USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 836 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 1 GLY N :NH3+ 172:sc= -0.0447 (180deg=-0.177) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0155 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -152:sc= -0.0631 (180deg=-0.565) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.0347 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 ASN : amide:sc=-0.000747 K(o=-0.00075,f=-1.2) USER MOD Single : A 16 THR OG1 : rot -170:sc= 0.0903 USER MOD Single : A 22 ASN : amide:sc= -0.615 X(o=-0.62,f=-0.87) USER MOD Single : A 25 CYS SG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0372 X(o=-0.037,f=-0.5) USER MOD Single : A 36 LYS NZ :NH3+ -140:sc= 0.481 (180deg=-0.0143) USER MOD Single : A 41 SER OG : rot 180:sc= -0.0203 USER MOD Single : A 43 HIS : no HD1:sc= -0.135 X(o=-0.13,f=-0.41) USER MOD Single : A 46 THR OG1 : rot 44:sc= 0.011 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 130:sc= -0.4 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -163:sc= -1.08 (180deg=-1.76) USER MOD Single : A 61 SER OG : rot 180:sc= -0.0285 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -106:sc= 0.318 (180deg=-0.78) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0.16) USER MOD Single : A 93 GLN : amide:sc= -0.0469 X(o=-0.047,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.603 -6.279 -6.913 1.00 0.00 N ATOM 2 CA GLY A 1 0.006 -5.123 -6.270 1.00 0.00 C ATOM 3 C GLY A 1 -0.204 -3.969 -7.231 1.00 0.00 C ATOM 4 O GLY A 1 -0.306 -2.816 -6.814 1.00 0.00 O ATOM 0 H1 GLY A 1 0.850 -6.988 -6.193 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.075 -6.691 -7.586 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.462 -5.988 -7.422 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.952 -5.408 -5.834 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.645 -4.797 -5.450 1.00 0.00 H new ATOM 8 N SER A 2 -0.269 -4.281 -8.522 1.00 0.00 N ATOM 9 CA SER A 2 -0.464 -3.261 -9.546 1.00 0.00 C ATOM 10 C SER A 2 -0.982 -3.881 -10.839 1.00 0.00 C ATOM 11 O SER A 2 -0.249 -4.575 -11.545 1.00 0.00 O ATOM 12 CB SER A 2 0.848 -2.519 -9.812 1.00 0.00 C ATOM 13 OG SER A 2 1.941 -3.180 -9.200 1.00 0.00 O ATOM 0 H SER A 2 -0.189 -5.232 -8.883 1.00 0.00 H new ATOM 0 HA SER A 2 -1.207 -2.552 -9.181 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.018 -2.448 -10.886 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.776 -1.500 -9.432 1.00 0.00 H new ATOM 0 HG SER A 2 2.767 -2.687 -9.386 1.00 0.00 H new ATOM 19 N SER A 3 -2.250 -3.627 -11.144 1.00 0.00 N ATOM 20 CA SER A 3 -2.869 -4.163 -12.351 1.00 0.00 C ATOM 21 C SER A 3 -3.672 -3.086 -13.074 1.00 0.00 C ATOM 22 O SER A 3 -4.887 -3.202 -13.229 1.00 0.00 O ATOM 23 CB SER A 3 -3.776 -5.345 -12.002 1.00 0.00 C ATOM 24 OG SER A 3 -3.015 -6.474 -11.611 1.00 0.00 O ATOM 0 H SER A 3 -2.869 -3.053 -10.572 1.00 0.00 H new ATOM 0 HA SER A 3 -2.076 -4.507 -13.015 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.453 -5.062 -11.196 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.394 -5.600 -12.863 1.00 0.00 H new ATOM 0 HG SER A 3 -3.618 -7.215 -11.392 1.00 0.00 H new ATOM 30 N GLY A 4 -2.983 -2.038 -13.514 1.00 0.00 N ATOM 31 CA GLY A 4 -3.648 -0.955 -14.215 1.00 0.00 C ATOM 32 C GLY A 4 -2.725 -0.235 -15.179 1.00 0.00 C ATOM 33 O GLY A 4 -1.807 -0.837 -15.736 1.00 0.00 O ATOM 0 H GLY A 4 -1.977 -1.919 -13.398 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.503 -1.352 -14.763 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.038 -0.242 -13.489 1.00 0.00 H new ATOM 37 N SER A 5 -2.968 1.056 -15.376 1.00 0.00 N ATOM 38 CA SER A 5 -2.155 1.857 -16.284 1.00 0.00 C ATOM 39 C SER A 5 -2.129 1.240 -17.679 1.00 0.00 C ATOM 40 O SER A 5 -2.796 0.239 -17.939 1.00 0.00 O ATOM 41 CB SER A 5 -0.729 1.988 -15.745 1.00 0.00 C ATOM 42 OG SER A 5 -0.253 3.316 -15.877 1.00 0.00 O ATOM 0 H SER A 5 -3.721 1.570 -14.919 1.00 0.00 H new ATOM 0 HA SER A 5 -2.602 2.849 -16.353 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.705 1.693 -14.696 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.070 1.307 -16.283 1.00 0.00 H new ATOM 0 HG SER A 5 0.659 3.373 -15.524 1.00 0.00 H new ATOM 48 N SER A 6 -1.353 1.844 -18.572 1.00 0.00 N ATOM 49 CA SER A 6 -1.241 1.357 -19.942 1.00 0.00 C ATOM 50 C SER A 6 -2.604 1.346 -20.627 1.00 0.00 C ATOM 51 O SER A 6 -3.377 0.400 -20.482 1.00 0.00 O ATOM 52 CB SER A 6 -0.638 -0.049 -19.959 1.00 0.00 C ATOM 53 OG SER A 6 0.759 -0.002 -20.192 1.00 0.00 O ATOM 0 H SER A 6 -0.792 2.672 -18.372 1.00 0.00 H new ATOM 0 HA SER A 6 -0.584 2.033 -20.489 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.835 -0.544 -19.008 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.119 -0.645 -20.734 1.00 0.00 H new ATOM 0 HG SER A 6 1.121 -0.913 -20.196 1.00 0.00 H new ATOM 59 N GLY A 7 -2.892 2.407 -21.376 1.00 0.00 N ATOM 60 CA GLY A 7 -4.162 2.501 -22.073 1.00 0.00 C ATOM 61 C GLY A 7 -4.305 3.797 -22.844 1.00 0.00 C ATOM 62 O GLY A 7 -4.556 3.787 -24.050 1.00 0.00 O ATOM 0 H GLY A 7 -2.269 3.203 -21.512 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.259 1.660 -22.760 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.976 2.419 -21.352 1.00 0.00 H new ATOM 66 N LYS A 8 -4.147 4.919 -22.149 1.00 0.00 N ATOM 67 CA LYS A 8 -4.261 6.230 -22.775 1.00 0.00 C ATOM 68 C LYS A 8 -2.995 6.573 -23.555 1.00 0.00 C ATOM 69 O LYS A 8 -1.883 6.302 -23.101 1.00 0.00 O ATOM 70 CB LYS A 8 -4.526 7.303 -21.716 1.00 0.00 C ATOM 71 CG LYS A 8 -5.844 7.122 -20.984 1.00 0.00 C ATOM 72 CD LYS A 8 -7.030 7.406 -21.891 1.00 0.00 C ATOM 73 CE LYS A 8 -7.747 8.685 -21.486 1.00 0.00 C ATOM 74 NZ LYS A 8 -8.290 8.601 -20.102 1.00 0.00 N ATOM 0 H LYS A 8 -3.939 4.946 -21.151 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.099 6.200 -23.471 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -3.713 7.294 -20.990 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -4.517 8.283 -22.193 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -5.912 6.103 -20.603 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.877 7.788 -20.122 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -6.689 7.490 -22.923 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -7.727 6.569 -21.853 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.057 9.526 -21.555 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.561 8.882 -22.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -9.125 9.216 -20.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -8.562 7.619 -19.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -7.564 8.910 -19.425 1.00 0.00 H new ATOM 88 N TYR A 9 -3.171 7.170 -24.728 1.00 0.00 N ATOM 89 CA TYR A 9 -2.043 7.549 -25.570 1.00 0.00 C ATOM 90 C TYR A 9 -1.134 6.352 -25.832 1.00 0.00 C ATOM 91 O TYR A 9 -1.465 5.217 -25.487 1.00 0.00 O ATOM 92 CB TYR A 9 -1.245 8.676 -24.913 1.00 0.00 C ATOM 93 CG TYR A 9 -2.108 9.796 -24.376 1.00 0.00 C ATOM 94 CD1 TYR A 9 -2.667 10.739 -25.229 1.00 0.00 C ATOM 95 CD2 TYR A 9 -2.364 9.910 -23.015 1.00 0.00 C ATOM 96 CE1 TYR A 9 -3.455 11.764 -24.743 1.00 0.00 C ATOM 97 CE2 TYR A 9 -3.152 10.931 -22.520 1.00 0.00 C ATOM 98 CZ TYR A 9 -3.695 11.855 -23.387 1.00 0.00 C ATOM 99 OH TYR A 9 -4.481 12.874 -22.899 1.00 0.00 O ATOM 0 H TYR A 9 -4.085 7.402 -25.118 1.00 0.00 H new ATOM 0 HA TYR A 9 -2.436 7.900 -26.524 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -0.652 8.262 -24.097 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -0.544 9.085 -25.640 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -2.482 10.670 -26.291 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -1.940 9.188 -22.333 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -3.881 12.490 -25.420 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -3.342 11.005 -21.459 1.00 0.00 H new ATOM 0 HH TYR A 9 -4.552 12.794 -21.925 1.00 0.00 H new ATOM 109 N THR A 10 0.016 6.615 -26.446 1.00 0.00 N ATOM 110 CA THR A 10 0.975 5.561 -26.755 1.00 0.00 C ATOM 111 C THR A 10 1.728 5.119 -25.506 1.00 0.00 C ATOM 112 O THR A 10 1.794 5.851 -24.519 1.00 0.00 O ATOM 113 CB THR A 10 1.991 6.021 -27.818 1.00 0.00 C ATOM 114 OG1 THR A 10 2.820 4.922 -28.212 1.00 0.00 O ATOM 115 CG2 THR A 10 2.858 7.151 -27.284 1.00 0.00 C ATOM 0 H THR A 10 0.306 7.548 -26.739 1.00 0.00 H new ATOM 0 HA THR A 10 0.404 4.719 -27.148 1.00 0.00 H new ATOM 0 HB THR A 10 1.438 6.386 -28.683 1.00 0.00 H new ATOM 0 HG1 THR A 10 3.462 5.223 -28.889 1.00 0.00 H new ATOM 0 HG21 THR A 10 3.568 7.459 -28.052 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.227 7.997 -27.013 1.00 0.00 H new ATOM 0 HG23 THR A 10 3.402 6.808 -26.404 1.00 0.00 H new ATOM 123 N GLN A 11 2.295 3.918 -25.557 1.00 0.00 N ATOM 124 CA GLN A 11 3.044 3.379 -24.428 1.00 0.00 C ATOM 125 C GLN A 11 4.546 3.529 -24.650 1.00 0.00 C ATOM 126 O GLN A 11 4.985 3.976 -25.708 1.00 0.00 O ATOM 127 CB GLN A 11 2.693 1.905 -24.213 1.00 0.00 C ATOM 128 CG GLN A 11 1.344 1.693 -23.547 1.00 0.00 C ATOM 129 CD GLN A 11 0.276 1.239 -24.522 1.00 0.00 C ATOM 130 OE1 GLN A 11 0.169 0.053 -24.835 1.00 0.00 O ATOM 131 NE2 GLN A 11 -0.521 2.183 -25.008 1.00 0.00 N ATOM 0 H GLN A 11 2.250 3.300 -26.367 1.00 0.00 H new ATOM 0 HA GLN A 11 2.768 3.945 -23.538 1.00 0.00 H new ATOM 0 HB2 GLN A 11 2.698 1.395 -25.176 1.00 0.00 H new ATOM 0 HB3 GLN A 11 3.467 1.441 -23.602 1.00 0.00 H new ATOM 0 HG2 GLN A 11 1.447 0.951 -22.755 1.00 0.00 H new ATOM 0 HG3 GLN A 11 1.027 2.622 -23.074 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -0.396 3.154 -24.721 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -1.258 1.938 -25.669 1.00 0.00 H new ATOM 140 N ASN A 12 5.328 3.152 -23.644 1.00 0.00 N ATOM 141 CA ASN A 12 6.781 3.246 -23.729 1.00 0.00 C ATOM 142 C ASN A 12 7.411 1.859 -23.825 1.00 0.00 C ATOM 143 O ASN A 12 6.711 0.848 -23.841 1.00 0.00 O ATOM 144 CB ASN A 12 7.337 3.987 -22.511 1.00 0.00 C ATOM 145 CG ASN A 12 6.520 5.215 -22.159 1.00 0.00 C ATOM 146 OD1 ASN A 12 6.085 5.379 -21.019 1.00 0.00 O ATOM 147 ND2 ASN A 12 6.306 6.085 -23.140 1.00 0.00 N ATOM 0 H ASN A 12 4.980 2.779 -22.761 1.00 0.00 H new ATOM 0 HA ASN A 12 7.032 3.804 -24.631 1.00 0.00 H new ATOM 0 HB2 ASN A 12 7.358 3.311 -21.656 1.00 0.00 H new ATOM 0 HB3 ASN A 12 8.367 4.284 -22.709 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.762 6.929 -22.963 1.00 0.00 H new ATOM 0 HD22 ASN A 12 6.686 5.908 -24.070 1.00 0.00 H new ATOM 154 N ASN A 13 8.738 1.822 -23.890 1.00 0.00 N ATOM 155 CA ASN A 13 9.463 0.560 -23.985 1.00 0.00 C ATOM 156 C ASN A 13 10.076 0.182 -22.640 1.00 0.00 C ATOM 157 O ASN A 13 11.211 -0.289 -22.573 1.00 0.00 O ATOM 158 CB ASN A 13 10.559 0.656 -25.048 1.00 0.00 C ATOM 159 CG ASN A 13 10.001 0.618 -26.458 1.00 0.00 C ATOM 160 OD1 ASN A 13 9.033 1.310 -26.773 1.00 0.00 O ATOM 161 ND2 ASN A 13 10.612 -0.192 -27.314 1.00 0.00 N ATOM 0 H ASN A 13 9.333 2.651 -23.879 1.00 0.00 H new ATOM 0 HA ASN A 13 8.754 -0.216 -24.272 1.00 0.00 H new ATOM 0 HB2 ASN A 13 11.119 1.580 -24.906 1.00 0.00 H new ATOM 0 HB3 ASN A 13 11.262 -0.166 -24.916 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.282 -0.259 -28.277 1.00 0.00 H new ATOM 0 HD22 ASN A 13 11.411 -0.747 -27.009 1.00 0.00 H new ATOM 168 N PHE A 14 9.316 0.391 -21.570 1.00 0.00 N ATOM 169 CA PHE A 14 9.783 0.072 -20.226 1.00 0.00 C ATOM 170 C PHE A 14 8.765 -0.790 -19.486 1.00 0.00 C ATOM 171 O PHE A 14 7.556 -0.623 -19.653 1.00 0.00 O ATOM 172 CB PHE A 14 10.049 1.357 -19.438 1.00 0.00 C ATOM 173 CG PHE A 14 11.215 2.148 -19.959 1.00 0.00 C ATOM 174 CD1 PHE A 14 11.035 3.101 -20.948 1.00 0.00 C ATOM 175 CD2 PHE A 14 12.490 1.939 -19.459 1.00 0.00 C ATOM 176 CE1 PHE A 14 12.105 3.832 -21.429 1.00 0.00 C ATOM 177 CE2 PHE A 14 13.564 2.667 -19.936 1.00 0.00 C ATOM 178 CZ PHE A 14 13.372 3.614 -20.923 1.00 0.00 C ATOM 0 H PHE A 14 8.374 0.780 -21.608 1.00 0.00 H new ATOM 0 HA PHE A 14 10.712 -0.491 -20.315 1.00 0.00 H new ATOM 0 HB2 PHE A 14 9.156 1.981 -19.464 1.00 0.00 H new ATOM 0 HB3 PHE A 14 10.230 1.103 -18.394 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.047 3.275 -21.348 1.00 0.00 H new ATOM 0 HD2 PHE A 14 12.647 1.199 -18.688 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.951 4.573 -22.200 1.00 0.00 H new ATOM 0 HE2 PHE A 14 14.553 2.495 -19.537 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.210 4.183 -21.298 1.00 0.00 H new ATOM 188 N ILE A 15 9.262 -1.712 -18.669 1.00 0.00 N ATOM 189 CA ILE A 15 8.397 -2.600 -17.903 1.00 0.00 C ATOM 190 C ILE A 15 8.916 -2.783 -16.481 1.00 0.00 C ATOM 191 O ILE A 15 10.125 -2.827 -16.250 1.00 0.00 O ATOM 192 CB ILE A 15 8.273 -3.982 -18.573 1.00 0.00 C ATOM 193 CG1 ILE A 15 7.311 -4.871 -17.783 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.640 -4.640 -18.686 1.00 0.00 C ATOM 195 CD1 ILE A 15 7.027 -6.198 -18.453 1.00 0.00 C ATOM 0 H ILE A 15 10.260 -1.864 -18.520 1.00 0.00 H new ATOM 0 HA ILE A 15 7.414 -2.131 -17.871 1.00 0.00 H new ATOM 0 HB ILE A 15 7.872 -3.848 -19.578 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.729 -5.055 -16.793 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.372 -4.338 -17.639 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.536 -5.615 -19.161 