USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 785 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 THR OG1 : rot -73:sc= 2.42 USER MOD Set 1.2: A 47 THR OG1 : rot 13:sc= 0.984 USER MOD Set 2.1: A 26 HIS : no HD1:sc= 0.133 X(o=0.45,f=0.17) USER MOD Set 2.2: A 71 SER OG : rot -68:sc= 0.313 USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0436 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 116:sc= -3.73! USER MOD Single : A 17 LYS NZ :NH3+ -99:sc= -0.312 (180deg=-1.84!) USER MOD Single : A 19 GLN : amide:sc= -1.56 X(o=-1.6,f=-1.9) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -4.96! C(o=-5!,f=-7!) USER MOD Single : A 32 LYS NZ :NH3+ -120:sc= -0.33 (180deg=-1.86!) USER MOD Single : A 33 LYS NZ :NH3+ -155:sc= 0.128 (180deg=-0.341) USER MOD Single : A 41 GLN : amide:sc= -2.28! C(o=-2.3!,f=-4.6!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 49 GLN : amide:sc= -0.136 K(o=-0.14,f=-0.84) USER MOD Single : A 51 LYS NZ :NH3+ 152:sc= 0.742 (180deg=-0.22) USER MOD Single : A 53 GLN : amide:sc= -0.0761 K(o=-0.076,f=-0.61) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 MET CE :methyl -111:sc= -2.15 (180deg=-7.25!) USER MOD Single : A 63 GLN : amide:sc= -0.747 K(o=-0.75,f=-0.14) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 100:sc= -3.27! USER MOD Single : A 75 HIS : no HD1:sc= -0.286 X(o=-0.29,f=-0.74) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ -119:sc= -0.0356 (180deg=-0.912) USER MOD Single : A 92 TYR OH : rot 54:sc= 1.09 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc=-0.00894 X(o=-0.0089,f=-0.31) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 4.473 -7.111 -9.435 1.00 42.10 N ATOM 41 CA ASN A 5 5.070 -8.390 -9.068 1.00 44.20 C ATOM 42 C ASN A 5 4.988 -9.381 -10.225 1.00 43.43 C ATOM 43 O ASN A 5 4.448 -10.478 -10.081 1.00 51.24 O ATOM 44 CB ASN A 5 4.371 -8.968 -7.836 1.00 60.12 C ATOM 45 CG ASN A 5 4.411 -8.022 -6.651 1.00 60.44 C ATOM 46 OD1 ASN A 5 3.383 -7.489 -6.233 1.00 60.35 O ATOM 47 ND2 ASN A 5 5.602 -7.810 -6.104 1.00 42.23 N ATOM 0 HA ASN A 5 6.121 -8.218 -8.834 1.00 44.20 H new ATOM 0 HB2 ASN A 5 3.333 -9.193 -8.083 1.00 60.12 H new ATOM 0 HB3 ASN A 5 4.845 -9.910 -7.561 1.00 60.12 H new ATOM 0 HD21 ASN A 5 5.692 -7.184 -5.304 1.00 42.23 H new ATOM 0 HD22 ASN A 5 6.427 -8.274 -6.484 1.00 42.23 H new ATOM 54 N THR A 6 5.529 -8.986 -11.374 1.00 71.52 N ATOM 55 CA THR A 6 5.517 -9.838 -12.557 1.00 33.44 C ATOM 56 C THR A 6 6.780 -9.643 -13.388 1.00 35.42 C ATOM 57 O THR A 6 7.044 -8.549 -13.887 1.00 10.45 O ATOM 58 CB THR A 6 4.286 -9.557 -13.439 1.00 41.13 C ATOM 59 OG1 THR A 6 3.150 -9.268 -12.618 1.00 35.24 O ATOM 60 CG2 THR A 6 3.980 -10.746 -14.337 1.00 24.41 C ATOM 0 H THR A 6 5.981 -8.082 -11.510 1.00 71.52 H new ATOM 0 HA THR A 6 5.474 -10.868 -12.204 1.00 33.44 H new ATOM 0 HB THR A 6 4.507 -8.695 -14.068 1.00 41.13 H new ATOM 0 HG1 THR A 6 2.372 -9.089 -13.187 1.00 35.24 H new ATOM 0 HG21 THR A 6 3.107 -10.524 -14.950 1.00 24.41 H new ATOM 0 HG22 THR A 6 4.836 -10.944 -14.982 1.00 24.41 H new ATOM 0 HG23 THR A 6 3.778 -11.623 -13.723 1.00 24.41 H new ATOM 68 N LEU A 7 7.556 -10.711 -13.534 1.00 44.13 N ATOM 69 CA LEU A 7 8.793 -10.657 -14.307 1.00 33.31 C ATOM 70 C LEU A 7 8.624 -11.353 -15.654 1.00 33.13 C ATOM 71 O LEU A 7 7.845 -12.299 -15.781 1.00 44.35 O ATOM 72 CB LEU A 7 9.935 -11.307 -13.524 1.00 60.11 C ATOM 73 CG LEU A 7 10.341 -10.609 -12.226 1.00 21.24 C ATOM 74 CD1 LEU A 7 10.881 -11.618 -11.224 1.00 13.14 C ATOM 75 CD2 LEU A 7 11.373 -9.526 -12.503 1.00 11.42 C ATOM 0 H LEU A 7 7.351 -11.624 -13.128 1.00 44.13 H new ATOM 0 HA LEU A 7 9.034 -9.610 -14.488 1.00 33.31 H new ATOM 0 HB2 LEU A 7 9.650 -12.332 -13.288 1.00 60.11 H new ATOM 0 HB3 LEU A 7 10.809 -11.361 -14.173 1.00 60.11 H new ATOM 0 HG LEU A 7 9.456 -10.139 -11.797 1.00 21.24 H new ATOM 0 HD11 LEU A 7 11.165 -11.103 -10.306 1.00 13.14 H new ATOM 0 HD12 LEU A 7 10.112 -12.358 -11.002 1.00 13.14 H new ATOM 0 HD13 LEU A 7 11.754 -12.117 -11.645 1.00 13.14 H new ATOM 0 HD21 LEU A 7 11.650 -9.040 -11.568 1.00 11.42 H new ATOM 0 HD22 LEU A 7 12.258 -9.974 -12.955 1.00 11.42 H new ATOM 0 HD23 LEU A 7 10.951 -8.787 -13.185 1.00 11.42 H new ATOM 87 N ILE A 8 9.359 -10.880 -16.654 1.00 72.14 N ATOM 88 CA ILE A 8 9.292 -11.459 -17.990 1.00 64.14 C ATOM 89 C ILE A 8 10.623 -11.311 -18.720 1.00 61.33 C ATOM 90 O ILE A 8 11.597 -10.806 -18.162 1.00 34.05 O ATOM 91 CB ILE A 8 8.182 -10.804 -18.833 1.00 60.42 C ATOM 92 CG1 ILE A 8 8.425 -9.299 -18.955 1.00 41.35 C ATOM 93 CG2 ILE A 8 6.818 -11.078 -18.217 1.00 23.02 C ATOM 94 CD1 ILE A 8 7.665 -8.654 -20.093 1.00 71.45 C ATOM 0 H ILE A 8 10.008 -10.098 -16.565 1.00 72.14 H new ATOM 0 HA ILE A 8 9.064 -12.517 -17.864 1.00 64.14 H new ATOM 0 HB ILE A 8 8.201 -11.238 -19.833 1.00 60.42 H new ATOM 0 HG12 ILE A 8 8.141 -8.816 -18.020 1.00 41.35 H new ATOM 0 HG13 ILE A 8 9.491 -9.122 -19.094 1.00 41.35 H new ATOM 0 HG21 ILE A 8 6.044 -10.609 -18.824 1.00 23.02 H new ATOM 0 HG22 ILE A 8 6.646 -12.154 -18.178 1.00 23.02 H new ATOM 0 HG23 ILE A 8 6.786 -10.668 -17.207 1.00 23.02 H new ATOM 0 HD11 ILE A 8 7.885 -7.587 -20.119 1.00 71.45 H new ATOM 0 HD12 ILE A 8 7.966 -9.110 -21.036 1.00 71.45 H new ATOM 0 HD13 ILE A 8 6.595 -8.800 -19.945 1.00 71.45 H new ATOM 106 N SER A 9 10.657 -11.754 -19.973 1.00 61.21 N ATOM 107 CA SER A 9 11.869 -11.673 -20.780 1.00 20.20 C ATOM 108 C SER A 9 11.535 -11.711 -22.268 1.00 75.50 C ATOM 109 O SER A 9 11.009 -12.704 -22.773 1.00 11.33 O ATOM 110 CB SER A 9 12.818 -12.821 -20.429 1.00 41.33 C ATOM 111 OG SER A 9 12.099 -14.004 -20.130 1.00 74.45 O ATOM 0 H SER A 9 9.859 -12.173 -20.451 1.00 61.21 H new ATOM 0 HA SER A 9 12.360 -10.725 -20.560 1.00 20.20 H new ATOM 0 HB2 SER A 9 13.496 -13.005 -21.263 1.00 41.33 H new ATOM 0 HB3 SER A 9 13.433 -12.540 -19.574 1.00 41.33 H new ATOM 0 HG SER A 9 12.728 -14.723 -19.911 1.00 74.45 H new ATOM 117 N VAL A 10 11.843 -10.623 -22.966 1.00 4.02 N ATOM 118 CA VAL A 10 11.577 -10.531 -24.396 1.00 43.23 C ATOM 119 C VAL A 10 12.825 -10.104 -25.161 1.00 62.00 C ATOM 120 O VAL A 10 13.541 -9.193 -24.743 1.00 74.42 O ATOM 121 CB VAL A 10 10.441 -9.534 -24.693 1.00 31.32 C ATOM 122 CG1 VAL A 10 10.854 -8.123 -24.305 1.00 14.34 C ATOM 123 CG2 VAL A 10 10.046 -9.599 -26.160 1.00 51.44 C ATOM 0 H VAL A 10 12.277 -9.792 -22.564 1.00 4.02 H new ATOM 0 HA VAL A 10 11.274 -11.525 -24.726 1.00 43.23 H new ATOM 0 HB VAL A 10 9.573 -9.810 -24.094 1.00 31.32 H new ATOM 0 HG11 VAL A 10 10.039 -7.433 -24.522 1.00 14.34 H new ATOM 0 HG12 VAL A 10 11.083 -8.091 -23.240 1.00 14.34 H new ATOM 0 HG13 VAL A 10 11.737 -7.833 -24.875 1.00 14.34 H new ATOM 0 HG21 VAL A 10 9.242 -8.888 -26.352 1.00 51.44 H new ATOM 0 HG22 VAL A 10 10.907 -9.350 -26.780 1.00 51.44 H new ATOM 0 HG23 VAL A 10 9.705 -10.606 -26.401 1.00 51.44 H new ATOM 133 N ASP A 11 13.080 -10.767 -26.283 1.00 62.43 N ATOM 134 CA ASP A 11 14.241 -10.456 -27.109 1.00 5.14 C ATOM 135 C ASP A 11 13.816 -10.067 -28.521 1.00 11.11 C ATOM 136 O ASP A 11 12.888 -10.649 -29.083 1.00 12.10 O ATOM 137 CB ASP A 11 15.193 -11.653 -27.161 1.00 14.44 C ATOM 138 CG ASP A 11 14.722 -12.725 -28.123 1.00 35.11 C ATOM 139 OD1 ASP A 11 13.558 -13.161 -28.002 1.00 14.42 O ATOM 140 OD2 ASP A 11 15.517 -13.130 -28.997 1.00 1.23 O ATOM 0 H ASP A 11 12.498 -11.524 -26.642 1.00 62.43 H new ATOM 0 HA ASP A 11 14.759 -9.609 -26.659 1.00 5.14 H new ATOM 0 HB2 ASP A 11 16.185 -11.312 -27.458 1.00 14.44 H new ATOM 0 HB3 ASP A 11 15.289 -12.081 -26.163 1.00 14.44 H new ATOM 145 N TYR A 12 14.499 -9.079 -29.088 1.00 63.21 N ATOM 146 CA TYR A 12 14.190 -8.610 -30.433 1.00 51.34 C ATOM 147 C TYR A 12 15.357 -7.819 -31.016 1.00 51.33 C ATOM 148 O TYR A 12 16.301 -7.472 -30.307 1.00 53.41 O ATOM 149 CB TYR A 12 12.930 -7.743 -30.417 1.00 34.05 C ATOM 150 CG TYR A 12 12.952 -6.662 -29.360 1.00 5.22 C ATOM 151 CD1 TYR A 12 13.860 -5.612 -29.432 1.00 22.24 C ATOM 152 CD2 TYR A 12 12.067 -6.690 -28.289 1.00 63.23 C ATOM 153 CE1 TYR A 12 13.885 -4.622 -28.468 1.00 64.51 C ATOM 154 CE2 TYR A 12 12.084 -5.704 -27.322 1.00 43.02 C ATOM 155 CZ TYR A 12 12.995 -4.672 -27.416 1.00 21.53 C ATOM 156 OH TYR A 12 13.016 -3.689 -26.454 1.00 2.15 O ATOM 0 H TYR A 12 15.270 -8.587 -28.637 1.00 63.21 H new ATOM 0 HA TYR A 12 14.015 -9.482 -31.063 1.00 51.34 H new ATOM 0 HB2 TYR A 12 12.805 -7.280 -31.396 1.00 34.05 H new ATOM 0 HB3 TYR A 12 12.062 -8.382 -30.254 1.00 34.05 H new ATOM 0 HD1 TYR A 12 14.558 -5.569 -30.255 1.00 22.24 H new ATOM 0 HD2 TYR A 12 11.353 -7.497 -28.211 1.00 63.23 H new ATOM 0 HE1 TYR A 12 14.598 -3.814 -28.538 1.00 64.51 H new ATOM 0 HE2 TYR A 12 11.388 -5.741 -26.497 1.00 43.02 H new ATOM 0 HH TYR A 12 12.170 -3.194 -26.473 1.00 2.15 H new ATOM 166 N GLU A 13 15.283 -7.537 -32.313 1.00 64.25 N ATOM 167 CA GLU A 13 16.334 -6.787 -32.992 1.00 74.34 C ATOM 168 C GLU A 13 15.777 -5.506 -33.607 1.00 72.42 C ATOM 169 O GLU A 13 15.405 -5.479 -34.781 1.00 22.42 O ATOM 170 CB GLU A 13 16.984 -7.647 -34.079 1.00 12.43 C ATOM 171 CG GLU A 13 15.983 -8.388 -34.949 1.00 12.30 C ATOM 172 CD GLU A 13 16.649 -9.334 -35.929 1.00 5.32 C ATOM 173 OE1 GLU A 13 17.527 -8.876 -36.690 1.00 64.13 O ATOM 174 OE2 GLU A 13 16.294 -10.531 -35.935 1.00 14.54 O ATOM 0 H GLU A 13 14.508 -7.816 -32.914 1.00 64.25 H new ATOM 0 HA GLU A 13 17.088 -6.517 -32.253 1.00 74.34 H new ATOM 0 HB2 GLU A 13 17.602 -7.011 -34.712 1.00 12.43 H new ATOM 0 HB3 GLU A 13 17.649 -8.371 -33.608 1.00 12.43 H new ATOM 0 HG2 GLU A 13 15.301 -8.952 -34.312 1.00 12.30 H new ATOM 0 HG3 GLU A 13 15.381 -7.665 -35.500 1.00 12.30 H new ATOM 181 N ILE A 14 15.722 -4.448 -32.806 1.00 1.11 N ATOM 182 CA ILE A 14 15.212 -3.164 -33.271 1.00 34.13 C ATOM 183 C ILE A 14 15.900 -2.733 -34.561 1.00 71.54 C ATOM 184 O ILE A 14 17.091 -2.978 -34.754 1.00 2.12 O ATOM 185 CB ILE A 14 15.402 -2.065 -32.209 1.00 40.21 C ATOM 186 CG1 ILE A 14 14.680 -2.445 -30.915 1.00 25.05 C ATOM 187 CG2 ILE A 14 14.894 -0.730 -32.732 1.00 43.53 C ATOM 188 CD1 ILE A 14 13.206 -2.727 -31.105 1.00 5.34 C ATOM 0 H ILE A 14 16.024 -4.454 -31.832 1.00 1.11 H new ATOM 0 HA ILE A 14 14.146 -3.297 -33.458 1.00 34.13 H new ATOM 0 HB ILE A 14 16.466 -1.968 -31.994 1.00 40.21 H new ATOM 0 HG12 ILE A 14 15.158 -3.326 -30.487 1.00 25.05 H new ATOM 0 HG13 ILE A 14 14.797 -1.637 -30.193 1.00 25.05 H new ATOM 0 HG21 ILE A 14 15.035 0.037 -31.970 1.00 43.53 H new ATOM 0 HG22 ILE A 14 15.448 -0.456 -33.630 1.00 43.53 H new ATOM 0 HG23 ILE A 14 13.834 -0.813 -32.972 1.00 43.53 H new ATOM 0 HD11 ILE A 14 12.759 -2.990 -30.146 1.00 5.34 H new ATOM 0 HD12 ILE A 14 12.714 -1.840 -31.503 1.00 5.34 H new ATOM 0 HD13 ILE A 14 13.081 -3.555 -31.803 1.00 5.34 H new ATOM 200 N PHE A 15 15.142 -2.089 -35.443 1.00 64.41 N ATOM 201 CA PHE A 15 15.679 -1.623 -36.716 1.00 64.12 C ATOM 202 C PHE A 15 16.186 -0.188 -36.600 1.00 75.21 C ATOM 203 O PHE A 15 16.285 0.360 -35.503 1.00 60.22 O ATOM 204 CB PHE A 15 14.611 -1.712 -37.808 1.00 21.32 C ATOM 205 CG PHE A 15 13.812 -2.983 -37.762 1.00 62.44 C ATOM 206 CD1 PHE A 15 14.428 -4.195 -37.491 1.00 15.45 C ATOM 207 CD2 PHE A 15 12.446 -2.967 -37.992 1.00 52.00 C ATOM 208 CE1 PHE A 15 13.695 -5.366 -37.448 1.00 23.25 C ATOM 209 CE2 PHE A 15 11.708 -4.135 -37.950 1.00 24.11 C ATOM 210 CZ PHE A 15 12.334 -5.336 -37.679 1.00 30.34 C ATOM 0 H PHE A 15 14.154 -1.878 -35.299 1.00 64.41 H new ATOM 0 HA PHE A 15 16.518 -2.265 -36.985 1.00 64.12 H new ATOM 0 HB2 PHE A 15 13.934 -0.863 -37.713 1.00 21.32 H new ATOM 0 HB3 PHE A 15 15.092 -1.629 -38.783 1.00 21.32 H new ATOM 0 HD1 PHE A 15 15.493 -4.225 -37.311 1.00 15.45 H new ATOM 0 HD2 PHE A 15 11.952 -2.031 -38.207 1.00 52.00 H new ATOM 0 HE1 PHE A 15 14.186 -6.304 -37.234 1.00 23.25 H new ATOM 0 HE2 PHE A 15 10.643 -4.109 -38.129 1.00 24.11 H new ATOM 0 HZ PHE A 15 11.760 -6.250 -37.648 1.00 30.34 H new ATOM 220 N GLY A 16 16.505 0.415 -37.741 1.00 71.45 N ATOM 221 CA GLY A 16 16.998 1.780 -37.747 1.00 34.41 C ATOM 222 C GLY A 16 18.468 1.864 -38.105 1.00 61.20 C ATOM 223 O GLY A 16 19.138 0.842 -38.255 1.00 62.10 O ATOM 0 H GLY A 16 16.431 -0.018 -38.662 1.00 71.45 H new ATOM 0 HA2 GLY A 16 16.420 2.369 -38.459 1.00 34.41 H new ATOM 0 HA3 GLY A 16 16.841 2.224 -36.764 1.00 34.41 H new ATOM 227 N LYS A 17 18.972 3.085 -38.245 1.00 4.25 N ATOM 228 CA LYS A 17 20.373 3.301 -38.588 1.00 70.50 C ATOM 229 C LYS A 17 21.267 3.119 -37.366 1.00 21.14 C ATOM 230 O LYS A 17 21.984 4.037 -36.966 1.00 74.12 O ATOM 231 CB LYS A 17 20.567 4.702 -39.171 1.00 53.11 C ATOM 232 CG LYS A 17 20.020 5.810 -38.287 1.00 22.41 C ATOM 233 CD LYS A 17 20.390 7.183 -38.821 1.00 51.20 C ATOM 234 CE LYS A 17 21.800 7.580 -38.411 1.00 31.30 C ATOM 235 NZ LYS A 17 22.815 7.120 -39.399 1.00 52.43 N ATOM 0 H LYS A 17 18.431 3.941 -38.126 1.00 4.25 H new ATOM 0 HA LYS A 17 20.656 2.561 -39.336 1.00 70.50 H new ATOM 0 HB2 LYS A 17 21.631 4.873 -39.337 1.00 53.11 H new ATOM 0 HB3 LYS A 17 20.080 4.752 -40.145 1.00 53.11 H new ATOM 0 HG2 LYS A 17 18.935 5.724 -38.223 1.00 22.41 H new ATOM 0 HG3 LYS A 17 20.409 5.695 -37.275 1.00 22.41 H new ATOM 0 HD2 LYS A 17 20.312 7.185 -39.908 1.00 51.20 H new ATOM 0 HD3 LYS A 17 19.680 7.922 -38.450 1.00 51.20 H new ATOM 0 HE2 LYS A 17 21.857 8.664 -38.309 1.00 31.30 H new ATOM 0 HE3 LYS A 17 22.027 7.156 -37.433 1.00 31.30 H new ATOM 0 HZ1 LYS A 17 23.257 6.242 -39.060 1.00 52.43 H new ATOM 0 HZ2 LYS A 17 22.354 6.944 -40.314 1.00 52.43 H new ATOM 0 HZ3 LYS A 17 23.545 7.852 -39.514 1.00 52.43 H new ATOM 249 N VAL A 18 21.221 1.928 -36.776 1.00 43.41 N ATOM 250 CA VAL A 18 22.029 1.626 -35.601 1.00 22.32 C ATOM 251 C VAL A 18 23.343 0.959 -35.994 1.00 11.33 C ATOM 252 O VAL A 18 23.812 0.044 -35.318 1.00 33.12 O ATOM 253 CB VAL A 18 21.274 0.708 -34.621 1.00 74.04 C ATOM 254 CG1 VAL A 18 20.017 1.395 -34.107 1.00 65.42 C ATOM 255 CG2 VAL A 18 20.932 -0.616 -35.288 1.00 65.11 C ATOM 0 H VAL A 18 20.633 1.157 -37.093 1.00 43.41 H new ATOM 0 HA VAL A 18 22.239 2.576 -35.109 1.00 22.32 H new ATOM 0 HB VAL A 18 21.922 0.503 -33.769 1.00 74.04 H new ATOM 0 HG11 VAL A 18 19.497 0.732 -33.416 1.00 65.42 H new ATOM 0 HG12 VAL A 18 20.291 2.315 -33.590 1.00 65.42 H new ATOM 0 HG13 VAL A 18 19.362 1.631 -34.946 1.00 65.42 H new ATOM 0 HG21 VAL A 18 20.399 -1.252 -34.582 1.00 65.11 H new ATOM 0 HG22 VAL A 18 20.302 -0.433 -36.158 1.00 65.11 H new ATOM 0 HG23 VAL A 18 21.850 -1.113 -35.603 1.00 65.11 H new ATOM 265 N GLN A 19 23.932 1.425 -37.090 1.00 52.52 N ATOM 266 CA GLN A 19 25.192 0.874 -37.573 1.00 62.12 C ATOM 267 C GLN A 19 26.247 1.967 -37.711 1.00 61.45 C ATOM 268 O GLN A 19 25.923 3.130 -37.945 1.00 42.12 O ATOM 269 CB GLN A 19 24.985 0.175 -38.918 1.00 43.11 C ATOM 270 CG GLN A 19 23.941 -0.929 -38.876 1.00 1.12 C ATOM 271 CD GLN A 19 23.257 -1.137 -40.213 1.00 2.23 C ATOM 272 OE1 GLN A 19 23.723 -1.913 -41.047 1.00 72.41 O ATOM 273 NE2 GLN A 19 22.145 -0.442 -40.424 1.00 23.25 N ATOM 0 H GLN A 19 23.557 2.183 -37.660 1.00 52.52 H new ATOM 0 HA GLN A 19 25.544 0.145 -36.843 1.00 62.12 H new ATOM 0 HB2 GLN A 19 24.689 0.916 -39.661 1.00 43.11 H new ATOM 0 HB3 GLN A 19 25.934 -0.246 -39.249 1.00 43.11 H new ATOM 0 HG2 GLN A 19 24.415 -1.860 -38.566 1.00 1.12 H new ATOM 0 HG3 GLN A 19 23.192 -0.687 -38.123 1.00 1.12 H new ATOM 0 HE21 GLN A 19 21.794 0.190 -39.704 1.00 23.25 H new ATOM 0 HE22 GLN A 19 21.642 -0.541 -41.306 1.00 23.25 H new ATOM 282 N GLY A 20 27.512 1.583 -37.565 1.00 11.41 N ATOM 283 CA GLY A 20 28.595 2.543 -37.676 1.00 63.42 C ATOM 284 C GLY A 20 28.406 3.740 -36.766 1.00 33.42 C ATOM 285 O GLY A 20 28.901 4.830 -37.051 1.00 11.13 O ATOM 0 H GLY A 20 27.806 0.625 -37.372 1.00 11.41 H new ATOM 0 HA2 GLY A 20 29.538 2.052 -37.434 1.00 63.42 H new ATOM 0 HA3 GLY A 20 28.669 2.884 -38.709 1.00 63.42 H new ATOM 289 N VAL A 21 27.685 3.537 -35.667 1.00 40.53 N ATOM 290 CA VAL A 21 27.430 4.609 -34.712 1.00 43.21 C ATOM 291 C VAL A 21 27.809 4.186 -33.297 1.00 73.33 C ATOM 292 O VAL A 21 28.324 3.088 -33.083 1.00 14.11 O ATOM 293 CB VAL A 21 25.951 5.037 -34.730 1.00 33.12 C ATOM 294 CG1 VAL A 21 25.554 5.531 -36.112 1.00 42.45 C ATOM 295 CG2 VAL A 21 25.059 3.886 -34.290 1.00 34.10 C ATOM 0 H VAL A 21 27.268 2.641 -35.417 1.00 40.53 H new ATOM 0 HA VAL A 21 28.048 5.455 -35.013 1.00 43.21 H new ATOM 0 HB VAL A 21 25.820 5.859 -34.026 1.00 33.12 H new ATOM 0 HG11 VAL A 21 24.506 5.829 -36.105 1.00 42.45 H new ATOM 0 HG12 VAL A 21 26.172 6.386 -36.384 1.00 42.45 H new ATOM 0 HG13 VAL A 21 25.699 4.732 -36.839 1.00 42.45 H new ATOM 0 HG21 VAL A 21 24.017 4.206 -34.308 1.00 34.10 H new ATOM 0 HG22 VAL A 21 25.192 3.043 -34.968 1.00 34.10 H new ATOM 0 HG23 VAL A 21 25.328 3.584 -33.278 1.00 34.10 H new ATOM 305 N PHE A 22 27.550 5.063 -32.334 1.00 14.43 N ATOM 306 CA PHE A 22 27.863 4.781 -30.938 1.00 3.02 C ATOM 307 C PHE A 22 26.589 4.577 -30.124 1.00 74.44 C ATOM 308 O PHE A 22 26.482 5.042 -28.989 1.00 73.35 O ATOM 309 CB PHE A 22 28.687 5.922 -30.337 1.00 64.14 C ATOM 310 CG PHE A 22 29.495 5.512 -29.140 1.00 25.24 C ATOM 311 CD1 PHE A 22 30.344 4.418 -29.201 1.00 41.13 C ATOM 312 CD2 PHE A 22 29.407 6.220 -27.952 1.00 50.11 C ATOM 313 CE1 PHE A 22 31.088 4.038 -28.100 1.00 40.33 C ATOM 314 CE2 PHE A 22 30.149 5.845 -26.848 1.00 11.12 C ATOM 315 CZ PHE A 22 30.991 4.753 -26.922 1.00 43.35 C ATOM 0 H PHE A 22 27.124 5.976 -32.494 1.00 14.43 H new ATOM 0 HA PHE A 22 28.447 3.861 -30.903 1.00 3.02 H new ATOM 0 HB2 PHE A 22 29.358 6.316 -31.100 1.00 64.14 H new ATOM 0 HB3 PHE A 22 28.016 6.733 -30.052 1.00 64.14 H new ATOM 0 HD1 PHE A 22 30.425 3.856 -30.120 1.00 41.13 H new ATOM 0 HD2 PHE A 22 28.751 7.075 -27.888 1.00 50.11 H new ATOM 0 HE1 PHE A 22 31.745 3.183 -28.161 1.00 40.33 H new ATOM 0 HE2 PHE A 22 30.070 6.406 -25.928 1.00 11.12 H new ATOM 0 HZ PHE A 22 31.572 4.459 -26.061 1.00 43.35 H new ATOM 325 N PHE A 23 25.624 3.878 -30.713 1.00 53.04 N ATOM 326 CA PHE A 23 24.355 3.613 -30.045 1.00 70.32 C ATOM 327 C PHE A 23 24.583 2.967 -28.681 1.00 41.54 C ATOM 328 O PHE A 23 23.798 3.160 -27.753 1.00 2.03 O ATOM 329 CB PHE A 23 23.478 2.706 -30.911 1.00 23.50 C ATOM 330 CG PHE A 23 23.949 1.280 -30.953 1.00 32.21 C ATOM 331 CD1 PHE A 23 23.514 0.365 -30.008 1.00 22.23 C ATOM 332 CD2 PHE A 23 24.826 0.855 -31.937 1.00 63.34 C ATOM 333 CE1 PHE A 23 23.945 -0.948 -30.044 1.00 31.14 C ATOM 334 CE2 PHE A 23 25.260 -0.457 -31.979 1.00 1.14 C ATOM 335 CZ PHE A 23 24.820 -1.359 -31.030 1.00 31.11 C ATOM 0 H PHE A 23 25.697 3.485 -31.651 1.00 53.04 H new ATOM 0 HA PHE A 23 23.846 4.565 -29.896 1.00 70.32 H new ATOM 0 HB2 PHE A 23 22.456 2.732 -30.532 1.00 23.50 H new ATOM 0 HB3 PHE A 23 23.451 3.102 -31.926 1.00 23.50 H new ATOM 0 HD1 PHE A 23 22.830 0.681 -29.234 1.00 22.23 H new ATOM 0 HD2 PHE A 23 25.175 1.557 -32.680 1.00 63.34 H new ATOM 0 HE1 PHE A 23 23.598 -1.652 -29.302 1.00 31.14 H new ATOM 0 HE2 PHE A 23 25.942 -0.776 -32.753 1.00 1.14 H new ATOM 0 HZ PHE A 23 25.160 -2.384 -31.059 1.00 31.11 H new ATOM 345 N ARG A 24 25.663 2.201 -28.569 1.00 72.35 N ATOM 346 CA ARG A 24 25.994 1.525 -27.321 1.00 10.24 C ATOM 347 C ARG A 24 26.342 2.536 -26.232 1.00 30.24 C ATOM 348 O ARG A 24 26.401 3.740 -26.482 1.00 61.23 O ATOM 349 CB ARG A 24 27.164 0.563 -27.531 1.00 45.13 C ATOM 350 CG ARG A 24 27.022 -0.745 -26.771 1.00 73.42 C ATOM 351 CD ARG A 24 27.884 -1.840 -27.380 1.00 21.12 C ATOM 352 NE ARG A 24 29.307 -1.520 -27.307 1.00 21.24 N ATOM 353 CZ ARG A 24 30.239 -2.151 -28.012 1.00 44.21 C ATOM 354 NH1 ARG A 24 29.900 -3.130 -28.840 1.00 4.44 N ATOM 355 NH2 ARG A 24 31.514 -1.802 -27.891 1.00 30.10 N ATOM 0 H ARG A 24 26.324 2.033 -29.328 1.00 72.35 H new ATOM 0 HA ARG A 24 25.120 0.958 -27.001 1.00 10.24 H new ATOM 0 HB2 ARG A 24 27.259 0.346 -28.595 1.00 45.13 H new ATOM 0 HB3 ARG A 24 28.087 1.054 -27.222 1.00 45.13 H new ATOM 0 HG2 ARG A 24 27.306 -0.594 -25.729 1.00 73.42 H new ATOM 0 HG3 ARG A 24 25.978 -1.058 -26.775 1.00 73.42 H new ATOM 0 HD2 ARG A 24 27.697 -2.780 -26.861 1.00 21.12 H new ATOM 0 HD3 ARG A 24 27.599 -1.989 -28.421 1.00 21.12 H new ATOM 0 HE ARG A 24 29.601 -0.771 -26.680 1.00 21.24 H new ATOM 0 HH11 ARG A 24 28.921 -3.400 -28.937 1.00 4.44 H new ATOM 0 HH12 ARG A 24 30.618 -3.613 -29.380 1.00 4.44 H new ATOM 0 HH21 ARG A 24 31.779 -1.049 -27.256 1.00 30.10 H new ATOM 0 HH22 ARG A 24 32.229 -2.287 -28.433 1.00 30.10 H new ATOM 369 N LYS A 25 26.571 2.038 -25.021 1.00 42.02 N ATOM 370 CA LYS A 25 26.914 2.896 -23.893 1.00 21.30 C ATOM 371 C LYS A 25 25.773 3.857 -23.574 1.00 24.44 C ATOM 372 O LYS A 25 25.968 4.860 -22.887 1.00 14.12 O ATOM 373 CB LYS A 25 28.190 3.685 -24.195 1.00 22.51 C ATOM 374 CG LYS A 25 29.007 4.016 -22.958 1.00 41.32 C ATOM 375 CD LYS A 25 30.263 4.795 -23.312 1.00 23.41 C ATOM 376 CE LYS A 25 31.351 4.602 -22.266 1.00 41.23 C ATOM 377 NZ LYS A 25 32.648 5.191 -22.701 1.00 22.24 N ATOM 0 H LYS A 25 26.525 1.044 -24.796 1.00 42.02 H new ATOM 0 HA LYS A 25 27.084 2.260 -23.024 1.00 21.30 H new ATOM 0 HB2 LYS A 25 28.808 3.110 -24.885 1.00 22.51 H new ATOM 0 HB3 LYS A 25 27.923 4.612 -24.702 1.00 22.51 H new ATOM 0 HG2 LYS A 25 28.400 4.598 -22.265 1.00 41.32 H new ATOM 0 HG3 LYS A 25 29.282 3.094 -22.445 1.00 41.32 H new ATOM 0 HD2 LYS A 25 30.631 4.471 -24.286 1.00 23.41 H new ATOM 0 HD3 LYS A 25 30.023 5.855 -23.398 1.00 23.41 H new ATOM 0 HE2 LYS A 25 31.039 5.062 -21.328 1.00 41.23 H new ATOM 0 HE3 LYS A 25 31.483 3.538 -22.071 1.00 41.23 H new ATOM 0 HZ1 LYS A 25 33.364 5.039 -21.962 1.00 22.24 H new ATOM 0 HZ2 LYS A 25 32.958 4.734 -23.582 1.00 22.24 H new ATOM 0 HZ3 LYS A 25 32.529 6.211 -22.863 1.00 22.24 H new ATOM 391 N HIS A 26 24.583 3.543 -24.075 1.00 70.50 N ATOM 392 CA HIS A 26 23.410 4.378 -23.841 1.00 23.31 C ATOM 393 C HIS A 26 22.274 3.561 -23.233 1.00 61.21 C ATOM 394 O HIS A 26 21.595 4.012 -22.310 1.00 23.44 O ATOM 395 CB HIS A 26 22.948 5.022 -25.148 1.00 10.41 C ATOM 396 CG HIS A 26 21.692 5.827 -25.008 1.00 24.23 C ATOM 397 ND1 HIS A 26 20.681 5.812 -25.944 1.00 75.03 N ATOM 398 CD2 HIS A 26 21.287 6.672 -24.032 1.00 2.44 C ATOM 399 CE1 HIS A 26 19.708 6.615 -25.551 1.00 71.12 C ATOM 400 NE2 HIS A 26 20.051 7.149 -24.393 1.00 1.10 N ATOM 0 H HIS A 26 24.405 2.716 -24.646 1.00 70.50 H new ATOM 0 HA HIS A 26 23.687 5.162 -23.136 1.00 23.31 H new ATOM 0 HB2 HIS A 26 23.742 5.666 -25.527 1.00 10.41 H new ATOM 0 HB3 HIS A 26 22.788 4.241 -25.892 1.00 10.41 H new ATOM 0 HD2 HIS A 26 21.834 6.924 -23.136 1.00 2.44 H new ATOM 0 HE1 HIS A 26 18.789 6.803 -26.086 1.00 71.12 H new ATOM 0 HE2 HIS A 26 19.489 7.808 -23.854 1.00 1.10 H new ATOM 408 N THR A 27 22.071 2.356 -23.758 1.00 2.14 N ATOM 409 CA THR A 27 21.017 1.477 -23.269 1.00 14.25 C ATOM 410 C THR A 27 21.414 0.821 -21.951 1.00 43.42 