USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=15 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 Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.239 X(o=-0.24,f=-0.08) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -60:sc= -1.5 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.222 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0645 USER MOD Single : A 33 ASN : amide:sc= -0.151 X(o=-0.15,f=-0.2) USER MOD Single : A 41 ASN : amide:sc= -0.875 X(o=-0.87,f=-1.3) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 164:sc= -1.59 (180deg=-1.79) USER MOD Single : A 65 THR OG1 : rot -170:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HD1:sc=-0.00819 X(o=-0.0082,f=-0.4) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.72 USER MOD Single : A 94 SER OG : rot 12:sc= 1.08 USER MOD Single : A 99 HIS : no HD1:sc= 0.0382 K(o=0.038,f=-0.81) USER MOD Single : A 106 HIS : no HD1:sc= -0.456 X(o=-0.46,f=-0.026) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.0222 K(o=-0.022,f=-3.3!) USER MOD Single : A 124 ASN : amide:sc=-0.00704 K(o=-0.007,f=-1.3) USER MOD Single : A 125 GLN : amide:sc= -2.79 K(o=-2.8,f=-3.3) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -2.02 K(o=-2,f=-4.2!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 3 0.823 -6.336 -10.669 1.00 63.21 N ATOM 2 CA ASP A 3 0.103 -6.175 -9.410 1.00 1.10 C ATOM 3 C ASP A 3 0.050 -4.706 -8.998 1.00 54.11 C ATOM 4 O ASP A 3 1.079 -4.035 -8.924 1.00 24.32 O ATOM 5 CB ASP A 3 0.766 -7.003 -8.309 1.00 23.13 C ATOM 6 CG ASP A 3 0.341 -6.565 -6.920 1.00 5.44 C ATOM 7 OD1 ASP A 3 -0.872 -6.610 -6.630 1.00 40.21 O ATOM 8 OD2 ASP A 3 1.223 -6.177 -6.126 1.00 10.33 O1- ATOM 0 HA ASP A 3 -0.917 -6.530 -9.556 1.00 1.10 H new ATOM 0 HB2 ASP A 3 0.515 -8.055 -8.448 1.00 23.13 H new ATOM 0 HB3 ASP A 3 1.849 -6.919 -8.398 1.00 23.13 H new ATOM 13 N VAL A 4 -1.156 -4.215 -8.733 1.00 1.21 N ATOM 14 CA VAL A 4 -1.343 -2.827 -8.329 1.00 45.01 C ATOM 15 C VAL A 4 -2.396 -2.710 -7.232 1.00 4.33 C ATOM 16 O VAL A 4 -3.305 -3.535 -7.142 1.00 12.14 O ATOM 17 CB VAL A 4 -1.759 -1.946 -9.521 1.00 11.04 C ATOM 18 CG1 VAL A 4 -3.152 -2.323 -10.003 1.00 11.12 C ATOM 19 CG2 VAL A 4 -1.698 -0.474 -9.143 1.00 24.21 C ATOM 0 H VAL A 4 -2.018 -4.758 -8.791 1.00 1.21 H new ATOM 0 HA VAL A 4 -0.384 -2.478 -7.946 1.00 45.01 H new ATOM 0 HB VAL A 4 -1.058 -2.117 -10.338 1.00 11.04 H new ATOM 0 HG11 VAL A 4 -3.429 -1.690 -10.846 1.00 11.12 H new ATOM 0 HG12 VAL A 4 -3.159 -3.367 -10.316 1.00 11.12 H new ATOM 0 HG13 VAL A 4 -3.868 -2.183 -9.193 1.00 11.12 H new ATOM 0 HG21 VAL A 4 -1.995 0.134 -9.998 1.00 24.21 H new ATOM 0 HG22 VAL A 4 -2.375 -0.284 -8.310 1.00 24.21 H new ATOM 0 HG23 VAL A 4 -0.680 -0.215 -8.850 1.00 24.21 H new ATOM 29 N TYR A 5 -2.268 -1.681 -6.403 1.00 14.41 N ATOM 30 CA TYR A 5 -3.208 -1.457 -5.311 1.00 14.11 C ATOM 31 C TYR A 5 -4.374 -0.585 -5.767 1.00 34.31 C ATOM 32 O TYR A 5 -4.274 0.141 -6.757 1.00 3.50 O ATOM 33 CB TYR A 5 -2.499 -0.801 -4.126 1.00 22.13 C ATOM 34 CG TYR A 5 -1.169 -1.436 -3.789 1.00 23.14 C ATOM 35 CD1 TYR A 5 -1.089 -2.774 -3.423 1.00 4.24 C ATOM 36 CD2 TYR A 5 0.007 -0.697 -3.836 1.00 11.34 C ATOM 37 CE1 TYR A 5 0.125 -3.358 -3.114 1.00 42.42 C ATOM 38 CE2 TYR A 5 1.225 -1.274 -3.530 1.00 71.45 C ATOM 39 CZ TYR A 5 1.279 -2.604 -3.170 1.00 3.24 C ATOM 40 OH TYR A 5 2.490 -3.182 -2.863 1.00 3.20 O ATOM 0 H TYR A 5 -1.522 -0.988 -6.466 1.00 14.41 H new ATOM 0 HA TYR A 5 -3.601 -2.425 -5.000 1.00 14.11 H new ATOM 0 HB2 TYR A 5 -2.342 0.255 -4.346 1.00 22.13 H new ATOM 0 HB3 TYR A 5 -3.148 -0.851 -3.252 1.00 22.13 H new ATOM 0 HD1 TYR A 5 -1.990 -3.367 -3.379 1.00 4.24 H new ATOM 0 HD2 TYR A 5 -0.032 0.345 -4.116 1.00 11.34 H new ATOM 0 HE1 TYR A 5 0.170 -4.399 -2.830 1.00 42.42 H new ATOM 0 HE2 TYR A 5 2.130 -0.686 -3.573 1.00 71.45 H new ATOM 0 HH TYR A 5 3.203 -2.515 -2.952 1.00 3.20 H new ATOM 50 N THR A 6 -5.482 -0.661 -5.036 1.00 71.00 N ATOM 51 CA THR A 6 -6.669 0.119 -5.363 1.00 14.31 C ATOM 52 C THR A 6 -7.050 1.048 -4.216 1.00 73.50 C ATOM 53 O THR A 6 -6.324 1.161 -3.229 1.00 43.33 O ATOM 54 CB THR A 6 -7.867 -0.791 -5.691 1.00 51.52 C ATOM 55 OG1 THR A 6 -8.261 -1.522 -4.525 1.00 70.22 O ATOM 56 CG2 THR A 6 -7.520 -1.761 -6.811 1.00 71.11 C ATOM 0 H THR A 6 -5.582 -1.255 -4.213 1.00 71.00 H new ATOM 0 HA THR A 6 -6.423 0.714 -6.243 1.00 14.31 H new ATOM 0 HB THR A 6 -8.693 -0.161 -6.021 1.00 51.52 H new ATOM 0 HG1 THR A 6 -9.024 -2.097 -4.742 1.00 70.22 H new ATOM 0 HG21 THR A 6 -8.382 -2.393 -7.025 1.00 71.11 H new ATOM 0 HG22 THR A 6 -7.250 -1.201 -7.706 1.00 71.11 H new ATOM 0 HG23 THR A 6 -6.680 -2.384 -6.505 1.00 71.11 H new ATOM 64 N SER A 7 -8.193 1.711 -4.352 1.00 24.13 N ATOM 65 CA SER A 7 -8.670 2.632 -3.327 1.00 4.43 C ATOM 66 C SER A 7 -10.092 2.283 -2.900 1.00 34.24 C ATOM 67 O SER A 7 -10.640 1.259 -3.309 1.00 13.42 O ATOM 68 CB SER A 7 -8.620 4.072 -3.843 1.00 10.54 C ATOM 69 OG SER A 7 -7.847 4.163 -5.027 1.00 74.54 O ATOM 0 H SER A 7 -8.807 1.628 -5.162 1.00 24.13 H new ATOM 0 HA SER A 7 -8.017 2.540 -2.459 1.00 4.43 H new ATOM 0 HB2 SER A 7 -9.632 4.427 -4.037 1.00 10.54 H new ATOM 0 HB3 SER A 7 -8.196 4.721 -3.077 1.00 10.54 H new ATOM 0 HG SER A 7 -7.832 5.092 -5.337 1.00 74.54 H new ATOM 75 N ILE A 8 -10.683 3.139 -2.074 1.00 55.43 N ATOM 76 CA ILE A 8 -12.041 2.922 -1.591 1.00 25.01 C ATOM 77 C ILE A 8 -13.065 3.198 -2.688 1.00 21.43 C ATOM 78 O ILE A 8 -12.788 3.928 -3.641 1.00 13.54 O ATOM 79 CB ILE A 8 -12.355 3.811 -0.374 1.00 54.34 C ATOM 80 CG1 ILE A 8 -11.154 3.858 0.574 1.00 4.33 C ATOM 81 CG2 ILE A 8 -13.591 3.300 0.351 1.00 52.02 C ATOM 82 CD1 ILE A 8 -10.589 2.494 0.900 1.00 12.02 C ATOM 0 H ILE A 8 -10.242 3.990 -1.725 1.00 55.43 H new ATOM 0 HA ILE A 8 -12.106 1.876 -1.291 1.00 25.01 H new ATOM 0 HB ILE A 8 -12.557 4.823 -0.724 1.00 54.34 H new ATOM 0 HG12 ILE A 8 -10.371 4.469 0.125 1.00 4.33 H new ATOM 0 HG13 ILE A 8 -11.451 4.350 1.500 1.00 4.33 H new ATOM 0 HG21 ILE A 8 -13.800 3.939 1.209 1.00 52.02 H new ATOM 0 HG22 ILE A 8 -14.443 3.315 -0.328 1.00 52.02 H new ATOM 0 HG23 ILE A 8 -13.417 2.280 0.693 1.00 52.02 H new ATOM 0 HD11 ILE A 8 -9.741 2.604 1.576 1.00 12.02 H new ATOM 0 HD12 ILE A 8 -11.358 1.886 1.378 1.00 12.02 H new ATOM 0 HD13 ILE A 8 -10.260 2.007 -0.018 1.00 12.02 H new ATOM 94 N HIS A 9 -14.250 2.614 -2.544 1.00 22.41 N ATOM 95 CA HIS A 9 -15.317 2.800 -3.520 1.00 40.14 C ATOM 96 C HIS A 9 -16.560 3.388 -2.861 1.00 0.44 C ATOM 97 O HIS A 9 -16.731 3.298 -1.645 1.00 31.34 O ATOM 98 CB HIS A 9 -15.661 1.468 -4.190 1.00 13.31 C ATOM 99 CG HIS A 9 -14.925 1.235 -5.473 1.00 14.24 C ATOM 100 ND1 HIS A 9 -14.524 -0.015 -5.893 1.00 60.14 N ATOM 101 CD2 HIS A 9 -14.518 2.100 -6.431 1.00 65.44 C ATOM 102 CE1 HIS A 9 -13.901 0.091 -7.053 1.00 42.51 C ATOM 103 NE2 HIS A 9 -13.884 1.365 -7.402 1.00 14.34 N ATOM 0 H HIS A 9 -14.495 2.008 -1.761 1.00 22.41 H new ATOM 0 HA HIS A 9 -14.965 3.500 -4.278 1.00 40.14 H new ATOM 0 HB2 HIS A 9 -15.437 0.655 -3.499 1.00 13.31 H new ATOM 0 HB3 HIS A 9 -16.733 1.435 -4.385 1.00 13.31 H new ATOM 0 HD2 HIS A 9 -14.665 3.170 -6.432 1.00 65.44 H new ATOM 0 HE1 HIS A 9 -13.478 -0.725 -7.620 1.00 42.51 H new ATOM 0 HE2 HIS A 9 -13.468 1.741 -8.254 1.00 14.34 H new ATOM 111 N ILE A 10 -17.424 3.991 -3.671 1.00 62.41 N ATOM 112 CA ILE A 10 -18.651 4.593 -3.166 1.00 5.23 C ATOM 113 C ILE A 10 -19.876 4.021 -3.872 1.00 41.15 C ATOM 114 O ILE A 10 -20.015 4.143 -5.088 1.00 13.04 O ATOM 115 CB ILE A 10 -18.641 6.123 -3.340 1.00 51.44 C ATOM 116 CG1 ILE A 10 -17.477 6.739 -2.559 1.00 72.52 C ATOM 117 CG2 ILE A 10 -19.965 6.718 -2.884 1.00 54.40 C ATOM 118 CD1 ILE A 10 -17.602 6.577 -1.060 1.00 33.02 C ATOM 0 H ILE A 10 -17.297 4.075 -4.679 1.00 62.41 H new ATOM 0 HA ILE A 10 -18.703 4.356 -2.103 1.00 5.23 H new ATOM 0 HB ILE A 10 -18.508 6.352 -4.397 1.00 51.44 H new ATOM 0 HG12 ILE A 10 -16.545 6.280 -2.889 1.00 72.52 H new ATOM 0 HG13 ILE A 10 -17.412 7.801 -2.797 1.00 72.52 H new ATOM 0 HG21 ILE A 10 -19.941 7.800 -3.014 1.00 54.40 H new ATOM 0 HG22 ILE A 10 -20.776 6.299 -3.479 1.00 54.40 H new ATOM 0 HG23 ILE A 10 -20.127 6.482 -1.832 1.00 54.40 H new ATOM 0 HD11 ILE A 10 -16.743 7.037 -0.571 1.00 33.02 H new ATOM 0 HD12 ILE A 10 -18.517 7.061 -0.717 1.00 33.02 H new ATOM 0 HD13 ILE A 10 -17.637 5.517 -0.810 1.00 33.02 H new ATOM 130 N GLU A 11 -20.761 3.399 -3.099 1.00 14.33 N ATOM 131 CA GLU A 11 -21.975 2.809 -3.651 1.00 21.25 C ATOM 132 C GLU A 11 -23.084 3.851 -3.762 1.00 42.40 C ATOM 133 O GLU A 11 -23.048 4.884 -3.094 1.00 51.11 O ATOM 134 CB GLU A 11 -22.442 1.641 -2.781 1.00 50.43 C ATOM 135 CG GLU A 11 -21.800 0.314 -3.148 1.00 44.11 C ATOM 136 CD GLU A 11 -22.532 -0.398 -4.269 1.00 11.42 C ATOM 137 OE1 GLU A 11 -23.441 0.215 -4.868 1.00 55.02 O ATOM 138 OE2 GLU A 11 -22.196 -1.568 -4.549 1.00 31.51 O1- ATOM 0 H GLU A 11 -20.660 3.291 -2.090 1.00 14.33 H new ATOM 0 HA GLU A 11 -21.747 2.439 -4.651 1.00 21.25 H new ATOM 0 HB2 GLU A 11 -22.221 1.865 -1.737 1.00 50.43 H new ATOM 0 HB3 GLU A 11 -23.525 1.547 -2.865 1.00 50.43 H new ATOM 0 HG2 GLU A 11 -20.766 0.485 -3.446 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -21.776 -0.329 -2.268 1.00 44.11 H new ATOM 145 N GLU A 12 -24.068 3.572 -4.611 1.00 22.22 N ATOM 146 CA GLU A 12 -25.187 4.486 -4.810 1.00 35.34 C ATOM 147 C GLU A 12 -26.492 3.715 -4.995 1.00 30.44 C ATOM 148 O GLU A 12 -26.686 3.034 -6.002 1.00 41.32 O ATOM 149 CB GLU A 12 -24.934 5.381 -6.025 1.00 64.20 C ATOM 150 CG GLU A 12 -24.095 6.608 -5.712 1.00 75.35 C ATOM 151 CD GLU A 12 -23.731 7.398 -6.955 1.00 25.02 C ATOM 152 OE1 GLU A 12 -24.609 7.567 -7.827 1.00 51.50 O ATOM 153 OE2 GLU A 12 -22.570 7.845 -7.054 1.00 22.11 O1- ATOM 0 H GLU A 12 -24.113 2.721 -5.172 1.00 22.22 H new ATOM 0 HA GLU A 12 -25.276 5.110 -3.921 1.00 35.34 H new ATOM 0 HB2 GLU A 12 -24.435 4.797 -6.798 1.00 64.20 H new ATOM 0 HB3 GLU A 12 -25.892 5.701 -6.436 1.00 64.20 H new ATOM 0 HG2 GLU A 12 -24.642 7.252 -5.024 1.00 75.35 H new ATOM 0 HG3 GLU A 12 -23.183 6.299 -5.202 1.00 75.35 H new ATOM 160 N TYR A 13 -27.382 3.829 -4.015 1.00 22.50 N ATOM 161 CA TYR A 13 -28.668 3.141 -4.068 1.00 61.54 C ATOM 162 C TYR A 13 -29.811 4.137 -4.240 1.00 2.15 C ATOM 163 O TYR A 13 -29.753 5.258 -3.737 1.00 12.31 O ATOM 164 CB TYR A 13 -28.881 2.319 -2.797 1.00 3.33 C ATOM 165 CG TYR A 13 -28.094 1.028 -2.772 1.00 52.40 C ATOM 166 CD1 TYR A 13 -26.707 1.039 -2.681 1.00 2.40 C ATOM 167 CD2 TYR A 13 -28.736 -0.203 -2.839 1.00 44.14 C ATOM 168 CE1 TYR A 13 -25.983 -0.138 -2.659 1.00 40.42 C ATOM 169 CE2 TYR A 13 -28.020 -1.384 -2.816 1.00 2.10 C ATOM 170 CZ TYR A 13 -26.644 -1.346 -2.726 1.00 52.02 C ATOM 171 OH TYR A 13 -25.928 -2.521 -2.703 1.00 41.41 O ATOM 0 H TYR A 13 -27.237 4.390 -3.176 1.00 22.50 H new ATOM 0 HA TYR A 13 -28.660 2.472 -4.929 1.00 61.54 H new ATOM 0 HB2 TYR A 13 -28.601 2.922 -1.933 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -29.942 2.090 -2.696 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -26.186 1.984 -2.627 1.00 2.40 H new ATOM 0 HD2 TYR A 13 -29.813 -0.237 -2.910 1.00 44.14 H new ATOM 0 HE1 TYR A 13 -24.906 -0.112 -2.590 1.00 40.42 H new ATOM 0 HE2 TYR A 13 -28.535 -2.332 -2.868 1.00 2.10 H new ATOM 0 HH TYR A 13 -26.545 -3.281 -2.757 1.00 41.41 H new ATOM 181 N GLU A 14 -30.849 3.717 -4.957 1.00 51.13 N ATOM 182 CA GLU A 14 -32.006 4.571 -5.197 1.00 44.05 C ATOM 183 C GLU A 14 -33.259 3.982 -4.556 1.00 34.43 C ATOM 184 O GLU A 14 -33.396 2.764 -4.439 1.00 43.23 O ATOM 185 CB GLU A 14 -32.227 4.758 -6.700 1.00 41.01 C ATOM 186 CG GLU A 14 -32.624 6.173 -7.086 1.00 63.43 C ATOM 187 CD GLU A 14 -32.473 6.435 -8.572 1.00 53.14 C ATOM 188 OE1 GLU A 14 -32.584 5.473 -9.359 1.00 2.11 O ATOM 189 OE2 GLU A 14 -32.246 7.605 -8.946 1.00 40.11 O1- ATOM 0 H GLU A 14 -30.912 2.792 -5.381 1.00 51.13 H new ATOM 0 HA GLU A 14 -31.809 5.542 -4.743 1.00 44.05 H new ATOM 0 HB2 GLU A 14 -31.313 4.489 -7.229 1.00 41.01 H new ATOM 0 HB3 GLU A 14 -33.003 4.068 -7.033 1.00 41.01 H new ATOM 0 HG2 GLU A 14 -33.659 6.349 -6.793 1.00 63.43 H new ATOM 0 HG3 GLU A 14 -32.011 6.883 -6.531 1.00 63.43 H new ATOM 196 N SER A 15 -34.172 4.856 -4.143 1.00 45.22 N ATOM 197 CA SER A 15 -35.413 4.423 -3.510 1.00 21.12 C ATOM 198 C SER A 15 -36.446 5.545 -3.516 1.00 40.40 C ATOM 199 O SER A 15 -36.240 6.596 -2.910 1.00 61.11 O ATOM 200 CB SER A 15 -35.146 3.969 -2.074 1.00 50.55 C ATOM 201 OG SER A 15 -35.778 2.730 -1.804 1.00 60.35 O ATOM 0 H SER A 15 -34.076 5.867 -4.235 1.00 45.22 H new ATOM 0 HA SER A 15 -35.810 3.584 -4.081 1.00 21.12 H new ATOM 0 HB2 SER A 15 -34.072 3.875 -1.913 1.00 50.55 H new ATOM 0 HB3 SER A 15 -35.508 4.725 -1.377 1.00 50.55 H new ATOM 0 HG SER A 15 -36.746 2.823 -1.926 1.00 60.35 H new ATOM 207 N GLU A 16 -37.557 5.314 -4.208 1.00 11.34 N ATOM 208 CA GLU A 16 -38.622 6.306 -4.295 1.00 40.23 C ATOM 209 C GLU A 16 -39.979 5.675 -3.996 1.00 3.23 C ATOM 210 O GLU A 16 -40.211 4.505 -4.298 1.00 64.35 O ATOM 211 CB GLU A 16 -38.641 6.946 -5.685 1.00 4.30 C ATOM 212 CG GLU A 16 -39.158 6.022 -6.774 1.00 43.20 C ATOM 213 CD GLU A 16 -38.522 6.297 -8.123 1.00 63.23 C ATOM 214 OE1 GLU A 16 -37.836 7.332 -8.254 1.00 62.45 O ATOM 215 OE2 GLU A 16 -38.709 5.478 -9.047 1.00 71.20 O1- ATOM 0 H GLU A 16 -37.743 4.449 -4.716 1.00 11.34 H new ATOM 0 HA GLU A 16 -38.427 7.077 -3.550 1.00 40.23 H new ATOM 0 HB2 GLU A 16 -39.262 7.841 -5.655 1.00 4.30 H new ATOM 0 HB3 GLU A 16 -37.631 7.267 -5.942 1.00 4.30 H new ATOM 0 HG2 GLU A 16 -38.965 4.988 -6.490 1.00 43.20 H new ATOM 0 HG3 GLU A 16 -40.239 6.133 -6.857 1.00 43.20 H new ATOM 222 N ALA A 17 -40.871 6.459 -3.398 1.00 45.31 N ATOM 223 CA ALA A 17 -42.204 5.978 -3.058 1.00 31.31 C ATOM 224 C ALA A 17 -43.145 6.077 -4.254 1.00 53.14 C ATOM 225 O ALA A 17 -43.665 7.151 -4.560 1.00 52.54 O ATOM 226 CB ALA A 17 -42.763 6.760 -1.879 1.00 33.40 C ATOM 0 H ALA A 17 -40.694 7.430 -3.139 1.00 45.31 H new ATOM 0 HA ALA A 17 -42.123 4.928 -2.778 1.00 31.31 H new ATOM 0 HB1 ALA A 17 -43.759 6.390 -1.636 1.00 33.40 H new ATOM 0 HB2 ALA A 17 -42.109 6.634 -1.016 1.00 33.40 H new ATOM 0 HB3 ALA A 17 -42.822 7.817 -2.139 1.00 33.40 H new ATOM 232 N ARG A 18 -43.358 4.953 -4.929 1.00 33.11 N ATOM 233 CA ARG A 18 -44.235 4.914 -6.093 1.00 74.51 C ATOM 234 C ARG A 18 -45.695 4.782 -5.670 1.00 1.22 C ATOM 235 O ARG A 18 -46.027 3.988 -4.790 1.00 0.43 O ATOM 236 CB ARG A 18 -43.851 3.751 -7.009 1.00 24.01 C ATOM 237 CG ARG A 18 -42.386 3.754 -7.415 1.00 71.34 C ATOM 238 CD ARG A 18 -42.133 2.828 -8.596 1.00 21.32 C ATOM 239 NE ARG A 18 -42.284 3.519 -9.873 1.00 34.15 N ATOM 240 CZ ARG A 18 -42.214 2.909 -11.051 1.00 3.12 C ATOM 241 NH1 ARG A 18 -41.997 1.602 -11.112 1.00 25.32 N1+ ATOM 242 NH2 ARG A 18 -42.362 3.605 -12.171 1.00 33.24 N ATOM 0 H ARG A 18 -42.935 4.056 -4.690 1.00 33.11 H new ATOM 0 HA ARG A 18 -44.116 5.851 -6.637 1.00 74.51 H new ATOM 0 HB2 ARG A 18 -44.078 2.812 -6.504 1.00 24.01 H new ATOM 0 HB3 ARG A 18 -44.468 3.787 -7.907 1.00 24.01 H new ATOM 0 HG2 ARG A 18 -42.081 4.768 -7.674 1.00 71.34 H new ATOM 0 HG3 ARG A 18 -41.772 3.443 -6.569 1.00 71.34 H new ATOM 0 HD2 ARG A 18 -41.127 2.415 -8.524 1.00 21.32 H new ATOM 0 HD3 ARG A 18 -42.827 1.988 -8.554 1.00 21.32 H new ATOM 0 HE ARG A 18 -42.452 4.525 -9.860 1.00 34.15 H new ATOM 0 HH11 ARG A 18 -41.884 1.063 -10.253 1.00 25.32 H new ATOM 0 HH12 ARG A 18 -41.944 1.136 -12.018 1.00 25.32 H new ATOM 0 HH21 ARG A 18 -42.530 4.610 -12.128 1.00 33.24 H new ATOM 0 HH22 ARG A 18 -42.308 3.135 -13.075 1.00 33.24 H new ATOM 256 N ASP A 19 -46.562 5.565 -6.302 1.00 32.20 N ATOM 257 CA ASP A 19 -47.986 5.535 -5.992 1.00 41.34 C ATOM 258 C ASP A 19 -48.604 4.202 -6.402 1.00 44.41 C ATOM 259 O ASP A 19 -48.335 3.689 -7.490 1.00 5.35 O ATOM 260 CB ASP