H new ATOM 1718 N GLY A 103 4.836 -3.117 -14.520 1.00 32.43 N ATOM 1719 CA GLY A 103 3.782 -4.138 -14.623 1.00 51.44 C ATOM 1720 C GLY A 103 3.001 -4.283 -13.324 1.00 31.12 C ATOM 1721 O GLY A 103 2.446 -5.348 -13.039 1.00 1.20 O ATOM 0 H GLY A 103 4.547 -2.283 -14.009 1.00 32.43 H new ATOM 0 HA2 GLY A 103 3.098 -3.873 -15.430 1.00 51.44 H new ATOM 0 HA3 GLY A 103 4.230 -5.096 -14.886 1.00 51.44 H new ATOM 1725 N VAL A 104 2.961 -3.196 -12.540 1.00 62.24 N ATOM 1726 CA VAL A 104 2.290 -3.124 -11.227 1.00 70.53 C ATOM 1727 C VAL A 104 0.907 -2.480 -11.384 1.00 23.43 C ATOM 1728 O VAL A 104 0.732 -1.564 -12.204 1.00 2.14 O ATOM 1729 CB VAL A 104 3.170 -2.279 -10.224 1.00 71.02 C ATOM 1730 CG1 VAL A 104 2.538 -2.180 -8.813 1.00 61.41 C ATOM 1731 CG2 VAL A 104 4.587 -2.871 -10.164 1.00 73.53 C ATOM 0 H VAL A 104 3.405 -2.317 -12.806 1.00 62.24 H new ATOM 0 HA VAL A 104 2.168 -4.132 -10.830 1.00 70.53 H new ATOM 0 HB VAL A 104 3.221 -1.257 -10.600 1.00 71.02 H new ATOM 0 HG11 VAL A 104 3.185 -1.588 -8.165 1.00 61.41 H new ATOM 0 HG12 VAL A 104 1.561 -1.702 -8.885 1.00 61.41 H new ATOM 0 HG13 VAL A 104 2.423 -3.180 -8.395 1.00 61.41 H new ATOM 0 HG21 VAL A 104 5.196 -2.289 -9.472 1.00 73.53 H new ATOM 0 HG22 VAL A 104 4.535 -3.904 -9.821 1.00 73.53 H new ATOM 0 HG23 VAL A 104 5.036 -2.840 -11.157 1.00 73.53 H new ATOM 1741 N ASP A 105 -0.076 -2.970 -10.604 1.00 15.33 N ATOM 1742 CA ASP A 105 -1.434 -2.414 -10.616 1.00 51.53 C ATOM 1743 C ASP A 105 -1.495 -1.185 -9.692 1.00 1.34 C ATOM 1744 O ASP A 105 -0.871 -1.170 -8.619 1.00 1.02 O ATOM 1745 CB ASP A 105 -2.489 -3.462 -10.176 1.00 60.11 C ATOM 1746 CG ASP A 105 -3.913 -3.089 -10.642 1.00 61.21 C ATOM 1747 OD1 ASP A 105 -4.449 -2.061 -10.189 1.00 32.23 O ATOM 1748 OD2 ASP A 105 -4.497 -3.799 -11.491 1.00 22.00 O ATOM 0 H ASP A 105 0.050 -3.750 -9.959 1.00 15.33 H new ATOM 0 HA ASP A 105 -1.670 -2.121 -11.639 1.00 51.53 H new ATOM 0 HB2 ASP A 105 -2.220 -4.438 -10.581 1.00 60.11 H new ATOM 0 HB3 ASP A 105 -2.476 -3.553 -9.090 1.00 60.11 H new ATOM 1753 N VAL A 106 -2.283 -0.176 -10.101 1.00 45.14 N ATOM 1754 CA VAL A 106 -2.452 1.081 -9.359 1.00 14.10 C ATOM 1755 C VAL A 106 -3.949 1.356 -9.106 1.00 45.12 C ATOM 1756 O VAL A 106 -4.802 1.052 -9.953 1.00 73.12 O ATOM 1757 CB VAL A 106 -1.843 2.307 -10.139 1.00 11.31 C ATOM 1758 CG1 VAL A 106 -1.973 3.602 -9.318 1.00 14.54 C ATOM 1759 CG2 VAL A 106 -0.370 2.067 -10.545 1.00 22.33 C ATOM 0 H VAL A 106 -2.825 -0.212 -10.964 1.00 45.14 H new ATOM 0 HA VAL A 106 -1.922 0.967 -8.413 1.00 14.10 H new ATOM 0 HB VAL A 106 -2.420 2.417 -11.057 1.00 11.31 H new ATOM 0 HG11 VAL A 106 -1.545 4.433 -9.879 1.00 14.54 H new ATOM 0 HG12 VAL A 106 -3.026 3.802 -9.119 1.00 14.54 H new ATOM 0 HG13 VAL A 106 -1.440 3.489 -8.374 1.00 14.54 H new ATOM 0 HG21 VAL A 106 0.007 2.939 -11.080 1.00 22.33 H new ATOM 0 HG22 VAL A 106 0.232 1.902 -9.651 1.00 22.33 H new ATOM 0 HG23 VAL A 106 -0.309 