C ATOM 411 O THR A 27 20.558 0.458 -21.146 1.00 32.33 O ATOM 412 CB THR A 27 20.680 0.379 -24.295 1.00 33.14 C ATOM 413 OG1 THR A 27 19.679 -0.497 -23.764 1.00 30.12 O ATOM 414 CG2 THR A 27 21.921 -0.422 -24.657 1.00 42.14 C ATOM 0 H THR A 27 22.623 1.967 -24.522 1.00 2.14 H new ATOM 0 HA THR A 27 20.136 2.099 -23.111 1.00 14.25 H new ATOM 0 HB THR A 27 20.301 0.859 -25.197 1.00 33.14 H new ATOM 0 HG1 THR A 27 19.469 -1.191 -24.423 1.00 30.12 H new ATOM 0 HG21 THR A 27 21.658 -1.192 -25.383 1.00 42.14 H new ATOM 0 HG22 THR A 27 22.670 0.242 -25.088 1.00 42.14 H new ATOM 0 HG23 THR A 27 22.325 -0.892 -23.760 1.00 42.14 H new ATOM 422 N GLN A 28 22.718 0.674 -21.739 1.00 10.24 N ATOM 423 CA GLN A 28 23.228 0.062 -20.518 1.00 20.44 C ATOM 424 C GLN A 28 22.915 0.928 -19.302 1.00 74.21 C ATOM 425 O GLN A 28 22.808 0.428 -18.183 1.00 31.04 O ATOM 426 CB GLN A 28 24.738 -0.160 -20.625 1.00 53.13 C ATOM 427 CG GLN A 28 25.514 1.100 -20.975 1.00 20.52 C ATOM 428 CD GLN A 28 26.872 1.153 -20.303 1.00 40.32 C ATOM 429 OE1 GLN A 28 27.282 0.208 -19.629 1.00 12.02 O ATOM 430 NE2 GLN A 28 27.579 2.263 -20.484 1.00 72.23 N ATOM 0 H GLN A 28 23.440 0.970 -22.396 1.00 10.24 H new ATOM 0 HA GLN A 28 22.734 -0.901 -20.392 1.00 20.44 H new ATOM 0 HB2 GLN A 28 25.107 -0.553 -19.678 1.00 53.13 H new ATOM 0 HB3 GLN A 28 24.933 -0.919 -21.383 1.00 53.13 H new ATOM 0 HG2 GLN A 28 25.645 1.153 -22.056 1.00 20.52 H new ATOM 0 HG3 GLN A 28 24.933 1.974 -20.681 1.00 20.52 H new ATOM 0 HE21 GLN A 28 27.201 3.022 -21.051 1.00 72.23 H new ATOM 0 HE22 GLN A 28 28.500 2.356 -20.056 1.00 72.23 H new ATOM 439 N ALA A 29 22.769 2.229 -19.530 1.00 72.25 N ATOM 440 CA ALA A 29 22.466 3.164 -18.454 1.00 40.13 C ATOM 441 C ALA A 29 20.979 3.502 -18.423 1.00 4.13 C ATOM 442 O ALA A 29 20.426 3.810 -17.367 1.00 45.15 O ATOM 443 CB ALA A 29 23.294 4.431 -18.608 1.00 2.32 C ATOM 0 H ALA A 29 22.856 2.659 -20.451 1.00 72.25 H new ATOM 0 HA ALA A 29 22.723 2.687 -17.508 1.00 40.13 H new ATOM 0 HB1 ALA A 29 23.058 5.121 -17.798 1.00 2.32 H new ATOM 0 HB2 ALA A 29 24.354 4.179 -18.573 1.00 2.32 H new ATOM 0 HB3 ALA A 29 23.064 4.902 -19.564 1.00 2.32 H new ATOM 449 N GLU A 30 20.339 3.443 -19.586 1.00 72.20 N ATOM 450 CA GLU A 30 18.916 3.745 -19.690 1.00 70.40 C ATOM 451 C GLU A 30 18.076 2.613 -19.105 1.00 14.34 C ATOM 452 O GLU A 30 17.011 2.847 -18.535 1.00 13.22 O ATOM 453 CB GLU A 30 18.527 3.980 -21.151 1.00 63.11 C ATOM 454 CG GLU A 30 17.043 3.801 -21.423 1.00 21.34 C ATOM 455 CD GLU A 30 16.182 4.736 -20.596 1.00 72.11 C ATOM 456 OE1 GLU A 30 16.597 5.895 -20.387 1.00 44.15 O ATOM 457 OE2 GLU A 30 15.093 4.309 -20.158 1.00 3.21 O ATOM 0 H GLU A 30 20.782 3.189 -20.469 1.00 72.20 H new ATOM 0 HA GLU A 30 18.721 4.653 -19.119 1.00 70.40 H new ATOM 0 HB2 GLU A 30 18.821 4.989 -21.438 1.00 63.11 H new ATOM 0 HB3 GLU A 30 19.089 3.292 -21.783 1.00 63.11 H new ATOM 0 HG2 GLU A 30 16.848 3.974 -22.481 1.00 21.34 H new ATOM 0 HG3 GLU A 30 16.760 2.770 -21.211 1.00 21.34 H new ATOM 464 N GLY A 31 18.563 1.385 -19.251 1.00 23.14 N ATOM 465 CA GLY A 31 17.845 0.235 -18.732 1.00 42.24 C ATOM 466 C GLY A 31 18.061 0.039 -17.245 1.00 21.00 C ATOM 467 O GLY A 31 17.230 -0.560 -16.563 1.00 34.14 O ATOM 0 H GLY A 31 19.442 1.166 -19.719 1.00 23.14 H new ATOM 0 HA2 GLY A 31 16.780 0.357 -18.928 1.00 42.24 H new ATOM 0 HA3 GLY A 31 18.167 -0.660 -19.264 1.00 42.24 H new ATOM 471 N LYS A 32 19.182 0.543 -16.740 1.00 12.32 N ATOM 472 CA LYS A 32 19.506 0.421 -15.324 1.00 23.34 C ATOM 473 C LYS A 32 18.665 1.380 -14.488 1.00 3.33 C ATOM 474 O LYS A 32 18.306 1.078 -13.350 1.00 24.25 O ATOM 475 CB LYS A 32 20.994 0.697 -15.094 1.00 51.23 C ATOM 476 CG LYS A 32 21.893 -0.470 -15.463 1.00 43.21 C ATOM 477 CD LYS A 32 22.257 -1.300 -14.244 1.00 24.31 C ATOM 478 CE LYS A 32 21.039 -1.999 -13.661 1.00 55.01 C ATOM 479 NZ LYS A 32 20.443 -2.969 -14.622 1.00 2.24 N ATOM 0 H LYS A 32 19.882 1.040 -17.291 1.00 12.32 H new ATOM 0 HA LYS A 32 19.279 -0.599 -15.012 1.00 23.34 H new ATOM 0 HB2 LYS A 32 21.288 1.570 -15.678 1.00 51.23 H new ATOM 0 HB3 LYS A 32 21.151 0.948 -14.045 1.00 51.23 H new ATOM 0 HG2 LYS A 32 21.390 -1.100 -16.196 1.00 43.21 H new ATOM 0 HG3 LYS A 32 22.802 -0.096 -15.934 1.00 43.21 H new ATOM 0 HD2 LYS A 32 23.007 -2.042 -14.519 1.00 24.31 H new ATOM 0 HD3 LYS A 32 22.706 -0.658 -13.486 1.00 24.31 H new ATOM 0 HE2 LYS A 32 21.323 -2.521 -12.747 1.00 55.01 H new ATOM 0 HE3 LYS A 32 20.291 -1.256 -13.385 1.00 55.01 H new ATOM 0 HZ1 LYS A 32 19.460 -2.697 -14.825 1.00 2.24 H new ATOM 0 HZ2 LYS A 32 20.993 -2.966 -15.505 1.00 2.24 H new ATOM 0 HZ3 LYS A 32 20.459 -3.923 -14.208 1.00 2.24 H new ATOM 493 N LYS A 33 18.353 2.538 -15.060 1.00 12.11 N ATOM 494 CA LYS A 33 17.551 3.542 -14.369 1.00 65.45 C ATOM 495 C LYS A 33 16.166 2.997 -14.038 1.00 13.43 C ATOM 496 O LYS A 33 15.527 3.438 -13.081 1.00 50.32 O ATOM 497 CB LYS A 33 17.424 4.802 -15.229 1.00 31.44 C ATOM 498 CG LYS A 33 18.493 5.842 -14.945 1.00 3.22 C ATOM 499 CD LYS A 33 18.154 7.179 -15.582 1.00 53.03 C ATOM 500 CE LYS A 33 18.370 7.150 -17.088 1.00 33.44 C ATOM 501 NZ LYS A 33 19.806 6.975 -17.439 1.00 4.45 N ATOM 0 H LYS A 33 18.643 2.805 -16.001 1.00 12.11 H new ATOM 0 HA LYS A 33 18.054 3.796 -13.436 1.00 65.45 H new ATOM 0 HB2 LYS A 33 17.473 4.520 -16.281 1.00 31.44 H new ATOM 0 HB3 LYS A 33 16.443 5.247 -15.064 1.00 31.44 H new ATOM 0 HG2 LYS A 33 18.602 5.968 -13.868 1.00 3.22 H new ATOM 0 HG3 LYS A 33 19.453 5.491 -15.323 1.00 3.22 H new ATOM 0 HD2 LYS A 33 17.116 7.433 -15.367 1.00 53.03 H new ATOM 0 HD3 LYS A 33 18.771 7.961 -15.140 1.00 53.03 H new ATOM 0 HE2 LYS A 33 17.788 6.337 -17.523 1.00 33.44 H new ATOM 0 HE3 LYS A 33 17.999 8.077 -17.526 1.00 33.44 H new ATOM 0 HZ1 LYS A 33 19.983 7.369 -18.385 1.00 4.45 H new ATOM 0 HZ2 LYS A 33 20.397 7.471 -16.741 1.00 4.45 H new ATOM 0 HZ3 LYS A 33 20.043 5.962 -17.436 1.00 4.45 H new ATOM 515 N LEU A 34 15.707 2.037 -14.832 1.00 72.40 N ATOM 516 CA LEU A 34 14.397 1.431 -14.622 1.00 34.45 C ATOM 517 C LEU A 34 14.506 0.188 -13.744 1.00 21.12 C ATOM 518 O LEU A 34 13.827 0.074 -12.724 1.00 64.21 O ATOM 519 CB LEU A 34 13.760 1.066 -15.964 1.00 13.42 C ATOM 520 CG LEU A 34 13.251 2.237 -16.805 1.00 45.54 C ATOM 521 CD1 LEU A 34 13.332 1.905 -18.287 1.00 71.41 C ATOM 522 CD2 LEU A 34 11.825 2.596 -16.414 1.00 43.11 C ATOM 0 H LEU A 34 16.223 1.661 -15.628 1.00 72.40 H new ATOM 0 HA LEU A 34 13.765 2.159 -14.113 1.00 34.45 H new ATOM 0 HB2 LEU A 34 14.492 0.513 -16.553 1.00 13.42 H new ATOM 0 HB3 LEU A 34 12.926 0.390 -15.776 1.00 13.42 H new ATOM 0 HG LEU A 34 13.887 3.101 -16.612 1.00 45.54 H new ATOM 0 HD11 LEU A 34 12.966 2.750 -18.870 1.00 71.41 H new ATOM 0 HD12 LEU A 34 14.368 1.699 -18.558 1.00 71.41 H new ATOM 0 HD13 LEU A 34 12.721 1.027 -18.497 1.00 71.41 H new ATOM 0 HD21 LEU A 34 11.480 3.431 -17.023 1.00 43.11 H new ATOM 0 HD22 LEU A 34 11.176 1.736 -16.577 1.00 43.11 H new ATOM 0 HD23 LEU A 34 11.796 2.878 -15.362 1.00 43.11 H new ATOM 534 N GLY A 35 15.368 -0.741 -14.147 1.00 32.21 N ATOM 535 CA GLY A 35 15.552 -1.962 -13.385 1.00 22.32 C ATOM 536 C GLY A 35 15.470 -3.204 -14.250 1.00 50.04 C ATOM 537 O GLY A 35 14.744 -4.146 -13.931 1.00 14.05 O ATOM 0 H GLY A 35 15.942 -0.670 -14.987 1.00 32.21 H new ATOM 0 HA2 GLY A 35 16.521 -1.933 -12.887 1.00 22.32 H new ATOM 0 HA3 GLY A 35 14.794 -2.017 -12.604 1.00 22.32 H new ATOM 541 N LEU A 36 16.214 -3.206 -15.351 1.00 24.54 N ATOM 542 CA LEU A 36 16.222 -4.342 -16.267 1.00 13.41 C ATOM 543 C LEU A 36 17.649 -4.786 -16.572 1.00 54.11 C ATOM 544 O LEU A 36 18.580 -3.982 -16.543 1.00 1.50 O ATOM 545 CB LEU A 36 15.500 -3.979 -17.566 1.00 14.44 C ATOM 546 CG LEU A 36 14.174 -3.232 -17.411 1.00 31.55 C ATOM 547 CD1 LEU A 36 13.632 -2.818 -18.770 1.00 24.11 C ATOM 548 CD2 LEU A 36 13.161 -4.094 -16.671 1.00 14.34 C ATOM 0 H LEU A 36 16.819 -2.434 -15.631 1.00 24.54 H new ATOM 0 HA LEU A 36 15.699 -5.169 -15.786 1.00 13.41 H new ATOM 0 HB2 LEU A 36 16.169 -3.368 -18.172 1.00 14.44 H new ATOM 0 HB3 LEU A 36 15.314 -4.897 -18.124 1.00 14.44 H new ATOM 0 HG LEU A 36 14.353 -2.331 -16.825 1.00 31.55 H new ATOM 0 HD11 LEU A 36 12.688 -2.288 -18.639 1.00 24.11 H new ATOM 0 HD12 LEU A 36 14.350 -2.164 -19.264 1.00 24.11 H new ATOM 0 HD13 LEU A 36 13.468 -3.705 -19.382 1.00 24.11 H new ATOM 0 HD21 LEU A 36 12.223 -3.547 -16.569 1.00 14.34 H new ATOM 0 HD22 LEU A 36 12.987 -5.013 -17.231 1.00 14.34 H new ATOM 0 HD23 LEU A 36 13.547 -4.340 -15.682 1.00 14.34 H new ATOM 560 N VAL A 37 17.812 -6.072 -16.867 1.00 43.30 N ATOM 561 CA VAL A 37 19.125 -6.623 -17.181 1.00 41.33 C ATOM 562 C VAL A 37 19.160 -7.184 -18.598 1.00 64.52 C ATOM 563 O VAL A 37 18.182 -7.092 -19.338 1.00 61.24 O ATOM 564 CB VAL A 37 19.519 -7.734 -16.190 1.00 42.03 C ATOM 565 CG1 VAL A 37 19.689 -7.165 -14.790 1.00 31.12 C ATOM 566 CG2 VAL A 37 18.484 -8.848 -16.200 1.00 75.12 C ATOM 0 H VAL A 37 17.052 -6.751 -16.895 1.00 43.30 H new ATOM 0 HA VAL A 37 19.840 -5.804 -17.100 1.00 41.33 H new ATOM 0 HB VAL A 37 20.475 -8.155 -16.503 1.00 42.03 H new ATOM 0 HG11 VAL A 37 19.967 -7.965 -14.104 1.00 31.12 H new ATOM 0 HG12 VAL A 37 20.471 -6.405 -14.798 1.00 31.12 H new ATOM 0 HG13 VAL A 37 18.751 -6.716 -14.463 1.00 31.12 H new ATOM 0 HG21 VAL A 37 18.778 -9.625 -15.494 1.00 75.12 H new ATOM 0 HG22 VAL A 37 17.513 -8.445 -15.912 1.00 75.12 H new ATOM 0 HG23 VAL A 37 18.418 -9.274 -17.201 1.00 75.12 H new ATOM 576 N GLY A 38 20.296 -7.768 -18.970 1.00 31.35 N ATOM 577 CA GLY A 38 20.438 -8.337 -20.297 1.00 31.20 C ATOM 578 C GLY A 38 21.747 -7.951 -20.956 1.00 61.22 C ATOM 579 O GLY A 38 22.785 -7.882 -20.297 1.00 74.04 O ATOM 0 H GLY A 38 21.120 -7.857 -18.375 1.00 31.35 H new ATOM 0 HA2 GLY A 38 20.374 -9.423 -20.232 1.00 31.20 H new ATOM 0 HA3 GLY A 38 19.609 -8.006 -20.922 1.00 31.20 H new ATOM 583 N TRP A 39 21.700 -7.701 -22.260 1.00 12.25 N ATOM 584 CA TRP A 39 22.892 -7.321 -23.009 1.00 24.34 C ATOM 585 C TRP A 39 22.518 -6.601 -24.299 1.00 64.34 C ATOM 586 O TRP A 39 21.436 -6.811 -24.847 1.00 41.15 O ATOM 587 CB TRP A 39 23.735 -8.558 -23.325 1.00 44.45 C ATOM 588 CG TRP A 39 23.080 -9.490 -24.298 1.00 74.41 C ATOM 589 CD1 TRP A 39 23.011 -9.345 -25.654 1.00 41.13 C ATOM 590 CD2 TRP A 39 22.398 -10.711 -23.989 1.00 2.04 C ATOM 591 NE1 TRP A 39 22.328 -10.402 -26.207 1.00 1.34 N ATOM 592 CE2 TRP A 39 21.942 -11.254 -25.206 1.00 4.11 C ATOM 593 CE3 TRP A 39 22.131 -11.399 -22.802 1.00 74.22 C ATOM 594 CZ2 TRP A 39 21.234 -12.451 -25.268 1.00 11.22 C ATOM 595 CZ3 TRP A 39 21.427 -12.587 -22.865 1.00 50.23 C ATOM 596 CH2 TRP A 39 20.986 -13.103 -24.091 1.00 32.41 C ATOM 0 H TRP A 39 20.849 -7.755 -22.820 1.00 12.25 H new ATOM 0 HA TRP A 39 23.477 -6.639 -22.392 1.00 24.34 H new ATOM 0 HB2 TRP A 39 24.697 -8.240 -23.728 1.00 44.45 H new ATOM 0 HB3 TRP A 39 23.940 -9.096 -22.399 1.00 44.45 H new ATOM 0 HD1 TRP A 39 23.432 -8.521 -26.211 1.00 41.13 H new ATOM 0 HE1 TRP A 39 22.139 -10.531 -27.201 1.00 1.34 H new ATOM 0 HE3 TRP A 39 22.469 -11.010 -21.853 1.00 74.22 H new ATOM 0 HZ2 TRP A 39 20.893 -12.851 -26.211 1.00 11.22 H new ATOM 0 HZ3 TRP A 39 21.213 -13.126 -21.954 1.00 50.23 H new ATOM 0 HH2 TRP A 39 20.439 -14.034 -24.107 1.00 32.41 H new ATOM 607 N VAL A 40 23.420 -5.752 -24.781 1.00 43.20 N ATOM 608 CA VAL A 40 23.185 -5.002 -26.009 1.00 11.31 C ATOM 609 C