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.298 -4.012 -19.287 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.067 -4.765 -17.691 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.338 -6.776 -17.837 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.580 -6.023 -19.432 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.958 -6.752 -18.573 1.00 0.00 H new ATOM 207 N THR A 16 7.995 -2.890 -15.529 1.00 0.00 N ATOM 208 CA THR A 16 8.359 -3.069 -14.129 1.00 0.00 C ATOM 209 C THR A 16 9.052 -4.408 -13.908 1.00 0.00 C ATOM 210 O THR A 16 9.018 -5.286 -14.769 1.00 0.00 O ATOM 211 CB THR A 16 7.124 -2.985 -13.212 1.00 0.00 C ATOM 212 OG1 THR A 16 5.958 -2.681 -13.987 1.00 0.00 O ATOM 213 CG2 THR A 16 7.317 -1.923 -12.140 1.00 0.00 C ATOM 0 H THR A 16 6.990 -2.856 -15.702 1.00 0.00 H new ATOM 0 HA THR A 16 9.046 -2.262 -13.875 1.00 0.00 H new ATOM 0 HB THR A 16 6.994 -3.951 -12.725 1.00 0.00 H new ATOM 0 HG1 THR A 16 5.211 -2.474 -13.387 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.432 -1.882 -11.505 1.00 0.00 H new ATOM 0 HG22 THR A 16 8.188 -2.172 -11.534 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.470 -0.953 -12.612 1.00 0.00 H new ATOM 221 N GLY A 17 9.680 -4.560 -12.746 1.00 0.00 N ATOM 222 CA GLY A 17 10.371 -5.796 -12.432 1.00 0.00 C ATOM 223 C GLY A 17 9.417 -6.941 -12.158 1.00 0.00 C ATOM 224 O GLY A 17 9.351 -7.902 -12.925 1.00 0.00 O ATOM 0 H GLY A 17 9.722 -3.848 -12.016 1.00 0.00 H new ATOM 0 HA2 GLY A 17 11.026 -6.063 -13.262 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.008 -5.641 -11.561 1.00 0.00 H new ATOM 228 N VAL A 18 8.675 -6.841 -11.059 1.00 0.00 N ATOM 229 CA VAL A 18 7.719 -7.877 -10.685 1.00 0.00 C ATOM 230 C VAL A 18 6.765 -8.185 -11.834 1.00 0.00 C ATOM 231 O VAL A 18 6.267 -9.304 -11.957 1.00 0.00 O ATOM 232 CB VAL A 18 6.900 -7.464 -9.448 1.00 0.00 C ATOM 233 CG1 VAL A 18 6.029 -6.257 -9.763 1.00 0.00 C ATOM 234 CG2 VAL A 18 6.053 -8.629 -8.957 1.00 0.00 C ATOM 0 H VAL A 18 8.718 -6.053 -10.412 1.00 0.00 H new ATOM 0 HA VAL A 18 8.296 -8.770 -10.447 1.00 0.00 H new ATOM 0 HB VAL A 18 7.591 -7.186 -8.652 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.458 -5.980 -8.877 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.661 -5.421 -10.064 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.344 -6.504 -10.574 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.481 -8.320 -8.082 1.00 0.00 H new ATOM 0 HG22 VAL A 18 5.369 -8.940 -9.747 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.702 -9.463 -8.690 1.00 0.00 H new ATOM 244 N ARG A 19 6.514 -7.185 -12.672 1.00 0.00 N ATOM 245 CA ARG A 19 5.619 -7.348 -13.811 1.00 0.00 C ATOM 246 C ARG A 19 6.219 -8.299 -14.842 1.00 0.00 C ATOM 247 O ARG A 19 5.511 -9.109 -15.441 1.00 0.00 O ATOM 248 CB ARG A 19 5.330 -5.993 -14.459 1.00 0.00 C ATOM 249 CG ARG A 19 3.988 -5.401 -14.060 1.00 0.00 C ATOM 250 CD ARG A 19 2.885 -5.827 -15.016 1.00 0.00 C ATOM 251 NE ARG A 19 1.656 -6.180 -14.311 1.00 0.00 N ATOM 252 CZ ARG A 19 0.477 -6.309 -14.909 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.368 -6.114 -16.216 1.00 0.00 N ATOM 254 NH2 ARG A 19 -0.597 -6.633 -14.200 1.00 0.00 N ATOM 0 H ARG A 19 6.918 -6.253 -12.584 1.00 0.00 H new ATOM 0 HA ARG A 19 4.684 -7.776 -13.448 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.121 -5.294 -14.188 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.361 -6.104 -15.543 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.736 -5.717 -13.048 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.059 -4.313 -14.046 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.681 -5.018 -15.718 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.224 -6.680 -15.603 1.00 0.00 H new ATOM 0 HE ARG A 19 1.706 -6.336 -13.304 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.191 -5.864 -16.765 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.539 -6.214 -16.673 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -0.518 -6.783 -13.194 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.502 -6.732 -14.661 1.00 0.00 H new ATOM 268 N ALA A 20 7.528 -8.195 -15.044 1.00 0.00 N ATOM 269 CA ALA A 20 8.224 -9.046 -16.001 1.00 0.00 C ATOM 270 C ALA A 20 8.430 -10.449 -15.440 1.00 0.00 C ATOM 271 O ALA A 20 8.456 -11.429 -16.185 1.00 0.00 O ATOM 272 CB ALA A 20 9.560 -8.427 -16.385 1.00 0.00 C ATOM 0 H ALA A 20 8.128 -7.529 -14.557 1.00 0.00 H new ATOM 0 HA ALA A 20 7.605 -9.128 -16.894 1.00 0.00 H new ATOM 0 HB1 ALA A 20 10.068 -9.074 -17.100 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.392 -7.449 -16.836 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.178 -8.314 -15.494 1.00 0.00 H new ATOM 278 N ILE A 21 8.578 -10.538 -14.122 1.00 0.00 N ATOM 279 CA ILE A 21 8.782 -11.821 -13.462 1.00 0.00 C ATOM 280 C ILE A 21 7.507 -12.658 -13.481 1.00 0.00 C ATOM 281 O ILE A 21 7.557 -13.885 -13.415 1.00 0.00 O ATOM 282 CB ILE A 21 9.239 -11.637 -12.003 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.535 -10.825 -11.950 1.00 0.00 C ATOM 284 CG2 ILE A 21 9.428 -12.990 -11.332 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.863 -10.299 -10.570 1.00 0.00 C ATOM 0 H ILE A 21 8.560 -9.737 -13.491 1.00 0.00 H new ATOM 0 HA ILE A 21 9.564 -12.340 -14.017 1.00 0.00 H new ATOM 0 HB ILE A 21 8.467 -11.090 -11.462 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.359 -11.448 -12.298 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.457 -9.985 -12.641 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.751 -12.843 -10.301 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.485 -13.536 -11.342 1.00 0.00 H new ATOM 0 HG23 ILE A 21 10.184 -13.561 -11.871 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.794 -9.734 -10.608 1.00 0.00 H new ATOM 0 HD12 ILE A 21 10.058 -9.649 -10.227 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.974 -11.135 -9.879 1.00 0.00 H new ATOM 297 N ASN A 22 6.365 -11.985 -13.574 1.00 0.00 N ATOM 298 CA ASN A 22 5.076 -12.667 -13.604 1.00 0.00 C ATOM 299 C ASN A 22 4.659 -12.980 -15.038 1.00 0.00 C ATOM 300 O ASN A 22 3.946 -13.951 -15.289 1.00 0.00 O ATOM 301 CB ASN A 22 4.006 -11.809 -12.926 1.00 0.00 C ATOM 302 CG ASN A 22 4.153 -11.787 -11.416 1.00 0.00 C ATOM 303 OD1 ASN A 22 4.464 -12.805 -10.797 1.00 0.00 O ATOM 304 ND2 ASN A 22 3.930 -10.623 -10.817 1.00 0.00 N ATOM 0 H ASN A 22 6.306 -10.968 -13.630 1.00 0.00 H new ATOM 0 HA ASN A 22 5.178 -13.606 -13.061 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.065 -10.790 -13.309 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.019 -12.191 -13.187 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.014 -10.547 -9.803 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.674 -9.805 -11.371 1.00 0.00 H new ATOM 311 N GLU A 23 5.110 -12.150 -15.974 1.00 0.00 N ATOM 312 CA GLU A 23 4.783 -12.339 -17.383 1.00 0.00 C ATOM 313 C GLU A 23 5.780 -13.281 -18.051 1.00 0.00 C ATOM 314 O GLU A 23 5.407 -14.337 -18.563 1.00 0.00 O ATOM 315 CB GLU A 23 4.770 -10.993 -18.111 1.00 0.00 C ATOM 316 CG GLU A 23 3.627 -10.085 -17.690 1.00 0.00 C ATOM 317 CD GLU A 23 3.708 -8.711 -18.327 1.00 0.00 C ATOM 318 OE1 GLU A 23 4.825 -8.294 -18.699 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.654 -8.054 -18.454 1.00 0.00 O ATOM 0 H GLU A 23 5.702 -11.342 -15.782 1.00 0.00 H new ATOM 0 HA GLU A 23 3.791 -12.786 -17.443 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.715 -10.482 -17.929 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.705 -11.171 -19.184 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.679 -10.551 -17.960 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.633 -9.979 -16.605 1.00 0.00 H new ATOM 326 N PHE A 24 7.051 -12.892 -18.042 1.00 0.00 N ATOM 327 CA PHE A 24 8.102 -13.700 -18.648 1.00 0.00 C ATOM 328 C PHE A 24 8.375 -14.950 -17.817 1.00 0.00 C ATOM 329 O PHE A 24 8.999 -15.900 -18.291 1.00 0.00 O ATOM 330 CB PHE A 24 9.386 -12.880 -18.792 1.00 0.00 C ATOM 331 CG PHE A 24 9.249 -11.711 -19.726 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.720 -10.510 -19.282 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.650 -11.814 -21.049 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.593 -9.434 -20.139 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.525 -10.741 -21.911 1.00 0.00 C ATOM 336 CZ PHE A 24 8.997 -9.549 -21.455 1.00 0.00 C ATOM 0 H PHE A 24 7.378 -12.022 -17.622 1.00 0.00 H new ATOM 0 HA PHE A 24 7.763 -14.009 -19.637 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.688 -12.517 -17.810 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.184 -13.530 -19.151 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.403 -10.414 -18.254 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.065 -12.743 -21.410 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.178 -8.504 -19.780 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.840 -10.834 -22.940 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.900 -8.708 -22.126 1.00 0.00 H new ATOM 346 N CYS A 25 7.903 -14.942 -16.575 1.00 0.00 N ATOM 347 CA CYS A 25 8.097 -16.074 -15.676 1.00 0.00 C ATOM 348 C CYS A 25 9.581 -16.365 -15.480 1.00 0.00 C ATOM 349 O CYS A 25 10.051 -17.469 -15.759 1.00 0.00 O ATOM 350 CB CYS A 25 7.390 -17.314 -16.225 1.00 0.00 C ATOM 351 SG CYS A 25 5.629 -17.399 -15.821 1.00 0.00 S ATOM 0 H CYS A 25 7.383 -14.164 -16.168 1.00 0.00 H new ATOM 0 HA CYS A 25 7.665 -15.816 -14.709 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.505 -17.335 -17.309 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.885 -18.204 -15.835 1.00 0.00 H new ATOM 0 HG CYS A 25 5.119 -18.481 -16.330 1.00 0.00 H new ATOM 357 N LEU A 26 10.316 -15.368 -15.000 1.00 0.00 N ATOM 358 CA LEU A 26 11.748 -15.516 -14.767 1.00 0.00 C ATOM 359 C LEU A 26 12.045 -15.675 -13.280 1.00 0.00 C ATOM 360 O LEU A 26 11.132 -15.726 -12.455 1.00 0.00 O ATOM 361 CB LEU A 26 12.502 -14.306 -15.323 1.00 0.00 C ATOM 362 CG LEU A 26 12.162 -13.904 -16.758 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.395 -12.415 -16.965 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.982 -14.717 -17.749 1.00 0.00 C ATOM 0 H LEU A 26 9.944 -14.448 -14.765 1.00 0.00 H new ATOM 0 HA LEU A 26 12.084 -16.415 -15.283 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.309 -13.453 -14.673 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.571 -14.513 -15.269 1.00 0.00 H new ATOM 0 HG LEU A 26 11.107 -14.113 -16.933 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.148 -12.147 -17.992 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.763 -11.849 -16.280 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.442 -12.180 -16.771 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.726 -14.417 -18.765 1.00 0.00 H new ATOM 0 HD22 LEU A 26 14.043 -14.540 -17.575 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.764 -15.777 -17.618 1.00 0.00 H new ATOM 376 N LYS A 27 13.328 -15.752 -12.943 1.00 0.00 N ATOM 377 CA LYS A 27 13.747 -15.902 -11.554 1.00 0.00 C ATOM 378 C LYS A 27 14.015 -14.542 -10.917 1.00 0.00 C ATOM 379 O LYS A 27 14.063 -13.522 -11.604 1.00 0.00 O ATOM 380 CB LYS A 27 15.003 -16.773 -11.470 1.00 0.00 C ATOM 381 CG LYS A 27 14.742 -18.164 -10.920 1.00 0.00 C ATOM 382 CD LYS A 27 14.806 -19.217 -12.013 1.00 0.00 C ATOM 383 CE LYS A 27 16.242 -19.617 -12.318 1.00 0.00 C ATOM 384 NZ LYS A 27 16.391 -21.093 -12.444 1.00 0.00 N ATOM 0 H LYS A 27 14.096 -15.713 -13.613 1.00 0.00 H new ATOM 0 HA LYS A 27 12.939 -16.387 -11.007 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.441 -16.861 -12.464 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.739 -16.274 -10.840 1.00 0.00 H new ATOM 0 HG2 LYS A 27 15.476 -18.395 -10.148 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.761 -18.190 -10.445 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.240 -20.096 -11.706 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.334 -18.833 -12.918 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.563 -19.139 -13.243 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.897 -19.252 -11.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 17.383 -21.325 -12.