1.191 -11.191 1.00 22.33 H new ATOM 1769 N ARG A 107 -4.249 1.907 -7.914 1.00 73.11 N ATOM 1770 CA ARG A 107 -5.550 2.494 -7.578 1.00 32.33 C ATOM 1771 C ARG A 107 -5.356 3.996 -7.339 1.00 14.42 C ATOM 1772 O ARG A 107 -4.759 4.381 -6.336 1.00 31.11 O ATOM 1773 CB ARG A 107 -6.132 1.830 -6.289 1.00 2.12 C ATOM 1774 CG ARG A 107 -6.387 0.321 -6.413 1.00 2.14 C ATOM 1775 CD ARG A 107 -7.420 -0.040 -7.521 1.00 54.21 C ATOM 1776 NE ARG A 107 -6.922 -1.090 -8.426 1.00 52.34 N ATOM 1777 CZ ARG A 107 -7.650 -2.098 -8.913 1.00 74.10 C ATOM 1778 NH1 ARG A 107 -8.926 -2.230 -8.600 1.00 24.43 N ATOM 1779 NH2 ARG A 107 -7.096 -2.972 -9.721 1.00 32.45 N ATOM 0 H ARG A 107 -3.578 1.955 -7.147 1.00 73.11 H new ATOM 0 HA ARG A 107 -6.249 2.326 -8.397 1.00 32.33 H new ATOM 0 HB2 ARG A 107 -5.442 2.003 -5.463 1.00 2.12 H new ATOM 0 HB3 ARG A 107 -7.069 2.325 -6.031 1.00 2.12 H new ATOM 0 HG2 ARG A 107 -5.445 -0.183 -6.626 1.00 2.14 H new ATOM 0 HG3 ARG A 107 -6.743 -0.060 -5.456 1.00 2.14 H new ATOM 0 HD2 ARG A 107 -8.347 -0.374 -7.056 1.00 54.21 H new ATOM 0 HD3 ARG A 107 -7.657 0.853 -8.099 1.00 54.21 H new ATOM 0 HE ARG A 107 -5.942 -1.043 -8.703 1.00 52.34 H new ATOM 0 HH11 ARG A 107 -9.371 -1.556 -7.977 1.00 24.43 H new ATOM 0 HH12 ARG A 107 -9.467 -3.006 -8.981 1.00 24.43 H new ATOM 0 HH21 ARG A 107 -6.112 -2.880 -9.975 1.00 32.45 H new ATOM 0 HH22 ARG A 107 -7.649 -3.743 -10.095 1.00 32.45 H new ATOM 1793 N VAL A 108 -5.831 4.839 -8.272 1.00 75.34 N ATOM 1794 CA VAL A 108 -5.967 6.287 -8.029 1.00 4.31 C ATOM 1795 C VAL A 108 -7.414 6.542 -7.570 1.00 24.41 C ATOM 1796 O VAL A 108 -8.374 6.322 -8.314 1.00 4.01 O ATOM 1797 CB VAL A 108 -5.561 7.180 -9.280 1.00 41.24 C ATOM 1798 CG1 VAL A 108 -4.020 7.178 -9.475 1.00 53.25 C ATOM 1799 CG2 VAL A 108 -6.289 6.743 -10.582 1.00 62.43 C ATOM 0 H VAL A 108 -6.128 4.543 -9.202 1.00 75.34 H new ATOM 0 HA VAL A 108 -5.264 6.589 -7.253 1.00 4.31 H new ATOM 0 HB VAL A 108 -5.885 8.199 -9.067 1.00 41.24 H new ATOM 0 HG11 VAL A 108 -3.761 7.794 -10.336 1.00 53.25 H new ATOM 0 HG12 VAL A 108 -3.540 7.581 -8.583 1.00 53.25 H new ATOM 0 HG13 VAL A 108 -3.676 6.158 -9.643 1.00 53.25 H new ATOM 0 HG21 VAL A 108 -5.977 7.384 -11.406 1.00 62.43 H new ATOM 0 HG22 VAL A 108 -6.035 5.708 -10.811 1.00 62.43 H new ATOM 0 HG23 VAL A 108 -7.367 6.830 -10.443 1.00 62.43 H new ATOM 1809 N THR A 109 -7.552 6.942 -6.304 1.00 51.44 N ATOM 1810 CA THR A 109 -8.858 7.093 -5.645 1.00 45.03 C ATOM 1811 C THR A 109 -9.285 8.569 -5.631 1.00 62.02 C ATOM 1812 O THR A 109 -10.482 8.869 -5.700 1.00 43.33 O ATOM 1813 CB THR A 109 -8.781 6.527 -4.199 1.00 31.14 C ATOM 1814 OG1 THR A 109 -7.690 7.149 -3.493 1.00 13.52 O ATOM 1815 CG2 THR A 109 -8.575 4.998 -4.204 1.00 42.52 C ATOM 0 H THR A 109 -6.761 7.172 -5.702 1.00 51.44 H new ATOM 0 HA THR A 109 -9.608 6.532 -6.203 1.00 45.03 H new ATOM 0 HB THR A 109 -9.726 6.746 -3.701 1.00 31.14 H new ATOM 0 HG1 THR A 109 -7.137 6.458 -3.072 1.00 13.52 H new ATOM 0 HG21 THR A 109 -8.525 4.634 -3.178 1.00 42.52 H new ATOM 0 HG22 THR A 109 -9.409 4.520 -4.719 1.00 42.52 H new ATOM 0 HG23 THR A 109 -7.645 4.758 -4.719 1.00 42.52 H new ATOM 1823 N ASP A 110 -8.272 9.463 -5.517 1.00 1.14 N ATOM 1824 CA ASP A 110 -8.413 10.941 -5.556 1.00 13.31 C ATOM 1825 C ASP A 110 -9.051 11.486 -4.264 1.00 23.53 C ATOM 1826 O ASP A 110 -8.436 12.265 -3.536 1.00 33.02 O ATOM 1827 CB ASP A 110 -9.162 11.438 -6.829 1.00 64.20 C ATOM 1828 CG ASP A 110 -9.156 12.980 -6.989 1.00 2.43 C ATOM 1829 OD1 ASP A 110 -10.075 13.648 -6.464 1.00 14.11 O ATOM 1830 OD2 ASP A 110 -8.255 13.517 -7.664 1.00 44.05 O ATOM 0 H ASP A 110 -7.304 9.167 -5.391 1.00 1.14 H new ATOM 0 HA ASP A 110 -7.404 11.348 -5.617 1.00 13.31 H new ATOM 0 HB2 ASP A 110 -8.703 10.988 -7.709 1.00 64.20 H new ATOM 0 HB3 ASP A 110 -10.194 11.089 -6.793 1.00 64.20 H new ATOM 1835 N ASN A 111 -10.295 11.097 -4.003 1.00 32.14 N ATOM 1836 CA ASN A 111 -10.968 11.387 -2.731 1.00 13.45 C ATOM 1837 C ASN A 111 -10.542 10.352 -1.676 1.00 33.13 C ATOM 1838 O ASN A 111 -10.481 9.153 -1.977 1.00 62.31 O ATOM 1839 CB ASN A 111 -12.512 11.364 -2.900 1.00 53.35 C ATOM 1840 CG ASN A 111 -13.048 12.314 -3.988 1.00 60.12 C ATOM 1841 OD1 ASN A 111 -14.076 12.043 -4.609 1.00 1.51 O ATOM 1842 ND2 ASN A 111 -12.368 13.436 -4.237 1.00 10.22 N ATOM 0 H ASN A 111 -10.869 10.572 -4.663 1.00 32.14 H new ATOM 0 HA ASN A 111 -10.676 12.385 -2.405 1.00 13.45 H new ATOM 0 HB2 ASN A 111 -12.824 10.347 -3.137 1.00 53.35 H new ATOM 0 HB3 ASN A 111 -12.973 11.625 -1.948 1.00 53.35 H new ATOM 0 HD21 ASN A 111 -12.698 14.085 -4.951 1.00 10.22 H new ATOM 0 HD22 ASN A 111 -11.518 13.644 -3.713 1.00 10.22 H new ATOM 1849 N GLU A 112 -10.240 10.823 -0.450 1.00 34.31 N ATOM 1850 CA GLU A 112 -9.979 9.942 0.715 1.00 61.10 C ATOM 1851 C GLU A 112 -11.238 9.143 1.103 1.00 33.10 C ATOM 1852 O GLU A 112 -11.124 8.087 1.701 1.00 45.43 O ATOM 1853 CB GLU A 112 -9.420 10.753 1.924 1.00 43.43 C ATOM 1854 CG GLU A 112 -10.136 12.093 2.241 1.00 54.11 C ATOM 1855 CD GLU A 112 -11.598 11.964 2.702 1.00 32.42 C ATOM 1856 OE1 GLU A 112 -11.844 11.435 3.812 1.00 63.12 O ATOM 1857 OE2 GLU A 112 -12.504 12.389 1.954 1.00 75.22 O ATOM 0 H GLU A 112 -10.169 11.818 -0.236 1.00 34.31 H new ATOM 0 HA GLU A 112 -9.213 9.224 0.423 1.00 61.10 H new ATOM 0 HB2 GLU A 112 -9.467 10.121 2.811 1.00 43.43 H new ATOM 0 HB3 GLU A 112 -8.367 10.963 1.738 1.00 43.43 H new ATOM 0 HG2 GLU A 112 -9.572 12.613 3.016 1.00 54.11 H new ATOM 0 HG3 GLU A 112 -10.107 12.721 1.351 1.00 54.11 H new ATOM 1864 N ASP A 113 -12.417 9.702 0.755 1.00 75.11 N ATOM 1865 CA ASP A 113 -13.726 9.054 0.890 1.00 71.23 C ATOM 1866 C ASP A 113 -13.758 7.756 0.076 1.00 10.11 C ATOM 1867 O ASP A 113 -14.144 6.704 0.591 1.00 40.22 O ATOM 1868 CB ASP A 113 -14.827 10.044 0.414 1.00 22.34 C ATOM 1869 CG ASP A 113 -16.228 9.407 0.276 1.00 53.22 C ATOM 