A 19 -48.708 6.685 -6.697 1.00 22.55 C ATOM 261 CG ASP A 19 -48.564 6.620 -8.205 1.00 73.34 C ATOM 262 OD1 ASP A 19 -47.413 6.615 -8.692 1.00 3.01 O ATOM 263 OD2 ASP A 19 -49.601 6.574 -8.898 1.00 24.34 O1- ATOM 0 H ASP A 19 -46.303 6.228 -7.032 1.00 32.20 H new ATOM 0 HA ASP A 19 -48.100 5.651 -4.914 1.00 41.34 H new ATOM 0 HB2 ASP A 19 -49.766 6.662 -6.434 1.00 22.55 H new ATOM 0 HB3 ASP A 19 -48.311 7.634 -6.337 1.00 22.55 H new ATOM 268 N THR A 20 -49.433 3.644 -5.526 1.00 61.12 N ATOM 269 CA THR A 20 -50.088 2.370 -5.796 1.00 12.12 C ATOM 270 C THR A 20 -51.352 2.566 -6.625 1.00 54.32 C ATOM 271 O THR A 20 -51.828 3.688 -6.795 1.00 54.42 O ATOM 272 CB THR A 20 -50.452 1.638 -4.491 1.00 40.23 C ATOM 273 OG1 THR A 20 -51.010 0.353 -4.789 1.00 70.42 O ATOM 274 CG2 THR A 20 -51.446 2.450 -3.674 1.00 72.02 C ATOM 0 H THR A 20 -49.667 4.055 -4.622 1.00 61.12 H new ATOM 0 HA THR A 20 -49.379 1.763 -6.359 1.00 12.12 H new ATOM 0 HB THR A 20 -49.541 1.512 -3.906 1.00 40.23 H new ATOM 0 HG1 THR A 20 -51.237 -0.107 -3.954 1.00 70.42 H new ATOM 0 HG21 THR A 20 -51.688 1.913 -2.757 1.00 72.02 H new ATOM 0 HG22 THR A 20 -51.008 3.416 -3.424 1.00 72.02 H new ATOM 0 HG23 THR A 20 -52.355 2.604 -4.255 1.00 72.02 H new ATOM 282 N LYS A 21 -51.890 1.466 -7.142 1.00 3.44 N ATOM 283 CA LYS A 21 -53.101 1.516 -7.953 1.00 22.44 C ATOM 284 C LYS A 21 -54.346 1.403 -7.080 1.00 14.33 C ATOM 285 O LYS A 21 -55.466 1.314 -7.585 1.00 74.45 O ATOM 286 CB LYS A 21 -53.090 0.392 -8.992 1.00 24.43 C ATOM 287 CG LYS A 21 -52.942 -0.994 -8.387 1.00 51.34 C ATOM 288 CD LYS A 21 -54.238 -1.781 -8.474 1.00 33.02 C ATOM 289 CE LYS A 21 -54.431 -2.673 -7.258 1.00 63.52 C ATOM 290 NZ LYS A 21 -53.822 -4.017 -7.454 1.00 64.01 N1+ ATOM 0 H LYS A 21 -51.507 0.530 -7.014 1.00 3.44 H new ATOM 0 HA LYS A 21 -53.125 2.477 -8.466 1.00 22.44 H new ATOM 0 HB2 LYS A 21 -54.015 0.431 -9.567 1.00 24.43 H new ATOM 0 HB3 LYS A 21 -52.272 0.563 -9.692 1.00 24.43 H new ATOM 0 HG2 LYS A 21 -52.151 -1.536 -8.905 1.00 51.34 H new ATOM 0 HG3 LYS A 21 -52.638 -0.906 -7.344 1.00 51.34 H new ATOM 0 HD2 LYS A 21 -55.078 -1.092 -8.558 1.00 33.02 H new ATOM 0 HD3 LYS A 21 -54.234 -2.391 -9.377 1.00 33.02 H new ATOM 0 HE2 LYS A 21 -53.986 -2.197 -6.384 1.00 63.52 H new ATOM 0 HE3 LYS A 21 -55.496 -2.783 -7.054 1.00 63.52 H new ATOM 0 HZ1 LYS A 21 -53.975 -4.595 -6.603 1.00 64.01 H new ATOM 0 HZ2 LYS A 21 -54.264 -4.482 -8.273 1.00 64.01 H new ATOM 0 HZ3 LYS A 21 -52.801 -3.914 -7.624 1.00 64.01 H new ATOM 304 N LEU A 22 -54.145 1.408 -5.767 1.00 11.11 N ATOM 305 CA LEU A 22 -55.252 1.307 -4.823 1.00 62.04 C ATOM 306 C LEU A 22 -55.599 2.675 -4.242 1.00 2.31 C ATOM 307 O LEU A 22 -56.498 2.798 -3.411 1.00 51.15 O ATOM 308 CB LEU A 22 -54.899 0.337 -3.694 1.00 32.22 C ATOM 309 CG LEU A 22 -55.981 -0.676 -3.316 1.00 53.13 C ATOM 310 CD1 LEU A 22 -57.300 0.030 -3.045 1.00 24.41 C ATOM 311 CD2 LEU A 22 -56.145 -1.716 -4.415 1.00 34.53 C ATOM 0 H LEU A 22 -53.225 1.481 -5.332 1.00 11.11 H new ATOM 0 HA LEU A 22 -56.122 0.929 -5.361 1.00 62.04 H new ATOM 0 HB2 LEU A 22 -54.001 -0.211 -3.980 1.00 32.22 H new ATOM 0 HB3 LEU A 22 -54.649 0.919 -2.807 1.00 32.22 H new ATOM 0 HG LEU A 22 -55.672 -1.187 -2.404 1.00 53.13 H new ATOM 0 HD11 LEU A 22 -58.058 -0.706 -2.778 1.00 24.41 H new ATOM 0 HD12 LEU A 22 -57.173 0.735 -2.224 1.00 24.41 H new ATOM 0 HD13 LEU A 22 -57.615 0.567 -3.939 1.00 24.41 H new ATOM 0 HD21 LEU A 22 -56.919 -2.429 -4.129 1.00 34.53 H new ATOM 0 HD22 LEU A 22 -56.432 -1.222 -5.343 1.00 34.53 H new ATOM 0 HD23 LEU A 22 -55.202 -2.243 -4.561 1.00 34.53 H new ATOM 323 N GLY A 23 -54.881 3.701 -4.690 1.00 52.15 N ATOM 324 CA GLY A 23 -55.131 5.046 -4.206 1.00 43.34 C ATOM 325 C GLY A 23 -54.356 5.360 -2.941 1.00 14.33 C ATOM 326 O GLY A 23 -54.896 5.336 -1.835 1.00 42.31 O ATOM 0 H GLY A 23 -54.132 3.625 -5.378 1.00 52.15 H new ATOM 0 HA2 GLY A 23 -54.862 5.764 -4.981 1.00 43.34 H new ATOM 0 HA3 GLY A 23 -56.197 5.168 -4.015 1.00 43.34 H new ATOM 330 N PRO A 24 -53.059 5.663 -3.097 1.00 42.45 N ATOM 331 CA PRO A 24 -52.180 5.987 -1.969 1.00 55.11 C ATOM 332 C PRO A 24 -52.519 7.333 -1.340 1.00 31.25 C ATOM 333 O PRO A 24 -53.339 8.085 -1.865 1.00 23.44 O ATOM 334 CB PRO A 24 -50.788 6.028 -2.603 1.00 4.11 C ATOM 335 CG PRO A 24 -51.034 6.352 -4.037 1.00 61.03 C ATOM 336 CD PRO A 24 -52.348 5.710 -4.386 1.00 45.53 C ATOM 0 HA PRO A 24 -52.272 5.263 -1.159 1.00 55.11 H new ATOM 0 HB2 PRO A 24 -50.159 6.782 -2.129 1.00 4.11 H new ATOM 0 HB3 PRO A 24 -50.276 5.072 -2.495 1.00 4.11 H new ATOM 0 HG2 PRO A 24 -51.073 7.430 -4.193 1.00 61.03 H new ATOM 0 HG3 PRO A 24 -50.232 5.968 -4.667 1.00 61.03 H new ATOM 0 HD2 PRO A 24 -52.896 6.293 -5.126 1.00 45.53 H new ATOM 0 HD3 PRO A 24 -52.209 4.713 -4.805 1.00 45.53 H new ATOM 344 N GLU A 25 -51.882 7.632 -0.211 1.00 30.43 N ATOM 345 CA GLU A 25 -52.117 8.889 0.489 1.00 61.13 C ATOM 346 C GLU A 25 -50.812 9.461 1.035 1.00 2.52 C ATOM 347 O GLU A 25 -50.536 10.651 0.891 1.00 75.32 O ATOM 348 CB GLU A 25 -53.114 8.682 1.633 1.00 32.13 C ATOM 349 CG GLU A 25 -54.567 8.722 1.189 1.00 54.54 C ATOM 350 CD GLU A 25 -55.016 10.114 0.788 1.00 55.02 C ATOM 351 OE1 GLU A 25 -55.207 10.957 1.690 1.00 54.21 O ATOM 352 OE2 GLU A 25 -55.179 10.360 -0.425 1.00 12.11 O1- ATOM 0 H GLU A 25 -51.200 7.021 0.237 1.00 30.43 H new ATOM 0 HA GLU A 25 -52.534 9.600 -0.224 1.00 61.13 H new ATOM 0 HB2 GLU A 25 -52.914 7.722 2.108 1.00 32.13 H new ATOM 0 HB3 GLU A 25 -52.952 9.451 2.388 1.00 32.13 H new ATOM 0 HG2 GLU A 25 -54.705 8.043 0.347 1.00 54.54 H new ATOM 0 HG3 GLU A 25 -55.201 8.359 1.998 1.00 54.54 H new ATOM 359 N GLU A 26 -50.013 8.603 1.662 1.00 43.40 N ATOM 360 CA GLU A 26 -48.738 9.022 2.231 1.00 42.11 C ATOM 361 C GLU A 26 -47.793 7.835 2.383 1.00 25.51 C ATOM 362 O GLU A 26 -48.230 6.686 2.457 1.00 40.12 O ATOM 363 CB GLU A 26 -48.956 9.693 3.589 1.00 74.23 C ATOM 364 CG GLU A 26 -49.387 8.728 4.681 1.00 70.14 C ATOM 365 CD GLU A 26 -50.335 9.363 5.680 1.00 31.34 C ATOM 366 OE1 GLU A 26 -51.486 9.660 5.300 1.00 24.24 O ATOM 367 OE2 GLU A 26 -49.925 9.563 6.843 1.00 61.41 O1- ATOM 0 H GLU A 26 -50.227 7.614 1.789 1.00 43.40 H new ATOM 0 HA GLU A 26 -48.283 9.740 1.548 1.00 42.11 H new ATOM 0 HB2 GLU A 26 -48.033 10.185 3.894 1.00 74.23 H new ATOM 0 HB3 GLU A 26 -49.712 10.471 3.484 1.00 74.23 H new ATOM 0 HG2 GLU A 26 -49.870 7.863 4.226 1.00 70.14 H new ATOM 0 HG3 GLU A 26 -48.505 8.361 5.206 1.00 70.14 H new ATOM 374 N ILE A 27 -46.495 8.120 2.427 1.00 34.23 N ATOM 375 CA ILE A 27 -45.488 7.076 2.570 1.00 51.54 C ATOM 376 C ILE A 27 -45.443 6.550 4.000 1.00 3.43 C ATOM 377 O ILE A 27 -45.662 7.294 4.956 1.00 75.14 O ATOM 378 CB ILE A 27 -44.090 7.586 2.177 1.00 31.11 C ATOM 379 CG1 ILE A 27 -43.135 6.411 1.966 1.00 64.55 C ATOM 380 CG2 ILE A 27 -43.551 8.527 3.244 1.00 22.12 C ATOM 381 CD1 ILE A 27 -41.744 6.829 1.543 1.00 33.44 C ATOM 0 H ILE A 27 -46.117 9.065 2.366 1.00 34.23 H new ATOM 0 HA ILE A 27 -45.772 6.267 1.897 1.00 51.54 H new ATOM 0 HB ILE A 27 -44.171 8.137 1.240 1.00 31.11 H new ATOM 0 HG12 ILE A 27 -43.068 5.838 2.891 1.00 64.55 H new ATOM 0 HG13 ILE A 27 -43.552 5.747 1.209 1.00 64.55 H new ATOM 0 HG21 ILE A 27 -42.562 8.879 2.952 1.00 22.12 H new ATOM 0 HG22 ILE A 27 -44.223 9.379 3.351 1.00 22.12 H new ATOM 0 HG23 ILE A 27 -43.482 7.998 4.194 1.00 22.12 H new ATOM 0 HD11 ILE A 27 -41.122 5.944 1.412 1.00 33.44 H new ATOM 0 HD12 ILE A 27 -41.799 7.376 0.602 1.00 33.44 H new ATOM 0 HD13 ILE A 27 -41.307 7.469 2.310 1.00 33.44 H new ATOM 393 N THR A 28 -45.154 5.259 4.141 1.00 23.51 N ATOM 394 CA THR A 28 -45.079 4.631 5.454 1.00 45.35 C ATOM 395 C THR A 28 -44.118 3.447 5.443 1.00 32.33 C ATOM 396 O THR A 28 -43.523 3.128 4.413 1.00 33.43 O ATOM 397 CB THR A 28 -46.463 4.150 5.927 1.00 53.03 C ATOM 398 OG1 THR A 28 -46.415 3.811 7.317 1.00 4.11 O ATOM 399 CG2 THR A 28 -46.921 2.944 5.121 1.00 21.31 C ATOM 0 H THR A 28 -44.968 4.629 3.361 1.00 23.51 H new ATOM 0 HA THR A 28 -44.710 5.388 6.146 1.00 45.35 H new ATOM 0 HB THR A 28 -47.176 4.960 5.776 1.00 53.03 H new ATOM 0 HG1 THR A 28 -47.299 3.508 7.610 1.00 4.11 H new ATOM 0 HG21 THR A 28 -47.901 2.622 5.473 1.00 21.31 H new ATOM 0 HG22 THR A 28 -46.985 3.214 4.067 1.00 21.31 H new ATOM 0 HG23 THR A 28 -46.206 2.131 5.245 1.00 21.31 H new ATOM 407 N ARG A 29 -43.971 2.801 6.594 1.00 14.42 N ATOM 408 CA ARG A 29 -43.081 1.651 6.717 1.00 74.04 C ATOM 409 C ARG A 29 -43.831 0.439 7.261 1.00 61.04 C ATOM 410 O ARG A 29 -44.444 0.504 8.327 1.00 23.41 O ATOM 411 CB ARG A 29 -41.902 1.989 7.631 1.00 13.44 C ATOM 412 CG ARG A 29 -42.191 3.116 8.608 1.00 21.03 C ATOM 413 CD ARG A 29 -43.212 2.698 9.654 1.00 15.43 C ATOM 414 NE ARG A 29 -43.013 3.395 10.923 1.00 11.32 N ATOM 415 CZ ARG A 29 -43.565 3.010 12.067 1.00 74.13 C ATOM 416 NH1 ARG A 29 -44.346 1.939 12.104 1.00 53.55 N1+ ATOM 417 NH2 ARG A 29 -43.337 3.697 13.180 1.00 74.03 N ATOM 0 H ARG A 29 -44.456 3.053 7.455 1.00 14.42 H new ATOM 0 HA ARG A 29 -42.704 1.406 5.724 1.00 74.04 H new ATOM 0 HB2 ARG A 29 -41.621 1.097 8.191 1.00 13.44 H new ATOM 0 HB3 ARG A 29 -41.044 2.263 7.017 1.00 13.44 H new ATOM 0 HG2 ARG A 29 -41.267 3.418 9.100 1.00 21.03 H new ATOM 0 HG3 ARG A 29 -42.561 3.985 8.064 1.00 21.03 H new ATOM 0 HD2 ARG A 29 -44.216 2.902 9.282 1.00 15.43 H new ATOM 0 HD3 ARG A 29 -43.145 1.622 9.817 1.00 15.43 H new ATOM 0 HE ARG A 29 -42.417 4.223 10.930 1.00 11.32 H new ATOM 0 HH11 ARG A 29 -44.524 1.408 11.251 1.00 53.55 H new ATOM 0 HH12 ARG A 29 -44.768 1.646 12.985 1.00 53.55 H new ATOM 0 HH21 ARG A 29 -42.737 4.522 13.156 1.00 74.03 H new ATOM 0 HH22 ARG A 29 -43.762 3.400 14.059 1.00 74.03 H new ATOM 431 N ASP A 30 -43.778 -0.663 6.522 1.00 64.35 N ATOM 432 CA ASP A 30 -44.451 -1.891 6.930 1.00 0.23 C ATOM 433 C ASP A 30 -43.686 -3.117 6.446 1.00 34.02 C ATOM 434 O ASP A 30 -43.920 -3.612 5.343 1.00 14.01 O ATOM 435 CB ASP A 30 -45.881 -1.918 6.388 1.00 31.35 C ATOM 436 CG ASP A 30 -46.561 -3.254 6.618 1.00 31.41 C ATOM 437 OD1 ASP A 30 -47.014 -3.500 7.754 1.00 64.23 O ATOM 438 OD2 ASP A 30 -46.642 -4.051 5.660 1.00 50.33 O1- ATOM 0 H ASP A 30 -43.276 -0.732 5.637 1.00 64.35 H new ATOM 0 HA ASP A 30 -44.484 -1.914 8.019 1.00 0.23 H new ATOM 0 HB2 ASP A 30 -46.463 -1.130 6.866 1.00 31.35 H new ATOM 0 HB3 ASP A 30 -45.866 -1.700 5.320 1.00 31.35 H new ATOM 443 N ILE A 31 -42.769 -3.603 7.276 1.00 63.23 N ATOM 444 CA ILE A 31 -41.969 -4.772 6.932 1.00 25.31 C ATOM 445 C ILE A 31 -42.351 -5.973 7.792 1.00 64.24 C ATOM 446 O ILE A 31 -41.699 -6.285 8.789 1.00 20.01 O ATOM 447 CB ILE A 31 -40.463 -4.493 7.099 1.00 73.13 C ATOM 448 CG1 ILE A 31 -40.140 -3.056 6.687 1.00 24.14 C ATOM 449 CG2 ILE A 31 -39.648 -5.481 6.279 1.00 43.12 C ATOM 450 CD1 ILE A 31 -40.553 -2.726 5.269 1.00 71.21 C ATOM 0 H ILE A 31 -42.562 -3.205 8.192 1.00 63.23 H new ATOM 0 HA ILE A 31 -42.174 -4.998 5.886 1.00 25.31 H new ATOM 0 HB ILE A 31 -40.199 -4.618 8.149 1.00 73.13 H new ATOM 0 HG12 ILE A 31 -40.639 -2.370 7.371 1.00 24.14 H new ATOM 0 HG13 ILE A 31 -39.068 -2.889 6.793 1.00 24.14 H new ATOM 0 HG21 ILE A 31 -38.586 -5.271 6.407 1.00 43.12 H new ATOM 0 HG22 ILE A 31 -39.861 -6.496 6.615 1.00 43.12 H new ATOM 0 HG23 ILE A 31 -39.912 -5.385 5.226 1.00 43.12 H new ATOM 0 HD11 ILE A 31 -40.293 -1.691 5.046 1.00 71.21 H new ATOM 0 HD12 ILE A 31 -40.034 -3.388 4.576 1.00 71.21 H new ATOM 0 HD13 ILE A 31 -41.629 -2.861 5.163 1.00 71.21 H new ATOM 462 N PRO A 32 -43.431 -6.663 7.399 1.00 34.15 N ATOM 463 CA PRO A 32 -43.923 -7.841 8.118 1.00 63.53 C ATOM 464 C PRO A 32 -42.987 -9.037 7.979 1.00 74.13 C ATOM 465 O PRO A 32 -42.351 -9.222 6.943 1.00 52.54 O ATOM 466 CB PRO A 32 -45.266 -8.133 7.445 1.00 61.33 C ATOM 467 CG PRO A 32 -45.138 -7.554 6.078 1.00 72.25 C ATOM 468 CD PRO A 32 -44.256 -6.346 6.221 1.00 11.40 C ATOM 0 HA PRO A 32 -43.999 -7.661 9.190 1.00 63.53 H new ATOM 0 HB2 PRO A 32 -45.464 -9.204 7.404 1.00 61.33 H new ATOM 0 HB3 PRO A 32 -46.091 -7.677 7.993 1.00 61.33 H new ATOM 0 HG2 PRO A 32 -44.702 -8.276 5.388 1.00 72.25 H new ATOM 0 HG3 PRO A 32 -46.114 -7.279 5.678 1.00 72.25 H new ATOM 0 HD2 PRO A 32 -43.644 -6.188 5.333 1.00 11.40 H new ATOM 0 HD3 PRO A 32 -44.840 -5.438 6.372 1.00 11.40 H new ATOM 476 N ASN A 33 -42.909 -9.846 9.031 1.00 71.22 N ATOM 477 CA ASN A 33 -42.049 -11.024 9.027 1.00 2.45 C ATOM 478 C ASN A 33 -40.582 -10.628 8.905 1.00 2.05 C ATOM 479 O ASN A 33 -39.784 -11.338 8.295 1.00 32.14 O ATOM 480 CB ASN A 33 -42.434 -11.956 7.875 1.00 52.30 C ATOM 481 CG ASN A 33 -43.936 -12.103 7.726 1.00 14.10 C ATOM 482 OD1 ASN A 33 -44.659 -12.233 8.714 1.00 31.13 O ATOM 483 ND2 ASN A 33 -44.413 -12.082 6.487 1.00 31.33 N ATOM 0 H ASN A 33 -43.431 -9.707 9.897 1.00 71.22 H new ATOM 0 HA ASN A 33 -42.187 -11.547 9.973 1.00 2.45 H new ATOM 0 HB2 ASN A 33 -42.016 -11.571 6.945 1.00 52.30 H new ATOM 0 HB3 ASN A 33 -41.991 -12.938 8.042 1.00 52.30 H new ATOM 0 HD21 ASN A 33 -45.416 -12.176 6.325 1.00 31.33 H new ATOM 0 HD22 ASN A 33 -43.777 -11.972 5.697 1.00 31.33 H new ATOM 490 N VAL A 34 -40.232 -9.488 9.493 1.00 34.42 N ATOM 491 CA VAL A 34 -38.860 -8.996 9.454 1.00 3.55 C ATOM 492 C VAL A 34 -38.132 -9.293 10.759 1.00 63.25 C ATOM 493 O VAL A 34 -38.755 -9.438 11.811 1.00 72.34 O ATOM 494 CB VAL A 34 -38.815 -7.480 9.187 1.00 61.54 C ATOM 495 CG1 VAL A 34 -39.327 -6.710 10.393 1.00 74.44 C ATOM 496 CG2 VAL A 34 -37.402 -7.046 8.827 1.00 63.24 C ATOM 0 H VAL A 34 -40.880 -8.888 10.002 1.00 34.42 H new ATOM 0 HA VAL A 34 -38.361 -9.516 8.637 1.00 3.55 H new ATOM 0 HB VAL A 34 -39.466 -7.257 8.342 1.00 61.54 H new ATOM 0 HG11 VAL A 34 -39.288 -5.641 10.185 1.00 74.44 H new ATOM 0 HG12 VAL A 34 -40.357 -7.002 10.601 1.00 74.44 H new ATOM 0 HG13 VAL A 34 -38.705 -6.935 11.259 1.00 74.44 H new ATOM 0 HG21 VAL A 34 -37.387 -5.972 8.641 1.00 63.24 H new ATOM 0 HG22 VAL A 34 -36.728 -7.281 9.651 1.00 63.24 H new ATOM 0 HG23 VAL A 34 -37.077 -7.574 7.930 1.00 63.24 H new ATOM 506 N GLY A 35 -36.807 -9.382 10.685 1.00 71.54 N ATOM 507 CA GLY A 35 -36.016 -9.661 11.869 1.00 61.21 C ATOM 508 C GLY A 35 -35.892 -8.456 12.782 1.00 63.23 C ATOM 509 O GLY A 35 -35.714 -7.332 12.314 1.00 50.52 O ATOM 0 H GLY A 35 -36.268 -9.266 9.827 1.00 71.54 H new ATOM 0 HA2 GLY A 35 -36.470 -10.485 12.420 1.00 61.21 H new ATOM 0 HA3 GLY A 35 -35.021 -9.989 11.568 1.00 61.21 H new ATOM 513 N GLU A 36 -35.990 -8.691 14.086 1.00 25.34 N ATOM 514 CA GLU A 36 -35.891 -7.616 15.066 1.00 23.30 C ATOM 515 C GLU A 36 -34.595 -6.832 14.884 1.00 75.14 C ATOM 516 O GLU A 36 -34.546 -5.627 15.132 1.00 34.31 O ATOM 517 CB GLU A 36 -35.964 -8.181 16.486 1.00 11.14 C ATOM 518 CG GLU A 36 -37.381 -8.310 17.017 1.00 41.24 C ATOM 519 CD GLU A 36 -37.438 -8.317 18.532 1.00 1.32 C ATOM 520 OE1 GLU A 36 -37.285 -9.403 19.129 1.00 11.12 O ATOM 521 OE2 GLU A 36 -37.635 -7.233 19.122 1.00 24.50 O1- ATOM 0 H GLU A 36 -36.138 -9.616 14.489 1.00 25.34 H new ATOM 0 HA GLU A 36 -36.730 -6.938 14.910 1.00 23.30 H new ATOM 0 HB2 GLU A 36 -35.488 -9.161 16.503 1.00 11.14 H new ATOM 0 HB3 GLU A 36 -35.392 -7.537 17.154 1.00 11.14 H new ATOM 0 HG2 GLU A 36 -37.983 -7.484 16.638 1.00 41.24 H new ATOM 0 HG3 GLU A 36 -37.825 -9.230 16.636 1.00 41.24 H new ATOM 528 N ASP A 37 -33.548 -7.524 14.450 1.00 22.02 N ATOM 529 CA ASP A 37 -32.250 -6.894 14.234 1.00 32.15 C ATOM 530 C ASP A 37 -32.296 -5.955 13.033 1.00 14.55 C ATOM 531 O ASP A 37 -31.625 -4.923 13.013 1.00 61.42 O ATOM 532 CB ASP A 37 -31.172 -7.959 14.025 1.00 75.52 C ATOM 533 CG ASP A 37 -30.766 -8.635 15.319 1.00 61.23 C ATOM 534 OD1 ASP A 37 -31.292 -8.243 16.383 1.00 2.44 O ATOM 535 OD2 ASP A 37 -29.925 -9.555 15.268 1.00 44.23 O1- ATOM 0 H ASP A 37 -33.572 -8.522 14.241 1.00 22.02 H new ATOM 0 HA ASP A 37 -32.004 -6.309 15.120 