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.108 -21.548 -11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.786 -21.438 -13.216 1.00 0.00 H new ATOM 398 N SER A 28 14.190 -14.535 -9.599 1.00 0.00 N ATOM 399 CA SER A 28 14.451 -13.300 -8.869 1.00 0.00 C ATOM 400 C SER A 28 15.827 -12.743 -9.219 1.00 0.00 C ATOM 401 O SER A 28 15.998 -11.534 -9.375 1.00 0.00 O ATOM 402 CB SER A 28 14.356 -13.544 -7.362 1.00 0.00 C ATOM 403 OG SER A 28 13.324 -12.764 -6.783 1.00 0.00 O ATOM 0 H SER A 28 14.156 -15.371 -9.015 1.00 0.00 H new ATOM 0 HA SER A 28 13.697 -12.569 -9.160 1.00 0.00 H new ATOM 0 HB2 SER A 28 14.167 -14.601 -7.173 1.00 0.00 H new ATOM 0 HB3 SER A 28 15.308 -13.301 -6.890 1.00 0.00 H new ATOM 0 HG SER A 28 13.283 -12.939 -5.820 1.00 0.00 H new ATOM 409 N SER A 29 16.806 -13.634 -9.341 1.00 0.00 N ATOM 410 CA SER A 29 18.169 -13.232 -9.669 1.00 0.00 C ATOM 411 C SER A 29 18.289 -12.874 -11.148 1.00 0.00 C ATOM 412 O SER A 29 19.144 -12.079 -11.538 1.00 0.00 O ATOM 413 CB SER A 29 19.151 -14.352 -9.322 1.00 0.00 C ATOM 414 OG SER A 29 19.374 -14.420 -7.925 1.00 0.00 O ATOM 0 H SER A 29 16.681 -14.639 -9.218 1.00 0.00 H new ATOM 0 HA SER A 29 18.413 -12.349 -9.079 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.761 -15.305 -9.678 1.00 0.00 H new ATOM 0 HB3 SER A 29 20.097 -14.183 -9.837 1.00 0.00 H new ATOM 0 HG SER A 29 20.004 -15.145 -7.729 1.00 0.00 H new ATOM 420 N ASP A 30 17.427 -13.468 -11.965 1.00 0.00 N ATOM 421 CA ASP A 30 17.434 -13.213 -13.401 1.00 0.00 C ATOM 422 C ASP A 30 17.368 -11.716 -13.687 1.00 0.00 C ATOM 423 O ASP A 30 18.267 -11.152 -14.312 1.00 0.00 O ATOM 424 CB ASP A 30 16.259 -13.925 -14.073 1.00 0.00 C ATOM 425 CG ASP A 30 16.484 -15.419 -14.200 1.00 0.00 C ATOM 426 OD1 ASP A 30 17.518 -15.907 -13.699 1.00 0.00 O ATOM 427 OD2 ASP A 30 15.626 -16.100 -14.801 1.00 0.00 O ATOM 0 H ASP A 30 16.714 -14.130 -11.658 1.00 0.00 H new ATOM 0 HA ASP A 30 18.366 -13.602 -13.810 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.351 -13.745 -13.497 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.098 -13.499 -15.063 1.00 0.00 H new ATOM 432 N LEU A 31 16.298 -11.077 -13.226 1.00 0.00 N ATOM 433 CA LEU A 31 16.114 -9.645 -13.433 1.00 0.00 C ATOM 434 C LEU A 31 17.336 -8.865 -12.961 1.00 0.00 C ATOM 435 O LEU A 31 17.724 -7.870 -13.573 1.00 0.00 O ATOM 436 CB LEU A 31 14.867 -9.159 -12.692 1.00 0.00 C ATOM 437 CG LEU A 31 13.542 -9.304 -13.441 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.493 -8.357 -14.629 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.341 -10.743 -13.895 1.00 0.00 C ATOM 0 H LEU A 31 15.545 -11.528 -12.707 1.00 0.00 H new ATOM 0 HA LEU A 31 15.986 -9.471 -14.501 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.792 -9.705 -11.752 1.00 0.00 H new ATOM 0 HB3 LEU A 31 15.005 -8.108 -12.440 1.00 0.00 H new ATOM 0 HG LEU A 31 12.732 -9.042 -12.761 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.543 -8.475 -15.149 1.00 0.00 H new ATOM 0 HD12 LEU A 31 13.590 -7.329 -14.279 1.00 0.00 H new ATOM 0 HD13 LEU A 31 14.311 -8.587 -15.311 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.393 -10.828 -14.426 1.00 0.00 H new ATOM 0 HD22 LEU A 31 14.156 -11.032 -14.558 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.330 -11.401 -13.026 1.00 0.00 H new ATOM 451 N GLU A 32 17.941 -9.325 -11.870 1.00 0.00 N ATOM 452 CA GLU A 32 19.121 -8.670 -11.318 1.00 0.00 C ATOM 453 C GLU A 32 20.293 -8.749 -12.292 1.00 0.00 C ATOM 454 O GLU A 32 21.140 -7.857 -12.332 1.00 0.00 O ATOM 455 CB GLU A 32 19.508 -9.310 -9.983 1.00 0.00 C ATOM 456 CG GLU A 32 18.907 -8.610 -8.775 1.00 0.00 C ATOM 457 CD GLU A 32 19.865 -7.624 -8.136 1.00 0.00 C ATOM 458 OE1 GLU A 32 20.655 -7.001 -8.876 1.00 0.00 O ATOM 459 OE2 GLU A 32 19.825 -7.474 -6.897 1.00 0.00 O ATOM 0 H GLU A 32 17.634 -10.148 -11.352 1.00 0.00 H new ATOM 0 HA GLU A 32 18.879 -7.620 -11.153 1.00 0.00 H new ATOM 0 HB2 GLU A 32 19.190 -10.353 -9.984 1.00 0.00 H new ATOM 0 HB3 GLU A 32 20.594 -9.308 -9.890 1.00 0.00 H new ATOM 0 HG2 GLU A 32 18.000 -8.086 -9.077 1.00 0.00 H new ATOM 0 HG3 GLU A 32 18.613 -9.356 -8.037 1.00 0.00 H new ATOM 466 N GLN A 33 20.334 -9.823 -13.073 1.00 0.00 N ATOM 467 CA GLN A 33 21.402 -10.019 -14.046 1.00 0.00 C ATOM 468 C GLN A 33 21.367 -8.937 -15.120 1.00 0.00 C ATOM 469 O GLN A 33 22.396 -8.591 -15.701 1.00 0.00 O ATOM 470 CB GLN A 33 21.284 -11.400 -14.693 1.00 0.00 C ATOM 471 CG GLN A 33 22.572 -11.879 -15.343 1.00 0.00 C ATOM 472 CD GLN A 33 23.249 -12.983 -14.554 1.00 0.00 C ATOM 473 OE1 GLN A 33 23.144 -13.040 -13.329 1.00 0.00 O ATOM 474 NE2 GLN A 33 23.949 -13.868 -15.254 1.00 0.00 N ATOM 0 H GLN A 33 19.640 -10.571 -13.051 1.00 0.00 H new ATOM 0 HA GLN A 33 22.354 -9.952 -13.520 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.979 -12.122 -13.936 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.495 -11.374 -15.445 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.355 -12.237 -16.349 1.00 0.00 H new ATOM 0 HG3 GLN A 33 23.258 -11.038 -15.445 1.00 0.00 H new ATOM 0 HE21 GLN A 33 24.009 -13.783 -16.269 1.00 0.00 H new ATOM 0 HE22 GLN A 33 24.426 -14.633 -14.777 1.00 0.00 H new ATOM 483 N LEU A 34 20.177 -8.406 -15.378 1.00 0.00 N ATOM 484 CA LEU A 34 20.007 -7.362 -16.383 1.00 0.00 C ATOM 485 C LEU A 34 20.565 -6.032 -15.886 1.00 0.00 C ATOM 486 O LEU A 34 21.099 -5.946 -14.780 1.00 0.00 O ATOM 487 CB LEU A 34 18.527 -7.206 -16.740 1.00 0.00 C ATOM 488 CG LEU A 34 17.841 -8.447 -17.313 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.329 -8.309 -17.226 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.275 -8.678 -18.754 1.00 0.00 C ATOM 0 H LEU A 34 19.316 -8.681 -14.906 1.00 0.00 H new ATOM 0 HA LEU A 34 20.560 -7.657 -17.275 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.988 -6.898 -15.844 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.432 -6.396 -17.463 1.00 0.00 H new ATOM 0 HG LEU A 34 18.141 -9.311 -16.720 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.858 -9.201 -17.638 1.00 0.00 H new ATOM 0 HD12 LEU A 34 16.034 -8.192 -16.183 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.010 -7.435 -17.794 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.777 -9.565 -19.146 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.004 -7.813 -19.359 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.355 -8.822 -18.790 1.00 0.00 H new ATOM 502 N ARG A 35 20.435 -4.997 -16.710 1.00 0.00 N ATOM 503 CA ARG A 35 20.925 -3.671 -16.354 1.00 0.00 C ATOM 504 C ARG A 35 19.842 -2.864 -15.644 1.00 0.00 C ATOM 505 O ARG A 35 18.657 -2.988 -15.953 1.00 0.00 O ATOM 506 CB ARG A 35 21.395 -2.926 -17.604 1.00 0.00 C ATOM 507 CG ARG A 35 22.760 -2.275 -17.448 1.00 0.00 C ATOM 508 CD ARG A 35 23.220 -1.626 -18.744 1.00 0.00 C ATOM 509 NE ARG A 35 24.674 -1.515 -18.815 1.00 0.00 N ATOM 510 CZ ARG A 35 25.375 -0.603 -18.150 1.00 0.00 C ATOM 511 NH1 ARG A 35 24.757 0.273 -17.369 1.00 0.00 N ATOM 512 NH2 ARG A 35 26.696 -0.565 -18.266 1.00 0.00 N ATOM 0 H ARG A 35 19.995 -5.051 -17.628 1.00 0.00 H new ATOM 0 HA ARG A 35 21.768 -3.792 -15.674 1.00 0.00 H new ATOM 0 HB2 ARG A 35 21.428 -3.623 -18.441 1.00 0.00 H new ATOM 0 HB3 ARG A 35 20.663 -2.159 -17.856 1.00 0.00 H new ATOM 0 HG2 ARG A 35 22.718 -1.524 -16.659 1.00 0.00 H new ATOM 0 HG3 ARG A 35 23.488 -3.024 -17.137 1.00 0.00 H new ATOM 0 HD2 ARG A 35 22.859 -2.211 -19.590 1.00 0.00 H new ATOM 0 HD3 ARG A 35 22.776 -0.634 -18.830 1.00 0.00 H new ATOM 0 HE ARG A 35 25.179 -2.174 -19.408 1.00 0.00 H new ATOM 0 HH11 ARG A 35 23.741 0.247 -17.278 1.00 0.00 H new ATOM 0 HH12 ARG A 35 25.297 0.972 -16.859 1.00 0.00 H new ATOM 0 HH21 ARG A 35 27.175 -1.236 -18.866 1.00 0.00 H new ATOM 0 HH22 ARG A 35 27.233 0.136 -17.755 1.00 0.00 H new ATOM 526 N LYS A 36 20.257 -2.037 -14.691 1.00 0.00 N ATOM 527 CA LYS A 36 19.324 -1.208 -13.937 1.00 0.00 C ATOM 528 C LYS A 36 19.176 0.167 -14.581 1.00 0.00 C ATOM 529 O LYS A 36 20.078 1.001 -14.499 1.00 0.00 O ATOM 530 CB LYS A 36 19.799 -1.057 -12.490 1.00 0.00 C ATOM 531 CG LYS A 36 20.253 -2.362 -11.859 1.00 0.00 C ATOM 532 CD LYS A 36 19.106 -3.352 -11.741 1.00 0.00 C ATOM 533 CE LYS A 36 19.490 -4.549 -10.883 1.00 0.00 C ATOM 534 NZ LYS A 36 20.761 -5.174 -11.341 1.00 0.00 N ATOM 0 H LYS A 36 21.234 -1.923 -14.422 1.00 0.00 H new ATOM 0 HA LYS A 36 18.351 -1.700 -13.944 1.00 0.00 H new ATOM 0 HB2 LYS A 36 20.622 -0.343 -12.459 1.00 0.00 H new ATOM 0 HB3 LYS A 36 18.990 -0.637 -11.893 1.00 0.00 H new ATOM 0 HG2 LYS A 36 21.052 -2.799 -12.458 1.00 0.00 H new ATOM 0 HG3 LYS A 36 20.668 -2.165 -10.871 1.00 0.00 H new ATOM 0 HD2 LYS A 36 18.238 -2.855 -11.307 1.00 0.00 H new ATOM 0 HD3 LYS A 36 18.815 -3.693 -12.734 1.00 0.00 H new ATOM 0 HE2 LYS A 36 19.594 -4.233 -9.845 1.00 0.00 H new ATOM 0 HE3 LYS A 36 18.690 -5.289 -10.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 20.679 -6.209 -11.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 20.950 -4.896 -12.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 21.543 -4.854 -10.735 1.00 0.00 H new ATOM 548 N ILE A 37 18.032 0.397 -15.218 1.00 0.00 N ATOM 549 CA ILE A 37 17.766 1.672 -15.872 1.00 0.00 C ATOM 550 C ILE A 37 16.926 2.582 -14.982 1.00 0.00 C ATOM 551 O ILE A 37 15.705 2.440 -14.909 1.00 0.00 O ATOM 552 CB ILE A 37 17.040 1.474 -17.216 1.00 0.00 C ATOM 553 CG1 ILE A 37 17.855 0.557 -18.130 1.00 0.00 C ATOM 554 CG2 ILE A 37 16.793 2.817 -17.887 1.00 0.00 C ATOM 555 CD1 ILE A 37 17.425 -0.892 -18.070 1.00 0.00 C ATOM 0 H ILE A 37 17.275 -0.283 -15.295 1.00 0.00 H new ATOM 0 HA ILE A 37 18.733 2.140 -16.056 1.00 0.00 H new ATOM 0 HB ILE A 37 16.076 1.002 -17.026 1.00 0.00 H new ATOM 0 HG12 ILE A 37 17.769 0.911 -19.157 1.00 0.00 H new ATOM 0 HG13 ILE A 37 18.908 0.627 -17.856 1.00 0.00 H new ATOM 0 HG21 ILE A 37 16.279 2.661 -18.836 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.177 3.440 -17.239 1.00 0.00 H new ATOM 0 HG23 ILE A 37 17.746 3.314 -18.068 1.00 0.00 H new ATOM 0 HD11 ILE A 37 18.046 -1.484 -18.743 1.00 0.00 H new ATOM 0 HD12 ILE A 37 17.538 -1.263 -17.051 1.00 0.00 H new ATOM 0 HD13 ILE A 37 16.381 -0.975 -18.373 1.00 0.00 H new ATOM 567 N ARG A 38 17.588 3.517 -14.309 1.00 0.00 N ATOM 568 CA ARG A 38 16.902 4.451 -13.424 1.00 0.00 C ATOM 569 C ARG A 38 16.251 5.577 -14.222 1.00 0.00 C ATOM 570 O ARG A 38 16.827 6.083 -15.185 1.00 0.00 O ATOM 571 CB ARG A 38 17.882 5.034 -12.404 1.00 0.00 C ATOM 572 CG ARG A 38 19.014 5.830 -13.034 1.00 0.00 C ATOM 573 CD ARG A 38 20.061 6.220 -12.003 1.00 0.00 C ATOM 574 NE ARG A 38 21.367 6.458 -12.612 1.00 0.00 N ATOM 575 CZ ARG A 38 22.205 5.487 -12.957 1.00 0.00 C ATOM 576 NH1 ARG A 38 21.875 4.219 -12.754 1.00 0.00 N ATOM 577 NH2 ARG A 38 23.376 5.783 -13.506 1.00 0.00 N ATOM 0 H ARG A 38 18.598 3.648 -14.359 1.00 0.00 H new ATOM 0 HA ARG A 38 16.121 3.905 -12.895 1.00 0.00 H new ATOM 0 HB2 ARG A 38 17.336 5.678 -11.715 1.00 0.00 H new ATOM 0 HB3 ARG A 38 18.305 4.221 -11.813 1.00 0.00 H new ATOM 0 HG2 ARG A 38 19.480 5.240 -13.823 1.00 0.00 H new ATOM 0 HG3 ARG A 38 18.612 6.728 -13.503 1.00 0.00 H new ATOM 0 HD2 ARG A 38 19.736 7.119 -11.479 1.00 0.00 H new ATOM 0 HD3 ARG A 38 20.147 5.430 -11.257 1.00 0.00 H new ATOM 0 HE ARG A 38 21.651 7.423 -12.782 1.00 0.00 H new ATOM 0 HH11 ARG A 38 20.976 3.987 -12.332 1.00 0.00 H new ATOM 0 HH12 ARG A 38 22.520 3.475 -13.020 1.00 0.00 H new ATOM 0 HH21 ARG A 38 23.634 6.757 -13.664 1.00 0.00 H new ATOM 0 HH22 ARG A 38 24.019 5.036 -13.770 1.00 0.00 H new ATOM 591 N ARG A 39 15.046 5.964 -13.814 1.00 0.00 N ATOM 592 CA ARG A 39 14.316 7.029 -14.492 1.00 0.00 C ATOM 593 C ARG A 39 14.325 8.308 -13.660 1.00 0.00 C ATOM 594 O ARG A 39 14.699 9.375 -14.148 1.00 0.00 O ATOM 595 CB ARG A 39 12.875 6.595 -14.764 1.00 0.00 C ATOM 596 CG ARG A 39 12.747 5.573 -15.882 1.00 0.00 C ATOM 597 CD ARG A 39 12.747 6.240 -17.248 1.00 0.00 C ATOM 598 NE ARG A 39 11.679 5.734 -18.105 1.00 0.00 N ATOM 599 CZ ARG A 39 10.396 6.035 -17.937 1.00 0.00 C ATOM 600 NH1 ARG A 39 10.025 6.837 -16.948 1.00 0.00 N ATOM 601 NH2 ARG A 39 9.482 5.534 -18.758 1.00 0.00 N ATOM 0 H ARG A 39 14.555 5.556 -13.018 1.00 0.00 H new ATOM 0 HA ARG A 39 14.813 7.230 -15.441 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.452 6.177 -13.851 1.00 0.00 H new ATOM 0 HB3 ARG A 39 12.282 7.474 -15.017 1.00 0.00 H new ATOM 0 HG2 ARG A 39 13.571 4.862 -15.823 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.826 5.005 -15.753 1.00 0.00 H new ATOM 0 HD2 ARG A 39 12.633 7.317 -17.125 1.00 0.00 H new ATOM 0 HD3 ARG A 39 13.709 6.074 -17.732 1.00 0.00 H new ATOM 0 HE ARG A 39 11.932 5.115 -18.875 1.00 0.00 H new ATOM 0 HH11 ARG A 39 10.725 7.224 -16.315 1.00 0.00 H new ATOM 0 HH12 ARG A 39 9.040 7.067 -16.820 1.00 0.00 H new ATOM 0 HH21 ARG A 39 9.764 4.917 -19.519 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.497 5.766 -18.628 1.00 0.00 H new ATOM 615 N ARG A 40 13.910 8.194 -12.403 1.00 0.00 N ATOM 616 CA ARG A 40 13.869 9.341 -11.505 1.00 0.00 C ATOM 617 C ARG A 40 15.256 9.645 -10.946 1.00 0.00 C ATOM 618 O ARG A 40 16.010 8.736 -10.601 1.00 0.00 O ATOM 619 CB ARG A 40 12.891 9.082 -10.357 1.00 0.00 C ATOM 620 CG ARG A 40 12.796 10.232 -9.367 1.00 0.00 C ATOM 621 CD ARG A 40 11.385 10.379 -8.818 1.00 0.00 C ATOM 622 NE ARG A 40 10.554 11.230 -9.666 1.00 0.00 N ATOM 623 CZ ARG A 40 10.718 12.544 -9.773 1.00 0.00 C ATOM 624 NH1 ARG A 40 11.677 13.154 -9.090 1.00 0.00 N ATOM 625 NH2 ARG A 40 9.922 13.251 -10.565 1.00 0.00 N ATOM 0 H ARG A 40 13.597 7.318 -11.983 1.00 0.00 H new ATOM 0 HA ARG A 40 13.529 10.205 -12.076 1.00 0.00 H new ATOM 0 HB2 ARG A 40 11.902 8.887 -10.771 1.00 0.00 H new ATOM 0 HB3 ARG A 40 13.198 8.181 -9.826 1.00 0.00 H new ATOM 0 HG2 ARG A 40 13.492 10.064 -8.545 1.00 0.00 H new ATOM 0 HG3 ARG A 40 13.096 11.159 -9.855 1.00 0.00 H new ATOM 0 HD2 ARG A 40 10.925 9.394 -8.731 1.00 0.00 H new ATOM 0 HD3 ARG A 40 11.429 10.800 -7.814 1.00 0.00 H new ATOM 0 HE ARG A 40 9.807 10.792 -10.205 1.00 0.00 H new ATOM 0 HH11 ARG A 40 12.291 12.614 -8.480 1.00 0.00 H new ATOM 0 HH12 ARG A 40 11.800 14.163 -9.174 1.00 0.00 H new ATOM 0 HH21 ARG A 40 9.183 12.786 -11.092 1.00 0.00 H new ATOM 0 HH22 ARG A 40 10.049 14.260 -10.646 1.00 0.00 H new ATOM 639 N SER A 41 