USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1084 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 63 LYS NZ :NH3+ -132:sc= -1.21 (180deg=-4.29!) USER MOD Set 1.2: A 93 THR OG1 : rot -140:sc= -0.804 USER MOD Set 2.1: A 20 THR OG1 : rot 180:sc= -0.313 USER MOD Set 2.2: A 21 LYS NZ :NH3+ -131:sc= 0.148 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.216 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : A 13 TYR OH : rot 30:sc= 0 USER MOD Single : A 15 SER OG : rot -80:sc= -1.42 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0575 USER MOD Single : A 33 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.14) USER MOD Single : A 41 ASN : amide:sc= -0.553 K(o=-0.55,f=-1.4) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0237 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HD1:sc= -0.0385 X(o=-0.038,f=-0.46) USER MOD Single : A 86 LYS NZ :NH3+ -124:sc= 0 (180deg=-0.865) USER MOD Single : A 94 SER OG : rot 180:sc= 0.0704 USER MOD Single : A 99 HIS : no HD1:sc= -0.609 X(o=-0.61,f=-0.73) USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 K(o=0,f=-0.95!) USER MOD Single : A 124 ASN : amide:sc= -0.0247 K(o=-0.025,f=-1.3!) USER MOD Single : A 125 GLN : amide:sc= -2.5 K(o=-2.5,f=-3.6!) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -1.93 K(o=-1.9,f=-2.7) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 148:sc= -0.136 (180deg=-1.27!) USER MOD Single : A 138 SER OG : rot 155:sc= 0.962 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 3 -0.976 -9.262 -4.218 1.00 63.21 N ATOM 2 CA ASP A 3 -0.599 -8.122 -3.390 1.00 1.10 C ATOM 3 C ASP A 3 -0.697 -6.821 -4.180 1.00 54.11 C ATOM 4 O ASP A 3 0.316 -6.256 -4.593 1.00 24.32 O ATOM 5 CB ASP A 3 0.821 -8.301 -2.852 1.00 23.13 C ATOM 6 CG ASP A 3 0.923 -9.440 -1.856 1.00 5.44 C ATOM 7 OD1 ASP A 3 -0.053 -9.667 -1.112 1.00 40.21 O ATOM 8 OD2 ASP A 3 1.980 -10.105 -1.822 1.00 10.33 O1- ATOM 0 HA ASP A 3 -1.292 -8.070 -2.551 1.00 1.10 H new ATOM 0 HB2 ASP A 3 1.501 -8.487 -3.683 1.00 23.13 H new ATOM 0 HB3 ASP A 3 1.146 -7.376 -2.376 1.00 23.13 H new ATOM 13 N VAL A 4 -1.923 -6.351 -4.387 1.00 1.21 N ATOM 14 CA VAL A 4 -2.153 -5.115 -5.129 1.00 45.01 C ATOM 15 C VAL A 4 -2.966 -4.124 -4.304 1.00 4.33 C ATOM 16 O VAL A 4 -4.012 -4.469 -3.752 1.00 12.14 O ATOM 17 CB VAL A 4 -2.886 -5.386 -6.455 1.00 11.04 C ATOM 18 CG1 VAL A 4 -4.247 -6.015 -6.196 1.00 11.12 C ATOM 19 CG2 VAL A 4 -3.028 -4.100 -7.257 1.00 24.21 C ATOM 0 H VAL A 4 -2.772 -6.806 -4.052 1.00 1.21 H new ATOM 0 HA VAL A 4 -1.174 -4.687 -5.345 1.00 45.01 H new ATOM 0 HB VAL A 4 -2.293 -6.090 -7.040 1.00 11.04 H new ATOM 0 HG11 VAL A 4 -4.749 -6.199 -7.146 1.00 11.12 H new ATOM 0 HG12 VAL A 4 -4.117 -6.958 -5.666 1.00 11.12 H new ATOM 0 HG13 VAL A 4 -4.851 -5.339 -5.591 1.00 11.12 H new ATOM 0 HG21 VAL A 4 -3.548 -4.310 -8.192 1.00 24.21 H new ATOM 0 HG22 VAL A 4 -3.598 -3.372 -6.680 1.00 24.21 H new ATOM 0 HG23 VAL A 4 -2.039 -3.696 -7.475 1.00 24.21 H new ATOM 29 N TYR A 5 -2.479 -2.891 -4.223 1.00 14.41 N ATOM 30 CA TYR A 5 -3.159 -1.849 -3.464 1.00 14.11 C ATOM 31 C TYR A 5 -4.547 -1.576 -4.036 1.00 34.31 C ATOM 32 O TYR A 5 -4.756 -1.635 -5.248 1.00 3.50 O ATOM 33 CB TYR A 5 -2.332 -0.562 -3.470 1.00 22.13 C ATOM 34 CG TYR A 5 -2.251 0.101 -4.827 1.00 23.14 C ATOM 35 CD1 TYR A 5 -1.362 -0.357 -5.793 1.00 4.24 C ATOM 36 CD2 TYR A 5 -3.061 1.184 -5.142 1.00 11.34 C ATOM 37 CE1 TYR A 5 -1.284 0.246 -7.034 1.00 42.42 C ATOM 38 CE2 TYR A 5 -2.991 1.791 -6.382 1.00 71.45 C ATOM 39 CZ TYR A 5 -2.101 1.319 -7.324 1.00 3.24 C ATOM 40 OH TYR A 5 -2.027 1.922 -8.558 1.00 3.20 O ATOM 0 H TYR A 5 -1.615 -2.589 -4.674 1.00 14.41 H new ATOM 0 HA TYR A 5 -3.270 -2.197 -2.437 1.00 14.11 H new ATOM 0 HB2 TYR A 5 -2.764 0.140 -2.757 1.00 22.13 H new ATOM 0 HB3 TYR A 5 -1.323 -0.787 -3.124 1.00 22.13 H new ATOM 0 HD1 TYR A 5 -0.722 -1.198 -5.570 1.00 4.24 H new ATOM 0 HD2 TYR A 5 -3.757 1.558 -4.406 1.00 11.34 H new ATOM 0 HE1 TYR A 5 -0.587 -0.121 -7.773 1.00 42.42 H new ATOM 0 HE2 TYR A 5 -3.630 2.631 -6.612 1.00 71.45 H new ATOM 0 HH TYR A 5 -2.670 2.661 -8.600 1.00 3.20 H new ATOM 50 N THR A 6 -5.495 -1.275 -3.154 1.00 71.00 N ATOM 51 CA THR A 6 -6.863 -0.994 -3.569 1.00 14.31 C ATOM 52 C THR A 6 -7.446 0.177 -2.785 1.00 73.50 C ATOM 53 O THR A 6 -6.966 0.510 -1.701 1.00 43.33 O ATOM 54 CB THR A 6 -7.772 -2.224 -3.382 1.00 51.52 C ATOM 55 OG1 THR A 6 -9.140 -1.860 -3.600 1.00 70.22 O ATOM 56 CG2 THR A 6 -7.612 -2.807 -1.986 1.00 71.11 C ATOM 0 H THR A 6 -5.340 -1.220 -2.147 1.00 71.00 H new ATOM 0 HA THR A 6 -6.825 -0.737 -4.628 1.00 14.31 H new ATOM 0 HB THR A 6 -7.478 -2.980 -4.110 1.00 51.52 H new ATOM 0 HG1 THR A 6 -9.711 -2.647 -3.481 1.00 70.22 H new ATOM 0 HG21 THR A 6 -8.263 -3.674 -1.877 1.00 71.11 H new ATOM 0 HG22 THR A 6 -6.576 -3.110 -1.835 1.00 71.11 H new ATOM 0 HG23 THR A 6 -7.882 -2.055 -1.245 1.00 71.11 H new ATOM 64 N SER A 7 -8.482 0.798 -3.339 1.00 24.13 N ATOM 65 CA SER A 7 -9.128 1.934 -2.692 1.00 4.43 C ATOM 66 C SER A 7 -10.522 1.558 -2.200 1.00 34.24 C ATOM 67 O SER A 7 -10.929 0.399 -2.280 1.00 13.42 O ATOM 68 CB SER A 7 -9.217 3.116 -3.660 1.00 10.54 C ATOM 69 OG SER A 7 -8.144 3.100 -4.584 1.00 74.54 O ATOM 0 H SER A 7 -8.892 0.534 -4.235 1.00 24.13 H new ATOM 0 HA SER A 7 -8.524 2.223 -1.832 1.00 4.43 H new ATOM 0 HB2 SER A 7 -10.165 3.079 -4.198 1.00 10.54 H new ATOM 0 HB3 SER A 7 -9.205 4.051 -3.100 1.00 10.54 H new ATOM 0 HG SER A 7 -8.225 3.864 -5.192 1.00 74.54 H new ATOM 75 N ILE A 8 -11.250 2.547 -1.692 1.00 55.43 N ATOM 76 CA ILE A 8 -12.599 2.322 -1.188 1.00 25.01 C ATOM 77 C ILE A 8 -13.644 2.651 -2.249 1.00 21.43 C ATOM 78 O ILE A 8 -13.666 3.756 -2.792 1.00 13.54 O ATOM 79 CB ILE A 8 -12.877 3.164 0.070 1.00 54.34 C ATOM 80 CG1 ILE A 8 -11.863 2.835 1.167 1.00 4.33 C ATOM 81 CG2 ILE A 8 -14.296 2.924 0.566 1.00 52.02 C ATOM 82 CD1 ILE A 8 -10.634 3.717 1.138 1.00 12.02 C ATOM 0 H ILE A 8 -10.928 3.512 -1.619 1.00 55.43 H new ATOM 0 HA ILE A 8 -12.668 1.265 -0.930 1.00 25.01 H new ATOM 0 HB ILE A 8 -12.775 4.218 -0.189 1.00 54.34 H new ATOM 0 HG12 ILE A 8 -12.347 2.932 2.139 1.00 4.33 H new ATOM 0 HG13 ILE A 8 -11.556 1.794 1.066 1.00 4.33 H new ATOM 0 HG21 ILE A 8 -14.477 3.527 1.456 1.00 52.02 H new ATOM 0 HG22 ILE A 8 -15.006 3.204 -0.212 1.00 52.02 H new ATOM 0 HG23 ILE A 8 -14.423 1.869 0.810 1.00 52.02 H new ATOM 0 HD11 ILE A 8 -9.959 3.427 1.943 1.00 12.02 H new ATOM 0 HD12 ILE A 8 -10.126 3.602 0.180 1.00 12.02 H new ATOM 0 HD13 ILE A 8 -10.930 4.758 1.270 1.00 12.02 H new ATOM 94 N HIS A 9 -14.512 1.687 -2.536 1.00 22.41 N ATOM 95 CA HIS A 9 -15.563 1.874 -3.530 1.00 40.14 C ATOM 96 C HIS A 9 -16.766 2.586 -2.921 1.00 0.44 C ATOM 97 O HIS A 9 -16.945 2.591 -1.702 1.00 31.34 O ATOM 98 CB HIS A 9 -15.992 0.527 -4.111 1.00 13.31 C ATOM 99 CG HIS A 9 -15.246 0.143 -5.352 1.00 14.24 C ATOM 100 ND1 HIS A 9 -15.727 -0.768 -6.268 1.00 60.14 N ATOM 101 CD2 HIS A 9 -14.048 0.556 -5.827 1.00 65.44 C ATOM 102 CE1 HIS A 9 -14.856 -0.902 -7.251 1.00 42.51 C ATOM 103 NE2 HIS A 9 -13.828 -0.109 -7.009 1.00 14.34 N ATOM 0 H HIS A 9 -14.509 0.768 -2.094 1.00 22.41 H new ATOM 0 HA HIS A 9 -15.164 2.495 -4.332 1.00 40.14 H new ATOM 0 HB2 HIS A 9 -15.848 -0.247 -3.357 1.00 13.31 H new ATOM 0 HB3 HIS A 9 -17.058 0.560 -4.334 1.00 13.31 H new ATOM 0 HD2 HIS A 9 -13.388 1.274 -5.363 1.00 65.44 H new ATOM 0 HE1 HIS A 9 -14.966 -1.550 -8.108 1.00 42.51 H new ATOM 0 HE2 HIS A 9 -13.005 -0.007 -7.603 1.00 14.34 H new ATOM 111 N ILE A 10 -17.587 3.187 -3.774 1.00 62.41 N ATOM 112 CA ILE A 10 -18.774 3.902 -3.319 1.00 5.23 C ATOM 113 C ILE A 10 -20.031 3.367 -3.997 1.00 41.15 C ATOM 114 O ILE A 10 -20.170 3.444 -5.217 1.00 13.04 O ATOM 115 CB ILE A 10 -18.660 5.412 -3.592 1.00 51.44 C ATOM 116 CG1 ILE A 10 -17.499 6.012 -2.795 1.00 72.52 C ATOM 117 CG2 ILE A 10 -19.966 6.113 -3.246 1.00 54.40 C ATOM 118 CD1 ILE A 10 -17.712 5.971 -1.297 1.00 33.02 C ATOM 0 H ILE A 10 -17.453 3.194 -4.785 1.00 62.41 H new ATOM 0 HA ILE A 10 -18.847 3.740 -2.244 1.00 5.23 H new ATOM 0 HB ILE A 10 -18.461 5.560 -4.653 1.00 51.44 H new ATOM 0 HG12 ILE A 10 -16.584 5.473 -3.039 1.00 72.52 H new ATOM 0 HG13 ILE A 10 -17.352 7.047 -3.105 1.00 72.52 H new ATOM 0 HG21 ILE A 10 -19.870 7.180 -3.444 1.00 54.40 H new ATOM 0 HG22 ILE A 10 -20.772 5.702 -3.854 1.00 54.40 H new ATOM 0 HG23 ILE A 10 -20.193 5.959 -2.191 1.00 54.40 H new ATOM 0 HD11 ILE A 10 -16.851 6.412 -0.795 1.00 33.02 H new ATOM 0 HD12 ILE A 10 -18.609 6.535 -1.042 1.00 33.02 H new ATOM 0 HD13 ILE A 10 -17.829 4.936 -0.974 1.00 33.02 H new ATOM 130 N GLU A 11 -20.944 2.827 -3.196 1.00 14.33 N ATOM 131 CA GLU A 11 -22.190 2.280 -3.718 1.00 21.25 C ATOM 132 C GLU A 11 -23.252 3.369 -3.841 1.00 42.40 C ATOM 133 O GLU A 11 -23.181 4.398 -3.172 1.00 51.11 O ATOM 134 CB GLU A 11 -22.700 1.156 -2.813 1.00 50.43 C ATOM 135 CG GLU A 11 -22.846 -0.179 -3.524 1.00 44.11 C ATOM 136 CD GLU A 11 -21.577 -0.602 -4.237 1.00 11.42 C ATOM 137 OE1 GLU A 11 -20.705 -1.215 -3.585 1.00 55.02 O ATOM 138 OE2 GLU A 11 -21.455 -0.321 -5.448 1.00 31.51 O1- ATOM 0 H GLU A 11 -20.844 2.757 -2.183 1.00 14.33 H new ATOM 0 HA GLU A 11 -21.991 1.875 -4.710 1.00 21.25 H new ATOM 0 HB2 GLU A 11 -22.015 1.038 -1.973 1.00 50.43 H new ATOM 0 HB3 GLU A 11 -23.666 1.445 -2.398 1.00 50.43 H new ATOM 0 HG2 GLU A 11 -23.123 -0.944 -2.799 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -23.660 -0.115 -4.246 1.00 44.11 H new ATOM 145 N GLU A 12 -24.237 3.133 -4.704 1.00 22.22 N ATOM 146 CA GLU A 12 -25.312 4.095 -4.916 1.00 35.34 C ATOM 147 C GLU A 12 -26.645 3.382 -5.126 1.00 30.44 C ATOM 148 O GLU A 12 -26.855 2.720 -6.142 1.00 41.32 O ATOM 149 CB GLU A 12 -25.002 4.983 -6.123 1.00 64.20 C ATOM 150 CG GLU A 12 -24.020 6.102 -5.818 1.00 75.35 C ATOM 151 CD GLU A 12 -23.886 7.088 -6.962 1.00 25.02 C ATOM 152 OE1 GLU A 12 -24.628 6.949 -7.956 1.00 51.50 O ATOM 153 OE2 GLU A 12 -23.038 8.000 -6.861 1.00 22.11 O1- ATOM 0 H GLU A 12 -24.312 2.285 -5.266 1.00 22.22 H new ATOM 0 HA GLU A 12 -25.388 4.719 -4.025 1.00 35.34 H new ATOM 0 HB2 GLU A 12 -24.598 4.365 -6.924 1.00 64.20 H new ATOM 0 HB3 GLU A 12 -25.931 5.417 -6.493 1.00 64.20 H new ATOM 0 HG2 GLU A 12 -24.345 6.632 -4.923 1.00 75.35 H new ATOM 0 HG3 GLU A 12 -23.043 5.673 -5.597 1.00 75.35 H new ATOM 160 N TYR A 13 -27.543 3.523 -4.156 1.00 22.50 N ATOM 161 CA TYR A 13 -28.854 2.890 -4.232 1.00 61.54 C ATOM 162 C TYR A 13 -29.953 3.935 -4.401 1.00 2.15 C ATOM 163 O TYR A 13 -29.831 5.062 -3.924 1.00 12.31 O ATOM 164 CB TYR A 13 -29.116 2.058 -2.976 1.00 3.33 C ATOM 165 CG TYR A 13 -28.327 0.769 -2.928 1.00 52.40 C ATOM 166 CD1 TYR A 13 -27.024 0.748 -2.446 1.00 2.40 C ATOM 167 CD2 TYR A 13 -28.883 -0.426 -3.366 1.00 44.14 C ATOM 168 CE1 TYR A 13 -26.298 -0.427 -2.402 1.00 40.42 C ATOM 169 CE2 TYR A 13 -28.165 -1.606 -3.324 1.00 2.10 C ATOM 170 CZ TYR A 13 -26.873 -1.601 -2.841 1.00 52.02 C ATOM 171 OH TYR A 13 -26.154 -2.774 -2.798 1.00 41.41 O ATOM 0 H TYR A 13 -27.387 4.070 -3.309 1.00 22.50 H new ATOM 0 HA TYR A 13 -28.863 2.234 -5.102 1.00 61.54 H new ATOM 0 HB2 TYR A 13 -28.873 2.656 -2.097 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -30.179 1.826 -2.920 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -26.571 1.665 -2.100 1.00 2.40 H new ATOM 0 HD2 TYR A 13 -29.894 -0.433 -3.746 1.00 44.14 H new ATOM 0 HE1 TYR A 13 -25.286 -0.426 -2.026 1.00 40.42 H new ATOM 0 HE2 TYR A 13 -28.613 -2.527 -3.667 1.00 2.10 H new ATOM 0 HH TYR A 13 -25.517 -2.740 -2.054 1.00 41.41 H new ATOM 181 N GLU A 14 -31.028 3.549 -5.084 1.00 51.13 N ATOM 182 CA GLU A 14 -32.148 4.452 -5.317 1.00 44.05 C ATOM 183 C GLU A 14 -33.410 3.942 -4.626 1.00 34.43 C ATOM 184 O GLU A 14 -33.742 2.760 -4.711 1.00 43.23 O ATOM 185 CB GLU A 14 -32.403 4.609 -6.818 1.00 41.01 C ATOM 186 CG GLU A 14 -32.848 6.005 -7.217 1.00 63.43 C ATOM 187 CD GLU A 14 -32.833 6.215 -8.719 1.00 53.14 C ATOM 188 OE1 GLU A 14 -32.342 5.320 -9.439 1.00 2.11 O ATOM 189 OE2 GLU A 14 -33.313 7.274 -9.174 1.00 40.11 O1- ATOM 0 H GLU A 14 -31.146 2.618 -5.484 1.00 51.13 H new ATOM 0 HA GLU A 14 -31.891 5.424 -4.896 1.00 44.05 H new ATOM 0 HB2 GLU A 14 -31.492 4.358 -7.361 1.00 41.01 H new ATOM 0 HB3 GLU A 14 -33.165 3.892 -7.125 1.00 41.01 H new ATOM 0 HG2 GLU A 14 -33.855 6.183 -6.839 1.00 63.43 H new ATOM 0 HG3 GLU A 14 -32.195 6.739 -6.745 1.00 63.43 H new ATOM 196 N SER A 15 -34.108 4.843 -3.942 1.00 45.22 N ATOM 197 CA SER A 15 -35.330 4.484 -3.232 1.00 21.12 C ATOM 198 C SER A 15 -36.345 5.622 -3.290 1.00 40.40 C ATOM 199 O SER A 15 -36.176 6.652 -2.638 1.00 61.11 O ATOM 200 CB SER A 15 -35.018 4.138 -1.776 1.00 50.55 C ATOM 201 OG SER A 15 -35.178 2.752 -1.535 1.00 60.35 O ATOM 0 H SER A 15 -33.848 5.826 -3.865 1.00 45.22 H new ATOM 0 HA SER A 15 -35.761 3.610 -3.720 1.00 21.12 H new ATOM 0 HB2 SER A 15 -33.997 4.436 -1.539 1.00 50.55 H new ATOM 0 HB3 SER A 15 -35.676 4.703 -1.116 1.00 50.55 H new ATOM 0 HG SER A 15 -36.129 2.549 -1.411 1.00 60.35 H new ATOM 207 N GLU A 16 -37.400 5.427 -4.075 1.00 11.34 N ATOM 208 CA GLU A 16 -38.442 6.437 -4.219 1.00 40.23 C ATOM 209 C GLU A 16 -39.826 5.824 -4.016 1.00 3.23 C ATOM 210 O GLU A 16 -40.069 4.678 -4.393 1.00 64.35 O ATOM 211 CB GLU A 16 -38.360 7.095 -5.598 1.00 4.30 C ATOM 212 CG GLU A 16 -38.878 6.214 -6.724 1.00 43.20 C ATOM 213 CD GLU A 16 -38.176 6.479 -8.041 1.00 63.23 C ATOM 214 OE1 GLU A 16 -37.383 7.441 -8.109 1.00 62.45 O ATOM 215 OE2 GLU A 16 -38.421 5.723 -9.005 1.00 71.20 O1- ATOM 0 H GLU A 16 -37.556 4.579 -4.621 1.00 11.34 H new ATOM 0 HA GLU A 16 -38.284 7.196 -3.453 1.00 40.23 H new ATOM 0 HB2 GLU A 16 -38.930 8.024 -5.583 1.00 4.30 H new ATOM 0 HB3 GLU A 16 -37.323 7.361 -5.803 1.00 4.30 H new ATOM 0 HG2 GLU A 16 -38.747 5.167 -6.451 1.00 43.20 H new ATOM 0 HG3 GLU A 16 -39.948 6.380 -6.847 1.00 43.20 H new ATOM 222 N ALA A 17 -40.726 6.597 -3.420 1.00 45.31 N ATOM 223 CA ALA A 17 -42.086 6.133 -3.169 1.00 31.31 C ATOM 224 C ALA A 17 -42.944 6.243 -4.424 1.00 53.14 C ATOM 225 O ALA A 17 -43.435 7.321 -4.759 1.00 52.54 O ATOM 226 CB ALA A 17 -42.710 6.921 -2.028 1.00 33.40 C ATOM 0 H ALA A 17 -40.539 7.548 -3.101 1.00 45.31 H new ATOM 0 HA ALA A 17 -42.039 5.082 -2.885 1.00 31.31 H new ATOM 0 HB1 ALA A 17 -43.725 6.564 -1.852 1.00 33.40 H new ATOM 0 HB2 ALA A 17 -42.116 6.786 -1.124 1.00 33.40 H new ATOM 0 HB3 ALA A 17 -42.738 7.979 -2.289 1.00 33.40 H new ATOM 232 N ARG A 18 -43.120 5.121 -5.116 1.00 33.11 N ATOM 233 CA ARG A 18 -43.918 5.093 -6.336 1.00 74.51 C ATOM 234 C ARG A 18 -45.404 4.969 -6.010 1.00 1.22 C ATOM 235 O ARG A 18 -45.789 4.256 -5.083 1.00 0.43 O ATOM 236 CB ARG A 18 -43.482 3.931 -7.229 1.00 24.01 C ATOM 237 CG ARG A 18 -41.985 3.892 -7.488 1.00 71.34 C ATOM 238 CD ARG A 18 -41.629 2.851 -8.539 1.00 21.32 C ATOM 239 NE ARG A 18 -40.185 2.667 -8.660 1.00 34.15 N ATOM 240 CZ ARG A 18 -39.625 1.628 -9.269 1.00 3.12 C ATOM 241 NH1 ARG A 18 -40.384 0.686 -9.811 1.00 25.32 N1+ ATOM 242 NH2 ARG A 18 -38.303 1.532 -9.339 1.00 33.24 N ATOM 0 H ARG A 18 -42.721 4.220 -4.852 1.00 33.11 H new ATOM 0 HA ARG A 18 -43.757 6.031 -6.868 1.00 74.51 H new ATOM 0 HB2 ARG A 18 -43.787 2.993 -6.765 1.00 24.01 H new ATOM 0 HB3 ARG A 18 -44.006 4.000 -8.182 1.00 24.01 H new ATOM 0 HG2 ARG A 18 -41.646 4.874 -7.817 1.00 71.34 H new ATOM 0 HG3 ARG A 18 -41.460 3.668 -6.560 1.00 71.34 H new ATOM 0 HD2 ARG A 18 -42.095 1.900 -8.280 1.00 21.32 H new ATOM 0 HD3 ARG A 18 -42.038 3.154 -9.503 1.00 21.32 H new ATOM 0 HE ARG A 18 -39.573 3.375 -8.255 1.00 34.15 H new ATOM 0 HH11 ARG A 18 -41.400 0.758 -9.761 1.00 25.32 H new ATOM 0 HH12 ARG A 18 -39.952 -0.111 -10.278 1.00 25.32 H new ATOM 0 HH21 ARG A 18 -37.716 2.256 -8.925 1.00 33.24 H new ATOM 0 HH22 ARG A 18 -37.874 0.734 -9.807 1.00 33.24 H new ATOM 256 N ASP A 19 -46.233 5.666 -6.779 1.00 32.20 