1.00 32.15 H new ATOM 0 HB2 ASP A 37 -31.539 -8.710 13.326 1.00 75.52 H new ATOM 0 HB3 ASP A 37 -30.295 -7.499 13.568 1.00 75.52 H new ATOM 540 N ALA A 38 -33.091 -6.320 12.032 1.00 41.12 N ATOM 541 CA ALA A 38 -33.224 -5.509 10.828 1.00 33.22 C ATOM 542 C ALA A 38 -33.870 -4.164 11.141 1.00 61.11 C ATOM 543 O ALA A 38 -33.715 -3.199 10.390 1.00 73.30 O ATOM 544 CB ALA A 38 -34.034 -6.255 9.777 1.00 54.45 C ATOM 0 H ALA A 38 -33.652 -7.172 12.031 1.00 41.12 H new ATOM 0 HA ALA A 38 -32.225 -5.319 10.434 1.00 33.22 H new ATOM 0 HB1 ALA A 38 -34.126 -5.638 8.883 1.00 54.45 H new ATOM 0 HB2 ALA A 38 -33.530 -7.188 9.524 1.00 54.45 H new ATOM 0 HB3 ALA A 38 -35.027 -6.474 10.170 1.00 54.45 H new ATOM 550 N LEU A 39 -34.596 -4.106 12.251 1.00 44.35 N ATOM 551 CA LEU A 39 -35.268 -2.878 12.664 1.00 51.12 C ATOM 552 C LEU A 39 -34.706 -2.368 13.986 1.00 25.44 C ATOM 553 O LEU A 39 -35.308 -1.517 14.641 1.00 75.32 O ATOM 554 CB LEU A 39 -36.773 -3.116 12.794 1.00 75.42 C ATOM 555 CG LEU A 39 -37.194 -4.285 13.684 1.00 63.45 C ATOM 556 CD1 LEU A 39 -37.250 -3.853 15.142 1.00 3.12 C ATOM 557 CD2 LEU A 39 -38.539 -4.839 13.238 1.00 33.13 C ATOM 0 H LEU A 39 -34.735 -4.895 12.882 1.00 44.35 H new ATOM 0 HA LEU A 39 -35.091 -2.121 11.900 1.00 51.12 H new ATOM 0 HB2 LEU A 39 -37.232 -2.207 13.182 1.00 75.42 H new ATOM 0 HB3 LEU A 39 -37.182 -3.279 11.797 1.00 75.42 H new ATOM 0 HG LEU A 39 -36.449 -5.075 13.589 1.00 63.45 H new ATOM 0 HD11 LEU A 39 -37.551 -4.698 15.761 1.00 3.12 H new ATOM 0 HD12 LEU A 39 -36.266 -3.506 15.457 1.00 3.12 H new ATOM 0 HD13 LEU A 39 -37.973 -3.045 15.255 1.00 3.12 H new ATOM 0 HD21 LEU A 39 -38.822 -5.671 13.883 1.00 33.13 H new ATOM 0 HD22 LEU A 39 -39.295 -4.056 13.303 1.00 33.13 H new ATOM 0 HD23 LEU A 39 -38.465 -5.188 12.208 1.00 33.13 H new ATOM 569 N ARG A 40 -33.547 -2.891 14.373 1.00 20.52 N ATOM 570 CA ARG A 40 -32.903 -2.487 15.617 1.00 43.52 C ATOM 571 C ARG A 40 -32.407 -1.047 15.530 1.00 33.33 C ATOM 572 O ARG A 40 -32.374 -0.331 16.529 1.00 61.33 O ATOM 573 CB ARG A 40 -31.735 -3.422 15.937 1.00 31.43 C ATOM 574 CG ARG A 40 -30.505 -3.175 15.080 1.00 41.24 C ATOM 575 CD ARG A 40 -29.530 -4.339 15.157 1.00 43.45 C ATOM 576 NE ARG A 40 -28.159 -3.925 14.871 1.00 63.04 N ATOM 577 CZ ARG A 40 -27.154 -4.777 14.694 1.00 32.22 C ATOM 578 NH1 ARG A 40 -27.367 -6.083 14.775 1.00 22.50 N1+ ATOM 579 NH2 ARG A 40 -25.935 -4.323 14.438 1.00 20.05 N ATOM 0 H ARG A 40 -33.035 -3.596 13.843 1.00 20.52 H new ATOM 0 HA ARG A 40 -33.641 -2.551 16.417 1.00 43.52 H new ATOM 0 HB2 ARG A 40 -31.465 -3.306 16.987 1.00 31.43 H new ATOM 0 HB3 ARG A 40 -32.059 -4.454 15.803 1.00 31.43 H new ATOM 0 HG2 ARG A 40 -30.807 -3.020 14.044 1.00 41.24 H new ATOM 0 HG3 ARG A 40 -30.009 -2.261 15.408 1.00 41.24 H new ATOM 0 HD2 ARG A 40 -29.574 -4.784 16.151 1.00 43.45 H new ATOM 0 HD3 ARG A 40 -29.831 -5.111 14.449 1.00 43.45 H new ATOM 0 HE ARG A 40 -27.962 -2.927 14.803 1.00 63.04 H new ATOM 0 HH11 ARG A 40 -28.303 -6.436 14.973 1.00 22.50 H new ATOM 0 HH12 ARG A 40 -26.595 -6.735 14.639 1.00 22.50 H new ATOM 0 HH21 ARG A 40 -25.767 -3.319 14.377 1.00 20.05 H new ATOM 0 HH22 ARG A 40 -25.165 -4.978 14.302 1.00 20.05 H new ATOM 593 N ASN A 41 -32.023 -0.630 14.328 1.00 55.32 N ATOM 594 CA ASN A 41 -31.527 0.724 14.110 1.00 71.13 C ATOM 595 C ASN A 41 -32.590 1.591 13.442 1.00 35.30 C ATOM 596 O ASN A 41 -32.580 2.815 13.573 1.00 31.23 O ATOM 597 CB ASN A 41 -30.261 0.695 13.252 1.00 34.41 C ATOM 598 CG ASN A 41 -29.221 -0.269 13.787 1.00 10.32 C ATOM 599 OD1 ASN A 41 -28.877 -0.235 14.969 1.00 32.53 O ATOM 600 ND2 ASN A 41 -28.714 -1.136 12.917 1.00 61.32 N ATOM 0 H ASN A 41 -32.046 -1.211 13.490 1.00 55.32 H new ATOM 0 HA ASN A 41 -31.288 1.158 15.081 1.00 71.13 H new ATOM 0 HB2 ASN A 41 -30.523 0.413 12.232 1.00 34.41 H new ATOM 0 HB3 ASN A 41 -29.834 1.697 13.206 1.00 34.41 H new ATOM 0 HD21 ASN A 41 -28.010 -1.809 13.219 1.00 61.32 H new ATOM 0 HD22 ASN A 41 -29.029 -1.128 11.947 1.00 61.32 H new ATOM 607 N LEU A 42 -33.505 0.947 12.726 1.00 5.31 N ATOM 608 CA LEU A 42 -34.576 1.659 12.037 1.00 1.45 C ATOM 609 C LEU A 42 -35.355 2.542 13.006 1.00 41.30 C ATOM 610 O LEU A 42 -35.678 2.126 14.119 1.00 64.12 O ATOM 611 CB LEU A 42 -35.522 0.665 11.361 1.00 35.41 C ATOM 612 CG LEU A 42 -36.137 1.119 10.036 1.00 32.44 C ATOM 613 CD1 LEU A 42 -35.338 0.573 8.863 1.00 21.05 C ATOM 614 CD2 LEU A 42 -37.591 0.679 9.945 1.00 43.22 C ATOM 0 H LEU A 42 -33.527 -0.066 12.607 1.00 5.31 H new ATOM 0 HA LEU A 42 -34.125 2.297 11.277 1.00 1.45 H new ATOM 0 HB2 LEU A 42 -34.978 -0.263 11.187 1.00 35.41 H new ATOM 0 HB3 LEU A 42 -36.331 0.435 12.054 1.00 35.41 H new ATOM 0 HG LEU A 42 -36.105 2.208 9.996 1.00 32.44 H new ATOM 0 HD11 LEU A 42 -35.790 0.906 7.929 1.00 21.05 H new ATOM 0 HD12 LEU A 42 -34.312 0.938 8.920 1.00 21.05 H new ATOM 0 HD13 LEU A 42 -35.338 -0.516 8.898 1.00 21.05 H new ATOM 0 HD21 LEU A 42 -38.013 1.010 8.996 1.00 43.22 H new ATOM 0 HD22 LEU A 42 -37.647 -0.408 10.007 1.00 43.22 H new ATOM 0 HD23 LEU A 42 -38.156 1.119 10.767 1.00 43.22 H new ATOM 626 N ASP A 43 -35.654 3.763 12.576 1.00 10.14 N ATOM 627 CA ASP A 43 -36.398 4.704 13.404 1.00 31.33 C ATOM 628 C ASP A 43 -37.847 4.813 12.936 1.00 31.33 C ATOM 629 O ASP A 43 -38.300 4.030 12.102 1.00 2.34 O ATOM 630 CB ASP A 43 -35.733 6.082 13.371 1.00 44.20 C ATOM 631 CG ASP A 43 -34.260 6.022 13.724 1.00 54.04 C ATOM 632 OD1 ASP A 43 -33.943 5.915 14.926 1.00 1.31 O ATOM 633 OD2 ASP A 43 -33.426 6.084 12.797 1.00 30.34 O1- ATOM 0 H ASP A 43 -35.392 4.124 11.659 1.00 10.14 H new ATOM 0 HA ASP A 43 -36.393 4.331 14.428 1.00 31.33 H new ATOM 0 HB2 ASP A 43 -35.848 6.514 12.377 1.00 44.20 H new ATOM 0 HB3 ASP A 43 -36.244 6.746 14.068 1.00 44.20 H new ATOM 638 N ASP A 44 -38.566 5.789 13.479 1.00 73.33 N ATOM 639 CA ASP A 44 -39.963 6.001 13.118 1.00 11.43 C ATOM 640 C ASP A 44 -40.090 6.403 11.652 1.00 44.41 C ATOM 641 O ASP A 44 -41.172 6.330 11.069 1.00 0.12 O ATOM 642 CB ASP A 44 -40.587 7.075 14.010 1.00 63.23 C ATOM 643 CG ASP A 44 -41.090 6.514 15.325 1.00 31.34 C ATOM 644 OD1 ASP A 44 -40.274 6.367 16.260 1.00 40.13 O ATOM 645 OD2 ASP A 44 -42.300 6.224 15.421 1.00 13.32 O1- ATOM 0 H ASP A 44 -38.205 6.446 14.171 1.00 73.33 H new ATOM 0 HA ASP A 44 -40.497 5.062 13.267 1.00 11.43 H new ATOM 0 HB2 ASP A 44 -39.849 7.852 14.208 1.00 63.23 H new ATOM 0 HB3 ASP A 44 -41.414 7.548 13.480 1.00 63.23 H new ATOM 650 N ARG A 45 -38.977 6.829 11.062 1.00 71.11 N ATOM 651 CA ARG A 45 -38.965 7.245 9.665 1.00 52.13 C ATOM 652 C ARG A 45 -38.982 6.035 8.737 1.00 35.45 C ATOM 653 O ARG A 45 -39.373 6.136 7.574 1.00 3.22 O ATOM 654 CB ARG A 45 -37.733 8.104 9.377 1.00 65.04 C ATOM 655 CG ARG A 45 -37.678 9.385 10.195 1.00 43.34 C ATOM 656 CD ARG A 45 -38.391 10.527 9.489 1.00 43.42 C ATOM 657 NE ARG A 45 -37.608 11.056 8.376 1.00 64.23 N ATOM 658 CZ ARG A 45 -37.998 12.080 7.625 1.00 23.12 C ATOM 659 NH1 ARG A 45 -39.154 12.683 7.868 1.00 63.01 N1+ ATOM 660 NH2 ARG A 45 -37.230 12.504 6.629 1.00 3.01 N ATOM 0 H ARG A 45 -38.073 6.895 11.530 1.00 71.11 H new ATOM 0 HA ARG A 45 -39.863 7.835 9.481 1.00 52.13 H new ATOM 0 HB2 ARG A 45 -36.837 7.517 9.576 1.00 65.04 H new ATOM 0 HB3 ARG A 45 -37.718 8.359 8.317 1.00 65.04 H new ATOM 0 HG2 ARG A 45 -38.136 9.216 11.170 1.00 43.34 H new ATOM 0 HG3 ARG A 45 -36.638 9.659 10.375 1.00 43.34 H new ATOM 0 HD2 ARG A 45 -39.356 10.179 9.120 1.00 43.42 H new ATOM 0 HD3 ARG A 45 -38.592 11.326 10.203 1.00 43.42 H new ATOM 0 HE ARG A 45 -36.713 10.615 8.164 1.00 64.23 H new ATOM 0 HH11 ARG A 45 -39.746 12.361 8.633 1.00 63.01 H new ATOM 0 HH12 ARG A 45 -39.451 13.469 7.290 1.00 63.01 H new ATOM 0 HH21 ARG A 45 -36.340 12.044 6.440 1.00 3.01 H new ATOM 0 HH22 ARG A 45 -37.530 13.290 6.053 1.00 3.01 H new ATOM 674 N GLY A 46 -38.556 4.888 9.259 1.00 63.25 N ATOM 675 CA GLY A 46 -38.530 3.675 8.464 1.00 13.20 C ATOM 676 C GLY A 46 -37.181 3.436 7.816 1.00 41.41 C ATOM 677 O GLY A 46 -36.967 2.408 7.172 1.00 11.40 O ATOM 0 H GLY A 46 -38.228 4.778 10.219 1.00 63.25 H new ATOM 0 HA2 GLY A 46 -38.782 2.824 9.097 1.00 13.20 H new ATOM 0 HA3 GLY A 46 -39.296 3.735 7.691 1.00 13.20 H new ATOM 681 N VAL A 47 -36.268 4.387 7.985 1.00 30.53 N ATOM 682 CA VAL A 47 -34.932 4.275 7.411 1.00 42.32 C ATOM 683 C VAL A 47 -33.886 4.044 8.496 1.00 35.22 C ATOM 684 O VAL A 47 -33.964 4.620 9.581 1.00 74.45 O ATOM 685 CB VAL A 47 -34.557 5.536 6.612 1.00 33.24 C ATOM 686 CG1 VAL A 47 -33.160 5.401 6.025 1.00 62.32 C ATOM 687 CG2 VAL A 47 -35.581 5.798 5.518 1.00 11.24 C ATOM 0 H VAL A 47 -36.429 5.244 8.515 1.00 30.53 H new ATOM 0 HA VAL A 47 -34.948 3.419 6.737 1.00 42.32 H new ATOM 0 HB VAL A 47 -34.559 6.389 7.291 1.00 33.24 H new ATOM 0 HG11 VAL A 47 -32.913 6.302 5.464 1.00 62.32 H new ATOM 0 HG12 VAL A 47 -32.438 5.266 6.831 1.00 62.32 H new ATOM 0 HG13 VAL A 47 -33.127 4.538 5.360 1.00 62.32 H new ATOM 0 HG21 VAL A 47 -35.300 6.693 4.963 1.00 11.24 H new ATOM 0 HG22 VAL A 47 -35.614 4.946 4.839 1.00 11.24 H new ATOM 0 HG23 VAL A 47 -36.564 5.943 5.967 1.00 11.24 H new ATOM 697 N ILE A 48 -32.907 3.196 8.195 1.00 4.11 N ATOM 698 CA ILE A 48 -31.845 2.889 9.144 1.00 23.31 C ATOM 699 C ILE A 48 -30.948 4.101 9.376 1.00 42.35 C ATOM 700 O ILE A 48 -30.588 4.808 8.434 1.00 21.41 O ATOM 701 CB ILE A 48 -30.980 1.710 8.660 1.00 74.51 C ATOM 702 CG1 ILE A 48 -31.836 0.452 8.507 1.00 2.21 C ATOM 703 CG2 ILE A 48 -29.832 1.463 9.628 1.00 61.43 C ATOM 704 CD1 ILE A 48 -32.357 -0.088 9.820 1.00 11.41 C ATOM 0 H ILE A 48 -32.828 2.710 7.302 1.00 4.11 H new ATOM 0 HA ILE A 48 -32.329 2.613 10.081 1.00 23.31 H new ATOM 0 HB ILE A 48 -30.560 1.961 7.686 1.00 74.51 H new ATOM 0 HG12 ILE A 48 -32.680 0.674 7.854 1.00 2.21 H new ATOM 0 HG13 ILE A 48 -31.247 -0.321 8.014 1.00 2.21 H new ATOM 0 HG21 ILE A 48 -29.230 0.627 9.272 1.00 61.43 H new ATOM 0 HG22 ILE A 48 -29.211 2.356 9.691 1.00 61.43 H new ATOM 0 HG23 ILE A 48 -30.232 1.228 10.614 1.00 61.43 H new ATOM 0 HD11 ILE A 48 -32.955 -0.980 9.635 1.00 11.41 H new ATOM 0 HD12 ILE A 48 -31.518 -0.342 10.468 1.00 11.41 H new ATOM 0 HD13 ILE A 48 -32.974 0.668 10.305 1.00 11.41 H new ATOM 716 N ARG A 49 -30.590 4.334 10.634 1.00 61.21 N ATOM 717 CA ARG A 49 -29.735 5.460 10.990 1.00 55.21 C ATOM 718 C ARG A 49 -28.319 5.255 10.460 1.00 4.43 C ATOM 719 O ARG A 49 -27.920 4.133 10.144 1.00 74.42 O ATOM 720 CB ARG A 49 -29.702 5.643 12.508 1.00 75.12 C ATOM 721 CG ARG A 49 -29.069 6.952 12.950 1.00 63.14 C ATOM 722 CD ARG A 49 -29.432 7.289 14.388 1.00 21.00 C ATOM 723 NE ARG A 49 -30.621 8.132 14.469 1.00 40.53 N ATOM 724 CZ ARG A 49 -31.075 8.655 15.604 1.00 35.01 C ATOM 725 NH1 ARG A 49 -30.442 8.422 16.745 1.00 2.42 N1+ ATOM 726 NH2 ARG A 49 -32.164 9.413 15.597 1.00 44.41 N ATOM 0 H ARG A 49 -30.879 3.758 11.424 1.00 61.21 H new ATOM 0 HA ARG A 49 -30.150 6.358 10.532 1.00 55.21 H new ATOM 0 HB2 ARG A 49 -30.720 5.593 12.894 1.00 75.12 H new ATOM 0 HB3 ARG A 49 -29.152 4.814 12.953 1.00 75.12 H new ATOM 0 HG2 ARG A 49 -27.985 6.884 12.853 1.00 63.14 H new ATOM 0 HG3 ARG A 49 -29.398 7.757 12.292 1.00 63.14 H new ATOM 0 HD2 ARG A 49 -29.603 6.367 14.944 1.00 21.00 H new ATOM 0 HD3 ARG A 49 -28.594 7.798 14.864 1.00 21.00 H new ATOM 0 HE ARG A 49 -31.131 8.331 13.608 1.00 40.53 H new ATOM 0 HH11 ARG A 49 -29.604 7.840 16.754 1.00 2.42 H new ATOM 0 HH12 ARG A 49 -30.793 8.825 17.614 1.00 2.42 H new ATOM 0 HH21 ARG A 49 -32.653 9.595 14.721 1.00 44.41 H new ATOM 0 HH22 ARG A 49 -32.512 9.814 16.468 1.00 44.41 H new ATOM 740 N ILE A 50 -27.564 6.345 10.365 1.00 42.34 N ATOM 741 CA ILE A 50 -26.193 6.284 9.875 1.00 64.41 C ATOM 742 C ILE A 50 -25.280 5.593 10.881 1.00 25.51 C ATOM 743 O ILE A 50 -25.503 5.663 12.089 1.00 50.31 O ATOM 744 CB ILE A 50 -25.640 7.690 9.577 1.00 4.21 C ATOM 745 CG1 ILE A 50 -26.612 8.467 8.686 1.00 31.11 C ATOM 746 CG2 ILE A 50 -24.273 7.591 8.917 1.00 54.25 C ATOM 747 CD1 ILE A 50 -26.229 9.918 8.497 1.00 54.33 C ATOM 0 H ILE A 50 -27.879 7.281 10.621 1.00 42.34 H new ATOM 0 HA ILE A 50 -26.213 5.707 8.951 1.00 64.41 H new ATOM 0 HB ILE A 50 -25.531 8.228 10.518 1.00 4.21 H new ATOM 0 HG12 ILE A 50 -26.664 7.983 7.711 1.00 31.11 H new ATOM 0 HG13 ILE A 50 -27.610 8.417 9.121 1.00 31.11 H new ATOM 0 HG21 ILE A 50 -23.894 8.592 8.712 1.00 54.25 H new ATOM 0 HG22 ILE A 50 -23.584 7.072 9.583 1.00 54.25 H new ATOM 0 HG23 ILE A 50 -24.360 7.038 7.982 1.00 54.25 H new ATOM 0 HD11 ILE A 50 -26.962 10.407 7.855 1.00 54.33 H new ATOM 0 HD12 ILE A 50 -26.205 10.417 9.466 1.00 54.33 H new ATOM 0 HD13 ILE A 50 -25.244 9.977 8.034 1.00 54.33 H new ATOM 759 N GLY A 51 -24.247 4.926 10.374 1.00 2.14 N ATOM 760 CA GLY A 51 -23.314 4.233 11.242 1.00 43.44 C ATOM 761 C GLY A 51 -23.735 2.805 11.525 1.00 53.24 C ATOM 762 O GLY A 51 -23.154 2.137 12.380 1.00 63.33 O ATOM 0 H GLY A 51 -24.040 4.854 9.378 1.00 2.14 H new ATOM 0 HA2 GLY A 51 -22.326 4.233 10.781 1.00 43.44 H new ATOM 0 HA3 GLY A 51 -23.227 4.776 12.183 1.00 43.44 H new ATOM 766 N ALA A 52 -24.750 2.336 10.807 1.00 53.13 N ATOM 767 CA ALA A 52 -25.250 0.978 10.985 1.00 25.41 C ATOM 768 C ALA A 52 -24.790 0.072 9.849 1.00 3.24 C ATOM 769 O ALA A 52 -24.881 0.436 8.676 1.00 33.21 O ATOM 770 CB ALA A 52 -26.768 0.982 11.078 1.00 4.44 C ATOM 0 H ALA A 52 -25.243 2.877 10.096 1.00 53.13 H new ATOM 0 HA ALA A 52 -24.842 0.586 11.916 1.00 25.41 H new ATOM 0 HB1 ALA A 52 -27.127 -0.039 11.211 1.00 4.44 H new ATOM 0 HB2 ALA A 52 -27.079 1.589 11.928 1.00 4.44 H new ATOM 0 HB3 ALA A 52 -27.188 1.398 10.162 1.00 4.44 H new ATOM 776 N GLU A 53 -24.296 -1.110 10.203 1.00 24.44 N ATOM 777 CA GLU A 53 -23.821 -2.068 9.211 1.00 12.23 C ATOM 778 C GLU A 53 -24.982 -2.624 8.392 1.00 61.23 C ATOM 779 O GLU A 53 -26.040 -2.946 8.933 1.00 62.55 O ATOM 780 CB GLU A 53 -23.069 -3.213 9.894 1.00 5.05 C ATOM 781 CG GLU A 53 -21.978 -2.744 10.841 1.00 63.31 C ATOM 782 CD GLU A 53 -20.978 -3.838 11.166 1.00 65.35 C ATOM 783 OE1 GLU A 53 -21.355 -5.026 11.097 1.00 22.21 O ATOM 784 OE2 GLU A 53 -19.819 -3.504 11.488 1.00 42.20 O1- ATOM 0 H GLU A 53 -24.214 -1.427 11.169 1.00 24.44 H new ATOM 0 HA GLU A 53 -23.141 -1.547 8.537 1.00 12.23 H new ATOM 0 HB2 GLU A 53 -23.781 -3.825 10.448 1.00 5.05 H new ATOM 0 HB3 GLU A 53 -22.626 -3.852 9.130 1.00 5.05 H new ATOM 0 HG2 GLU A 53 -21.454 -1.898 10.395 1.00 63.31 H new ATOM 0 HG3 GLU A 53 -22.433 -2.386 11.765 1.00 63.31 H new ATOM 791 N VAL A 54 -24.776 -2.735 7.084 1.00 22.21 N ATOM 792 CA VAL A 54 -25.804 -3.253 6.190 1.00 62.55 C ATOM 793 C VAL A 54 -25.668 -4.760 6.009 1.00 25.30 C ATOM 794 O VAL A 54 -24.563 -5.302 6.031 1.00 72.42 O ATOM 795 CB VAL A 54 -25.741 -2.573 4.808 1.00 34.21 C ATOM 796 CG1 VAL A 54 -24.372 -2.774 4.178 1.00 11.11 C ATOM 797 CG2 VAL A 54 -26.838 -3.109 3.901 1.00 22.21 C ATOM 0 H VAL A 54 -23.906 -2.473 6.620 1.00 22.21 H new ATOM 0 HA VAL A 54 -26.766 -3.032 6.653 1.00 62.55 H new ATOM 0 HB VAL A 54 -25.901 -1.503 4.940 1.00 34.21 H new ATOM 0 HG11 VAL A 54 -24.345 -2.288 3.203 1.00 11.11 H new ATOM 0 HG12 VAL A 54 -23.608 -2.339 4.822 1.00 11.11 H new ATOM 0 HG13 VAL A 54 -24.180 -3.840 4.057 1.00 11.11 H new ATOM 0 HG21 VAL A 54 -26.779 -2.618 2.930 1.00 22.21 H new ATOM 0 HG22 VAL A 54 -26.711 -4.184 3.773 1.00 22.21 H new ATOM 0 HG23 VAL A 54 -27.811 -2.909 4.350 1.00 22.21 H new ATOM 807 N LYS A 55 -26.800 -5.434 5.829 1.00 32.13 N ATOM 808 CA LYS A 55 -26.808 -6.880 5.644 1.00 11.44 C ATOM 809 C LYS A 55 -28.118 -7.340 5.012 1.00 24.20 C ATOM 810 O LYS A 55 -29.031 -6.540 4.802 1.00 53.12 O ATOM 811 CB LYS A 55 -26.599 -7.588 6.984 1.00 13.34 C ATOM 812 CG LYS A 55 -27.723 -7.352 7.977 1.00 34.42 C ATOM 813 CD LYS A 55 -27.663 -8.339 9.132 1.00 72.33 C ATOM 814 CE LYS A 55 -26.523 -8.013 10.085 1.00 