VAL A 40 24.395 -5.067 -26.933 1.00 45.32 C ATOM 610 O VAL A 40 25.516 -4.759 -26.527 1.00 15.12 O ATOM 611 CB VAL A 40 22.859 -3.526 -25.711 1.00 74.13 C ATOM 612 CG1 VAL A 40 23.977 -2.884 -24.905 1.00 42.21 C ATOM 613 CG2 VAL A 40 22.617 -2.763 -27.005 1.00 34.11 C ATOM 0 H VAL A 40 24.321 -5.566 -24.340 1.00 43.20 H new ATOM 0 HA VAL A 40 22.330 -5.463 -26.503 1.00 11.31 H new ATOM 0 HB VAL A 40 21.947 -3.486 -25.116 1.00 74.13 H new ATOM 0 HG11 VAL A 40 23.729 -1.842 -24.704 1.00 42.21 H new ATOM 0 HG12 VAL A 40 24.097 -3.416 -23.962 1.00 42.21 H new ATOM 0 HG13 VAL A 40 24.908 -2.933 -25.471 1.00 42.21 H new ATOM 0 HG21 VAL A 40 22.388 -1.722 -26.776 1.00 34.11 H new ATOM 0 HG22 VAL A 40 23.511 -2.810 -27.627 1.00 34.11 H new ATOM 0 HG23 VAL A 40 21.779 -3.210 -27.540 1.00 34.11 H new ATOM 623 N GLN A 41 24.162 -5.469 -28.178 1.00 55.23 N ATOM 624 CA GLN A 41 25.234 -5.574 -29.161 1.00 31.23 C ATOM 625 C GLN A 41 24.693 -5.410 -30.577 1.00 74.30 C ATOM 626 O GLN A 41 23.559 -5.790 -30.866 1.00 71.43 O ATOM 627 CB GLN A 41 25.946 -6.921 -29.027 1.00 21.32 C ATOM 628 CG GLN A 41 27.351 -6.927 -29.607 1.00 42.10 C ATOM 629 CD GLN A 41 27.862 -8.327 -29.885 1.00 3.23 C ATOM 630 OE1 GLN A 41 27.109 -9.299 -29.824 1.00 53.32 O ATOM 631 NE2 GLN A 41 29.150 -8.437 -30.192 1.00 35.22 N ATOM 0 H GLN A 41 23.240 -5.727 -28.530 1.00 55.23 H new ATOM 0 HA GLN A 41 25.948 -4.773 -28.970 1.00 31.23 H new ATOM 0 HB2 GLN A 41 25.996 -7.193 -27.973 1.00 21.32 H new ATOM 0 HB3 GLN A 41 25.353 -7.687 -29.526 1.00 21.32 H new ATOM 0 HG2 GLN A 41 27.360 -6.351 -30.532 1.00 42.10 H new ATOM 0 HG3 GLN A 41 28.028 -6.428 -28.914 1.00 42.10 H new ATOM 0 HE21 GLN A 41 29.738 -7.604 -30.231 1.00 35.22 H new ATOM 0 HE22 GLN A 41 29.551 -9.354 -30.389 1.00 35.22 H new ATOM 640 N ASN A 42 25.511 -4.841 -31.456 1.00 63.40 N ATOM 641 CA ASN A 42 25.114 -4.626 -32.843 1.00 31.34 C ATOM 642 C ASN A 42 25.174 -5.929 -33.634 1.00 61.22 C ATOM 643 O ASN A 42 25.621 -6.958 -33.126 1.00 32.12 O ATOM 644 CB ASN A 42 26.016 -3.577 -33.496 1.00 75.24 C ATOM 645 CG ASN A 42 27.322 -4.166 -33.993 1.00 11.02 C ATOM 646 OD1 ASN A 42 28.137 -4.648 -33.206 1.00 72.52 O ATOM 647 ND2 ASN A 42 27.527 -4.129 -35.304 1.00 41.53 N ATOM 0 H ASN A 42 26.453 -4.520 -31.233 1.00 63.40 H new ATOM 0 HA ASN A 42 24.085 -4.265 -32.849 1.00 31.34 H new ATOM 0 HB2 ASN A 42 25.488 -3.116 -34.331 1.00 75.24 H new ATOM 0 HB3 ASN A 42 26.228 -2.786 -32.777 1.00 75.24 H new ATOM 0 HD21 ASN A 42 28.388 -4.510 -35.697 1.00 41.53 H new ATOM 0 HD22 ASN A 42 26.824 -3.720 -35.919 1.00 41.53 H new ATOM 654 N THR A 43 24.722 -5.878 -34.883 1.00 74.02 N ATOM 655 CA THR A 43 24.723 -7.053 -35.745 1.00 41.05 C ATOM 656 C THR A 43 25.137 -6.691 -37.167 1.00 62.12 C ATOM 657 O THR A 43 24.869 -5.586 -37.640 1.00 21.42 O ATOM 658 CB THR A 43 23.338 -7.725 -35.782 1.00 34.03 C ATOM 659 OG1 THR A 43 22.349 -6.787 -36.221 1.00 43.34 O ATOM 660 CG2 THR A 43 22.960 -8.261 -34.409 1.00 21.00 C ATOM 0 H THR A 43 24.350 -5.035 -35.320 1.00 74.02 H new ATOM 0 HA THR A 43 25.446 -7.752 -35.325 1.00 41.05 H new ATOM 0 HB THR A 43 23.383 -8.560 -36.482 1.00 34.03 H new ATOM 0 HG1 THR A 43 22.167 -6.144 -35.504 1.00 43.34 H new ATOM 0 HG21 THR A 43 21.978 -8.731 -34.460 1.00 21.00 H new ATOM 0 HG22 THR A 43 23.698 -8.996 -34.090 1.00 21.00 H new ATOM 0 HG23 THR A 43 22.932 -7.440 -33.693 1.00 21.00 H new ATOM 668 N ASP A 44 25.791 -7.628 -37.845 1.00 31.44 N ATOM 669 CA ASP A 44 26.241 -7.408 -39.214 1.00 74.53 C ATOM 670 C ASP A 44 25.062 -7.085 -40.128 1.00 23.42 C ATOM 671 O ASP A 44 25.200 -6.333 -41.092 1.00 62.15 O ATOM 672 CB ASP A 44 26.982 -8.641 -39.734 1.00 42.13 C ATOM 673 CG ASP A 44 28.348 -8.807 -39.097 1.00 13.41 C ATOM 674 OD1 ASP A 44 29.074 -7.798 -38.980 1.00 52.41 O ATOM 675 OD2 ASP A 44 28.691 -9.946 -38.716 1.00 13.43 O ATOM 0 H ASP A 44 26.021 -8.548 -37.468 1.00 31.44 H new ATOM 0 HA ASP A 44 26.922 -6.557 -39.214 1.00 74.53 H new ATOM 0 HB2 ASP A 44 26.383 -9.530 -39.539 1.00 42.13 H new ATOM 0 HB3 ASP A 44 27.095 -8.564 -40.815 1.00 42.13 H new ATOM 680 N ARG A 45 23.905 -7.660 -39.818 1.00 12.04 N ATOM 681 CA ARG A 45 22.703 -7.435 -40.612 1.00 21.01 C ATOM 682 C ARG A 45 22.294 -5.965 -40.575 1.00 64.32 C ATOM 683 O ARG A 45 21.770 -5.432 -41.552 1.00 10.32 O ATOM 684 CB ARG A 45 21.556 -8.307 -40.099 1.00 20.43 C ATOM 685 CG ARG A 45 20.532 -8.657 -41.166 1.00 52.40 C ATOM 686 CD ARG A 45 19.353 -7.697 -41.142 1.00 15.33 C ATOM 687 NE ARG A 45 18.217 -8.244 -40.404 1.00 52.51 N ATOM 688 CZ ARG A 45 17.444 -9.221 -40.864 1.00 21.42 C ATOM 689 NH1 ARG A 45 17.684 -9.757 -42.053 1.00 22.35 N ATOM 690 NH2 ARG A 45 16.429 -9.665 -40.134 1.00 21.54 N ATOM 0 H ARG A 45 23.774 -8.285 -39.023 1.00 12.04 H new ATOM 0 HA ARG A 45 22.924 -7.707 -41.644 1.00 21.01 H new ATOM 0 HB2 ARG A 45 21.968 -9.228 -39.687 1.00 20.43 H new ATOM 0 HB3 ARG A 45 21.054 -7.788 -39.282 1.00 20.43 H new ATOM 0 HG2 ARG A 45 21.004 -8.630 -42.148 1.00 52.40 H new ATOM 0 HG3 ARG A 45 20.177 -9.676 -41.011 1.00 52.40 H new ATOM 0 HD2 ARG A 45 19.661 -6.756 -40.687 1.00 15.33 H new ATOM 0 HD3 ARG A 45 19.047 -7.473 -42.164 1.00 15.33 H new ATOM 0 HE ARG A 45 18.006 -7.854 -39.485 1.00 52.51 H new ATOM 0 HH11 ARG A 45 18.464 -9.419 -42.617 1.00 22.35 H new ATOM 0 HH12 ARG A 45 17.089 -10.507 -42.404 1.00 22.35 H new ATOM 0 HH21 ARG A 45 16.242 -9.256 -39.219 1.00 21.54 H new ATOM 0 HH22 ARG A 45 15.836 -10.415 -40.488 1.00 21.54 H new ATOM 704 N GLY A 46 22.538 -5.317 -39.440 1.00 42.44 N ATOM 705 CA GLY A 46 22.189 -3.915 -39.297 1.00 73.43 C ATOM 706 C GLY A 46 21.053 -3.698 -38.317 1.00 61.30 C ATOM 707 O GLY A 46 20.084 -3.001 -38.621 1.00 24.21 O ATOM 0 H GLY A 46 22.971 -5.737 -38.617 1.00 42.44 H new ATOM 0 HA2 GLY A 46 23.064 -3.358 -38.963 1.00 73.43 H new ATOM 0 HA3 GLY A 46 21.907 -3.513 -40.270 1.00 73.43 H new ATOM 711 N THR A 47 21.170 -4.298 -37.136 1.00 74.12 N ATOM 712 CA THR A 47 20.144 -4.169 -36.109 1.00 73.51 C ATOM 713 C THR A 47 20.739 -4.324 -34.715 1.00 24.44 C ATOM 714 O THR A 47 21.844 -4.844 -34.555 1.00 1.35 O ATOM 715 CB THR A 47 19.027 -5.214 -36.297 1.00 12.42 C ATOM 716 OG1 THR A 47 19.598 -6.501 -36.557 1.00 41.40 O ATOM 717 CG2 THR A 47 18.106 -4.821 -37.442 1.00 51.11 C ATOM 0 H THR A 47 21.965 -4.878 -36.868 1.00 74.12 H new ATOM 0 HA THR A 47 19.719 -3.170 -36.211 1.00 73.51 H new ATOM 0 HB THR A 47 18.441 -5.256 -35.379 1.00 12.42 H new ATOM 0 HG1 THR A 47 20.557 -6.479 -36.358 1.00 41.40 H new ATOM 0 HG21 THR A 47 17.326 -5.573 -37.556 1.00 51.11 H new ATOM 0 HG22 THR A 47 17.650 -3.855 -37.227 1.00 51.11 H new ATOM 0 HG23 THR A 47 18.682 -4.753 -38.365 1.00 51.11 H new ATOM 725 N VAL A 48 20.001 -3.871 -33.707 1.00 34.33 N ATOM 726 CA VAL A 48 20.455 -3.961 -32.324 1.00 65.44 C ATOM 727 C VAL A 48 19.842 -5.167 -31.622 1.00 24.53 C ATOM 728 O VAL A 48 18.732 -5.093 -31.096 1.00 3.01 O ATOM 729 CB VAL A 48 20.104 -2.687 -31.534 1.00 23.13 C ATOM 730 CG1 VAL A 48 20.567 -2.810 -30.090 1.00 15.02 C ATOM 731 CG2 VAL A 48 20.718 -1.463 -32.196 1.00 63.25 C ATOM 0 H VAL A 48 19.085 -3.437 -33.822 1.00 34.33 H new ATOM 0 HA VAL A 48 21.539 -4.074 -32.353 1.00 65.44 H new ATOM 0 HB VAL A 48 19.021 -2.567 -31.535 1.00 23.13 H new ATOM 0 HG11 VAL A 48 20.311 -1.900 -29.547 1.00 15.02 H new ATOM 0 HG12 VAL A 48 20.076 -3.663 -29.622 1.00 15.02 H new ATOM 0 HG13 VAL A 48 21.647 -2.955 -30.065 1.00 15.02 H new ATOM 0 HG21 VAL A 48 20.459 -0.572 -31.624 1.00 63.25 H new ATOM 0 HG22 VAL A 48 21.802 -1.572 -32.228 1.00 63.25 H new ATOM 0 HG23 VAL A 48 20.333 -1.367 -33.211 1.00 63.25 H new ATOM 741 N GLN A 49 20.574 -6.277 -31.617 1.00 33.33 N ATOM 742 CA GLN A 49 20.101 -7.500 -30.978 1.00 61.02 C ATOM 743 C GLN A 49 20.160 -7.379 -29.459 1.00 52.41 C ATOM 744 O GLN A 49 21.213 -7.565 -28.852 1.00 4.53 O ATOM 745 CB GLN A 49 20.936 -8.696 -31.439 1.00 33.43 C ATOM 746 CG GLN A 49 20.379 -9.388 -32.673 1.00 13.14 C ATOM 747 CD GLN A 49 21.010 -10.744 -32.917 1.00 22.35 C ATOM 748 OE1 GLN A 49 22.065 -11.059 -32.365 1.00 2.10 O ATOM 749 NE2 GLN A 49 20.367 -11.557 -33.747 1.00 15.34 N ATOM 0 H GLN A 49 21.495 -6.355 -32.048 1.00 33.33 H new ATOM 0 HA GLN A 49 19.063 -7.655 -31.271 1.00 61.02 H new ATOM 0 HB2 GLN A 49 21.952 -8.360 -31.648 1.00 33.43 H new ATOM 0 HB3 GLN A 49 21.000 -9.419 -30.625 1.00 33.43 H new ATOM 0 HG2 GLN A 49 19.301 -9.508 -32.562 1.00 13.14 H new ATOM 0 HG3 GLN A 49 20.541 -8.754 -33.545 1.00 13.14 H new ATOM 0 HE21 GLN A 49 19.495 -11.256 -34.183 1.00 15.34 H new ATOM 0 HE22 GLN A 49 20.745 -12.483 -33.949 1.00 15.34 H new ATOM 758 N GLY A 50 19.020 -7.065 -28.851 1.00 12.23 N ATOM 759 CA GLY A 50 18.964 -6.923 -27.407 1.00 72.44 C ATOM 760 C GLY A 50 17.657 -7.425 -26.826 1.00 52.11 C ATOM 761 O GLY A 50 16.653 -7.528 -27.532 1.00 64.50 O ATOM 0 H GLY A 50 18.135 -6.906 -29.332 1.00 12.23 H new ATOM 0 HA2 GLY A 50 19.792 -7.472 -26.959 1.00 72.44 H new ATOM 0 HA3 GLY A 50 19.097 -5.874 -27.143 1.00 72.44 H new ATOM 765 N LYS A 51 17.667 -7.739 -25.535 1.00 63.21 N ATOM 766 CA LYS A 51 16.474 -8.233 -24.858 1.00 25.52 C ATOM 767 C LYS A 51 16.150 -7.380 -23.636 1.00 32.33 C ATOM 768 O LYS A 51 16.902 -6.470 -23.284 1.00 32.55 O ATOM 769 CB LYS A 51 16.669 -9.692 -24.438 1.00 20.15 C ATOM 770 CG LYS A 51 17.755 -9.884 -23.393 1.00 71.51 C ATOM 771 CD LYS A 51 17.639 -11.237 -22.711 1.00 30.22 C ATOM 772 CE LYS A 51 17.793 -12.378 -23.705 1.00 1.10 C ATOM 773 NZ LYS A 51 18.125 -13.662 -23.028 1.00 75.43 N ATOM 0 H LYS A 51 18.489 -7.660 -24.936 1.00 63.21 H new ATOM 0 HA LYS A 51 15.638 -8.170 -25.555 1.00 25.52 H new ATOM 0 HB2 LYS A 51 15.728 -10.078 -24.047 1.00 20.15 H new ATOM 0 HB3 LYS A 51 16.915 -10.285 -25.319 1.00 20.15 H new ATOM 0 HG2 LYS A 51 18.734 -9.796 -23.864 1.00 71.51 H new ATOM 0 HG3 LYS A 51 17.687 -9.092 -22.647 1.00 71.51 H new ATOM 0 HD2 LYS A 51 18.402 -11.322 -21.937 1.00 30.22 H new ATOM 0 HD3 LYS A 51 16.672 -11.314 -22.215 1.00 30.22 H new ATOM 0 HE2 LYS A 51 16.869 -12.494 -24.271 1.00 1.10 H new ATOM 0 HE3 LYS A 51 18.577 -12.132 -24.422 1.00 1.10 H new ATOM 0 HZ1 LYS A 51 17.771 -14.457 -23.598 1.00 75.43 H new ATOM 0 HZ2 LYS A 51 19.157 -13.743 -22.924 1.00 75.43 H new ATOM 0 HZ3 LYS A 51 17.680 -13.684 -22.088 1.00 75.43 H new ATOM 787 N LEU A 52 15.027 -7.680 -22.992 1.00 22.21 N ATOM 788 CA LEU A 52 14.604 -6.941 -21.807 1.00 72.54 C ATOM 789 C LEU A 52 14.193 -7.894 -20.689 1.00 62.33 C ATOM 790 O LEU A 52 13.060 -8.373 -20.655 1.00 21.13 O ATOM 791 CB LEU A 52 13.440 -6.010 -22.152 1.00 5.10 C ATOM 792 CG LEU A 52 13.517 -5.316 -23.512 1.00 53.33 C ATOM 793 CD1 LEU A 52 12.278 -4.466 -23.748 1.00 73.12 C ATOM 794 CD2 LEU A 52 14.775 -4.465 -23.607 1.00 51.01 C ATOM 0 H LEU A 52 14.393 -8.429 -23.270 1.00 22.21 H new ATOM 0 HA LEU A 52 15.448 -6.345 -21.460 1.00 72.54 H new ATOM 0 HB2 LEU A 52 12.516 -6.586 -22.112 1.00 5.10 H new ATOM 0 HB3 LEU A 52 13.372 -5.244 -21.379 1.00 5.10 H new ATOM 0 HG LEU A 52 13.561 -6.082 -24.287 1.00 53.33 H new ATOM 0 HD11 LEU A 52 12.350 -3.980 -24.721 1.00 73.12 H new ATOM 0 HD12 LEU A 52 11.392 -5.100 -23.724 1.00 73.12 H new ATOM 0 HD13 LEU A 52 12.203 -3.708 -22.968 1.00 73.12 H new ATOM 0 HD21 LEU A 52 14.813 -3.979 -24.582 1.00 51.01 H new ATOM 0 HD22 LEU A 52 14.762 -3.707 -22.824 1.00 51.01 H new ATOM 0 HD23 LEU A 