N ATOM 257 CA ASP A 19 -47.677 5.633 -6.573 1.00 41.34 C ATOM 258 C ASP A 19 -48.257 4.292 -7.007 1.00 44.41 C ATOM 259 O ASP A 19 -47.949 3.789 -8.089 1.00 5.35 O ATOM 260 CB ASP A 19 -48.349 6.769 -7.346 1.00 22.55 C ATOM 261 CG ASP A 19 -48.207 6.609 -8.848 1.00 73.34 C ATOM 262 OD1 ASP A 19 -47.070 6.391 -9.317 1.00 3.01 O ATOM 263 OD2 ASP A 19 -49.233 6.701 -9.553 1.00 24.34 O1- ATOM 0 H ASP A 19 -45.930 6.261 -7.551 1.00 32.20 H new ATOM 0 HA ASP A 19 -47.871 5.764 -5.508 1.00 41.34 H new ATOM 0 HB2 ASP A 19 -49.407 6.806 -7.086 1.00 22.55 H new ATOM 0 HB3 ASP A 19 -47.912 7.720 -7.042 1.00 22.55 H new ATOM 268 N THR A 20 -49.098 3.712 -6.155 1.00 61.12 N ATOM 269 CA THR A 20 -49.719 2.428 -6.450 1.00 12.12 C ATOM 270 C THR A 20 -50.972 2.605 -7.301 1.00 54.32 C ATOM 271 O THR A 20 -51.464 3.719 -7.476 1.00 54.42 O ATOM 272 CB THR A 20 -50.093 1.676 -5.158 1.00 40.23 C ATOM 273 OG1 THR A 20 -50.628 0.387 -5.479 1.00 70.42 O ATOM 274 CG2 THR A 20 -51.111 2.465 -4.348 1.00 72.02 C ATOM 0 H THR A 20 -49.364 4.112 -5.255 1.00 61.12 H new ATOM 0 HA THR A 20 -48.986 1.842 -7.005 1.00 12.12 H new ATOM 0 HB THR A 20 -49.190 1.556 -4.559 1.00 40.23 H new ATOM 0 HG1 THR A 20 -50.862 -0.085 -4.653 1.00 70.42 H new ATOM 0 HG21 THR A 20 -51.360 1.914 -3.441 1.00 72.02 H new ATOM 0 HG22 THR A 20 -50.691 3.434 -4.080 1.00 72.02 H new ATOM 0 HG23 THR A 20 -52.013 2.612 -4.942 1.00 72.02 H new ATOM 282 N LYS A 21 -51.484 1.498 -7.829 1.00 3.44 N ATOM 283 CA LYS A 21 -52.681 1.530 -8.662 1.00 22.44 C ATOM 284 C LYS A 21 -53.939 1.388 -7.811 1.00 14.33 C ATOM 285 O LYS A 21 -55.048 1.279 -8.337 1.00 74.45 O ATOM 286 CB LYS A 21 -52.630 0.413 -9.707 1.00 24.43 C ATOM 287 CG LYS A 21 -52.666 -0.983 -9.108 1.00 51.34 C ATOM 288 CD LYS A 21 -51.268 -1.551 -8.933 1.00 33.02 C ATOM 289 CE LYS A 21 -51.024 -1.999 -7.500 1.00 63.52 C ATOM 290 NZ LYS A 21 -49.581 -1.937 -7.137 1.00 64.01 N1+ ATOM 0 H LYS A 21 -51.089 0.567 -7.695 1.00 3.44 H new ATOM 0 HA LYS A 21 -52.714 2.493 -9.171 1.00 22.44 H new ATOM 0 HB2 LYS A 21 -53.471 0.528 -10.391 1.00 24.43 H new ATOM 0 HB3 LYS A 21 -51.721 0.522 -10.299 1.00 24.43 H new ATOM 0 HG2 LYS A 21 -53.171 -0.953 -8.142 1.00 51.34 H new ATOM 0 HG3 LYS A 21 -53.249 -1.641 -9.752 1.00 51.34 H new ATOM 0 HD2 LYS A 21 -51.130 -2.396 -9.608 1.00 33.02 H new ATOM 0 HD3 LYS A 21 -50.531 -0.798 -9.210 1.00 33.02 H new ATOM 0 HE2 LYS A 21 -51.597 -1.369 -6.820 1.00 63.52 H new ATOM 0 HE3 LYS A 21 -51.387 -3.019 -7.372 1.00 63.52 H new ATOM 0 HZ1 LYS A 21 -49.295 -2.834 -6.695 1.00 64.01 H new ATOM 0 HZ2 LYS A 21 -49.014 -1.777 -7.994 1.00 64.01 H new ATOM 0 HZ3 LYS A 21 -49.425 -1.156 -6.468 1.00 64.01 H new ATOM 304 N LEU A 22 -53.761 1.389 -6.494 1.00 11.11 N ATOM 305 CA LEU A 22 -54.883 1.261 -5.571 1.00 62.04 C ATOM 306 C LEU A 22 -55.272 2.620 -4.996 1.00 2.31 C ATOM 307 O LEU A 22 -56.202 2.724 -4.197 1.00 51.15 O ATOM 308 CB LEU A 22 -54.527 0.299 -4.436 1.00 32.22 C ATOM 309 CG LEU A 22 -55.565 -0.781 -4.122 1.00 53.13 C ATOM 310 CD1 LEU A 22 -56.929 -0.154 -3.878 1.00 24.41 C ATOM 311 CD2 LEU A 22 -55.636 -1.797 -5.253 1.00 34.53 C ATOM 0 H LEU A 22 -52.851 1.477 -6.042 1.00 11.11 H new ATOM 0 HA LEU A 22 -55.734 0.863 -6.124 1.00 62.04 H new ATOM 0 HB2 LEU A 22 -53.585 -0.191 -4.684 1.00 32.22 H new ATOM 0 HB3 LEU A 22 -54.354 0.883 -3.532 1.00 32.22 H new ATOM 0 HG LEU A 22 -55.259 -1.300 -3.214 1.00 53.13 H new ATOM 0 HD11 LEU A 22 -57.655 -0.936 -3.656 1.00 24.41 H new ATOM 0 HD12 LEU A 22 -56.868 0.534 -3.035 1.00 24.41 H new ATOM 0 HD13 LEU A 22 -57.244 0.391 -4.768 1.00 24.41 H new ATOM 0 HD21 LEU A 22 -56.379 -2.558 -5.013 1.00 34.53 H new ATOM 0 HD22 LEU A 22 -55.918 -1.293 -6.177 1.00 34.53 H new ATOM 0 HD23 LEU A 22 -54.662 -2.269 -5.380 1.00 34.53 H new ATOM 323 N GLY A 23 -54.556 3.659 -5.412 1.00 52.15 N ATOM 324 CA GLY A 23 -54.844 4.999 -4.930 1.00 43.34 C ATOM 325 C GLY A 23 -54.091 5.330 -3.657 1.00 14.33 C ATOM 326 O GLY A 23 -54.644 5.297 -2.558 1.00 42.31 O ATOM 0 H GLY A 23 -53.782 3.598 -6.074 1.00 52.15 H new ATOM 0 HA2 GLY A 23 -54.583 5.723 -5.702 1.00 43.34 H new ATOM 0 HA3 GLY A 23 -55.915 5.095 -4.751 1.00 43.34 H new ATOM 330 N PRO A 24 -52.798 5.658 -3.797 1.00 42.45 N ATOM 331 CA PRO A 24 -51.941 6.003 -2.659 1.00 55.11 C ATOM 332 C PRO A 24 -52.315 7.344 -2.036 1.00 31.25 C ATOM 333 O PRO A 24 -53.073 8.118 -2.619 1.00 23.44 O ATOM 334 CB PRO A 24 -50.542 6.071 -3.277 1.00 4.11 C ATOM 335 CG PRO A 24 -50.777 6.387 -4.714 1.00 61.03 C ATOM 336 CD PRO A 24 -52.074 5.719 -5.077 1.00 45.53 C ATOM 0 HA PRO A 24 -52.029 5.280 -1.848 1.00 55.11 H new ATOM 0 HB2 PRO A 24 -49.934 6.838 -2.797 1.00 4.11 H new ATOM 0 HB3 PRO A 24 -50.012 5.126 -3.161 1.00 4.11 H new ATOM 0 HG2 PRO A 24 -50.835 7.464 -4.873 1.00 61.03 H new ATOM 0 HG3 PRO A 24 -49.960 6.017 -5.334 1.00 61.03 H new ATOM 0 HD2 PRO A 24 -52.625 6.291 -5.823 1.00 45.53 H new ATOM 0 HD3 PRO A 24 -51.911 4.725 -5.494 1.00 45.53 H new ATOM 344 N GLU A 25 -51.777 7.612 -0.851 1.00 30.43 N ATOM 345 CA GLU A 25 -52.055 8.860 -0.151 1.00 61.13 C ATOM 346 C GLU A 25 -50.794 9.405 0.513 1.00 2.52 C ATOM 347 O GLU A 25 -50.529 10.605 0.475 1.00 75.32 O ATOM 348 CB GLU A 25 -53.147 8.648 0.900 1.00 32.13 C ATOM 349 CG GLU A 25 -52.939 7.409 1.753 1.00 54.54 C ATOM 350 CD GLU A 25 -54.078 7.171 2.726 1.00 55.02 C ATOM 351 OE1 GLU A 25 -54.098 7.830 3.787 1.00 54.21 O ATOM 352 OE2 GLU A 25 -54.949 6.329 2.426 1.00 12.11 O1- ATOM 0 H GLU A 25 -51.146 6.982 -0.356 1.00 30.43 H new ATOM 0 HA GLU A 25 -52.402 9.588 -0.884 1.00 61.13 H new ATOM 0 HB2 GLU A 25 -53.189 9.523 1.549 1.00 32.13 H new ATOM 0 HB3 GLU A 25 -54.112 8.576 0.399 1.00 32.13 H new ATOM 0 HG2 GLU A 25 -52.833 6.540 1.104 1.00 54.54 H new ATOM 0 HG3 GLU A 25 -52.006 7.508 2.309 1.00 54.54 H new ATOM 359 N GLU A 26 -50.020 8.512 1.122 1.00 43.40 N ATOM 360 CA GLU A 26 -48.787 8.902 1.796 1.00 42.11 C ATOM 361 C GLU A 26 -47.864 7.702 1.982 1.00 25.51 C ATOM 362 O GLU A 26 -48.313 6.555 1.989 1.00 40.12 O ATOM 363 CB GLU A 26 -49.101 9.533 3.155 1.00 74.23 C ATOM 364 CG GLU A 26 -49.606 8.538 4.185 1.00 70.14 C ATOM 365 CD GLU A 26 -50.556 9.166 5.187 1.00 31.34 C ATOM 366 OE1 GLU A 26 -50.156 10.145 5.851 1.00 24.24 O ATOM 367 OE2 GLU A 26 -51.700 8.680 5.304 1.00 61.41 O1- ATOM 0 H GLU A 26 -50.225 7.514 1.162 1.00 43.40 H new ATOM 0 HA GLU A 26 -48.278 9.635 1.171 1.00 42.11 H new ATOM 0 HB2 GLU A 26 -48.202 10.016 3.539 1.00 74.23 H new ATOM 0 HB3 GLU A 26 -49.849 10.314 3.019 1.00 74.23 H new ATOM 0 HG2 GLU A 26 -50.112 7.718 3.675 1.00 70.14 H new ATOM 0 HG3 GLU A 26 -48.757 8.108 4.716 1.00 70.14 H new ATOM 374 N ILE A 27 -46.572 7.974 2.130 1.00 34.23 N ATOM 375 CA ILE A 27 -45.586 6.917 2.316 1.00 51.54 C ATOM 376 C ILE A 27 -45.590 6.407 3.754 1.00 3.43 C ATOM 377 O ILE A 27 -45.735 7.182 4.698 1.00 75.14 O ATOM 378 CB ILE A 27 -44.167 7.400 1.959 1.00 31.11 C ATOM 379 CG1 ILE A 27 -43.235 6.206 1.752 1.00 64.55 C ATOM 380 CG2 ILE A 27 -43.631 8.316 3.049 1.00 22.12 C ATOM 381 CD1 ILE A 27 -41.819 6.600 1.390 1.00 33.44 C ATOM 0 H ILE A 27 -46.184 8.917 2.125 1.00 34.23 H new ATOM 0 HA ILE A 27 -45.865 6.105 1.644 1.00 51.54 H new ATOM 0 HB ILE A 27 -44.214 7.964 1.028 1.00 31.11 H new ATOM 0 HG12 ILE A 27 -43.216 5.608 2.663 1.00 64.55 H new ATOM 0 HG13 ILE A 27 -43.640 5.572 0.963 1.00 64.55 H new ATOM 0 HG21 ILE A 27 -42.628 8.649 2.783 1.00 22.12 H new ATOM 0 HG22 ILE A 27 -44.286 9.181 3.152 1.00 22.12 H new ATOM 0 HG23 ILE A 27 -43.595 7.774 3.994 1.00 22.12 H new ATOM 0 HD11 ILE A 27 -41.214 5.703 1.258 1.00 33.44 H new ATOM 0 HD12 ILE A 27 -41.826 7.172 0.462 1.00 33.44 H new ATOM 0 HD13 ILE A 27 -41.395 7.209 2.188 1.00 33.44 H new ATOM 393 N THR A 28 -45.427 5.097 3.912 1.00 23.51 N ATOM 394 CA THR A 28 -45.411 4.483 5.233 1.00 45.35 C ATOM 395 C THR A 28 -44.440 3.309 5.282 1.00 32.33 C ATOM 396 O THR A 28 -43.799 2.978 4.284 1.00 33.43 O ATOM 397 CB THR A 28 -46.813 3.993 5.642 1.00 53.03 C ATOM 398 OG1 THR A 28 -46.833 3.674 7.037 1.00 4.11 O ATOM 399 CG2 THR A 28 -47.216 2.771 4.831 1.00 21.31 C ATOM 0 H THR A 28 -45.304 4.441 3.141 1.00 23.51 H new ATOM 0 HA THR A 28 -45.084 5.251 5.934 1.00 45.35 H new ATOM 0 HB THR A 28 -47.526 4.793 5.443 1.00 53.03 H new ATOM 0 HG1 THR A 28 -47.728 3.365 7.289 1.00 4.11 H new ATOM 0 HG21 THR A 28 -48.209 2.443 5.137 1.00 21.31 H new ATOM 0 HG22 THR A 28 -47.228 3.026 3.771 1.00 21.31 H new ATOM 0 HG23 THR A 28 -46.499 1.968 5.003 1.00 21.31 H new ATOM 407 N ARG A 29 -44.338 2.681 6.450 1.00 14.42 N ATOM 408 CA ARG A 29 -43.444 1.542 6.628 1.00 74.04 C ATOM 409 C ARG A 29 -44.197 0.345 7.199 1.00 61.04 C ATOM 410 O ARG A 29 -44.841 0.445 8.244 1.00 23.41 O ATOM 411 CB ARG A 29 -42.284 1.919 7.552 1.00 13.44 C ATOM 412 CG ARG A 29 -42.702 2.773 8.737 1.00 21.03 C ATOM 413 CD ARG A 29 -42.635 4.255 8.406 1.00 15.43 C ATOM 414 NE ARG A 29 -43.606 5.031 9.174 1.00 11.32 N ATOM 415 CZ ARG A 29 -43.477 5.296 10.468 1.00 74.13 C ATOM 416 NH1 ARG A 29 -42.424 4.849 11.138 1.00 53.55 N1+ ATOM 417 NH2 ARG A 29 -44.404 6.009 11.097 1.00 74.03 N ATOM 0 H ARG A 29 -44.862 2.941 7.285 1.00 14.42 H new ATOM 0 HA ARG A 29 -43.047 1.266 5.651 1.00 74.04 H new ATOM 0 HB2 ARG A 29 -41.813 1.008 7.920 1.00 13.44 H new ATOM 0 HB3 ARG A 29 -41.531 2.456 6.975 1.00 13.44 H new ATOM 0 HG2 ARG A 29 -43.717 2.511 9.036 1.00 21.03 H new ATOM 0 HG3 ARG A 29 -42.055 2.559 9.587 1.00 21.03 H new ATOM 0 HD2 ARG A 29 -41.631 4.627 8.610 1.00 15.43 H new ATOM 0 HD3 ARG A 29 -42.818 4.397 7.341 1.00 15.43 H new ATOM 0 HE ARG A 29 -44.429 5.389 8.689 1.00 11.32 H new ATOM 0 HH11 ARG A 29 -41.710 4.300 10.659 1.00 53.55 H new ATOM 0 HH12 ARG A 29 -42.328 5.054 12.132 1.00 53.55 H new ATOM 0 HH21 ARG A 29 -45.216 6.354 10.586 1.00 74.03 H new ATOM 0 HH22 ARG A 29 -44.304 6.212 12.092 1.00 74.03 H new ATOM 431 N ASP A 30 -44.110 -0.785 6.508 1.00 64.35 N ATOM 432 CA ASP A 30 -44.783 -2.004 6.947 1.00 0.23 C ATOM 433 C ASP A 30 -43.989 -3.240 6.539 1.00 34.02 C ATOM 434 O ASP A 30 -44.228 -3.823 5.482 1.00 14.01 O ATOM 435 CB ASP A 30 -46.194 -2.072 6.360 1.00 31.35 C ATOM 436 CG ASP A 30 -46.876 -3.395 6.647 1.00 31.41 C ATOM 437 OD1 ASP A 30 -47.459 -3.536 7.743 1.00 64.23 O ATOM 438 OD2 ASP A 30 -46.827 -4.289 5.777 1.00 50.33 O1- ATOM 0 H ASP A 30 -43.581 -0.884 5.642 1.00 64.35 H new ATOM 0 HA ASP A 30 -44.851 -1.981 8.035 1.00 0.23 H new ATOM 0 HB2 ASP A 30 -46.795 -1.260 6.770 1.00 31.35 H new ATOM 0 HB3 ASP A 30 -46.144 -1.918 5.282 1.00 31.35 H new ATOM 443 N ILE A 31 -43.041 -3.633 7.384 1.00 63.23 N ATOM 444 CA ILE A 31 -42.211 -4.800 7.112 1.00 25.31 C ATOM 445 C ILE A 31 -42.532 -5.940 8.072 1.00 64.24 C ATOM 446 O ILE A 31 -41.845 -6.155 9.071 1.00 20.01 O ATOM 447 CB ILE A 31 -40.712 -4.462 7.217 1.00 73.13 C ATOM 448 CG1 ILE A 31 -40.433 -3.088 6.605 1.00 24.14 C ATOM 449 CG2 ILE A 31 -39.878 -5.533 6.531 1.00 43.12 C ATOM 450 CD1 ILE A 31 -40.875 -2.967 5.163 1.00 71.21 C ATOM 0 H ILE A 31 -42.829 -3.160 8.263 1.00 63.23 H new ATOM 0 HA ILE A 31 -42.434 -5.114 6.092 1.00 25.31 H new ATOM 0 HB ILE A 31 -40.434 -4.433 8.271 1.00 73.13 H new ATOM 0 HG12 ILE A 31 -40.940 -2.326 7.197 1.00 24.14 H new ATOM 0 HG13 ILE A 31 -39.365 -2.882 6.667 1.00 24.14 H new ATOM 0 HG21 ILE A 31 -38.821 -5.280 6.614 1.00 43.12 H new ATOM 0 HG22 ILE A 31 -40.059 -6.496 7.008 1.00 43.12 H new ATOM 0 HG23 ILE A 31 -40.156 -5.592 5.479 1.00 43.12 H new ATOM 0 HD11 ILE A 31 -40.646 -1.967 4.795 1.00 71.21 H new ATOM 0 HD12 ILE A 31 -40.349 -3.706 4.558 1.00 71.21 H new ATOM 0 HD13 ILE A 31 -41.949 -3.141 5.096 1.00 71.21 H new ATOM 462 N PRO A 32 -43.602 -6.688 7.766 1.00 34.15 N ATOM 463 CA PRO A 32 -44.037 -7.821 8.588 1.00 63.53 C ATOM 464 C PRO A 32 -43.070 -8.997 8.515 1.00 74.13 C ATOM 465 O PRO A 32 -42.385 -9.187 7.511 1.00 52.54 O ATOM 466 CB PRO A 32 -45.390 -8.201 7.980 1.00 61.33 C ATOM 467 CG PRO A 32 -45.317 -7.729 6.569 1.00 72.25 C ATOM 468 CD PRO A 32 -44.467 -6.488 6.592 1.00 11.40 C ATOM 0 HA PRO A 32 -44.087 -7.562 9.645 1.00 63.53 H new ATOM 0 HB2 PRO A 32 -45.558 -9.277 8.029 1.00 61.33 H new ATOM 0 HB3 PRO A 32 -46.212 -7.725 8.515 1.00 61.33 H new ATOM 0 HG2 PRO A 32 -44.878 -8.491 5.925 1.00 72.25 H new ATOM 0 HG3 PRO A 32 -46.311 -7.514 6.177 1.00 72.25 H new ATOM 0 HD2 PRO A 32 -43.884 -6.383 5.677 1.00 11.40 H new ATOM 0 HD3 PRO A 32 -45.073 -5.587 6.689 1.00 11.40 H new ATOM 476 N ASN A 33 -43.021 -9.784 9.584 1.00 71.22 N ATOM 477 CA ASN A 33 -42.137 -10.944 9.640 1.00 2.45 C ATOM 478 C ASN A 33 -40.675 -10.515 9.568 1.00 2.05 C ATOM 479 O ASN A 33 -39.820 -11.264 9.094 1.00 32.14 O ATOM 480 CB ASN A 33 -42.454 -11.909 8.497 1.00 52.30 C ATOM 481 CG ASN A 33 -43.946 -12.094 8.295 1.00 14.10 C ATOM 482 OD1 ASN A 33 -44.672 -12.442 9.227 1.00 31.13 O ATOM 483 ND2 ASN A 33 -44.410 -11.864 7.073 1.00 31.33 N ATOM 0 H ASN A 33 -43.582 -9.641 10.423 1.00 71.22 H new ATOM 0 HA ASN A 33 -42.303 -11.452 10.590 1.00 2.45 H new ATOM 0 HB2 ASN A 33 -42.009 -11.535 7.575 1.00 52.30 H new ATOM 0 HB3 ASN A 33 -41.995 -12.876 8.703 1.00 52.30 H new ATOM 0 HD21 ASN A 33 -45.405 -11.974 6.876 1.00 31.33 H new ATOM 0 HD22 ASN A 33 -43.772 -11.577 6.331 1.00 31.33 H new ATOM 490 N VAL A 34 -40.393 -9.306 10.043 1.00 34.42 N ATOM 491 CA VAL A 34 -39.034 -8.778 10.034 1.00 3.55 C ATOM 492 C VAL A 34 -38.345 -9.012 11.374 1.00 63.25 C ATOM 493 O VAL A 34 -39.000 -9.126 12.409 1.00 72.34 O ATOM 494 CB VAL A 34 -39.019 -7.271 9.717 1.00 61.54 C ATOM 495 CG1 VAL A 34 -39.605 -6.476 10.875 1.00 74.44 C ATOM 496 CG2 VAL A 34 -37.605 -6.807 9.403 1.00 63.24 C ATOM 0 H VAL A 34 -41.088 -8.673 10.439 1.00 34.42 H new ATOM 0 HA VAL A 34 -38.492 -9.311 9.252 1.00 3.55 H new ATOM 0 HB VAL A 34 -39.638 -7.096 8.837 1.00 61.54 H new ATOM 0 HG11 VAL A 34 -39.586 -5.413 10.633 1.00 74.44 H new ATOM 0 HG12 VAL A 34 -40.634 -6.791 11.048 1.00 74.44 H new ATOM 0 HG13 VAL A 34 -39.015 -6.654 11.774 1.00 74.44 H new ATOM 0 HG21 VAL A 34 -37.613 -5.740 9.181 1.00 63.24 H new ATOM 0 HG22 VAL A 34 -36.961 -6.994 10.262 1.00 63.24 H new ATOM 0 HG23 VAL A 34 -37.226 -7.354 8.540 1.00 63.24 H new ATOM 506 N GLY A 35 -37.017 -9.081 11.346 1.00 71.54 N ATOM 507 CA GLY A 35 -36.261 -9.300 12.565 1.00 61.21 C ATOM 508 C GLY A 35 -36.053 -8.024 13.357 1.00 63.23 C ATOM 509 O GLY A 35 -36.145 -6.926 12.809 1.00 50.52 O ATOM 0 H GLY A 35 -36.452 -8.989 10.502 1.00 71.54 H new ATOM 0 HA2 GLY A 35 -36.783 -10.028 13.186 1.00 61.21 H new ATOM 0 HA3 GLY A 35 -35.291 -9.731 12.315 1.00 61.21 H new ATOM 513 N GLU A 36 -35.774 -8.168 14.648 1.00 25.34 N ATOM 514 CA GLU A 36 -35.556 -7.017 15.515 1.00 23.30 C ATOM 515 C GLU A 36 -34.218 -6.352 15.210 1.00 75.14 C ATOM 516 O GLU A 36 -34.041 -5.155 15.437 1.00 34.31 O ATOM 517 CB GLU A 36 -35.603 -7.441 16.985 1.00 11.14 C ATOM 518 CG GLU A 36 -36.991 -7.360 17.597 1.00 41.24 C ATOM 519 CD GLU A 36 -37.359 -5.951 18.024 1.00 1.32 C ATOM 520 OE1 GLU A 36 -36.581 -5.341 18.785 1.00 11.12 O ATOM 521 OE2 GLU A 36 -38.425 -5.462 17.595 1.00 24.50 O1- ATOM 0 H GLU A 36 -35.694 -9.070 15.117 1.00 25.34 H new ATOM 0 HA GLU A 36 -36.352 -6.297 15.326 1.00 23.30 H new ATOM 0 HB2 GLU A 36 -35.236 -8.464 17.071 1.00 11.14 H new ATOM 0 HB3 GLU A 36 -34.925 -6.809 17.559 1.00 11.14 H new ATOM 0 HG2 GLU A 36 -37.724 -7.720 16.875 1.00 41.24 H new ATOM 0 HG3 GLU A 36 -37.042 -8.023 18.461 1.00 41.24 H new ATOM 528 N ASP A 37 -33.278 -7.135 14.693 1.00 22.02 N ATOM 529 CA ASP A 37 -31.955 -6.623 14.355 1.00 32.15 C ATOM 530 C ASP A 37 -32.025 -5.689 13.151 1.00 14.55 C ATOM 531 O ASP A 37 -31.324 -4.679 13.095 1.00 61.42 O ATOM 532 CB ASP A 37 -30.996 -7.779 14.064 1.00 75.52 C ATOM 533 CG ASP A 37 -31.545 -8.739 13.027 1.00 61.23 C ATOM 534 OD1 ASP A 37 -32.525 -9.448 13.337 1.00 2.44 O ATOM 535 