15.586 10.930 -10.862 1.00 0.00 N ATOM 640 CA SER A 41 16.884 11.354 -10.351 1.00 0.00 C ATOM 641 C SER A 41 16.887 11.372 -8.825 1.00 0.00 C ATOM 642 O SER A 41 15.840 11.409 -8.177 1.00 0.00 O ATOM 643 CB SER A 41 17.240 12.741 -10.889 1.00 0.00 C ATOM 644 OG SER A 41 18.255 12.661 -11.875 1.00 0.00 O ATOM 0 H SER A 41 14.972 11.695 -11.141 1.00 0.00 H new ATOM 0 HA SER A 41 17.632 10.638 -10.691 1.00 0.00 H new ATOM 0 HB2 SER A 41 16.352 13.208 -11.314 1.00 0.00 H new ATOM 0 HB3 SER A 41 17.574 13.378 -10.070 1.00 0.00 H new ATOM 0 HG SER A 41 18.463 13.560 -12.204 1.00 0.00 H new ATOM 650 N PRO A 42 18.092 11.346 -8.236 1.00 0.00 N ATOM 651 CA PRO A 42 18.261 11.359 -6.780 1.00 0.00 C ATOM 652 C PRO A 42 17.881 12.701 -6.164 1.00 0.00 C ATOM 653 O PRO A 42 18.345 13.753 -6.607 1.00 0.00 O ATOM 654 CB PRO A 42 19.757 11.091 -6.595 1.00 0.00 C ATOM 655 CG PRO A 42 20.386 11.565 -7.860 1.00 0.00 C ATOM 656 CD PRO A 42 19.381 11.302 -8.946 1.00 0.00 C ATOM 0 HA PRO A 42 17.618 10.629 -6.289 1.00 0.00 H new ATOM 0 HB2 PRO A 42 20.151 11.627 -5.732 1.00 0.00 H new ATOM 0 HB3 PRO A 42 19.952 10.032 -6.429 1.00 0.00 H new ATOM 0 HG2 PRO A 42 20.629 12.626 -7.801 1.00 0.00 H new ATOM 0 HG3 PRO A 42 21.318 11.035 -8.055 1.00 0.00 H new ATOM 0 HD2 PRO A 42 19.433 12.055 -9.732 1.00 0.00 H new ATOM 0 HD3 PRO A 42 19.546 10.334 -9.420 1.00 0.00 H new ATOM 664 N HIS A 43 17.034 12.659 -5.141 1.00 0.00 N ATOM 665 CA HIS A 43 16.592 13.872 -4.463 1.00 0.00 C ATOM 666 C HIS A 43 17.529 14.224 -3.312 1.00 0.00 C ATOM 667 O HIS A 43 17.740 15.397 -3.008 1.00 0.00 O ATOM 668 CB HIS A 43 15.165 13.699 -3.940 1.00 0.00 C ATOM 669 CG HIS A 43 14.205 14.720 -4.469 1.00 0.00 C ATOM 670 ND1 HIS A 43 14.224 15.166 -5.774 1.00 0.00 N ATOM 671 CD2 HIS A 43 13.193 15.382 -3.861 1.00 0.00 C ATOM 672 CE1 HIS A 43 13.266 16.059 -5.945 1.00 0.00 C ATOM 673 NE2 HIS A 43 12.625 16.208 -4.800 1.00 0.00 N ATOM 0 H HIS A 43 16.640 11.798 -4.763 1.00 0.00 H new ATOM 0 HA HIS A 43 16.610 14.688 -5.185 1.00 0.00 H new ATOM 0 HB2 HIS A 43 14.808 12.704 -4.206 1.00 0.00 H new ATOM 0 HB3 HIS A 43 15.177 13.753 -2.851 1.00 0.00 H new ATOM 0 HD2 HIS A 43 12.889 15.280 -2.830 1.00 0.00 H new ATOM 0 HE1 HIS A 43 13.044 16.579 -6.865 1.00 0.00 H new ATOM 0 HE2 HIS A 43 11.836 16.835 -4.639 1.00 0.00 H new ATOM 681 N GLU A 44 18.086 13.199 -2.675 1.00 0.00 N ATOM 682 CA GLU A 44 19.000 13.401 -1.556 1.00 0.00 C ATOM 683 C GLU A 44 19.850 12.157 -1.316 1.00 0.00 C ATOM 684 O GLU A 44 19.893 11.625 -0.207 1.00 0.00 O ATOM 685 CB GLU A 44 18.218 13.750 -0.288 1.00 0.00 C ATOM 686 CG GLU A 44 17.150 12.729 0.070 1.00 0.00 C ATOM 687 CD GLU A 44 16.457 13.045 1.381 1.00 0.00 C ATOM 688 OE1 GLU A 44 17.133 13.548 2.302 1.00 0.00 O ATOM 689 OE2 GLU A 44 15.240 12.788 1.486 1.00 0.00 O ATOM 0 H GLU A 44 17.921 12.221 -2.914 1.00 0.00 H new ATOM 0 HA GLU A 44 19.663 14.230 -1.806 1.00 0.00 H new ATOM 0 HB2 GLU A 44 18.915 13.841 0.545 1.00 0.00 H new ATOM 0 HB3 GLU A 44 17.748 14.725 -0.418 1.00 0.00 H new ATOM 0 HG2 GLU A 44 16.409 12.689 -0.728 1.00 0.00 H new ATOM 0 HG3 GLU A 44 17.604 11.740 0.133 1.00 0.00 H new ATOM 696 N ASP A 45 20.525 11.698 -2.365 1.00 0.00 N ATOM 697 CA ASP A 45 21.375 10.517 -2.269 1.00 0.00 C ATOM 698 C ASP A 45 20.574 9.308 -1.797 1.00 0.00 C ATOM 699 O ASP A 45 21.053 8.506 -0.994 1.00 0.00 O ATOM 700 CB ASP A 45 22.541 10.777 -1.314 1.00 0.00 C ATOM 701 CG ASP A 45 23.139 12.159 -1.493 1.00 0.00 C ATOM 702 OD1 ASP A 45 23.445 12.527 -2.646 1.00 0.00 O ATOM 703 OD2 ASP A 45 23.302 12.871 -0.479 1.00 0.00 O ATOM 0 H ASP A 45 20.500 12.126 -3.291 1.00 0.00 H new ATOM 0 HA ASP A 45 21.770 10.303 -3.262 1.00 0.00 H new ATOM 0 HB2 ASP A 45 22.197 10.664 -0.286 1.00 0.00 H new ATOM 0 HB3 ASP A 45 23.314 10.026 -1.476 1.00 0.00 H new ATOM 708 N THR A 46 19.350 9.181 -2.301 1.00 0.00 N ATOM 709 CA THR A 46 18.482 8.072 -1.929 1.00 0.00 C ATOM 710 C THR A 46 18.114 7.230 -3.146 1.00 0.00 C ATOM 711 O THR A 46 17.445 7.706 -4.062 1.00 0.00 O ATOM 712 CB THR A 46 17.190 8.571 -1.256 1.00 0.00 C ATOM 713 OG1 THR A 46 16.712 9.745 -1.922 1.00 0.00 O ATOM 714 CG2 THR A 46 17.430 8.878 0.215 1.00 0.00 C ATOM 0 H THR A 46 18.938 9.833 -2.968 1.00 0.00 H new ATOM 0 HA THR A 46 19.039 7.459 -1.220 1.00 0.00 H new ATOM 0 HB THR A 46 16.441 7.783 -1.329 1.00 0.00 H new ATOM 0 HG1 THR A 46 16.770 9.617 -2.892 1.00 0.00 H new ATOM 0 HG21 THR A 46 16.503 9.229 0.669 1.00 0.00 H new ATOM 0 HG22 THR A 46 17.765 7.975 0.725 1.00 0.00 H new ATOM 0 HG23 THR A 46 18.194 9.650 0.306 1.00 0.00 H new ATOM 722 N GLU A 47 18.556 5.976 -3.148 1.00 0.00 N ATOM 723 CA GLU A 47 18.273 5.068 -4.253 1.00 0.00 C ATOM 724 C GLU A 47 16.787 4.726 -4.309 1.00 0.00 C ATOM 725 O GLU A 47 16.098 4.734 -3.289 1.00 0.00 O ATOM 726 CB GLU A 47 19.098 3.787 -4.115 1.00 0.00 C ATOM 727 CG GLU A 47 18.835 3.031 -2.823 1.00 0.00 C ATOM 728 CD GLU A 47 19.456 1.648 -2.821 1.00 0.00 C ATOM 729 OE1 GLU A 47 20.453 1.444 -3.545 1.00 0.00 O ATOM 730 OE2 GLU A 47 18.947 0.769 -2.095 1.00 0.00 O ATOM 0 H GLU A 47 19.111 5.566 -2.397 1.00 0.00 H new ATOM 0 HA GLU A 47 18.548 5.570 -5.181 1.00 0.00 H new ATOM 0 HB2 GLU A 47 18.882 3.133 -4.960 1.00 0.00 H new ATOM 0 HB3 GLU A 47 20.157 4.039 -4.170 1.00 0.00 H new ATOM 0 HG2 GLU A 47 19.230 3.604 -1.984 1.00 0.00 H new ATOM 0 HG3 GLU A 47 17.759 2.943 -2.670 1.00 0.00 H new ATOM 737 N SER A 48 16.299 4.427 -5.509 1.00 0.00 N ATOM 738 CA SER A 48 14.894 4.086 -5.700 1.00 0.00 C ATOM 739 C SER A 48 14.749 2.864 -6.602 1.00 0.00 C ATOM 740 O SER A 48 15.740 2.297 -7.062 1.00 0.00 O ATOM 741 CB SER A 48 14.137 5.271 -6.302 1.00 0.00 C ATOM 742 OG SER A 48 14.257 6.422 -5.483 1.00 0.00 O ATOM 0 H SER A 48 16.856 4.414 -6.363 1.00 0.00 H new ATOM 0 HA SER A 48 14.468 3.849 -4.725 1.00 0.00 H new ATOM 0 HB2 SER A 48 14.525 5.487 -7.297 1.00 0.00 H new ATOM 0 HB3 SER A 48 13.085 5.013 -6.420 1.00 0.00 H new ATOM 0 HG SER A 48 13.766 7.166 -5.890 1.00 0.00 H new ATOM 748 N PHE A 49 13.507 2.464 -6.850 1.00 0.00 N ATOM 749 CA PHE A 49 13.230 1.309 -7.696 1.00 0.00 C ATOM 750 C PHE A 49 13.574 1.607 -9.153 1.00 0.00 C ATOM 751 O PHE A 49 13.255 2.677 -9.673 1.00 0.00 O ATOM 752 CB PHE A 49 11.759 0.906 -7.581 1.00 0.00 C ATOM 753 CG PHE A 49 11.478 -0.486 -8.072 1.00 0.00 C ATOM 754 CD1 PHE A 49 11.871 -1.589 -7.332 1.00 0.00 C ATOM 755 CD2 PHE A 49 10.821 -0.690 -9.275 1.00 0.00 C ATOM 756 CE1 PHE A 49 11.614 -2.870 -7.781 1.00 0.00 C ATOM 757 CE2 PHE A 49 10.561 -1.970 -9.728 1.00 0.00 C ATOM 758 CZ PHE A 49 10.959 -3.061 -8.981 1.00 0.00 C ATOM 0 H PHE A 49 12.676 2.923 -6.477 1.00 0.00 H new ATOM 0 HA PHE A 49 13.854 0.483 -7.355 1.00 0.00 H new ATOM 0 HB2 PHE A 49 11.450 0.984 -6.539 1.00 0.00 H new ATOM 0 HB3 PHE A 49 11.152 1.612 -8.148 1.00 0.00 H new ATOM 0 HD1 PHE A 49 12.385 -1.446 -6.393 1.00 0.00 H new ATOM 0 HD2 PHE A 49 10.509 0.159 -9.865 1.00 0.00 H new ATOM 0 HE1 PHE A 49 11.925 -3.721 -7.194 1.00 0.00 H new ATOM 0 HE2 PHE A 49 10.047 -2.117 -10.666 1.00 0.00 H new ATOM 0 HZ PHE A 49 10.758 -4.061 -9.335 1.00 0.00 H new ATOM 768 N THR A 50 14.229 0.653 -9.807 1.00 0.00 N ATOM 769 CA THR A 50 14.619 0.812 -11.203 1.00 0.00 C ATOM 770 C THR A 50 13.676 0.051 -12.127 1.00 0.00 C ATOM 771 O THR A 50 12.873 -0.766 -11.676 1.00 0.00 O ATOM 772 CB THR A 50 16.060 0.324 -11.443 1.00 0.00 C ATOM 773 OG1 THR A 50 16.480 0.669 -12.768 1.00 0.00 O ATOM 774 CG2 THR A 50 16.161 -1.181 -11.249 1.00 0.00 C ATOM 0 H THR A 50 14.501 -0.238 -9.392 1.00 0.00 H new ATOM 0 HA THR A 50 14.562 1.877 -11.428 1.00 0.00 H new ATOM 0 HB THR A 50 16.711 0.812 -10.718 1.00 0.00 H new ATOM 0 HG1 THR A 50 17.352 1.115 -12.729 1.00 0.00 H new ATOM 0 HG21 THR A 50 17.188 -1.502 -11.424 1.00 0.00 H new ATOM 0 HG22 THR A 50 15.869 -1.437 -10.230 1.00 0.00 H new ATOM 0 HG23 THR A 50 15.499 -1.684 -11.953 1.00 0.00 H new ATOM 782 N VAL A 51 13.779 0.322 -13.424 1.00 0.00 N ATOM 783 CA VAL A 51 12.936 -0.339 -14.413 1.00 0.00 C ATOM 784 C VAL A 51 13.775 -1.142 -15.401 1.00 0.00 C ATOM 785 O VAL A 51 14.995 -0.989 -15.463 1.00 0.00 O ATOM 786 CB VAL A 51 12.080 0.678 -15.191 1.00 0.00 C ATOM 787 CG1 VAL A 51 11.091 1.365 -14.262 1.00 0.00 C ATOM 788 CG2 VAL A 51 12.967 1.699 -15.888 1.00 0.00 C ATOM 0 H VAL A 51 14.438 0.995 -13.815 1.00 0.00 H new ATOM 0 HA VAL A 51 12.277 -1.014 -13.867 1.00 0.00 H new ATOM 0 HB VAL A 51 11.514 0.142 -15.953 1.00 0.00 H new ATOM 0 HG11 VAL A 51 10.495 2.080 -14.829 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.434 0.619 -13.814 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.634 1.889 -13.475 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.345 2.410 -16.433 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.561 2.232 -15.146 1.00 0.00 H new ATOM 0 HG23 VAL A 51 13.631 1.188 -16.586 1.00 0.00 H new ATOM 798 N TYR A 52 13.113 -1.997 -16.173 1.00 0.00 N ATOM 799 CA TYR A 52 13.798 -2.825 -17.158 1.00 0.00 C ATOM 800 C TYR A 52 13.255 -2.566 -18.560 1.00 0.00 C ATOM 801 O TYR A 52 12.130 -2.092 -18.726 1.00 0.00 O ATOM 802 CB TYR A 52 13.644 -4.306 -16.805 1.00 0.00 C ATOM 803 CG TYR A 52 14.164 -4.657 -15.429 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.504 -4.485 -15.107 1.00 0.00 C ATOM 805 CD2 TYR A 52 13.315 -5.163 -14.453 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.984 -4.805 -13.852 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.786 -5.485 -13.194 1.00 0.00 C ATOM 808 CZ TYR A 52 15.121 -5.305 -12.899 1.00 0.00 C ATOM 809 OH TYR A 52 15.594 -5.625 -11.647 1.00 0.00 O ATOM 0 H TYR A 52 12.103 -2.135 -16.135 1.00 0.00 H new ATOM 0 HA TYR A 52 14.856 -2.562 -17.144 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.590 -4.578 -16.866 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.172 -4.905 -17.547 1.00 0.00 H new ATOM 0 HD1 TYR A 52 16.183 -4.094 -15.851 1.00 0.00 H new ATOM 0 HD2 TYR A 52 12.269 -5.307 -14.682 1.00 0.00 H new ATOM 0 HE1 TYR A 52 17.029 -4.665 -13.618 1.00 0.00 H new ATOM 0 HE2 TYR A 52 13.112 -5.875 -12.446 1.00 0.00 H new ATOM 0 HH TYR A 52 14.858 -5.963 -11.096 1.00 0.00 H new ATOM 819 N LEU A 53 14.062 -2.882 -19.567 1.00 0.00 N ATOM 820 CA LEU A 53 13.664 -2.684 -20.957 1.00 0.00 C ATOM 821 C LEU A 53 12.983 -3.932 -21.510 1.00 0.00 C ATOM 822 O LEU A 53 13.493 -5.044 -21.370 1.00 0.00 O ATOM 823 CB LEU A 53 14.883 -2.333 -21.812 1.00 0.00 C ATOM 824 CG LEU A 53 14.890 -0.934 -22.428 1.00 0.00 C ATOM 825 CD1 LEU A 53 15.898 -0.043 -21.719 1.00 0.00 C ATOM 826 CD2 LEU A 53 15.195 -1.008 -23.917 1.00 0.00 C ATOM 0 H LEU A 53 14.995 -3.276 -19.447 1.00 0.00 H new ATOM 0 HA LEU A 53 12.954 -1.858 -20.992 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.776 -2.442 -21.197 1.00 0.00 H new ATOM 0 HB3 LEU A 53 14.959 -3.063 -22.618 1.00 0.00 H new ATOM 0 HG LEU A 53 13.899 -0.498 -22.302 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.889 0.949 -22.171 1.00 0.00 H new ATOM 0 HD12 LEU A 53 15.635 0.037 -20.664 1.00 0.00 H new ATOM 0 HD13 LEU A 53 16.894 -0.475 -21.812 1.00 0.00 H new ATOM 0 HD21 LEU A 53 15.196 -0.003 -24.339 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.173 -1.465 -24.066 1.00 0.00 H new ATOM 0 HD23 LEU A 53 14.434 -1.610 -24.415 1.00 0.00 H new ATOM 838 N ARG A 54 11.830 -3.739 -22.142 1.00 0.00 N ATOM 839 CA ARG A 54 11.079 -4.848 -22.718 1.00 0.00 C ATOM 840 C ARG A 54 11.928 -5.611 -23.731 1.00 0.00 C ATOM 841 O ARG A 54 11.786 -6.823 -23.887 1.00 0.00 O ATOM 842 CB ARG A 54 9.803 -4.335 -23.388 1.00 0.00 C ATOM 843 CG ARG A 54 8.646 -5.319 -23.330 1.00 0.00 C ATOM 844 CD ARG A 54 7.306 -4.610 -23.445 1.00 0.00 C ATOM 845 NE ARG A 54 6.185 -5.543 -23.367 1.00 0.00 N ATOM 846 CZ ARG A 54 5.856 -6.380 -24.344 1.00 0.00 C ATOM 847 NH1 ARG A 54 6.558 -6.401 -25.469 1.00 0.00 N ATOM 848 NH2 ARG A 54 4.822 -7.199 -24.198 1.00 0.00 N ATOM 0 H ARG A 54 11.395 -2.825 -22.268 1.00 0.00 H new ATOM 0 HA ARG A 54 10.808 -5.529 -21.911 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.501 -3.404 -22.909 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.019 -4.102 -24.431 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.745 -6.046 -24.136 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.686 -5.874 -22.393 1.00 0.00 H new ATOM 0 HD2 ARG A 54 7.218 -3.870 -22.649 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.262 -4.069 -24.390 1.00 0.00 H new ATOM 0 HE ARG A 54 5.624 -5.552 -22.515 1.00 0.00 H new ATOM 0 HH11 ARG A 54 7.353 -5.773 -25.586 1.00 0.00 H new ATOM 0 HH12 ARG A 54 6.303 -7.045 -26.218 1.00 0.00 H new ATOM 0 HH21 ARG A 54 4.279 -7.186 -23.335 1.00 0.00 H new ATOM 0 HH22 ARG A 54 4.570 -7.841 -24.949 1.00 0.00 H new ATOM 862 N SER A 55 12.810 -4.891 -24.418 1.00 0.00 N ATOM 863 CA SER A 55 13.678 -5.499 -25.419 1.00 0.00 C ATOM 864 C SER A 55 14.723 -6.394 -24.761 1.00 0.00 C ATOM 865 O SER A 55 15.006 -7.492 -25.240 1.00 0.00 O ATOM 866 CB SER A 55 14.369 -4.416 -26.250 1.00 0.00 C ATOM 867 OG SER A 55 15.362 -4.975 -27.092 1.00 0.00 O ATOM 0 H SER A 55 12.942 -3.887 -24.299 1.00 0.00 H new ATOM 0 HA SER A 55 13.060 -6.113 -26.075 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.630 -3.890 -26.854 1.00 0.00 H new ATOM 0 HB3 SER