52 15.653 -5.099 -23.484 1.00 51.01 H new ATOM 806 N GLN A 53 15.121 -8.163 -19.777 1.00 5.53 N ATOM 807 CA GLN A 53 14.855 -9.057 -18.656 1.00 53.14 C ATOM 808 C GLN A 53 14.568 -8.266 -17.385 1.00 14.34 C ATOM 809 O GLN A 53 15.444 -7.584 -16.855 1.00 13.15 O ATOM 810 CB GLN A 53 16.042 -9.994 -18.431 1.00 23.31 C ATOM 811 CG GLN A 53 16.364 -10.868 -19.632 1.00 62.32 C ATOM 812 CD GLN A 53 17.379 -11.948 -19.313 1.00 63.11 C ATOM 813 OE1 GLN A 53 18.584 -11.753 -19.480 1.00 14.01 O ATOM 814 NE2 GLN A 53 16.898 -13.096 -18.851 1.00 15.11 N ATOM 0 H GLN A 53 16.064 -7.775 -19.792 1.00 5.53 H new ATOM 0 HA GLN A 53 13.974 -9.651 -18.899 1.00 53.14 H new ATOM 0 HB2 GLN A 53 16.920 -9.400 -18.179 1.00 23.31 H new ATOM 0 HB3 GLN A 53 15.832 -10.633 -17.573 1.00 23.31 H new ATOM 0 HG2 GLN A 53 15.447 -11.332 -19.995 1.00 62.32 H new ATOM 0 HG3 GLN A 53 16.746 -10.243 -20.439 1.00 62.32 H new ATOM 0 HE21 GLN A 53 15.892 -13.215 -18.728 1.00 15.11 H new ATOM 0 HE22 GLN A 53 17.534 -13.859 -18.619 1.00 15.11 H new ATOM 823 N GLY A 54 13.333 -8.361 -16.900 1.00 20.21 N ATOM 824 CA GLY A 54 12.952 -7.649 -15.694 1.00 43.33 C ATOM 825 C GLY A 54 11.451 -7.622 -15.486 1.00 60.04 C ATOM 826 O GLY A 54 10.701 -8.359 -16.126 1.00 71.52 O ATOM 0 H GLY A 54 12.590 -8.918 -17.321 1.00 20.21 H new ATOM 0 HA2 GLY A 54 13.427 -8.120 -14.833 1.00 43.33 H new ATOM 0 HA3 GLY A 54 13.327 -6.627 -15.746 1.00 43.33 H new ATOM 830 N PRO A 55 10.992 -6.756 -14.571 1.00 31.13 N ATOM 831 CA PRO A 55 9.567 -6.616 -14.258 1.00 75.40 C ATOM 832 C PRO A 55 8.783 -5.977 -15.399 1.00 13.31 C ATOM 833 O PRO A 55 9.257 -5.039 -16.041 1.00 10.12 O ATOM 834 CB PRO A 55 9.561 -5.705 -13.028 1.00 51.24 C ATOM 835 CG PRO A 55 10.828 -4.927 -13.128 1.00 15.14 C ATOM 836 CD PRO A 55 11.829 -5.846 -13.771 1.00 32.34 C ATOM 0 HA PRO A 55 9.090 -7.582 -14.092 1.00 75.40 H new ATOM 0 HB2 PRO A 55 8.692 -5.048 -13.026 1.00 51.24 H new ATOM 0 HB3 PRO A 55 9.524 -6.285 -12.106 1.00 51.24 H new ATOM 0 HG2 PRO A 55 10.686 -4.026 -13.724 1.00 15.14 H new ATOM 0 HG3 PRO A 55 11.168 -4.607 -12.143 1.00 15.14 H new ATOM 0 HD2 PRO A 55 12.536 -5.298 -14.394 1.00 32.34 H new ATOM 0 HD3 PRO A 55 12.413 -6.387 -13.027 1.00 32.34 H new ATOM 844 N ILE A 56 7.582 -6.489 -15.646 1.00 12.03 N ATOM 845 CA ILE A 56 6.732 -5.966 -16.708 1.00 44.14 C ATOM 846 C ILE A 56 6.428 -4.487 -16.492 1.00 21.55 C ATOM 847 O ILE A 56 6.251 -3.733 -17.448 1.00 3.33 O ATOM 848 CB ILE A 56 5.406 -6.743 -16.803 1.00 0.11 C ATOM 849 CG1 ILE A 56 5.677 -8.231 -17.033 1.00 71.15 C ATOM 850 CG2 ILE A 56 4.539 -6.178 -17.918 1.00 43.32 C ATOM 851 CD1 ILE A 56 4.425 -9.080 -17.035 1.00 11.02 C ATOM 0 H ILE A 56 7.176 -7.266 -15.125 1.00 12.03 H new ATOM 0 HA ILE A 56 7.282 -6.088 -17.641 1.00 44.14 H new ATOM 0 HB ILE A 56 4.869 -6.632 -15.861 1.00 0.11 H new ATOM 0 HG12 ILE A 56 6.192 -8.355 -17.986 1.00 71.15 H new ATOM 0 HG13 ILE A 56 6.351 -8.594 -16.257 1.00 71.15 H new ATOM 0 HG21 ILE A 56 3.605 -6.738 -17.972 1.00 43.32 H new ATOM 0 HG22 ILE A 56 4.322 -5.129 -17.714 1.00 43.32 H new ATOM 0 HG23 ILE A 56 5.068 -6.261 -18.868 1.00 43.32 H new ATOM 0 HD11 ILE A 56 4.693 -10.123 -17.203 1.00 11.02 H new ATOM 0 HD12 ILE A 56 3.920 -8.986 -16.074 1.00 11.02 H new ATOM 0 HD13 ILE A 56 3.759 -8.744 -17.829 1.00 11.02 H new ATOM 863 N SER A 57 6.370 -4.080 -15.228 1.00 24.04 N ATOM 864 CA SER A 57 6.086 -2.692 -14.884 1.00 53.33 C ATOM 865 C SER A 57 7.066 -1.749 -15.576 1.00 73.01 C ATOM 866 O SER A 57 6.745 -0.592 -15.849 1.00 64.02 O ATOM 867 CB SER A 57 6.154 -2.495 -13.369 1.00 5.43 C ATOM 868 OG SER A 57 5.431 -1.343 -12.971 1.00 11.02 O ATOM 0 H SER A 57 6.516 -4.692 -14.425 1.00 24.04 H new ATOM 0 HA SER A 57 5.079 -2.457 -15.228 1.00 53.33 H new ATOM 0 HB2 SER A 57 5.749 -3.374 -12.866 1.00 5.43 H new ATOM 0 HB3 SER A 57 7.194 -2.401 -13.058 1.00 5.43 H new ATOM 0 HG SER A 57 5.489 -1.240 -11.998 1.00 11.02 H new ATOM 874 N LYS A 58 8.263 -2.253 -15.857 1.00 53.43 N ATOM 875 CA LYS A 58 9.291 -1.458 -16.518 1.00 64.43 C ATOM 876 C LYS A 58 9.446 -1.874 -17.978 1.00 32.33 C ATOM 877 O LYS A 58 9.784 -1.057 -18.834 1.00 62.11 O ATOM 878 CB LYS A 58 10.629 -1.610 -15.790 1.00 14.24 C ATOM 879 CG LYS A 58 10.791 -0.663 -14.613 1.00 34.21 C ATOM 880 CD LYS A 58 9.738 -0.914 -13.546 1.00 70.22 C ATOM 881 CE LYS A 58 10.207 -0.443 -12.178 1.00 63.23 C ATOM 882 NZ LYS A 58 9.164 -0.643 -11.135 1.00 20.43 N ATOM 0 H LYS A 58 8.545 -3.208 -15.637 1.00 53.43 H new ATOM 0 HA LYS A 58 8.983 -0.413 -16.486 1.00 64.43 H new ATOM 0 HB2 LYS A 58 10.726 -2.636 -15.436 1.00 14.24 H new ATOM 0 HB3 LYS A 58 11.440 -1.439 -16.498 1.00 14.24 H new ATOM 0 HG2 LYS A 58 11.784 -0.785 -14.181 1.00 34.21 H new ATOM 0 HG3 LYS A 58 10.719 0.367 -14.961 1.00 34.21 H new ATOM 0 HD2 LYS A 58 8.817 -0.397 -13.814 1.00 70.22 H new ATOM 0 HD3 LYS A 58 9.506 -1.978 -13.506 1.00 70.22 H new ATOM 0 HE2 LYS A 58 11.110 -0.985 -11.897 1.00 63.23 H new ATOM 0 HE3 LYS A 58 10.472 0.613 -12.229 1.00 63.23 H new ATOM 0 HZ1 LYS A 58 9.522 -0.310 -10.217 1.00 20.43 H new ATOM 0 HZ2 LYS A 58 8.311 -0.105 -11.390 1.00 20.43 H new ATOM 0 HZ3 LYS A 58 8.929 -1.654 -11.068 1.00 20.43 H new ATOM 896 N VAL A 59 9.194 -3.150 -18.255 1.00 2.22 N ATOM 897 CA VAL A 59 9.303 -3.673 -19.611 1.00 73.42 C ATOM 898 C VAL A 59 8.443 -2.870 -20.581 1.00 4.12 C ATOM 899 O VAL A 59 8.771 -2.748 -21.761 1.00 54.53 O ATOM 900 CB VAL A 59 8.883 -5.154 -19.677 1.00 24.05 C ATOM 901 CG1 VAL A 59 8.974 -5.672 -21.104 1.00 32.33 C ATOM 902 CG2 VAL A 59 9.742 -5.992 -18.741 1.00 35.11 C ATOM 0 H VAL A 59 8.913 -3.840 -17.558 1.00 2.22 H new ATOM 0 HA VAL A 59 10.350 -3.586 -19.900 1.00 73.42 H new ATOM 0 HB VAL A 59 7.846 -5.235 -19.353 1.00 24.05 H new ATOM 0 HG11 VAL A 59 8.674 -6.719 -21.131 1.00 32.33 H new ATOM 0 HG12 VAL A 59 8.314 -5.089 -21.746 1.00 32.33 H new ATOM 0 HG13 VAL A 59 10.000 -5.580 -21.460 1.00 32.33 H new ATOM 0 HG21 VAL A 59 9.432 -7.035 -18.800 1.00 35.11 H new ATOM 0 HG22 VAL A 59 10.789 -5.907 -19.034 1.00 35.11 H new ATOM 0 HG23 VAL A 59 9.621 -5.635 -17.718 1.00 35.11 H new ATOM 912 N ARG A 60 7.343 -2.323 -20.074 1.00 72.53 N ATOM 913 CA ARG A 60 6.435 -1.532 -20.896 1.00 3.31 C ATOM 914 C ARG A 60 7.093 -0.224 -21.327 1.00 0.02 C ATOM 915 O ARG A 60 6.741 0.348 -22.358 1.00 13.34 O ATOM 916 CB ARG A 60 5.145 -1.237 -20.129 1.00 73.42 C ATOM 917 CG ARG A 60 4.382 -2.486 -19.719 1.00 75.32 C ATOM 918 CD ARG A 60 3.505 -3.000 -20.851 1.00 23.33 C ATOM 919 NE ARG A 60 2.455 -2.049 -21.205 1.00 63.12 N ATOM 920 CZ ARG A 60 1.643 -2.205 -22.244 1.00 74.23 C ATOM 921 NH1 ARG A 60 1.758 -3.269 -23.027 1.00 23.33 N ATOM 922 NH2 ARG A 60 0.711 -1.296 -22.502 1.00 43.22 N ATOM 0 H ARG A 60 7.059 -2.413 -19.098 1.00 72.53 H new ATOM 0 HA ARG A 60 6.195 -2.110 -21.788 1.00 3.31 H new ATOM 0 HB2 ARG A 60 5.387 -0.660 -19.237 1.00 73.42 H new ATOM 0 HB3 ARG A 60 4.499 -0.613 -20.747 1.00 73.42 H new ATOM 0 HG2 ARG A 60 5.086 -3.263 -19.422 1.00 75.32 H new ATOM 0 HG3 ARG A 60 3.763 -2.267 -18.849 1.00 75.32 H new ATOM 0 HD2 ARG A 60 4.123 -3.200 -21.726 1.00 23.33 H new ATOM 0 HD3 ARG A 60 3.052 -3.947 -20.557 1.00 23.33 H new ATOM 0 HE ARG A 60 2.339 -1.220 -20.622 1.00 63.12 H new ATOM 0 HH11 ARG A 60 2.472 -3.971 -22.832 1.00 23.33 H new ATOM 0 HH12 ARG A 60 1.132 -3.386 -23.824 1.00 23.33 H new ATOM 0 HH21 ARG A 60 0.618 -0.476 -21.902 1.00 43.22 H new ATOM 0 HH22 ARG A 60 0.088 -1.417 -23.300 1.00 43.22 H new ATOM 936 N GLU A 61 8.049 0.242 -20.530 1.00 4.32 N ATOM 937 CA GLU A 61 8.755 1.483 -20.829 1.00 14.10 C ATOM 938 C GLU A 61 9.963 1.220 -21.722 1.00 65.04 C ATOM 939 O GLU A 61 10.301 2.032 -22.583 1.00 54.13 O ATOM 940 CB GLU A 61 9.202 2.166 -19.535 1.00 0.10 C ATOM 941 CG GLU A 61 8.126 2.202 -18.462 1.00 43.45 C ATOM 942 CD GLU A 61 8.135 3.496 -17.671 1.00 74.03 C ATOM 943 OE1 GLU A 61 9.218 4.103 -17.539 1.00 23.53 O ATOM 944 OE2 GLU A 61 7.059 3.902 -17.185 1.00 34.51 O ATOM 0 H GLU A 61 8.353 -0.220 -19.673 1.00 4.32 H new ATOM 0 HA GLU A 61 8.069 2.142 -21.361 1.00 14.10 H new ATOM 0 HB2 GLU A 61 10.076 1.646 -19.143 1.00 0.10 H new ATOM 0 HB3 GLU A 61 9.512 3.186 -19.761 1.00 0.10 H new ATOM 0 HG2 GLU A 61 7.149 2.072 -18.928 1.00 43.45 H new ATOM 0 HG3 GLU A 61 8.269 1.363 -17.781 1.00 43.45 H new ATOM 951 N MET A 62 10.612 0.079 -21.510 1.00 13.40 N ATOM 952 CA MET A 62 11.783 -0.291 -22.296 1.00 73.51 C ATOM 953 C MET A 62 11.400 -0.558 -23.749 1.00 3.44 C ATOM 954 O MET A 62 12.161 -0.250 -24.666 1.00 1.24 O ATOM 955 CB MET A 62 12.454 -1.530 -21.698 1.00 53.51 C ATOM 956 CG MET A 62 13.960 -1.563 -21.903 1.00 75.30 C ATOM 957 SD MET A 62 14.832 -0.400 -20.837 1.00 52.53 S ATOM 958 CE MET A 62 15.021 0.996 -21.944 1.00 2.23 C ATOM 0 H MET A 62 10.347 -0.604 -20.801 1.00 13.40 H new ATOM 0 HA MET A 62 12.485 0.542 -22.271 1.00 73.51 H new ATOM 0 HB2 MET A 62 12.240 -1.570 -20.630 1.00 53.51 H new ATOM 0 HB3 MET A 62 12.015 -2.422 -22.144 1.00 53.51 H new ATOM 0 HG2 MET A 62 14.327 -2.571 -21.711 1.00 75.30 H new ATOM 0 HG3 MET A 62 14.186 -1.335 -22.945 1.00 75.30 H new ATOM 0 HE1 MET A 62 16.073 1.113 -22.205 1.00 2.23 H new ATOM 0 HE2 MET A 62 14.439 0.824 -22.850 1.00 2.23 H new ATOM 0 HE3 MET A 62 14.666 1.901 -21.452 1.00 2.23 H new ATOM 968 N GLN A 63 10.218 -1.131 -23.949 1.00 62.02 N ATOM 969 CA GLN A 63 9.737 -1.439 -25.291 1.00 11.13 C ATOM 970 C GLN A 63 9.475 -0.161 -26.082 1.00 32.54 C ATOM 971 O GLN A 63 9.605 -0.139 -27.306 1.00 14.53 O ATOM 972 CB GLN A 63 8.460 -2.278 -25.217 1.00 62.32 C ATOM 973 CG GLN A 63 7.329 -1.600 -24.462 1.00 13.10 C ATOM 974 CD GLN A 63 5.998 -2.301 -24.651 1.00 21.31 C ATOM 975 OE1 GLN A 63 5.198 -1.919 -25.505 1.00 35.12 O ATOM 976 NE2 GLN A 63 5.755 -3.334 -23.853 1.00 34.41 N ATOM 0 H GLN A 63 9.576 -1.391 -23.200 1.00 62.02 H new ATOM 0 HA GLN A 63 10.510 -2.010 -25.805 1.00 11.13 H new ATOM 0 HB2 GLN A 63 8.125 -2.505 -26.229 1.00 62.32 H new ATOM 0 HB3 GLN A 63 8.688 -3.229 -24.736 1.00 62.32 H new ATOM 0 HG2 GLN A 63 7.572 -1.571 -23.400 1.00 13.10 H new ATOM 0 HG3 GLN A 63 7.242 -0.567 -24.797 1.00 13.10 H new ATOM 0 HE21 GLN A 63 6.447 -3.616 -23.159 1.00 34.41 H new ATOM 0 HE22 GLN A 63 4.876 -3.846 -23.934 1.00 34.41 H new ATOM 985 N LYS A 64 9.105 0.901 -25.374 1.00 72.24 N ATOM 986 CA LYS A 64 8.825 2.183 -26.009 1.00 11.40 C ATOM 987 C LYS A 64 10.102 3.002 -26.168 1.00 61.00 C ATOM 988 O LYS A 64 10.264 3.733 -27.145 1.00 62.54 O ATOM 989 CB LYS A 64 7.801 2.970 -25.187 1.00 24.12 C ATOM 990 CG LYS A 64 6.753 3.672 -26.032 1.00 35.22 C ATOM 991 CD LYS A 64 5.647 2.719 -26.453 1.00 71.45 C ATOM 992 CE LYS A 64 4.310 3.434 -26.575 1.00 43.31 C ATOM 993 NZ LYS A 64 3.271 2.567 -27.196 1.00 21.12 N ATOM 0 H LYS A 64 8.992 0.899 -24.360 1.00 72.24 H new ATOM 0 HA LYS A 64 8.414 1.987 -26.999 1.00 11.40 H new ATOM 0 HB2 LYS A 64 7.303 2.290 -24.496 1.00 24.12 H new ATOM 0 HB3 LYS A 64 8.325 3.711 -24.583 1.00 24.12 H new ATOM 0 HG2 LYS A 64 6.325 4.501 -25.468 1.00 35.22 H new ATOM 0 HG3 LYS A 64 7.224 4.098 -26.918 1.00 35.22 H new ATOM 0 HD2 LYS A 64 5.904 2.261 -27.408 1.00 71.45 H new ATOM 0 HD3 LYS A 64 5.564 1.912 -25.725 1.00 71.45 H new ATOM 0 HE2 LYS A 64 3.976 3.750 -25.587 1.00 43.31 H new ATOM 0 HE3 LYS A 64 4.434 4.337 -27.173 1.00 43.31 H new ATOM 0 HZ1 LYS A 64 2.375 3.091 -27.261 1.00 21.12 H