OD2 ASP A 37 -30.994 -8.782 11.908 1.00 44.23 O1- ATOM 0 H ASP A 37 -33.408 -8.128 14.499 1.00 22.02 H new ATOM 0 HA ASP A 37 -31.582 -6.058 15.209 1.00 32.15 H new ATOM 0 HB2 ASP A 37 -30.044 -7.379 13.716 1.00 75.52 H new ATOM 0 HB3 ASP A 37 -30.795 -8.322 14.988 1.00 75.52 H new ATOM 540 N ALA A 38 -32.876 -6.033 12.190 1.00 41.12 N ATOM 541 CA ALA A 38 -33.039 -5.225 10.988 1.00 33.22 C ATOM 542 C ALA A 38 -33.690 -3.884 11.312 1.00 61.11 C ATOM 543 O ALA A 38 -33.567 -2.923 10.551 1.00 73.30 O ATOM 544 CB ALA A 38 -33.862 -5.978 9.954 1.00 54.45 C ATOM 0 H ALA A 38 -33.463 -6.866 12.221 1.00 41.12 H new ATOM 0 HA ALA A 38 -32.050 -5.028 10.575 1.00 33.22 H new ATOM 0 HB1 ALA A 38 -33.976 -5.363 9.061 1.00 54.45 H new ATOM 0 HB2 ALA A 38 -33.356 -6.907 9.692 1.00 54.45 H new ATOM 0 HB3 ALA A 38 -34.845 -6.205 10.366 1.00 54.45 H new ATOM 550 N LEU A 39 -34.382 -3.826 12.444 1.00 44.35 N ATOM 551 CA LEU A 39 -35.054 -2.603 12.868 1.00 51.12 C ATOM 552 C LEU A 39 -34.439 -2.062 14.156 1.00 25.44 C ATOM 553 O LEU A 39 -35.023 -1.209 14.824 1.00 75.32 O ATOM 554 CB LEU A 39 -36.547 -2.862 13.074 1.00 75.42 C ATOM 555 CG LEU A 39 -36.906 -3.977 14.055 1.00 63.45 C ATOM 556 CD1 LEU A 39 -36.913 -3.451 15.482 1.00 3.12 C ATOM 557 CD2 LEU A 39 -38.256 -4.584 13.702 1.00 33.13 C ATOM 0 H LEU A 39 -34.493 -4.612 13.085 1.00 44.35 H new ATOM 0 HA LEU A 39 -34.926 -1.857 12.083 1.00 51.12 H new ATOM 0 HB2 LEU A 39 -37.011 -1.938 13.420 1.00 75.42 H new ATOM 0 HB3 LEU A 39 -36.991 -3.099 12.107 1.00 75.42 H new ATOM 0 HG LEU A 39 -36.149 -4.757 13.981 1.00 63.45 H new ATOM 0 HD11 LEU A 39 -37.171 -4.259 16.166 1.00 3.12 H new ATOM 0 HD12 LEU A 39 -35.925 -3.065 15.732 1.00 3.12 H new ATOM 0 HD13 LEU A 39 -37.648 -2.651 15.571 1.00 3.12 H new ATOM 0 HD21 LEU A 39 -38.495 -5.376 14.411 1.00 33.13 H new ATOM 0 HD22 LEU A 39 -39.025 -3.813 13.747 1.00 33.13 H new ATOM 0 HD23 LEU A 39 -38.216 -4.999 12.695 1.00 33.13 H new ATOM 569 N ARG A 40 -33.255 -2.562 14.495 1.00 20.52 N ATOM 570 CA ARG A 40 -32.560 -2.128 15.701 1.00 43.52 C ATOM 571 C ARG A 40 -31.975 -0.730 15.519 1.00 33.33 C ATOM 572 O ARG A 40 -31.777 0.000 16.488 1.00 61.33 O ATOM 573 CB ARG A 40 -31.446 -3.116 16.056 1.00 31.43 C ATOM 574 CG ARG A 40 -30.205 -2.973 15.191 1.00 41.24 C ATOM 575 CD ARG A 40 -29.328 -4.212 15.267 1.00 43.45 C ATOM 576 NE ARG A 40 -28.972 -4.548 16.642 1.00 63.04 N ATOM 577 CZ ARG A 40 -28.548 -5.749 17.019 1.00 32.22 C ATOM 578 NH1 ARG A 40 -28.424 -6.722 16.127 1.00 22.50 N1+ ATOM 579 NH2 ARG A 40 -28.245 -5.978 18.291 1.00 20.05 N ATOM 0 H ARG A 40 -32.757 -3.267 13.952 1.00 20.52 H new ATOM 0 HA ARG A 40 -33.283 -2.097 16.516 1.00 43.52 H new ATOM 0 HB2 ARG A 40 -31.168 -2.977 17.101 1.00 31.43 H new ATOM 0 HB3 ARG A 40 -31.829 -4.132 15.961 1.00 31.43 H new ATOM 0 HG2 ARG A 40 -30.500 -2.797 14.156 1.00 41.24 H new ATOM 0 HG3 ARG A 40 -29.634 -2.102 15.512 1.00 41.24 H new ATOM 0 HD2 ARG A 40 -29.850 -5.054 14.812 1.00 43.45 H new ATOM 0 HD3 ARG A 40 -28.420 -4.049 14.687 1.00 43.45 H new ATOM 0 HE ARG A 40 -29.053 -3.821 17.352 1.00 63.04 H new ATOM 0 HH11 ARG A 40 -28.654 -6.549 15.148 1.00 22.50 H new ATOM 0 HH12 ARG A 40 -28.098 -7.643 16.419 1.00 22.50 H new ATOM 0 HH21 ARG A 40 -28.338 -5.231 18.980 1.00 20.05 H new ATOM 0 HH22 ARG A 40 -27.920 -6.901 18.580 1.00 20.05 H new ATOM 593 N ASN A 41 -31.701 -0.368 14.270 1.00 55.32 N ATOM 594 CA ASN A 41 -31.139 0.942 13.961 1.00 71.13 C ATOM 595 C ASN A 41 -32.211 1.879 13.413 1.00 35.30 C ATOM 596 O ASN A 41 -32.120 3.098 13.563 1.00 31.23 O ATOM 597 CB ASN A 41 -29.999 0.805 12.949 1.00 34.41 C ATOM 598 CG ASN A 41 -29.200 -0.469 13.147 1.00 10.32 C ATOM 599 OD1 ASN A 41 -29.479 -1.493 12.524 1.00 32.53 O ATOM 600 ND2 ASN A 41 -28.200 -0.410 14.019 1.00 61.32 N ATOM 0 H ASN A 41 -31.859 -0.962 13.456 1.00 55.32 H new ATOM 0 HA ASN A 41 -30.747 1.369 14.884 1.00 71.13 H new ATOM 0 HB2 ASN A 41 -30.409 0.820 11.939 1.00 34.41 H new ATOM 0 HB3 ASN A 41 -29.334 1.665 13.036 1.00 34.41 H new ATOM 0 HD21 ASN A 41 -27.627 -1.235 14.195 1.00 61.32 H new ATOM 0 HD22 ASN A 41 -28.005 0.461 14.513 1.00 61.32 H new ATOM 607 N LEU A 42 -33.224 1.302 12.779 1.00 5.31 N ATOM 608 CA LEU A 42 -34.315 2.086 12.209 1.00 1.45 C ATOM 609 C LEU A 42 -34.899 3.041 13.244 1.00 41.30 C ATOM 610 O LEU A 42 -35.043 2.691 14.416 1.00 64.12 O ATOM 611 CB LEU A 42 -35.411 1.160 11.678 1.00 35.41 C ATOM 612 CG LEU A 42 -36.236 1.697 10.508 1.00 32.44 C ATOM 613 CD1 LEU A 42 -35.602 1.306 9.183 1.00 21.05 C ATOM 614 CD2 LEU A 42 -37.668 1.188 10.587 1.00 43.22 C ATOM 0 H LEU A 42 -33.314 0.295 12.646 1.00 5.31 H new ATOM 0 HA LEU A 42 -33.913 2.675 11.384 1.00 1.45 H new ATOM 0 HB2 LEU A 42 -34.949 0.222 11.370 1.00 35.41 H new ATOM 0 HB3 LEU A 42 -36.090 0.926 12.498 1.00 35.41 H new ATOM 0 HG LEU A 42 -36.254 2.785 10.571 1.00 32.44 H new ATOM 0 HD11 LEU A 42 -36.203 1.697 8.362 1.00 21.05 H new ATOM 0 HD12 LEU A 42 -34.596 1.720 9.125 1.00 21.05 H new ATOM 0 HD13 LEU A 42 -35.552 0.220 9.110 1.00 21.05 H new ATOM 0 HD21 LEU A 42 -38.240 1.580 9.746 1.00 43.22 H new ATOM 0 HD22 LEU A 42 -37.669 0.099 10.550 1.00 43.22 H new ATOM 0 HD23 LEU A 42 -38.121 1.520 11.521 1.00 43.22 H new ATOM 626 N ASP A 43 -35.235 4.248 12.804 1.00 10.14 N ATOM 627 CA ASP A 43 -35.807 5.254 13.692 1.00 31.33 C ATOM 628 C ASP A 43 -37.295 5.441 13.415 1.00 31.33 C ATOM 629 O ASP A 43 -37.900 4.670 12.670 1.00 2.34 O ATOM 630 CB ASP A 43 -35.074 6.587 13.527 1.00 44.20 C ATOM 631 CG ASP A 43 -34.873 7.305 14.847 1.00 54.04 C ATOM 632 OD1 ASP A 43 -34.283 6.700 15.767 1.00 1.31 O ATOM 633 OD2 ASP A 43 -35.305 8.470 14.960 1.00 30.34 O1- ATOM 0 H ASP A 43 -35.121 4.554 11.838 1.00 10.14 H new ATOM 0 HA ASP A 43 -35.688 4.907 14.718 1.00 31.33 H new ATOM 0 HB2 ASP A 43 -34.104 6.410 13.062 1.00 44.20 H new ATOM 0 HB3 ASP A 43 -35.640 7.228 12.851 1.00 44.20 H new ATOM 638 N ASP A 44 -37.880 6.468 14.022 1.00 73.33 N ATOM 639 CA ASP A 44 -39.298 6.755 13.840 1.00 11.43 C ATOM 640 C ASP A 44 -39.580 7.226 12.417 1.00 44.41 C ATOM 641 O ASP A 44 -40.729 7.238 11.973 1.00 0.12 O ATOM 642 CB ASP A 44 -39.757 7.818 14.841 1.00 63.23 C ATOM 643 CG ASP A 44 -39.973 7.249 16.230 1.00 31.34 C ATOM 644 OD1 ASP A 44 -39.788 6.027 16.407 1.00 40.13 O ATOM 645 OD2 ASP A 44 -40.326 8.027 17.141 1.00 13.32 O1- ATOM 0 H ASP A 44 -37.395 7.115 14.644 1.00 73.33 H new ATOM 0 HA ASP A 44 -39.855 5.835 14.016 1.00 11.43 H new ATOM 0 HB2 ASP A 44 -39.013 8.613 14.889 1.00 63.23 H new ATOM 0 HB3 ASP A 44 -40.684 8.269 14.488 1.00 63.23 H new ATOM 650 N ARG A 45 -38.525 7.611 11.706 1.00 71.11 N ATOM 651 CA ARG A 45 -38.660 8.083 10.334 1.00 52.13 C ATOM 652 C ARG A 45 -38.866 6.915 9.374 1.00 35.45 C ATOM 653 O ARG A 45 -39.386 7.087 8.274 1.00 3.22 O ATOM 654 CB ARG A 45 -37.421 8.881 9.924 1.00 65.04 C ATOM 655 CG ARG A 45 -37.350 10.263 10.554 1.00 43.34 C ATOM 656 CD ARG A 45 -36.310 11.135 9.867 1.00 43.42 C ATOM 657 NE ARG A 45 -34.948 10.729 10.201 1.00 64.23 N ATOM 658 CZ ARG A 45 -33.886 11.047 9.470 1.00 23.12 C ATOM 659 NH1 ARG A 45 -34.029 11.772 8.369 1.00 63.01 N1+ ATOM 660 NH2 ARG A 45 -32.678 10.640 9.839 1.00 3.01 N ATOM 0 H ARG A 45 -37.568 7.605 12.058 1.00 71.11 H new ATOM 0 HA ARG A 45 -39.535 8.730 10.283 1.00 52.13 H new ATOM 0 HB2 ARG A 45 -36.529 8.319 10.201 1.00 65.04 H new ATOM 0 HB3 ARG A 45 -37.409 8.985 8.839 1.00 65.04 H new ATOM 0 HG2 ARG A 45 -38.327 10.743 10.493 1.00 43.34 H new ATOM 0 HG3 ARG A 45 -37.107 10.170 11.612 1.00 43.34 H new ATOM 0 HD2 ARG A 45 -36.449 11.083 8.787 1.00 43.42 H new ATOM 0 HD3 ARG A 45 -36.460 12.175 10.158 1.00 43.42 H new ATOM 0 HE ARG A 45 -34.804 10.170 11.042 1.00 64.23 H new ATOM 0 HH11 ARG A 45 -34.956 12.086 8.082 1.00 63.01 H new ATOM 0 HH12 ARG A 45 -33.212 12.015 7.809 1.00 63.01 H new ATOM 0 HH21 ARG A 45 -32.564 10.082 10.685 1.00 3.01 H new ATOM 0 HH22 ARG A 45 -31.863 10.885 9.276 1.00 3.01 H new ATOM 674 N GLY A 46 -38.453 5.725 9.801 1.00 63.25 N ATOM 675 CA GLY A 46 -38.601 4.546 8.968 1.00 13.20 C ATOM 676 C GLY A 46 -37.357 4.252 8.153 1.00 41.41 C ATOM 677 O GLY A 46 -37.413 3.522 7.164 1.00 11.40 O ATOM 0 H GLY A 46 -38.019 5.557 10.709 1.00 63.25 H new ATOM 0 HA2 GLY A 46 -38.831 3.686 9.598 1.00 13.20 H new ATOM 0 HA3 GLY A 46 -39.448 4.684 8.296 1.00 13.20 H new ATOM 681 N VAL A 47 -36.232 4.825 8.567 1.00 30.53 N ATOM 682 CA VAL A 47 -34.969 4.622 7.868 1.00 42.32 C ATOM 683 C VAL A 47 -33.836 4.343 8.849 1.00 35.22 C ATOM 684 O VAL A 47 -33.800 4.901 9.947 1.00 74.45 O ATOM 685 CB VAL A 47 -34.599 5.846 7.009 1.00 33.24 C ATOM 686 CG1 VAL A 47 -34.425 7.078 7.882 1.00 62.32 C ATOM 687 CG2 VAL A 47 -33.338 5.570 6.203 1.00 11.24 C ATOM 0 H VAL A 47 -36.169 5.434 9.383 1.00 30.53 H new ATOM 0 HA VAL A 47 -35.104 3.758 7.217 1.00 42.32 H new ATOM 0 HB VAL A 47 -35.414 6.038 6.311 1.00 33.24 H new ATOM 0 HG11 VAL A 47 -34.164 7.932 7.258 1.00 62.32 H new ATOM 0 HG12 VAL A 47 -35.356 7.285 8.409 1.00 62.32 H new ATOM 0 HG13 VAL A 47 -33.630 6.901 8.606 1.00 62.32 H new ATOM 0 HG21 VAL A 47 -33.091 6.445 5.602 1.00 11.24 H new ATOM 0 HG22 VAL A 47 -32.513 5.351 6.881 1.00 11.24 H new ATOM 0 HG23 VAL A 47 -33.505 4.715 5.548 1.00 11.24 H new ATOM 697 N ILE A 48 -32.911 3.478 8.447 1.00 4.11 N ATOM 698 CA ILE A 48 -31.776 3.126 9.290 1.00 23.31 C ATOM 699 C ILE A 48 -30.832 4.311 9.463 1.00 42.35 C ATOM 700 O ILE A 48 -30.458 4.966 8.490 1.00 21.41 O ATOM 701 CB ILE A 48 -30.989 1.937 8.709 1.00 74.51 C ATOM 702 CG1 ILE A 48 -31.891 0.707 8.595 1.00 2.21 C ATOM 703 CG2 ILE A 48 -29.775 1.631 9.574 1.00 61.43 C ATOM 704 CD1 ILE A 48 -32.345 0.163 9.931 1.00 11.41 C ATOM 0 H ILE A 48 -32.926 3.008 7.542 1.00 4.11 H new ATOM 0 HA ILE A 48 -32.181 2.842 10.261 1.00 23.31 H new ATOM 0 HB ILE A 48 -30.642 2.204 7.711 1.00 74.51 H new ATOM 0 HG12 ILE A 48 -32.767 0.963 8.000 1.00 2.21 H new ATOM 0 HG13 ILE A 48 -31.357 -0.076 8.056 1.00 2.21 H new ATOM 0 HG21 ILE A 48 -29.229 0.788 9.150 1.00 61.43 H new ATOM 0 HG22 ILE A 48 -29.124 2.504 9.609 1.00 61.43 H new ATOM 0 HG23 ILE A 48 -30.101 1.381 10.584 1.00 61.43 H new ATOM 0 HD11 ILE A 48 -32.981 -0.708 9.772 1.00 11.41 H new ATOM 0 HD12 ILE A 48 -31.475 -0.125 10.521 1.00 11.41 H new ATOM 0 HD13 ILE A 48 -32.907 0.930 10.464 1.00 11.41 H new ATOM 716 N ARG A 49 -30.448 4.579 10.707 1.00 61.21 N ATOM 717 CA ARG A 49 -29.546 5.684 11.007 1.00 55.21 C ATOM 718 C ARG A 49 -28.163 5.433 10.415 1.00 4.43 C ATOM 719 O ARG A 49 -27.785 4.291 10.155 1.00 74.42 O ATOM 720 CB ARG A 49 -29.436 5.884 12.520 1.00 75.12 C ATOM 721 CG ARG A 49 -28.712 7.161 12.914 1.00 63.14 C ATOM 722 CD ARG A 49 -29.109 7.619 14.309 1.00 21.00 C ATOM 723 NE ARG A 49 -30.227 8.560 14.277 1.00 40.53 N ATOM 724 CZ ARG A 49 -30.107 9.831 13.910 1.00 35.01 C ATOM 725 NH1 ARG A 49 -28.926 10.311 13.545 1.00 2.42 N1+ ATOM 726 NH2 ARG A 49 -31.170 10.626 13.907 1.00 44.41 N ATOM 0 H ARG A 49 -30.748 4.046 11.523 1.00 61.21 H new ATOM 0 HA ARG A 49 -29.957 6.588 10.556 1.00 55.21 H new ATOM 0 HB2 ARG A 49 -30.437 5.897 12.950 1.00 75.12 H new ATOM 0 HB3 ARG A 49 -28.913 5.031 12.954 1.00 75.12 H new ATOM 0 HG2 ARG A 49 -27.635 6.996 12.877 1.00 63.14 H new ATOM 0 HG3 ARG A 49 -28.939 7.947 12.193 1.00 63.14 H new ATOM 0 HD2 ARG A 49 -29.381 6.753 14.912 1.00 21.00 H new ATOM 0 HD3 ARG A 49 -28.253 8.089 14.794 1.00 21.00 H new ATOM 0 HE ARG A 49 -31.150 8.222 14.551 1.00 40.53 H new ATOM 0 HH11 ARG A 49 -28.106 9.704 13.545 1.00 2.42 H new ATOM 0 HH12 ARG A 49 -28.837 11.287 13.264 1.00 2.42 H new ATOM 0 HH21 ARG A 49 -32.081 10.261 14.187 1.00 44.41 H new ATOM 0 HH22 ARG A 49 -31.076 11.602 13.625 1.00 44.41 H new ATOM 740 N ILE A 50 -27.412 6.509 10.202 1.00 42.34 N ATOM 741 CA ILE A 50 -26.070 6.405 9.641 1.00 64.41 C ATOM 742 C ILE A 50 -25.124 5.702 10.607 1.00 25.51 C ATOM 743 O ILE A 50 -25.267 5.811 11.825 1.00 50.31 O ATOM 744 CB ILE A 50 -25.496 7.792 9.295 1.00 4.21 C ATOM 745 CG1 ILE A 50 -26.483 8.575 8.426 1.00 31.11 C ATOM 746 CG2 ILE A 50 -24.157 7.649 8.588 1.00 54.25 C ATOM 747 CD1 ILE A 50 -26.089 10.019 8.217 1.00 54.33 C ATOM 0 H ILE A 50 -27.710 7.462 10.409 1.00 42.34 H new ATOM 0 HA ILE A 50 -26.154 5.817 8.727 1.00 64.41 H new ATOM 0 HB ILE A 50 -25.339 8.345 10.221 1.00 4.21 H new ATOM 0 HG12 ILE A 50 -26.568 8.086 7.456 1.00 31.11 H new ATOM 0 HG13 ILE A 50 -27.469 8.539 8.888 1.00 31.11 H new ATOM 0 HG21 ILE A 50 -23.764 8.637 8.350 1.00 54.25 H new ATOM 0 HG22 ILE A 50 -23.456 7.127 9.239 1.00 54.25 H new ATOM 0 HG23 ILE A 50 -24.290 7.080 7.668 1.00 54.25 H new ATOM 0 HD11 ILE A 50 -26.833 10.513 7.592 1.00 54.33 H new ATOM 0 HD12 ILE A 50 -26.032 10.524 9.181 1.00 54.33 H new ATOM 0 HD13 ILE A 50 -25.117 10.063 7.726 1.00 54.33 H new ATOM 759 N GLY A 51 -24.153 4.979 10.055 1.00 2.14 N ATOM 760 CA GLY A 51 -23.195 4.269 10.882 1.00 43.44 C ATOM 761 C GLY A 51 -23.643 2.858 11.208 1.00 53.24 C ATOM 762 O GLY A 51 -23.075 2.206 12.083 1.00 63.33 O ATOM 0 H GLY A 51 -24.013 4.873 9.050 1.00 2.14 H new ATOM 0 HA2 GLY A 51 -22.234 4.232 10.369 1.00 43.44 H new ATOM 0 HA3 GLY A 51 -23.041 4.821 11.809 1.00 43.44 H new ATOM 766 N ALA A 52 -24.666 2.387 10.504 1.00 53.13 N ATOM 767 CA ALA A 52 -25.191 1.044 10.722 1.00 25.41 C ATOM 768 C ALA A 52 -24.746 0.094 9.616 1.00 3.24 C ATOM 769 O ALA A 52 -24.872 0.404 8.432 1.00 33.21 O ATOM 770 CB ALA A 52 -26.709 1.079 10.813 1.00 4.44 C ATOM 0 H ALA A 52 -25.149 2.915 9.777 1.00 53.13 H new ATOM 0 HA ALA A 52 -24.791 0.673 11.665 1.00 25.41 H new ATOM 0 HB1 ALA A 52 -27.087 0.070 10.976 1.00 4.44 H new ATOM 0 HB2 ALA A 52 -27.009 1.717 11.644 1.00 4.44 H new ATOM 0 HB3 ALA A 52 -27.120 1.475 9.884 1.00 4.44 H new ATOM 776 N GLU A 53 -24.225 -1.064 10.011 1.00 24.44 N ATOM 777 CA GLU A 53 -23.760 -2.057 9.051 1.00 12.23 C ATOM 778 C GLU A 53 -24.928 -2.643 8.264 1.00 61.23 C ATOM 779 O GLU A 53 -25.969 -2.975 8.832 1.00 62.55 O ATOM 780 CB GLU A 53 -23.002 -3.176 9.769 1.00 5.05 C ATOM 781 CG GLU A 53 -21.726 -2.710 10.448 1.00 63.31 C ATOM 782 CD GLU A 53 -20.932 -3.853 11.048 1.00 65.35 C ATOM 783 OE1 GLU A 53 -21.554 -4.834 11.506 1.00 22.21 O ATOM 784 OE2 GLU A 53 -19.685 -3.767 11.058 1.00 42.20 O1- ATOM 0 H GLU A 53 -24.115 -1.337 10.988 1.00 24.44 H new ATOM 0 HA GLU A 53 -23.087 -1.561 8.352 1.00 12.23 H new ATOM 0 HB2 GLU A 53 -23.657 -3.626 10.515 1.00 5.05 H new ATOM 0 HB3 GLU A 53 -22.756 -3.956 9.049 1.00 5.05 H new ATOM 0 HG2 GLU A 53 -21.105 -2.183 9.723 1.00 63.31 H new ATOM 0 HG3 GLU A 53 -21.977 -1.996 11.232 1.00 63.31 H new ATOM 791 N VAL A 54 -24.749 -2.767 6.953 1.00 22.21 N ATOM 792 CA VAL A 54 -25.787 -3.313 6.087 1.00 62.55 C ATOM 793 C VAL A 54 -25.630 -4.820 5.923 1.00 25.30 C ATOM 794 O VAL A 54 -24.514 -5.337 5.863 1.00 72.42 O ATOM 795 CB VAL A 54 -25.764 -2.651 4.697 1.00 34.21 C ATOM 796 CG1 VAL A 54 -24.601 -3.179 3.873 1.00 11.11 C ATOM 797 CG2 VAL A 54 -27.085 -2.879 3.976 1.00 22.21 C ATOM 0 H VAL A 54 -23.894 -2.496 6.467 1.00 22.21 H new ATOM 0 HA VAL A 54 -26.743 -3.101 6.566 1.00 62.55 H new ATOM 0 HB VAL A 54 -25.628 -1.578 4.828 1.00 34.21 H new ATOM 0 HG11 VAL A 54 -24.601 -2.700 2.894 1.00 11.11 H new ATOM 0 HG12 VAL A 54 -23.664 -2.960 4.384 1.00 11.11 H new ATOM 0 HG13 VAL A 54 -24.703 -4.257 3.749 1.00 11.11 H new ATOM 0 HG21 VAL A 54 -27.051 -2.404 2.995 1.00 22.21 H new ATOM 0 HG22 VAL A 54 -27.254 -3.949 3.855 1.00 22.21 H new ATOM 0 HG23 VAL A 54 -27.898 -2.447 4.560 1.00 22.21 H new ATOM 807 N LYS A 55 -26.756 -5.522 5.851 1.00 32.13 N ATOM 808 CA LYS A 55 -26.745 -6.972 5.690 1.00 11.44 C ATOM 809 C LYS A 55 -28.040 -7.459 5.050 1.00 24.20 C ATOM 810 O LYS A 55 -28.956 -6.673 4.804 1.00 53.12 O ATOM 811 CB LYS A 55 -26.547 -7.654 7.047 1.00 13.34 C ATOM 812 CG LYS A 55 -27.664 -7.374 8.037 1.00 