A 55 14.823 -3.679 -25.587 1.00 0.00 H new ATOM 0 HG SER A 55 15.788 -4.263 -27.613 1.00 0.00 H new ATOM 873 N ASP A 56 15.292 -5.918 -23.659 1.00 0.00 N ATOM 874 CA ASP A 56 16.305 -6.675 -22.932 1.00 0.00 C ATOM 875 C ASP A 56 15.685 -7.881 -22.235 1.00 0.00 C ATOM 876 O ASP A 56 16.324 -8.923 -22.087 1.00 0.00 O ATOM 877 CB ASP A 56 17.003 -5.780 -21.907 1.00 0.00 C ATOM 878 CG ASP A 56 18.239 -5.108 -22.472 1.00 0.00 C ATOM 879 OD1 ASP A 56 18.967 -5.761 -23.248 1.00 0.00 O ATOM 880 OD2 ASP A 56 18.478 -3.928 -22.137 1.00 0.00 O ATOM 0 H ASP A 56 15.069 -5.011 -23.249 1.00 0.00 H new ATOM 0 HA ASP A 56 17.042 -7.033 -23.651 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.305 -5.018 -21.560 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.282 -6.376 -21.038 1.00 0.00 H new ATOM 885 N VAL A 57 14.435 -7.733 -21.806 1.00 0.00 N ATOM 886 CA VAL A 57 13.728 -8.810 -21.123 1.00 0.00 C ATOM 887 C VAL A 57 13.272 -9.879 -22.109 1.00 0.00 C ATOM 888 O VAL A 57 13.199 -11.060 -21.770 1.00 0.00 O ATOM 889 CB VAL A 57 12.504 -8.280 -20.355 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.831 -9.403 -19.581 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.909 -7.148 -19.423 1.00 0.00 C ATOM 0 H VAL A 57 13.891 -6.877 -21.920 1.00 0.00 H new ATOM 0 HA VAL A 57 14.430 -9.249 -20.414 1.00 0.00 H new ATOM 0 HB VAL A 57 11.787 -7.888 -21.076 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.968 -9.009 -19.045 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.504 -10.178 -20.274 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.538 -9.828 -18.868 1.00 0.00 H new ATOM 0 HG21 VAL A 57 12.031 -6.785 -18.888 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.646 -7.512 -18.707 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.341 -6.334 -20.005 1.00 0.00 H new ATOM 901 N GLU A 58 12.966 -9.457 -23.332 1.00 0.00 N ATOM 902 CA GLU A 58 12.515 -10.379 -24.368 1.00 0.00 C ATOM 903 C GLU A 58 13.512 -11.521 -24.551 1.00 0.00 C ATOM 904 O GLU A 58 13.124 -12.672 -24.747 1.00 0.00 O ATOM 905 CB GLU A 58 12.323 -9.639 -25.693 1.00 0.00 C ATOM 906 CG GLU A 58 11.685 -10.489 -26.779 1.00 0.00 C ATOM 907 CD GLU A 58 11.176 -9.662 -27.944 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.522 -8.464 -28.016 1.00 0.00 O ATOM 909 OE2 GLU A 58 10.433 -10.213 -28.782 1.00 0.00 O ATOM 0 H GLU A 58 13.022 -8.483 -23.629 1.00 0.00 H new ATOM 0 HA GLU A 58 11.560 -10.799 -24.053 1.00 0.00 H new ATOM 0 HB2 GLU A 58 11.703 -8.759 -25.521 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.292 -9.283 -26.044 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.414 -11.213 -27.143 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.858 -11.056 -26.352 1.00 0.00 H new ATOM 916 N ALA A 59 14.798 -11.192 -24.485 1.00 0.00 N ATOM 917 CA ALA A 59 15.850 -12.188 -24.641 1.00 0.00 C ATOM 918 C ALA A 59 16.089 -12.944 -23.339 1.00 0.00 C ATOM 919 O ALA A 59 16.427 -14.128 -23.348 1.00 0.00 O ATOM 920 CB ALA A 59 17.137 -11.527 -25.114 1.00 0.00 C ATOM 0 H ALA A 59 15.136 -10.243 -24.325 1.00 0.00 H new ATOM 0 HA ALA A 59 15.526 -12.907 -25.393 1.00 0.00 H new ATOM 0 HB1 ALA A 59 17.914 -12.283 -25.226 1.00 0.00 H new ATOM 0 HB2 ALA A 59 16.964 -11.039 -26.073 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.455 -10.785 -24.382 1.00 0.00 H new ATOM 926 N LYS A 60 15.912 -12.252 -22.218 1.00 0.00 N ATOM 927 CA LYS A 60 16.107 -12.857 -20.906 1.00 0.00 C ATOM 928 C LYS A 60 15.248 -14.108 -20.750 1.00 0.00 C ATOM 929 O LYS A 60 15.586 -15.013 -19.987 1.00 0.00 O ATOM 930 CB LYS A 60 15.769 -11.852 -19.803 1.00 0.00 C ATOM 931 CG LYS A 60 16.785 -11.822 -18.674 1.00 0.00 C ATOM 932 CD LYS A 60 16.969 -13.197 -18.053 1.00 0.00 C ATOM 933 CE LYS A 60 18.030 -13.178 -16.963 1.00 0.00 C ATOM 934 NZ LYS A 60 18.445 -14.553 -16.570 1.00 0.00 N ATOM 0 H LYS A 60 15.634 -11.271 -22.192 1.00 0.00 H new ATOM 0 HA LYS A 60 17.155 -13.144 -20.818 1.00 0.00 H new ATOM 0 HB2 LYS A 60 15.695 -10.856 -20.241 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.789 -12.093 -19.392 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.741 -11.462 -19.053 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.460 -11.117 -17.909 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.022 -13.538 -17.635 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.252 -13.912 -18.826 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.900 -12.622 -17.312 1.00 0.00 H new ATOM 0 HE3 LYS A 60 17.645 -12.651 -16.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 18.936 -14.519 -15.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.604 -15.160 -16.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.085 -14.942 -17.292 1.00 0.00 H new ATOM 948 N SER A 61 14.138 -14.152 -21.479 1.00 0.00 N ATOM 949 CA SER A 61 13.229 -15.291 -21.420 1.00 0.00 C ATOM 950 C SER A 61 13.718 -16.423 -22.319 1.00 0.00 C ATOM 951 O SER A 61 13.420 -17.594 -22.079 1.00 0.00 O ATOM 952 CB SER A 61 11.819 -14.868 -21.835 1.00 0.00 C ATOM 953 OG SER A 61 11.542 -15.257 -23.169 1.00 0.00 O ATOM 0 H SER A 61 13.846 -13.412 -22.118 1.00 0.00 H new ATOM 0 HA SER A 61 13.204 -15.651 -20.392 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.088 -15.318 -21.163 1.00 0.00 H new ATOM 0 HB3 SER A 61 11.717 -13.787 -21.739 1.00 0.00 H new ATOM 0 HG SER A 61 10.634 -14.977 -23.410 1.00 0.00 H new ATOM 959 N LEU A 62 14.470 -16.065 -23.354 1.00 0.00 N ATOM 960 CA LEU A 62 15.001 -17.050 -24.290 1.00 0.00 C ATOM 961 C LEU A 62 16.324 -17.619 -23.789 1.00 0.00 C ATOM 962 O LEU A 62 16.646 -18.780 -24.041 1.00 0.00 O ATOM 963 CB LEU A 62 15.194 -16.418 -25.670 1.00 0.00 C ATOM 964 CG LEU A 62 14.048 -15.540 -26.172 1.00 0.00 C ATOM 965 CD1 LEU A 62 14.319 -15.070 -27.593 1.00 0.00 C ATOM 966 CD2 LEU A 62 12.728 -16.293 -26.100 1.00 0.00 C ATOM 0 H LEU A 62 14.726 -15.101 -23.566 1.00 0.00 H new ATOM 0 HA LEU A 62 14.282 -17.866 -24.368 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.103 -15.817 -25.648 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.357 -17.217 -26.394 1.00 0.00 H new ATOM 0 HG LEU A 62 13.978 -14.663 -25.528 1.00 0.00 H new ATOM 0 HD11 LEU A 62 13.493 -14.446 -27.934 1.00 0.00 H new ATOM 0 HD12 LEU A 62 15.243 -14.492 -27.615 1.00 0.00 H new ATOM 0 HD13 LEU A 62 14.416 -15.934 -28.250 1.00 0.00 H new ATOM 0 HD21 LEU A 62 11.924 -15.652 -26.461 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.785 -17.188 -26.720 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.528 -16.579 -25.067 1.00 0.00 H new ATOM 978 N GLU A 63 17.085 -16.795 -23.076 1.00 0.00 N ATOM 979 CA GLU A 63 18.373 -17.218 -22.538 1.00 0.00 C ATOM 980 C GLU A 63 18.184 -18.146 -21.342 1.00 0.00 C ATOM 981 O GLU A 63 19.055 -18.958 -21.028 1.00 0.00 O ATOM 982 CB GLU A 63 19.204 -16.001 -22.127 1.00 0.00 C ATOM 983 CG GLU A 63 18.724 -15.341 -20.846 1.00 0.00 C ATOM 984 CD GLU A 63 19.544 -15.748 -19.637 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.338 -16.871 -19.132 1.00 0.00 O ATOM 986 OE2 GLU A 63 20.392 -14.943 -19.197 1.00 0.00 O ATOM 0 H GLU A 63 16.832 -15.831 -22.857 1.00 0.00 H new ATOM 0 HA GLU A 63 18.903 -17.763 -23.319 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.243 -16.307 -22.001 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.183 -15.268 -22.933 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.767 -14.258 -20.962 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.679 -15.602 -20.676 1.00 0.00 H new ATOM 993 N VAL A 64 17.040 -18.020 -20.677 1.00 0.00 N ATOM 994 CA VAL A 64 16.735 -18.847 -19.515 1.00 0.00 C ATOM 995 C VAL A 64 15.972 -20.103 -19.920 1.00 0.00 C ATOM 996 O VAL A 64 16.522 -21.204 -19.917 1.00 0.00 O ATOM 997 CB VAL A 64 15.908 -18.070 -18.474 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.554 -18.965 -17.297 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.665 -16.836 -18.007 1.00 0.00 C ATOM 0 H VAL A 64 16.309 -17.353 -20.923 1.00 0.00 H new ATOM 0 HA VAL A 64 17.688 -19.132 -19.070 1.00 0.00 H new ATOM 0 HB VAL A 64 14.980 -17.744 -18.943 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.970 -18.398 -16.572 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.970 -19.815 -17.649 1.00 0.00 H new ATOM 0 HG13 VAL A 64 16.469 -19.324 -16.825 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.066 -16.298 -17.272 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.610 -17.138 -17.555 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.862 -16.186 -18.859 1.00 0.00 H new ATOM 1009 N TRP A 65 14.702 -19.930 -20.268 1.00 0.00 N ATOM 1010 CA TRP A 65 13.862 -21.050 -20.676 1.00 0.00 C ATOM 1011 C TRP A 65 14.435 -21.739 -21.910 1.00 0.00 C ATOM 1012 O TRP A 65 14.193 -22.924 -22.139 1.00 0.00 O ATOM 1013 CB TRP A 65 12.438 -20.570 -20.960 1.00 0.00 C ATOM 1014 CG TRP A 65 11.610 -20.402 -19.722 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.428 -19.253 -19.007 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.853 -21.417 -19.053 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.604 -19.492 -17.933 1.00 0.00 N ATOM 1018 CE2 TRP A 65 10.237 -20.812 -17.940 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.634 -22.777 -19.287 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 9.419 -21.521 -17.065 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.822 -23.480 -18.417 1.00 0.00 C ATOM 1022 CH2 TRP A 65 9.222 -22.852 -17.318 1.00 0.00 C ATOM 0 H TRP A 65 14.231 -19.025 -20.276 1.00 0.00 H new ATOM 0 HA TRP A 65 13.838 -21.770 -19.858 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.482 -19.619 -21.491 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.947 -21.283 -21.623 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.867 -18.297 -19.250 1.00 0.00 H new ATOM 0 HE1 TRP A 65 10.313 -18.799 -17.243 1.00 0.00 H new ATOM 0 HE3 TRP A 65 11.091 -23.270 -20.132 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.956 -21.038 -16.217 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.647 -24.532 -18.588 1.00 0.00 H new ATOM 0 HH2 TRP A 65 8.592 -23.429 -16.657 1.00 0.00 H new ATOM 1033 N GLY A 66 15.195 -20.989 -22.701 1.00 0.00 N ATOM 1034 CA GLY A 66 15.790 -21.546 -23.902 1.00 0.00 C ATOM 1035 C GLY A 66 15.151 -21.011 -25.168 1.00 0.00 C ATOM 1036 O GLY A 66 15.845 -20.661 -26.123 1.00 0.00 O ATOM 0 H GLY A 66 15.409 -20.006 -22.532 1.00 0.00 H new ATOM 0 HA2 GLY A 66 16.856 -21.320 -23.914 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.694 -22.632 -23.881 1.00 0.00 H new ATOM 1040 N SER A 67 13.823 -20.948 -25.177 1.00 0.00 N ATOM 1041 CA SER A 67 13.089 -20.458 -26.338 1.00 0.00 C ATOM 1042 C SER A 67 11.779 -19.800 -25.913 1.00 0.00 C ATOM 1043 O SER A 67 11.271 -20.022 -24.814 1.00 0.00 O ATOM 1044 CB SER A 67 12.805 -21.604 -27.311 1.00 0.00 C ATOM 1045 OG SER A 67 12.896 -22.859 -26.660 1.00 0.00 O ATOM 0 H SER A 67 13.234 -21.230 -24.394 1.00 0.00 H new ATOM 0 HA SER A 67 13.706 -19.712 -26.839 1.00 0.00 H new ATOM 0 HB2 SER A 67 11.810 -21.484 -27.739 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.514 -21.567 -28.138 1.00 0.00 H new ATOM 0 HG SER A 67 12.709 -23.575 -27.302 1.00 0.00 H new ATOM 1051 N PRO A 68 11.219 -18.970 -26.806 1.00 0.00 N ATOM 1052 CA PRO A 68 9.961 -18.263 -26.548 1.00 0.00 C ATOM 1053 C PRO A 68 8.761 -19.204 -26.523 1.00 0.00 C ATOM 1054 O PRO A 68 7.701 -18.858 -26.003 1.00 0.00 O ATOM 1055 CB PRO A 68 9.853 -17.290 -27.725 1.00 0.00 C ATOM 1056 CG PRO A 68 10.647 -17.924 -28.814 1.00 0.00 C ATOM 1057 CD PRO A 68 11.770 -18.658 -28.135 1.00 0.00 C ATOM 0 HA PRO A 68 9.960 -17.776 -25.573 1.00 0.00 H new ATOM 0 HB2 PRO A 68 8.815 -17.145 -28.025 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.250 -16.309 -27.465 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.031 -18.608 -29.399 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.032 -17.173 -29.504 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.046 -19.562 -28.678 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.667 -18.043 -28.064 1.00 0.00 H new ATOM 1065 N GLU A 69 8.937 -20.394 -27.088 1.00 0.00 N ATOM 1066 CA GLU A 69 7.867 -21.384 -27.131 1.00 0.00 C ATOM 1067 C GLU A 69 7.640 -21.999 -25.752 1.00 0.00 C ATOM 1068 O GLU A 69 6.508 -22.302 -25.375 1.00 0.00 O ATOM 1069 CB GLU A 69 8.199 -22.483 -28.143 1.00 0.00 C ATOM 1070 CG GLU A 69 8.142 -22.016 -29.588 1.00 0.00 C ATOM 1071 CD GLU A 69 9.488 -22.102 -30.281 1.00 0.00 C ATOM 1072 OE1 GLU A 69 10.127 -23.172 -30.204 1.00 0.00 O ATOM 1073 OE2 GLU A 69 9.902 -21.100 -30.901 1.00 0.00 O ATOM 0 H GLU A 69 9.809 -20.696 -27.522 1.00 0.00 H new ATOM 0 HA GLU A 69 6.952 -20.880 -27.441 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.197 -22.869 -27.934 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.503 -23.311 -28.010 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.417 -22.621 -30.133 1.00 0.00 H new ATOM 0 HG3 GLU A 69 7.786 -20.986 -29.620 1.00 0.00 H new ATOM 1080 N ALA A 70 8.724 -22.180 -25.006 1.00 0.00 N ATOM 1081 CA ALA A 70 8.644 -22.757 -23.669 1.00 0.00 C ATOM 1082 C ALA A 70 7.837 -21.863 -22.734 1.00 0.00 C ATOM 1083 O ALA A 70 7.107 -22.351 -21.869 1.00 0.00 O ATOM 1084 CB ALA