54.12 C ATOM 815 NZ LYS A 55 -26.114 -9.201 10.884 1.00 75.44 N1+ ATOM 0 H LYS A 55 -27.723 -5.001 5.807 1.00 32.13 H new ATOM 0 HA LYS A 55 -25.990 -7.140 4.972 1.00 11.44 H new ATOM 0 HB2 LYS A 55 -26.500 -8.659 6.808 1.00 13.34 H new ATOM 0 HB3 LYS A 55 -25.661 -7.249 7.422 1.00 13.34 H new ATOM 0 HG2 LYS A 55 -27.661 -6.335 8.363 1.00 34.42 H new ATOM 0 HG3 LYS A 55 -28.683 -7.442 7.469 1.00 34.42 H new ATOM 0 HD2 LYS A 55 -28.608 -8.323 9.675 1.00 72.33 H new ATOM 0 HD3 LYS A 55 -27.536 -9.349 8.743 1.00 72.33 H new ATOM 0 HE2 LYS A 55 -25.668 -7.645 9.517 1.00 54.12 H new ATOM 0 HE3 LYS A 55 -26.829 -7.211 10.757 1.00 54.12 H new ATOM 0 HZ1 LYS A 55 -25.335 -8.939 11.521 1.00 75.44 H new ATOM 0 HZ2 LYS A 55 -26.923 -9.537 11.445 1.00 75.44 H new ATOM 0 HZ3 LYS A 55 -25.798 -9.958 10.244 1.00 75.44 H new ATOM 829 N ASP A 56 -28.204 -8.630 4.712 1.00 1.11 N ATOM 830 CA ASP A 56 -29.404 -9.197 4.107 1.00 50.12 C ATOM 831 C ASP A 56 -30.628 -8.936 4.979 1.00 51.21 C ATOM 832 O ASP A 56 -30.542 -8.948 6.206 1.00 22.43 O ATOM 833 CB ASP A 56 -29.230 -10.701 3.888 1.00 24.03 C ATOM 834 CG ASP A 56 -29.846 -11.172 2.586 1.00 74.11 C ATOM 835 OD1 ASP A 56 -29.539 -10.573 1.533 1.00 70.55 O ATOM 836 OD2 ASP A 56 -30.634 -12.139 2.618 1.00 42.54 O1- ATOM 0 H ASP A 56 -27.457 -9.304 4.878 1.00 1.11 H new ATOM 0 HA ASP A 56 -29.557 -8.713 3.143 1.00 50.12 H new ATOM 0 HB2 ASP A 56 -28.168 -10.945 3.893 1.00 24.03 H new ATOM 0 HB3 ASP A 56 -29.685 -11.241 4.718 1.00 24.03 H new ATOM 841 N GLY A 57 -31.767 -8.697 4.336 1.00 23.23 N ATOM 842 CA GLY A 57 -32.992 -8.435 5.069 1.00 2.42 C ATOM 843 C GLY A 57 -33.097 -6.993 5.525 1.00 30.44 C ATOM 844 O GLY A 57 -34.079 -6.606 6.159 1.00 50.43 O ATOM 0 H GLY A 57 -31.863 -8.680 3.321 1.00 23.23 H new ATOM 0 HA2 GLY A 57 -33.848 -8.677 4.439 1.00 2.42 H new ATOM 0 HA3 GLY A 57 -33.040 -9.092 5.937 1.00 2.42 H new ATOM 848 N ASP A 58 -32.082 -6.198 5.205 1.00 1.23 N ATOM 849 CA ASP A 58 -32.064 -4.790 5.587 1.00 24.33 C ATOM 850 C ASP A 58 -32.135 -3.893 4.356 1.00 44.22 C ATOM 851 O ASP A 58 -31.127 -3.653 3.689 1.00 4.32 O ATOM 852 CB ASP A 58 -30.802 -4.475 6.392 1.00 74.23 C ATOM 853 CG ASP A 58 -31.086 -3.589 7.589 1.00 42.34 C ATOM 854 OD1 ASP A 58 -32.144 -2.928 7.601 1.00 52.45 O ATOM 855 OD2 ASP A 58 -30.248 -3.560 8.516 1.00 60.24 O1- ATOM 0 H ASP A 58 -31.261 -6.504 4.682 1.00 1.23 H new ATOM 0 HA ASP A 58 -32.939 -4.595 6.207 1.00 24.33 H new ATOM 0 HB2 ASP A 58 -30.349 -5.406 6.732 1.00 74.23 H new ATOM 0 HB3 ASP A 58 -30.075 -3.985 5.745 1.00 74.23 H new ATOM 860 N LEU A 59 -33.332 -3.398 4.060 1.00 1.10 N ATOM 861 CA LEU A 59 -33.535 -2.526 2.907 1.00 32.31 C ATOM 862 C LEU A 59 -32.994 -1.127 3.182 1.00 22.24 C ATOM 863 O LEU A 59 -32.708 -0.369 2.254 1.00 63.34 O ATOM 864 CB LEU A 59 -35.022 -2.451 2.557 1.00 63.13 C ATOM 865 CG LEU A 59 -35.737 -3.789 2.368 1.00 21.11 C ATOM 866 CD1 LEU A 59 -34.782 -4.828 1.801 1.00 3.32 C ATOM 867 CD2 LEU A 59 -36.329 -4.269 3.686 1.00 13.30 C ATOM 0 H LEU A 59 -34.176 -3.585 4.601 1.00 1.10 H new ATOM 0 HA LEU A 59 -32.990 -2.947 2.062 1.00 32.31 H new ATOM 0 HB2 LEU A 59 -35.532 -1.898 3.345 1.00 63.13 H new ATOM 0 HB3 LEU A 59 -35.130 -1.872 1.640 1.00 63.13 H new ATOM 0 HG LEU A 59 -36.551 -3.647 1.658 1.00 21.11 H new ATOM 0 HD11 LEU A 59 -35.308 -5.774 1.673 1.00 3.32 H new ATOM 0 HD12 LEU A 59 -34.406 -4.488 0.836 1.00 3.32 H new ATOM 0 HD13 LEU A 59 -33.947 -4.967 2.487 1.00 3.32 H new ATOM 0 HD21 LEU A 59 -36.834 -5.223 3.532 1.00 13.30 H new ATOM 0 HD22 LEU A 59 -35.532 -4.395 4.419 1.00 13.30 H new ATOM 0 HD23 LEU A 59 -37.046 -3.534 4.052 1.00 13.30 H new ATOM 879 N LEU A 60 -32.854 -0.792 4.459 1.00 4.23 N ATOM 880 CA LEU A 60 -32.344 0.516 4.856 1.00 33.23 C ATOM 881 C LEU A 60 -33.279 1.629 4.393 1.00 4.21 C ATOM 882 O LEU A 60 -32.899 2.799 4.355 1.00 64.02 O ATOM 883 CB LEU A 60 -30.946 0.737 4.277 1.00 0.12 C ATOM 884 CG LEU A 60 -29.941 -0.395 4.498 1.00 74.51 C ATOM 885 CD1 LEU A 60 -28.974 -0.487 3.327 1.00 63.21 C ATOM 886 CD2 LEU A 60 -29.185 -0.190 5.801 1.00 1.41 C ATOM 0 H LEU A 60 -33.086 -1.408 5.238 1.00 4.23 H new ATOM 0 HA LEU A 60 -32.289 0.542 5.944 1.00 33.23 H new ATOM 0 HB2 LEU A 60 -31.041 0.907 3.205 1.00 0.12 H new ATOM 0 HB3 LEU A 60 -30.536 1.650 4.709 1.00 0.12 H new ATOM 0 HG LEU A 60 -30.490 -1.334 4.564 1.00 74.51 H new ATOM 0 HD11 LEU A 60 -28.267 -1.298 3.502 1.00 63.21 H new ATOM 0 HD12 LEU A 60 -29.530 -0.682 2.410 1.00 63.21 H new ATOM 0 HD13 LEU A 60 -28.431 0.453 3.229 1.00 63.21 H new ATOM 0 HD21 LEU A 60 -28.475 -1.005 5.942 1.00 1.41 H new ATOM 0 HD22 LEU A 60 -28.648 0.758 5.765 1.00 1.41 H new ATOM 0 HD23 LEU A 60 -29.890 -0.176 6.632 1.00 1.41 H new ATOM 898 N VAL A 61 -34.506 1.256 4.044 1.00 0.20 N ATOM 899 CA VAL A 61 -35.499 2.222 3.587 1.00 71.21 C ATOM 900 C VAL A 61 -36.914 1.690 3.780 1.00 70.32 C ATOM 901 O VAL A 61 -37.194 0.524 3.503 1.00 31.11 O ATOM 902 CB VAL A 61 -35.294 2.577 2.102 1.00 31.34 C ATOM 903 CG1 VAL A 61 -35.654 1.395 1.215 1.00 4.22 C ATOM 904 CG2 VAL A 61 -36.113 3.803 1.730 1.00 2.31 C ATOM 0 H VAL A 61 -34.837 0.291 4.069 1.00 0.20 H new ATOM 0 HA VAL A 61 -35.367 3.120 4.190 1.00 71.21 H new ATOM 0 HB VAL A 61 -34.241 2.810 1.944 1.00 31.34 H new ATOM 0 HG11 VAL A 61 -35.503 1.665 0.170 1.00 4.22 H new ATOM 0 HG12 VAL A 61 -35.019 0.545 1.466 1.00 4.22 H new ATOM 0 HG13 VAL A 61 -36.699 1.126 1.373 1.00 4.22 H new ATOM 0 HG21 VAL A 61 -35.956 4.040 0.678 1.00 2.31 H new ATOM 0 HG22 VAL A 61 -37.170 3.601 1.903 1.00 2.31 H new ATOM 0 HG23 VAL A 61 -35.801 4.649 2.342 1.00 2.31 H new ATOM 914 N GLY A 62 -37.806 2.554 4.257 1.00 71.04 N ATOM 915 CA GLY A 62 -39.182 2.153 4.479 1.00 31.12 C ATOM 916 C GLY A 62 -40.125 2.714 3.434 1.00 34.53 C ATOM 917 O GLY A 62 -40.515 3.879 3.500 1.00 41.31 O ATOM 0 H GLY A 62 -37.599 3.524 4.493 1.00 71.04 H new ATOM 0 HA2 GLY A 62 -39.245 1.065 4.474 1.00 31.12 H new ATOM 0 HA3 GLY A 62 -39.500 2.487 5.467 1.00 31.12 H new ATOM 921 N LYS A 63 -40.493 1.883 2.464 1.00 64.14 N ATOM 922 CA LYS A 63 -41.396 2.303 1.399 1.00 33.22 C ATOM 923 C LYS A 63 -42.493 1.264 1.175 1.00 20.52 C ATOM 924 O LYS A 63 -42.240 0.186 0.638 1.00 13.53 O ATOM 925 CB LYS A 63 -40.618 2.525 0.100 1.00 74.02 C ATOM 926 CG LYS A 63 -40.221 3.973 -0.130 1.00 20.40 C ATOM 927 CD LYS A 63 -38.815 4.082 -0.698 1.00 71.32 C ATOM 928 CE LYS A 63 -38.359 5.530 -0.785 1.00 42.40 C ATOM 929 NZ LYS A 63 -38.357 6.192 0.550 1.00 61.51 N1+ ATOM 0 H LYS A 63 -40.180 0.915 2.394 1.00 64.14 H new ATOM 0 HA LYS A 63 -41.862 3.241 1.701 1.00 33.22 H new ATOM 0 HB2 LYS A 63 -39.719 1.908 0.114 1.00 74.02 H new ATOM 0 HB3 LYS A 63 -41.224 2.185 -0.740 1.00 74.02 H new ATOM 0 HG2 LYS A 63 -40.928 4.441 -0.815 1.00 20.40 H new ATOM 0 HG3 LYS A 63 -40.278 4.521 0.811 1.00 20.40 H new ATOM 0 HD2 LYS A 63 -38.124 3.519 -0.071 1.00 71.32 H new ATOM 0 HD3 LYS A 63 -38.786 3.630 -1.690 1.00 71.32 H new ATOM 0 HE2 LYS A 63 -37.357 5.570 -1.212 1.00 42.40 H new ATOM 0 HE3 LYS A 63 -39.016 6.078 -1.461 1.00 42.40 H new ATOM 0 HZ1 LYS A 63 -37.797 7.067 0.503 1.00 61.51 H new ATOM 0 HZ2 LYS A 63 -39.333 6.421 0.826 1.00 61.51 H new ATOM 0 HZ3 LYS A 63 -37.939 5.551 1.255 1.00 61.51 H new ATOM 943 N VAL A 64 -43.710 1.599 1.589 1.00 71.05 N ATOM 944 CA VAL A 64 -44.845 0.697 1.432 1.00 72.21 C ATOM 945 C VAL A 64 -46.138 1.475 1.214 1.00 72.14 C ATOM 946 O VAL A 64 -46.225 2.661 1.534 1.00 61.31 O ATOM 947 CB VAL A 64 -45.010 -0.217 2.660 1.00 41.14 C ATOM 948 CG1 VAL A 64 -44.034 -1.381 2.595 1.00 41.34 C ATOM 949 CG2 VAL A 64 -44.821 0.577 3.944 1.00 71.41 C ATOM 0 H VAL A 64 -43.936 2.488 2.036 1.00 71.05 H new ATOM 0 HA VAL A 64 -44.642 0.082 0.556 1.00 72.21 H new ATOM 0 HB VAL A 64 -46.022 -0.622 2.656 1.00 41.14 H new ATOM 0 HG11 VAL A 64 -44.166 -2.016 3.471 1.00 41.34 H new ATOM 0 HG12 VAL A 64 -44.222 -1.964 1.693 1.00 41.34 H new ATOM 0 HG13 VAL A 64 -43.013 -0.999 2.574 1.00 41.34 H new ATOM 0 HG21 VAL A 64 -44.941 -0.085 4.802 1.00 71.41 H new ATOM 0 HG22 VAL A 64 -43.822 1.013 3.959 1.00 71.41 H new ATOM 0 HG23 VAL A 64 -45.564 1.373 3.993 1.00 71.41 H new ATOM 959 N THR A 65 -47.144 0.799 0.666 1.00 75.31 N ATOM 960 CA THR A 65 -48.433 1.426 0.403 1.00 21.11 C ATOM 961 C THR A 65 -49.582 0.495 0.772 1.00 50.33 C ATOM 962 O THR A 65 -49.430 -0.726 0.829 1.00 22.30 O ATOM 963 CB THR A 65 -48.570 1.830 -1.077 1.00 51.22 C ATOM 964 OG1 THR A 65 -47.656 1.072 -1.879 1.00 52.43 O ATOM 965 CG2 THR A 65 -48.299 3.316 -1.258 1.00 65.41 C ATOM 0 H THR A 65 -47.090 -0.183 0.396 1.00 75.31 H new ATOM 0 HA THR A 65 -48.481 2.322 1.022 1.00 21.11 H new ATOM 0 HB THR A 65 -49.591 1.621 -1.395 1.00 51.22 H new ATOM 0 HG1 THR A 65 -47.634 1.440 -2.787 1.00 52.43 H new ATOM 0 HG21 THR A 65 -48.401 3.579 -2.311 1.00 65.41 H new ATOM 0 HG22 THR A 65 -49.014 3.891 -0.669 1.00 65.41 H new ATOM 0 HG23 THR A 65 -47.287 3.545 -0.924 1.00 65.41 H new ATOM 973 N PRO A 66 -50.761 1.081 1.028 1.00 71.34 N ATOM 974 CA PRO A 66 -51.960 0.321 1.395 1.00 72.00 C ATOM 975 C PRO A 66 -52.508 -0.496 0.229 1.00 31.14 C ATOM 976 O PRO A 66 -52.491 -0.048 -0.918 1.00 4.01 O ATOM 977 CB PRO A 66 -52.958 1.408 1.803 1.00 54.11 C ATOM 978 CG PRO A 66 -52.512 2.626 1.068 1.00 72.32 C ATOM 979 CD PRO A 66 -51.014 2.531 0.979 1.00 51.54 C ATOM 0 HA PRO A 66 -51.757 -0.407 2.181 1.00 72.00 H new ATOM 0 HB2 PRO A 66 -53.977 1.132 1.531 1.00 54.11 H new ATOM 0 HB3 PRO A 66 -52.948 1.570 2.881 1.00 54.11 H new ATOM 0 HG2 PRO A 66 -52.960 2.668 0.075 1.00 72.32 H new ATOM 0 HG3 PRO A 66 -52.815 3.532 1.593 1.00 72.32 H new ATOM 0 HD2 PRO A 66 -50.637 2.974 0.057 1.00 51.54 H new ATOM 0 HD3 PRO A 66 -50.528 3.052 1.804 1.00 51.54 H new ATOM 987 N LYS A 67 -52.995 -1.695 0.530 1.00 13.34 N ATOM 988 CA LYS A 67 -53.549 -2.574 -0.492 1.00 22.03 C ATOM 989 C LYS A 67 -55.046 -2.781 -0.277 1.00 61.40 C ATOM 990 O LYS A 67 -55.587 -2.429 0.770 1.00 45.12 O ATOM 991 CB LYS A 67 -52.830 -3.924 -0.479 1.00 13.12 C ATOM 992 CG LYS A 67 -51.649 -3.993 -1.433 1.00 24.12 C ATOM 993 CD LYS A 67 -51.122 -5.412 -1.566 1.00 43.33 C ATOM 994 CE LYS A 67 -51.923 -6.212 -2.582 1.00 51.24 C ATOM 995 NZ LYS A 67 -51.473 -5.944 -3.976 1.00 22.33 N1+ ATOM 0 H LYS A 67 -53.017 -2.080 1.474 1.00 13.34 H new ATOM 0 HA LYS A 67 -53.400 -2.100 -1.462 1.00 22.03 H new ATOM 0 HB2 LYS A 67 -52.482 -4.131 0.533 1.00 13.12 H new ATOM 0 HB3 LYS A 67 -53.542 -4.708 -0.738 1.00 13.12 H new ATOM 0 HG2 LYS A 67 -51.950 -3.622 -2.413 1.00 24.12 H new ATOM 0 HG3 LYS A 67 -50.853 -3.340 -1.076 1.00 24.12 H new ATOM 0 HD2 LYS A 67 -50.075 -5.385 -1.867 1.00 43.33 H new ATOM 0 HD3 LYS A 67 -51.163 -5.909 -0.597 1.00 43.33 H new ATOM 0 HE2 LYS A 67 -51.824 -7.276 -2.366 1.00 51.24 H new ATOM 0 HE3 LYS A 67 -52.980 -5.965 -2.487 1.00 51.24 H new ATOM 0 HZ1 LYS A 67 -52.043 -6.507 -4.639 1.00 22.33 H new ATOM 0 HZ2 LYS A 67 -51.591 -4.933 -4.191 1.00 22.33 H new ATOM 0 HZ3 LYS A 67 -50.471 -6.204 -4.073 1.00 22.33 H new ATOM 1009 N GLY A 68 -55.709 -3.358 -1.275 1.00 41.33 N ATOM 1010 CA GLY A 68 -57.135 -3.604 -1.173 1.00 62.55 C ATOM 1011 C GLY A 68 -57.507 -5.024 -1.551 1.00 22.32 C ATOM 1012 O GLY A 68 -56.655 -5.913 -1.570 1.00 24.52 O ATOM 0 H GLY A 68 -55.284 -3.659 -2.152 1.00 41.33 H new ATOM 0 HA2 GLY A 68 -57.463 -3.405 -0.153 1.00 62.55 H new ATOM 0 HA3 GLY A 68 -57.668 -2.908 -1.820 1.00 62.55 H new ATOM 1016 N VAL A 69 -58.783 -5.239 -1.853 1.00 13.52 N ATOM 1017 CA VAL A 69 -59.266 -6.562 -2.233 1.00 23.11 C ATOM 1018 C VAL A 69 -59.204 -6.758 -3.743 1.00 22.23 C ATOM 1019 O VAL A 69 -59.768 -7.711 -4.281 1.00 32.21 O ATOM 1020 CB VAL A 69 -60.713 -6.789 -1.756 1.00 70.31 C ATOM 1021 CG1 VAL A 69 -60.773 -6.848 -0.238 1.00 51.03 C ATOM 1022 CG2 VAL A 69 -61.627 -5.696 -2.291 1.00 34.25 C ATOM 0 H VAL A 69 -59.501 -4.515 -1.842 1.00 13.52 H new ATOM 0 HA VAL A 69 -58.613 -7.288 -1.749 1.00 23.11 H new ATOM 0 HB VAL A 69 -61.059 -7.746 -2.146 1.00 70.31 H new ATOM 0 HG11 VAL A 69 -61.803 -7.009 0.079 1.00 51.03 H new ATOM 0 HG12 VAL A 69 -60.151 -7.669 0.119 1.00 51.03 H new ATOM 0 HG13 VAL A 69 -60.408 -5.909 0.177 1.00 51.03 H new ATOM 0 HG21 VAL A 69 -62.645 -5.872 -1.945 1.00 34.25 H new ATOM 0 HG22 VAL A 69 -61.283 -4.726 -1.931 1.00 34.25 H new ATOM 0 HG23 VAL A 69 -61.608 -5.707 -3.381 1.00 34.25 H new ATOM 1032 N THR A 70 -58.513 -5.849 -4.424 1.00 55.35 N ATOM 1033 CA THR A 70 -58.376 -5.921 -5.873 1.00 0.23 C ATOM 1034 C THR A 70 -57.514 -7.108 -6.286 1.00 24.22 C ATOM 1035 O THR A 70 -57.886 -7.878 -7.172 1.00 33.12 O ATOM 1036 CB THR A 70 -57.759 -4.629 -6.445 1.00 23.51 C ATOM 1037 OG1 THR A 70 -58.557 -3.500 -6.074 1.00 74.35 O ATOM 1038 CG2 THR A 70 -57.652 -4.706 -7.959 1.00 3.05 C ATOM 0 H THR A 70 -58.039 -5.054 -3.995 1.00 55.35 H new ATOM 0 HA THR A 70 -59.380 -6.046 -6.279 1.00 0.23 H new ATOM 0 HB THR A 70 -56.757 -4.516 -6.032 1.00 23.51 H new ATOM 0 HG1 THR A 70 -58.158 -2.683 -6.439 1.00 74.35 H new ATOM 0 HG21 THR A 70 -57.214 -3.784 -8.340 1.00 3.05 H new ATOM 0 HG22 THR A 70 -57.020 -5.550 -8.237 1.00 3.05 H new ATOM 0 HG23 THR A 70 -58.645 -4.840 -8.388 1.00 3.05 H new ATOM 1046 N GLU A 71 -56.362 -7.251 -5.638 1.00 11.11 N ATOM 1047 CA GLU A 71 -55.448 -8.346 -5.940 1.00 34.23 C ATOM 1048 C GLU A 71 -55.018 -9.063 -4.663 1.00 23.33 C ATOM 1049 O GLU A 71 -53.826 -9.212 -4.391 1.00 53.31 O ATOM 1050 CB GLU A 71 -54.216 -7.821 -6.682 1.00 54.35 C ATOM 1051 CG GLU A 71 -53.493 -8.887 -7.489 1.00 72.01 C ATOM 1052 CD GLU A 71 -52.263 -8.350 -8.194 1.00 25.40 C ATOM 1053 OE1 GLU A 71 -51.229 -8.158 -7.520 1.00 5.12 O ATOM 1054 OE2 GLU A 71 -52.333 -8.120 -9.420 1.00 23.50 O1- ATOM 0 H GLU A 71 -56.040 -6.623 -4.902 1.00 11.11 H new ATOM 0 HA GLU A 71 -55.972 -9.058 -6.578 1.00 34.23 H new ATOM 0 HB2 GLU A 71 -54.520 -7.015 -7.350 1.00 54.35 H new ATOM 0 HB3 GLU A 71 -53.522 -7.391 -5.959 1.00 54.35 H new ATOM 0 HG2 GLU A 71 -53.201 -9.703 -6.827 1.00 72.01 H new ATOM 0 HG3 GLU A 71 -54.177 -9.305 -8.227 1.00 72.01 H new ATOM 1061 N LEU A 72 -55.998 -9.505 -3.882 1.00 12.50 N ATOM 1062 CA LEU A 72 -55.723 -10.207 -2.633 1.00 60.42 C ATOM 1063 C LEU A 72 -55.209 -11.618 -2.903 1.00 51.14 C ATOM 1064 O LEU A 72 -55.259 -12.104 -4.033 1.00 34.14 O ATOM 1065 CB LEU A 72 -56.986 -10.268 -1.771 1.00 44.10 C ATOM 1066 CG LEU A 72 -56.771 -10.184 -0.260 1.00 41.21 C ATOM 1067 CD1 LEU A 72 -56.086 -8.879 0.110 1.00 14.22 C ATOM 1068 CD2 LEU A 72 -58.096 -10.320 0.475 1.00 4.04 C ATOM 0 H LEU A 72 -56.990 -9.390 -4.092 1.00 12.50 H new ATOM 0 HA LEU A 72 -54.951 -9.655 -2.097 1.00 60.42 H new ATOM 0 HB2 LEU A 72 -57.646 -9.453 -2.070 1.00 44.10 H new ATOM 0 HB3 LEU A 72 -57.508 -11.199 -1.992 1.00 44.10 H new ATOM 0 HG LEU A 72 -56.124 -11.008 0.042 1.00 41.21 H new ATOM 0 HD11 LEU A 72 -55.941 -8.837 1.190 1.00 14.22 H new ATOM 0 HD12 LEU A 72 -55.118 -8.822 -0.388 1.00 14.22 H new ATOM 0 HD13 LEU A 72 -56.706 -8.040 -0.206 1.00 14.22 H new ATOM 0 HD21 LEU A 72 -57.924 -10.258 1.550 1.00 4.04 H new ATOM 0 HD22 LEU A 72 -58.767 -9.517 0.168 1.00 4.04 H new ATOM 0 HD23 LEU A 72 -58.548 -11.282 0.235 1.00 4.04 H new ATOM 1080 N THR A 73 -54.715 -12.273 -1.857 1.00 73.31 N ATOM 1081 CA THR A 73 -54.193 -13.628 -1.979 1.00 33.52 C ATOM 1082 C THR A 73 -55.260 -14.662 -1.643 1.00 24.20 C ATOM 1083 O THR A 73 -56.198 -14.379 -0.897 1.00 22.42 O ATOM 1084 CB THR A 73 -52.975 -13.845 -1.061 1.00 30.40 C ATOM 1085 OG1 THR A 73 -53.375 -13.757 0.311 1.00 65.52 O ATOM 1086 CG2 THR A 73 -51.891 -12.817 -1.346 1.00 71.53 C ATOM 0 H THR A 73 -54.666 -11.886 -0.915 1.00 73.31 H new ATOM 0 HA THR A 73 -53.884 -13.755 -3.017 1.00 33.52 H new ATOM 0 HB THR A 73 -52.571 -14.838 -1.259 1.00 30.40 H new ATOM 0 HG1 THR A 73 -52.596 -13.898 0.889 