34.42 C ATOM 813 CD LYS A 55 -27.865 -8.536 8.995 1.00 72.33 C ATOM 814 CE LYS A 55 -26.715 -8.650 9.982 1.00 54.12 C ATOM 815 NZ LYS A 55 -27.053 -9.537 11.129 1.00 75.44 N1+ ATOM 0 H LYS A 55 -27.688 -5.111 5.902 1.00 32.13 H new ATOM 0 HA LYS A 55 -25.915 -7.233 5.033 1.00 11.44 H new ATOM 0 HB2 LYS A 55 -26.469 -8.731 6.895 1.00 13.34 H new ATOM 0 HB3 LYS A 55 -25.601 -7.323 7.476 1.00 13.34 H new ATOM 0 HG2 LYS A 55 -27.432 -6.471 8.602 1.00 34.42 H new ATOM 0 HG3 LYS A 55 -28.591 -7.183 7.496 1.00 34.42 H new ATOM 0 HD2 LYS A 55 -28.800 -8.403 9.539 1.00 72.33 H new ATOM 0 HD3 LYS A 55 -27.954 -9.464 8.430 1.00 72.33 H new ATOM 0 HE2 LYS A 55 -25.835 -9.038 9.470 1.00 54.12 H new ATOM 0 HE3 LYS A 55 -26.456 -7.659 10.354 1.00 54.12 H new ATOM 0 HZ1 LYS A 55 -26.243 -9.588 11.779 1.00 75.44 H new ATOM 0 HZ2 LYS A 55 -27.878 -9.153 11.633 1.00 75.44 H new ATOM 0 HZ3 LYS A 55 -27.275 -10.490 10.777 1.00 75.44 H new ATOM 829 N ASP A 56 -28.111 -8.758 4.782 1.00 1.11 N ATOM 830 CA ASP A 56 -29.297 -9.350 4.172 1.00 50.12 C ATOM 831 C ASP A 56 -30.518 -9.165 5.068 1.00 51.21 C ATOM 832 O ASP A 56 -30.424 -9.261 6.291 1.00 22.43 O ATOM 833 CB ASP A 56 -29.068 -10.838 3.901 1.00 24.03 C ATOM 834 CG ASP A 56 -29.344 -11.697 5.119 1.00 74.11 C ATOM 835 OD1 ASP A 56 -28.750 -11.426 6.183 1.00 70.55 O ATOM 836 OD2 ASP A 56 -30.152 -12.643 5.006 1.00 42.54 O1- ATOM 0 H ASP A 56 -27.362 -9.422 4.977 1.00 1.11 H new ATOM 0 HA ASP A 56 -29.482 -8.841 3.226 1.00 50.12 H new ATOM 0 HB2 ASP A 56 -29.711 -11.158 3.081 1.00 24.03 H new ATOM 0 HB3 ASP A 56 -28.038 -10.991 3.578 1.00 24.03 H new ATOM 841 N GLY A 57 -31.665 -8.900 4.449 1.00 23.23 N ATOM 842 CA GLY A 57 -32.888 -8.705 5.204 1.00 2.42 C ATOM 843 C GLY A 57 -33.056 -7.274 5.675 1.00 30.44 C ATOM 844 O GLY A 57 -34.029 -6.948 6.357 1.00 50.43 O ATOM 0 H GLY A 57 -31.768 -8.817 3.438 1.00 23.23 H new ATOM 0 HA2 GLY A 57 -33.741 -8.983 4.586 1.00 2.42 H new ATOM 0 HA3 GLY A 57 -32.889 -9.371 6.067 1.00 2.42 H new ATOM 848 N ASP A 58 -32.109 -6.418 5.313 1.00 1.23 N ATOM 849 CA ASP A 58 -32.156 -5.013 5.703 1.00 24.33 C ATOM 850 C ASP A 58 -32.246 -4.111 4.476 1.00 44.22 C ATOM 851 O ASP A 58 -31.248 -3.871 3.795 1.00 4.32 O ATOM 852 CB ASP A 58 -30.922 -4.649 6.529 1.00 74.23 C ATOM 853 CG ASP A 58 -31.060 -5.054 7.984 1.00 42.34 C ATOM 854 OD1 ASP A 58 -31.526 -6.184 8.245 1.00 52.45 O ATOM 855 OD2 ASP A 58 -30.700 -4.243 8.862 1.00 60.24 O1- ATOM 0 H ASP A 58 -31.298 -6.672 4.749 1.00 1.23 H new ATOM 0 HA ASP A 58 -33.048 -4.860 6.310 1.00 24.33 H new ATOM 0 HB2 ASP A 58 -30.045 -5.135 6.101 1.00 74.23 H new ATOM 0 HB3 ASP A 58 -30.752 -3.574 6.468 1.00 74.23 H new ATOM 860 N LEU A 59 -33.446 -3.615 4.199 1.00 1.10 N ATOM 861 CA LEU A 59 -33.667 -2.740 3.053 1.00 32.31 C ATOM 862 C LEU A 59 -33.157 -1.330 3.338 1.00 22.24 C ATOM 863 O LEU A 59 -32.821 -0.583 2.418 1.00 63.34 O ATOM 864 CB LEU A 59 -35.155 -2.694 2.701 1.00 63.13 C ATOM 865 CG LEU A 59 -35.843 -4.047 2.515 1.00 21.11 C ATOM 866 CD1 LEU A 59 -34.868 -5.068 1.950 1.00 3.32 C ATOM 867 CD2 LEU A 59 -36.424 -4.535 3.835 1.00 13.30 C ATOM 0 H LEU A 59 -34.282 -3.804 4.752 1.00 1.10 H new ATOM 0 HA LEU A 59 -33.112 -3.144 2.207 1.00 32.31 H new ATOM 0 HB2 LEU A 59 -35.677 -2.149 3.487 1.00 63.13 H new ATOM 0 HB3 LEU A 59 -35.273 -2.120 1.782 1.00 63.13 H new ATOM 0 HG LEU A 59 -36.660 -3.924 1.804 1.00 21.11 H new ATOM 0 HD11 LEU A 59 -35.375 -6.025 1.824 1.00 3.32 H new ATOM 0 HD12 LEU A 59 -34.499 -4.723 0.984 1.00 3.32 H new ATOM 0 HD13 LEU A 59 -34.030 -5.189 2.636 1.00 3.32 H new ATOM 0 HD21 LEU A 59 -36.910 -5.499 3.684 1.00 13.30 H new ATOM 0 HD22 LEU A 59 -35.624 -4.642 4.567 1.00 13.30 H new ATOM 0 HD23 LEU A 59 -37.155 -3.813 4.200 1.00 13.30 H new ATOM 879 N LEU A 60 -33.098 -0.975 4.617 1.00 4.23 N ATOM 880 CA LEU A 60 -32.626 0.343 5.023 1.00 33.23 C ATOM 881 C LEU A 60 -33.588 1.433 4.559 1.00 4.21 C ATOM 882 O LEU A 60 -33.269 2.621 4.612 1.00 64.02 O ATOM 883 CB LEU A 60 -31.230 0.605 4.456 1.00 0.12 C ATOM 884 CG LEU A 60 -30.253 -0.571 4.511 1.00 74.51 C ATOM 885 CD1 LEU A 60 -29.067 -0.322 3.592 1.00 63.21 C ATOM 886 CD2 LEU A 60 -29.784 -0.807 5.940 1.00 1.41 C ATOM 0 H LEU A 60 -33.371 -1.582 5.390 1.00 4.23 H new ATOM 0 HA LEU A 60 -32.579 0.364 6.112 1.00 33.23 H new ATOM 0 HB2 LEU A 60 -31.334 0.917 3.417 1.00 0.12 H new ATOM 0 HB3 LEU A 60 -30.791 1.443 4.998 1.00 0.12 H new ATOM 0 HG LEU A 60 -30.771 -1.467 4.167 1.00 74.51 H new ATOM 0 HD11 LEU A 60 -28.382 -1.169 3.644 1.00 63.21 H new ATOM 0 HD12 LEU A 60 -29.419 -0.203 2.567 1.00 63.21 H new ATOM 0 HD13 LEU A 60 -28.548 0.584 3.905 1.00 63.21 H new ATOM 0 HD21 LEU A 60 -29.090 -1.647 5.961 1.00 1.41 H new ATOM 0 HD22 LEU A 60 -29.283 0.087 6.311 1.00 1.41 H new ATOM 0 HD23 LEU A 60 -30.643 -1.030 6.573 1.00 1.41 H new ATOM 898 N VAL A 61 -34.767 1.021 4.107 1.00 0.20 N ATOM 899 CA VAL A 61 -35.778 1.962 3.636 1.00 71.21 C ATOM 900 C VAL A 61 -37.182 1.403 3.832 1.00 70.32 C ATOM 901 O VAL A 61 -37.483 0.288 3.409 1.00 31.11 O ATOM 902 CB VAL A 61 -35.575 2.305 2.148 1.00 31.34 C ATOM 903 CG1 VAL A 61 -36.737 3.138 1.630 1.00 4.22 C ATOM 904 CG2 VAL A 61 -34.254 3.030 1.944 1.00 2.31 C ATOM 0 H VAL A 61 -35.047 0.041 4.057 1.00 0.20 H new ATOM 0 HA VAL A 61 -35.667 2.870 4.228 1.00 71.21 H new ATOM 0 HB VAL A 61 -35.543 1.376 1.579 1.00 31.34 H new ATOM 0 HG11 VAL A 61 -36.577 3.371 0.577 1.00 4.22 H new ATOM 0 HG12 VAL A 61 -37.665 2.577 1.740 1.00 4.22 H new ATOM 0 HG13 VAL A 61 -36.803 4.064 2.201 1.00 4.22 H new ATOM 0 HG21 VAL A 61 -34.127 3.265 0.887 1.00 2.31 H new ATOM 0 HG22 VAL A 61 -34.252 3.953 2.523 1.00 2.31 H new ATOM 0 HG23 VAL A 61 -33.434 2.393 2.275 1.00 2.31 H new ATOM 914 N GLY A 62 -38.041 2.187 4.476 1.00 71.04 N ATOM 915 CA GLY A 62 -39.406 1.755 4.717 1.00 31.12 C ATOM 916 C GLY A 62 -40.378 2.312 3.697 1.00 34.53 C ATOM 917 O GLY A 62 -40.789 3.469 3.787 1.00 41.31 O ATOM 0 H GLY A 62 -37.816 3.115 4.836 1.00 71.04 H new ATOM 0 HA2 GLY A 62 -39.448 0.666 4.698 1.00 31.12 H new ATOM 0 HA3 GLY A 62 -39.712 2.068 5.715 1.00 31.12 H new ATOM 921 N LYS A 63 -40.748 1.488 2.723 1.00 64.14 N ATOM 922 CA LYS A 63 -41.679 1.903 1.680 1.00 33.22 C ATOM 923 C LYS A 63 -42.738 0.832 1.437 1.00 20.52 C ATOM 924 O LYS A 63 -42.414 -0.326 1.175 1.00 13.53 O ATOM 925 CB LYS A 63 -40.925 2.194 0.380 1.00 74.02 C ATOM 926 CG LYS A 63 -41.837 2.441 -0.809 1.00 20.40 C ATOM 927 CD LYS A 63 -42.675 3.693 -0.618 1.00 71.32 C ATOM 928 CE LYS A 63 -43.975 3.619 -1.405 1.00 42.40 C ATOM 929 NZ LYS A 63 -43.741 3.260 -2.831 1.00 61.51 N1+ ATOM 0 H LYS A 63 -40.417 0.527 2.634 1.00 64.14 H new ATOM 0 HA LYS A 63 -42.178 2.812 2.015 1.00 33.22 H new ATOM 0 HB2 LYS A 63 -40.288 3.067 0.526 1.00 74.02 H new ATOM 0 HB3 LYS A 63 -40.268 1.354 0.155 1.00 74.02 H new ATOM 0 HG2 LYS A 63 -41.238 2.538 -1.714 1.00 20.40 H new ATOM 0 HG3 LYS A 63 -42.492 1.582 -0.951 1.00 20.40 H new ATOM 0 HD2 LYS A 63 -42.897 3.826 0.441 1.00 71.32 H new ATOM 0 HD3 LYS A 63 -42.105 4.566 -0.936 1.00 71.32 H new ATOM 0 HE2 LYS A 63 -44.634 2.881 -0.948 1.00 42.40 H new ATOM 0 HE3 LYS A 63 -44.487 4.580 -1.352 1.00 42.40 H new ATOM 0 HZ1 LYS A 63 -44.270 3.912 -3.444 1.00 61.51 H new ATOM 0 HZ2 LYS A 63 -42.726 3.331 -3.045 1.00 61.51 H new ATOM 0 HZ3 LYS A 63 -44.063 2.286 -3.001 1.00 61.51 H new ATOM 943 N VAL A 64 -44.003 1.228 1.525 1.00 71.05 N ATOM 944 CA VAL A 64 -45.110 0.302 1.312 1.00 72.21 C ATOM 945 C VAL A 64 -46.384 1.047 0.930 1.00 72.14 C ATOM 946 O VAL A 64 -46.775 2.011 1.590 1.00 61.31 O ATOM 947 CB VAL A 64 -45.382 -0.546 2.568 1.00 41.14 C ATOM 948 CG1 VAL A 64 -44.482 -1.773 2.589 1.00 41.34 C ATOM 949 CG2 VAL A 64 -45.188 0.288 3.826 1.00 71.41 C ATOM 0 H VAL A 64 -44.288 2.183 1.742 1.00 71.05 H new ATOM 0 HA VAL A 64 -44.818 -0.357 0.494 1.00 72.21 H new ATOM 0 HB VAL A 64 -46.418 -0.884 2.539 1.00 41.14 H new ATOM 0 HG11 VAL A 64 -44.688 -2.360 3.484 1.00 41.34 H new ATOM 0 HG12 VAL A 64 -44.674 -2.380 1.704 1.00 41.34 H new ATOM 0 HG13 VAL A 64 -43.438 -1.459 2.594 1.00 41.34 H new ATOM 0 HG21 VAL A 64 -45.384 -0.327 4.704 1.00 71.41 H new ATOM 0 HG22 VAL A 64 -44.163 0.657 3.863 1.00 71.41 H new ATOM 0 HG23 VAL A 64 -45.877 1.132 3.813 1.00 71.41 H new ATOM 959 N THR A 65 -47.031 0.595 -0.140 1.00 75.31 N ATOM 960 CA THR A 65 -48.260 1.218 -0.611 1.00 21.11 C ATOM 961 C THR A 65 -49.484 0.416 -0.181 1.00 50.33 C ATOM 962 O THR A 65 -49.398 -0.772 0.132 1.00 22.30 O ATOM 963 CB THR A 65 -48.268 1.360 -2.144 1.00 51.22 C ATOM 964 OG1 THR A 65 -47.407 0.376 -2.731 1.00 52.43 O ATOM 965 CG2 THR A 65 -47.814 2.750 -2.562 1.00 65.41 C ATOM 0 H THR A 65 -46.723 -0.202 -0.697 1.00 75.31 H new ATOM 0 HA THR A 65 -48.302 2.210 -0.161 1.00 21.11 H new ATOM 0 HB THR A 65 -49.289 1.207 -2.495 1.00 51.22 H new ATOM 0 HG1 THR A 65 -47.418 0.471 -3.706 1.00 52.43 H new ATOM 0 HG21 THR A 65 -47.828 2.826 -3.649 1.00 65.41 H new ATOM 0 HG22 THR A 65 -48.487 3.495 -2.138 1.00 65.41 H new ATOM 0 HG23 THR A 65 -46.801 2.926 -2.199 1.00 65.41 H new ATOM 973 N PRO A 66 -50.650 1.076 -0.164 1.00 71.34 N ATOM 974 CA PRO A 66 -51.914 0.444 0.226 1.00 72.00 C ATOM 975 C PRO A 66 -52.393 -0.574 -0.804 1.00 31.14 C ATOM 976 O PRO A 66 -52.188 -0.402 -2.006 1.00 4.01 O ATOM 977 CB PRO A 66 -52.889 1.620 0.309 1.00 54.11 C ATOM 978 CG PRO A 66 -52.319 2.650 -0.604 1.00 72.32 C ATOM 979 CD PRO A 66 -50.826 2.494 -0.524 1.00 51.54 C ATOM 0 HA PRO A 66 -51.820 -0.115 1.157 1.00 72.00 H new ATOM 0 HB2 PRO A 66 -53.891 1.326 -0.003 1.00 54.11 H new ATOM 0 HB3 PRO A 66 -52.970 1.996 1.329 1.00 54.11 H new ATOM 0 HG2 PRO A 66 -52.672 2.505 -1.625 1.00 72.32 H new ATOM 0 HG3 PRO A 66 -52.623 3.652 -0.301 1.00 72.32 H new ATOM 0 HD2 PRO A 66 -50.346 2.730 -1.474 1.00 51.54 H new ATOM 0 HD3 PRO A 66 -50.392 3.156 0.226 1.00 51.54 H new ATOM 987 N LYS A 67 -53.033 -1.636 -0.325 1.00 13.34 N ATOM 988 CA LYS A 67 -53.544 -2.682 -1.203 1.00 22.03 C ATOM 989 C LYS A 67 -55.064 -2.775 -1.112 1.00 61.40 C ATOM 990 O LYS A 67 -55.684 -2.140 -0.260 1.00 45.12 O ATOM 991 CB LYS A 67 -52.917 -4.030 -0.843 1.00 13.12 C ATOM 992 CG LYS A 67 -51.638 -4.331 -1.605 1.00 24.12 C ATOM 993 CD LYS A 67 -51.073 -5.691 -1.232 1.00 43.33 C ATOM 994 CE LYS A 67 -51.925 -6.820 -1.790 1.00 51.24 C ATOM 995 NZ LYS A 67 -51.116 -8.039 -2.072 1.00 22.33 N1+ ATOM 0 H LYS A 67 -53.210 -1.795 0.667 1.00 13.34 H new ATOM 0 HA LYS A 67 -53.274 -2.425 -2.227 1.00 22.03 H new ATOM 0 HB2 LYS A 67 -52.705 -4.048 0.226 1.00 13.12 H new ATOM 0 HB3 LYS A 67 -53.641 -4.821 -1.038 1.00 13.12 H new ATOM 0 HG2 LYS A 67 -51.836 -4.300 -2.676 1.00 24.12 H new ATOM 0 HG3 LYS A 67 -50.898 -3.559 -1.395 1.00 24.12 H new ATOM 0 HD2 LYS A 67 -50.055 -5.780 -1.612 1.00 43.33 H new ATOM 0 HD3 LYS A 67 -51.017 -5.778 -0.147 1.00 43.33 H new ATOM 0 HE2 LYS A 67 -52.714 -7.065 -1.079 1.00 51.24 H new ATOM 0 HE3 LYS A 67 -52.413 -6.488 -2.706 1.00 51.24 H new ATOM 0 HZ1 LYS A 67 -51.733 -8.785 -2.451 1.00 22.33 H new ATOM 0 HZ2 LYS A 67 -50.378 -7.813 -2.769 1.00 22.33 H new ATOM 0 HZ3 LYS A 67 -50.671 -8.371 -1.193 1.00 22.33 H new ATOM 1009 N GLY A 68 -55.658 -3.573 -1.994 1.00 41.33 N ATOM 1010 CA GLY A 68 -57.100 -3.735 -1.994 1.00 62.55 C ATOM 1011 C GLY A 68 -57.542 -4.994 -1.274 1.00 22.32 C ATOM 1012 O GLY A 68 -56.795 -5.970 -1.199 1.00 24.52 O ATOM 0 H GLY A 68 -55.166 -4.110 -2.708 1.00 41.33 H new ATOM 0 HA2 GLY A 68 -57.560 -2.868 -1.519 1.00 62.55 H new ATOM 0 HA3 GLY A 68 -57.459 -3.763 -3.023 1.00 62.55 H new ATOM 1016 N VAL A 69 -58.759 -4.972 -0.740 1.00 13.52 N ATOM 1017 CA VAL A 69 -59.299 -6.120 -0.022 1.00 23.11 C ATOM 1018 C VAL A 69 -59.674 -7.243 -0.982 1.00 22.23 C ATOM 1019 O VAL A 69 -59.692 -8.416 -0.607 1.00 32.21 O ATOM 1020 CB VAL A 69 -60.540 -5.731 0.805 1.00 70.31 C ATOM 1021 CG1 VAL A 69 -61.002 -6.903 1.657 1.00 51.03 C ATOM 1022 CG2 VAL A 69 -60.243 -4.516 1.670 1.00 34.25 C ATOM 0 H VAL A 69 -59.389 -4.172 -0.791 1.00 13.52 H new ATOM 0 HA VAL A 69 -58.516 -6.469 0.652 1.00 23.11 H new ATOM 0 HB VAL A 69 -61.347 -5.472 0.119 1.00 70.31 H new ATOM 0 HG11 VAL A 69 -61.879 -6.610 2.234 1.00 51.03 H new ATOM 0 HG12 VAL A 69 -61.256 -7.744 1.012 1.00 51.03 H new ATOM 0 HG13 VAL A 69 -60.202 -7.196 2.337 1.00 51.03 H new ATOM 0 HG21 VAL A 69 -61.130 -4.255 2.247 1.00 34.25 H new ATOM 0 HG22 VAL A 69 -59.422 -4.745 2.350 1.00 34.25 H new ATOM 0 HG23 VAL A 69 -59.964 -3.676 1.034 1.00 34.25 H new ATOM 1032 N THR A 70 -59.973 -6.876 -2.225 1.00 55.35 N ATOM 1033 CA THR A 70 -60.347 -7.853 -3.240 1.00 0.23 C ATOM 1034 C THR A 70 -59.139 -8.663 -3.698 1.00 24.22 C ATOM 1035 O THR A 70 -59.281 -9.783 -4.184 1.00 33.12 O ATOM 1036 CB THR A 70 -60.989 -7.173 -4.464 1.00 23.51 C ATOM 1037 OG1 THR A 70 -61.720 -6.012 -4.052 1.00 74.35 O ATOM 1038 CG2 THR A 70 -61.919 -8.132 -5.192 1.00 3.05 C ATOM 0 H THR A 70 -59.963 -5.910 -2.552 1.00 55.35 H new ATOM 0 HA THR A 70 -61.075 -8.522 -2.781 1.00 0.23 H new ATOM 0 HB THR A 70 -60.192 -6.878 -5.147 1.00 23.51 H new ATOM 0 HG1 THR A 70 -62.124 -5.584 -4.836 1.00 74.35 H new ATOM 0 HG21 THR A 70 -62.360 -7.628 -6.052 1.00 3.05 H new ATOM 0 HG22 THR A 70 -61.354 -9.001 -5.530 1.00 3.05 H new ATOM 0 HG23 THR A 70 -62.710 -8.455 -4.516 1.00 3.05 H new ATOM 1046 N GLU A 71 -57.952 -8.086 -3.537 1.00 11.11 N ATOM 1047 CA GLU A 71 -56.719 -8.756 -3.934 1.00 34.23 C ATOM 1048 C GLU A 71 -56.087 -9.481 -2.749 1.00 23.33 C ATOM 1049 O GLU A 71 -54.864 -9.518 -2.610 1.00 53.31 O ATOM 1050 CB GLU A 71 -55.729 -7.745 -4.516 1.00 54.35 C ATOM 1051 CG GLU A 71 -56.104 -7.255 -5.904 1.00 72.01 C ATOM 1052 CD GLU A 71 -55.640 -8.195 -7.000 1.00 25.40 C ATOM 1053 OE1 GLU A 71 -54.493 -8.681 -6.919 1.00 5.12 O ATOM 1054 OE2 GLU A 71 -56.425 -8.445 -7.939 1.00 23.50 O1- ATOM 0 H GLU A 71 -57.818 -7.158 -3.135 1.00 11.11 H new ATOM 0 HA GLU A 71 -56.966 -9.493 -4.698 1.00 34.23 H new ATOM 0 HB2 GLU A 71 -55.660 -6.889 -3.844 1.00 54.35 H new ATOM 0 HB3 GLU A 71 -54.739 -8.200 -4.556 1.00 54.35 H new ATOM 0 HG2 GLU A 71 -57.186 -7.139 -5.964 1.00 72.01 H new ATOM 0 HG3 GLU A 71 -55.668 -6.269 -6.067 1.00 72.01 H new ATOM 1061 N LEU A 72 -56.930 -10.055 -1.898 1.00 12.50 N ATOM 1062 CA LEU A 72 -56.454 -10.779 -0.723 1.00 60.42 C ATOM 1063 C LEU A 72 -56.422 -12.281 -0.986 1.00 51.14 C ATOM 1064 O LEU A 72 -56.906 -12.754 -2.015 1.00 34.14 O ATOM 1065 CB LEU A 72 -57.348 -10.478 0.481 1.00 44.10 C ATOM 1066 CG LEU A 72 -57.174 -9.100 1.120 1.00 41.21 C ATOM 1067 CD1 LEU A 72 -58.121 -8.933 2.297 1.00 14.22 C ATOM 1068 CD2 LEU A 72 -55.732 -8.896 1.561 1.00 4.04 C ATOM 0 H LEU A 72 -57.945 -10.034 -1.999 1.00 12.50 H new ATOM 0 HA LEU A 72 -55.439 -10.446 -0.506 1.00 60.42 H new ATOM 0 HB2 LEU A 72 -58.388 -10.584 0.171 1.00 44.10 H new ATOM 0 HB3 LEU A 72 -57.164 -11.235 1.243 1.00 44.10 H new ATOM 0 HG LEU A 72 -57.417 -8.342 0.375 1.00 41.21 H new ATOM 0 HD11 LEU A 72 -57.982 -7.946 2.739 1.00 14.22 H new ATOM 0 HD12 LEU A 72 -59.150 -9.035 1.953 1.00 14.22 H new ATOM 0 HD13 LEU A 72 -57.911 -9.698 3.045 1.00 14.22 H new ATOM 0 HD21 LEU A 72 -55.626 -7.910 2.014 1.00 4.04 H new ATOM 0 HD22 LEU A 72 -55.463 -9.661 2.290 1.00 4.04 H new ATOM 0 HD23 LEU A 72 -55.073 -8.971 0.696 1.00 4.04 H new ATOM 1080 N THR A 73 -55.853 -13.029 -0.045 1.00 73.31 N ATOM 1081 CA THR A 73 -55.759 -14.478 -0.174 1.00 33.52 C ATOM 1082 C THR A 73 -56.813 -15.175 0.679 1.00 24.20 C ATOM 1083 O THR A 73 -57.366 -14.583 1.606 1.00 22.42 O ATOM 1084 CB THR A 73 -54.365 -14.988 0.235 1.00 30.40 C ATOM 1085 OG1 THR A 73 -54.216 -14.923 1.658 1.00 65.52 O ATOM 1086 CG2 THR A 73 -53.270 -14.169 -0.432 1.00 71.53 C ATOM 0 H THR A 73 -55.451 -12.655 0.814 1.00 73.31 H new ATOM 0 HA THR A 73 -55.931 -14.714 -1.224 1.00 33.52 H new ATOM 0 HB THR A 73 -54.273 -16.023 -0.093 1.00 30.40 H new ATOM 0 HG1 THR A 73 -53.327 -15.251 1.909 1.00 65.52 H new ATOM 0 HG21 THR A 73 -52.295 -14.549 -0.127 1.00 71.53 H new ATOM 0 HG22 THR A 73 -53.367 -14.245 -1.515 1.00 71.53 H new ATOM 0 HG23 THR A 73 -53.363 -13.125 -0.132 1.00 71.53 H new ATOM 1094 N ALA A 74 -57.086 -16.435 0.361 1.00 25.51 N ATOM 1095 CA ALA A 74 -58.072 -17.214 1.099 1.00 22.05 C ATOM 1096 C ALA A 74 -57.739 -17.250 2.587 1.00 64.11 C ATOM 1097 O ALA A 74 -58.634 -17.278 3.432 1.00 22.20 O ATOM 1098 CB ALA A 74 -58.156 -18.626 0.541 1.00 52.43 C ATOM 0 H ALA A 74 -56.638 -16.939 -0.404 1.00 25.51 H new ATOM 0 HA ALA A 74 -59.042 -16.731 0.981 1.00 22.05 H new ATOM 0 HB1 ALA A 74 -58.897 -19.196 1.102 1.00 52.43 H new ATOM 0 HB2 ALA A 74 -58.448 -18.586 -0.508 1.00 52.43 H new ATOM 0 HB3 ALA A 74 -57.183 -19.110 0.628 1.00 52.43 H new ATOM 1104 N GLU A 75 -56.447 -17.252 2.900 1.00 71.15 N ATOM 1105 CA GLU A 75 -55.999 -17.287 4.288 1.00 23.11 C ATOM 1106 C GLU A 75 -56.575 -16.115 5.076 1.00 12.34 C ATOM 1107 O GLU A 75 -57.058 -16.286 6.195 1.00 50.21 O ATOM 1108 CB GLU A 75 -54.470 -17.256 4.352 1.00 42.41 C ATOM 1109 CG GLU A 75 -53.804 -18.369 3.561 1.00 25.54 C ATOM 1110 CD GLU A 75 -52.424 -18.715 4.087 1.00 73.13 C ATOM 1111 OE1 GLU A 75 -51.504 -17.886 3.928 1.00 41.51 O ATOM 1112 OE2 GLU A 75 -52.266 -19.814 4.658 1.00 65.41 O1- ATOM 0 H GLU A 75 -55.693 -17.230 2.213 1.00 71.15 H new ATOM 0 HA GLU A 75 -56.357 -18.214 4.736 1.00 23.11 H new ATOM 0 HB2 GLU A 75 -54.119 -16.295 3.977 1.00 42.41 H new ATOM 0 HB3 GLU A 75 -54.157 -17.325 5.394 1.00 42.41 H new ATOM 0 HG2 GLU A 75 -54.434 -19.258 3.592 1.00 25.54 H new ATOM 0 HG3 GLU A 75 -53.726 -18.070 2.516 1.00 25.54 H new ATOM 1119 N GLU A 76 -56.521 -14.926 4.483 1.00 50.31 N ATOM 1120 CA GLU A 76 -57.038 -13.726 5.131 1.00 72.21 C ATOM 1121 C GLU A 76 -58.524 -13.873 5.445 1.00 22.24 C ATOM 1122 O GLU A 76 -59.027 -13.293 6.407 1.00 10.21 O ATOM 1123 CB GLU A 76 -56.811 -12.502 4.242 1.00 62.24 C ATOM 1124 CG GLU A 76 -55.400 -11.944 4.323 1.00 64.30 C ATOM 1125 CD GLU A 76 -55.106 -11.293 5.661 1.00 33.44 C ATOM 1126 OE1 GLU A 76 -55.637 -10.191 5.913 1.00 31.41 O ATOM 1127 OE2 GLU A 76 -54.346 -11.885 6.454 1.00 3.21 O1- ATOM 0 H GLU A 76 -56.125 -14.768 3.556 1.00 50.31 H new ATOM 0 HA GLU A 76 -56.499 -13.590 6.069 1.00 72.21 H new ATOM 0 HB2 GLU A 76 -57.028 -12.769 3.208 1.00 62.24 H new ATOM 0 HB3 GLU A 76 -57.518 -11.722 4.525 1.00 62.24 H new ATOM 0 HG2 GLU A 76 -54.685 -12.748 4.149 1.00 64.30 H new ATOM 0 HG3 GLU A 76 -55.256 -11.212 3.528 1.00 64.30 H new ATOM 1134 N ARG A 77 -59.221 -14.653 4.624 1.00 60.41 N ATOM 1135 CA ARG A 77 -60.649 -14.876 4.812 1.00 75.45 C ATOM 1136 C ARG A 77 -60.916 -15.630 6.112 1.00 5.25 C ATOM 1137 O ARG A 77 -61.763 -15.229 6.912 1.00 54.11 O ATOM 1138 CB ARG A 77 -61.225 -15.657 3.630 1.00 61.41 C ATOM 1139 CG ARG A 77 -60.824 -15.096 2.275 1.00 55.33 C ATOM 1140 CD ARG A 77 -61.529 -15.821 1.140 1.00 52.34 C ATOM 1141 NE ARG A 77 -62.973 -15.605 1.165 1.00 62.33 N ATOM 1142 CZ ARG A 77 -63.763 -15.801 0.116 1.00 34.33 C ATOM 1143 NH1 ARG A 77 -63.253 -16.218 -1.035 1.00 23.02 N1+ ATOM 1144 NH2 ARG A 77 -65.068 -15.583 0.218 1.00 22.33 N ATOM 0 H ARG A 77 -58.820 -15.140 3.823 1.00 60.41 H new ATOM 0 HA ARG A 77 -61.138 -13.904 4.869 1.00 75.45 H new ATOM 0 HB2 ARG A 77 -60.896 -16.694 3.696 1.00 61.41 H new ATOM 0 HB3 ARG A 77 -62.312 -15.662 3.704 1.00 61.41 H new ATOM 0 HG2 ARG A 77 -61.065 -14.034 2.234 1.00 55.33 H new ATOM 0 HG3 ARG A 77 -59.745 -15.183 2.149 1.00 55.33 H new ATOM 0 HD2 ARG A 77 -61.128 -15.478 0.186 1.00 52.34 H new ATOM 0 HD3 ARG A 77 -61.321 -16.889 1.208 1.00 52.34 H new ATOM 0 HE ARG A 77 -63.398 -15.286 2.036 1.00 62.33 H new ATOM 0 HH11 ARG A 77 -62.251 -16.389 -1.117 1.00 23.02 H new ATOM 0 HH12 ARG A 77 -63.863 -16.368 -1.839 1.00 23.02 H new ATOM 0 HH21 ARG A 77 -65.464 -15.265 1.102 1.00 22.33 H new ATOM 0 HH22 ARG A 77 -65.675 -15.734 -0.588 1.00 22.33 H new ATOM 1158 N LEU A 78 -60.188 -16.722 6.316 1.00 4.11 N ATOM 1159 CA LEU A 78 -60.347 -17.533 7.518 1.00 63.30 C ATOM 1160 C LEU A 78 -59.629 -16.895 8.703 1.00 1.51 C ATOM 1161 O LEU A 78 -59.949 -17.174 9.859 1.00 72.43 O ATOM 1162 CB LEU A 78 -59.806 -18.945 7.280 1.00 62.25 C ATOM 1163 CG LEU A 78 -58.296 -19.122 7.444 1.00 4.10 C ATOM 1164 CD1 LEU A 78 -57.957 -19.500 8.877 1.00 71.01 C ATOM 1165 CD2 LEU A 78 -57.774 -20.173 6.475 1.00 24.05 C ATOM 0 H LEU A 78 -59.482 -17.066 5.665 1.00 4.11 H new ATOM 0 HA LEU A 78 -61.411 -17.592 7.749 1.00 63.30 H new ATOM 0 HB2 LEU A 78 -60.308 -19.625 7.968 1.00 62.25 H new ATOM 0 HB3 LEU A 78 -60.080 -19.252 6.271 1.00 62.25 H new ATOM 0 HG LEU A 78 -57.810 -18.173 7.215 1.00 4.10 H new ATOM 0 HD11 LEU A 78 -56.878 -19.622 8.976 1.00 71.01 H new ATOM 0 HD12 LEU A 78 -58.296 -18.713 9.551 1.00 71.01 H new ATOM 0 HD13 LEU A 78 -58.453 -20.436 9.133 1.00 71.01 H new ATOM 0 HD21 LEU A 78 -56.698 -20.286 6.606 1.00 24.05 H new ATOM 0 HD22 LEU A 78 -58.265 -21.126 6.672 1.00 24.05 H new ATOM 0 HD23 LEU A 78 -57.985 -19.861 5.452 1.00 24.05 H new ATOM 1177 N LEU A 79 -58.660 -16.036 8.408 1.00 73.12 N ATOM 1178 CA LEU A 79 -57.898 -15.355 9.450 1.00 25.52 C ATOM 1179 C LEU A 79 -58.740 -14.277 10.124 1.00 13.43 C ATOM 1180 O LEU A 79 -58.478 -13.892 11.264 1.00 45.51 O ATOM 1181 CB LEU A 79 -56.631 -14.734 8.859 1.00 42.42 C ATOM 1182 CG LEU A 79 -55.329 -15.493 9.115 1.00 44.11 C ATOM 1183 CD1 LEU A 79 -55.054 -15.594 10.608 1.00 40.45 C ATOM 1184 CD2 LEU A 79 -55.387 -16.878 8.487 1.00 24.32 C ATOM 0 H LEU A 79 -58.383 -15.794 7.457 1.00 73.12 H new ATOM 0 HA LEU A 79 -57.617 -16.093 10.202 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -56.766 -14.638 7.782 1.00 42.42 H new ATOM 0 HB3 LEU A 79 -56.525 -13.725 9.258 1.00 42.42 H new ATOM 0 HG LEU A 79 -54.512 -14.940 8.653 1.00 44.11 H new ATOM 0 HD11 LEU A 79 -54.123 -16.137 10.771 1.00 40.45 H new ATOM 0 HD12 LEU A 79 -54.968 -14.593 11.031 1.00 40.45 H new ATOM 0 HD13 LEU A 79 -55.873 -16.124 11.094 1.00 40.45 H new ATOM 0 HD21 LEU A 79 -54.452 -17.404 8.679 1.00 24.32 H new ATOM 0 HD22 LEU A 79 -56.215 -17.439 8.920 1.00 24.32 H new ATOM 0 HD23 LEU A 79 -55.536 -16.784 7.411 1.00 24.32 H new ATOM 1196 N HIS A 80 -59.754 -13.794 9.413 1.00 75.01 N ATOM 1197 CA HIS A 80 -60.638 -12.762 9.944 1.00 1.10 C ATOM 1198 C HIS A 80 -61.298 -13.226 11.239 1.00 41.42 C ATOM 1199 O HIS A 80 -61.365 -12.478 12.214 1.00 43.25 O ATOM 1200 CB HIS A 80 -61.708 -12.398 8.914 1.00 42.21 C ATOM 1201 CG HIS A 80 -62.691 -11.381 9.406 1.00 54.33 C ATOM 1202 ND1 HIS A 80 -64.034 -11.423 9.100 1.00 50.24 N ATOM 1203 CD2 HIS A 80 -62.518 -10.289 10.188 1.00 45.33 C ATOM 1204 CE1 HIS A 80 -64.646 -10.400 9.672 1.00 33.42 C ATOM 1205 NE2 HIS A 80 -63.748 -9.697 10.338 1.00 55.02 N ATOM 0 H HIS A 80 -59.984 -14.101 8.468 1.00 75.01 H new ATOM 0 HA HIS A 80 -60.037 -11.879 10.160 1.00 1.10 H new ATOM 0 HB2 HIS A 80 -61.222 -12.017 8.016 1.00 42.21 H new ATOM 0 HB3 HIS A 80 -62.246 -13.301 8.626 1.00 42.21 H new ATOM 0 HD2 HIS A 80 -61.586 -9.947 10.614 1.00 45.33 H new ATOM 0 HE1 HIS A 80 -65.701 -10.177 9.606 1.00 33.42 H new ATOM 0 HE2 HIS A 80 -63.937 -8.852 10.876 1.00 55.02 H new ATOM 1213 N ALA A 81 -61.783 -14.462 11.241 1.00 63.15 N ATOM 1214 CA ALA A 81 -62.437 -15.025 12.416 1.00 52.51 C ATOM 1215 C ALA A 81 -61.440 -15.231 13.553 1.00 71.02 C ATOM 1216 O ALA A 81 -61.820 -15.272 14.723 1.00 50.32 O ATOM 1217 CB ALA A 81 -63.117 -16.340 12.063 1.00 34.12 C ATOM 0 H ALA A 81 -61.736 -15.094 10.442 1.00 63.15 H new ATOM 0 HA ALA A 81 -63.194 -14.317 12.754 1.00 52.51 H new ATOM 0 HB1 ALA A 81 -63.601 -16.749 12.950 1.00 34.12 H new ATOM 0 HB2 ALA A 81 -63.865 -16.167 11.289 1.00 34.12 H new ATOM 0 HB3 ALA A 81 -62.373 -17.048 11.697 1.00 34.12 H new ATOM 1223 N ILE A 82 -60.166 -15.360 13.199 1.00 14.21 N ATOM 1224 CA ILE A 82 -59.116 -15.561 14.190 1.00 11.44 C ATOM 1225 C ILE A 82 -58.873 -14.292 15.000 1.00 25.11 C ATOM 1226 O ILE A 82 -58.983 -14.294 16.225 1.00 24.25 O ATOM 1227 CB ILE A 82 -57.794 -15.995 13.529 1.00 54.10 C ATOM 1228 CG1 ILE A 82 -58.046 -17.129 12.532 1.00 55.43 C ATOM 1229 CG2 ILE A 82 -56.789 -16.426 14.587 1.00 73.32 C ATOM 1230 CD1 ILE A 82 -58.709 -18.340 13.150 1.00 45.00 C ATOM 0 H ILE A 82 -59.836 -15.329 12.234 1.00 14.21 H new ATOM 0 HA ILE A 82 -59.458 -16.354 14.855 1.00 11.44 H new ATOM 0 HB ILE A 82 -57.379 -15.145 12.987 1.00 54.10 H new ATOM 0 HG12 ILE A 82 -58.672 -16.757 11.721 1.00 55.43 H new ATOM 0 HG13 ILE A 82 -57.097 -17.431 12.090 1.00 55.43 H new ATOM 0 HG21 ILE A 82 -55.860 -16.730 14.104 1.00 73.32 H new ATOM 0 HG22 ILE A 82 -56.592 -15.593 15.262 1.00 73.32 H new ATOM 0 HG23 ILE A 82 -57.194 -17.264 15.154 1.00 73.32 H new ATOM 0 HD11 ILE A 82 -58.857 -19.103 12.386 1.00 45.00 H new ATOM 0 HD12 ILE A 82 -58.075 -18.738 13.942 1.00 45.00 H new ATOM 0 HD13 ILE A 82 -59.674 -18.053 13.568 1.00 45.00 H new ATOM 1242 N PHE A 83 -58.544 -13.208 14.305 1.00 72.31 N ATOM 1243 CA PHE A 83 -58.287 -11.930 14.959 1.00 63.53 C ATOM 1244 C PHE A 83 -59.590 -11.279 15.413 1.00 3.44 C ATOM 1245 O PHE A 83 -59.606 -10.489 16.356 1.00 52.42 O ATOM 1246 CB PHE A 83 -57.537 -10.991 14.013 1.00 53.14 C ATOM 1247 CG PHE A 83 -56.043 -11.089 14.129 1.00 4.12 C ATOM 1248 CD1 PHE A 83 -55.344 -12.060 13.430 1.00 53.02 C ATOM 1249 CD2 PHE A 83 -55.338 -10.212 14.937 1.00 44.11 C ATOM 1250 CE1 PHE A 83 -53.968 -12.153 13.534 1.00 32.53 C ATOM 1251 CE2 PHE A 83 -53.963 -10.300 15.044 1.00 2.50 C ATOM 1252 CZ PHE A 83 -53.277 -11.273 14.343 1.00 24.31 C ATOM 0 H PHE A 83 -58.449 -13.189 13.290 1.00 72.31 H new ATOM 0 HA PHE A 83 -57.670 -12.118 15.838 1.00 63.53 H new ATOM 0 HB2 PHE A 83 -57.829 -11.214 12.987 1.00 53.14 H new ATOM 0 HB3 PHE A 83 -57.842 -9.964 14.216 1.00 53.14 H new ATOM 0 HD1 PHE A 83 -55.880 -12.752 12.797 1.00 53.02 H new ATOM 0 HD2 PHE A 83 -55.869 -9.451 15.490 1.00 44.11 H new ATOM 0 HE1 PHE A 83 -53.434 -12.913 12.983 1.00 32.53 H new ATOM 0 HE2 PHE A 83 -53.425 -9.608 15.675 1.00 2.50 H new ATOM 0 HZ PHE A 83 -52.203 -11.345 14.428 1.00 24.31 H new ATOM 1262 N GLY A 84 -60.682 -11.619 14.735 1.00 11.45 N ATOM 1263 CA GLY A 84 -61.975 -11.059 15.082 1.00 21.23 C ATOM 1264 C GLY A 84 -62.080 -9.586 14.738 1.00 34.15 C ATOM 1265 O GLY A 84 -62.801 -8.838 15.398 1.00 1.13 O ATOM 0 H GLY A 84 -60.694 -12.272 13.952 1.00 11.45 H new ATOM 0 HA2 GLY A 84 -62.758 -11.608 14.558 1.00 21.23 H new ATOM 0 HA3 GLY A 84 -62.151 -11.193 16.149 1.00 21.23 H new ATOM 1269 N GLU A 85 -61.357 -9.169 13.703 1.00 71.23 N ATOM 1270 CA GLU A 85 -61.371 -7.775 13.276 1.00 3.24 C ATOM 1271 C GLU A 85 -60.597 -7.597 11.973 1.00 45.31 C ATOM 1272 O GLU A 85 -59.417 -7.934 11.888 1.00 43.43 O ATOM 1273 CB GLU A 85 -60.773 -6.879 14.363 1.00 62.14 C ATOM 1274 CG GLU A 85 -61.030 -5.398 14.140 1.00 3.03 C ATOM 1275 CD GLU A 85 -61.068 -4.611 15.437 1.00 22.13 C ATOM 1276 OE1 GLU A 85 -60.087 -4.687 16.206 1.00 62.10 O ATOM 1277 OE2 GLU A 85 -62.078 -3.918 15.681 1.00 0.10 O1- ATOM 0 H GLU A 85 -60.755 -9.776 13.146 1.00 71.23 H new ATOM 0 HA GLU A 85 -62.408 -7.485 13.105 1.00 3.24 H new ATOM 0 HB2 GLU A 85 -61.186 -7.169 15.329 1.00 62.14 H new ATOM 0 HB3 GLU A 85 -59.697 -7.049 14.412 1.00 62.14 H new ATOM 0 HG2 GLU A 85 -60.251 -4.991 13.495 1.00 3.03 H new ATOM 0 HG3 GLU A 85 -61.977 -5.272 13.615 1.00 3.03 H new ATOM 1284 N LYS A 86 -61.272 -7.067 10.959 1.00 0.31 N ATOM 1285 CA LYS A 86 -60.651 -6.843 9.659 1.00 50.23 C ATOM 1286 C LYS A 86 -59.394 -5.988 9.797 1.00 62.42 C ATOM 1287 O LYS A 86 -59.340 -5.077 10.622 1.00 1.22 O ATOM 1288 CB LYS A 86 -61.639 -6.166 8.707 1.00 52.31 C ATOM 1289 CG LYS A 86 -62.990 -6.856 8.641 1.00 22.44 C ATOM 1290 CD LYS A 86 -63.808 -6.370 7.457 1.00 14.40 C ATOM 1291 CE LYS A 86 -64.567 -5.094 7.790 1.00 71.34 C ATOM 1292 NZ LYS A 86 -63.729 -3.880 7.581 1.00 0.31 N1+ ATOM 0 H LYS A 86 -62.251 -6.784 11.013 1.00 0.31 H new ATOM 0 HA LYS A 86 -60.368 -7.812 9.248 1.00 50.23 H new ATOM 0 HB2 LYS A 86 -61.783 -5.132 9.021 1.00 52.31 H new ATOM 0 HB3 LYS A 86 -61.206 -6.137 7.707 1.00 52.31 H new ATOM 0 HG2 LYS A 86 -62.846 -7.934 8.566 1.00 22.44 H new ATOM 0 HG3 LYS A 86 -63.539 -6.671 9.564 1.00 22.44 H new ATOM 0 HD2 LYS A 86 -63.149 -6.192 6.607 1.00 14.40 H new ATOM 0 HD3 LYS A 86 -64.512 -7.146 7.157 1.00 14.40 H new ATOM 0 HE2 LYS A 86 -65.460 -5.030 7.169 1.00 71.34 H new ATOM 0 HE3 LYS A 86 -64.902 -5.130 8.827 1.00 71.34 H new ATOM 0 HZ1 LYS A 86 -63.693 -3.327 8.461 1.00 0.31 H new ATOM 0 HZ2 LYS A 86 -62.766 -4.165 7.311 1.00 0.31 H new ATOM 0 HZ3 LYS A 86 -64.143 -3.299 6.824 1.00 0.31 H new ATOM 1306 N ALA A 87 -58.388 -6.288 8.982 1.00 21.22 N ATOM 1307 CA ALA A 87 -57.134 -5.545 9.011 1.00 63.11 C ATOM 1308 C ALA A 87 -56.677 -5.183 7.601 1.00 4.23 C ATOM 1309 O ALA A 87 -56.751 -6.003 6.686 1.00 21.02 O ATOM 1310 CB ALA A 87 -56.059 -6.350 9.726 1.00 2.10 C ATOM 0 H ALA A 87 -58.417 -7.040 8.294 1.00 21.22 H new ATOM 0 HA ALA A 87 -57.303 -4.618 9.559 1.00 63.11 H new ATOM 0 HB1 ALA A 87 -55.128 -5.783 9.740 1.00 2.10 H new ATOM 0 HB2 ALA A 87 -56.376 -6.552 10.749 1.00 2.10 H new ATOM 0 HB3 ALA A 87 -55.901 -7.293 9.202 1.00 2.10 H new ATOM 1316 N ARG A 88 -56.206 -3.953 7.434 1.00 51.52 N ATOM 1317 CA ARG A 88 -55.739 -3.483 6.135 1.00 72.01 C ATOM 1318 C ARG A 88 -54.364 -4.059 5.811 1.00 43.43 C ATOM 1319 O ARG A 88 -53.504 -4.168 6.685 1.00 52.35 O ATOM 1320 CB ARG A 88 -55.682 -1.954 6.113 1.00 64.15 C ATOM 1321 CG ARG A 88 -55.512 -1.372 4.720 1.00 10.34 C ATOM 1322 CD ARG A 88 -56.780 -1.525 3.894 1.00 52.23 C ATOM 1323 NE ARG A 88 -57.811 -0.570 4.291 1.00 54.25 N ATOM 1324 CZ ARG A 88 -59.081 -0.660 3.912 1.00 53.44 C ATOM 1325 NH1 ARG A 88 -59.475 -1.657 3.131 1.00 14.44 N1+ ATOM 1326 NH2 ARG A 88 -59.961 0.248 4.315 1.00 23.21 N ATOM 0 H ARG A 88 -56.137 -3.263 8.182 1.00 51.52 H new ATOM 0 HA ARG A 88 -56.444 -3.824 5.377 1.00 72.01 H new ATOM 0 HB2 ARG A 88 -56.597 -1.558 6.554 1.00 64.15 H new ATOM 0 HB3 ARG A 88 -54.856 -1.620 6.740 1.00 64.15 H new ATOM 0 HG2 ARG A 88 -55.250 -0.317 4.795 1.00 10.34 H new ATOM 0 HG3 ARG A 88 -54.685 -1.870 4.215 1.00 10.34 H new ATOM 0 HD2 ARG A 88 -56.544 -1.386 2.839 1.00 52.23 H new ATOM 0 HD3 ARG A 88 -57.164 -2.539 4.004 1.00 52.23 H new ATOM 0 HE ARG A 88 -57.541 0.209 4.892 1.00 54.25 H new ATOM 0 HH11 ARG A 88 -58.802 -2.357 2.820 1.00 14.44 H new ATOM 0 HH12 ARG A 88 -60.451 -1.723 2.842 1.00 14.44 H new ATOM 0 HH21 ARG A 88 -59.662 1.016 4.916 1.00 23.21 H new ATOM 0 HH22 ARG A 88 -60.936 0.178 4.023 1.00 23.21 H new ATOM 1340 N GLU A 89 -54.165 -4.427 4.550 1.00 51.11 N ATOM 1341 CA GLU A 89 -52.895 -4.993 4.111 1.00 3.21 C ATOM 1342 C GLU A 89 -52.229 -4.096 3.072 1.00 11.30 C ATOM 1343 O GLU A 89 -52.893 -3.308 2.398 1.00 53.52 O ATOM 1344 CB GLU A 89 -53.109 -6.393 3.530 1.00 74.52 C ATOM 1345 CG GLU A 89 -53.136 -7.490 4.582 1.00 45.43 C ATOM 1346 CD GLU A 89 -51.755 -8.032 4.894 1.00 12.21 C ATOM 1347 OE1 GLU A 89 -51.014 -7.368 5.649 1.00 23.33 O ATOM 1348 OE2 GLU A 89 -51.415 -9.121 4.386 1.00 4.44 O1- ATOM 0 H GLU A 89 -54.867 -4.344 3.814 1.00 51.11 H new ATOM 0 HA GLU A 89 -52.239 -5.063 4.979 1.00 3.21 H new ATOM 0 HB2 GLU A 89 -54.048 -6.408 2.977 1.00 74.52 H new ATOM 0 HB3 GLU A 89 -52.314 -6.606 2.815 1.00 74.52 H new ATOM 0 HG2 GLU A 89 -53.585 -7.101 5.496 1.00 45.43 H new ATOM 0 HG3 GLU A 89 -53.772 -8.305 4.236 1.00 45.43 H new ATOM 1355 N VAL A 90 -50.911 -4.221 2.948 1.00 14.00 N ATOM 1356 CA VAL A 90 -50.155 -3.423 1.991 1.00 43.15 C ATOM 1357 C VAL A 90 -49.208 -4.296 1.174 1.00 34.22 C ATOM 1358 O VAL A 90 -49.108 -5.502 1.400 1.00 14.45 O ATOM 1359 CB VAL A 90 -49.340 -2.324 2.697 1.00 61.31 C ATOM 1360 CG1 VAL A 90 -50.252 -1.198 