A 70 10.040 -22.987 -23.109 1.00 0.00 C ATOM 0 H ALA A 70 9.668 -21.936 -25.304 1.00 0.00 H new ATOM 0 HA ALA A 70 8.132 -23.717 -23.743 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.965 -23.418 -22.111 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.585 -23.671 -23.760 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.571 -22.037 -23.055 1.00 0.00 H new ATOM 1090 N LEU A 71 7.973 -20.554 -22.910 1.00 0.00 N ATOM 1091 CA LEU A 71 7.256 -19.591 -22.080 1.00 0.00 C ATOM 1092 C LEU A 71 5.808 -19.451 -22.536 1.00 0.00 C ATOM 1093 O LEU A 71 4.898 -19.330 -21.717 1.00 0.00 O ATOM 1094 CB LEU A 71 7.952 -18.230 -22.128 1.00 0.00 C ATOM 1095 CG LEU A 71 7.181 -17.060 -21.515 1.00 0.00 C ATOM 1096 CD1 LEU A 71 7.066 -17.228 -20.008 1.00 0.00 C ATOM 1097 CD2 LEU A 71 7.854 -15.739 -21.857 1.00 0.00 C ATOM 0 H LEU A 71 8.573 -20.134 -23.620 1.00 0.00 H new ATOM 0 HA LEU A 71 7.260 -19.958 -21.054 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.910 -18.316 -21.616 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.168 -17.991 -23.169 1.00 0.00 H new ATOM 0 HG LEU A 71 6.176 -17.052 -21.937 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.514 -16.386 -19.589 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.538 -18.155 -19.784 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.063 -17.263 -19.569 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.291 -14.918 -21.412 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.871 -15.736 -21.465 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.883 -15.615 -22.940 1.00 0.00 H new ATOM 1109 N ALA A 72 5.601 -19.471 -23.849 1.00 0.00 N ATOM 1110 CA ALA A 72 4.263 -19.350 -24.414 1.00 0.00 C ATOM 1111 C ALA A 72 3.341 -20.439 -23.877 1.00 0.00 C ATOM 1112 O ALA A 72 2.123 -20.265 -23.827 1.00 0.00 O ATOM 1113 CB ALA A 72 4.324 -19.409 -25.933 1.00 0.00 C ATOM 0 H ALA A 72 6.344 -19.570 -24.541 1.00 0.00 H new ATOM 0 HA ALA A 72 3.855 -18.384 -24.115 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.318 -19.317 -26.341 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.942 -18.592 -26.304 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.756 -20.360 -26.243 1.00 0.00 H new ATOM 1119 N ARG A 73 3.928 -21.562 -23.477 1.00 0.00 N ATOM 1120 CA ARG A 73 3.158 -22.680 -22.946 1.00 0.00 C ATOM 1121 C ARG A 73 2.266 -22.227 -21.794 1.00 0.00 C ATOM 1122 O ARG A 73 1.146 -22.711 -21.637 1.00 0.00 O ATOM 1123 CB ARG A 73 4.095 -23.793 -22.473 1.00 0.00 C ATOM 1124 CG ARG A 73 5.024 -24.311 -23.559 1.00 0.00 C ATOM 1125 CD ARG A 73 4.788 -25.787 -23.837 1.00 0.00 C ATOM 1126 NE ARG A 73 5.768 -26.634 -23.163 1.00 0.00 N ATOM 1127 CZ ARG A 73 5.703 -27.961 -23.144 1.00 0.00 C ATOM 1128 NH1 ARG A 73 4.709 -28.588 -23.759 1.00 0.00 N ATOM 1129 NH2 ARG A 73 6.633 -28.663 -22.509 1.00 0.00 N ATOM 0 H ARG A 73 4.935 -21.722 -23.511 1.00 0.00 H new ATOM 0 HA ARG A 73 2.523 -23.064 -23.745 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.694 -23.423 -21.641 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.498 -24.622 -22.092 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.871 -23.738 -24.474 1.00 0.00 H new ATOM 0 HG3 ARG A 73 6.060 -24.158 -23.257 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.785 -26.062 -23.510 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.833 -25.965 -24.911 1.00 0.00 H new ATOM 0 HE ARG A 73 6.545 -26.182 -22.680 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.992 -28.051 -24.248 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.661 -29.607 -23.743 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.399 -28.184 -22.035 1.00 0.00 H new ATOM 0 HH22 ARG A 73 6.582 -29.682 -22.495 1.00 0.00 H new ATOM 1143 N GLU A 74 2.772 -21.296 -20.991 1.00 0.00 N ATOM 1144 CA GLU A 74 2.021 -20.779 -19.853 1.00 0.00 C ATOM 1145 C GLU A 74 1.237 -19.529 -20.241 1.00 0.00 C ATOM 1146 O GLU A 74 0.201 -19.223 -19.651 1.00 0.00 O ATOM 1147 CB GLU A 74 2.966 -20.462 -18.692 1.00 0.00 C ATOM 1148 CG GLU A 74 3.427 -21.693 -17.930 1.00 0.00 C ATOM 1149 CD GLU A 74 2.671 -21.892 -16.630 1.00 0.00 C ATOM 1150 OE1 GLU A 74 1.436 -22.073 -16.685 1.00 0.00 O ATOM 1151 OE2 GLU A 74 3.313 -21.865 -15.560 1.00 0.00 O ATOM 0 H GLU A 74 3.698 -20.885 -21.107 1.00 0.00 H new ATOM 0 HA GLU A 74 1.314 -21.547 -19.538 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.839 -19.936 -19.078 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.465 -19.784 -18.001 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.299 -22.574 -18.559 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.492 -21.606 -17.717 1.00 0.00 H new ATOM 1158 N LYS A 75 1.739 -18.808 -21.238 1.00 0.00 N ATOM 1159 CA LYS A 75 1.087 -17.591 -21.708 1.00 0.00 C ATOM 1160 C LYS A 75 -0.228 -17.914 -22.410 1.00 0.00 C ATOM 1161 O LYS A 75 -1.210 -17.184 -22.277 1.00 0.00 O ATOM 1162 CB LYS A 75 2.012 -16.828 -22.659 1.00 0.00 C ATOM 1163 CG LYS A 75 3.376 -16.522 -22.066 1.00 0.00 C ATOM 1164 CD LYS A 75 3.876 -15.152 -22.494 1.00 0.00 C ATOM 1165 CE LYS A 75 4.579 -14.434 -21.352 1.00 0.00 C ATOM 1166 NZ LYS A 75 3.649 -13.549 -20.597 1.00 0.00 N ATOM 0 H LYS A 75 2.596 -19.046 -21.737 1.00 0.00 H new ATOM 0 HA LYS A 75 0.871 -16.966 -20.841 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.144 -17.412 -23.570 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.532 -15.893 -22.946 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.319 -16.566 -20.978 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.089 -17.285 -22.379 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.562 -15.260 -23.334 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.037 -14.550 -22.842 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.013 -15.169 -20.673 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.403 -13.841 -21.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.844 -12.556 -20.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.667 -13.779 -20.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.785 -13.693 -19.576 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.240 -19.013 -23.157 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.435 -19.435 -23.878 1.00 0.00 C ATOM 1182 C LYS A 76 -2.608 -19.628 -22.922 1.00 0.00 C ATOM 1183 O LYS A 76 -3.757 -19.355 -23.270 1.00 0.00 O ATOM 1184 CB LYS A 76 -1.164 -20.735 -24.639 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.407 -21.344 -25.264 1.00 0.00 C ATOM 1186 CD LYS A 76 -2.174 -21.716 -26.719 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.205 -22.882 -26.848 1.00 0.00 C ATOM 1188 NZ LYS A 76 -1.568 -23.782 -27.977 1.00 0.00 N ATOM 0 H LYS A 76 0.565 -19.628 -23.279 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.695 -18.652 -24.590 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.431 -20.542 -25.422 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.718 -21.459 -23.957 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.700 -22.231 -24.703 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.233 -20.637 -25.196 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.124 -21.978 -27.185 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.781 -20.854 -27.258 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.195 -22.500 -26.998 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.196 -23.451 -25.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -0.884 -24.564 -28.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.522 -24.167 -27.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -1.552 -23.245 -28.868 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.310 -20.100 -21.716 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.340 -20.328 -20.708 1.00 0.00 C ATOM 1204 C LEU A 77 -4.083 -19.035 -20.386 1.00 0.00 C ATOM 1205 O LEU A 77 -5.270 -18.899 -20.685 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.717 -20.902 -19.435 1.00 0.00 C ATOM 1207 CG LEU A 77 -2.534 -22.420 -19.402 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -3.878 -23.122 -19.524 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -1.594 -22.868 -20.512 1.00 0.00 C ATOM 0 H LEU A 77 -1.364 -20.332 -21.413 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.055 -21.045 -21.111 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.743 -20.436 -19.289 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.339 -20.613 -18.588 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.090 -22.693 -18.445 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.728 -24.201 -19.499 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.520 -22.825 -18.695 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.350 -22.843 -20.466 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.475 -23.951 -20.473 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.010 -22.583 -21.478 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.622 -22.392 -20.380 1.00 0.00 H new ATOM 1221 N ARG A 78 -3.377 -18.089 -19.778 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.969 -16.807 -19.416 1.00 0.00 C ATOM 1223 C ARG A 78 -4.481 -16.076 -20.654 1.00 0.00 C ATOM 1224 O ARG A 78 -5.405 -15.267 -20.573 1.00 0.00 O ATOM 1225 CB ARG A 78 -2.946 -15.936 -18.684 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.654 -15.733 -19.458 1.00 0.00 C ATOM 1227 CD ARG A 78 -1.036 -14.375 -19.165 1.00 0.00 C ATOM 1228 NE ARG A 78 -0.821 -13.597 -20.382 1.00 0.00 N ATOM 1229 CZ ARG A 78 -0.557 -12.295 -20.385 1.00 0.00 C ATOM 1230 NH1 ARG A 78 -0.475 -11.629 -19.242 1.00 0.00 N ATOM 1231 NH2 ARG A 78 -0.373 -11.657 -21.534 1.00 0.00 N ATOM 0 H ARG A 78 -2.394 -18.186 -19.525 1.00 0.00 H new ATOM 0 HA ARG A 78 -4.812 -17.000 -18.753 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -3.392 -14.963 -18.477 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.715 -16.393 -17.722 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.946 -16.520 -19.198 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.851 -15.821 -20.526 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -1.686 -13.819 -18.490 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -0.085 -14.513 -18.650 1.00 0.00 H new ATOM 0 HE ARG A 78 -0.877 -14.080 -21.279 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.615 -12.116 -18.357 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -0.272 -10.629 -19.248 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -0.434 -12.166 -22.416 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -0.170 -10.657 -21.535 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.874 -16.367 -21.800 1.00 0.00 N ATOM 1246 CA LYS A 79 -4.267 -15.739 -23.056 1.00 0.00 C ATOM 1247 C LYS A 79 -5.651 -16.211 -23.489 1.00 0.00 C ATOM 1248 O LYS A 79 -6.577 -15.410 -23.619 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.244 -16.054 -24.149 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.613 -15.487 -25.509 1.00 0.00 C ATOM 1251 CD LYS A 79 -2.379 -15.211 -26.352 1.00 0.00 C ATOM 1252 CE LYS A 79 -2.729 -15.079 -27.826 1.00 0.00 C ATOM 1253 NZ LYS A 79 -1.661 -14.376 -28.589 1.00 0.00 N ATOM 0 H LYS A 79 -3.107 -17.034 -21.885 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.302 -14.661 -22.900 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.273 -15.658 -23.851 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.136 -17.135 -24.233 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.263 -16.188 -26.032 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.179 -14.565 -25.378 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -1.899 -14.295 -26.007 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -1.658 -16.018 -26.219 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.887 -16.070 -28.252 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.667 -14.534 -27.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -1.937 -14.306 -29.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -1.527 -13.421 -28.