1.00 65.52 H new ATOM 0 HG21 THR A 73 -51.042 -12.991 -0.685 1.00 71.53 H new ATOM 0 HG22 THR A 73 -51.568 -12.907 -2.383 1.00 71.53 H new ATOM 0 HG23 THR A 73 -52.285 -11.815 -1.174 1.00 71.53 H new ATOM 1094 N ALA A 74 -55.112 -15.861 -2.196 1.00 25.51 N ATOM 1095 CA ALA A 74 -56.063 -16.938 -1.952 1.00 22.05 C ATOM 1096 C ALA A 74 -56.154 -17.263 -0.464 1.00 64.11 C ATOM 1097 O ALA A 74 -57.226 -17.588 0.044 1.00 22.20 O ATOM 1098 CB ALA A 74 -55.671 -18.177 -2.743 1.00 52.43 C ATOM 0 H ALA A 74 -54.342 -16.111 -2.816 1.00 25.51 H new ATOM 0 HA ALA A 74 -57.046 -16.605 -2.285 1.00 22.05 H new ATOM 0 HB1 ALA A 74 -56.390 -18.974 -2.551 1.00 52.43 H new ATOM 0 HB2 ALA A 74 -55.665 -17.942 -3.807 1.00 52.43 H new ATOM 0 HB3 ALA A 74 -54.677 -18.504 -2.438 1.00 52.43 H new ATOM 1104 N GLU A 75 -55.021 -17.174 0.226 1.00 71.15 N ATOM 1105 CA GLU A 75 -54.974 -17.462 1.655 1.00 23.11 C ATOM 1106 C GLU A 75 -55.838 -16.477 2.436 1.00 12.34 C ATOM 1107 O GLU A 75 -56.451 -16.835 3.441 1.00 50.21 O ATOM 1108 CB GLU A 75 -53.532 -17.406 2.161 1.00 42.41 C ATOM 1109 CG GLU A 75 -52.616 -18.425 1.504 1.00 25.54 C ATOM 1110 CD GLU A 75 -51.168 -18.266 1.927 1.00 73.13 C ATOM 1111 OE1 GLU A 75 -50.668 -17.122 1.909 1.00 41.51 O ATOM 1112 OE2 GLU A 75 -50.536 -19.285 2.274 1.00 65.41 O1- ATOM 0 H GLU A 75 -54.125 -16.905 -0.181 1.00 71.15 H new ATOM 0 HA GLU A 75 -55.367 -18.467 1.811 1.00 23.11 H new ATOM 0 HB2 GLU A 75 -53.133 -16.406 1.987 1.00 42.41 H new ATOM 0 HB3 GLU A 75 -53.528 -17.568 3.239 1.00 42.41 H new ATOM 0 HG2 GLU A 75 -52.956 -19.429 1.756 1.00 25.54 H new ATOM 0 HG3 GLU A 75 -52.687 -18.327 0.421 1.00 25.54 H new ATOM 1119 N GLU A 76 -55.879 -15.233 1.968 1.00 50.31 N ATOM 1120 CA GLU A 76 -56.667 -14.195 2.623 1.00 72.21 C ATOM 1121 C GLU A 76 -58.160 -14.465 2.466 1.00 22.24 C ATOM 1122 O GLU A 76 -58.963 -14.093 3.323 1.00 10.21 O ATOM 1123 CB GLU A 76 -56.322 -12.821 2.046 1.00 62.24 C ATOM 1124 CG GLU A 76 -55.084 -12.194 2.665 1.00 64.30 C ATOM 1125 CD GLU A 76 -55.274 -11.855 4.132 1.00 33.44 C ATOM 1126 OE1 GLU A 76 -56.420 -11.562 4.530 1.00 31.41 O ATOM 1127 OE2 GLU A 76 -54.273 -11.883 4.880 1.00 3.21 O1- ATOM 0 H GLU A 76 -55.376 -14.920 1.138 1.00 50.31 H new ATOM 0 HA GLU A 76 -56.423 -14.206 3.685 1.00 72.21 H new ATOM 0 HB2 GLU A 76 -56.172 -12.915 0.970 1.00 62.24 H new ATOM 0 HB3 GLU A 76 -57.170 -12.152 2.192 1.00 62.24 H new ATOM 0 HG2 GLU A 76 -54.243 -12.879 2.560 1.00 64.30 H new ATOM 0 HG3 GLU A 76 -54.827 -11.288 2.117 1.00 64.30 H new ATOM 1134 N ARG A 77 -58.526 -15.113 1.365 1.00 60.41 N ATOM 1135 CA ARG A 77 -59.923 -15.431 1.095 1.00 75.45 C ATOM 1136 C ARG A 77 -60.559 -16.143 2.285 1.00 5.25 C ATOM 1137 O ARG A 77 -61.641 -15.768 2.740 1.00 54.11 O ATOM 1138 CB ARG A 77 -60.036 -16.305 -0.156 1.00 61.41 C ATOM 1139 CG ARG A 77 -59.337 -15.721 -1.372 1.00 55.33 C ATOM 1140 CD ARG A 77 -59.906 -14.359 -1.742 1.00 52.34 C ATOM 1141 NE ARG A 77 -61.366 -14.346 -1.697 1.00 62.33 N ATOM 1142 CZ ARG A 77 -62.136 -14.806 -2.676 1.00 34.33 C ATOM 1143 NH1 ARG A 77 -61.588 -15.314 -3.771 1.00 23.02 N1+ ATOM 1144 NH2 ARG A 77 -63.457 -14.760 -2.560 1.00 22.33 N ATOM 0 H ARG A 77 -57.875 -15.428 0.646 1.00 60.41 H new ATOM 0 HA ARG A 77 -60.456 -14.496 0.926 1.00 75.45 H new ATOM 0 HB2 ARG A 77 -59.614 -17.287 0.058 1.00 61.41 H new ATOM 0 HB3 ARG A 77 -61.090 -16.455 -0.390 1.00 61.41 H new ATOM 0 HG2 ARG A 77 -58.270 -15.628 -1.170 1.00 55.33 H new ATOM 0 HG3 ARG A 77 -59.443 -16.402 -2.216 1.00 55.33 H new ATOM 0 HD2 ARG A 77 -59.515 -13.605 -1.059 1.00 52.34 H new ATOM 0 HD3 ARG A 77 -59.572 -14.086 -2.743 1.00 52.34 H new ATOM 0 HE ARG A 77 -61.819 -13.962 -0.868 1.00 62.33 H new ATOM 0 HH11 ARG A 77 -60.573 -15.352 -3.863 1.00 23.02 H new ATOM 0 HH12 ARG A 77 -62.182 -15.667 -4.522 1.00 23.02 H new ATOM 0 HH21 ARG A 77 -63.882 -14.371 -1.718 1.00 22.33 H new ATOM 0 HH22 ARG A 77 -64.048 -15.114 -3.313 1.00 22.33 H new ATOM 1158 N LEU A 78 -59.882 -17.171 2.784 1.00 4.11 N ATOM 1159 CA LEU A 78 -60.381 -17.937 3.920 1.00 63.30 C ATOM 1160 C LEU A 78 -60.009 -17.262 5.237 1.00 1.51 C ATOM 1161 O LEU A 78 -60.698 -17.419 6.245 1.00 72.43 O ATOM 1162 CB LEU A 78 -59.820 -19.359 3.888 1.00 62.25 C ATOM 1163 CG LEU A 78 -58.296 -19.481 3.894 1.00 4.10 C ATOM 1164 CD1 LEU A 78 -57.765 -19.466 5.319 1.00 71.01 C ATOM 1165 CD2 LEU A 78 -57.859 -20.750 3.175 1.00 24.05 C ATOM 0 H LEU A 78 -58.986 -17.493 2.419 1.00 4.11 H new ATOM 0 HA LEU A 78 -61.468 -17.980 3.848 1.00 63.30 H new ATOM 0 HB2 LEU A 78 -60.211 -19.902 4.749 1.00 62.25 H new ATOM 0 HB3 LEU A 78 -60.201 -19.858 2.997 1.00 62.25 H new ATOM 0 HG LEU A 78 -57.881 -18.624 3.363 1.00 4.10 H new ATOM 0 HD11 LEU A 78 -56.679 -19.554 5.303 1.00 71.01 H new ATOM 0 HD12 LEU A 78 -58.047 -18.530 5.802 1.00 71.01 H new ATOM 0 HD13 LEU A 78 -58.189 -20.303 5.874 1.00 71.01 H new ATOM 0 HD21 LEU A 78 -56.771 -20.820 3.189 1.00 24.05 H new ATOM 0 HD22 LEU A 78 -58.285 -21.618 3.678 1.00 24.05 H new ATOM 0 HD23 LEU A 78 -58.207 -20.721 2.143 1.00 24.05 H new ATOM 1177 N LEU A 79 -58.914 -16.507 5.220 1.00 73.12 N ATOM 1178 CA LEU A 79 -58.451 -15.805 6.412 1.00 25.52 C ATOM 1179 C LEU A 79 -59.547 -14.907 6.976 1.00 13.43 C ATOM 1180 O LEU A 79 -59.571 -14.615 8.171 1.00 45.51 O ATOM 1181 CB LEU A 79 -57.210 -14.973 6.087 1.00 42.42 C ATOM 1182 CG LEU A 79 -56.435 -14.427 7.287 1.00 44.11 C ATOM 1183 CD1 LEU A 79 -54.985 -14.164 6.911 1.00 40.45 C ATOM 1184 CD2 LEU A 79 -57.090 -13.158 7.812 1.00 24.32 C ATOM 0 H LEU A 79 -58.332 -16.366 4.395 1.00 73.12 H new ATOM 0 HA LEU A 79 -58.195 -16.549 7.166 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -56.533 -15.585 5.490 1.00 42.42 H new ATOM 0 HB3 LEU A 79 -57.514 -14.132 5.463 1.00 42.42 H new ATOM 0 HG LEU A 79 -56.454 -15.176 8.079 1.00 44.11 H new ATOM 0 HD11 LEU A 79 -54.449 -13.776 7.777 1.00 40.45 H new ATOM 0 HD12 LEU A 79 -54.520 -15.094 6.583 1.00 40.45 H new ATOM 0 HD13 LEU A 79 -54.945 -13.434 6.103 1.00 40.45 H new ATOM 0 HD21 LEU A 79 -56.525 -12.783 8.666 1.00 24.32 H new ATOM 0 HD22 LEU A 79 -57.103 -12.403 7.026 1.00 24.32 H new ATOM 0 HD23 LEU A 79 -58.112 -13.377 8.121 1.00 24.32 H new ATOM 1196 N HIS A 80 -60.454 -14.473 6.107 1.00 75.01 N ATOM 1197 CA HIS A 80 -61.555 -13.610 6.518 1.00 1.10 C ATOM 1198 C HIS A 80 -62.507 -14.351 7.452 1.00 41.42 C ATOM 1199 O HIS A 80 -63.141 -13.745 8.316 1.00 43.25 O ATOM 1200 CB HIS A 80 -62.317 -13.101 5.294 1.00 42.21 C ATOM 1201 CG HIS A 80 -63.397 -12.118 5.627 1.00 54.33 C ATOM 1202 ND1 HIS A 80 -63.348 -11.288 6.728 1.00 50.24 N ATOM 1203 CD2 HIS A 80 -64.560 -11.832 4.995 1.00 45.33 C ATOM 1204 CE1 HIS A 80 -64.433 -10.537 6.760 1.00 33.42 C ATOM 1205 NE2 HIS A 80 -65.184 -10.847 5.719 1.00 55.02 N ATOM 0 H HIS A 80 -60.448 -14.705 5.114 1.00 75.01 H new ATOM 0 HA HIS A 80 -61.136 -12.759 7.055 1.00 1.10 H new ATOM 0 HB2 HIS A 80 -61.612 -12.635 4.606 1.00 42.21 H new ATOM 0 HB3 HIS A 80 -62.758 -13.950 4.772 1.00 42.21 H new ATOM 0 HD2 HIS A 80 -64.928 -12.293 4.090 1.00 45.33 H new ATOM 0 HE1 HIS A 80 -64.667 -9.796 7.510 1.00 33.42 H new ATOM 0 HE2 HIS A 80 -66.083 -10.423 5.490 1.00 55.02 H new ATOM 1213 N ALA A 81 -62.602 -15.664 7.273 1.00 63.15 N ATOM 1214 CA ALA A 81 -63.474 -16.487 8.101 1.00 52.51 C ATOM 1215 C ALA A 81 -62.858 -16.733 9.474 1.00 71.02 C ATOM 1216 O ALA A 81 -63.569 -16.980 10.448 1.00 50.32 O ATOM 1217 CB ALA A 81 -63.765 -17.810 7.407 1.00 34.12 C ATOM 0 H ALA A 81 -62.085 -16.181 6.561 1.00 63.15 H new ATOM 0 HA ALA A 81 -64.411 -15.949 8.244 1.00 52.51 H new ATOM 0 HB1 ALA A 81 -64.417 -18.415 8.036 1.00 34.12 H new ATOM 0 HB2 ALA A 81 -64.256 -17.620 6.452 1.00 34.12 H new ATOM 0 HB3 ALA A 81 -62.830 -18.344 7.234 1.00 34.12 H new ATOM 1223 N ILE A 82 -61.533 -16.662 9.543 1.00 14.21 N ATOM 1224 CA ILE A 82 -60.822 -16.876 10.798 1.00 11.44 C ATOM 1225 C ILE A 82 -61.007 -15.694 11.743 1.00 25.11 C ATOM 1226 O ILE A 82 -61.543 -15.842 12.843 1.00 24.25 O ATOM 1227 CB ILE A 82 -59.317 -17.099 10.561 1.00 54.10 C ATOM 1228 CG1 ILE A 82 -59.099 -18.122 9.445 1.00 55.43 C ATOM 1229 CG2 ILE A 82 -58.640 -17.556 11.844 1.00 73.32 C ATOM 1230 CD1 ILE A 82 -57.641 -18.387 9.143 1.00 45.00 C ATOM 0 H ILE A 82 -60.930 -16.458 8.746 1.00 14.21 H new ATOM 0 HA ILE A 82 -61.246 -17.771 11.253 1.00 11.44 H new ATOM 0 HB ILE A 82 -58.870 -16.154 10.254 1.00 54.10 H new ATOM 0 HG12 ILE A 82 -59.580 -19.060 9.724 1.00 55.43 H new ATOM 0 HG13 ILE A 82 -59.591 -17.769 8.539 1.00 55.43 H new ATOM 0 HG21 ILE A 82 -57.577 -17.709 11.660 1.00 73.32 H new ATOM 0 HG22 ILE A 82 -58.769 -16.796 12.614 1.00 73.32 H new ATOM 0 HG23 ILE A 82 -59.089 -18.491 12.179 1.00 73.32 H new ATOM 0 HD11 ILE A 82 -57.563 -19.122 8.342 1.00 45.00 H new ATOM 0 HD12 ILE A 82 -57.159 -17.460 8.833 1.00 45.00 H new ATOM 0 HD13 ILE A 82 -57.148 -18.771 10.036 1.00 45.00 H new ATOM 1242 N PHE A 83 -60.562 -14.520 11.307 1.00 72.31 N ATOM 1243 CA PHE A 83 -60.680 -13.311 12.115 1.00 63.53 C ATOM 1244 C PHE A 83 -62.115 -12.793 12.114 1.00 3.44 C ATOM 1245 O PHE A 83 -62.544 -12.119 13.048 1.00 52.42 O ATOM 1246 CB PHE A 83 -59.735 -12.228 11.589 1.00 53.14 C ATOM 1247 CG PHE A 83 -58.524 -12.019 12.452 1.00 4.12 C ATOM 1248 CD1 PHE A 83 -57.645 -13.061 12.700 1.00 53.02 C ATOM 1249 CD2 PHE A 83 -58.264 -10.781 13.016 1.00 44.11 C ATOM 1250 CE1 PHE A 83 -56.529 -12.873 13.493 1.00 32.53 C ATOM 1251 CE2 PHE A 83 -57.150 -10.586 13.810 1.00 2.50 C ATOM 1252 CZ PHE A 83 -56.282 -11.633 14.049 1.00 24.31 C ATOM 0 H PHE A 83 -60.117 -14.380 10.400 1.00 72.31 H new ATOM 0 HA PHE A 83 -60.404 -13.560 13.140 1.00 63.53 H new ATOM 0 HB2 PHE A 83 -59.412 -12.496 10.583 1.00 53.14 H new ATOM 0 HB3 PHE A 83 -60.281 -11.288 11.509 1.00 53.14 H new ATOM 0 HD1 PHE A 83 -57.834 -14.033 12.268 1.00 53.02 H new ATOM 0 HD2 PHE A 83 -58.940 -9.959 12.833 1.00 44.11 H new ATOM 0 HE1 PHE A 83 -55.852 -13.694 13.678 1.00 32.53 H new ATOM 0 HE2 PHE A 83 -56.958 -9.615 14.243 1.00 2.50 H new ATOM 0 HZ PHE A 83 -55.411 -11.483 14.670 1.00 24.31 H new ATOM 1262 N GLY A 84 -62.854 -13.116 11.056 1.00 11.45 N ATOM 1263 CA GLY A 84 -64.232 -12.675 10.952 1.00 21.23 C ATOM 1264 C GLY A 84 -64.359 -11.164 10.929 1.00 34.15 C ATOM 1265 O GLY A 84 -65.427 -10.621 11.205 1.00 1.13 O ATOM 0 H GLY A 84 -62.522 -13.675 10.270 1.00 11.45 H new ATOM 0 HA2 GLY A 84 -64.674 -13.087 10.045 1.00 21.23 H new ATOM 0 HA3 GLY A 84 -64.801 -13.071 11.793 1.00 21.23 H new ATOM 1269 N GLU A 85 -63.264 -10.486 10.601 1.00 71.23 N ATOM 1270 CA GLU A 85 -63.257 -9.029 10.545 1.00 3.24 C ATOM 1271 C GLU A 85 -62.392 -8.531 9.391 1.00 45.31 C ATOM 1272 O GLU A 85 -61.455 -9.208 8.965 1.00 43.43 O ATOM 1273 CB GLU A 85 -62.745 -8.449 11.866 1.00 62.14 C ATOM 1274 CG GLU A 85 -63.821 -8.320 12.931 1.00 3.03 C ATOM 1275 CD GLU A 85 -63.323 -7.621 14.182 1.00 22.13 C ATOM 1276 OE1 GLU A 85 -62.311 -8.077 14.755 1.00 62.10 O ATOM 1277 OE2 GLU A 85 -63.945 -6.618 14.587 1.00 0.10 O1- ATOM 0 H GLU A 85 -62.371 -10.922 10.370 1.00 71.23 H new ATOM 0 HA GLU A 85 -64.281 -8.693 10.379 1.00 3.24 H new ATOM 0 HB2 GLU A 85 -61.944 -9.083 12.246 1.00 62.14 H new ATOM 0 HB3 GLU A 85 -62.312 -7.467 11.678 1.00 62.14 H new ATOM 0 HG2 GLU A 85 -64.667 -7.767 12.523 1.00 3.03 H new ATOM 0 HG3 GLU A 85 -64.187 -9.312 13.195 1.00 3.03 H new ATOM 1284 N LYS A 86 -62.714 -7.345 8.887 1.00 0.31 N ATOM 1285 CA LYS A 86 -61.967 -6.755 7.782 1.00 50.23 C ATOM 1286 C LYS A 86 -60.638 -6.184 8.266 1.00 62.42 C ATOM 1287 O LYS A 86 -60.585 -5.474 9.269 1.00 1.22 O ATOM 1288 CB LYS A 86 -62.793 -5.654 7.112 1.00 52.31 C ATOM 1289 CG LYS A 86 -64.092 -6.153 6.505 1.00 22.44 C ATOM 1290 CD LYS A 86 -65.216 -6.171 7.527 1.00 14.40 C ATOM 1291 CE LYS A 86 -66.581 -6.181 6.856 1.00 71.34 C ATOM 1292 NZ LYS A 86 -67.674 -6.458 7.828 1.00 0.31 N1+ ATOM 0 H LYS A 86 -63.487 -6.773 9.226 1.00 0.31 H new ATOM 0 HA LYS A 86 -61.761 -7.541 7.055 1.00 50.23 H new ATOM 0 HB2 LYS A 86 -63.018 -4.882 7.848 1.00 52.31 H new ATOM 0 HB3 LYS A 86 -62.193 -5.185 6.332 1.00 52.31 H new ATOM 0 HG2 LYS A 86 -64.372 -5.515 5.667 1.00 22.44 H new ATOM 0 HG3 LYS A 86 -63.946 -7.157 6.106 1.00 22.44 H new ATOM 0 HD2 LYS A 86 -65.116 -7.050 8.163 1.00 14.40 H new ATOM 0 HD3 LYS A 86 -65.134 -5.298 8.174 1.00 14.40 H new ATOM 0 HE2 LYS A 86 -66.757 -5.218 6.376 1.00 71.34 H new ATOM 0 HE3 LYS A 86 -66.594 -6.936 6.070 1.00 71.34 H new ATOM 0 HZ1 LYS A 86 -68.588 -6.456 7.332 1.00 0.31 H new ATOM 0 HZ2 LYS A 86 -67.520 -7.388 8.268 1.00 0.31 H new ATOM 0 HZ3 LYS A 86 -67.678 -5.723 8.564 1.00 0.31 H new ATOM 1306 N ALA A 87 -59.567 -6.499 7.545 1.00 21.22 N ATOM 1307 CA ALA A 87 -58.238 -6.015 7.899 1.00 63.11 C ATOM 1308 C ALA A 87 -57.617 -5.228 6.750 1.00 4.23 C ATOM 1309 O ALA A 87 -58.063 -5.324 5.607 1.00 21.02 O ATOM 1310 CB ALA A 87 -57.340 -7.179 8.291 1.00 2.10 C ATOM 0 H ALA A 87 -59.594 -7.087 6.712 1.00 21.22 H new ATOM 0 HA ALA A 87 -58.337 -5.344 8.752 1.00 63.11 H new ATOM 0 HB1 ALA A 87 -56.351 -6.803 8.553 1.00 2.10 H new ATOM 0 HB2 ALA A 87 -57.770 -7.698 9.148 1.00 2.10 H new ATOM 0 HB3 ALA A 87 -57.255 -7.871 7.453 1.00 2.10 H new ATOM 1316 N ARG A 88 -56.584 -4.451 7.062 1.00 51.52 N ATOM 1317 CA ARG A 88 -55.903 -3.646 6.056 1.00 72.01 C ATOM 1318 C ARG A 88 -54.721 -4.406 5.460 1.00 43.43 C ATOM 1319 O ARG A 88 -54.083 -5.210 6.140 1.00 52.35 O ATOM 1320 CB ARG A 88 -55.420 -2.329 6.667 1.00 64.15 C ATOM 1321 CG ARG A 88 -56.515 -1.552 7.381 1.00 10.34 C ATOM 1322 CD ARG A 88 -57.514 -0.964 6.397 1.00 52.23 C ATOM 1323 NE ARG A 88 -58.766 -0.588 7.049 1.00 54.25 N ATOM 1324 CZ ARG A 88 -59.691 0.174 6.477 1.00 53.44 C ATOM 1325 NH1 ARG A 88 -59.506 0.639 5.249 1.00 14.44 N1+ ATOM 1326 NH2 ARG A 88 -60.805 0.473 7.134 1.00 23.21 N ATOM 0 H ARG A 88 -56.201 -4.362 8.003 1.00 51.52 H new ATOM 0 HA ARG A 88 -56.614 -3.430 5.258 1.00 72.01 H new ATOM 0 HB2 ARG A 88 -54.616 -2.539 7.372 1.00 64.15 H new ATOM 0 HB3 ARG A 88 -54.998 -1.705 5.879 1.00 64.15 H new ATOM 0 HG2 ARG A 88 -57.034 -2.210 8.078 1.00 10.34 H new ATOM 0 HG3 ARG A 88 -56.069 -0.751 7.970 1.00 10.34 H new ATOM 0 HD2 ARG A 88 -57.078 -0.088 5.917 1.00 52.23 H new ATOM 0 HD3 ARG A 88 -57.719 -1.690 5.610 1.00 52.23 H new ATOM 0 HE ARG A 88 -58.939 -0.929 7.995 1.00 54.25 H new ATOM 0 HH11 ARG A 88 -58.651 0.412 4.741 1.00 14.44 H new ATOM 0 HH12 ARG A 88 -60.218 1.224 4.812 1.00 14.44 H new ATOM 0 HH21 ARG A 88 -60.951 0.117 8.079 1.00 23.21 H new ATOM 0 HH22 ARG A 88 -61.515 1.058 6.694 1.00 23.21 H new ATOM 1340 N GLU A 89 -54.436 -4.145 4.189 1.00 51.11 N ATOM 1341 CA GLU A 89 -53.332 -4.805 3.503 1.00 3.21 C ATOM 1342 C GLU A 89 -52.243 -3.803 3.133 1.00 11.30 C ATOM 1343 O GLU A 89 -52.486 -2.598 3.077 1.00 53.52 O ATOM 1344 CB GLU A 89 -53.835 -5.515 2.244 1.00 74.52 C ATOM 1345 CG GLU A 89 -54.803 -6.651 2.532 1.00 45.43 C ATOM 1346 CD GLU A 89 -56.246 -6.187 2.590 1.00 12.21 C ATOM 1347 OE1 GLU A 89 -56.602 -5.261 1.832 1.00 23.33 O ATOM 1348 OE2 GLU A 89 -57.018 -6.752 3.392 1.00 4.44 O1- ATOM 0 H GLU A 89 -54.954 -3.481 3.613 1.00 51.11 H new ATOM 0 HA GLU A 89 -52.907 -5.543 4.183 1.00 3.21 H new ATOM 0 HB2 GLU A 89 -54.324 -4.787 1.597 1.00 74.52 H new ATOM 0 HB3 GLU A 89 -52.981 -5.908 1.693 1.00 74.52 H new ATOM 0 HG2 GLU A 89 -54.701 -7.414 1.761 1.00 45.43 H new ATOM 0 HG3 GLU A 89 -54.537 -7.118 3.480 1.00 45.43 H new ATOM 1355 N VAL A 90 -51.040 -4.310 2.882 1.00 14.00 N ATOM 1356 CA VAL A 90 -49.912 -3.460 2.517 1.00 43.15 C ATOM 1357 C VAL A 90 -49.009 -4.151 1.504 1.00 34.22 C ATOM 1358 O VAL A 90 -48.966 -5.380 1.430 1.00 14.45 O ATOM 1359 CB VAL A 90 -49.079 -3.073 3.753 1.00 61.31 C ATOM 1360 CG1 VAL A 90 -48.056 -2.005 3.394 1.00 61.42 C ATOM 1361 CG2 