3.161 1.00 61.42 C ATOM 1361 CG2 VAL A 90 -48.561 -2.906 3.867 1.00 63.51 C ATOM 0 H VAL A 90 -50.345 -4.867 3.498 1.00 14.00 H new ATOM 0 HA VAL A 90 -50.881 -2.956 1.325 1.00 43.15 H new ATOM 0 HB VAL A 90 -48.626 -1.911 1.984 1.00 61.31 H new ATOM 0 HG11 VAL A 90 -49.659 -0.430 3.658 1.00 61.42 H new ATOM 0 HG12 VAL A 90 -50.760 -0.763 2.300 1.00 61.42 H new ATOM 0 HG13 VAL A 90 -50.991 -1.592 3.858 1.00 61.42 H new ATOM 0 HG21 VAL A 90 -47.991 -2.115 4.354 1.00 63.51 H new ATOM 0 HG22 VAL A 90 -49.255 -3.347 4.583 1.00 63.51 H new ATOM 0 HG23 VAL A 90 -47.878 -3.674 3.504 1.00 63.51 H new ATOM 1371 N ARG A 91 -48.513 -3.678 0.225 1.00 25.45 N ATOM 1372 CA ARG A 91 -47.574 -4.399 -0.627 1.00 3.45 C ATOM 1373 C ARG A 91 -46.145 -3.922 -0.385 1.00 15.52 C ATOM 1374 O ARG A 91 -45.859 -2.727 -0.449 1.00 10.53 O ATOM 1375 CB ARG A 91 -47.942 -4.212 -2.100 1.00 35.24 C ATOM 1376 CG ARG A 91 -47.515 -5.371 -2.986 1.00 1.41 C ATOM 1377 CD ARG A 91 -47.722 -5.054 -4.458 1.00 62.05 C ATOM 1378 NE ARG A 91 -47.756 -6.261 -5.279 1.00 32.31 N ATOM 1379 CZ ARG A 91 -46.666 -6.912 -5.673 1.00 62.40 C ATOM 1380 NH1 ARG A 91 -45.465 -6.473 -5.322 1.00 60.23 N1+ ATOM 1381 NH2 ARG A 91 -46.778 -8.003 -6.419 1.00 63.42 N ATOM 0 H ARG A 91 -48.582 -2.680 0.026 1.00 25.45 H new ATOM 0 HA ARG A 91 -47.634 -5.458 -0.376 1.00 3.45 H new ATOM 0 HB2 ARG A 91 -49.021 -4.081 -2.182 1.00 35.24 H new ATOM 0 HB3 ARG A 91 -47.481 -3.295 -2.468 1.00 35.24 H new ATOM 0 HG2 ARG A 91 -46.464 -5.600 -2.806 1.00 1.41 H new ATOM 0 HG3 ARG A 91 -48.085 -6.262 -2.721 1.00 1.41 H new ATOM 0 HD2 ARG A 91 -48.655 -4.505 -4.583 1.00 62.05 H new ATOM 0 HD3 ARG A 91 -46.920 -4.402 -4.805 1.00 62.05 H new ATOM 0 HE ARG A 91 -48.665 -6.624 -5.566 1.00 32.31 H new ATOM 0 HH11 ARG A 91 -45.376 -5.634 -4.749 1.00 60.23 H new ATOM 0 HH12 ARG A 91 -44.630 -6.974 -5.625 1.00 60.23 H new ATOM 0 HH21 ARG A 91 -47.701 -8.343 -6.691 1.00 63.42 H new ATOM 0 HH22 ARG A 91 -45.941 -8.502 -6.721 1.00 63.42 H new ATOM 1395 N ASP A 92 -45.252 -4.866 -0.106 1.00 43.34 N ATOM 1396 CA ASP A 92 -43.852 -4.543 0.145 1.00 22.20 C ATOM 1397 C ASP A 92 -43.160 -4.089 -1.136 1.00 4.24 C ATOM 1398 O ASP A 92 -42.747 -4.911 -1.956 1.00 43.15 O ATOM 1399 CB ASP A 92 -43.125 -5.753 0.731 1.00 42.30 C ATOM 1400 CG ASP A 92 -43.308 -7.001 -0.109 1.00 10.14 C ATOM 1401 OD1 ASP A 92 -44.362 -7.658 0.023 1.00 24.00 O ATOM 1402 OD2 ASP A 92 -42.396 -7.322 -0.899 1.00 53.42 O1- ATOM 0 H ASP A 92 -45.473 -5.860 -0.048 1.00 43.34 H new ATOM 0 HA ASP A 92 -43.817 -3.725 0.864 1.00 22.20 H new ATOM 0 HB2 ASP A 92 -42.062 -5.528 0.816 1.00 42.30 H new ATOM 0 HB3 ASP A 92 -43.493 -5.941 1.740 1.00 42.30 H new ATOM 1407 N THR A 93 -43.037 -2.777 -1.304 1.00 3.24 N ATOM 1408 CA THR A 93 -42.398 -2.214 -2.487 1.00 15.11 C ATOM 1409 C THR A 93 -41.063 -1.568 -2.136 1.00 15.23 C ATOM 1410 O THR A 93 -40.553 -0.730 -2.879 1.00 31.43 O ATOM 1411 CB THR A 93 -43.299 -1.167 -3.168 1.00 51.14 C ATOM 1412 OG1 THR A 93 -43.309 0.043 -2.401 1.00 20.55 O ATOM 1413 CG2 THR A 93 -44.719 -1.690 -3.319 1.00 32.22 C ATOM 0 H THR A 93 -43.372 -2.083 -0.635 1.00 3.24 H new ATOM 0 HA THR A 93 -42.228 -3.040 -3.177 1.00 15.11 H new ATOM 0 HB THR A 93 -42.897 -0.964 -4.161 1.00 51.14 H new ATOM 0 HG1 THR A 93 -44.216 0.415 -2.389 1.00 20.55 H new ATOM 0 HG21 THR A 93 -45.336 -0.933 -3.802 1.00 32.22 H new ATOM 0 HG22 THR A 93 -44.711 -2.594 -3.928 1.00 32.22 H new ATOM 0 HG23 THR A 93 -45.129 -1.918 -2.335 1.00 32.22 H new ATOM 1421 N SER A 94 -40.500 -1.964 -0.998 1.00 41.23 N ATOM 1422 CA SER A 94 -39.225 -1.420 -0.546 1.00 71.52 C ATOM 1423 C SER A 94 -38.081 -1.919 -1.424 1.00 43.33 C ATOM 1424 O SER A 94 -38.260 -2.819 -2.246 1.00 3.02 O ATOM 1425 CB SER A 94 -38.970 -1.806 0.912 1.00 20.52 C ATOM 1426 OG SER A 94 -39.534 -3.072 1.211 1.00 2.23 O ATOM 0 H SER A 94 -40.907 -2.659 -0.373 1.00 41.23 H new ATOM 0 HA SER A 94 -39.273 -0.334 -0.623 1.00 71.52 H new ATOM 0 HB2 SER A 94 -37.897 -1.828 1.103 1.00 20.52 H new ATOM 0 HB3 SER A 94 -39.396 -1.050 1.571 1.00 20.52 H new ATOM 0 HG SER A 94 -39.356 -3.296 2.148 1.00 2.23 H new ATOM 1432 N LEU A 95 -36.905 -1.327 -1.244 1.00 11.13 N ATOM 1433 CA LEU A 95 -35.730 -1.710 -2.019 1.00 34.44 C ATOM 1434 C LEU A 95 -35.142 -3.021 -1.507 1.00 62.22 C ATOM 1435 O LEU A 95 -35.244 -3.336 -0.321 1.00 61.44 O ATOM 1436 CB LEU A 95 -34.673 -0.606 -1.958 1.00 53.31 C ATOM 1437 CG LEU A 95 -33.758 -0.619 -0.733 1.00 14.14 C ATOM 1438 CD1 LEU A 95 -32.490 -1.409 -1.022 1.00 71.33 C ATOM 1439 CD2 LEU A 95 -33.418 0.801 -0.305 1.00 61.44 C ATOM 0 H LEU A 95 -36.740 -0.581 -0.569 1.00 11.13 H new ATOM 0 HA LEU A 95 -36.039 -1.852 -3.054 1.00 34.44 H new ATOM 0 HB2 LEU A 95 -34.052 -0.676 -2.851 1.00 53.31 H new ATOM 0 HB3 LEU A 95 -35.181 0.358 -1.997 1.00 53.31 H new ATOM 0 HG LEU A 95 -34.287 -1.107 0.086 1.00 14.14 H new ATOM 0 HD11 LEU A 95 -31.851 -1.407 -0.139 1.00 71.33 H new ATOM 0 HD12 LEU A 95 -32.751 -2.436 -1.279 1.00 71.33 H new ATOM 0 HD13 LEU A 95 -31.958 -0.951 -1.856 1.00 71.33 H new ATOM 0 HD21 LEU A 95 -32.766 0.772 0.568 1.00 61.44 H new ATOM 0 HD22 LEU A 95 -32.909 1.315 -1.121 1.00 61.44 H new ATOM 0 HD23 LEU A 95 -34.335 1.335 -0.055 1.00 61.44 H new ATOM 1451 N ARG A 96 -34.526 -3.779 -2.407 1.00 22.20 N ATOM 1452 CA ARG A 96 -33.922 -5.056 -2.045 1.00 2.41 C ATOM 1453 C ARG A 96 -32.422 -4.900 -1.814 1.00 14.45 C ATOM 1454 O ARG A 96 -31.690 -4.451 -2.697 1.00 63.30 O ATOM 1455 CB ARG A 96 -34.176 -6.093 -3.141 1.00 44.25 C ATOM 1456 CG ARG A 96 -35.574 -6.686 -3.107 1.00 63.41 C ATOM 1457 CD ARG A 96 -35.683 -7.799 -2.076 1.00 52.41 C ATOM 1458 NE ARG A 96 -36.770 -8.725 -2.383 1.00 50.34 N ATOM 1459 CZ ARG A 96 -38.055 -8.426 -2.226 1.00 2.41 C ATOM 1460 NH1 ARG A 96 -38.412 -7.234 -1.770 1.00 13.23 N1+ ATOM 1461 NH2 ARG A 96 -38.987 -9.322 -2.527 1.00 2.33 N ATOM 0 H ARG A 96 -34.432 -3.532 -3.392 1.00 22.20 H new ATOM 0 HA ARG A 96 -34.382 -5.398 -1.118 1.00 2.41 H new ATOM 0 HB2 ARG A 96 -34.011 -5.629 -4.113 1.00 44.25 H new ATOM 0 HB3 ARG A 96 -33.447 -6.897 -3.044 1.00 44.25 H new ATOM 0 HG2 ARG A 96 -36.297 -5.903 -2.877 1.00 63.41 H new ATOM 0 HG3 ARG A 96 -35.829 -7.075 -4.093 1.00 63.41 H new ATOM 0 HD2 ARG A 96 -34.742 -8.347 -2.033 1.00 52.41 H new ATOM 0 HD3 ARG A 96 -35.845 -7.365 -1.089 1.00 52.41 H new ATOM 0 HE ARG A 96 -36.530 -9.651 -2.737 1.00 50.34 H new ATOM 0 HH11 ARG A 96 -37.699 -6.542 -1.538 1.00 13.23 H new ATOM 0 HH12 ARG A 96 -39.400 -7.008 -1.651 1.00 13.23 H new ATOM 0 HH21 ARG A 96 -38.717 -10.240 -2.879 1.00 2.33 H new ATOM 0 HH22 ARG A 96 -39.973 -9.092 -2.406 1.00 2.33 H new ATOM 1475 N VAL A 97 -31.970 -5.277 -0.623 1.00 32.32 N ATOM 1476 CA VAL A 97 -30.557 -5.180 -0.275 1.00 32.11 C ATOM 1477 C VAL A 97 -29.882 -6.545 -0.337 1.00 2.42 C ATOM 1478 O VAL A 97 -30.383 -7.538 0.191 1.00 4.01 O ATOM 1479 CB VAL A 97 -30.364 -4.587 1.134 1.00 24.41 C ATOM 1480 CG1 VAL A 97 -29.014 -4.992 1.704 1.00 40.42 C ATOM 1481 CG2 VAL A 97 -30.505 -3.073 1.098 1.00 52.15 C ATOM 0 H VAL A 97 -32.562 -5.653 0.118 1.00 32.32 H new ATOM 0 HA VAL A 97 -30.096 -4.516 -1.006 1.00 32.11 H new ATOM 0 HB VAL A 97 -31.141 -4.986 1.787 1.00 24.41 H new ATOM 0 HG11 VAL A 97 -28.896 -4.564 2.699 1.00 40.42 H new ATOM 0 HG12 VAL A 97 -28.957 -6.079 1.767 1.00 40.42 H new ATOM 0 HG13 VAL A 97 -28.220 -4.624 1.054 1.00 40.42 H new ATOM 0 HG21 VAL A 97 -30.366 -2.671 2.101 1.00 52.15 H new ATOM 0 HG22 VAL A 97 -29.752 -2.653 0.431 1.00 52.15 H new ATOM 0 HG23 VAL A 97 -31.498 -2.809 0.736 1.00 52.15 H new ATOM 1491 N PRO A 98 -28.715 -6.599 -0.997 1.00 12.13 N ATOM 1492 CA PRO A 98 -27.944 -7.837 -1.142 1.00 3.14 C ATOM 1493 C PRO A 98 -27.331 -8.297 0.176 1.00 31.21 C ATOM 1494 O PRO A 98 -27.227 -7.522 1.128 1.00 54.31 O ATOM 1495 CB PRO A 98 -26.845 -7.456 -2.137 1.00 5.32 C ATOM 1496 CG PRO A 98 -26.691 -5.982 -1.984 1.00 31.15 C ATOM 1497 CD PRO A 98 -28.058 -5.454 -1.650 1.00 23.22 C ATOM 0 HA PRO A 98 -28.568 -8.668 -1.471 1.00 3.14 H new ATOM 0 HB2 PRO A 98 -25.913 -7.977 -1.916 1.00 5.32 H new ATOM 0 HB3 PRO A 98 -27.125 -7.721 -3.157 1.00 5.32 H new ATOM 0 HG2 PRO A 98 -25.978 -5.744 -1.195 1.00 31.15 H new ATOM 0 HG3 PRO A 98 -26.313 -5.532 -2.902 1.00 31.15 H new ATOM 0 HD2 PRO A 98 -28.004 -4.590 -0.988 1.00 23.22 H new ATOM 0 HD3 PRO A 98 -28.596 -5.138 -2.544 1.00 23.22 H new ATOM 1505 N HIS A 99 -26.929 -9.562 0.226 1.00 2.03 N ATOM 1506 CA HIS A 99 -26.326 -10.126 1.430 1.00 40.20 C ATOM 1507 C HIS A 99 -24.991 -9.452 1.734 1.00 23.32 C ATOM 1508 O HIS A 99 -24.083 -9.447 0.905 1.00 3.54 O ATOM 1509 CB HIS A 99 -26.124 -11.633 1.267 1.00 10.22 C ATOM 1510 CG HIS A 99 -25.329 -12.002 0.053 1.00 63.35 C ATOM 1511 ND1 HIS A 99 -23.962 -12.187 0.075 1.00 22.30 N ATOM 1512 CD2 HIS A 99 -25.715 -12.225 -1.225 1.00 12.11 C ATOM 1513 CE1 HIS A 99 -23.542 -12.504 -1.137 1.00 51.45 C ATOM 1514 NE2 HIS A 99 -24.587 -12.535 -1.944 1.00 54.33 N ATOM 0 H HIS A 99 -27.009 -10.217 -0.552 1.00 2.03 H new ATOM 0 HA HIS A 99 -27.003 -9.946 2.265 1.00 40.20 H new ATOM 0 HB2 HIS A 99 -25.621 -12.022 2.153 1.00 10.22 H new ATOM 0 HB3 HIS A 99 -27.099 -12.118 1.215 1.00 10.22 H new ATOM 0 HD2 HIS A 99 -26.723 -12.169 -1.608 1.00 12.11 H new ATOM 0 HE1 HIS A 99 -22.519 -12.704 -1.419 1.00 51.45 H new ATOM 0 HE2 HIS A 99 -24.560 -12.754 -2.940 1.00 54.33 H new ATOM 1522 N GLY A 100 -24.881 -8.883 2.932 1.00 52.11 N ATOM 1523 CA GLY A 100 -23.656 -8.214 3.325 1.00 34.40 C ATOM 1524 C GLY A 100 -23.595 -6.781 2.835 1.00 32.53 C ATOM 1525 O GLY A 100 -23.322 -5.863 3.608 1.00 13.43 O ATOM 0 H GLY A 100 -25.619 -8.874 3.636 1.00 52.11 H new ATOM 0 HA2 GLY A 100 -23.571 -8.227 4.412 1.00 34.40 H new ATOM 0 HA3 GLY A 100 -22.802 -8.766 2.932 1.00 34.40 H new ATOM 1529 N GLY A 101 -23.848 -6.587 1.544 1.00 3.44 N ATOM 1530 CA GLY A 101 -23.814 -5.253 0.973 1.00 63.32 C ATOM 1531 C GLY A 101 -22.429 -4.860 0.498 1.00 13.11 C ATOM 1532 O GLY A 101 -22.285 -4.156 -0.500 1.00 41.12 O ATOM 0 H GLY A 101 -24.076 -7.330 0.883 1.00 3.44 H new ATOM 0 HA2 GLY A 101 -24.510 -5.202 0.136 1.00 63.32 H new ATOM 0 HA3 GLY A 101 -24.157 -4.534 1.717 1.00 63.32 H new ATOM 1536 N GLY A 102 -21.408 -5.317 1.216 1.00 35.30 N ATOM 1537 CA GLY A 102 -20.041 -4.997 0.847 1.00 42.33 C ATOM 1538 C GLY A 102 -19.439 -3.922 1.730 1.00 11.11 C ATOM 1539 O GLY A 102 -18.265 -3.990 2.091 1.00 65.03 O ATOM 0 H GLY A 102 -21.502 -5.903 2.046 1.00 35.30 H new ATOM 0 HA2 GLY A 102 -19.431 -5.898 0.909 1.00 42.33 H new ATOM 0 HA3 GLY A 102 -20.016 -4.666 -0.191 1.00 42.33 H new ATOM 1543 N GLY A 103 -20.245 -2.923 2.077 1.00 42.51 N ATOM 1544 CA GLY A 103 -19.766 -1.841 2.918 1.00 70.24 C ATOM 1545 C GLY A 103 -20.731 -1.507 4.039 1.00 14.31 C ATOM 1546 O GLY A 103 -21.579 -2.325 4.400 1.00 75.45 O ATOM 0 H GLY A 103 -21.221 -2.844 1.791 1.00 42.51 H new ATOM 0 HA2 GLY A 103 -18.801 -2.116 3.343 1.00 70.24 H new ATOM 0 HA3 GLY A 103 -19.604 -0.954 2.306 1.00 70.24 H new ATOM 1550 N ILE A 104 -20.602 -0.306 4.590 1.00 10.42 N ATOM 1551 CA ILE A 104 -21.469 0.132 5.676 1.00 73.30 C ATOM 1552 C ILE A 104 -22.099 1.486 5.364 1.00 61.32 C ATOM 1553 O ILE A 104 -21.505 2.314 4.673 1.00 74.25 O ATOM 1554 CB ILE A 104 -20.699 0.231 7.006 1.00 31.42 C ATOM 1555 CG1 ILE A 104 -19.973 -1.083 7.299 1.00 73.31 C ATOM 1556 CG2 ILE A 104 -21.648 0.583 8.143 1.00 75.13 C ATOM 1557 CD1 ILE A 104 -19.041 -1.006 8.489 1.00 42.35 C ATOM 0 H ILE A 104 -19.905 0.381 4.302 1.00 10.42 H new ATOM 0 HA ILE A 104 -22.254 -0.618 5.775 1.00 73.30 H new ATOM 0 HB ILE A 104 -19.956 1.024 6.920 1.00 31.42 H new ATOM 0 HG12 ILE A 104 -20.711 -1.865 7.476 1.00 73.31 H new ATOM 0 HG13 ILE A 104 -19.402 -1.377 6.419 1.00 73.31 H new ATOM 0 HG21 ILE A 104 -21.089 0.649 9.076 1.00 75.13 H new ATOM 0 HG22 ILE A 104 -22.124 1.542 7.936 1.00 75.13 H new ATOM 0 HG23 ILE A 104 -22.412 -0.190 8.232 1.00 75.13 H new ATOM 0 HD11 ILE A 104 -18.561 -1.973 8.638 1.00 42.35 H new ATOM 0 HD12 ILE A 104 -18.280 -0.247 8.307 1.00 42.35 H new ATOM 0 HD13 ILE A 104 -19.610 -0.742 9.380 1.00 42.35 H new ATOM 1569 N ILE A 105 -23.304 1.705 5.880 1.00 72.41 N ATOM 1570 CA ILE A 105 -24.012 2.960 5.659 1.00 11.13 C ATOM 1571 C ILE A 105 -23.280 4.127 6.310 1.00 43.31 C ATOM 1572 O ILE A 105 -23.346 4.317 7.525 1.00 71.54 O ATOM 1573 CB ILE A 105 -25.449 2.899 6.210 1.00 21.24 C ATOM 1574 CG1 ILE A 105 -26.169 1.656 5.683 1.00 33.43 C ATOM 1575 CG2 ILE A 105 -26.214 4.159 5.835 1.00 13.51 C ATOM 1576 CD1 ILE A 105 -26.377 1.667 4.184 1.00 11.11 C ATOM 0 H ILE A 105 -23.810 1.030 6.454 1.00 72.41 H new ATOM 0 HA ILE A 105 -24.050 3.115 4.581 1.00 11.13 H new ATOM 0 HB ILE A 105 -25.403 2.835 7.297 1.00 21.24 H new ATOM 0 HG12 ILE A 105 -25.594 0.771 5.955 1.00 33.43 H new ATOM 0 HG13 ILE A 105 -27.138 1.571 6.175 1.00 33.43 H new ATOM 0 HG21 ILE A 105 -27.228 4.101 6.231 1.00 13.51 H new ATOM 0 HG22 ILE A 105 -25.710 5.029 6.255 1.00 13.51 H new ATOM 0 HG23 ILE A 105 -26.254 4.251 4.750 1.00 13.51 H new ATOM 0 HD11 ILE A 105 -26.893 0.756 3.882 1.00 11.11 H new ATOM 0 HD12 ILE A 105 -26.978 2.533 3.906 1.00 11.11 H new ATOM 0 HD13 ILE A 105 -25.410 1.720 3.683 1.00 11.11 H new ATOM 1588 N HIS A 106 -22.581 4.910 5.495 1.00 44.11 N ATOM 1589 CA HIS A 106 -21.837 6.061 5.991 1.00 34.34 C ATOM 1590 C HIS A 106 -22.554 7.363 5.642 1.00 52.02 C ATOM 1591 O HIS A 106 -22.399 8.372 6.330 1.00 2.51 O ATOM 1592 CB HIS A 106 -20.423 6.072 5.408 1.00 22.33 C ATOM 1593 CG HIS A 106 -19.516 7.073 6.054 1.00 1.11 C ATOM 1594 ND1 HIS A 106 -18.879 6.848 7.256 1.00 2.12 N ATOM 1595 CD2 HIS A 106 -19.139 8.311 5.658 1.00 44.21 C ATOM 1596 CE1 HIS A 106 -18.151 7.903 7.571 1.00 70.15 C ATOM 1597 NE2 HIS A 106 -18.292 8.806 6.618 1.00 4.01 N ATOM 0 H HIS A 106 -22.514 4.768 4.487 1.00 44.11 H new ATOM 0 HA HIS A 106 -21.774 5.981 7.076 1.00 34.34 H new ATOM 0 HB2 HIS A 106 -19.988 5.078 5.514 1.00 22.33 H new ATOM 0 HB3 HIS A 106 -20.481 6.283 4.340 1.00 22.33 H new ATOM 0 HD2 HIS A 106 -19.447 8.816 4.754 1.00 44.21 H new ATOM 0 HE1 HIS A 106 -17.543 8.010 8.457 1.00 70.15 H new ATOM 0 HE2 HIS A 106 -17.844 9.722 6.598 1.00 4.01 H new ATOM 1605 N ASP A 107 -23.336 7.332 4.568 1.00 2.53 N ATOM 1606 CA ASP A 107 -24.077 8.509 4.129 1.00 2.33 C ATOM 1607 C ASP A 107 -25.457 8.118 3.608 1.00 53.53 C ATOM 1608 O ASP A 107 -25.634 7.046 3.032 1.00 42.21 O ATOM 1609 CB ASP A 107 -23.298 9.249 3.040 1.00 13.01 C ATOM 1610 CG ASP A 107 -23.319 10.753 3.235 1.00 51.05 C ATOM 1611 OD1 ASP A 107 -23.005 11.211 4.354 1.00 40.31 O ATOM 1612 OD2 ASP A 107 -23.648 11.471 2.269 1.00 71.12 O1- ATOM 0 H ASP A 107 -23.473 6.506 3.986 1.00 2.53 H new ATOM 0 HA ASP A 107 -24.206 9.170 4.986 1.00 2.33 H new ATOM 0 HB2 ASP A 107 -22.265 8.900 3.035 1.00 13.01 H new ATOM 0 HB3 ASP A 107 -23.721 9.006 2.065 1.00 13.01 H new ATOM 1617 N VAL A 108 -26.432 8.998 3.816 1.00 40.23 N ATOM 1618 CA VAL A 108 -27.797 8.746 3.368 1.00 11.03 C ATOM 1619 C VAL A 108 -28.515 10.048 3.034 1.00 62.13 C ATOM 1620 O VAL A 108 -28.678 10.918 3.890 1.00 23.34 O ATOM 1621 CB VAL A 108 -28.606 7.986 4.435 1.00 20.20 C ATOM 1622 CG1 VAL A 108 -30.035 7.765 3.965 1.00 12.41 C ATOM 1623 CG2 VAL A 108 -27.936 6.662 4.770 1.00 33.40 C ATOM 0 H VAL A 108 -26.302 9.891 4.292 1.00 40.23 H new ATOM 0 HA VAL A 108 -27.727 8.132 2.470 1.00 11.03 H new ATOM 0 HB VAL A 108 -28.636 8.591 5.341 1.00 20.20 H new ATOM 0 HG11 VAL A 108 -30.591 7.226 4.732 1.00 12.41 H new ATOM 0 HG12 VAL A 108 -30.511 8.728 3.781 1.00 12.41 H new ATOM 0 HG13 VAL A 108 -30.029 7.182 3.044 1.00 12.41 H new ATOM 0 HG21 VAL A 108 -28.522 6.139 5.526 1.00 33.40 H new ATOM 0 HG22 VAL A 108 -27.873 6.049 3.871 1.00 33.40 H new ATOM 0 HG23 VAL A 108 -26.933 6.849 5.153 1.00 33.40 H new ATOM 1633 N LYS A 109 -28.942 