new ATOM 0 HZ2 LYS A 64 3.578 2.286 -28.149 1.00 21.12 H new ATOM 0 HZ3 LYS A 64 3.133 1.717 -26.612 1.00 21.12 H new ATOM 1007 N TRP A 65 11.005 2.874 -25.203 1.00 63.40 N ATOM 1008 CA TRP A 65 12.269 3.601 -25.238 1.00 21.04 C ATOM 1009 C TRP A 65 13.135 3.133 -26.402 1.00 54.45 C ATOM 1010 O TRP A 65 14.000 3.868 -26.880 1.00 51.52 O ATOM 1011 CB TRP A 65 13.023 3.417 -23.920 1.00 23.03 C ATOM 1012 CG TRP A 65 12.869 4.575 -22.980 1.00 62.35 C ATOM 1013 CD1 TRP A 65 11.814 4.821 -22.150 1.00 13.24 C ATOM 1014 CD2 TRP A 65 13.800 5.644 -22.778 1.00 31.30 C ATOM 1015 NE1 TRP A 65 12.032 5.979 -21.443 1.00 2.12 N ATOM 1016 CE2 TRP A 65 13.244 6.502 -21.809 1.00 51.24 C ATOM 1017 CE3 TRP A 65 15.049 5.958 -23.319 1.00 4.12 C ATOM 1018 CZ2 TRP A 65 13.895 7.653 -21.373 1.00 41.05 C ATOM 1019 CZ3 TRP A 65 15.694 7.101 -22.885 1.00 63.23 C ATOM 1020 CH2 TRP A 65 15.117 7.937 -21.920 1.00 62.40 C ATOM 0 H TRP A 65 10.886 2.274 -24.387 1.00 63.40 H new ATOM 0 HA TRP A 65 12.047 4.659 -25.378 1.00 21.04 H new ATOM 0 HB2 TRP A 65 12.667 2.511 -23.430 1.00 23.03 H new ATOM 0 HB3 TRP A 65 14.082 3.270 -24.133 1.00 23.03 H new ATOM 0 HD1 TRP A 65 10.937 4.197 -22.062 1.00 13.24 H new ATOM 0 HE1 TRP A 65 11.395 6.383 -20.757 1.00 2.12 H new ATOM 0 HE3 TRP A 65 15.502 5.319 -24.063 1.00 4.12 H new ATOM 0 HZ2 TRP A 65 13.451 8.299 -20.630 1.00 41.05 H new ATOM 0 HZ3 TRP A 65 16.660 7.354 -23.297 1.00 63.23 H new ATOM 0 HH2 TRP A 65 15.647 8.823 -21.602 1.00 62.40 H new ATOM 1031 N LEU A 66 12.896 1.908 -26.856 1.00 64.21 N ATOM 1032 CA LEU A 66 13.655 1.342 -27.967 1.00 12.25 C ATOM 1033 C LEU A 66 12.839 1.373 -29.255 1.00 33.32 C ATOM 1034 O LEU A 66 13.392 1.320 -30.352 1.00 64.54 O ATOM 1035 CB LEU A 66 14.070 -0.095 -27.647 1.00 4.24 C ATOM 1036 CG LEU A 66 15.367 -0.257 -26.852 1.00 71.44 C ATOM 1037 CD1 LEU A 66 15.528 -1.695 -26.382 1.00 41.31 C ATOM 1038 CD2 LEU A 66 16.563 0.169 -27.691 1.00 61.51 C ATOM 0 H LEU A 66 12.183 1.287 -26.473 1.00 64.21 H new ATOM 0 HA LEU A 66 14.549 1.948 -28.110 1.00 12.25 H new ATOM 0 HB2 LEU A 66 13.263 -0.569 -27.088 1.00 4.24 H new ATOM 0 HB3 LEU A 66 14.172 -0.640 -28.585 1.00 4.24 H new ATOM 0 HG LEU A 66 15.316 0.387 -25.974 1.00 71.44 H new ATOM 0 HD11 LEU A 66 16.456 -1.792 -25.818 1.00 41.31 H new ATOM 0 HD12 LEU A 66 14.686 -1.966 -25.745 1.00 41.31 H new ATOM 0 HD13 LEU A 66 15.557 -2.359 -27.246 1.00 41.31 H new ATOM 0 HD21 LEU A 66 17.477 0.047 -27.110 1.00 61.51 H new ATOM 0 HD22 LEU A 66 16.618 -0.449 -28.587 1.00 61.51 H new ATOM 0 HD23 LEU A 66 16.452 1.215 -27.978 1.00 61.51 H new ATOM 1050 N GLU A 67 11.520 1.461 -29.112 1.00 71.30 N ATOM 1051 CA GLU A 67 10.628 1.500 -30.265 1.00 63.12 C ATOM 1052 C GLU A 67 10.984 2.661 -31.189 1.00 0.43 C ATOM 1053 O GLU A 67 11.177 2.478 -32.391 1.00 61.21 O ATOM 1054 CB GLU A 67 9.173 1.624 -29.809 1.00 2.13 C ATOM 1055 CG GLU A 67 8.200 1.890 -30.945 1.00 35.34 C ATOM 1056 CD GLU A 67 6.815 1.338 -30.667 1.00 73.20 C ATOM 1057 OE1 GLU A 67 6.327 1.502 -29.529 1.00 62.52 O ATOM 1058 OE2 GLU A 67 6.219 0.742 -31.589 1.00 15.03 O ATOM 0 H GLU A 67 11.046 1.507 -28.210 1.00 71.30 H new ATOM 0 HA GLU A 67 10.749 0.568 -30.817 1.00 63.12 H new ATOM 0 HB2 GLU A 67 8.881 0.706 -29.299 1.00 2.13 H new ATOM 0 HB3 GLU A 67 9.097 2.431 -29.080 1.00 2.13 H new ATOM 0 HG2 GLU A 67 8.131 2.964 -31.116 1.00 35.34 H new ATOM 0 HG3 GLU A 67 8.587 1.445 -31.862 1.00 35.34 H new ATOM 1065 N THR A 68 11.069 3.859 -30.618 1.00 54.20 N ATOM 1066 CA THR A 68 11.399 5.051 -31.388 1.00 51.45 C ATOM 1067 C THR A 68 12.528 5.836 -30.730 1.00 54.30 C ATOM 1068 O THR A 68 13.432 6.326 -31.406 1.00 43.42 O ATOM 1069 CB THR A 68 10.175 5.972 -31.551 1.00 0.42 C ATOM 1070 OG1 THR A 68 10.580 7.234 -32.094 1.00 11.14 O ATOM 1071 CG2 THR A 68 9.480 6.189 -30.215 1.00 72.11 C ATOM 0 H THR A 68 10.914 4.029 -29.624 1.00 54.20 H new ATOM 0 HA THR A 68 11.722 4.712 -32.372 1.00 51.45 H new ATOM 0 HB THR A 68 9.474 5.491 -32.234 1.00 0.42 H new ATOM 0 HG1 THR A 68 9.796 7.813 -32.196 1.00 11.14 H new ATOM 0 HG21 THR A 68 8.619 6.842 -30.355 1.00 72.11 H new ATOM 0 HG22 THR A 68 9.147 5.230 -29.818 1.00 72.11 H new ATOM 0 HG23 THR A 68 10.175 6.650 -29.514 1.00 72.11 H new ATOM 1079 N ARG A 69 12.469 5.951 -29.407 1.00 51.53 N ATOM 1080 CA ARG A 69 13.487 6.678 -28.658 1.00 33.23 C ATOM 1081 C ARG A 69 14.873 6.095 -28.918 1.00 52.40 C ATOM 1082 O ARG A 69 15.010 4.921 -29.258 1.00 41.25 O ATOM 1083 CB ARG A 69 13.176 6.634 -27.160 1.00 62.34 C ATOM 1084 CG ARG A 69 12.360 7.819 -26.672 1.00 52.24 C ATOM 1085 CD ARG A 69 11.057 7.954 -27.445 1.00 32.02 C ATOM 1086 NE ARG A 69 10.103 8.825 -26.762 1.00 65.23 N ATOM 1087 CZ ARG A 69 9.067 9.396 -27.366 1.00 20.31 C ATOM 1088 NH1 ARG A 69 8.851 9.188 -28.658 1.00 1.45 N ATOM 1089 NH2 ARG A 69 8.244 10.176 -26.677 1.00 74.51 N ATOM 0 H ARG A 69 11.728 5.550 -28.832 1.00 51.53 H new ATOM 0 HA ARG A 69 13.479 7.715 -28.994 1.00 33.23 H new ATOM 0 HB2 ARG A 69 12.635 5.715 -26.937 1.00 62.34 H new ATOM 0 HB3 ARG A 69 14.113 6.595 -26.604 1.00 62.34 H new ATOM 0 HG2 ARG A 69 12.144 7.701 -25.610 1.00 52.24 H new ATOM 0 HG3 ARG A 69 12.944 8.733 -26.779 1.00 52.24 H new ATOM 0 HD2 ARG A 69 11.264 8.352 -28.438 1.00 32.02 H new ATOM 0 HD3 ARG A 69 10.613 6.968 -27.583 1.00 32.02 H new ATOM 0 HE ARG A 69 10.240 9.004 -25.767 1.00 65.23 H new ATOM 0 HH11 ARG A 69 9.481 8.588 -29.190 1.00 1.45 H new ATOM 0 HH12 ARG A 69 8.055 9.628 -29.119 1.00 1.45 H new ATOM 0 HH21 ARG A 69 8.407 10.337 -25.683 1.00 74.51 H new ATOM 0 HH22 ARG A 69 7.449 10.614 -27.141 1.00 74.51 H new ATOM 1103 N GLY A 70 15.898 6.926 -28.756 1.00 3.12 N ATOM 1104 CA GLY A 70 17.260 6.476 -28.978 1.00 30.10 C ATOM 1105 C GLY A 70 18.253 7.621 -29.002 1.00 54.33 C ATOM 1106 O GLY A 70 17.866 8.788 -28.932 1.00 64.12 O ATOM 0 H GLY A 70 15.810 7.903 -28.475 1.00 3.12 H new ATOM 0 HA2 GLY A 70 17.540 5.773 -28.193 1.00 30.10 H new ATOM 0 HA3 GLY A 70 17.311 5.935 -29.923 1.00 30.10 H new ATOM 1110 N SER A 71 19.536 7.288 -29.100 1.00 53.32 N ATOM 1111 CA SER A 71 20.587 8.298 -29.128 1.00 4.03 C ATOM 1112 C SER A 71 20.441 9.202 -30.348 1.00 71.11 C ATOM 1113 O SER A 71 19.783 8.860 -31.331 1.00 32.54 O ATOM 1114 CB SER A 71 21.964 7.631 -29.135 1.00 61.35 C ATOM 1115 OG SER A 71 21.849 6.223 -29.023 1.00 21.23 O ATOM 0 H SER A 71 19.872 6.327 -29.161 1.00 53.32 H new ATOM 0 HA SER A 71 20.492 8.910 -28.231 1.00 4.03 H new ATOM 0 HB2 SER A 71 22.489 7.884 -30.056 1.00 61.35 H new ATOM 0 HB3 SER A 71 22.563 8.017 -28.310 1.00 61.35 H new ATOM 0 HG SER A 71 21.523 5.992 -28.128 1.00 21.23 H new ATOM 1121 N PRO A 72 21.069 10.385 -30.286 1.00 1.34 N ATOM 1122 CA PRO A 72 21.025 11.364 -31.376 1.00 72.34 C ATOM 1123 C PRO A 72 21.807 10.902 -32.601 1.00 44.30 C ATOM 1124 O PRO A 72 21.586 11.388 -33.709 1.00 55.54 O ATOM 1125 CB PRO A 72 21.674 12.607 -30.764 1.00 41.21 C ATOM 1126 CG PRO A 72 22.560 12.081 -29.688 1.00 11.21 C ATOM 1127 CD PRO A 72 21.872 10.859 -29.145 1.00 55.34 C ATOM 0 HA PRO A 72 20.009 11.530 -31.734 1.00 72.34 H new ATOM 0 HB2 PRO A 72 22.243 13.164 -31.509 1.00 41.21 H new ATOM 0 HB3 PRO A 72 20.924 13.288 -30.362 1.00 41.21 H new ATOM 0 HG2 PRO A 72 23.546 11.832 -30.081 1.00 11.21 H new ATOM 0 HG3 PRO A 72 22.708 12.825 -28.906 1.00 11.21 H new ATOM 0 HD2 PRO A 72 22.589 10.106 -28.818 1.00 55.34 H new ATOM 0 HD3 PRO A 72 21.246 11.099 -28.285 1.00 55.34 H new ATOM 1135 N GLU A 73 22.723 9.961 -32.393 1.00 0.24 N ATOM 1136 CA GLU A 73 23.538 9.435 -33.481 1.00 43.32 C ATOM 1137 C GLU A 73 22.738 8.457 -34.336 1.00 65.24 C ATOM 1138 O GLU A 73 22.734 8.549 -35.564 1.00 21.41 O ATOM 1139 CB GLU A 73 24.785 8.743 -32.926 1.00 0.40 C ATOM 1140 CG GLU A 73 25.998 8.854 -33.835 1.00 31.45 C ATOM 1141 CD GLU A 73 27.306 8.693 -33.084 1.00 34.01 C ATOM 1142 OE1 GLU A 73 27.333 8.989 -31.871 1.00 11.21 O ATOM 1143 OE2 GLU A 73 28.301 8.272 -33.709 1.00 22.32 O ATOM 0 H GLU A 73 22.919 9.548 -31.481 1.00 0.24 H new ATOM 0 HA GLU A 73 23.845 10.272 -34.108 1.00 43.32 H new ATOM 0 HB2 GLU A 73 25.028 9.175 -31.955 1.00 0.40 H new ATOM 0 HB3 GLU A 73 24.562 7.689 -32.759 1.00 0.40 H new ATOM 0 HG2 GLU A 73 25.935 8.094 -34.614 1.00 31.45 H new ATOM 0 HG3 GLU A 73 25.986 9.823 -34.334 1.00 31.45 H new ATOM 1150 N SER A 74 22.063 7.520 -33.678 1.00 62.03 N ATOM 1151 CA SER A 74 21.263 6.521 -34.377 1.00 40.22 C ATOM 1152 C SER A 74 19.809 6.969 -34.485 1.00 75.14 C ATOM 1153 O SER A 74 19.416 7.986 -33.912 1.00 74.34 O ATOM 1154 CB SER A 74 21.342 5.176 -33.653 1.00 32.10 C ATOM 1155 OG SER A 74 22.635 4.961 -33.115 1.00 0.53 O ATOM 0 H SER A 74 22.054 7.432 -32.662 1.00 62.03 H new ATOM 0 HA SER A 74 21.666 6.408 -35.383 1.00 40.22 H new ATOM 0 HB2 SER A 74 20.602 5.146 -32.853 1.00 32.10 H new ATOM 0 HB3 SER A 74 21.095 4.372 -34.346 1.00 32.10 H new ATOM 0 HG SER A 74 22.631 5.173 -32.158 1.00 0.53 H new ATOM 1161 N HIS A 75 19.013 6.202 -35.225 1.00 3.22 N ATOM 1162 CA HIS A 75 17.601 6.519 -35.409 1.00 23.53 C ATOM 1163 C HIS A 75 16.798 5.259 -35.720 1.00 5.00 C ATOM 1164 O HIS A 75 17.154 4.490 -36.613 1.00 64.32 O ATOM 1165 CB HIS A 75 17.428 7.539 -36.534 1.00 10.01 C ATOM 1166 CG HIS A 75 17.691 8.951 -36.108 1.00 33.30 C ATOM 1167 ND1 HIS A 75 18.832 9.642 -36.456 1.00 70.21 N ATOM 1168 CD2 HIS A 75 16.951 9.802 -35.360 1.00 33.14 C ATOM 1169 CE1 HIS A 75 18.784 10.856 -35.939 1.00 15.43 C ATOM 1170 NE2 HIS A 75 17.652 10.979 -35.269 1.00 13.20 N ATOM 0 H HIS A 75 19.322 5.357 -35.706 1.00 3.22 H new ATOM 0 HA HIS A 75 17.226 6.948 -34.480 1.00 23.53 H new ATOM 0 HB2 HIS A 75 18.102 7.283 -37.352 1.00 10.01 H new ATOM 0 HB3 HIS A 75 16.413 7.469 -36.924 1.00 10.01 H new ATOM 0 HD2 HIS A 75 15.988 9.594 -34.917 1.00 33.14 H new ATOM 0 HE1 HIS A 75 19.541 11.619 -36.046 1.00 15.43 H new ATOM 0 HE2 HIS A 75 17.348 11.813 -34.766 1.00 13.20 H new ATOM 1178 N ILE A 76 15.716 5.055 -34.978 1.00 14.05 N ATOM 1179 CA ILE A 76 14.863 3.889 -35.175 1.00 41.31 C ATOM 1180 C ILE A 76 13.613 4.251 -35.970 1.00 31.12 C ATOM 1181 O ILE A 76 12.604 4.671 -35.403 1.00 30.54 O ATOM 1182 CB ILE A 76 14.441 3.266 -33.831 1.00 41.24 C ATOM 1183 CG1 ILE A 76 15.674 2.833 -33.036 1.00 21.22 C ATOM 1184 CG2 ILE A 76 13.512 2.084 -34.064 1.00 51.32 C ATOM 1185 CD1 ILE A 76 15.491 2.930 -31.537 1.00 62.34 C ATOM 0 H ILE A 76 15.408 5.682 -34.234 1.00 14.05 H new ATOM 0 HA ILE A 76 15.449 3.160 -35.735 1.00 41.31 H new ATOM 0 HB ILE A 76 13.904 4.017 -33.252 1.00 41.24 H new ATOM 0 HG12 ILE A 76 15.922 1.804 -33.298 1.00 21.22 H new ATOM 0 HG13 ILE A 76 16.522 3.451 -33.331 1.00 21.22 H new ATOM 0 HG21 ILE A 76 13.222 1.654 -33.105 1.00 51.32 H new ATOM 0 HG22 ILE A 76 12.621 2.420 -34.595 1.00 51.32 H new ATOM 0 HG23 ILE A 76 14.026 1.329 -34.659 1.00 51.32 H new ATOM 0 HD11 ILE A 76 16.404 2.607 -31.037 1.00 62.34 H new ATOM 0 HD12 ILE A 76 15.273 3.962 -31.263 1.00 62.34 H new ATOM 0 HD13 ILE A 76 14.664 2.290 -31.229 1.00 62.34 H new ATOM 1197 N ASP A 77 13.686 4.084 -37.286 1.00 22.24 N ATOM 1198 CA ASP A 77 12.559 4.390 -38.159 1.00 63.32 C ATOM 1199 C ASP A 77 11.399 3.432 -37.906 1.00 25.34 C ATOM 1200 O ASP A 77 10.237 3.776 -38.121 1.00 21.10 O ATOM 1201 CB ASP A 77 12.988 4.314 -39.625 1.00 40.35 C ATOM 1202 CG ASP A 77 11.890 4.755 -40.573 1.00 74.52 C ATOM 1203 OD1 ASP A 77 10.947 3.966 -40.795 