VAL A 90 -49.984 -2.598 4.879 1.00 63.51 C ATOM 0 H VAL A 90 -50.821 -5.305 2.925 1.00 14.00 H new ATOM 0 HA VAL A 90 -50.327 -2.556 2.071 1.00 43.15 H new ATOM 0 HB VAL A 90 -48.542 -3.956 4.098 1.00 61.31 H new ATOM 0 HG11 VAL A 90 -47.477 -1.744 4.280 1.00 61.42 H new ATOM 0 HG12 VAL A 90 -47.387 -2.386 2.622 1.00 61.42 H new ATOM 0 HG13 VAL A 90 -48.570 -1.119 3.023 1.00 61.42 H new ATOM 0 HG21 VAL A 90 -49.378 -2.329 5.744 1.00 63.51 H new ATOM 0 HG22 VAL A 90 -50.550 -1.728 4.548 1.00 63.51 H new ATOM 0 HG23 VAL A 90 -50.673 -3.397 5.153 1.00 63.51 H new ATOM 1371 N ARG A 91 -48.286 -3.355 0.723 1.00 25.45 N ATOM 1372 CA ARG A 91 -47.382 -3.890 -0.289 1.00 3.45 C ATOM 1373 C ARG A 91 -45.958 -3.392 -0.063 1.00 15.52 C ATOM 1374 O ARG A 91 -45.736 -2.204 0.170 1.00 10.53 O ATOM 1375 CB ARG A 91 -47.857 -3.496 -1.688 1.00 35.24 C ATOM 1376 CG ARG A 91 -47.065 -4.151 -2.807 1.00 1.41 C ATOM 1377 CD ARG A 91 -47.089 -3.310 -4.073 1.00 62.05 C ATOM 1378 NE ARG A 91 -48.213 -3.656 -4.939 1.00 32.31 N ATOM 1379 CZ ARG A 91 -48.391 -3.145 -6.152 1.00 62.40 C ATOM 1380 NH1 ARG A 91 -47.522 -2.270 -6.641 1.00 60.23 N1+ ATOM 1381 NH2 ARG A 91 -49.439 -3.509 -6.880 1.00 63.42 N ATOM 0 H ARG A 91 -48.309 -2.336 0.772 1.00 25.45 H new ATOM 0 HA ARG A 91 -47.386 -4.977 -0.206 1.00 3.45 H new ATOM 0 HB2 ARG A 91 -48.908 -3.763 -1.794 1.00 35.24 H new ATOM 0 HB3 ARG A 91 -47.791 -2.413 -1.793 1.00 35.24 H new ATOM 0 HG2 ARG A 91 -46.034 -4.298 -2.486 1.00 1.41 H new ATOM 0 HG3 ARG A 91 -47.478 -5.138 -3.017 1.00 1.41 H new ATOM 0 HD2 ARG A 91 -47.148 -2.255 -3.806 1.00 62.05 H new ATOM 0 HD3 ARG A 91 -46.155 -3.449 -4.618 1.00 62.05 H new ATOM 0 HE ARG A 91 -48.899 -4.327 -4.593 1.00 32.31 H new ATOM 0 HH11 ARG A 91 -46.715 -1.988 -6.085 1.00 60.23 H new ATOM 0 HH12 ARG A 91 -47.661 -1.879 -7.573 1.00 60.23 H new ATOM 0 HH21 ARG A 91 -50.109 -4.182 -6.508 1.00 63.42 H new ATOM 0 HH22 ARG A 91 -49.574 -3.116 -7.811 1.00 63.42 H new ATOM 1395 N ASP A 92 -44.998 -4.307 -0.135 1.00 43.34 N ATOM 1396 CA ASP A 92 -43.595 -3.962 0.060 1.00 22.20 C ATOM 1397 C ASP A 92 -43.025 -3.284 -1.181 1.00 4.24 C ATOM 1398 O ASP A 92 -42.771 -3.934 -2.196 1.00 43.15 O ATOM 1399 CB ASP A 92 -42.781 -5.212 0.393 1.00 42.30 C ATOM 1400 CG ASP A 92 -42.897 -6.280 -0.675 1.00 10.14 C ATOM 1401 OD1 ASP A 92 -43.944 -6.958 -0.725 1.00 24.00 O ATOM 1402 OD2 ASP A 92 -41.940 -6.440 -1.463 1.00 53.42 O1- ATOM 0 H ASP A 92 -45.166 -5.295 -0.327 1.00 43.34 H new ATOM 0 HA ASP A 92 -43.531 -3.264 0.895 1.00 22.20 H new ATOM 0 HB2 ASP A 92 -41.733 -4.938 0.516 1.00 42.30 H new ATOM 0 HB3 ASP A 92 -43.118 -5.618 1.347 1.00 42.30 H new ATOM 1407 N THR A 93 -42.826 -1.971 -1.096 1.00 3.24 N ATOM 1408 CA THR A 93 -42.288 -1.205 -2.213 1.00 15.11 C ATOM 1409 C THR A 93 -40.926 -0.613 -1.868 1.00 15.23 C ATOM 1410 O THR A 93 -40.533 0.420 -2.408 1.00 31.43 O ATOM 1411 CB THR A 93 -43.241 -0.067 -2.624 1.00 51.14 C ATOM 1412 OG1 THR A 93 -43.192 0.986 -1.655 1.00 20.55 O ATOM 1413 CG2 THR A 93 -44.668 -0.577 -2.754 1.00 32.22 C ATOM 0 H THR A 93 -43.030 -1.417 -0.264 1.00 3.24 H new ATOM 0 HA THR A 93 -42.179 -1.897 -3.048 1.00 15.11 H new ATOM 0 HB THR A 93 -42.919 0.315 -3.593 1.00 51.14 H new ATOM 0 HG1 THR A 93 -43.800 1.706 -1.924 1.00 20.55 H new ATOM 0 HG21 THR A 93 -45.323 0.244 -3.045 1.00 32.22 H new ATOM 0 HG22 THR A 93 -44.707 -1.359 -3.513 1.00 32.22 H new ATOM 0 HG23 THR A 93 -44.998 -0.983 -1.798 1.00 32.22 H new ATOM 1421 N SER A 94 -40.210 -1.274 -0.964 1.00 41.23 N ATOM 1422 CA SER A 94 -38.892 -0.811 -0.545 1.00 71.52 C ATOM 1423 C SER A 94 -37.803 -1.384 -1.446 1.00 43.33 C ATOM 1424 O SER A 94 -38.056 -2.276 -2.257 1.00 3.02 O ATOM 1425 CB SER A 94 -38.628 -1.208 0.909 1.00 20.52 C ATOM 1426 OG SER A 94 -39.678 -0.775 1.756 1.00 2.23 O ATOM 0 H SER A 94 -40.520 -2.132 -0.508 1.00 41.23 H new ATOM 0 HA SER A 94 -38.872 0.276 -0.627 1.00 71.52 H new ATOM 0 HB2 SER A 94 -38.523 -2.291 0.980 1.00 20.52 H new ATOM 0 HB3 SER A 94 -37.686 -0.774 1.242 1.00 20.52 H new ATOM 0 HG SER A 94 -40.436 -0.478 1.211 1.00 2.23 H new ATOM 1432 N LEU A 95 -36.589 -0.863 -1.300 1.00 11.13 N ATOM 1433 CA LEU A 95 -35.460 -1.320 -2.102 1.00 34.44 C ATOM 1434 C LEU A 95 -34.938 -2.661 -1.593 1.00 62.22 C ATOM 1435 O LEU A 95 -35.041 -2.967 -0.404 1.00 61.44 O ATOM 1436 CB LEU A 95 -34.337 -0.281 -2.076 1.00 53.31 C ATOM 1437 CG LEU A 95 -33.478 -0.252 -0.812 1.00 14.14 C ATOM 1438 CD1 LEU A 95 -32.299 -1.203 -0.946 1.00 71.33 C ATOM 1439 CD2 LEU A 95 -32.994 1.163 -0.528 1.00 61.44 C ATOM 0 H LEU A 95 -36.362 -0.124 -0.634 1.00 11.13 H new ATOM 0 HA LEU A 95 -35.804 -1.450 -3.128 1.00 34.44 H new ATOM 0 HB2 LEU A 95 -33.684 -0.460 -2.931 1.00 53.31 H new ATOM 0 HB3 LEU A 95 -34.779 0.706 -2.213 1.00 53.31 H new ATOM 0 HG LEU A 95 -34.090 -0.581 0.028 1.00 14.14 H new ATOM 0 HD11 LEU A 95 -31.699 -1.169 -0.037 1.00 71.33 H new ATOM 0 HD12 LEU A 95 -32.666 -2.218 -1.101 1.00 71.33 H new ATOM 0 HD13 LEU A 95 -31.686 -0.905 -1.797 1.00 71.33 H new ATOM 0 HD21 LEU A 95 -32.384 1.164 0.375 1.00 61.44 H new ATOM 0 HD22 LEU A 95 -32.398 1.519 -1.368 1.00 61.44 H new ATOM 0 HD23 LEU A 95 -33.852 1.820 -0.387 1.00 61.44 H new ATOM 1451 N ARG A 96 -34.377 -3.455 -2.498 1.00 22.20 N ATOM 1452 CA ARG A 96 -33.838 -4.761 -2.141 1.00 2.41 C ATOM 1453 C ARG A 96 -32.332 -4.685 -1.914 1.00 14.45 C ATOM 1454 O ARG A 96 -31.579 -4.277 -2.798 1.00 63.30 O ATOM 1455 CB ARG A 96 -34.149 -5.781 -3.237 1.00 44.25 C ATOM 1456 CG ARG A 96 -35.549 -6.365 -3.149 1.00 63.41 C ATOM 1457 CD ARG A 96 -35.624 -7.483 -2.120 1.00 52.41 C ATOM 1458 NE ARG A 96 -36.938 -8.117 -2.096 1.00 50.34 N ATOM 1459 CZ ARG A 96 -37.232 -9.173 -1.343 1.00 2.41 C ATOM 1460 NH1 ARG A 96 -36.306 -9.708 -0.559 1.00 13.23 N1+ ATOM 1461 NH2 ARG A 96 -38.451 -9.693 -1.376 1.00 2.33 N ATOM 0 H ARG A 96 -34.284 -3.216 -3.485 1.00 22.20 H new ATOM 0 HA ARG A 96 -34.311 -5.080 -1.212 1.00 2.41 H new ATOM 0 HB2 ARG A 96 -34.024 -5.305 -4.210 1.00 44.25 H new ATOM 0 HB3 ARG A 96 -33.423 -6.592 -3.183 1.00 44.25 H new ATOM 0 HG2 ARG A 96 -36.256 -5.579 -2.885 1.00 63.41 H new ATOM 0 HG3 ARG A 96 -35.847 -6.747 -4.125 1.00 63.41 H new ATOM 0 HD2 ARG A 96 -34.864 -8.232 -2.343 1.00 52.41 H new ATOM 0 HD3 ARG A 96 -35.397 -7.082 -1.132 1.00 52.41 H new ATOM 0 HE ARG A 96 -37.671 -7.729 -2.689 1.00 50.34 H new ATOM 0 HH11 ARG A 96 -35.367 -9.310 -0.533 1.00 13.23 H new ATOM 0 HH12 ARG A 96 -36.532 -10.518 0.018 1.00 13.23 H new ATOM 0 HH21 ARG A 96 -39.164 -9.283 -1.979 1.00 2.33 H new ATOM 0 HH22 ARG A 96 -38.676 -10.503 -0.798 1.00 2.33 H new ATOM 1475 N VAL A 97 -31.898 -5.079 -0.720 1.00 32.32 N ATOM 1476 CA VAL A 97 -30.481 -5.057 -0.377 1.00 32.11 C ATOM 1477 C VAL A 97 -29.893 -6.463 -0.376 1.00 2.42 C ATOM 1478 O VAL A 97 -30.460 -7.400 0.187 1.00 4.01 O ATOM 1479 CB VAL A 97 -30.249 -4.414 1.004 1.00 24.41 C ATOM 1480 CG1 VAL A 97 -28.939 -4.900 1.606 1.00 40.42 C ATOM 1481 CG2 VAL A 97 -30.265 -2.897 0.895 1.00 52.15 C ATOM 0 H VAL A 97 -32.507 -5.417 0.025 1.00 32.32 H new ATOM 0 HA VAL A 97 -29.980 -4.458 -1.138 1.00 32.11 H new ATOM 0 HB VAL A 97 -31.060 -4.716 1.667 1.00 24.41 H new ATOM 0 HG11 VAL A 97 -28.792 -4.435 2.581 1.00 40.42 H new ATOM 0 HG12 VAL A 97 -28.971 -5.983 1.722 1.00 40.42 H new ATOM 0 HG13 VAL A 97 -28.114 -4.630 0.947 1.00 40.42 H new ATOM 0 HG21 VAL A 97 -30.100 -2.460 1.880 1.00 52.15 H new ATOM 0 HG22 VAL A 97 -29.476 -2.573 0.217 1.00 52.15 H new ATOM 0 HG23 VAL A 97 -31.231 -2.570 0.510 1.00 52.15 H new ATOM 1491 N PRO A 98 -28.727 -6.616 -1.021 1.00 12.13 N ATOM 1492 CA PRO A 98 -28.035 -7.906 -1.108 1.00 3.14 C ATOM 1493 C PRO A 98 -27.463 -8.350 0.234 1.00 31.21 C ATOM 1494 O PRO A 98 -27.303 -7.542 1.149 1.00 54.31 O ATOM 1495 CB PRO A 98 -26.907 -7.636 -2.107 1.00 5.32 C ATOM 1496 CG PRO A 98 -26.660 -6.170 -2.013 1.00 31.15 C ATOM 1497 CD PRO A 98 -27.994 -5.544 -1.714 1.00 23.22 C ATOM 0 HA PRO A 98 -28.707 -8.709 -1.409 1.00 3.14 H new ATOM 0 HB2 PRO A 98 -26.012 -8.205 -1.856 1.00 5.32 H new ATOM 0 HB3 PRO A 98 -27.196 -7.925 -3.118 1.00 5.32 H new ATOM 0 HG2 PRO A 98 -25.939 -5.945 -1.227 1.00 31.15 H new ATOM 0 HG3 PRO A 98 -26.247 -5.783 -2.945 1.00 31.15 H new ATOM 0 HD2 PRO A 98 -27.891 -4.658 -1.087 1.00 23.22 H new ATOM 0 HD3 PRO A 98 -28.505 -5.232 -2.625 1.00 23.22 H new ATOM 1505 N HIS A 99 -27.157 -9.638 0.345 1.00 2.03 N ATOM 1506 CA HIS A 99 -26.602 -10.189 1.576 1.00 40.20 C ATOM 1507 C HIS A 99 -25.219 -9.608 1.856 1.00 23.32 C ATOM 1508 O HIS A 99 -24.376 -9.527 0.963 1.00 3.54 O ATOM 1509 CB HIS A 99 -26.519 -11.712 1.486 1.00 10.22 C ATOM 1510 CG HIS A 99 -25.723 -12.201 0.315 1.00 63.35 C ATOM 1511 ND1 HIS A 99 -26.272 -12.415 -0.931 1.00 22.30 N ATOM 1512 CD2 HIS A 99 -24.411 -12.517 0.206 1.00 12.11 C ATOM 1513 CE1 HIS A 99 -25.333 -12.842 -1.756 1.00 51.45 C ATOM 1514 NE2 HIS A 99 -24.194 -12.912 -1.092 1.00 54.33 N ATOM 0 H HIS A 99 -27.284 -10.320 -0.403 1.00 2.03 H new ATOM 0 HA HIS A 99 -27.264 -9.917 2.398 1.00 40.20 H new ATOM 0 HB2 HIS A 99 -26.075 -12.098 2.403 1.00 10.22 H new ATOM 0 HB3 HIS A 99 -27.528 -12.120 1.424 1.00 10.22 H new ATOM 0 HD2 HIS A 99 -23.673 -12.468 0.993 1.00 12.11 H new ATOM 0 HE1 HIS A 99 -25.473 -13.092 -2.797 1.00 51.45 H new ATOM 0 HE2 HIS A 99 -23.299 -13.211 -1.479 1.00 54.33 H new ATOM 1522 N GLY A 100 -24.994 -9.202 3.103 1.00 52.11 N ATOM 1523 CA GLY A 100 -23.711 -8.634 3.476 1.00 34.40 C ATOM 1524 C GLY A 100 -23.640 -7.143 3.210 1.00 32.53 C ATOM 1525 O GLY A 100 -23.259 -6.367 4.085 1.00 13.43 O ATOM 0 H GLY A 100 -25.676 -9.256 3.860 1.00 52.11 H new ATOM 0 HA2 GLY A 100 -23.528 -8.821 4.534 1.00 34.40 H new ATOM 0 HA3 GLY A 100 -22.919 -9.137 2.922 1.00 34.40 H new ATOM 1529 N GLY A 101 -24.005 -6.741 1.996 1.00 3.44 N ATOM 1530 CA GLY A 101 -23.971 -5.335 1.638 1.00 63.32 C ATOM 1531 C GLY A 101 -22.624 -4.910 1.088 1.00 13.11 C ATOM 1532 O GLY A 101 -22.549 -4.070 0.192 1.00 41.12 O ATOM 0 H GLY A 101 -24.324 -7.364 1.254 1.00 3.44 H new ATOM 0 HA2 GLY A 101 -24.743 -5.133 0.896 1.00 63.32 H new ATOM 0 HA3 GLY A 101 -24.208 -4.734 2.516 1.00 63.32 H new ATOM 1536 N GLY A 102 -21.555 -5.490 1.628 1.00 35.30 N ATOM 1537 CA GLY A 102 -20.219 -5.152 1.173 1.00 42.33 C ATOM 1538 C GLY A 102 -19.596 -4.035 1.987 1.00 11.11 C ATOM 1539 O GLY A 102 -18.401 -4.064 2.280 1.00 65.03 O ATOM 0 H GLY A 102 -21.591 -6.187 2.372 1.00 35.30 H new ATOM 0 HA2 GLY A 102 -19.584 -6.036 1.230 1.00 42.33 H new ATOM 0 HA3 GLY A 102 -20.259 -4.855 0.125 1.00 42.33 H new ATOM 1543 N GLY A 103 -20.407 -3.047 2.352 1.00 42.51 N ATOM 1544 CA GLY A 103 -19.909 -1.929 3.132 1.00 70.24 C ATOM 1545 C GLY A 103 -20.809 -1.594 4.305 1.00 14.31 C ATOM 1546 O GLY A 103 -21.577 -2.438 4.768 1.00 75.45 O ATOM 0 H GLY A 103 -21.400 -3.001 2.122 1.00 42.51 H new ATOM 0 HA2 GLY A 103 -18.910 -2.163 3.500 1.00 70.24 H new ATOM 0 HA3 GLY A 103 -19.815 -1.054 2.489 1.00 70.24 H new ATOM 1550 N ILE A 104 -20.713 -0.360 4.789 1.00 10.42 N ATOM 1551 CA ILE A 104 -21.524 0.084 5.915 1.00 73.30 C ATOM 1552 C ILE A 104 -22.127 1.460 5.650 1.00 61.32 C ATOM 1553 O ILE A 104 -21.519 2.296 4.981 1.00 74.25 O ATOM 1554 CB ILE A 104 -20.702 0.138 7.216 1.00 31.42 C ATOM 1555 CG1 ILE A 104 -20.030 -1.213 7.475 1.00 73.31 C ATOM 1556 CG2 ILE A 104 -21.589 0.527 8.389 1.00 75.13 C ATOM 1557 CD1 ILE A 104 -19.051 -1.189 8.629 1.00 42.35 C ATOM 0 H ILE A 104 -20.081 0.350 4.418 1.00 10.42 H new ATOM 0 HA ILE A 104 -22.326 -0.645 6.032 1.00 73.30 H new ATOM 0 HB ILE A 104 -19.926 0.896 7.107 1.00 31.42 H new ATOM 0 HG12 ILE A 104 -20.798 -1.959 7.676 1.00 73.31 H new ATOM 0 HG13 ILE A 104 -19.507 -1.529 6.572 1.00 73.31 H new ATOM 0 HG21 ILE A 104 -20.993 0.561 9.301 1.00 75.13 H new ATOM 0 HG22 ILE A 104 -22.026 1.508 8.205 1.00 75.13 H new ATOM 0 HG23 ILE A 104 -22.385 -0.209 8.503 1.00 75.13 H new ATOM 0 HD11 ILE A 104 -18.613 -2.179 8.755 1.00 42.35 H new ATOM 0 HD12 ILE A 104 -18.262 -0.467 8.421 1.00 42.35 H new ATOM 0 HD13 ILE A 104 -19.573 -0.904 9.543 1.00 42.35 H new ATOM 1569 N ILE A 105 -23.322 1.689 6.183 1.00 72.41 N ATOM 1570 CA ILE A 105 -24.005 2.965 6.007 1.00 11.13 C ATOM 1571 C ILE A 105 -23.244 4.094 6.693 1.00 43.31 C ATOM 1572 O ILE A 105 -23.253 4.209 7.919 1.00 71.54 O ATOM 1573 CB ILE A 105 -25.441 2.917 6.562 1.00 21.24 C ATOM 1574 CG1 ILE A 105 -26.200 1.729 5.969 1.00 33.43 C ATOM 1575 CG2 ILE A 105 -26.168 4.220 6.263 1.00 13.51 C ATOM 1576 CD1 ILE A 105 -26.436 1.844 4.480 1.00 11.11 C ATOM 0 H ILE A 105 -23.838 1.008 6.740 1.00 72.41 H new ATOM 0 HA ILE A 105 -24.046 3.156 4.935 1.00 11.13 H new ATOM 0 HB ILE A 105 -25.393 2.790 7.644 1.00 21.24 H new ATOM 0 HG12 ILE A 105 -25.642 0.815 6.170 1.00 33.43 H new ATOM 0 HG13 ILE A 105 -27.161 1.634 6.474 1.00 33.43 H new ATOM 0 HG21 ILE A 105 -27.181 4.171 6.661 1.00 13.51 H new ATOM 0 HG22 ILE A 105 -25.635 5.049 6.728 1.00 13.51 H new ATOM 0 HG23 ILE A 105 -26.209 4.375 5.185 1.00 13.51 H new ATOM 0 HD11 ILE A 105 -26.979 0.967 4.129 1.00 11.11 H new ATOM 0 HD12 ILE A 105 -27.021 2.740 4.272 1.00 11.11 H new ATOM 0 HD13 ILE A 105 -25.478 1.908 3.964 1.00 11.11 H new ATOM 1588 N HIS A 106 -22.587 4.929 5.893 1.00 44.11 N ATOM 1589 CA HIS A 106 -21.822 6.053 6.424 1.00 34.34 C ATOM 1590 C HIS A 106 -22.556 7.369 6.188 1.00 52.02 C ATOM 1591 O HIS A 106 -22.338 8.350 6.899 1.00 2.51 O ATOM 1592 CB HIS A 106 -20.437 6.105 5.778 1.00 22.33 C ATOM 1593 CG HIS A 106 -19.559 7.183 6.331 1.00 1.11 C ATOM 1594 ND1 HIS A 106 -18.528 7.754 5.615 1.00 2.12 N ATOM 1595 CD2 HIS A 106 -19.563 7.797 7.537 1.00 44.21 C ATOM 1596 CE1 HIS A 106 -17.934 8.672 6.358 1.00 70.15 C ATOM 1597 NE2 HIS A 106 -18.544 8.718 7.529 1.00 4.01 N ATOM 0 H HIS A 106 -22.569 4.849 4.876 1.00 44.11 H new ATOM 0 HA HIS A 106 -21.708 5.908 7.498 1.00 34.34 H new ATOM 0 HB2 HIS A 106 -19.945 5.142 5.914 1.00 22.33 H new ATOM 0 HB3 HIS A 106 -20.551 6.256 4.705 1.00 22.33 H new ATOM 0 HD2 HIS A 106 -20.241 7.600 8.354 1.00 44.21 H new ATOM 0 HE1 HIS A 106 -17.093 9.281 6.059 1.00 70.15 H new ATOM 0 HE2 HIS A 106 -18.298 9.337 8.302 1.00 4.01 H new ATOM 1605 N ASP A 107 -23.427 7.383 5.185 1.00 2.53 N ATOM 1606 CA ASP A 107 -24.194 8.580 4.854 1.00 2.33 C ATOM 1607 C ASP A 107 -25.492 8.214 4.143 1.00 53.53 C ATOM 1608 O ASP A 107 -25.609 7.138 3.556 1.00 42.21 O ATOM 1609 CB ASP A 107 -23.364 9.518 3.976 1.00 13.01 C ATOM 1610 CG ASP A 107 -22.313 10.272 4.767 1.00 51.05 C ATOM 1611 OD1 ASP A 107 -22.693 11.066 5.653 1.00 40.31 O ATOM 1612 OD2 ASP A 107 -21.109 10.068 4.500 1.00 71.12 O1- ATOM 0 H ASP A 107 -23.620 6.580 4.587 1.00 2.53 H new ATOM 0 HA ASP A 107 -24.442 9.091 5.784 1.00 2.33 H new ATOM 0 HB2 ASP A 107 -22.878 8.940 3.190 1.00 13.01 H new ATOM 0 HB3 ASP A 107 -24.026 10.231 3.484 1.00 13.01 H new ATOM 1617 N VAL A 108 -26.468 9.115 4.200 1.00 40.23 N ATOM 1618 CA VAL A 108 -27.758 8.887 3.562 1.00 11.03 C ATOM 1619 C VAL A 108 -28.395 10.202 3.125 1.00 62.13 C ATOM 1620 O VAL A 108 -28.426 11.172 3.883 1.00 23.34 O ATOM 1621 CB VAL A 108 -28.727 8.148 4.504 1.00 20.20 C ATOM 1622 CG1 VAL A 108 -30.079 7.953 3.833 1.00 12.41 C ATOM 1623 CG2 VAL A 108 -28.138 6.813 4.932 1.00 33.40 C ATOM 0 H VAL A 108 -26.389 10.010 4.682 1.00 40.23 H new ATOM 0 HA VAL A 108 -27.572 8.267 2.685 1.00 11.03 H new ATOM 0 HB VAL A 108 -28.875 8.757 5.396 1.00 20.20 H new ATOM 0 HG11 VAL A 108 -30.751 7.429 4.513 1.00 12.41 H new ATOM 0 HG12 VAL A 108 -30.503 8.925 3.581 1.00 12.41 H new ATOM 0 HG13 VAL A 108 -29.953 7.365 2.924 1.00 12.41 H new ATOM 0 HG21 VAL A 108 -28.836 6.304 5.597 1.00 33.40 H new ATOM 0 HG22 VAL A 108 -27.959 6.195 4.052 1.00 33.40 H new ATOM 0 HG23 VAL A 108 -27.196 6.981 5.454 1.00 33.40 H new ATOM 1633 N LYS A 109 -28.903 