10.177 1.783 1.00 73.05 N ATOM 1634 CA LYS A 109 -29.646 11.373 1.333 1.00 64.22 C ATOM 1635 C LYS A 109 -31.150 11.129 1.273 1.00 55.52 C ATOM 1636 O LYS A 109 -31.599 10.037 0.927 1.00 53.24 O ATOM 1637 CB LYS A 109 -29.133 11.803 -0.043 1.00 5.12 C ATOM 1638 CG LYS A 109 -27.965 12.773 0.020 1.00 4.01 C ATOM 1639 CD LYS A 109 -28.441 14.217 0.057 1.00 43.23 C ATOM 1640 CE LYS A 109 -27.311 15.166 0.427 1.00 25.43 C ATOM 1641 NZ LYS A 109 -27.741 16.591 0.363 1.00 11.23 N1+ ATOM 0 H LYS A 109 -28.813 9.468 1.061 1.00 73.05 H new ATOM 0 HA LYS A 109 -29.454 12.170 2.052 1.00 64.22 H new ATOM 0 HB2 LYS A 109 -28.830 10.918 -0.602 1.00 5.12 H new ATOM 0 HB3 LYS A 109 -29.949 12.266 -0.598 1.00 5.12 H new ATOM 0 HG2 LYS A 109 -27.364 12.564 0.905 1.00 4.01 H new ATOM 0 HG3 LYS A 109 -27.320 12.624 -0.846 1.00 4.01 H new ATOM 0 HD2 LYS A 109 -28.846 14.493 -0.917 1.00 43.23 H new ATOM 0 HD3 LYS A 109 -29.252 14.316 0.779 1.00 43.23 H new ATOM 0 HE2 LYS A 109 -26.959 14.937 1.433 1.00 25.43 H new ATOM 0 HE3 LYS A 109 -26.470 15.010 -0.248 1.00 25.43 H new ATOM 0 HZ1 LYS A 109 -26.943 17.206 0.622 1.00 11.23 H new ATOM 0 HZ2 LYS A 109 -28.053 16.816 -0.603 1.00 11.23 H new ATOM 0 HZ3 LYS A 109 -28.527 16.746 1.026 1.00 11.23 H new ATOM 1655 N VAL A 110 -31.925 12.156 1.611 1.00 33.40 N ATOM 1656 CA VAL A 110 -33.379 12.054 1.592 1.00 62.24 C ATOM 1657 C VAL A 110 -34.019 13.386 1.221 1.00 62.33 C ATOM 1658 O VAL A 110 -33.804 14.398 1.888 1.00 72.31 O ATOM 1659 CB VAL A 110 -33.927 11.597 2.958 1.00 4.52 C ATOM 1660 CG1 VAL A 110 -33.441 12.521 4.064 1.00 44.34 C ATOM 1661 CG2 VAL A 110 -35.446 11.538 2.929 1.00 54.34 C ATOM 0 H VAL A 110 -31.570 13.067 1.901 1.00 33.40 H new ATOM 0 HA VAL A 110 -33.634 11.309 0.838 1.00 62.24 H new ATOM 0 HB VAL A 110 -33.552 10.595 3.164 1.00 4.52 H new ATOM 0 HG11 VAL A 110 -33.838 12.183 5.021 1.00 44.34 H new ATOM 0 HG12 VAL A 110 -32.352 12.507 4.097 1.00 44.34 H new ATOM 0 HG13 VAL A 110 -33.785 13.536 3.867 1.00 44.34 H new ATOM 0 HG21 VAL A 110 -35.816 11.214 3.902 1.00 54.34 H new ATOM 0 HG22 VAL A 110 -35.844 12.527 2.701 1.00 54.34 H new ATOM 0 HG23 VAL A 110 -35.768 10.831 2.164 1.00 54.34 H new ATOM 1671 N PHE A 111 -34.808 13.379 0.150 1.00 31.14 N ATOM 1672 CA PHE A 111 -35.479 14.588 -0.312 1.00 61.30 C ATOM 1673 C PHE A 111 -36.991 14.465 -0.152 1.00 14.04 C ATOM 1674 O PHE A 111 -37.561 13.391 -0.342 1.00 54.20 O ATOM 1675 CB PHE A 111 -35.131 14.862 -1.777 1.00 25.34 C ATOM 1676 CG PHE A 111 -33.666 14.723 -2.080 1.00 21.54 C ATOM 1677 CD1 PHE A 111 -32.727 15.465 -1.382 1.00 61.01 C ATOM 1678 CD2 PHE A 111 -33.230 13.852 -3.065 1.00 34.24 C ATOM 1679 CE1 PHE A 111 -31.379 15.339 -1.659 1.00 62.23 C ATOM 1680 CE2 PHE A 111 -31.882 13.722 -3.345 1.00 44.30 C ATOM 1681 CZ PHE A 111 -30.956 14.467 -2.643 1.00 45.00 C ATOM 0 H PHE A 111 -34.998 12.550 -0.413 1.00 31.14 H new ATOM 0 HA PHE A 111 -35.133 15.422 0.299 1.00 61.30 H new ATOM 0 HB2 PHE A 111 -35.692 14.175 -2.410 1.00 25.34 H new ATOM 0 HB3 PHE A 111 -35.454 15.870 -2.037 1.00 25.34 H new ATOM 0 HD1 PHE A 111 -33.052 16.150 -0.613 1.00 61.01 H new ATOM 0 HD2 PHE A 111 -33.950 13.269 -3.620 1.00 34.24 H new ATOM 0 HE1 PHE A 111 -30.657 15.922 -1.107 1.00 62.23 H new ATOM 0 HE2 PHE A 111 -31.554 13.037 -4.113 1.00 44.30 H new ATOM 0 HZ PHE A 111 -29.903 14.368 -2.863 1.00 45.00 H new ATOM 1691 N ASN A 112 -37.635 15.573 0.201 1.00 50.25 N ATOM 1692 CA ASN A 112 -39.081 15.590 0.389 1.00 72.43 C ATOM 1693 C ASN A 112 -39.719 16.733 -0.397 1.00 13.34 C ATOM 1694 O ASN A 112 -39.236 17.865 -0.367 1.00 60.11 O ATOM 1695 CB ASN A 112 -39.422 15.724 1.874 1.00 64.11 C ATOM 1696 CG ASN A 112 -39.603 14.379 2.550 1.00 42.02 C ATOM 1697 OD1 ASN A 112 -38.942 13.402 2.200 1.00 74.51 O ATOM 1698 ND2 ASN A 112 -40.502 14.324 3.526 1.00 45.40 N ATOM 0 H ASN A 112 -37.178 16.471 0.363 1.00 50.25 H new ATOM 0 HA ASN A 112 -39.482 14.648 0.015 1.00 72.43 H new ATOM 0 HB2 ASN A 112 -38.629 16.277 2.378 1.00 64.11 H new ATOM 0 HB3 ASN A 112 -40.336 16.308 1.983 1.00 64.11 H new ATOM 0 HD21 ASN A 112 -40.667 13.446 4.019 1.00 45.40 H new ATOM 0 HD22 ASN A 112 -41.027 15.160 3.783 1.00 45.40 H new ATOM 1705 N ARG A 113 -40.805 16.427 -1.098 1.00 20.34 N ATOM 1706 CA ARG A 113 -41.509 17.428 -1.892 1.00 53.42 C ATOM 1707 C ARG A 113 -41.878 18.637 -1.038 1.00 54.43 C ATOM 1708 O ARG A 113 -41.949 19.760 -1.535 1.00 33.44 O ATOM 1709 CB ARG A 113 -42.769 16.823 -2.512 1.00 52.52 C ATOM 1710 CG ARG A 113 -43.663 16.114 -1.508 1.00 1.01 C ATOM 1711 CD ARG A 113 -44.896 15.527 -2.177 1.00 10.22 C ATOM 1712 NE ARG A 113 -45.582 14.567 -1.315 1.00 43.12 N ATOM 1713 CZ ARG A 113 -46.356 14.919 -0.295 1.00 21.52 C ATOM 1714 NH1 ARG A 113 -46.544 16.200 -0.010 1.00 31.21 N1+ ATOM 1715 NH2 ARG A 113 -46.946 13.987 0.443 1.00 54.41 N ATOM 0 H ARG A 113 -41.217 15.495 -1.133 1.00 20.34 H new ATOM 0 HA ARG A 113 -40.843 17.758 -2.689 1.00 53.42 H new ATOM 0 HB2 ARG A 113 -43.340 17.614 -2.999 1.00 52.52 H new ATOM 0 HB3 ARG A 113 -42.478 16.116 -3.289 1.00 52.52 H new ATOM 0 HG2 ARG A 113 -43.101 15.320 -1.017 1.00 1.01 H new ATOM 0 HG3 ARG A 113 -43.968 16.816 -0.732 1.00 1.01 H new ATOM 0 HD2 ARG A 113 -45.582 16.331 -2.442 1.00 10.22 H new ATOM 0 HD3 ARG A 113 -44.606 15.037 -3.106 1.00 10.22 H new ATOM 0 HE ARG A 113 -45.460 13.573 -1.507 1.00 43.12 H new ATOM 0 HH11 ARG A 113 -46.093 16.920 -0.575 1.00 31.21 H new ATOM 0 HH12 ARG A 113 -47.139 16.466 0.774 1.00 31.21 H new ATOM 0 HH21 ARG A 113 -46.805 13.000 0.227 1.00 54.41 H new ATOM 0 HH22 ARG A 113 -47.540 14.257 1.226 1.00 54.41 H new ATOM 1729 N GLU A 114 -42.113 18.398 0.249 1.00 1.14 N ATOM 1730 CA GLU A 114 -42.477 19.467 1.170 1.00 4.11 C ATOM 1731 C GLU A 114 -41.391 20.539 1.216 1.00 41.23 C ATOM 1732 O GLU A 114 -41.674 21.715 1.445 1.00 33.03 O ATOM 1733 CB GLU A 114 -42.712 18.904 2.573 1.00 54.33 C ATOM 1734 CG GLU A 114 -44.037 18.175 2.722 1.00 44.41 C ATOM 1735 CD GLU A 114 -44.057 17.237 3.914 1.00 52.21 C ATOM 1736 OE1 GLU A 114 -44.396 17.698 5.024 1.00 71.42 O ATOM 1737 OE2 GLU A 114 -43.732 16.045 3.737 1.00 73.01 O1- ATOM 0 H GLU A 114 -42.058 17.474 0.676 1.00 1.14 H new ATOM 0 HA GLU A 114 -43.399 19.923 0.810 1.00 4.11 H new ATOM 0 HB2 GLU A 114 -41.901 18.220 2.821 1.00 54.33 H new ATOM 0 HB3 GLU A 114 -42.673 19.720 3.294 1.00 54.33 H new ATOM 0 HG2 GLU A 114 -44.839 18.905 2.826 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -44.239 17.607 1.814 1.00 44.41 H new ATOM 1744 N ASP A 115 -40.148 20.123 0.997 1.00 61.31 N ATOM 1745 CA ASP A 115 -39.020 21.046 1.012 1.00 32.24 C ATOM 1746 C ASP A 115 -39.007 21.911 -0.244 1.00 43.43 C ATOM 1747 O ASP A 115 -38.412 22.987 -0.264 1.00 43.12 O ATOM 1748 CB ASP A 115 -37.704 20.274 1.129 1.00 53.53 C ATOM 1749 CG ASP A 115 -36.615 21.085 1.803 1.00 13.43 C ATOM 1750 OD1 ASP A 115 -36.954 22.007 2.574 1.00 74.43 O ATOM 1751 OD2 ASP A 115 -35.424 20.798 1.560 1.00 32.32 O1- ATOM 0 H ASP A 115 -39.897 19.153 0.807 1.00 61.31 H new ATOM 0 HA ASP A 115 -39.128 21.699 1.878 1.00 32.24 H new ATOM 0 HB2 ASP A 115 -37.873 19.357 1.694 1.00 53.53 H new ATOM 0 HB3 ASP A 115 -37.370 19.978 0.134 1.00 53.53 H new ATOM 1756 N GLY A 116 -39.668 21.431 -1.293 1.00 54.51 N ATOM 1757 CA GLY A 116 -39.720 22.172 -2.540 1.00 23.20 C ATOM 1758 C GLY A 116 -38.879 21.535 -3.628 1.00 2.22 C ATOM 1759 O GLY A 116 -38.488 22.199 -4.588 1.00 55.14 O ATOM 0 H GLY A 116 -40.168 20.542 -1.302 1.00 54.51 H new ATOM 0 HA2 GLY A 116 -40.755 22.238 -2.877 1.00 23.20 H new ATOM 0 HA3 GLY A 116 -39.375 23.191 -2.368 1.00 23.20 H new ATOM 1763 N ASP A 117 -38.599 20.245 -3.478 1.00 71.14 N ATOM 1764 CA ASP A 117 -37.797 19.518 -4.456 1.00 22.33 C ATOM 1765 C ASP A 117 -38.687 18.849 -5.499 1.00 23.13 C ATOM 1766 O ASP A 117 -39.400 17.892 -5.198 1.00 55.15 O ATOM 1767 CB ASP A 117 -36.931 18.468 -3.758 1.00 15.40 C ATOM 1768 CG ASP A 117 -35.613 19.035 -3.271 1.00 11.35 C ATOM 1769 OD1 ASP A 117 -34.846 19.557 -4.108 1.00 73.13 O ATOM 1770 OD2 ASP A 117 -35.347 18.958 -2.053 1.00 42.23 O1- ATOM 0 H ASP A 117 -38.915 19.681 -2.689 1.00 71.14 H new ATOM 0 HA ASP A 117 -37.149 20.234 -4.962 1.00 22.33 H new ATOM 0 HB2 ASP A 117 -37.479 18.053 -2.912 1.00 15.40 H new ATOM 0 HB3 ASP A 117 -36.737 17.645 -4.446 1.00 15.40 H new ATOM 1775 N GLU A 118 -38.641 19.362 -6.724 1.00 12.24 N ATOM 1776 CA GLU A 118 -39.446 18.815 -7.811 1.00 23.12 C ATOM 1777 C GLU A 118 -39.135 17.337 -8.027 1.00 62.43 C ATOM 1778 O GLU A 118 -37.989 16.906 -7.895 1.00 43.24 O ATOM 1779 CB GLU A 118 -39.196 19.595 -9.103 1.00 34.24 C ATOM 1780 CG GLU A 118 -40.041 19.121 -10.273 1.00 62.21 C ATOM 1781 CD GLU A 118 -39.673 19.806 -11.575 1.00 42.54 C ATOM 1782 OE1 GLU A 118 -38.474 19.809 -11.926 1.00 52.30 O ATOM 1783 OE2 GLU A 118 -40.583 20.339 -12.244 1.00 0.43 O1- ATOM 0 H GLU A 118 -38.056 20.154 -6.989 1.00 12.24 H new ATOM 0 HA GLU A 118 -40.496 18.911 -7.535 1.00 23.12 H new ATOM 0 HB2 GLU A 118 -39.397 20.651 -8.925 1.00 34.24 H new ATOM 0 HB3 GLU A 118 -38.142 19.512 -9.369 1.00 34.24 H new ATOM 0 HG2 GLU A 118 -39.923 18.043 -10.388 1.00 62.21 H new ATOM 0 HG3 GLU A 118 -41.093 19.305 -10.055 1.00 62.21 H new ATOM 1790 N LEU A 119 -40.164 16.565 -8.360 1.00 53.45 N ATOM 1791 CA LEU A 119 -40.002 15.134 -8.594 1.00 44.14 C ATOM 1792 C LEU A 119 -40.761 14.697 -9.843 1.00 13.41 C ATOM 1793 O LEU A 119 -41.691 15.363 -10.298 1.00 3.34 O ATOM 1794 CB LEU A 119 -40.492 14.339 -7.382 1.00 54.15 C ATOM 1795 CG LEU A 119 -39.505 14.208 -6.222 1.00 4.14 C ATOM 1796 CD1 LEU A 119 -40.230 13.808 -4.946 1.00 75.22 C ATOM 1797 CD2 LEU A 119 -38.418 13.196 -6.558 1.00 64.10 C ATOM 0 H LEU A 119 -41.119 16.906 -8.474 1.00 53.45 H new ATOM 0 HA LEU A 119 -38.941 14.934 -8.747 1.00 44.14 H new ATOM 0 HB2 LEU A 119 -41.401 14.809 -7.008 1.00 54.15 H new ATOM 0 HB3 LEU A 119 -40.765 13.338 -7.715 1.00 54.15 H new ATOM 0 HG LEU A 119 -39.035 15.178 -6.060 1.00 4.14 H new ATOM 0 HD11 LEU A 119 -39.511 13.720 -4.131 1.00 75.22 H new ATOM 0 HD12 LEU A 119 -40.971 14.567 -4.695 1.00 75.22 H new ATOM 0 HD13 LEU A 119 -40.728 12.850 -5.096 1.00 75.22 H new ATOM 0 HD21 LEU A 119 -37.724 13.116 -5.721 1.00 64.10 H new ATOM 0 HD22 LEU A 119 -38.872 12.223 -6.747 1.00 64.10 H new ATOM 0 HD23 LEU A 119 -37.878 13.523 -7.446 1.00 64.10 H new ATOM 1809 N PRO A 120 -40.358 13.550 -10.410 1.00 20.10 N ATOM 1810 CA PRO A 120 -40.988 12.997 -11.613 1.00 0.40 C ATOM 1811 C PRO A 120 -42.398 12.483 -11.344 1.00 11.03 C ATOM 1812 O PRO A 120 -42.824 12.338 -10.197 1.00 42.43 O ATOM 1813 CB PRO A 120 -40.062 11.843 -11.999 1.00 45.01 C ATOM 1814 CG PRO A 120 -39.402 11.443 -10.725 1.00 75.10 C ATOM 1815 CD PRO A 120 -39.255 12.705 -9.921 1.00 64.30 C ATOM 0 HA PRO A 120 -41.104 13.748 -12.395 1.00 0.40 H new ATOM 0 HB2 PRO A 120 -40.622 11.014 -12.432 1.00 45.01 H new ATOM 0 HB3 PRO A 120 -39.329 12.155 -12.743 1.00 45.01 H new ATOM 0 HG2 PRO A 120 -40.001 10.707 -10.189 1.00 75.10 H new ATOM 0 HG3 PRO A 120 -38.431 10.986 -10.915 1.00 75.10 H new ATOM 0 HD2 PRO A 120 -39.340 12.513 -8.851 1.00 64.30 H new ATOM 0 HD3 PRO A 120 -38.285 13.175 -10.084 1.00 64.30 H new ATOM 1823 N PRO A 121 -43.141 12.198 -12.423 1.00 13.45 N ATOM 1824 CA PRO A 121 -44.514 11.695 -12.328 1.00 63.41 C ATOM 1825 C PRO A 121 -44.572 10.268 -11.792 1.00 74.12 C ATOM 1826 O PRO A 121 -43.968 9.357 -12.356 1.00 70.11 O ATOM 1827 CB PRO A 121 -45.010 11.741 -13.777 1.00 51.31 C ATOM 1828 CG PRO A 121 -43.774 11.647 -14.603 1.00 10.41 C ATOM 1829 CD PRO A 121 -42.698 12.347 -13.820 1.00 53.13 C ATOM 0 HA PRO A 121 -45.117 12.284 -11.637 1.00 63.41 H new ATOM 0 HB2 PRO A 121 -45.691 10.917 -13.989 1.00 51.31 H new ATOM 0 HB3 PRO A 121 -45.553 12.664 -13.981 1.00 51.31 H new ATOM 0 HG2 PRO A 121 -43.507 10.607 -14.789 1.00 10.41 H new ATOM 0 HG3 PRO A 121 -43.918 12.118 -15.575 1.00 10.41 H new ATOM 0 HD2 PRO A 121 -41.721 11.891 -13.983 1.00 53.13 H new ATOM 0 HD3 PRO A 121 -42.612 13.396 -14.105 1.00 53.13 H new ATOM 1837 N GLY A 122 -45.305 10.082 -10.698 1.00 43.21 N ATOM 1838 CA GLY A 122 -45.429 8.764 -10.103 1.00 45.50 C ATOM 1839 C GLY A 122 -44.613 8.622 -8.834 1.00 61.31 C ATOM 1840 O GLY A 122 -44.794 7.670 -8.075 1.00 64.21 O ATOM 0 H GLY A 122 -45.815 10.821 -10.213 1.00 43.21 H new ATOM 0 HA2 GLY A 122 -46.478 8.566 -9.881 1.00 45.50 H new ATOM 0 HA3 GLY A 122 -45.108 8.012 -10.824 1.00 45.50 H new ATOM 1844 N VAL A 123 -43.710 9.570 -8.603 1.00 20.12 N ATOM 1845 CA VAL A 123 -42.862 9.546 -7.417 1.00 30.11 C ATOM 1846 C VAL A 123 -43.315 10.586 -6.398 1.00 42.43 C ATOM 1847 O VAL A 123 -43.693 11.699 -6.758 1.00 35.02 O ATOM 1848 CB VAL A 123 -41.387 9.802 -7.776 1.00 72.33 C ATOM 1849 CG1 VAL A 123 -40.529 9.833 -6.521 1.00 14.23 C ATOM 1850 CG2 VAL A 123 -40.884 8.746 -8.749 1.00 34.10 C ATOM 0 H VAL A 123 -43.547 10.364 -9.222 1.00 20.12 H new ATOM 0 HA VAL A 123 -42.953 8.551 -6.982 1.00 30.11 H new ATOM 0 HB VAL A 123 -41.314 10.775 -8.261 1.00 72.33 H new ATOM 0 HG11 VAL A 123 -39.490 10.015 -6.795 1.00 14.23 H new ATOM 0 HG12 VAL A 123 -40.876 10.630 -5.863 1.00 14.23 H new ATOM 0 HG13 VAL A 123 -40.606 8.876 -6.004 1.00 14.23 H new ATOM 0 HG21 VAL A 123 -39.840 8.943 -8.992 1.00 34.10 H new ATOM 0 HG22 VAL A 123 -40.971 7.760 -8.293 1.00 34.10 H new ATOM 0 HG23 VAL A 123 -41.481 8.778 -9.661 1.00 34.10 H new ATOM 1860 N ASN A 124 -43.271 10.215 -5.122 1.00 33.12 N ATOM 1861 CA ASN A 124 -43.675 11.116 -4.049 1.00 53.53 C ATOM 1862 C ASN A 124 -42.468 11.567 -3.233 1.00 53.12 C ATOM 1863 O ASN A 124 -42.429 12.691 -2.734 1.00 73.13 O ATOM 1864 CB ASN A 124 -44.695 10.430 -3.137 1.00 43.21 C ATOM 1865 CG ASN A 124 -46.053 10.284 -3.795 1.00 42.43 C ATOM 1866 OD1 ASN A 124 -46.412 11.058 -4.682 1.00 73.31 O ATOM 1867 ND2 ASN A 124 -46.816 9.286 -3.363 1.00 3.04 N ATOM 0 H ASN A 124 -42.960 9.296 -4.806 1.00 33.12 H new ATOM 0 HA ASN A 124 -44.134 11.996 -4.500 1.00 53.53 H new ATOM 0 HB2 ASN A 124 -44.323 9.445 -2.856 1.00 43.21 H new ATOM 0 HB3 ASN A 124 -44.800 11.005 -2.217 1.00 43.21 H new ATOM 0 HD21 ASN A 124 -47.740 9.138 -3.769 1.00 3.04 H new ATOM 0 HD22 ASN A 124 -46.478 8.668 -2.625 1.00 3.04 H new ATOM 1874 N GLN A 125 -41.485 10.681 -3.102 1.00 42.31 N ATOM 1875 CA GLN A 125 -40.277 10.988 -2.345 1.00 61.22 C ATOM 1876 C GLN A 125 -39.044 10.408 -3.031 1.00 32.52 C ATOM 1877 O GLN A 125 -39.155 9.577 -3.932 1.00 3.53 O ATOM 1878 CB GLN A 125 -40.388 10.442 -0.921 1.00 74.32 C ATOM 1879 CG GLN A 125 -41.182 11.339 0.015 1.00 12.52 C ATOM 1880 CD GLN A 125 -42.464 10.690 0.498 1.00 12.21 C ATOM 1881 OE1 GLN A 125 -42.796 10.752 1.682 1.00 35.21 O ATOM 1882 NE2 GLN A 125 -43.192 10.062 -0.418 1.00 13.11 N ATOM 0 H GLN A 125 -41.502 9.746 -3.510 1.00 42.31 H new ATOM 0 HA GLN A 125 -40.171 12.072 -2.302 1.00 61.22 H new ATOM 0 HB2 GLN A 125 -40.857 9.459 -0.953 1.00 74.32 H new ATOM 0 HB3 GLN A 125 -39.386 10.304 -0.515 1.00 74.32 H new ATOM 0 HG2 GLN A 125 -40.564 11.598 0.875 1.00 12.52 H new ATOM 0 HG3 GLN A 125 -41.422 12.271 -0.497 1.00 12.52 H new ATOM 0 HE21 GLN A 125 -42.879 10.036 -1.388 1.00 13.11 H new ATOM 0 HE22 GLN A 125 -44.065 9.606 -0.151 1.00 13.11 H new ATOM 1891 N LEU A 126 -37.869 10.852 -2.597 1.00 13.13 N ATOM 1892 CA LEU A 126 -36.613 10.376 -3.169 1.00 42.24 C ATOM 1893 C LEU A 126 -35.563 10.173 -2.082 1.00 22.01 C ATOM 1894 O LEU A 126 -35.351 11.044 -1.239 1.00 4.43 O ATOM 1895 CB LEU A 126 -36.099 11.369 -4.214 1.00 14.10 C ATOM 1896 CG LEU A 126 -35.075 10.823 -5.210 1.00 62.41 C ATOM 1897 CD1 LEU A 126 -33.751 10.543 -4.515 1.00 34.22 C ATOM 1898 CD2 LEU A 126 -35.603 9.564 -5.882 1.00 54.24 C ATOM 0 H LEU A 126 -37.759 11.540 -1.852 1.00 13.13 H new ATOM 0 HA LEU A 126 -36.800 9.416 -3.650 1.00 42.24 H new ATOM 0 HB2 LEU A 