1.00 11.51 O ATOM 1204 OD2 ASP A 77 11.973 5.887 -41.094 1.00 22.21 O ATOM 0 H ASP A 77 14.514 3.738 -37.771 1.00 22.24 H new ATOM 0 HA ASP A 77 12.224 5.403 -37.938 1.00 63.32 H new ATOM 0 HB2 ASP A 77 13.868 4.940 -39.776 1.00 40.35 H new ATOM 0 HB3 ASP A 77 13.280 3.291 -39.863 1.00 40.35 H new ATOM 1209 N LYS A 78 11.723 2.227 -37.448 1.00 1.13 N ATOM 1210 CA LYS A 78 10.709 1.218 -37.164 1.00 45.12 C ATOM 1211 C LYS A 78 11.253 0.151 -36.220 1.00 24.22 C ATOM 1212 O LYS A 78 12.464 -0.053 -36.130 1.00 74.20 O ATOM 1213 CB LYS A 78 10.230 0.568 -38.464 1.00 21.21 C ATOM 1214 CG LYS A 78 11.359 0.196 -39.410 1.00 75.40 C ATOM 1215 CD LYS A 78 10.941 -0.907 -40.369 1.00 5.11 C ATOM 1216 CE LYS A 78 12.140 -1.496 -41.096 1.00 44.13 C ATOM 1217 NZ LYS A 78 11.809 -2.790 -41.755 1.00 11.23 N ATOM 0 H LYS A 78 12.680 1.926 -37.266 1.00 1.13 H new ATOM 0 HA LYS A 78 9.866 1.711 -36.679 1.00 45.12 H new ATOM 0 HB2 LYS A 78 9.659 -0.329 -38.223 1.00 21.21 H new ATOM 0 HB3 LYS A 78 9.551 1.252 -38.973 1.00 21.21 H new ATOM 0 HG2 LYS A 78 11.665 1.075 -39.976 1.00 75.40 H new ATOM 0 HG3 LYS A 78 12.225 -0.130 -38.834 1.00 75.40 H new ATOM 0 HD2 LYS A 78 10.425 -1.694 -39.818 1.00 5.11 H new ATOM 0 HD3 LYS A 78 10.232 -0.510 -41.096 1.00 5.11 H new ATOM 0 HE2 LYS A 78 12.495 -0.788 -41.845 1.00 44.13 H new ATOM 0 HE3 LYS A 78 12.955 -1.647 -40.389 1.00 44.13 H new ATOM 0 HZ1 LYS A 78 12.652 -3.159 -42.239 1.00 11.23 H new ATOM 0 HZ2 LYS A 78 11.495 -3.474 -41.038 1.00 11.23 H new ATOM 0 HZ3 LYS A 78 11.048 -2.642 -42.449 1.00 11.23 H new ATOM 1231 N ALA A 79 10.351 -0.528 -35.519 1.00 1.12 N ATOM 1232 CA ALA A 79 10.741 -1.576 -34.584 1.00 71.53 C ATOM 1233 C ALA A 79 9.702 -2.692 -34.547 1.00 30.14 C ATOM 1234 O ALA A 79 8.654 -2.599 -35.184 1.00 42.04 O ATOM 1235 CB ALA A 79 10.944 -0.995 -33.193 1.00 42.22 C ATOM 0 H ALA A 79 9.345 -0.371 -35.581 1.00 1.12 H new ATOM 0 HA ALA A 79 11.683 -2.003 -34.928 1.00 71.53 H new ATOM 0 HB1 ALA A 79 11.235 -1.789 -32.506 1.00 42.22 H new ATOM 0 HB2 ALA A 79 11.728 -0.238 -33.226 1.00 42.22 H new ATOM 0 HB3 ALA A 79 10.015 -0.540 -32.849 1.00 42.22 H new ATOM 1241 N ASN A 80 10.000 -3.747 -33.795 1.00 64.24 N ATOM 1242 CA ASN A 80 9.092 -4.882 -33.676 1.00 0.11 C ATOM 1243 C ASN A 80 9.649 -5.926 -32.713 1.00 1.44 C ATOM 1244 O ASN A 80 10.811 -6.321 -32.812 1.00 50.42 O ATOM 1245 CB ASN A 80 8.851 -5.515 -35.048 1.00 35.13 C ATOM 1246 CG ASN A 80 8.090 -6.824 -34.955 1.00 23.05 C ATOM 1247 OD1 ASN A 80 8.642 -7.895 -35.210 1.00 10.43 O ATOM 1248 ND2 ASN A 80 6.817 -6.743 -34.588 1.00 34.44 N ATOM 0 H ASN A 80 10.863 -3.839 -33.259 1.00 64.24 H new ATOM 0 HA ASN A 80 8.144 -4.517 -33.280 1.00 0.11 H new ATOM 0 HB2 ASN A 80 8.294 -4.818 -35.674 1.00 35.13 H new ATOM 0 HB3 ASN A 80 9.809 -5.689 -35.538 1.00 35.13 H new ATOM 0 HD21 ASN A 80 6.255 -7.590 -34.508 1.00 34.44 H new ATOM 0 HD22 ASN A 80 6.401 -5.834 -34.386 1.00 34.44 H new ATOM 1255 N PHE A 81 8.812 -6.369 -31.780 1.00 41.14 N ATOM 1256 CA PHE A 81 9.220 -7.367 -30.798 1.00 44.44 C ATOM 1257 C PHE A 81 8.967 -8.778 -31.319 1.00 75.24 C ATOM 1258 O PHE A 81 8.360 -8.963 -32.375 1.00 23.51 O ATOM 1259 CB PHE A 81 8.470 -7.154 -29.482 1.00 22.11 C ATOM 1260 CG PHE A 81 6.977 -7.113 -29.643 1.00 3.04 C ATOM 1261 CD1 PHE A 81 6.256 -8.279 -29.839 1.00 60.43 C ATOM 1262 CD2 PHE A 81 6.295 -5.908 -29.597 1.00 45.44 C ATOM 1263 CE1 PHE A 81 4.882 -8.245 -29.987 1.00 61.12 C ATOM 1264 CE2 PHE A 81 4.922 -5.867 -29.744 1.00 72.11 C ATOM 1265 CZ PHE A 81 4.214 -7.037 -29.941 1.00 24.15 C ATOM 0 H PHE A 81 7.847 -6.052 -31.684 1.00 41.14 H new ATOM 0 HA PHE A 81 10.289 -7.251 -30.621 1.00 44.44 H new ATOM 0 HB2 PHE A 81 8.731 -7.955 -28.790 1.00 22.11 H new ATOM 0 HB3 PHE A 81 8.804 -6.221 -29.029 1.00 22.11 H new ATOM 0 HD1 PHE A 81 6.773 -9.226 -29.877 1.00 60.43 H new ATOM 0 HD2 PHE A 81 6.843 -4.990 -29.444 1.00 45.44 H new ATOM 0 HE1 PHE A 81 4.332 -9.162 -30.138 1.00 61.12 H new ATOM 0 HE2 PHE A 81 4.402 -4.921 -29.705 1.00 72.11 H new ATOM 0 HZ PHE A 81 3.141 -7.007 -30.059 1.00 24.15 H new ATOM 1275 N LYS A 82 9.435 -9.771 -30.572 1.00 24.53 N ATOM 1276 CA LYS A 82 9.260 -11.167 -30.955 1.00 70.24 C ATOM 1277 C LYS A 82 8.206 -11.843 -30.084 1.00 54.53 C ATOM 1278 O LYS A 82 7.086 -12.091 -30.529 1.00 52.51 O ATOM 1279 CB LYS A 82 10.588 -11.919 -30.843 1.00 30.33 C ATOM 1280 CG LYS A 82 11.648 -11.431 -31.815 1.00 31.11 C ATOM 1281 CD LYS A 82 11.557 -12.154 -33.148 1.00 60.22 C ATOM 1282 CE LYS A 82 12.476 -11.528 -34.186 1.00 1.12 C ATOM 1283 NZ LYS A 82 11.876 -10.308 -34.794 1.00 60.42 N ATOM 0 H LYS A 82 9.939 -9.635 -29.696 1.00 24.53 H new ATOM 0 HA LYS A 82 8.921 -11.193 -31.991 1.00 70.24 H new ATOM 0 HB2 LYS A 82 10.967 -11.820 -29.826 1.00 30.33 H new ATOM 0 HB3 LYS A 82 10.410 -12.981 -31.015 1.00 30.33 H new ATOM 0 HG2 LYS A 82 11.532 -10.359 -31.973 1.00 31.11 H new ATOM 0 HG3 LYS A 82 12.637 -11.585 -31.383 1.00 31.11 H new ATOM 0 HD2 LYS A 82 11.820 -13.203 -33.013 1.00 60.22 H new ATOM 0 HD3 LYS A 82 10.528 -12.127 -33.508 1.00 60.22 H new ATOM 0 HE2 LYS A 82 13.428 -11.271 -33.721 1.00 1.12 H new ATOM 0 HE3 LYS A 82 12.690 -12.256 -34.968 1.00 1.12 H new ATOM 0 HZ1 LYS A 82 12.533 -9.911 -35.496 1.00 60.42 H new ATOM 0 HZ2 LYS A 82 10.980 -10.557 -35.260 1.00 60.42 H new ATOM 0 HZ3 LYS A 82 11.696 -9.603 -34.051 1.00 60.42 H new ATOM 1297 N ASN A 83 8.572 -12.136 -28.841 1.00 35.13 N ATOM 1298 CA ASN A 83 7.656 -12.782 -27.907 1.00 1.00 C ATOM 1299 C ASN A 83 8.282 -12.892 -26.520 1.00 13.52 C ATOM 1300 O ASN A 83 9.314 -13.537 -26.344 1.00 4.13 O ATOM 1301 CB ASN A 83 7.272 -14.172 -28.417 1.00 33.44 C ATOM 1302 CG ASN A 83 5.940 -14.643 -27.865 1.00 12.33 C ATOM 1303 OD1 ASN A 83 4.886 -14.119 -28.226 1.00 72.34 O ATOM 1304 ND2 ASN A 83 5.982 -15.635 -26.984 1.00 31.34 N ATOM 0 H ASN A 83 9.496 -11.937 -28.457 1.00 35.13 H new ATOM 0 HA ASN A 83 6.758 -12.168 -27.833 1.00 1.00 H new ATOM 0 HB2 ASN A 83 7.226 -14.157 -29.506 1.00 33.44 H new ATOM 0 HB3 ASN A 83 8.049 -14.885 -28.141 1.00 33.44 H new ATOM 0 HD21 ASN A 83 5.118 -15.993 -26.577 1.00 31.34 H new ATOM 0 HD22 ASN A 83 6.879 -16.039 -26.714 1.00 31.34 H new ATOM 1311 N GLU A 84 7.648 -12.257 -25.539 1.00 12.32 N ATOM 1312 CA GLU A 84 8.143 -12.283 -24.167 1.00 71.15 C ATOM 1313 C GLU A 84 7.924 -13.655 -23.536 1.00 71.13 C ATOM 1314 O GLU A 84 7.202 -14.493 -24.078 1.00 45.22 O ATOM 1315 CB GLU A 84 7.448 -11.207 -23.330 1.00 21.40 C ATOM 1316 CG GLU A 84 5.972 -11.479 -23.093 1.00 60.44 C ATOM 1317 CD GLU A 84 5.730 -12.388 -21.904 1.00 74.52 C ATOM 1318 OE1 GLU A 84 6.618 -12.470 -21.030 1.00 15.33 O ATOM 1319 OE2 GLU A 84 4.653 -13.019 -21.848 1.00 40.41 O ATOM 0 H GLU A 84 6.791 -11.719 -25.668 1.00 12.32 H new ATOM 0 HA GLU A 84 9.214 -12.080 -24.190 1.00 71.15 H new ATOM 0 HB2 GLU A 84 7.953 -11.125 -22.367 1.00 21.40 H new ATOM 0 HB3 GLU A 84 7.556 -10.244 -23.829 1.00 21.40 H new ATOM 0 HG2 GLU A 84 5.453 -10.534 -22.934 1.00 60.44 H new ATOM 0 HG3 GLU A 84 5.542 -11.933 -23.986 1.00 60.44 H new ATOM 1326 N LYS A 85 8.552 -13.878 -22.387 1.00 63.10 N ATOM 1327 CA LYS A 85 8.427 -15.147 -21.680 1.00 2.03 C ATOM 1328 C LYS A 85 8.347 -14.924 -20.173 1.00 22.32 C ATOM 1329 O LYS A 85 9.307 -14.469 -19.551 1.00 30.24 O ATOM 1330 CB LYS A 85 9.612 -16.057 -22.009 1.00 65.23 C ATOM 1331 CG LYS A 85 9.457 -17.473 -21.483 1.00 34.40 C ATOM 1332 CD LYS A 85 8.667 -18.343 -22.447 1.00 12.21 C ATOM 1333 CE LYS A 85 8.568 -19.777 -21.951 1.00 64.31 C ATOM 1334 NZ LYS A 85 7.537 -20.552 -22.696 1.00 24.03 N ATOM 0 H LYS A 85 9.153 -13.196 -21.925 1.00 63.10 H new ATOM 0 HA LYS A 85 7.506 -15.628 -22.008 1.00 2.03 H new ATOM 0 HB2 LYS A 85 9.742 -16.093 -23.091 1.00 65.23 H new ATOM 0 HB3 LYS A 85 10.520 -15.621 -21.593 1.00 65.23 H new ATOM 0 HG2 LYS A 85 10.442 -17.911 -21.319 1.00 34.40 H new ATOM 0 HG3 LYS A 85 8.954 -17.450 -20.516 1.00 34.40 H new ATOM 0 HD2 LYS A 85 7.666 -17.931 -22.574 1.00 12.21 H new ATOM 0 HD3 LYS A 85 9.144 -18.328 -23.427 1.00 12.21 H new ATOM 0 HE2 LYS A 85 9.537 -20.266 -22.057 1.00 64.31 H new ATOM 0 HE3 LYS A 85 8.325 -19.778 -20.888 1.00 64.31 H new ATOM 0 HZ1 LYS A 85 7.500 -21.524 -22.328 1.00 24.03 H new ATOM 0 HZ2 LYS A 85 6.608 -20.101 -22.574 1.00 24.03 H new ATOM 0 HZ3 LYS A 85 7.782 -20.573 -23.707 1.00 24.03 H new ATOM 1348 N VAL A 86 7.197 -15.249 -19.591 1.00 71.53 N ATOM 1349 CA VAL A 86 6.993 -15.087 -18.157 1.00 32.42 C ATOM 1350 C VAL A 86 7.904 -16.018 -17.364 1.00 12.54 C ATOM 1351 O VAL A 86 7.648 -17.218 -17.266 1.00 22.13 O ATOM 1352 CB VAL A 86 5.529 -15.362 -17.764 1.00 22.05 C ATOM 1353 CG1 VAL A 86 5.293 -15.008 -16.303 1.00 61.31 C ATOM 1354 CG2 VAL A 86 4.581 -14.589 -18.668 1.00 30.12 C ATOM 0 H VAL A 86 6.392 -15.626 -20.091 1.00 71.53 H new ATOM 0 HA VAL A 86 7.238 -14.052 -17.917 1.00 32.42 H new ATOM 0 HB VAL A 86 5.330 -16.426 -17.892 1.00 22.05 H new ATOM 0 HG11 VAL A 86 4.254 -15.209 -16.043 1.00 61.31 H new ATOM 0 HG12 VAL A 86 5.947 -15.610 -15.672 1.00 61.31 H new ATOM 0 HG13 VAL A 86 5.509 -13.951 -16.145 1.00 61.31 H new ATOM 0 HG21 VAL A 86 3.551 -14.795 -18.376 1.00 30.12 H new ATOM 0 HG22 VAL A 86 4.778 -13.521 -18.574 1.00 30.12 H new ATOM 0 HG23 VAL A 86 4.733 -14.896 -19.703 1.00 30.12 H new ATOM 1364 N ILE A 87 8.967 -15.455 -16.799 1.00 32.24 N ATOM 1365 CA ILE A 87 9.915 -16.234 -16.012 1.00 62.22 C ATOM 1366 C ILE A 87 9.722 -15.991 -14.519 1.00 73.33 C ATOM 1367 O ILE A 87 9.072 -15.026 -14.115 1.00 73.12 O ATOM 1368 CB ILE A 87 11.370 -15.899 -16.391 1.00 71.21 C ATOM 1369 CG1 ILE A 87 11.611 -14.391 -16.293 1.00 22.53 C ATOM 1370 CG2 ILE A 87 11.681 -16.400 -17.794 1.00 32.45 C ATOM 1371 CD1 ILE A 87 13.038 -13.987 -16.591 1.00 71.23 C ATOM 0 H ILE A 87 9.193 -14.463 -16.872 1.00 32.24 H new ATOM 0 HA ILE A 87 9.722 -17.283 -16.234 1.00 62.22 H new ATOM 0 HB ILE A 87 12.037 -16.401 -15.691 1.00 71.21 H new ATOM 0 HG12 ILE A 87 10.944 -13.879 -16.987 1.00 22.53 H new ATOM 0 HG13 ILE A 87 11.348 -14.054 -15.290 1.00 22.53 H new ATOM 0 HG21 ILE A 87 12.713 -16.156 -18.047 1.00 32.45 H new ATOM 0 HG22 ILE A 87 11.544 -17.481 -17.833 1.00 32.45 H new ATOM 0 HG23 ILE A 87 11.010 -15.923 -18.508 1.00 32.45 H new ATOM 0 HD11 ILE A 87 13.136 -12.905 -16.503 1.00 71.23 H new ATOM 0 HD12 ILE A 87 13.709 -14.471 -15.881 1.00 71.23 H new ATOM 0 HD13 ILE A 87 13.299 -14.294 -17.604 1.00 71.23 H new ATOM 1383 N LEU A 88 10.291 -16.872 -13.704 1.00 3.43 N ATOM 1384 CA LEU A 88 10.184 -16.752 -12.254 1.00 34.53 C ATOM 1385 C LEU A 88 11.373 -15.988 -11.680 1.00 74.04 C ATOM 1386 O LEU A 88 11.258 -15.321 -10.652 1.00 25.33 O ATOM 1387 CB LEU A 88 10.097 -18.139 -11.613 1.00 45.03 C ATOM 1388 CG LEU A 88 8.704 -18.764 -11.552 1.00 35.42 C ATOM 1389 CD1 LEU A 88 8.157 -18.990 -12.953 1.00 43.01 C ATOM 1390 CD2 LEU A 88 8.740 -20.072 -10.775 1.00 34.25 C ATOM 0 H LEU A 88 10.831 -17.677 -14.022 1.00 3.43 H new ATOM 0 HA LEU A 88 9.275 -16.195 -12.027 1.00 34.53 H new ATOM 0 HB2 LEU A 88 10.752 -18.814 -12.164 1.00 45.03 H new ATOM 0 HB3 LEU A 88 10.489 -18.073 -10.598 1.00 45.03 H new ATOM 0 HG LEU A 88 8.040 -18.073 -11.032 1.00 35.42 H new ATOM 0 HD11 LEU A 88 7.164 -19.436 -12.889 1.00 43.01 H new ATOM 0 HD12 LEU A 88 8.093 -18.036 -13.477 1.00 43.01 H new ATOM 0 HD13 LEU A 88 8.821 -19.660 -13.499 1.00 43.01 H