1870 OD1 ASP A 113 -16.785 8.920 1.287 1.00 22.01 O ATOM 1871 OD2 ASP A 113 -16.767 9.362 -0.848 1.00 12.05 O ATOM 0 H ASP A 113 -12.479 10.641 0.363 1.00 75.11 H new ATOM 0 HA ASP A 113 -13.910 8.794 1.933 1.00 71.23 H new ATOM 0 HB2 ASP A 113 -14.884 10.874 1.119 1.00 22.34 H new ATOM 0 HB3 ASP A 113 -14.533 10.463 -0.548 1.00 22.34 H new ATOM 1876 N GLU A 114 -13.310 7.854 -1.190 1.00 24.13 N ATOM 1877 CA GLU A 114 -13.240 6.705 -2.105 1.00 0.35 C ATOM 1878 C GLU A 114 -12.178 5.697 -1.633 1.00 14.42 C ATOM 1879 O GLU A 114 -12.424 4.487 -1.627 1.00 52.42 O ATOM 1880 CB GLU A 114 -12.957 7.172 -3.557 1.00 64.14 C ATOM 1881 CG GLU A 114 -12.855 6.036 -4.608 1.00 3.44 C ATOM 1882 CD GLU A 114 -14.124 5.170 -4.710 1.00 71.42 C ATOM 1883 OE1 GLU A 114 -15.054 5.538 -5.462 1.00 23.35 O ATOM 1884 OE2 GLU A 114 -14.200 4.118 -4.054 1.00 11.20 O ATOM 0 H GLU A 114 -12.988 8.729 -1.603 1.00 24.13 H new ATOM 0 HA GLU A 114 -14.208 6.204 -2.097 1.00 0.35 H new ATOM 0 HB2 GLU A 114 -13.748 7.857 -3.862 1.00 64.14 H new ATOM 0 HB3 GLU A 114 -12.025 7.737 -3.565 1.00 64.14 H new ATOM 0 HG2 GLU A 114 -12.646 6.474 -5.584 1.00 3.44 H new ATOM 0 HG3 GLU A 114 -12.009 5.396 -4.357 1.00 3.44 H new ATOM 1891 N ALA A 115 -11.009 6.220 -1.205 1.00 60.11 N ATOM 1892 CA ALA A 115 -9.897 5.395 -0.696 1.00 73.43 C ATOM 1893 C ALA A 115 -10.339 4.561 0.526 1.00 34.24 C ATOM 1894 O ALA A 115 -10.029 3.379 0.622 1.00 64.04 O ATOM 1895 CB ALA A 115 -8.702 6.284 -0.341 1.00 44.53 C ATOM 0 H ALA A 115 -10.812 7.221 -1.203 1.00 60.11 H new ATOM 0 HA ALA A 115 -9.597 4.701 -1.481 1.00 73.43 H new ATOM 0 HB1 ALA A 115 -7.887 5.665 0.034 1.00 44.53 H new ATOM 0 HB2 ALA A 115 -8.371 6.821 -1.230 1.00 44.53 H new ATOM 0 HB3 ALA A 115 -8.996 7.000 0.426 1.00 44.53 H new ATOM 1901 N LYS A 116 -11.127 5.212 1.399 1.00 61.14 N ATOM 1902 CA LYS A 116 -11.659 4.659 2.658 1.00 62.35 C ATOM 1903 C LYS A 116 -12.575 3.441 2.393 1.00 75.21 C ATOM 1904 O LYS A 116 -12.571 2.468 3.162 1.00 41.24 O ATOM 1905 CB LYS A 116 -12.426 5.810 3.342 1.00 65.11 C ATOM 1906 CG LYS A 116 -12.806 5.640 4.823 1.00 23.24 C ATOM 1907 CD LYS A 116 -13.425 6.953 5.370 1.00 24.51 C ATOM 1908 CE LYS A 116 -12.448 8.155 5.291 1.00 32.04 C ATOM 1909 NZ LYS A 116 -13.093 9.451 5.639 1.00 51.43 N ATOM 0 H LYS A 116 -11.423 6.175 1.241 1.00 61.14 H new ATOM 0 HA LYS A 116 -10.857 4.292 3.299 1.00 62.35 H new ATOM 0 HB2 LYS A 116 -11.823 6.714 3.253 1.00 65.11 H new ATOM 0 HB3 LYS A 116 -13.343 5.982 2.779 1.00 65.11 H new ATOM 0 HG2 LYS A 116 -13.517 4.821 4.932 1.00 23.24 H new ATOM 0 HG3 LYS A 116 -11.923 5.375 5.405 1.00 23.24 H new ATOM 0 HD2 LYS A 116 -14.328 7.187 4.806 1.00 24.51 H new ATOM 0 HD3 LYS A 116 -13.727 6.803 6.407 1.00 24.51 H new ATOM 0 HE2 LYS A 116 -11.610 7.980 5.965 1.00 32.04 H new ATOM 0 HE3 LYS A 116 -12.039 8.218 4.283 1.00 32.04 H new ATOM 0 HZ1 LYS A 116 -12.721 10.201 5.022 1.00 51.43 H new ATOM 0 HZ2 