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -0.771 -14.909 -28.512 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.785 -17.515 -23.710 1.00 0.00 N ATOM 1268 CA GLU A 80 -7.058 -18.091 -24.129 1.00 0.00 C ATOM 1269 C GLU A 80 -8.149 -17.804 -23.102 1.00 0.00 C ATOM 1270 O GLU A 80 -9.329 -17.718 -23.441 1.00 0.00 O ATOM 1271 CB GLU A 80 -6.917 -19.602 -24.330 1.00 0.00 C ATOM 1272 CG GLU A 80 -5.836 -19.984 -25.328 1.00 0.00 C ATOM 1273 CD GLU A 80 -6.405 -20.488 -26.640 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -7.010 -21.580 -26.645 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -6.246 -19.788 -27.662 1.00 0.00 O ATOM 0 H GLU A 80 -5.029 -18.192 -23.606 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.343 -17.630 -25.075 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.695 -20.069 -23.370 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.871 -20.006 -24.668 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.202 -19.119 -25.520 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.200 -20.755 -24.892 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.746 -17.658 -21.844 1.00 0.00 N ATOM 1283 CA ALA A 81 -8.688 -17.379 -20.767 1.00 0.00 C ATOM 1284 C ALA A 81 -9.501 -16.123 -21.061 1.00 0.00 C ATOM 1285 O ALA A 81 -10.730 -16.142 -21.007 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.950 -17.234 -19.444 1.00 0.00 C ATOM 0 H ALA A 81 -6.773 -17.728 -21.546 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.379 -18.219 -20.695 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -8.666 -17.026 -18.649 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -7.418 -18.159 -19.221 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -7.236 -16.413 -19.514 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.807 -15.032 -21.371 1.00 0.00 N ATOM 1293 CA GLU A 82 -9.466 -13.767 -21.672 1.00 0.00 C ATOM 1294 C GLU A 82 -10.329 -13.888 -22.925 1.00 0.00 C ATOM 1295 O GLU A 82 -11.358 -13.222 -23.049 1.00 0.00 O ATOM 1296 CB GLU A 82 -8.429 -12.658 -21.858 1.00 0.00 C ATOM 1297 CG GLU A 82 -7.746 -12.240 -20.567 1.00 0.00 C ATOM 1298 CD GLU A 82 -7.310 -10.788 -20.580 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -6.864 -10.312 -21.645 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -7.416 -10.127 -19.525 1.00 0.00 O ATOM 0 H GLU A 82 -7.789 -14.999 -21.420 1.00 0.00 H new ATOM 0 HA GLU A 82 -10.111 -13.513 -20.831 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.672 -12.995 -22.567 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.915 -11.788 -22.300 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.426 -12.403 -19.731 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.876 -12.875 -20.399 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.902 -14.740 -23.850 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.635 -14.948 -25.093 1.00 0.00 C ATOM 1309 C ILE A 83 -11.938 -15.699 -24.843 1.00 0.00 C ATOM 1310 O ILE A 83 -12.972 -15.379 -25.428 1.00 0.00 O ATOM 1311 CB ILE A 83 -9.793 -15.730 -26.119 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.488 -14.987 -26.412 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -10.585 -15.946 -27.399 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -7.441 -15.847 -27.085 1.00 0.00 C ATOM 0 H ILE A 83 -9.052 -15.298 -23.763 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.859 -13.961 -25.497 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.547 -16.705 -25.698 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.703 -14.127 -27.047 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.082 -14.599 -25.477 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.977 -16.500 -28.114 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.489 -16.513 -27.176 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -10.858 -14.981 -27.825 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.543 -15.255 -27.262 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.197 -16.693 -26.442 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -7.828 -16.214 -28.036 1.00 0.00 H new ATOM 1326 N GLU A 84 -11.880 -16.699 -23.969 1.00 0.00 N ATOM 1327 CA GLU A 84 -13.057 -17.495 -23.641 1.00 0.00 C ATOM 1328 C GLU A 84 -14.115 -16.642 -22.947 1.00 0.00 C ATOM 1329 O GLU A 84 -15.308 -16.937 -23.016 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.669 -18.674 -22.746 1.00 0.00 C ATOM 1331 CG GLU A 84 -11.804 -19.710 -23.445 1.00 0.00 C ATOM 1332 CD GLU A 84 -12.611 -20.868 -23.998 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -13.481 -21.387 -23.269 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -12.372 -21.254 -25.162 1.00 0.00 O ATOM 0 H GLU A 84 -11.031 -16.977 -23.476 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.477 -17.877 -24.572 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.136 -18.297 -21.873 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.576 -19.156 -22.381 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.257 -19.232 -24.258 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.062 -20.092 -22.743 1.00 0.00 H new ATOM 1341 N TYR A 85 -13.668 -15.585 -22.278 1.00 0.00 N ATOM 1342 CA TYR A 85 -14.575 -14.690 -21.569 1.00 0.00 C ATOM 1343 C TYR A 85 -15.226 -13.700 -22.530 1.00 0.00 C ATOM 1344 O TYR A 85 -16.450 -13.649 -22.650 1.00 0.00 O ATOM 1345 CB TYR A 85 -13.824 -13.934 -20.471 1.00 0.00 C ATOM 1346 CG TYR A 85 -14.650 -12.858 -19.804 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -15.766 -13.182 -19.043 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -14.313 -11.516 -19.934 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -16.523 -12.202 -18.432 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -15.064 -10.529 -19.326 1.00 0.00 C ATOM 1351 CZ TYR A 85 -16.168 -10.877 -18.576 1.00 0.00 C ATOM 1352 OH TYR A 85 -16.920 -9.897 -17.968 1.00 0.00 O ATOM 0 H TYR A 85 -12.683 -15.327 -22.212 1.00 0.00 H new ATOM 0 HA TYR A 85 -15.359 -15.295 -21.114 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -13.490 -14.645 -19.715 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -12.930 -13.481 -20.900 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -16.047 -14.218 -18.927 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.449 -11.240 -20.520 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -17.388 -12.472 -17.845 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.788 -9.491 -19.437 1.00 0.00 H new ATOM 0 HH TYR A 85 -16.535 -9.018 -18.168 1.00 0.00 H new ATOM 1362 N ARG A 86 -14.398 -12.916 -23.211 1.00 0.00 N ATOM 1363 CA ARG A 86 -14.891 -11.926 -24.162 1.00 0.00 C ATOM 1364 C ARG A 86 -15.695 -12.594 -25.274 1.00 0.00 C ATOM 1365 O ARG A 86 -16.572 -11.976 -25.875 1.00 0.00 O ATOM 1366 CB ARG A 86 -13.726 -11.139 -24.762 1.00 0.00 C ATOM 1367 CG ARG A 86 -12.740 -12.002 -25.533 1.00 0.00 C ATOM 1368 CD ARG A 86 -12.799 -11.716 -27.026 1.00 0.00 C ATOM 1369 NE ARG A 86 -12.063 -10.506 -27.381 1.00 0.00 N ATOM 1370 CZ ARG A 86 -10.740 -10.457 -27.493 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -10.012 -11.544 -27.280 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -10.143 -9.318 -27.820 1.00 0.00 N ATOM 0 H ARG A 86 -13.382 -12.947 -23.122 1.00 0.00 H new ATOM 0 HA ARG A 86 -15.546 -11.239 -23.626 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -14.122 -10.372 -25.427 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -13.196 -10.624 -23.961 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.730 -11.819 -25.166 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.959 -13.055 -25.354 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.388 -12.564 -27.574 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.839 -11.611 -27.334 1.00 0.00 H new ATOM 0 HE ARG A 86 -12.593 -9.652 -27.552 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -10.467 -12.422 -27.029 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -8.997 -11.503 -27.367 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.700 -8.480 -27.985 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -9.127 -9.281 -27.906 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.387 -13.859 -25.541 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.080 -14.610 -26.582 1.00 0.00 C ATOM 1388 C GLU A 87 -17.588 -14.597 -26.350 1.00 0.00 C ATOM 1389 O GLU A 87 -18.342 -14.021 -27.134 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.572 -16.052 -26.626 1.00 0.00 C ATOM 1391 CG GLU A 87 -14.595 -16.319 -27.759 1.00 0.00 C ATOM 1392 CD GLU A 87 -15.284 -16.784 -29.027 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -15.721 -17.954 -29.069 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -15.388 -15.980 -29.976 1.00 0.00 O ATOM 0 H GLU A 87 -14.663 -14.385 -25.052 1.00 0.00 H new ATOM 0 HA GLU A 87 -15.873 -14.131 -27.539 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.089 -16.287 -25.678 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.423 -16.725 -26.725 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.031 -15.410 -27.969 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -13.876 -17.075 -27.443 1.00 0.00 H new ATOM 1401 N ARG A 88 -18.020 -15.236 -25.268 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.437 -15.300 -24.933 1.00 0.00 C ATOM 1403 C ARG A 88 -20.044 -13.902 -24.866 1.00 0.00 C ATOM 1404 O ARG A 88 -21.196 -13.694 -25.249 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.635 -16.018 -23.596 1.00 0.00 C ATOM 1406 CG ARG A 88 -18.714 -15.519 -22.495 1.00 0.00 C ATOM 1407 CD ARG A 88 -19.120 -16.072 -21.137 1.00 0.00 C ATOM 1408 NE ARG A 88 -17.963 -16.479 -20.345 1.00 0.00 N ATOM 1409 CZ ARG A 88 -18.045 -16.909 -19.090 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -19.225 -16.987 -18.490 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -16.947 -17.261 -18.435 1.00 0.00 N ATOM 0 H ARG A 88 -17.409 -15.717 -24.608 1.00 0.00 H new ATOM 0 HA ARG A 88 -19.945 -15.861 -25.718 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -20.670 -15.894 -23.276 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -19.471 -17.086 -23.739 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -17.688 -15.812 -22.717 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -18.735 -14.430 -22.467 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -19.685 -15.316 -20.592 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -19.783 -16.926 -21.277 1.00 0.00 H new ATOM 0 HE ARG A 88 -17.041 -16.431 -20.779 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -20.071 -16.717 -18.992 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -19.287 -17.317 -17.527 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -16.038 -17.202 -18.894 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -17.011 -17.591 -17.472 1.00 0.00 H new ATOM 1425 N LEU A 89 -19.261 -12.946 -24.377 1.00 0.00 N ATOM 1426 CA LEU A 89 -19.721 -11.567 -24.260 1.00 0.00 C ATOM 1427 C LEU A 89 -20.067 -10.990 -25.628 1.00 0.00 C ATOM 1428 O LEU A 89 -21.042 -10.252 -25.774 1.00 0.00 O ATOM 1429 CB LEU A 89 -18.649 -10.707 -23.588 1.00 0.00 C ATOM 1430 CG LEU A 89 -18.449 -10.933 -22.089 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -17.354 -10.025 -21.553 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -19.752 -10.703 -21.336 1.00 0.00 C ATOM 0 H LEU A 89 -18.305 -13.101 -24.056 1.00 0.00 H new ATOM 0 HA LEU A 89 -20.621 -11.561 -23.646 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.699 -10.886 -24.092 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.901 -9.658 -23.747 1.00 0.00 H new ATOM 0 HG LEU A 89 -18.142 -11.967 -21.935 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -17.226 -10.200 -20.485 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -16.419 -10.239 -22.070 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.631 -8.984 -21.719 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -19.591 -10.868 -20.271 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -20.090 -9.679 -21.497 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -20.510 -11.397 -21.700 1.00 0.00 H new ATOM 1444 N PHE A 90 -19.264 -11.332 -26.630 1.00 0.00 N ATOM 1445 CA PHE A 90 -19.486 -10.849 -27.988 1.00 0.00 C ATOM 1446 C PHE A 90 -20.853 -11.290 -28.505 1.00 0.00 C ATOM 1447 O PHE A 90 -21.549 -10.529 -29.177 1.00 0.00 O ATOM 1448 CB PHE A 90 -18.386 -11.361 -28.920 1.00 0.00 C ATOM 1449 CG PHE A 90 -17.367 -10.316 -29.274 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -17.732 -9.187 -29.989 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -16.043 -10.464 -28.892 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -16.796 -8.224 -30.316 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -15.103 -9.504 -29.216 1.00 0.00 C ATOM 1454 CZ PHE A 90 -15.480 -8.383 -29.930 1.00 0.00 C ATOM 0 H PHE A 90 -18.453 -11.942 -26.527 1.00 0.00 H new ATOM 0 HA PHE A 90 -19.458 -9.760 -27.969 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -17.882 -12.203 -28.446 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -18.842 -11.737 -29.836 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -18.760 -9.058 -30.294 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -15.742 -11.339 -28.335 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -17.094 -7.348 -30.873 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -14.075 -9.630 -28.911 1.00 0.00 H new ATOM 0 HZ PHE A 90 -14.747 -7.632 -30.186 1.00 0.00 H new ATOM 1464 N ARG A 91 -21.229 -12.524 -28.187 1.00 0.00 N ATOM 1465 CA ARG A 91 -22.511 -13.067 -28.620 1.00 0.00 C ATOM 1466 C ARG A 91 -23.653 -12.498 -27.784 1.00 0.00 C ATOM 1467 O ARG A 91 -24.752 -12.270 -28.289 1.00 0.00 O ATOM 1468 CB ARG A 91 -22.502 -14.594 -28.519 1.00 0.00 C ATOM 1469 CG ARG A 91 -21.796 -15.277 -29.679 1.00 0.00 C ATOM 1470 CD ARG A 91 -22.109 -16.764 -29.723 1.00 0.00 C ATOM 1471 NE ARG A 91 -21.168 -17.546 -28.925 1.00 0.00 N ATOM 1472 CZ ARG A 91 -21.170 -18.873 -28.878 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -22.059 -19.563 -29.579 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -20.281 -19.513 -28.128 1.00 0.00 N ATOM 0 H ARG A 91 -20.665 -13.167 -27.631 1.00 0.00 H new ATOM 0 HA ARG A 91 -22.667 -12.779 -29.660 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -22.017 -14.885 -27.587 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -23.530 -14.952 -28.469 