new ATOM 0 HD21 LEU A 88 7.739 -20.503 -10.742 1.00 34.25 H new ATOM 0 HD22 LEU A 88 9.419 -20.769 -11.267 1.00 34.25 H new ATOM 0 HD23 LEU A 88 9.087 -19.882 -9.759 1.00 34.25 H new ATOM 1402 N LYS A 89 12.514 -16.087 -12.354 1.00 34.41 N ATOM 1403 CA LYS A 89 13.724 -15.403 -11.915 1.00 31.02 C ATOM 1404 C LYS A 89 14.605 -15.037 -13.105 1.00 75.34 C ATOM 1405 O LYS A 89 14.695 -15.788 -14.078 1.00 21.45 O ATOM 1406 CB LYS A 89 14.507 -16.284 -10.939 1.00 62.11 C ATOM 1407 CG LYS A 89 15.128 -17.508 -11.589 1.00 64.22 C ATOM 1408 CD LYS A 89 15.463 -18.576 -10.562 1.00 33.35 C ATOM 1409 CE LYS A 89 16.717 -18.223 -9.778 1.00 5.41 C ATOM 1410 NZ LYS A 89 16.413 -17.357 -8.605 1.00 44.32 N ATOM 0 H LYS A 89 12.626 -16.635 -13.207 1.00 34.41 H new ATOM 0 HA LYS A 89 13.428 -14.484 -11.409 1.00 31.02 H new ATOM 0 HB2 LYS A 89 15.295 -15.689 -10.477 1.00 62.11 H new ATOM 0 HB3 LYS A 89 13.841 -16.606 -10.139 1.00 62.11 H new ATOM 0 HG2 LYS A 89 14.440 -17.917 -12.329 1.00 64.22 H new ATOM 0 HG3 LYS A 89 16.033 -17.218 -12.122 1.00 64.22 H new ATOM 0 HD2 LYS A 89 14.625 -18.697 -9.875 1.00 33.35 H new ATOM 0 HD3 LYS A 89 15.604 -19.533 -11.064 1.00 33.35 H new ATOM 0 HE2 LYS A 89 17.202 -19.138 -9.438 1.00 5.41 H new ATOM 0 HE3 LYS A 89 17.423 -17.712 -10.433 1.00 5.41 H new ATOM 0 HZ1 LYS A 89 16.912 -16.450 -8.705 1.00 44.32 H new ATOM 0 HZ2 LYS A 89 15.388 -17.185 -8.556 1.00 44.32 H new ATOM 0 HZ3 LYS A 89 16.727 -17.830 -7.734 1.00 44.32 H new ATOM 1424 N LEU A 90 15.253 -13.881 -13.023 1.00 12.24 N ATOM 1425 CA LEU A 90 16.128 -13.416 -14.093 1.00 63.20 C ATOM 1426 C LEU A 90 17.386 -14.275 -14.180 1.00 34.42 C ATOM 1427 O LEU A 90 17.650 -15.097 -13.302 1.00 1.45 O ATOM 1428 CB LEU A 90 16.512 -11.953 -13.866 1.00 55.22 C ATOM 1429 CG LEU A 90 15.374 -11.017 -13.454 1.00 25.33 C ATOM 1430 CD1 LEU A 90 15.866 -9.580 -13.378 1.00 24.33 C ATOM 1431 CD2 LEU A 90 14.209 -11.133 -14.425 1.00 62.54 C ATOM 0 H LEU A 90 15.189 -13.248 -12.226 1.00 12.24 H new ATOM 0 HA LEU A 90 15.585 -13.501 -15.034 1.00 63.20 H new ATOM 0 HB2 LEU A 90 17.283 -11.916 -13.097 1.00 55.22 H new ATOM 0 HB3 LEU A 90 16.958 -11.569 -14.783 1.00 55.22 H new ATOM 0 HG LEU A 90 15.026 -11.313 -12.464 1.00 25.33 H new ATOM 0 HD11 LEU A 90 15.043 -8.929 -13.084 1.00 24.33 H new ATOM 0 HD12 LEU A 90 16.667 -9.508 -12.642 1.00 24.33 H new ATOM 0 HD13 LEU A 90 16.241 -9.272 -14.354 1.00 24.33 H new ATOM 0 HD21 LEU A 90 13.409 -10.460 -14.116 1.00 62.54 H new ATOM 0 HD22 LEU A 90 14.543 -10.864 -15.427 1.00 62.54 H new ATOM 0 HD23 LEU A 90 13.839 -12.158 -14.429 1.00 62.54 H new ATOM 1443 N ASP A 91 18.158 -14.079 -15.243 1.00 12.13 N ATOM 1444 CA ASP A 91 19.390 -14.833 -15.443 1.00 33.42 C ATOM 1445 C ASP A 91 20.595 -13.900 -15.501 1.00 60.14 C ATOM 1446 O ASP A 91 21.606 -14.214 -16.131 1.00 12.14 O ATOM 1447 CB ASP A 91 19.305 -15.658 -16.728 1.00 33.21 C ATOM 1448 CG ASP A 91 18.435 -16.890 -16.569 1.00 1.11 C ATOM 1449 OD1 ASP A 91 17.862 -17.075 -15.474 1.00 44.05 O ATOM 1450 OD2 ASP A 91 18.327 -17.668 -17.539 1.00 74.22 O ATOM 0 H ASP A 91 17.952 -13.404 -15.980 1.00 12.13 H new ATOM 0 HA ASP A 91 19.516 -15.507 -14.596 1.00 33.42 H new ATOM 0 HB2 ASP A 91 18.906 -15.036 -17.530 1.00 33.21 H new ATOM 0 HB3 ASP A 91 20.308 -15.961 -17.029 1.00 33.21 H new ATOM 1455 N TYR A 92 20.480 -12.752 -14.843 1.00 24.32 N ATOM 1456 CA TYR A 92 21.559 -11.772 -14.823 1.00 2.41 C ATOM 1457 C TYR A 92 21.559 -10.988 -13.514 1.00 21.23 C ATOM 1458 O TYR A 92 20.594 -11.032 -12.751 1.00 52.32 O ATOM 1459 CB TYR A 92 21.425 -10.811 -16.005 1.00 51.52 C ATOM 1460 CG TYR A 92 22.147 -11.277 -17.249 1.00 52.44 C ATOM 1461 CD1 TYR A 92 21.525 -12.121 -18.161 1.00 65.04 C ATOM 1462 CD2 TYR A 92 23.450 -10.874 -17.513 1.00 1.44 C ATOM 1463 CE1 TYR A 92 22.181 -12.550 -19.299 1.00 62.11 C ATOM 1464 CE2 TYR A 92 24.113 -11.296 -18.648 1.00 71.44 C ATOM 1465 CZ TYR A 92 23.474 -12.135 -19.538 1.00 45.44 C ATOM 1466 OH TYR A 92 24.132 -12.559 -20.670 1.00 71.23 O ATOM 0 H TYR A 92 19.651 -12.477 -14.317 1.00 24.32 H new ATOM 0 HA TYR A 92 22.504 -12.309 -14.904 1.00 2.41 H new ATOM 0 HB2 TYR A 92 20.368 -10.678 -16.237 1.00 51.52 H new ATOM 0 HB3 TYR A 92 21.813 -9.835 -15.714 1.00 51.52 H new ATOM 0 HD1 TYR A 92 20.512 -12.447 -17.977 1.00 65.04 H new ATOM 0 HD2 TYR A 92 23.953 -10.219 -16.818 1.00 1.44 H new ATOM 0 HE1 TYR A 92 21.684 -13.207 -19.997 1.00 62.11 H new ATOM 0 HE2 TYR A 92 25.125 -10.972 -18.838 1.00 71.44 H new ATOM 0 HH TYR A 92 23.593 -12.347 -21.460 1.00 71.23 H new ATOM 1476 N SER A 93 22.650 -10.271 -13.261 1.00 35.44 N ATOM 1477 CA SER A 93 22.778 -9.480 -12.043 1.00 3.23 C ATOM 1478 C SER A 93 22.660 -7.990 -12.348 1.00 53.22 C ATOM 1479 O SER A 93 22.259 -7.200 -11.493 1.00 42.43 O ATOM 1480 CB SER A 93 24.118 -9.767 -11.362 1.00 33.34 C ATOM 1481 OG SER A 93 24.035 -10.919 -10.540 1.00 2.21 O ATOM 0 H SER A 93 23.457 -10.222 -13.883 1.00 35.44 H new ATOM 0 HA SER A 93 21.968 -9.761 -11.370 1.00 3.23 H new ATOM 0 HB2 SER A 93 24.890 -9.910 -12.118 1.00 33.34 H new ATOM 0 HB3 SER A 93 24.416 -8.908 -10.761 1.00 33.34 H new ATOM 0 HG SER A 93 24.904 -11.083 -10.117 1.00 2.21 H new ATOM 1487 N ASP A 94 23.011 -7.614 -13.573 1.00 13.21 N ATOM 1488 CA ASP A 94 22.943 -6.219 -13.993 1.00 63.04 C ATOM 1489 C ASP A 94 23.269 -6.083 -15.478 1.00 12.55 C ATOM 1490 O ASP A 94 24.227 -6.677 -15.971 1.00 24.12 O ATOM 1491 CB ASP A 94 23.908 -5.368 -13.167 1.00 10.44 C ATOM 1492 CG ASP A 94 25.355 -5.774 -13.366 1.00 10.14 C ATOM 1493 OD1 ASP A 94 25.788 -6.756 -12.728 1.00 1.25 O ATOM 1494 OD2 ASP A 94 26.055 -5.109 -14.159 1.00 35.33 O ATOM 0 H ASP A 94 23.345 -8.255 -14.292 1.00 13.21 H new ATOM 0 HA ASP A 94 21.926 -5.864 -13.828 1.00 63.04 H new ATOM 0 HB2 ASP A 94 23.787 -4.320 -13.439 1.00 10.44 H new ATOM 0 HB3 ASP A 94 23.651 -5.455 -12.111 1.00 10.44 H new ATOM 1499 N PHE A 95 22.464 -5.297 -16.185 1.00 12.52 N ATOM 1500 CA PHE A 95 22.665 -5.083 -17.613 1.00 72.53 C ATOM 1501 C PHE A 95 24.100 -4.652 -17.902 1.00 73.43 C ATOM 1502 O PHE A 95 24.618 -3.727 -17.278 1.00 33.00 O ATOM 1503 CB PHE A 95 21.688 -4.028 -18.135 1.00 42.35 C ATOM 1504 CG PHE A 95 21.336 -4.202 -19.585 1.00 53.01 C ATOM 1505 CD1 PHE A 95 22.307 -4.089 -20.566 1.00 43.44 C ATOM 1506 CD2 PHE A 95 20.033 -4.480 -19.966 1.00 51.34 C ATOM 1507 CE1 PHE A 95 21.985 -4.248 -21.901 1.00 3.30 C ATOM 1508 CE2 PHE A 95 19.705 -4.640 -21.299 1.00 70.35 C ATOM 1509 CZ PHE A 95 20.683 -4.525 -22.268 1.00 31.21 C ATOM 0 H PHE A 95 21.666 -4.798 -15.792 1.00 12.52 H new ATOM 0 HA PHE A 95 22.478 -6.026 -18.126 1.00 72.53 H new ATOM 0 HB2 PHE A 95 20.775 -4.064 -17.541 1.00 42.35 H new ATOM 0 HB3 PHE A 95 22.123 -3.039 -17.991 1.00 42.35 H new ATOM 0 HD1 PHE A 95 23.327 -3.874 -20.285 1.00 43.44 H new ATOM 0 HD2 PHE A 95 19.265 -4.573 -19.213 1.00 51.34 H new ATOM 0 HE1 PHE A 95 22.751 -4.156 -22.656 1.00 3.30 H new ATOM 0 HE2 PHE A 95 18.685 -4.855 -21.583 1.00 70.35 H new ATOM 0 HZ PHE A 95 20.430 -4.651 -23.310 1.00 31.21 H new ATOM 1519 N GLN A 96 24.735 -5.331 -18.852 1.00 41.13 N ATOM 1520 CA GLN A 96 26.110 -5.019 -19.223 1.00 64.12 C ATOM 1521 C GLN A 96 26.241 -4.844 -20.733 1.00 32.34 C ATOM 1522 O GLN A 96 25.265 -4.987 -21.470 1.00 41.32 O ATOM 1523 CB GLN A 96 27.053 -6.123 -18.742 1.00 64.44 C ATOM 1524 CG GLN A 96 27.637 -5.867 -17.362 1.00 74.11 C ATOM 1525 CD GLN A 96 28.836 -4.941 -17.398 1.00 50.42 C ATOM 1526 OE1 GLN A 96 29.753 -5.125 -18.199 1.00 2.41 O ATOM 1527 NE2 GLN A 96 28.835 -3.937 -16.529 1.00 5.03 N ATOM 0 H GLN A 96 24.320 -6.100 -19.378 1.00 41.13 H new ATOM 0 HA GLN A 96 26.385 -4.080 -18.742 1.00 64.12 H new ATOM 0 HB2 GLN A 96 26.513 -7.070 -18.729 1.00 64.44 H new ATOM 0 HB3 GLN A 96 27.868 -6.230 -19.458 1.00 64.44 H new ATOM 0 HG2 GLN A 96 26.868 -5.435 -16.721 1.00 74.11 H new ATOM 0 HG3 GLN A 96 27.929 -6.817 -16.914 1.00 74.11 H new ATOM 0 HE21 GLN A 96 28.054 -3.822 -15.883 1.00 5.03 H new ATOM 0 HE22 GLN A 96 29.615 -3.280 -16.507 1.00 5.03 H new ATOM 1536 N ILE A 97 27.451 -4.535 -21.185 1.00 2.31 N ATOM 1537 CA ILE A 97 27.709 -4.341 -22.607 1.00 35.25 C ATOM 1538 C ILE A 97 28.487 -5.516 -23.189 1.00 44.30 C ATOM 1539 O ILE A 97 29.436 -6.010 -22.579 1.00 14.33 O ATOM 1540 CB ILE A 97 28.493 -3.041 -22.865 1.00 33.11 C ATOM 1541 CG1 ILE A 97 27.786 -1.854 -22.208 1.00 34.14 C ATOM 1542 CG2 ILE A 97 28.653 -2.808 -24.360 1.00 1.53 C ATOM 1543 CD1 ILE A 97 28.545 -0.552 -22.336 1.00 34.01 C ATOM 0 H ILE A 97 28.269 -4.413 -20.588 1.00 2.31 H new ATOM 0 HA ILE A 97 26.738 -4.272 -23.098 1.00 35.25 H new ATOM 0 HB ILE A 97 29.485 -3.138 -22.423 1.00 33.11 H new ATOM 0 HG12 ILE A 97 26.800 -1.736 -22.656 1.00 34.14 H new ATOM 0 HG13 ILE A 97 27.632 -2.073 -21.151 1.00 34.14 H new ATOM 0 HG21 ILE A 97 29.209 -1.886 -24.527 1.00 1.53 H new ATOM 0 HG22 ILE A 97 29.195 -3.644 -24.803 1.00 1.53 H new ATOM 0 HG23 ILE A 97 27.670 -2.728 -24.823 1.00 1.53 H new ATOM 0 HD11 ILE A 97 27.985 0.245 -21.848 1.00 34.01 H new ATOM 0 HD12 ILE A 97 29.522 -0.652 -21.862 1.00 34.01 H new ATOM 0 HD13 ILE A 97 28.676 -0.310 -23.391 1.00 34.01 H new ATOM 1555 N VAL A 98 28.082 -5.958 -24.375 1.00 53.22 N ATOM 1556 CA VAL A 98 28.743 -7.073 -25.043 1.00 1.44 C ATOM 1557 C VAL A 98 30.075 -6.640 -25.645 1.00 60.33 C ATOM 1558 O VAL A 98 30.172 -5.587 -26.275 1.00 73.04 O ATOM 1559 CB VAL A 98 27.858 -7.666 -26.154 1.00 73.44 C ATOM 1560 CG1 VAL A 98 28.574 -8.812 -26.853 1.00 70.00 C ATOM 1561 CG2 VAL A 98 26.525 -8.128 -25.584 1.00 23.40 C ATOM 0 H VAL A 98 27.299 -5.561 -24.894 1.00 53.22 H new ATOM 0 HA VAL A 98 28.921 -7.836 -24.285 1.00 1.44 H new ATOM 0 HB VAL A 98 27.662 -6.888 -26.892 1.00 73.44 H new ATOM 0 HG11 VAL A 98 27.933 -9.219 -27.635 1.00 70.00 H new ATOM 0 HG12 VAL A 98 29.500 -8.446 -27.297 1.00 70.00 H new ATOM 0 HG13 VAL A 98 28.803 -9.594 -26.129 1.00 70.00 H new ATOM 0 HG21 VAL A 98 25.912 -8.544 -26.383 1.00 23.40 H new ATOM 0 HG22 VAL A 98 26.699 -8.891 -24.825 1.00 23.40 H new ATOM 0 HG23 VAL A 98 26.008 -7.280 -25.135 1.00 23.40 H new ATOM 1571 N LYS A 99 31.101 -7.461 -25.448 1.00 43.13 N ATOM 1572 CA LYS A 99 32.429 -7.166 -25.973 1.00 42.14 C ATOM 1573 C LYS A 99 32.867 -8.230 -26.975 1.00 53.54 C ATOM 1574 O LYS A 99 32.892 -7.986 -28.182 1.00 73.42 O ATOM 1575 CB LYS A 99 33.444 -7.078 -24.831 1.00 71.02 C ATOM 1576 CG LYS A 99 33.742 -8.416 -24.178 1.00 35.53 C ATOM 1577 CD LYS A 99 34.806 -8.287 -23.102 1.00 24.05 C ATOM 1578 CE LYS A 99 36.203 -8.480 -23.673 1.00 53.40 C ATOM 1579 NZ LYS A 99 37.256 -8.297 -22.637 1.00 3.33 N ATOM 0 H LYS A 99 31.038 -8.336 -24.928 1.00 43.13 H new ATOM 0 HA LYS A 99 32.384 -6.205 -26.486 1.00 42.14 H new ATOM 0 HB2 LYS A 99 34.373 -6.655 -25.213 1.00 71.02 H new ATOM 0 HB3 LYS A 99 33.068 -6.390 -24.074 1.00 71.02 H new ATOM 0 HG2 LYS A 99 32.829 -8.820 -23.741 1.00 35.53 H new ATOM 0 HG3 LYS A 99 34.074 -9.126 -24.936 1.00 35.53 H new ATOM 0 HD2 LYS A 99 34.735 -7.305 -22.635 1.00 24.05 H new ATOM 0 HD3 LYS A 99 34.626 -9.025 -22.321 1.00 24.05 H new ATOM 0 HE2 LYS A 99 36.285 -9.479 -24.102 1.00 53.40 H new ATOM 0 HE3 LYS A 99 36.365 -7.770 -24.484 1.00 53.40 H new ATOM 0 HZ1 LYS A 99 38.193 -8.437 -23.066 1.00 3.33 H new ATOM 0 HZ2 LYS A 99 37.194 -7.336 -22.245 1.00 3.33 H new ATOM 0 HZ3 LYS A 99 37.117 -8.991 -21.875 1.00 3.33 H new