LYS A 116 -14.122 9.373 5.508 1.00 51.43 H new ATOM 0 HZ3 LYS A 116 -12.887 9.686 6.631 1.00 51.43 H new ATOM 1923 N LYS A 117 -13.340 3.518 1.277 1.00 2.22 N ATOM 1924 CA LYS A 117 -14.191 2.412 0.798 1.00 43.35 C ATOM 1925 C LYS A 117 -13.303 1.223 0.380 1.00 22.44 C ATOM 1926 O LYS A 117 -13.471 0.097 0.873 1.00 0.15 O ATOM 1927 CB LYS A 117 -15.048 2.849 -0.432 1.00 33.01 C ATOM 1928 CG LYS A 117 -15.842 4.160 -0.256 1.00 23.14 C ATOM 1929 CD LYS A 117 -16.658 4.541 -1.527 1.00 23.10 C ATOM 1930 CE LYS A 117 -16.991 6.041 -1.607 1.00 1.45 C ATOM 1931 NZ LYS A 117 -17.678 6.554 -0.396 1.00 54.43 N ATOM 0 H LYS A 117 -13.381 4.349 0.687 1.00 2.22 H new ATOM 0 HA LYS A 117 -14.859 2.126 1.610 1.00 43.35 H new ATOM 0 HB2 LYS A 117 -14.388 2.957 -1.293 1.00 33.01 H new ATOM 0 HB3 LYS A 117 -15.750 2.048 -0.667 1.00 33.01 H new ATOM 0 HG2 LYS A 117 -16.521 4.058 0.590 1.00 23.14 H new ATOM 0 HG3 LYS A 117 -15.152 4.969 -0.016 1.00 23.14 H new ATOM 0 HD2 LYS A 117 -16.093 4.253 -2.413 1.00 23.10 H new ATOM 0 HD3 LYS A 117 -17.585 3.968 -1.541 1.00 23.10 H new ATOM 0 HE2 LYS A 117 -16.070 6.603 -1.759 1.00 1.45 H new ATOM 0 HE3 LYS A 117 -17.622 6.220 -2.478 1.00 1.45 H new ATOM 0 HZ1 LYS A 117 -17.890 7.565 -0.519 1.00 54.43 H new ATOM 0 HZ2 LYS A 117 -18.564 6.030 -0.251 1.00 54.43 H new ATOM 0 HZ3 LYS A 117 -17.062 6.428 0.432 1.00 54.43 H new ATOM 1945 N ARG A 118 -12.321 1.534 -0.501 1.00 61.11 N ATOM 1946 CA ARG A 118 -11.455 0.540 -1.167 1.00 63.23 C ATOM 1947 C ARG A 118 -10.673 -0.313 -0.153 1.00 34.42 C ATOM 1948 O ARG A 118 -10.556 -1.521 -0.332 1.00 42.02 O ATOM 1949 CB ARG A 118 -10.462 1.251 -2.137 1.00 53.25 C ATOM 1950 CG ARG A 118 -11.138 2.025 -3.290 1.00 23.04 C ATOM 1951 CD ARG A 118 -11.886 1.120 -4.281 1.00 73.24 C ATOM 1952 NE ARG A 118 -12.606 1.905 -5.304 1.00 53.10 N ATOM 1953 CZ ARG A 118 -12.146 2.226 -6.522 1.00 3.42 C ATOM 1954 NH1 ARG A 118 -10.940 1.850 -6.925 1.00 54.12 N ATOM 1955 NH2 ARG A 118 -12.919 2.911 -7.340 1.00 70.22 N ATOM 0 H ARG A 118 -12.109 2.495 -0.770 1.00 61.11 H new ATOM 0 HA ARG A 118 -12.104 -0.127 -1.734 1.00 63.23 H new ATOM 0 HB2 ARG A 118 -9.846 1.943 -1.563 1.00 53.25 H new ATOM 0 HB3 ARG A 118 -9.791 0.504 -2.562 1.00 53.25 H new ATOM 0 HG2 ARG A 118 -11.838 2.747 -2.870 1.00 23.04 H new ATOM 0 HG3 ARG A 118 -10.380 2.592 -3.830 1.00 23.04 H new ATOM 0 HD2 ARG A 118 -11.177 0.451 -4.769 1.00 73.24 H new ATOM 0 HD3 ARG A 118 -12.594 0.494 -3.738 1.00 73.24 H new ATOM 0 HE ARG A 118 -13.541 2.234 -5.061 1.00 53.10 H new ATOM 0 HH11 ARG A 118 -10.342 1.305 -6.304 1.00 54.12 H new ATOM 0 HH12 ARG A 118 -10.611 2.106 -7.856 1.00 54.12 H new ATOM 0 HH21 ARG A 118 -13.854 3.190 -7.044 1.00 70.22 H new ATOM 0 HH22 ARG A 118 -12.582 3.162 -8.269 1.00 70.22 H new ATOM 1969 N LEU A 119 -10.173 0.339 0.917 1.00 12.35 N ATOM 1970 CA LEU A 119 -9.358 -0.314 1.970 1.00 54.10 C ATOM 1971 C LEU A 119 -10.115 -1.478 2.622 