126 -36.953 11.752 -4.774 1.00 14.10 H new ATOM 0 HB3 LEU A 126 -35.654 12.217 -3.693 1.00 14.10 H new ATOM 0 HG LEU A 126 -34.906 11.577 -5.978 1.00 62.41 H new ATOM 0 HD11 LEU A 126 -33.035 10.155 -5.239 1.00 34.22 H new ATOM 0 HD12 LEU A 126 -33.365 11.466 -4.082 1.00 34.22 H new ATOM 0 HD13 LEU A 126 -33.903 9.807 -3.725 1.00 34.22 H new ATOM 0 HD21 LEU A 126 -34.861 9.190 -6.587 1.00 54.24 H new ATOM 0 HD22 LEU A 126 -35.801 8.804 -5.126 1.00 54.24 H new ATOM 0 HD23 LEU A 126 -36.526 9.795 -6.414 1.00 54.24 H new ATOM 1910 N VAL A 127 -34.905 9.018 -2.111 1.00 20.53 N ATOM 1911 CA VAL A 127 -33.874 8.702 -1.130 1.00 45.13 C ATOM 1912 C VAL A 127 -32.759 7.870 -1.756 1.00 1.10 C ATOM 1913 O VAL A 127 -33.018 6.929 -2.504 1.00 14.25 O ATOM 1914 CB VAL A 127 -34.458 7.936 0.072 1.00 20.41 C ATOM 1915 CG1 VAL A 127 -33.403 7.752 1.152 1.00 10.03 C ATOM 1916 CG2 VAL A 127 -35.676 8.660 0.623 1.00 54.52 C ATOM 0 H VAL A 127 -35.068 8.286 -2.803 1.00 20.53 H new ATOM 0 HA VAL A 127 -33.466 9.651 -0.782 1.00 45.13 H new ATOM 0 HB VAL A 127 -34.773 6.949 -0.266 1.00 20.41 H new ATOM 0 HG11 VAL A 127 -33.834 7.209 1.993 1.00 10.03 H new ATOM 0 HG12 VAL A 127 -32.563 7.187 0.748 1.00 10.03 H new ATOM 0 HG13 VAL A 127 -33.055 8.728 1.490 1.00 10.03 H new ATOM 0 HG21 VAL A 127 -36.076 8.105 1.472 1.00 54.52 H new ATOM 0 HG22 VAL A 127 -35.389 9.661 0.946 1.00 54.52 H new ATOM 0 HG23 VAL A 127 -36.437 8.734 -0.153 1.00 54.52 H new ATOM 1926 N ARG A 128 -31.517 8.226 -1.441 1.00 4.20 N ATOM 1927 CA ARG A 128 -30.362 7.513 -1.973 1.00 61.44 C ATOM 1928 C ARG A 128 -29.422 7.087 -0.849 1.00 20.05 C ATOM 1929 O ARG A 128 -29.034 7.898 -0.008 1.00 44.24 O ATOM 1930 CB ARG A 128 -29.610 8.391 -2.975 1.00 53.24 C ATOM 1931 CG ARG A 128 -30.451 8.805 -4.172 1.00 2.30 C ATOM 1932 CD ARG A 128 -29.854 10.012 -4.879 1.00 44.25 C ATOM 1933 NE ARG A 128 -28.547 9.717 -5.459 1.00 42.20 N ATOM 1934 CZ ARG A 128 -27.813 10.611 -6.112 1.00 12.20 C ATOM 1935 NH1 ARG A 128 -28.256 11.850 -6.267 1.00 23.30 N1+ ATOM 1936 NH2 ARG A 128 -26.633 10.266 -6.610 1.00 64.11 N ATOM 0 H ARG A 128 -31.286 9.002 -0.821 1.00 4.20 H new ATOM 0 HA ARG A 128 -30.722 6.619 -2.482 1.00 61.44 H new ATOM 0 HB2 ARG A 128 -29.253 9.286 -2.465 1.00 53.24 H new ATOM 0 HB3 ARG A 128 -28.730 7.853 -3.328 1.00 53.24 H new ATOM 0 HG2 ARG A 128 -30.526 7.972 -4.871 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -31.464 9.038 -3.844 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -30.533 10.344 -5.665 1.00 44.25 H new ATOM 0 HD3 ARG A 128 -29.759 10.836 -4.172 1.00 44.25 H new ATOM 0 HE ARG A 128 -28.177 8.772 -5.357 1.00 42.20 H new ATOM 0 HH11 ARG A 128 -29.162 12.119 -5.884 1.00 23.30 H new ATOM 0 HH12 ARG A 128 -27.691 12.535 -6.769 1.00 23.30 H new ATOM 0 HH21 ARG A 128 -26.288 9.313 -6.492 1.00 64.11 H new ATOM 0 HH22 ARG A 128 -26.070 10.953 -7.111 1.00 64.11 H new ATOM 1950 N VAL A 129 -29.059 5.808 -0.840 1.00 61.44 N ATOM 1951 CA VAL A 129 -28.165 5.273 0.180 1.00 71.52 C ATOM 1952 C VAL A 129 -26.728 5.212 -0.327 1.00 13.23 C ATOM 1953 O VAL A 129 -26.486 4.965 -1.508 1.00 34.03 O ATOM 1954 CB VAL A 129 -28.600 3.865 0.626 1.00 44.32 C ATOM 1955 CG1 VAL A 129 -27.647 3.320 1.679 1.00 3.32 C ATOM 1956 CG2 VAL A 129 -30.029 3.891 1.151 1.00 62.34 C ATOM 0 H VAL A 129 -29.371 5.123 -1.528 1.00 61.44 H new ATOM 0 HA VAL A 129 -28.219 5.949 1.034 1.00 71.52 H new ATOM 0 HB VAL A 129 -28.566 3.202 -0.238 1.00 44.32 H new ATOM 0 HG11 VAL A 129 -27.971 2.324 1.982 1.00 3.32 H new ATOM 0 HG12 VAL A 129 -26.640 3.264 1.265 1.00 3.32 H new ATOM 0 HG13 VAL A 129 -27.646 3.981 2.546 1.00 3.32 H new ATOM 0 HG21 VAL A 129 -30.321 2.888 1.462 1.00 62.34 H new ATOM 0 HG22 VAL A 129 -30.091 4.568 2.003 1.00 62.34 H new ATOM 0 HG23 VAL A 129 -30.700 4.236 0.364 1.00 62.34 H new ATOM 1966 N TYR A 130 -25.779 5.438 0.574 1.00 2.33 N ATOM 1967 CA TYR A 130 -24.365 5.410 0.219 1.00 2.11 C ATOM 1968 C TYR A 130 -23.610 4.392 1.067 1.00 50.21 C ATOM 1969 O TYR A 130 -23.637 4.450 2.298 1.00 35.14 O ATOM 1970 CB TYR A 130 -23.746 6.798 0.396 1.00 54.22 C ATOM 1971 CG TYR A 130 -24.247 7.816 -0.604 1.00 50.10 C ATOM 1972 CD1 TYR A 130 -25.567 8.249 -0.581 1.00 41.25 C ATOM 1973 CD2 TYR A 130 -23.400 8.346 -1.569 1.00 64.34 C ATOM 1974 CE1 TYR A 130 -26.030 9.179 -1.492 1.00 42.45 C ATOM 1975 CE2 TYR A 130 -23.854 9.277 -2.483 1.00 13.34 C ATOM 1976 CZ TYR A 130 -25.169 9.690 -2.442 1.00 23.14 C ATOM 1977 OH TYR A 130 -25.625 10.617 -3.350 1.00 43.15 O ATOM 0 H TYR A 130 -25.963 5.643 1.556 1.00 2.33 H new ATOM 0 HA TYR A 130 -24.285 5.114 -0.827 1.00 2.11 H new ATOM 0 HB2 TYR A 130 -23.958 7.156 1.404 1.00 54.22 H new ATOM 0 HB3 TYR A 130 -22.663 6.717 0.308 1.00 54.22 H new ATOM 0 HD1 TYR A 130 -26.243 7.852 0.162 1.00 41.25 H new ATOM 0 HD2 TYR A 130 -22.369 8.025 -1.605 1.00 64.34 H new ATOM 0 HE1 TYR A 130 -27.059 9.504 -1.461 1.00 42.45 H new ATOM 0 HE2 TYR A 130 -23.182 9.680 -3.226 1.00 13.34 H new ATOM 0 HH TYR A 130 -24.894 10.876 -3.949 1.00 43.15 H new ATOM 1987 N ILE A 131 -22.935 3.460 0.402 1.00 62.14 N ATOM 1988 CA ILE A 131 -22.171 2.430 1.094 1.00 14.52 C ATOM 1989 C ILE A 131 -20.703 2.467 0.683 1.00 32.22 C ATOM 1990 O ILE A 131 -20.380 2.572 -0.500 1.00 50.11 O ATOM 1991 CB ILE A 131 -22.736 1.026 0.812 1.00 53.44 C ATOM 1992 CG1 ILE A 131 -24.000 0.785 1.641 1.00 75.34 C ATOM 1993 CG2 ILE A 131 -21.689 -0.037 1.113 1.00 74.22 C ATOM 1994 CD1 ILE A 131 -25.193 0.361 0.814 1.00 41.20 C ATOM 0 H ILE A 131 -22.902 3.397 -0.616 1.00 62.14 H new ATOM 0 HA ILE A 131 -22.253 2.638 2.161 1.00 14.52 H new ATOM 0 HB ILE A 131 -22.998 0.962 -0.244 1.00 53.44 H new ATOM 0 HG12 ILE A 131 -23.794 0.018 2.387 1.00 75.34 H new ATOM 0 HG13 ILE A 131 -24.249 1.698 2.182 1.00 75.34 H new ATOM 0 HG21 ILE A 131 -22.104 -1.024 0.909 1.00 74.22 H new ATOM 0 HG22 ILE A 131 -20.814 0.126 0.484 1.00 74.22 H new ATOM 0 HG23 ILE A 131 -21.399 0.025 2.162 1.00 74.22 H new ATOM 0 HD11 ILE A 131 -26.052 0.208 1.467 1.00 41.20 H new ATOM 0 HD12 ILE A 131 -25.425 1.137 0.085 1.00 41.20 H new ATOM 0 HD13 ILE A 131 -24.963 -0.569 0.293 1.00 41.20 H new ATOM 2006 N VAL A 132 -19.816 2.377 1.670 1.00 41.23 N ATOM 2007 CA VAL A 132 -18.381 2.397 1.412 1.00 34.34 C ATOM 2008 C VAL A 132 -17.757 1.031 1.674 1.00 0.01 C ATOM 2009 O VAL A 132 -17.826 0.509 2.786 1.00 51.31 O ATOM 2010 CB VAL A 132 -17.668 3.450 2.281 1.00 61.21 C ATOM 2011 CG1 VAL A 132 -18.002 4.854 1.800 1.00 1.22 C ATOM 2012 CG2 VAL A 132 -18.045 3.275 3.745 1.00 73.24 C ATOM 0 H VAL A 132 -20.066 2.290 2.655 1.00 41.23 H new ATOM 0 HA VAL A 132 -18.252 2.657 0.361 1.00 34.34 H new ATOM 0 HB VAL A 132 -16.592 3.306 2.187 1.00 61.21 H new ATOM 0 HG11 VAL A 132 -17.489 5.585 2.426 1.00 1.22 H new ATOM 0 HG12 VAL A 132 -17.678 4.971 0.766 1.00 1.22 H new ATOM 0 HG13 VAL A 132 -19.078 5.014 1.863 1.00 1.22 H new ATOM 0 HG21 VAL A 132 -17.533 4.027 4.345 1.00 73.24 H new ATOM 0 HG22 VAL A 132 -19.123 3.392 3.860 1.00 73.24 H new ATOM 0 HG23 VAL A 132 -17.750 2.281 4.080 1.00 73.24 H new ATOM 2022 N GLN A 133 -17.147 0.457 0.641 1.00 42.41 N ATOM 2023 CA GLN A 133 -16.510 -0.849 0.760 1.00 12.41 C ATOM 2024 C GLN A 133 -15.257 -0.767 1.626 1.00 54.20 C ATOM 2025 O GLN A 133 -14.508 0.208 1.562 1.00 2.20 O ATOM 2026 CB GLN A 133 -16.153 -1.393 -0.624 1.00 71.20 C ATOM 2027 CG GLN A 133 -17.283 -2.166 -1.285 1.00 14.21 C ATOM 2028 CD GLN A 133 -18.129 -1.298 -2.195 1.00 65.31 C ATOM 2029 OE1 GLN A 133 -18.073 -1.423 -3.419 1.00 73.53 O ATOM 2030 NE2 GLN A 133 -18.920 -0.411 -1.603 1.00 12.32 N ATOM 0 H GLN A 133 -17.081 0.876 -0.287 1.00 42.41 H new ATOM 0 HA GLN A 133 -17.216 -1.528 1.239 1.00 12.41 H new ATOM 0 HB2 GLN A 133 -15.867 -0.562 -1.269 1.00 71.20 H new ATOM 0 HB3 GLN A 133 -15.282 -2.043 -0.536 1.00 71.20 H new ATOM 0 HG2 GLN A 133 -16.865 -2.991 -1.862 1.00 14.21 H new ATOM 0 HG3 GLN A 133 -17.917 -2.605 -0.515 1.00 14.21 H new ATOM 0 HE21 GLN A 133 -18.936 -0.341 -0.586 1.00 12.32 H new ATOM 0 HE22 GLN A 133 -19.512 0.200 -2.166 1.00 12.32 H new ATOM 2039 N LYS A 134 -15.036 -1.796 2.436 1.00 12.52 N ATOM 2040 CA LYS A 134 -13.873 -1.843 3.315 1.00 43.01 C ATOM 2041 C LYS A 134 -12.742 -2.645 2.680 1.00 3.21 C ATOM 2042 O LYS A 134 -12.976 -3.478 1.804 1.00 43.24 O ATOM 2043 CB LYS A 134 -14.253 -2.456 4.665 1.00 4.32 C ATOM 2044 CG LYS A 134 -15.387 -1.729 5.366 1.00 31.52 C ATOM 2045 CD LYS A 134 -15.873 -2.496 6.584 1.00 15.52 C ATOM 2046 CE LYS A 134 -16.788 -3.646 6.190 1.00 55.02 C ATOM 2047 NZ LYS A 134 -17.145 -4.496 7.360 1.00 1.44 N1+ ATOM 0 H LYS A 134 -15.647 -2.610 2.502 1.00 12.52 H new ATOM 0 HA LYS A 134 -13.526 -0.822 3.472 1.00 43.01 H new ATOM 0 HB2 LYS A 134 -14.538 -3.497 4.514 1.00 4.32 H new ATOM 0 HB3 LYS A 134 -13.377 -2.456 5.314 1.00 4.32 H new ATOM 0 HG2 LYS A 134 -15.052 -0.737 5.669 1.00 31.52 H new ATOM 0 HG3 LYS A 134 -16.214 -1.587 4.671 1.00 31.52 H new ATOM 0 HD2 LYS A 134 -15.017 -2.884 7.137 1.00 15.52 H new ATOM 0 HD3 LYS A 134 -16.405 -1.819 7.253 1.00 15.52 H new ATOM 0 HE2 LYS A 134 -17.697 -3.249 5.739 1.00 55.02 H new ATOM 0 HE3 LYS A 134 -16.297 -4.258 5.433 1.00 55.02 H new ATOM 0 HZ1 LYS A 134 -17.769 -5.268 7.051 1.00 1.44 H new ATOM 0 HZ2 LYS A 134 -16.280 -4.896 7.776 1.00 1.44 H new ATOM 0 HZ3 LYS A 134 -17.636 -3.918 8.072 1.00 1.44 H new ATOM 2061 N ARG A 135 -11.518 -2.391 3.129 1.00 73.21 N ATOM 2062 CA ARG A 135 -10.351 -3.091 2.605 1.00 2.23 C ATOM 2063 C ARG A 135 -10.554 -4.602 2.657 1.00 4.34 C ATOM 2064 O ARG A 135 -11.078 -5.136 3.635 1.00 70.31 O ATOM 2065 CB ARG A 135 -9.100 -2.706 3.398 1.00 24.23 C ATOM 2066 CG ARG A 135 -8.856 -1.207 3.460 1.00 61.24 C ATOM 2067 CD ARG A 135 -8.774 -0.598 2.069 1.00 61.52 C ATOM 2068 NE ARG A 135 -7.875 0.552 2.027 1.00 65.45 N ATOM 2069 CZ ARG A 135 -8.137 1.712 2.619 1.00 44.11 C ATOM 2070 NH1 ARG A 135 -9.266 1.875 3.294 1.00 2.13 N1+ ATOM 2071 NH2 ARG A 135 -7.268 2.712 2.536 1.00 1.42 N ATOM 0 H ARG A 135 -11.308 -1.706 3.855 1.00 73.21 H new ATOM 0 HA ARG A 135 -10.219 -2.795 1.564 1.00 2.23 H new ATOM 0 HB2 ARG A 135 -9.190 -3.093 4.413 1.00 24.23 H new ATOM 0 HB3 ARG A 135 -8.232 -3.189 2.948 1.00 24.23 H new ATOM 0 HG2 ARG A 135 -9.659 -0.729 4.021 1.00 61.24 H new ATOM 0 HG3 ARG A 135 -7.930 -1.010 4.000 1.00 61.24 H new ATOM 0 HD2 ARG A 135 -8.430 -1.353 1.362 1.00 61.52 H new ATOM 0 HD3 ARG A 135 -9.770 -0.292 1.748 1.00 61.52 H new ATOM 0 HE ARG A 135 -6.998 0.459 1.515 1.00 65.45 H new ATOM 0 HH11 ARG A 135 -9.936 1.109 3.360 1.00 2.13 H new ATOM 0 HH12 ARG A 135 -9.465 2.767 3.748 1.00 2.13 H new ATOM 0 HH21 ARG A 135 -6.398 2.590 2.017 1.00 1.42 H new ATOM 0 HH22 ARG A 135 -7.470 3.602 2.991 1.00 1.42 H new ATOM 2085 N LYS A 136 -10.139 -5.286 1.596 1.00 75.34 N ATOM 2086 CA LYS A 136 -10.273 -6.736 1.520 1.00 14.01 C ATOM 2087 C LYS A 136 -8.944 -7.388 1.153 1.00 71.32 C ATOM 2088 O LYS A 136 -8.152 -6.822 0.399 1.00 71.05 O ATOM 2089 CB LYS A 136 -11.340 -7.116 0.490 1.00 52.34 C ATOM 2090 CG LYS A 136 -11.236 -6.336 -0.809 1.00 44.13 C ATOM 2091 CD LYS A 136 -12.204 -6.865 -1.855 1.00 43.40 C ATOM 2092 CE LYS A 136 -11.580 -7.984 -2.675 1.00 63.11 C ATOM 2093 NZ LYS A 136 -11.747 -9.311 -2.017 1.00 55.42 N1+ ATOM 0 H LYS A 136 -9.707 -4.859 0.777 1.00 75.34 H new ATOM 0 HA LYS A 136 -10.577 -7.099 2.502 1.00 14.01 H new ATOM 0 HB2 LYS A 136 -11.260 -8.181 0.272 1.00 52.34 H new ATOM 0 HB3 LYS A 136 -12.326 -6.953 0.924 1.00 52.34 H new ATOM 0 HG2 LYS A 136 -11.443 -5.283 -0.620 1.00 44.13 H new ATOM 0 HG3 LYS A 136 -10.217 -6.397 -1.191 1.00 44.13 H new ATOM 0 HD2 LYS A 136 -13.107 -7.231 -1.365 1.00 43.40 H new ATOM 0 HD3 LYS A 136 -12.507 -6.053 -2.516 1.00 43.40 H new ATOM 0 HE2 LYS A 136 -12.037 -8.008 -3.664 1.00 63.11 H new ATOM 0 HE3 LYS A 136 -10.519 -7.781 -2.819 1.00 63.11 H new ATOM 0 HZ1 LYS A 136 -11.832 -10.050 -2.743 1.00 55.42 H new ATOM 0 HZ2 LYS A 136 -10.920 -9.508 -1.417 1.00 55.42 H new ATOM 0 HZ3 LYS A 136 -12.606 -9.302 -1.431 1.00 55.42 H new ATOM 2107 N ILE A 137 -8.707 -8.579 1.692 1.00 30.52 N ATOM 2108 CA ILE A 137 -7.474 -9.308 1.419 1.00 4.50 C ATOM 2109 C ILE A 137 -7.217 -9.412 -0.081 1.00 42.20 C ATOM 2110 O ILE A 137 -8.149 -9.388 -0.884 1.00 34.34 O ATOM 2111 CB ILE A 137 -7.512 -10.725 2.021 1.00 24.31 C ATOM 2112 CG1 ILE A 137 -8.728 -11.492 1.496 1.00 34.43 C ATOM 2113 CG2 ILE A 137 -7.539 -10.655 3.540 1.00 52.43 C ATOM 2114 CD1 ILE A 137 -8.474 -12.205 0.187 1.00 4.14 C ATOM 0 H ILE A 137 -9.352 -9.060 2.320 1.00 30.52 H new ATOM 0 HA ILE A 137 -6.666 -8.745 1.886 1.00 4.50 H new ATOM 0 HB ILE A 137 -6.610 -11.257 1.718 1.00 24.31 H new ATOM 0 HG12 ILE A 137 -9.037 -12.222 2.244 1.00 34.43 H new ATOM 0 HG13 ILE A 137 -9.558 -10.797 1.367 1.00 34.43 H new ATOM 0 HG21 ILE A 137 -7.566 -11.664 3.950 1.00 52.43 H new ATOM 0 HG22 ILE A 137 -6.646 -10.142 3.897 1.00 52.43 H new ATOM 0 HG23 ILE A 137 -8.425 -10.108 3.863 1.00 52.43 H new ATOM 0 HD11 ILE A 137 -9.379 -12.727 -0.125 1.00 4.14 H new ATOM 0 HD12 ILE A 137 -8.194 -11.478 -0.575 1.00 4.14 H new ATOM 0 HD13 ILE A 137 -7.666 -12.925 0.316 1.00 4.14 H new ATOM 2126 N SER A 138 -5.946 -9.528 -0.450 1.00 33.30 N ATOM 2127 CA SER A 138 -5.565 -9.634 -1.855 1.00 12.12 C ATOM 2128 C SER A 138 -6.148 -10.896 -2.482 1.00 23.35 C ATOM 2129 O SER A 138 -5.803 -12.011 -2.092 1.00 14.03 O ATOM 2130 CB SER A 138 -4.041 -9.639 -1.992 1.00 33.30 C ATOM 2131 OG SER A 138 -3.642 -10.212 -3.226 1.00 33.15 O ATOM 0 H SER A 138 -5.163 -9.551 0.203 1.00 33.30 H new ATOM 0 HA SER A 138 -5.967 -8.769 -2.382 1.00 12.12 H new ATOM 0 HB2 SER A 138 -3.663 -8.619 -1.922 1.00 33.30 H new ATOM 0 HB3 SER A 138 -3.600 -10.200 -1.168 1.00 33.30 H new ATOM 0 HG SER A 138 -2.760 -9.866 -3.477 1.00 33.15 H new ATOM 2137 N GLU A 139 -7.033 -10.711 -3.457 1.00 73.41 N ATOM 2138 CA GLU A 139 -7.665 -11.834 -4.138 1.00 32.15 C ATOM 2139 C GLU A 139 -6.616 -12.751 -4.763 1.00 5.54 C ATOM 2140 O GLU A 139 -6.528 -13.931 -4.426 1.00 63.51 O ATOM 2141 CB GLU A 139 -8.626 -11.331 -5.216 1.00 31.35 C ATOM 2142 CG GLU A 139 -9.623 -12.379 -5.680 1.00 73.33 C ATOM 2143 CD GLU A 139 -10.891 -12.387 -4.850 1.00 40.35 C ATOM 2144 OE1 GLU A 139 -11.765 -11.528 -5.093 1.00 55.44 O ATOM 2145 OE2 GLU A 139 -11.010 -13.251 -3.957 1.00 25.42 O1- ATOM 0 H GLU A 139 -7.328 -9.794 -3.792 1.00 73.41 H new ATOM 0 HA GLU A 139 -8.227 -12.404 -3.399 1.00 32.15 H new ATOM 0 HB2 GLU A 139 -9.171 -10.469 -4.831 1.00 31.35 H new ATOM 0 HB3 GLU A 139 -8.048 -10.986 -6.074 1.00 31.35 H new ATOM 0 HG2 GLU A 139 -9.878 -12.195 -6.724 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -9.157 -13.363 -5.634 1.00 73.33 H new ATOM 2152 N GLY A 140 -5.823 -12.198 -5.676 1.00 65.11 N ATOM 2153 CA GLY A 140 -4.793 -12.979 -6.333 1.00 41.24 C ATOM 2154 C GLY A 140 -5.232 -13.493 -7.690 1.00 43.02 C ATOM 2155 O GLY A 140 -4.401 -13.771 -8.555 1.00 23.34 O ATOM 0 H GLY A 140 -5.876 -11.223 -5.972 1.00 65.11 H new ATOM 0 HA2 GLY A 140 -3.898 -12.368 -6.451 1.00 41.24 H new ATOM 0 HA3 GLY A 140 -4.521 -13.823 -5.699 1.00 41.24 H new ATOM 2159 N ASP A 141 -6.541 -13.620 -7.877 1.00 63.32 N ATOM 2160 CA ASP A 141 -7.089 -14.106 -9.138 1.00 33.42 C ATOM 2161 C ASP A 141 -7.474 -12.942 -10.046 1.00 14.14 C ATOM 2162 O ASP A 141 -8.657 -12.674 -10.261 1.00 20.30 O ATOM 2163 CB ASP A 141 -8.309 -14.993 -8.880 1.00 74.13 C ATOM 2164 CG ASP A 141 -8.705 -15.800 -10.101 1.00 34.21 C ATOM 2165 OD1 ASP A 141 -8.172 -16.916 -10.271 1.00 41.30 O ATOM 2166 OD2 ASP A 141 -9.547 -15.316 -10.885 1.00 23.22 O1- ATOM 0 H ASP A 141 -7.242 -13.393 -7.172 1.00 63.32 H new ATOM 0 HA ASP A 141 -6.320 -14.695 -9.638 1.00 33.42 H new ATOM 0 HB2 ASP A 141 -8.094 -15.671 -8.054 1.00 74.13 H new ATOM 0 HB3 ASP A 141 -9.149 -14.370 -8.571 1.00 74.13 H new TER 2171 ASP A 141