10.227 1.898 1.00 73.05 N ATOM 1634 CA LYS A 109 -29.542 11.423 1.359 1.00 64.22 C ATOM 1635 C LYS A 109 -31.032 11.188 1.134 1.00 55.52 C ATOM 1636 O LYS A 109 -31.432 10.173 0.564 1.00 53.24 O ATOM 1637 CB LYS A 109 -28.875 11.832 0.044 1.00 5.12 C ATOM 1638 CG LYS A 109 -27.724 12.808 0.224 1.00 4.01 C ATOM 1639 CD LYS A 109 -28.187 14.249 0.081 1.00 43.23 C ATOM 1640 CE LYS A 109 -27.127 15.224 0.568 1.00 25.43 C ATOM 1641 NZ LYS A 109 -25.932 15.236 -0.322 1.00 11.23 N1+ ATOM 0 H LYS A 109 -28.885 9.433 1.258 1.00 73.05 H new ATOM 0 HA LYS A 109 -29.425 12.227 2.085 1.00 64.22 H new ATOM 0 HB2 LYS A 109 -28.507 10.939 -0.461 1.00 5.12 H new ATOM 0 HB3 LYS A 109 -29.623 12.282 -0.609 1.00 5.12 H new ATOM 0 HG2 LYS A 109 -27.275 12.665 1.207 1.00 4.01 H new ATOM 0 HG3 LYS A 109 -26.950 12.599 -0.514 1.00 4.01 H new ATOM 0 HD2 LYS A 109 -28.421 14.455 -0.963 1.00 43.23 H new ATOM 0 HD3 LYS A 109 -29.106 14.395 0.648 1.00 43.23 H new ATOM 0 HE2 LYS A 109 -27.552 16.227 0.619 1.00 25.43 H new ATOM 0 HE3 LYS A 109 -26.823 14.955 1.580 1.00 25.43 H new ATOM 0 HZ1 LYS A 109 -25.233 15.913 0.045 1.00 11.23 H new ATOM 0 HZ2 LYS A 109 -25.511 14.285 -0.351 1.00 11.23 H new ATOM 0 HZ3 LYS A 109 -26.217 15.518 -1.282 1.00 11.23 H new ATOM 1655 N VAL A 110 -31.850 12.134 1.584 1.00 33.40 N ATOM 1656 CA VAL A 110 -33.296 12.032 1.429 1.00 62.24 C ATOM 1657 C VAL A 110 -33.896 13.361 0.984 1.00 62.33 C ATOM 1658 O VAL A 110 -33.731 14.383 1.650 1.00 72.31 O ATOM 1659 CB VAL A 110 -33.971 11.590 2.741 1.00 4.52 C ATOM 1660 CG1 VAL A 110 -33.600 12.531 3.876 1.00 44.34 C ATOM 1661 CG2 VAL A 110 -35.481 11.520 2.566 1.00 54.34 C ATOM 0 H VAL A 110 -31.536 12.980 2.059 1.00 33.40 H new ATOM 0 HA VAL A 110 -33.480 11.279 0.663 1.00 62.24 H new ATOM 0 HB VAL A 110 -33.612 10.593 2.996 1.00 4.52 H new ATOM 0 HG11 VAL A 110 -34.086 12.203 4.795 1.00 44.34 H new ATOM 0 HG12 VAL A 110 -32.519 12.525 4.015 1.00 44.34 H new ATOM 0 HG13 VAL A 110 -33.928 13.542 3.633 1.00 44.34 H new ATOM 0 HG21 VAL A 110 -35.942 11.206 3.503 1.00 54.34 H new ATOM 0 HG22 VAL A 110 -35.861 12.503 2.286 1.00 54.34 H new ATOM 0 HG23 VAL A 110 -35.724 10.801 1.784 1.00 54.34 H new ATOM 1671 N PHE A 111 -34.596 13.340 -0.146 1.00 31.14 N ATOM 1672 CA PHE A 111 -35.221 14.543 -0.680 1.00 61.30 C ATOM 1673 C PHE A 111 -36.726 14.534 -0.425 1.00 14.04 C ATOM 1674 O PHE A 111 -37.350 13.475 -0.369 1.00 54.20 O ATOM 1675 CB PHE A 111 -34.949 14.662 -2.182 1.00 25.34 C ATOM 1676 CG PHE A 111 -33.518 14.395 -2.554 1.00 21.54 C ATOM 1677 CD1 PHE A 111 -32.486 15.049 -1.901 1.00 61.01 C ATOM 1678 CD2 PHE A 111 -33.206 13.489 -3.554 1.00 34.24 C ATOM 1679 CE1 PHE A 111 -31.169 14.806 -2.243 1.00 62.23 C ATOM 1680 CE2 PHE A 111 -31.891 13.241 -3.900 1.00 44.30 C ATOM 1681 CZ PHE A 111 -30.871 13.900 -3.241 1.00 45.00 C ATOM 0 H PHE A 111 -34.744 12.502 -0.709 1.00 31.14 H new ATOM 0 HA PHE A 111 -34.788 15.403 -0.169 1.00 61.30 H new ATOM 0 HB2 PHE A 111 -35.592 13.962 -2.716 1.00 25.34 H new ATOM 0 HB3 PHE A 111 -35.222 15.663 -2.515 1.00 25.34 H new ATOM 0 HD1 PHE A 111 -32.713 15.756 -1.117 1.00 61.01 H new ATOM 0 HD2 PHE A 111 -34.000 12.970 -4.070 1.00 34.24 H new ATOM 0 HE1 PHE A 111 -30.373 15.325 -1.729 1.00 62.23 H new ATOM 0 HE2 PHE A 111 -31.661 12.534 -4.683 1.00 44.30 H new ATOM 0 HZ PHE A 111 -29.842 13.707 -3.506 1.00 45.00 H new ATOM 1691 N ASN A 112 -37.302 15.722 -0.270 1.00 50.25 N ATOM 1692 CA ASN A 112 -38.733 15.851 -0.020 1.00 72.43 C ATOM 1693 C ASN A 112 -39.354 16.895 -0.942 1.00 13.34 C ATOM 1694 O ASN A 112 -38.812 17.986 -1.116 1.00 60.11 O ATOM 1695 CB ASN A 112 -38.983 16.231 1.442 1.00 64.11 C ATOM 1696 CG ASN A 112 -40.348 15.785 1.929 1.00 42.02 C ATOM 1697 OD1 ASN A 112 -41.193 15.363 1.140 1.00 74.51 O ATOM 1698 ND2 ASN A 112 -40.569 15.877 3.235 1.00 45.40 N ATOM 0 H ASN A 112 -36.800 16.609 -0.313 1.00 50.25 H new ATOM 0 HA ASN A 112 -39.201 14.888 -0.224 1.00 72.43 H new ATOM 0 HB2 ASN A 112 -38.212 15.782 2.068 1.00 64.11 H new ATOM 0 HB3 ASN A 112 -38.895 17.312 1.554 1.00 64.11 H new ATOM 0 HD21 ASN A 112 -41.469 15.592 3.621 1.00 45.40 H new ATOM 0 HD22 ASN A 112 -39.839 16.233 3.852 1.00 45.40 H new ATOM 1705 N ARG A 113 -40.495 16.552 -1.529 1.00 20.34 N ATOM 1706 CA ARG A 113 -41.191 17.459 -2.435 1.00 53.42 C ATOM 1707 C ARG A 113 -41.552 18.762 -1.728 1.00 54.43 C ATOM 1708 O ARG A 113 -41.596 19.824 -2.348 1.00 33.44 O ATOM 1709 CB ARG A 113 -42.457 16.796 -2.982 1.00 52.52 C ATOM 1710 CG ARG A 113 -43.460 16.416 -1.905 1.00 1.01 C ATOM 1711 CD ARG A 113 -44.758 15.906 -2.509 1.00 10.22 C ATOM 1712 NE ARG A 113 -45.409 16.916 -3.340 1.00 43.12 N ATOM 1713 CZ ARG A 113 -46.606 16.753 -3.892 1.00 21.52 C ATOM 1714 NH1 ARG A 113 -47.281 15.628 -3.701 1.00 31.21 N1+ ATOM 1715 NH2 ARG A 113 -47.130 17.718 -4.637 1.00 54.41 N ATOM 0 H ARG A 113 -40.958 15.653 -1.394 1.00 20.34 H new ATOM 0 HA ARG A 113 -40.522 17.688 -3.264 1.00 53.42 H new ATOM 0 HB2 ARG A 113 -42.935 17.474 -3.689 1.00 52.52 H new ATOM 0 HB3 ARG A 113 -42.177 15.901 -3.538 1.00 52.52 H new ATOM 0 HG2 ARG A 113 -43.031 15.649 -1.261 1.00 1.01 H new ATOM 0 HG3 ARG A 113 -43.666 17.282 -1.276 1.00 1.01 H new ATOM 0 HD2 ARG A 113 -44.555 15.019 -3.109 1.00 10.22 H new ATOM 0 HD3 ARG A 113 -45.435 15.602 -1.710 1.00 10.22 H new ATOM 0 HE ARG A 113 -44.917 17.794 -3.505 1.00 43.12 H new ATOM 0 HH11 ARG A 113 -46.881 14.884 -3.129 1.00 31.21 H new ATOM 0 HH12 ARG A 113 -48.200 15.506 -4.126 1.00 31.21 H new ATOM 0 HH21 ARG A 113 -46.614 18.585 -4.786 1.00 54.41 H new ATOM 0 HH22 ARG A 113 -48.049 17.593 -5.061 1.00 54.41 H new ATOM 1729 N GLU A 114 -41.808 18.672 -0.426 1.00 1.14 N ATOM 1730 CA GLU A 114 -42.167 19.844 0.364 1.00 4.11 C ATOM 1731 C GLU A 114 -41.019 20.849 0.397 1.00 41.23 C ATOM 1732 O GLU A 114 -41.234 22.046 0.589 1.00 33.03 O ATOM 1733 CB GLU A 114 -42.538 19.430 1.790 1.00 54.33 C ATOM 1734 CG GLU A 114 -43.992 19.017 1.945 1.00 44.41 C ATOM 1735 CD GLU A 114 -44.425 18.937 3.396 1.00 52.21 C ATOM 1736 OE1 GLU A 114 -44.004 19.804 4.189 1.00 71.42 O ATOM 1737 OE2 GLU A 114 -45.185 18.006 3.736 1.00 73.01 O1- ATOM 0 H GLU A 114 -41.773 17.801 0.103 1.00 1.14 H new ATOM 0 HA GLU A 114 -43.029 20.318 -0.105 1.00 4.11 H new ATOM 0 HB2 GLU A 114 -41.899 18.602 2.097 1.00 54.33 H new ATOM 0 HB3 GLU A 114 -42.331 20.260 2.466 1.00 54.33 H new ATOM 0 HG2 GLU A 114 -44.626 19.731 1.419 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -44.143 18.047 1.471 1.00 44.41 H new ATOM 1744 N ASP A 115 -39.801 20.354 0.208 1.00 61.31 N ATOM 1745 CA ASP A 115 -38.619 21.208 0.216 1.00 32.24 C ATOM 1746 C ASP A 115 -38.537 22.033 -1.065 1.00 43.43 C ATOM 1747 O ASP A 115 -37.838 23.043 -1.121 1.00 43.12 O ATOM 1748 CB ASP A 115 -37.355 20.363 0.376 1.00 53.53 C ATOM 1749 CG ASP A 115 -36.121 21.208 0.629 1.00 13.43 C ATOM 1750 OD1 ASP A 115 -36.225 22.199 1.382 1.00 74.43 O ATOM 1751 OD2 ASP A 115 -35.053 20.878 0.074 1.00 32.32 O1- ATOM 0 H ASP A 115 -39.606 19.366 0.047 1.00 61.31 H new ATOM 0 HA ASP A 115 -38.699 21.891 1.062 1.00 32.24 H new ATOM 0 HB2 ASP A 115 -37.490 19.666 1.203 1.00 53.53 H new ATOM 0 HB3 ASP A 115 -37.205 19.766 -0.523 1.00 53.53 H new ATOM 1756 N GLY A 116 -39.255 21.592 -2.094 1.00 54.51 N ATOM 1757 CA GLY A 116 -39.249 22.301 -3.360 1.00 23.20 C ATOM 1758 C GLY A 116 -38.488 21.555 -4.438 1.00 2.22 C ATOM 1759 O GLY A 116 -38.077 22.143 -5.439 1.00 55.14 O ATOM 0 H GLY A 116 -39.840 20.757 -2.073 1.00 54.51 H new ATOM 0 HA2 GLY A 116 -40.276 22.460 -3.689 1.00 23.20 H new ATOM 0 HA3 GLY A 116 -38.803 23.286 -3.220 1.00 23.20 H new ATOM 1763 N ASP A 117 -38.298 20.255 -4.234 1.00 71.14 N ATOM 1764 CA ASP A 117 -37.581 19.427 -5.196 1.00 22.33 C ATOM 1765 C ASP A 117 -38.548 18.772 -6.177 1.00 23.13 C ATOM 1766 O ASP A 117 -39.433 18.016 -5.778 1.00 55.15 O ATOM 1767 CB ASP A 117 -36.767 18.354 -4.471 1.00 15.40 C ATOM 1768 CG ASP A 117 -35.565 17.898 -5.276 1.00 11.35 C ATOM 1769 OD1 ASP A 117 -35.752 17.481 -6.438 1.00 73.13 O ATOM 1770 OD2 ASP A 117 -34.438 17.956 -4.742 1.00 42.23 O1- ATOM 0 H ASP A 117 -38.631 19.753 -3.411 1.00 71.14 H new ATOM 0 HA ASP A 117 -36.903 20.070 -5.757 1.00 22.33 H new ATOM 0 HB2 ASP A 117 -36.431 18.744 -3.510 1.00 15.40 H new ATOM 0 HB3 ASP A 117 -37.407 17.497 -4.261 1.00 15.40 H new ATOM 1775 N GLU A 118 -38.373 19.070 -7.461 1.00 12.24 N ATOM 1776 CA GLU A 118 -39.232 18.510 -8.498 1.00 23.12 C ATOM 1777 C GLU A 118 -38.945 17.026 -8.701 1.00 62.43 C ATOM 1778 O GLU A 118 -37.787 16.606 -8.745 1.00 43.24 O ATOM 1779 CB GLU A 118 -39.036 19.264 -9.816 1.00 34.24 C ATOM 1780 CG GLU A 118 -39.820 18.675 -10.976 1.00 62.21 C ATOM 1781 CD GLU A 118 -40.072 19.684 -12.081 1.00 42.54 C ATOM 1782 OE1 GLU A 118 -40.655 20.749 -11.791 1.00 52.30 O ATOM 1783 OE2 GLU A 118 -39.683 19.406 -13.235 1.00 0.43 O1- ATOM 0 H GLU A 118 -37.645 19.695 -7.807 1.00 12.24 H new ATOM 0 HA GLU A 118 -40.267 18.620 -8.175 1.00 23.12 H new ATOM 0 HB2 GLU A 118 -39.333 20.303 -9.678 1.00 34.24 H new ATOM 0 HB3 GLU A 118 -37.976 19.267 -10.069 1.00 34.24 H new ATOM 0 HG2 GLU A 118 -39.275 17.824 -11.384 1.00 62.21 H new ATOM 0 HG3 GLU A 118 -40.774 18.296 -10.610 1.00 62.21 H new ATOM 1790 N LEU A 119 -40.005 16.235 -8.824 1.00 53.45 N ATOM 1791 CA LEU A 119 -39.868 14.796 -9.022 1.00 44.14 C ATOM 1792 C LEU A 119 -40.664 14.336 -10.239 1.00 13.41 C ATOM 1793 O LEU A 119 -41.599 15.000 -10.688 1.00 3.34 O ATOM 1794 CB LEU A 119 -40.338 14.043 -7.777 1.00 54.15 C ATOM 1795 CG LEU A 119 -39.323 13.929 -6.638 1.00 4.14 C ATOM 1796 CD1 LEU A 119 -40.033 13.744 -5.306 1.00 75.22 C ATOM 1797 CD2 LEU A 119 -38.360 12.780 -6.895 1.00 64.10 C ATOM 0 H LEU A 119 -40.969 16.566 -8.790 1.00 53.45 H new ATOM 0 HA LEU A 119 -38.814 14.577 -9.195 1.00 44.14 H new ATOM 0 HB2 LEU A 119 -41.231 14.537 -7.393 1.00 54.15 H new ATOM 0 HB3 LEU A 119 -40.634 13.037 -8.075 1.00 54.15 H new ATOM 0 HG LEU A 119 -38.749 14.855 -6.595 1.00 4.14 H new ATOM 0 HD11 LEU A 119 -39.295 13.665 -4.508 1.00 75.22 H new ATOM 0 HD12 LEU A 119 -40.681 14.600 -5.117 1.00 75.22 H new ATOM 0 HD13 LEU A 119 -40.633 12.834 -5.337 1.00 75.22 H new ATOM 0 HD21 LEU A 119 -37.645 12.714 -6.075 1.00 64.10 H new ATOM 0 HD22 LEU A 119 -38.918 11.846 -6.966 1.00 64.10 H new ATOM 0 HD23 LEU A 119 -37.826 12.955 -7.829 1.00 64.10 H new ATOM 1809 N PRO A 120 -40.288 13.171 -10.787 1.00 20.10 N ATOM 1810 CA PRO A 120 -40.956 12.594 -11.957 1.00 0.40 C ATOM 1811 C PRO A 120 -42.364 12.102 -11.639 1.00 11.03 C ATOM 1812 O PRO A 120 -42.758 11.986 -10.478 1.00 42.43 O ATOM 1813 CB PRO A 120 -40.052 11.419 -12.337 1.00 45.01 C ATOM 1814 CG PRO A 120 -39.363 11.045 -11.071 1.00 75.10 C ATOM 1815 CD PRO A 120 -39.182 12.326 -10.304 1.00 64.30 C ATOM 0 HA PRO A 120 -41.085 13.326 -12.754 1.00 0.40 H new ATOM 0 HB2 PRO A 120 -40.632 10.585 -12.733 1.00 45.01 H new ATOM 0 HB3 PRO A 120 -39.336 11.704 -13.108 1.00 45.01 H new ATOM 0 HG2 PRO A 120 -39.955 10.329 -10.501 1.00 75.10 H new ATOM 0 HG3 PRO A 120 -38.402 10.573 -11.275 1.00 75.10 H new ATOM 0 HD2 PRO A 120 -39.242 12.162 -9.228 1.00 64.30 H new ATOM 0 HD3 PRO A 120 -38.212 12.781 -10.504 1.00 64.30 H new ATOM 1823 N PRO A 121 -43.140 11.805 -12.691 1.00 13.45 N ATOM 1824 CA PRO A 121 -44.515 11.319 -12.547 1.00 63.41 C ATOM 1825 C PRO A 121 -44.575 9.905 -11.979 1.00 74.12 C ATOM 1826 O PRO A 121 -43.932 8.992 -12.494 1.00 70.11 O ATOM 1827 CB PRO A 121 -45.051 11.343 -13.981 1.00 51.31 C ATOM 1828 CG PRO A 121 -43.841 11.217 -14.839 1.00 10.41 C ATOM 1829 CD PRO A 121 -42.735 11.919 -14.101 1.00 53.13 C ATOM 0 HA PRO A 121 -45.092 11.928 -11.851 1.00 63.41 H new ATOM 0 HB2 PRO A 121 -45.748 10.524 -14.157 1.00 51.31 H new ATOM 0 HB3 PRO A 121 -45.588 12.269 -14.188 1.00 51.31 H new ATOM 0 HG2 PRO A 121 -43.592 10.170 -15.011 1.00 10.41 H new ATOM 0 HG3 PRO A 121 -44.007 11.670 -15.816 1.00 10.41 H new ATOM 0 HD2 PRO A 121 -41.769 11.447 -14.281 1.00 53.13 H new ATOM 0 HD3 PRO A 121 -42.644 12.960 -14.410 1.00 53.13 H new ATOM 1837 N GLY A 122 -45.353 9.732 -10.914 1.00 43.21 N ATOM 1838 CA GLY A 122 -45.482 8.427 -10.295 1.00 45.50 C ATOM 1839 C GLY A 122 -44.622 8.286 -9.055 1.00 61.31 C ATOM 1840 O GLY A 122 -44.586 7.224 -8.433 1.00 64.21 O ATOM 0 H GLY A 122 -45.896 10.473 -10.470 1.00 43.21 H new ATOM 0 HA2 GLY A 122 -46.526 8.255 -10.031 1.00 45.50 H new ATOM 0 HA3 GLY A 122 -45.204 7.658 -11.015 1.00 45.50 H new ATOM 1844 N VAL A 123 -43.925 9.358 -8.695 1.00 20.12 N ATOM 1845 CA VAL A 123 -43.060 9.350 -7.521 1.00 30.11 C ATOM 1846 C VAL A 123 -43.539 10.354 -6.478 1.00 42.43 C ATOM 1847 O VAL A 123 -44.015 11.436 -6.817 1.00 35.02 O ATOM 1848 CB VAL A 123 -41.602 9.672 -7.895 1.00 72.33 C ATOM 1849 CG1 VAL A 123 -40.730 9.727 -6.651 1.00 14.23 C ATOM 1850 CG2 VAL A 123 -41.068 8.648 -8.886 1.00 34.10 C ATOM 0 H VAL A 123 -43.942 10.244 -9.200 1.00 20.12 H new ATOM 0 HA VAL A 123 -43.106 8.345 -7.102 1.00 30.11 H new ATOM 0 HB VAL A 123 -41.576 10.653 -8.370 1.00 72.33 H new ATOM 0 HG11 VAL A 123 -39.703 9.956 -6.936 1.00 14.23 H new ATOM 0 HG12 VAL A 123 -41.101 10.502 -5.980 1.00 14.23 H new ATOM 0 HG13 VAL A 123 -40.759 8.763 -6.143 1.00 14.23 H new ATOM 0 HG21 VAL A 123 -40.036 8.891 -9.140 1.00 34.10 H new ATOM 0 HG22 VAL A 123 -41.108 7.654 -8.440 1.00 34.10 H new ATOM 0 HG23 VAL A 123 -41.677 8.664 -9.790 1.00 34.10 H new ATOM 1860 N ASN A 124 -43.408 9.987 -5.208 1.00 33.12 N ATOM 1861 CA ASN A 124 -43.828 10.856 -4.113 1.00 53.53 C ATOM 1862 C ASN A 124 -42.624 11.350 -3.319 1.00 53.12 C ATOM 1863 O ASN A 124 -42.597 12.492 -2.860 1.00 73.13 O ATOM 1864 CB ASN A 124 -44.795 10.115 -3.188 1.00 43.21 C ATOM 1865 CG ASN A 124 -46.145 9.875 -3.835 1.00 42.43 C ATOM 1866 OD1 ASN A 124 -46.456 10.447 -4.881 1.00 73.31 O ATOM 1867 ND2 ASN A 124 -46.956 9.026 -3.215 1.00 3.04 N ATOM 0 H ASN A 124 -43.015 9.094 -4.911 1.00 33.12 H new ATOM 0 HA ASN A 124 -44.337 11.719 -4.542 1.00 53.53 H new ATOM 0 HB2 ASN A 124 -44.358 9.159 -2.901 1.00 43.21 H new ATOM 0 HB3 ASN A 124 -44.931 10.691 -2.273 1.00 43.21 H new ATOM 0 HD21 ASN A 124 -47.878 8.825 -3.603 1.00 3.04 H new ATOM 0 HD22 ASN A 124 -46.657 8.575 -2.350 1.00 3.04 H new ATOM 1874 N GLN A 125 -41.630 10.482 -3.160 1.00 42.31 N ATOM 1875 CA GLN A 125 -40.423 10.830 -2.421 1.00 61.22 C ATOM 1876 C GLN A 125 -39.189 10.203 -3.064 1.00 32.52 C ATOM 1877 O GLN A 125 -39.302 9.323 -3.918 1.00 3.53 O ATOM 1878 CB GLN A 125 -40.540 10.372 -0.966 1.00 74.32 C ATOM 1879 CG GLN A 125 -41.335 11.328 -0.089 1.00 12.52 C ATOM 1880 CD GLN A 125 -42.609 10.706 0.446 1.00 12.21 C ATOM 1881 OE1 GLN A 125 -42.932 10.843 1.626 1.00 35.21 O ATOM 1882 NE2 GLN A 125 -43.342 10.017 -0.422 1.00 13.11 N ATOM 0 H GLN A 125 -41.637 9.533 -3.533 1.00 42.31 H new ATOM 0 HA GLN A 125 -40.313 11.914 -2.447 1.00 61.22 H new ATOM 0 HB2 GLN A 125 -41.012 9.390 -0.940 1.00 74.32 H new ATOM 0 HB3 GLN A 125 -39.540 10.256 -0.549 1.00 74.32 H new ATOM 0 HG2 GLN A 125 -40.714 11.650 0.747 1.00 12.52 H new ATOM 0 HG3 GLN A 125 -41.584 12.220 -0.664 1.00 12.52 H new ATOM 0 HE21 GLN A 125 -43.036 9.929 -1.391 1.00 13.11 H new ATOM 0 HE22 GLN A 125 -44.211 9.576 -0.119 1.00 13.11 H new ATOM 1891 N LEU A 126 -38.015 10.665 -2.651 1.00 13.13 N ATOM 1892 CA LEU A 126 -36.759 10.150 -3.187 1.00 42.24 C ATOM 1893 C LEU A 126 -35.693 10.073 -2.100 1.00 22.01 C ATOM 1894 O LEU A 126 -35.445 11.046 -1.388 1.00 4.43 O ATOM 1895 CB LEU A 126 -36.271 11.036 -4.335 1.00 14.10 C ATOM 1896 CG LEU A 126 -35.262 10.400 -5.291 1.00 62.41 C ATOM 1897 CD1 LEU A 126 -33.929 10.181 -4.594 1.00 34.22 C ATOM 1898 CD2 LEU A 126 -35.800 9.085 -5.839 1.00 54.24 C ATOM 0 H LEU A 126 -37.905 11.395 -1.947 1.00 13.13 H new ATOM 0 HA LEU A 126 -36.939 9.143 -3.564 1.00 42.24 H new ATOM 0 HB2 LEU A 126 -37.137 11.357 -4.914 1.00 14.10 H new ATOM 0 HB3 LEU A 126 -35.822 11.933 -3.909 1.00 14.10 H new ATOM 0 HG LEU A 126 -35.105 11.082 -6.126 1.00 62.41 H new ATOM 0 HD11 LEU A 126 -33.224 9.727 -5.291 1.00 34.22 H new ATOM 0 HD12 LEU A 126 -33.536 11.138 -4.252 1.00 34.22 H new ATOM 0 HD13 LEU A 126 -34.070 9.520 -3.739 1.00 34.22 H new ATOM 0 HD21 LEU A 126 -35.068 8.647 -6.518 1.00 54.24 H new ATOM 0 HD22 LEU A 126 -35.988 8.397 -5.015 1.00 54.24 H new ATOM 0 HD23 LEU A 126 -36.730 9.268 -6.378 1.00 54.24 H new ATOM 1910 N VAL A 127 -35.061 8.909 -1.978 1.00 20.53 N ATOM 1911 CA VAL A 127 -34.018 8.707 -0.980 1.00 45.13 C ATOM 1912 C VAL A 127 -32.952 7.741 -1.487 1.00 1.10 C ATOM 1913 O VAL A 127 -33.267 6.688 -2.040 1.00 14.25 O ATOM 1914 CB VAL A 127 -34.601 8.163 0.338 1.00 20.41 C ATOM 1915 CG1 VAL A 127 -35.354 6.864 0.094 1.00 10.03 C ATOM 1916 CG2 VAL A 127 -33.498 7.964 1.366 1.00 54.52 C ATOM 0 H VAL A 127 -35.254 8.092 -2.558 1.00 20.53 H new ATOM 0 HA VAL A 127 -33.564 9.681 -0.795 1.00 45.13 H new ATOM 0 HB VAL A 127 -35.306 8.895 0.732 1.00 20.41 H new ATOM 0 HG11 VAL A 127 -35.758 6.495 1.037 1.00 10.03 H new ATOM 0 HG12 VAL A 127 -36.170 7.043 -0.606 1.00 10.03 H new ATOM 0 HG13 VAL A 127 -34.674 6.122 -0.324 1.00 10.03 H new ATOM 0 HG21 VAL A 127 -33.928 7.579 2.291 1.00 54.52 H new ATOM 0 HG22 VAL A 127 -32.767 7.253 0.982 1.00 54.52 H new ATOM 0 HG23 VAL A 127 -33.008 8.917 1.563 1.00 54.52 H new ATOM 1926 N ARG A 128 -31.690 8.109 -1.295 1.00 4.20 N ATOM 1927 CA ARG A 128 -30.577 7.275 -1.734 1.00 61.44 C ATOM 1928 C ARG A 128 -29.681 6.902 -0.557 1.00 20.05 C ATOM 1929 O ARG A 128 -29.662 7.588 0.465 1.00 44.24 O ATOM 1930 CB ARG A 128 -29.757 8.003 -2.801 1.00 53.24 C ATOM 1931 CG ARG A 128 -30.579 8.457 -3.996 1.00 2.30 C ATOM 1932 CD ARG A 128 -29.980 9.693 -4.647 1.00 44.25 C ATOM 1933 NE ARG A 128 -28.602 9.473 -5.075 1.00 42.20 N ATOM 1934 CZ ARG A 128 -28.269 8.750 -6.138 1.00 12.20 C ATOM 1935 NH1 ARG A 128 -29.210 8.181 -6.878 1.00 23.30 N1+ ATOM 1936 NH2 ARG A 128 -26.992 8.595 -6.463 1.00 64.11 N ATOM 0 H ARG A 128 -31.412 8.978 -0.839 1.00 4.20 H new ATOM 0 HA ARG A 128 -30.987 6.360 -2.161 1.00 61.44 H new ATOM 0 HB2 ARG A 128 -29.278 8.872 -2.349 1.00 53.24 H new ATOM 0 HB3 ARG A 128 -28.961 7.344 -3.148 1.00 53.24 H new ATOM 0 HG2 ARG A 128 -30.636 7.651 -4.727 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -31.599 8.671 -3.677 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -30.585 9.979 -5.507 1.00 44.25 H new ATOM 0 HD3 ARG A 128 -30.013 10.525 -3.944 1.00 44.25 H new ATOM 0 HE ARG A 128 -27.854 9.898 -4.528 1.00 42.20 H new ATOM 0 HH11 ARG A 128 -30.193 8.298 -6.632 1.00 23.30 H new ATOM 0 HH12 ARG A 128 -28.951 7.626 -7.694 1.00 23.30 H new ATOM 0 HH21 ARG A 128 -26.265 9.031 -5.896 1.00 64.11 H new ATOM 0 HH22 ARG A 128 -26.737 8.039 -7.280 1.00 64.11 H new ATOM 1950 N VAL A 129 -28.939 5.807 -0.707 1.00 61.44 N ATOM 1951 CA VAL A 129 -28.041 5.342 0.342 1.00 71.52 C ATOM 1952 C VAL A 129 -26.587 5.416 -0.107 1.00 13.23 C ATOM 1953 O VAL A 129 -26.289 5.336 -1.300 1.00 34.03 O ATOM 1954 CB VAL A 129 -28.367 3.896 0.759 1.00 44.32 C ATOM 1955 CG1 VAL A 129 -27.586 3.511 2.007 1.00 3.32 C ATOM 1956 CG2 VAL A 129 -29.862 3.729 0.982 1.00 62.34 C ATOM 0 H VAL A 129 -28.943 5.227 -1.546 1.00 61.44 H new ATOM 0 HA VAL A 129 -28.186 6.000 1.199 1.00 71.52 H new ATOM 0 HB VAL A 129 -28.068 3.228 -0.048 1.00 44.32 H new ATOM 0 HG11 VAL A 129 -27.829 2.486 2.287 1.00 3.32 H new ATOM 0 HG12 VAL A 129 -26.518 3.588 1.806 1.00 3.32 H new ATOM 0 HG13 VAL A 129 -27.851 4.183 2.824 1.00 3.32 H new ATOM 0 HG21 VAL A 129 -30.073 2.701 1.276 1.00 62.34 H new ATOM 0 HG22 VAL A 129 -30.190 4.407 1.770 1.00 62.34 H new ATOM 0 HG23 VAL A 129 -30.395 3.960 0.060 1.00 62.34 H new ATOM 1966 N TYR A 130 -25.683 5.568 0.854 1.00 2.33 N ATOM 1967 CA TYR A 130 -24.257 5.654 0.557 1.00 2.11 C ATOM 1968 C TYR A 130 -23.474 4.605 1.339 1.00 50.21 C ATOM 1969 O TYR A 130 -23.380 4.670 2.566 1.00 35.14 O ATOM 1970 CB TYR A 130 -23.730 7.052 0.888 1.00 54.22 C ATOM 1971 CG TYR A 130 -24.225 8.124 -0.057 1.00 50.10 C ATOM 1972 CD1 TYR A 130 -25.575 8.443 -0.130 1.00 41.25 C ATOM 1973 CD2 TYR A 130 -23.343 8.818 -0.875 1.00 64.34 C ATOM 1974 CE1 TYR A 130 -26.033 9.421 -0.993 1.00 42.45 C ATOM 1975 CE2 TYR A 130 -23.790 9.800 -1.738 1.00 13.34 C ATOM 1976 CZ TYR A 130 -25.135 10.097 -1.793 1.00 23.14 C ATOM 1977 OH TYR A 130 -25.585 11.072 -2.653 1.00 43.15 O ATOM 0 H TYR A 130 -25.912 5.634 1.846 1.00 2.33 H new ATOM 0 HA TYR A 130 -24.121 5.464 -0.508 1.00 2.11 H new ATOM 0 HB2 TYR A 130 -24.025 7.311 1.905 1.00 54.22 H new ATOM 0 HB3 TYR A 130 -22.640 7.035 0.867 1.00 54.22 H new ATOM 0 HD1 TYR A 130 -26.279 7.918 0.498 1.00 41.25 H new ATOM 0 HD2 TYR A 130 -22.289 8.586 -0.836 1.00 64.34 H new ATOM 0 HE1 TYR A 130 -27.086 9.654 -1.041 1.00 42.45 H new ATOM 0 HE2 TYR A 130 -23.090 10.332 -2.366 1.00 13.34 H new ATOM 0 HH TYR A 130 -24.826 11.451 -3.143 1.00 43.15 H new ATOM 1987 N ILE A 131 -22.912 3.639 0.621 1.00 62.14 N ATOM 1988 CA ILE A 131 -22.135 2.576 1.246 1.00 14.52 C ATOM 1989 C ILE A 131 -20.701 2.566 0.727 1.00 32.22 C ATOM 1990 O ILE A 131 -20.465 2.649 -0.478 1.00 50.11 O ATOM 1991 CB ILE A 131 -22.769 1.195 0.999 1.00 53.44 C ATOM 1992 CG1 ILE A 131 -24.032 1.029 1.846 1.00 75.34 C ATOM 1993 CG2 ILE A 131 -21.769 0.090 1.307 1.00 74.22 C ATOM 1994 CD1 ILE A 131 -25.311 1.269 1.077 1.00 41.20 C ATOM 0 H ILE A 131 -22.980 3.570 -0.394 1.00 62.14 H new ATOM 0 HA ILE A 131 -22.130 2.777 2.317 1.00 14.52 H new ATOM 0 HB ILE A 131 -23.048 1.123 -0.052 1.00 53.44 H new ATOM 0 HG12 ILE A 131 -24.051 0.021 2.262 1.00 75.34 H new ATOM 0 HG13 ILE A 131 -23.989 1.720 2.688 1.00 75.34 H new ATOM 0 HG21 ILE A 131 -22.232 -0.880 1.128 1.00 74.22 H new ATOM 0 HG22 ILE A 131 -20.896 0.200 0.664 1.00 74.22 H new ATOM 0 HG23 ILE A 131 -21.462 0.158 2.351 1.00 74.22 H new ATOM 0 HD11 ILE A 131 -26.165 1.134 1.740 1.00 41.20 H new ATOM 0 HD12 ILE A 131 -25.314 2.286 0.684 1.00 41.20 H new ATOM 0 HD13 ILE A 131 -25.377 0.561 0.251 1.00 41.20 H new ATOM 2006 N VAL A 132 -19.746 2.460 1.646 1.00 41.23 N ATOM 2007 CA VAL A 132 -18.334 2.435 1.281 1.00 34.34 C ATOM 2008 C VAL A 132 -17.747 1.039 1.451 1.00 0.01 C ATOM 2009 O VAL A 132 -17.993 0.370 2.455 1.00 51.31 O ATOM 2010 CB VAL A 132 -17.518 3.430 2.129 1.00 61.21 C ATOM 2011 CG1 VAL A 132 -17.962 4.858 1.852 1.00 1.22 C ATOM 2012 CG2 VAL A 132 -17.647 3.100 3.609 1.00 73.24 C ATOM 0 H VAL A 132 -19.924 2.390 2.648 1.00 41.23 H new ATOM 0 HA VAL A 132 -18.273 2.726 0.232 1.00 34.34 H new ATOM 0 HB VAL A 132 -16.468 3.341 1.851 1.00 61.21 H new ATOM 0 HG11 VAL A 132 -17.375 5.546 2.460 1.00 1.22 H new ATOM 0 HG12 VAL A 132 -17.812 5.087 0.797 1.00 1.22 H new ATOM 0 HG13 VAL A 132 -19.018 4.965 2.100 1.00 1.22 H new ATOM 0 HG21 VAL A 132 -17.064 3.813 4.193 1.00 73.24 H new ATOM 0 HG22 VAL A 132 -18.694 3.159 3.905 1.00 73.24 H new ATOM 0 HG23 VAL A 132 -17.275 2.092 3.791 1.00 73.24 H new ATOM 2022 N GLN A 133 -16.970 0.605 0.464 1.00 42.41 N ATOM 2023 CA GLN A 133 -16.348 -0.712 0.505 1.00 12.41 C ATOM 2024 C GLN A 133 -15.082 -0.692 1.356 1.00 54.20 C ATOM 2025 O GLN A 133 -14.271 0.230 1.258 1.00 2.20 O ATOM 2026 CB GLN A 133 -16.017 -1.187 -0.911 1.00 71.20 C ATOM 2027 CG GLN A 133 -17.231 -1.658 -1.695 1.00 14.21 C ATOM 2028 CD GLN A 133 -18.193 -0.530 -2.012 1.00 65.31 C ATOM 2029 OE1 GLN A 133 -18.041 0.169 -3.015 1.00 73.53 O ATOM 2030 NE2 GLN A 133 -19.194 -0.347 -1.158 1.00 12.32 N ATOM 0 H GLN A 133 -16.757 1.147 -0.374 1.00 42.41 H new ATOM 0 HA GLN A 133 -17.056 -1.406 0.958 1.00 12.41 H new ATOM 0 HB2 GLN A 133 -15.537 -0.374 -1.455 1.00 71.20 H new ATOM 0 HB3 GLN A 133 -15.295 -2.001 -0.852 1.00 71.20 H new ATOM 0 HG2 GLN A 133 -16.901 -2.122 -2.625 1.00 14.21 H new ATOM 0 HG3 GLN A 133 -17.753 -2.426 -1.124 1.00 14.21 H new ATOM 0 HE21 GLN A 133 -19.283 -0.949 -0.339 1.00 12.32 H new ATOM 0 HE22 GLN A 133 -19.874 0.396 -1.321 1.00 12.32 H new ATOM 2039 N LYS A 134 -14.920 -1.712 2.191 1.00 12.52 N ATOM 2040 CA LYS A 134 -13.753 -1.812 3.060 1.00 43.01 C ATOM 2041 C LYS A 134 -12.533 -2.289 2.279 1.00 3.21 C ATOM 2042 O LYS A 134 -12.650 -3.105 1.364 1.00 43.24 O ATOM 2043 CB LYS A 134 -14.036 -2.770 4.220 1.00 4.32 C ATOM 2044 CG LYS A 134 -14.170 -4.221 3.792 1.00 31.52 C ATOM 2045 CD LYS A 134 -14.755 -5.077 4.902 1.00 15.52 C ATOM 2046 CE LYS A 134 -14.289 -6.522 4.795 1.00 55.02 C ATOM 2047 NZ LYS A 134 -14.869 -7.372 5.871 1.00 1.44 N1+ ATOM 0 H LYS A 134 -15.582 -2.482 2.285 1.00 12.52 H new ATOM 0 HA LYS A 134 -13.542 -0.820 3.459 1.00 43.01 H new ATOM 0 HB2 LYS A 134 -13.232 -2.689 4.952 1.00 4.32 H new ATOM 0 HB3 LYS A 134 -14.954 -2.461 4.720 1.00 4.32 H new ATOM 0 HG2 LYS A 134 -14.806 -4.284 2.909 1.00 31.52 H new ATOM 0 HG3 LYS A 134 -13.192 -4.610 3.508 1.00 31.52 H new ATOM 0 HD2 LYS A 134 -14.462 -4.670 5.870 1.00 15.52 H new ATOM 0 HD3 LYS A 134 -15.843 -5.040 4.856 1.00 15.52 H new ATOM 0 HE2 LYS A 134 -14.572 -6.924 3.822 1.00 55.02 H new ATOM 0 HE3 LYS A 134 -13.201 -6.558 4.850 1.00 55.02 H new ATOM 0 HZ1 LYS A 134 -14.528 -8.349 5.764 1.00 1.44 H new ATOM 0 HZ2 LYS A 134 -14.578 -7.004 6.799 1.00 1.44 H new ATOM 0 HZ3 LYS A 134 -15.907 -7.358 5.803 1.00 1.44 H new ATOM 2061 N ARG A 135 -11.363 -1.776 2.646 1.00 73.21 N ATOM 2062 CA ARG A 135 -10.122 -2.150 1.980 1.00 2.23 C ATOM 2063 C ARG A 135 -9.880 -3.653 2.085 1.00 4.34 C ATOM 2064 O ARG A 135 -10.435 -4.322 2.957 1.00 70.31 O ATOM 2065 CB ARG A 135 -8.943 -1.389 2.586 1.00 24.23 C ATOM 2066 CG ARG A 135 -8.770 -1.622 4.078 1.00 61.24 C ATOM 2067 CD ARG A 135 -7.368 -1.254 4.541 1.00 61.52 C ATOM 2068 NE ARG A 135 -7.246 0.172 4.832 1.00 65.45 N ATOM 2069 CZ ARG A 135 -6.082 0.804 4.930 1.00 44.11 C ATOM 2070 NH1 ARG A 135 -4.946 0.140 4.762 1.00 2.13 N1+ ATOM 2071 NH2 ARG A 135 -6.051 2.103 5.198 1.00 1.42 N ATOM 0 H ARG A 135 -11.249 -1.100 3.401 1.00 73.21 H new ATOM 0 HA ARG A 135 -10.211 -1.887 0.926 1.00 2.23 H new ATOM 0 HB2 ARG A 135 -8.028 -1.684 2.072 1.00 24.23 H new ATOM 0 HB3 ARG A 135 -9.079 -0.322 2.407 1.00 24.23 H new ATOM 0 HG2 ARG A 135 -9.503 -1.030 4.627 1.00 61.24 H new ATOM 0 HG3 ARG A 135 -8.968 -2.669 4.309 1.00 61.24 H new ATOM 0 HD2 ARG A 135 -7.118 -1.829 5.433 1.00 61.52 H new ATOM 0 HD3 ARG A 135 -6.648 -1.530 3.771 1.00 61.52 H new ATOM 0 HE ARG A 135 -8.101 0.712 4.967 1.00 65.45 H new ATOM 0 HH11 ARG A 135 -4.965 -0.859 4.557 1.00 2.13 H new ATOM 0 HH12 ARG A 135 -4.054 0.628 4.838 1.00 2.13 H new ATOM 0 HH21 ARG A 135 -6.922 2.618 5.329 1.00 1.42 H new ATOM 0 HH22 ARG A 135 -5.156 2.587 5.273 1.00 1.42 H new ATOM 2085 N LYS A 136 -9.047 -4.177 1.192 1.00 75.34 N ATOM 2086 CA LYS A 136 -8.730 -5.601 1.185 1.00 14.01 C ATOM 2087 C LYS A 136 -7.367 -5.857 1.820 1.00 71.32 C ATOM 2088 O LYS A 136 -6.509 -4.975 1.848 1.00 71.05 O ATOM 2089 CB LYS A 136 -8.747 -6.140 -0.247 1.00 52.34 C ATOM 2090 CG LYS A 136 -7.697 -5.512 -1.146 1.00 44.13 C ATOM 2091 CD LYS A 136 -7.423 -6.372 -2.368 1.00 43.40 C ATOM 2092 CE LYS A 136 -6.732 -5.578 -3.466 1.00 63.11 C ATOM 2093 NZ LYS A 136 -5.254 -5.553 -3.286 1.00 55.42 N1+ ATOM 0 H LYS A 136 -8.579 -3.637 0.464 1.00 75.34 H new ATOM 0 HA LYS A 136 -9.488 -6.121 1.771 1.00 14.01 H new ATOM 0 HB2 LYS A 136 -8.593 -7.219 -0.222 1.00 52.34 H new ATOM 0 HB3 LYS A 136 -9.733 -5.968 -0.679 1.00 52.34 H new ATOM 0 HG2 LYS A 136 -8.032 -4.524 -1.463 1.00 44.13 H new ATOM 0 HG3 LYS A 136 -6.773 -5.371 -0.585 1.00 44.13 H new ATOM 0 HD2 LYS A 136 -6.800 -7.221 -2.085 1.00 43.40 H new ATOM 0 HD3 LYS A 136 -8.361 -6.777 -2.746 1.00 43.40 H new ATOM 0 HE2 LYS A 136 -6.972 -6.014 -4.436 1.00 63.11 H new ATOM 0 HE3 LYS A 136 -7.114 -4.557 -3.472 1.00 63.11 H new ATOM 0 HZ1 LYS A 136 -4.820 -5.002 -4.054 1.00 55.42 H new ATOM 0 HZ2 LYS A 136 -5.023 -5.114 -2.372 1.00 55.42 H new ATOM 0 HZ3 LYS A 136 -4.885 -6.525 -3.306 1.00 55.42 H new ATOM 2107 N ILE A 137 -7.175 -7.071 2.326 1.00 30.52 N ATOM 2108 CA ILE A 137 -5.915 -7.442 2.958 1.00 4.50 C ATOM 2109 C ILE A 137 -5.401 -8.773 2.417 1.00 42.20 C ATOM 2110 O ILE A 137 -6.143 -9.528 1.788 1.00 34.34 O ATOM 2111 CB ILE A 137 -6.060 -7.546 4.487 1.00 24.31 C ATOM 2112 CG1 ILE A 137 -7.442 -8.092 4.853 1.00 34.43 C ATOM 2113 CG2 ILE A 137 -5.832 -6.188 5.134 1.00 52.43 C ATOM 2114 CD1 ILE A 137 -7.730 -9.455 4.265 1.00 4.14 C ATOM 0 H ILE A 137 -7.875 -7.813 2.311 1.00 30.52 H new ATOM 0 HA ILE A 137 -5.200 -6.654 2.722 1.00 4.50 H new ATOM 0 HB ILE A 137 -5.306 -8.237 4.863 1.00 24.31 H new ATOM 0 HG12 ILE A 137 -7.525 -8.149 5.938 1.00 34.43 H new ATOM 0 HG13 ILE A 137 -8.203 -7.390 4.511 1.00 34.43 H new ATOM 0 HG21 ILE A 137 -5.938 -6.278 6.215 1.00 52.43 H new ATOM 0 HG22 ILE A 137 -4.829 -5.835 4.896 1.00 52.43 H new ATOM 0 HG23 ILE A 137 -6.566 -5.477 4.755 1.00 52.43 H new ATOM 0 HD11 ILE A 137 -8.726 -9.778 4.566 1.00 4.14 H new ATOM 0 HD12 ILE A 137 -7.680 -9.400 3.178 1.00 4.14 H new ATOM 0 HD13 ILE A 137 -6.992 -10.171 4.627 1.00 4.14 H new ATOM 2126 N SER A 138 -4.126 -9.054 2.667 1.00 33.30 N ATOM 2127 CA SER A 138 -3.511 -10.291 2.203 1.00 12.12 C ATOM 2128 C SER A 138 -3.360 -11.286 3.350 1.00 23.35 C ATOM 2129 O SER A 138 -3.328 -10.901 4.518 1.00 14.03 O ATOM 2130 CB SER A 138 -2.144 -10.004 1.578 1.00 33.30 C ATOM 2131 OG SER A 138 -1.763 -11.038 0.687 1.00 33.15 O ATOM 0 H SER A 138 -3.499 -8.441 3.188 1.00 33.30 H new ATOM 0 HA SER A 138 -4.162 -10.730 1.447 1.00 12.12 H new ATOM 0 HB2 SER A 138 -2.177 -9.054 1.045 1.00 33.30 H new ATOM 0 HB3 SER A 138 -1.395 -9.903 2.364 1.00 33.30 H new ATOM 0 HG SER A 138 -0.887 -10.830 0.300 1.00 33.15 H new ATOM 2137 N GLU A 139 -3.266 -12.567 3.006 1.00 73.41 N ATOM 2138 CA GLU A 139 -3.119 -13.617 4.006 1.00 32.15 C ATOM 2139 C GLU A 139 -1.718 -14.219 3.962 1.00 5.54 C ATOM 2140 O GLU A 139 -1.081 -14.416 4.997 1.00 63.51 O ATOM 2141 CB GLU A 139 -4.164 -14.713 3.786 1.00 31.35 C ATOM 2142 CG GLU A 139 -5.577 -14.181 3.620 1.00 73.33 C ATOM 2143 CD GLU A 139 -6.593 -15.285 3.395 1.00 40.35 C ATOM 2144 OE1 GLU A 139 -6.701 -15.767 2.249 1.00 55.44 O ATOM 2145 OE2 GLU A 139 -7.278 -15.667 4.367 1.00 25.42 O1- ATOM 0 H GLU A 139 -3.289 -12.902 2.043 1.00 73.41 H new ATOM 0 HA GLU A 139 -3.273 -13.170 4.988 1.00 32.15 H new ATOM 0 HB2 GLU A 139 -3.895 -15.288 2.900 1.00 31.35 H new ATOM 0 HB3 GLU A 139 -4.141 -15.401 4.631 1.00 31.35 H new ATOM 0 HG2 GLU A 139 -5.854 -13.613 4.508 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -5.604 -13.490 2.778 1.00 73.33 H new ATOM 2152 N GLY A 140 -1.242 -14.509 2.755 1.00 65.11 N ATOM 2153 CA GLY A 140 0.080 -15.086 2.597 1.00 41.24 C ATOM 2154 C GLY A 140 0.046 -16.599 2.512 1.00 43.02 C ATOM 2155 O GLY A 140 1.086 -17.254 2.582 1.00 23.34 O ATOM 0 H GLY A 140 -1.749 -14.354 1.883 1.00 65.11 H new ATOM 0 HA2 GLY A 140 0.543 -14.685 1.695 1.00 41.24 H new ATOM 0 HA3 GLY A 140 0.707 -14.786 3.437 1.00 41.24 H new ATOM 2159 N ASP A 141 -1.151 -17.154 2.361 1.00 63.32 N ATOM 2160 CA ASP A 141 -1.316 -18.600 2.267 1.00 33.42 C ATOM 2161 C ASP A 141 -0.842 -19.113 0.910 1.00 14.14 C ATOM 2162 O ASP A 141 -1.609 -19.148 -0.053 1.00 20.30 O ATOM 2163 CB ASP A 141 -2.780 -18.983 2.488 1.00 74.13 C ATOM 2164 CG ASP A 141 -3.116 -19.165 3.955 1.00 34.21 C ATOM 2165 OD1 ASP A 141 -2.232 -19.614 4.713 1.00 41.30 O ATOM 2166 OD2 ASP A 141 -4.263 -18.861 4.344 1.00 23.22 O1- ATOM 0 H ASP A 141 -2.021 -16.625 2.301 1.00 63.32 H new ATOM 0 HA ASP A 141 -0.707 -19.062 3.044 1.00 33.42 H new ATOM 0 HB2 ASP A 141 -3.422 -18.211 2.064 1.00 74.13 H new ATOM 0 HB3 ASP A 141 -2.996 -19.907 1.952 1.00 74.13 H new TER 2171 ASP A 141