1.00 2.23 C ATOM 1972 O LEU A 119 -9.609 -2.605 2.687 1.00 43.21 O ATOM 1973 CB LEU A 119 -8.944 0.717 3.058 1.00 41.31 C ATOM 1974 CG LEU A 119 -8.075 1.907 2.568 1.00 71.12 C ATOM 1975 CD1 LEU A 119 -7.679 2.830 3.728 1.00 32.22 C ATOM 1976 CD2 LEU A 119 -6.846 1.419 1.788 1.00 21.54 C ATOM 0 H LEU A 119 -10.322 1.335 1.078 1.00 12.35 H new ATOM 0 HA LEU A 119 -8.463 -0.711 1.492 1.00 54.10 H new ATOM 0 HB2 LEU A 119 -9.849 1.117 3.515 1.00 41.31 H new ATOM 0 HB3 LEU A 119 -8.397 0.191 3.841 1.00 41.31 H new ATOM 0 HG LEU A 119 -8.683 2.495 1.881 1.00 71.12 H new ATOM 0 HD11 LEU A 119 -7.072 3.652 3.348 1.00 32.22 H new ATOM 0 HD12 LEU A 119 -8.578 3.230 4.198 1.00 32.22 H new ATOM 0 HD13 LEU A 119 -7.106 2.265 4.463 1.00 32.22 H new ATOM 0 HD21 LEU A 119 -6.259 2.277 1.459 1.00 21.54 H new ATOM 0 HD22 LEU A 119 -6.235 0.786 2.431 1.00 21.54 H new ATOM 0 HD23 LEU A 119 -7.170 0.847 0.919 1.00 21.54 H new ATOM 1988 N LYS A 120 -11.348 -1.180 3.052 1.00 52.33 N ATOM 1989 CA LYS A 120 -12.243 -2.155 3.688 1.00 5.42 C ATOM 1990 C LYS A 120 -12.585 -3.302 2.706 1.00 65.12 C ATOM 1991 O LYS A 120 -12.557 -4.477 3.084 1.00 50.21 O ATOM 1992 CB LYS A 120 -13.535 -1.444 4.172 1.00 62.23 C ATOM 1993 CG LYS A 120 -14.572 -2.385 4.832 1.00 61.54 C ATOM 1994 CD LYS A 120 -15.933 -1.693 5.097 1.00 55.34 C ATOM 1995 CE LYS A 120 -17.015 -2.682 5.566 1.00 21.21 C ATOM 1996 NZ LYS A 120 -18.335 -2.021 5.757 1.00 53.34 N ATOM 0 H LYS A 120 -11.755 -0.249 2.968 1.00 52.33 H new ATOM 0 HA LYS A 120 -11.737 -2.590 4.550 1.00 5.42 H new ATOM 0 HB2 LYS A 120 -13.262 -0.666 4.885 1.00 62.23 H new ATOM 0 HB3 LYS A 120 -14.002 -0.947 3.322 1.00 62.23 H new ATOM 0 HG2 LYS A 120 -14.730 -3.251 4.189 1.00 61.54 H new ATOM 0 HG3 LYS A 120 -14.170 -2.757 5.774 1.00 61.54 H new ATOM 0 HD2 LYS A 120 -15.802 -0.918 5.852 1.00 55.34 H new ATOM 0 HD3 LYS A 120 -16.269 -1.197 4.186 1.00 55.34 H new ATOM 0 HE2 LYS A 120 -17.114 -3.484 4.834 1.00 21.21 H new ATOM 0 HE3 LYS A 120 -16.702 -3.143 6.503 1.00 21.21 H new ATOM 0 HZ1 LYS A 120 -19.033 -2.724 6.073 1.00 53.34 H new ATOM 0 HZ2 LYS A 120 -18.248 -1.273 6.474 1.00 53.34 H new ATOM 0 HZ3 LYS A 120 -18.647 -1.603 4.857 1.00 53.34 H new ATOM 2010 N GLU A 121 -12.860 -2.927 1.440 1.00 64.42 N ATOM 2011 CA GLU A 121 -13.231 -3.865 0.349 1.00 11.35 C ATOM 2012 C GLU A 121 -12.136 -4.897 0.057 1.00 25.03 C ATOM 2013 O GLU A 121 -12.430 -6.081 -0.160 1.00 12.23 O ATOM 2014 CB GLU A 121 -13.586 -3.057 -0.927 1.00 31.33 C ATOM 2015 CG GLU A 121 -14.956 -2.363 -0.836 1.00 1.34 C ATOM 2016 CD GLU A 121 -15.230 -1.360 -1.959 1.00 41.32 C ATOM 2017 OE1 GLU A 121 -14.958 -1.675 -3.138 1.00 74.42 O ATOM 2018 OE2 GLU A 121 -15.731 -0.256 -1.662 1.00 63.41 O ATOM 0 H GLU A 121 -12.832 -1.953 1.138 1.00 64.42 H new ATOM 0 HA GLU A 121 -14.102 -4.432 0.679 1.00 11.35 H new ATOM 0 HB2 GLU A 121 -12.815 -2.306 -1.101 1.00 31.33 H new ATOM 0 HB3 GLU A 121 -13.580 -3.726 -1.788 1.00 31.33 H new ATOM 0 HG2 GLU A 121 -15.737 -3.124 -0.846 1.00 1.34 H new ATOM 0 HG3 GLU A 121 -15.026 -1.847 0.121 1.00 1.34 H new ATOM 2025 N LEU A 122 -10.875 -4.442 0.082 1.00 31.34 N ATOM 2026 CA LEU A 122 -9.715 -5.308 -0.180 1.00 1.45 C ATOM 2027 C LEU A 122 -9.481 -6.256 1.012 1.00 63.42 C ATOM 2028 O LEU A 122 -9.083 -7.397 0.824 1.00 73.23 O ATOM 2029 CB LEU A 122 -8.449 -4.459 -0.506 1.00 23.34 C ATOM 2030 CG LEU A 122 -8.581 -3.466 -1.718 1.00 13.31 C ATOM 2031 CD1 LEU A 122 -7.266 -2.715 -1.971 1.00 71.52 C ATOM 2032 CD2 LEU A 122 -9.090 -4.154 -3.007 1.00 3.22 C ATOM 0 H LEU A 122 -10.631 -3.472 0.282 1.00 31.34 H new ATOM 0 HA LEU A 122 -9.922 -5.920 -1.058 1.00 1.45 H new ATOM 0 HB2 LEU A 122 -8.182 -3.885 0.381 1.00 23.34 H new ATOM 0 HB3 LEU A 122 -7.621 -5.139 -0.707 1.00 23.34 H new ATOM 0 HG LEU A 122 -9.341 -2.737 -1.436 1.00 13.31 H new ATOM 0 HD11 LEU A 122 -7.391 -2.037 -2.815 1.00 71.52 H new ATOM 0 HD12 LEU A 122 -6.997 -2.143 -1.083 1.00 71.52 H new ATOM 0 HD13 LEU A 122 -6.475 -3.431 -2.195 1.00 71.52 H new ATOM 0 HD21 LEU A 122 -9.161 -3.419 -3.808 1.00 3.22 H new ATOM 0 HD22 LEU A 122 -8.395 -4.942 -3.298 1.00 3.22 H new ATOM 0 HD23 LEU A 122 -10.073 -4.587 -2.824 1.00 3.22 H new ATOM 2044 N LEU A 123 -9.790 -5.785 2.243 1.00 54.22 N ATOM 2045 CA LEU A 123 -9.752 -6.636 3.467 1.00 61.53 C ATOM 2046 C LEU A 123 -10.815 -7.757 3.401 1.00 2.42 C ATOM 2047 O LEU A 123 -10.549 -8.901 3.807 1.00 23.11 O ATOM 2048 CB LEU A 123 -9.926 -5.773 4.766 1.00 41.24 C ATOM 2049 CG LEU A 123 -8.611 -5.273 5.455 1.00 23.45 C ATOM 2050 CD1 LEU A 123 -7.715 -4.446 4.501 1.00 75.21 C ATOM 2051 CD2 LEU A 123 -8.956 -4.493 6.744 1.00 63.33 C ATOM 0 H LEU A 123 -10.069 -4.820 2.420 1.00 54.22 H new ATOM 0 HA LEU A 123 -8.770 -7.108 3.510 1.00 61.53 H new ATOM 0 HB2 LEU A 123 -10.533 -4.903 4.518 1.00 41.24 H new ATOM 0 HB3 LEU A 123 -10.490 -6.359 5.492 1.00 41.24 H new ATOM 0 HG LEU A 123 -8.022 -6.149 5.725 1.00 23.45 H new ATOM 0 HD11 LEU A 123 -6.818 -4.125 5.031 1.00 75.21 H new ATOM 0 HD12 LEU A 123 -7.431 -5.059 3.645 1.00 75.21 H new ATOM 0 HD13 LEU A 123 -8.264 -3.571 4.154 1.00 75.21 H new ATOM 0 HD21 LEU A 123 -8.037 -4.148 7.218 1.00 63.33 H new ATOM 0 HD22 LEU A 123 -9.579 -3.634 6.494 1.00 63.33 H new ATOM 0 HD23 LEU A 123 -9.496 -5.145 7.431 1.00 63.33 H new ATOM 2063 N GLU A 124 -12.001 -7.411 2.866 1.00 42.32 N ATOM 2064 CA GLU A 124 -13.121 -8.359 2.663 1.00 72.14 C ATOM 2065 C GLU A 124 -12.755 -9.460 1.646 1.00 14.13 C ATOM 2066 O GLU A 124 -13.270 -10.580 1.722 1.00 3.41 O ATOM 2067 CB GLU A 124 -14.391 -7.587 2.188 1.00 73.21 C ATOM 2068 CG GLU A 124 -14.961 -6.605 3.238 1.00 23.02 C ATOM 2069 CD GLU A 124 -16.130 -5.757 2.710 1.00 31.13 C ATOM 2070 OE1 GLU A 124 -17.281 -6.247 2.700 1.00 64.50 O ATOM 2071 OE2 GLU A 124 -15.909 -4.604 2.290 1.00 74.40 O ATOM 0 H GLU A 124 -12.214 -6.462 2.560 1.00 42.32 H new ATOM 