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -22.101 -14.812 -30.617 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -20.719 -15.133 -29.587 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -23.122 -16.932 -29.357 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -22.082 -17.110 -30.756 1.00 0.00 H new ATOM 0 HE ARG A 91 -20.471 -17.045 -28.374 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -22.744 -19.075 -30.156 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -22.058 -20.582 -29.541 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -19.596 -18.985 -27.587 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -20.283 -20.532 -28.092 1.00 0.00 H new ATOM 1488 N ASN A 92 -23.386 -12.272 -26.501 1.00 0.00 N ATOM 1489 CA ASN A 92 -24.392 -11.731 -25.595 1.00 0.00 C ATOM 1490 C ASN A 92 -24.382 -10.206 -25.619 1.00 0.00 C ATOM 1491 O ASN A 92 -24.120 -9.561 -24.604 1.00 0.00 O ATOM 1492 CB ASN A 92 -24.146 -12.231 -24.170 1.00 0.00 C ATOM 1493 CG ASN A 92 -24.411 -13.717 -24.025 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -23.497 -14.500 -23.765 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -25.668 -14.113 -24.193 1.00 0.00 N ATOM 0 H ASN A 92 -22.482 -12.455 -26.066 1.00 0.00 H new ATOM 0 HA ASN A 92 -25.370 -12.076 -25.931 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -23.115 -12.019 -23.886 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -24.786 -11.682 -23.480 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -25.907 -15.101 -24.108 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -26.394 -13.429 -24.407 1.00 0.00 H new ATOM 1502 N GLN A 93 -24.670 -9.636 -26.785 1.00 0.00 N ATOM 1503 CA GLN A 93 -24.694 -8.187 -26.941 1.00 0.00 C ATOM 1504 C GLN A 93 -25.984 -7.734 -27.619 1.00 0.00 C ATOM 1505 O GLN A 93 -25.959 -7.174 -28.715 1.00 0.00 O ATOM 1506 CB GLN A 93 -23.486 -7.720 -27.755 1.00 0.00 C ATOM 1507 CG GLN A 93 -23.081 -6.282 -27.473 1.00 0.00 C ATOM 1508 CD GLN A 93 -21.664 -5.977 -27.917 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -21.444 -5.165 -28.816 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -20.693 -6.628 -27.287 1.00 0.00 N ATOM 0 H GLN A 93 -24.890 -10.156 -27.635 1.00 0.00 H new ATOM 0 HA GLN A 93 -24.649 -7.739 -25.948 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -22.641 -8.375 -27.543 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -23.712 -7.824 -28.816 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -23.770 -5.608 -27.982 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -23.173 -6.085 -26.405 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -20.921 -7.293 -26.547 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -19.719 -6.463 -27.543 1.00 0.00 H new ATOM 1519 N LYS A 94 -27.111 -7.979 -26.959 1.00 0.00 N ATOM 1520 CA LYS A 94 -28.411 -7.596 -27.495 1.00 0.00 C ATOM 1521 C LYS A 94 -28.699 -8.330 -28.801 1.00 0.00 C ATOM 1522 O LYS A 94 -27.815 -8.971 -29.371 1.00 0.00 O ATOM 1523 CB LYS A 94 -28.465 -6.084 -27.726 1.00 0.00 C ATOM 1524 CG LYS A 94 -29.380 -5.353 -26.758 1.00 0.00 C ATOM 1525 CD LYS A 94 -28.831 -5.383 -25.342 1.00 0.00 C ATOM 1526 CE LYS A 94 -28.011 -4.139 -25.036 1.00 0.00 C ATOM 1527 NZ LYS A 94 -27.992 -3.832 -23.578 1.00 0.00 N ATOM 0 H LYS A 94 -27.150 -8.442 -26.051 1.00 0.00 H new ATOM 0 HA LYS A 94 -29.172 -7.874 -26.766 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -27.458 -5.676 -27.640 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -28.801 -5.892 -28.745 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -29.501 -4.319 -27.081 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -30.369 -5.810 -26.775 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -29.655 -5.461 -24.633 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -28.212 -6.270 -25.209 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -26.990 -4.281 -25.391 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -28.423 -3.289 -25.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -27.423 -2.978 -23.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -28.964 -3.672 -23.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -27.576 -4.632 -23.060 1.00 0.00 H new ATOM 1541 N ILE A 95 -29.939 -8.232 -29.268 1.00 0.00 N ATOM 1542 CA ILE A 95 -30.341 -8.886 -30.508 1.00 0.00 C ATOM 1543 C ILE A 95 -29.568 -8.329 -31.699 1.00 0.00 C ATOM 1544 O ILE A 95 -29.359 -9.021 -32.696 1.00 0.00 O ATOM 1545 CB ILE A 95 -31.850 -8.721 -30.767 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -32.278 -9.562 -31.971 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -32.192 -7.255 -30.990 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -33.401 -10.528 -31.665 1.00 0.00 C ATOM 0 H ILE A 95 -30.682 -7.707 -28.807 1.00 0.00 H new ATOM 0 HA ILE A 95 -30.114 -9.946 -30.394 1.00 0.00 H new ATOM 0 HB ILE A 95 -32.394 -9.072 -29.890 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -32.591 -8.897 -32.776 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -31.418 -10.122 -32.337 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -33.262 -7.155 -31.172 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -31.918 -6.679 -30.106 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -31.641 -6.880 -31.852 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -33.652 -11.091 -32.564 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -33.085 -11.217 -30.882 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -34.276 -9.973 -31.328 1.00 0.00 H new ATOM 1560 N LEU A 96 -29.144 -7.075 -31.588 1.00 0.00 N ATOM 1561 CA LEU A 96 -28.392 -6.424 -32.655 1.00 0.00 C ATOM 1562 C LEU A 96 -29.210 -6.366 -33.941 1.00 0.00 C ATOM 1563 O LEU A 96 -30.296 -6.940 -34.023 1.00 0.00 O ATOM 1564 CB LEU A 96 -27.078 -7.167 -32.906 1.00 0.00 C ATOM 1565 CG LEU A 96 -25.840 -6.292 -33.103 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -25.334 -5.774 -31.766 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -24.747 -7.069 -33.823 1.00 0.00 C ATOM 0 H LEU A 96 -29.308 -6.489 -30.770 1.00 0.00 H new ATOM 0 HA LEU A 96 -28.172 -5.404 -32.340 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -26.896 -7.836 -32.065 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -27.201 -7.793 -33.790 1.00 0.00 H new ATOM 0 HG LEU A 96 -26.118 -5.437 -33.719 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -24.452 -5.153 -31.926 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -26.113 -5.181 -31.287 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -25.073 -6.616 -31.125 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -23.873 -6.431 -33.955 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -24.472 -7.943 -33.232 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -25.112 -7.391 -34.799 1.00 0.00 H new ATOM 1579 N ARG A 97 -28.681 -5.670 -34.942 1.00 0.00 N ATOM 1580 CA ARG A 97 -29.362 -5.538 -36.224 1.00 0.00 C ATOM 1581 C ARG A 97 -28.853 -6.577 -37.219 1.00 0.00 C ATOM 1582 O ARG A 97 -27.743 -6.463 -37.736 1.00 0.00 O ATOM 1583 CB ARG A 97 -29.159 -4.131 -36.791 1.00 0.00 C ATOM 1584 CG ARG A 97 -30.371 -3.593 -37.533 1.00 0.00 C ATOM 1585 CD ARG A 97 -31.350 -2.918 -36.585 1.00 0.00 C ATOM 1586 NE ARG A 97 -32.558 -2.471 -37.273 1.00 0.00 N ATOM 1587 CZ ARG A 97 -32.625 -1.358 -37.995 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -31.557 -0.583 -38.123 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -33.761 -1.019 -38.591 1.00 0.00 N ATOM 0 H ARG A 97 -27.783 -5.189 -34.890 1.00 0.00 H new ATOM 0 HA ARG A 97 -30.426 -5.707 -36.061 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -28.912 -3.452 -35.975 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -28.304 -4.141 -37.467 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -30.048 -2.880 -38.292 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -30.872 -4.409 -38.054 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -31.622 -3.612 -35.790 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -30.866 -2.064 -36.111 1.00 0.00 H new ATOM 0 HE ARG A 97 -33.397 -3.045 -37.195 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -30.682 -0.841 -37.667 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -31.610 0.271 -38.678 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -34.584 -1.613 -38.495 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -33.811 -0.164 -39.145 1.00 0.00 H new ATOM 1603 N GLU A 98 -29.674 -7.589 -37.481 1.00 0.00 N ATOM 1604 CA GLU A 98 -29.306 -8.649 -38.413 1.00 0.00 C ATOM 1605 C GLU A 98 -30.465 -8.975 -39.351 1.00 0.00 C ATOM 1606 O GLU A 98 -30.875 -10.130 -39.470 1.00 0.00 O ATOM 1607 CB GLU A 98 -28.884 -9.906 -37.650 1.00 0.00 C ATOM 1608 CG GLU A 98 -27.613 -9.726 -36.837 1.00 0.00 C ATOM 1609 CD GLU A 98 -26.363 -9.741 -37.697 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -26.385 -10.387 -38.765 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -25.363 -9.106 -37.301 1.00 0.00 O ATOM 0 H GLU A 98 -30.597 -7.697 -37.062 1.00 0.00 H new ATOM 0 HA GLU A 98 -28.465 -8.296 -39.011 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -29.693 -10.205 -36.983 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -28.739 -10.720 -38.360 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -27.664 -8.783 -36.294 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -27.547 -10.519 -36.093 1.00 0.00 H new ATOM 1618 N TYR A 99 -30.988 -7.950 -40.015 1.00 0.00 N ATOM 1619 CA TYR A 99 -32.101 -8.126 -40.940 1.00 0.00 C ATOM 1620 C TYR A 99 -32.053 -7.085 -42.054 1.00 0.00 C ATOM 1621 O TYR A 99 -32.871 -6.166 -42.096 1.00 0.00 O ATOM 1622 CB TYR A 99 -33.432 -8.029 -40.193 1.00 0.00 C ATOM 1623 CG TYR A 99 -33.577 -9.042 -39.080 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -33.159 -8.748 -37.788 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -34.131 -10.293 -39.320 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -33.289 -9.670 -36.768 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -34.266 -11.221 -38.306 1.00 0.00 C ATOM 1628 CZ TYR A 99 -33.844 -10.905 -37.032 1.00 0.00 C ATOM 1629 OH TYR A 99 -33.975 -11.828 -36.019 1.00 0.00 O ATOM 0 H TYR A 99 -30.659 -6.988 -39.930 1.00 0.00 H new ATOM 0 HA TYR A 99 -32.015 -9.116 -41.388 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -33.533 -7.027 -39.776 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -34.248 -8.163 -40.903 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -32.725 -7.782 -37.578 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -34.462 -10.544 -40.317 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -32.958 -9.426 -35.769 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -34.700 -12.189 -38.510 1.00 0.00 H new ATOM 0 HH TYR A 99 -34.385 -12.645 -36.372 1.00 0.00 H new ATOM 1639 N ARG A 100 -31.088 -7.237 -42.956 1.00 0.00 N ATOM 1640 CA ARG A 100 -30.932 -6.311 -44.071 1.00 0.00 C ATOM 1641 C ARG A 100 -30.681 -4.892 -43.568 1.00 0.00 C ATOM 1642 O ARG A 100 -30.687 -4.640 -42.363 1.00 0.00 O ATOM 1643 CB ARG A 100 -32.176 -6.336 -44.960 1.00 0.00 C ATOM 1644 CG ARG A 100 -32.090 -7.338 -46.100 1.00 0.00 C ATOM 1645 CD ARG A 100 -32.676 -6.773 -47.384 1.00 0.00 C ATOM 1646 NE ARG A 100 -32.062 -7.362 -48.571 1.00 0.00 N ATOM 1647 CZ ARG A 100 -30.860 -7.022 -49.023 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -30.146 -6.102 -48.389 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -30.369 -7.603 -50.110 1.00 0.00 N ATOM 0 H ARG A 100 -30.403 -7.992 -42.936 1.00 0.00 H new ATOM 0 HA ARG A 100 -30.069 -6.628 -44.657 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -33.046 -6.570 -44.346 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -32.337 -5.340 -45.374 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -31.049 -7.614 -46.265 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -32.622 -8.249 -45.826 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -33.750 -6.955 -47.403 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -32.536 -5.692 -47.402 1.00 0.00 H new ATOM 0 HE ARG A 100 -32.585 -8.074 -49.081 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -30.519 -5.654 -47.552 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -29.223 -5.843 -48.738 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -30.915 -8.312 -50.600 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -29.446 -7.341 -50.456 1.00 0.00 H new ATOM 1663 N ASP A 101 -30.460 -3.971 -44.499 1.00 0.00 N ATOM 1664 CA ASP A 101 -30.208 -2.577 -44.152 1.00 0.00 C ATOM 1665 C ASP A 101 -31.426 -1.957 -43.476 1.00 0.00 C ATOM 1666 O ASP A 101 -31.352 -0.854 -42.931 1.00 0.00 O ATOM 1667 CB ASP A 101 -29.839 -1.776 -45.401 1.00 0.00 C ATOM 1668 CG ASP A 101 -28.377 -1.926 -45.774 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -28.037 -2.916 -46.456 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -27.573 -1.054 -45.385 1.00 0.00 O ATOM 0 H ASP A 101 -30.450 -4.164 -45.500 1.00 0.00 H new ATOM 0 HA ASP A 101 -29.373 -2.548 -43.452 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -30.459 -2.103 -46.235 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -30.062 -0.722 -45.232 1.00 0.00 H new TER 1675 ASP A 101