0 HA GLU A 124 -13.328 -8.845 3.617 1.00 72.14 H new ATOM 0 HB2 GLU A 124 -14.148 -7.033 1.281 1.00 73.21 H new ATOM 0 HB3 GLU A 124 -15.164 -8.308 1.923 1.00 73.21 H new ATOM 0 HG2 GLU A 124 -15.295 -7.169 4.108 1.00 23.02 H new ATOM 0 HG3 GLU A 124 -14.164 -5.942 3.575 1.00 23.02 H new ATOM 2078 N LYS A 125 -11.846 -9.130 0.703 1.00 43.15 N ATOM 2079 CA LYS A 125 -11.471 -10.016 -0.423 1.00 55.23 C ATOM 2080 C LYS A 125 -9.990 -10.470 -0.340 1.00 23.31 C ATOM 2081 O LYS A 125 -9.439 -10.926 -1.348 1.00 31.30 O ATOM 2082 CB LYS A 125 -11.734 -9.266 -1.756 1.00 11.41 C ATOM 2083 CG LYS A 125 -13.165 -8.716 -1.906 1.00 11.20 C ATOM 2084 CD LYS A 125 -13.369 -7.957 -3.230 1.00 24.42 C ATOM 2085 CE LYS A 125 -14.713 -7.228 -3.273 1.00 4.42 C ATOM 2086 NZ LYS A 125 -14.941 -6.564 -4.581 1.00 31.41 N ATOM 0 H LYS A 125 -11.350 -8.239 0.700 1.00 43.15 H new ATOM 0 HA LYS A 125 -12.080 -10.919 -0.371 1.00 55.23 H new ATOM 0 HB2 LYS A 125 -11.029 -8.438 -1.838 1.00 11.41 H new ATOM 0 HB3 LYS A 125 -11.529 -9.942 -2.586 1.00 11.41 H new ATOM 0 HG2 LYS A 125 -13.875 -9.541 -1.851 1.00 11.20 H new ATOM 0 HG3 LYS A 125 -13.384 -8.050 -1.072 1.00 11.20 H new ATOM 0 HD2 LYS A 125 -12.562 -7.237 -3.363 1.00 24.42 H new ATOM 0 HD3 LYS A 125 -13.310 -8.658 -4.062 1.00 24.42 H new ATOM 0 HE2 LYS A 125 -15.517 -7.938 -3.081 1.00 4.42 H new ATOM 0 HE3 LYS A 125 -14.748 -6.484 -2.477 1.00 4.42 H new ATOM 0 HZ1 LYS A 125 -15.862 -6.081 -4.569 1.00 31.41 H new ATOM 0 HZ2 LYS A 125 -14.188 -5.868 -4.753 1.00 31.41 H new ATOM 0 HZ3 LYS A 125 -14.933 -7.277 -5.338 1.00 31.41 H new ATOM 2100 N VAL A 126 -9.359 -10.300 0.857 1.00 61.42 N ATOM 2101 CA VAL A 126 -7.922 -10.660 1.184 1.00 74.52 C ATOM 2102 C VAL A 126 -6.880 -9.981 0.241 1.00 54.32 C ATOM 2103 O VAL A 126 -5.685 -10.313 0.247 1.00 73.41 O ATOM 2104 CB VAL A 126 -7.673 -12.232 1.287 1.00 71.33 C ATOM 2105 CG1 VAL A 126 -7.497 -12.946 -0.082 1.00 23.44 C ATOM 2106 CG2 VAL A 126 -6.492 -12.565 2.235 1.00 51.22 C ATOM 0 H VAL A 126 -9.843 -9.895 1.658 1.00 61.42 H new ATOM 0 HA VAL A 126 -7.759 -10.247 2.180 1.00 74.52 H new ATOM 0 HB VAL A 126 -8.593 -12.631 1.715 1.00 71.33 H new ATOM 0 HG11 VAL A 126 -7.332 -14.011 0.082 1.00 23.44 H new ATOM 0 HG12 VAL A 126 -8.395 -12.806 -0.684 1.00 23.44 H new ATOM 0 HG13 VAL A 126 -6.640 -12.523 -0.606 1.00 23.44 H new ATOM 0 HG21 VAL A 126 -6.354 -13.645 2.279 1.00 51.22 H new ATOM 0 HG22 VAL A 126 -5.581 -12.098 1.860 1.00 51.22 H new ATOM 0 HG23 VAL A 126 -6.709 -12.186 3.234 1.00 51.22 H new ATOM 2116 N GLY A 127 -7.359 -8.998 -0.513 1.00 34.13 N ATOM 2117 CA GLY A 127 -6.573 -8.249 -1.473 1.00 70.13 C ATOM 2118 C GLY A 127 -7.385 -7.997 -2.713 1.00 23.34 C ATOM 2119 O GLY A 127 -8.254 -7.132 -2.692 1.00 45.35 O ATOM 0 H GLY A 127 -8.332 -8.696 -0.468 1.00 34.13 H new ATOM 0 HA2 GLY A 127 -6.256 -7.302 -1.037 1.00 70.13 H new ATOM 0 HA3 GLY A 127 -5.668 -8.802 -1.726 1.00 70.13 H new