USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=23 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0841 USER MOD Single : A 6 SER OG : rot 180:sc= 0.195 USER MOD Single : A 8 LYS NZ :NH3+ -165:sc=-0.00207 (180deg=-0.0661) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.0167 USER MOD Single : A 11 GLN : amide:sc= -0.0552 X(o=-0.055,f=0) USER MOD Single : A 12 ASN : amide:sc= -0.586 K(o=-0.59,f=-2.1!) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.188 USER MOD Single : A 22 ASN : amide:sc= 0 K(o=0,f=-1.4) 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 X(o=0,f=-0.14) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 41:sc= 0.146 USER MOD Single : A 43 HIS : no HD1:sc= -0.0661 X(o=-0.066,f=-0.31) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 26:sc= -0.308 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+ -177:sc= -0.487 (180deg=-0.499) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -147:sc= -0.122 (180deg=-0.759) 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= -0.0636 X(o=-0.064,f=-0.44) USER MOD Single : A 93 GLN : amide:sc= -0.169 K(o=-0.17,f=-1.9!) 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 -0.670 -0.184 3.602 1.00 0.00 N ATOM 2 CA GLY A 1 -0.019 0.962 2.995 1.00 0.00 C ATOM 3 C GLY A 1 -0.568 1.279 1.618 1.00 0.00 C ATOM 4 O GLY A 1 -1.778 1.231 1.399 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.259 -0.359 4.541 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.688 0.006 3.699 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.530 -1.021 3.001 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.143 1.831 3.641 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.051 0.771 2.921 1.00 0.00 H new ATOM 8 N SER A 2 0.324 1.605 0.688 1.00 0.00 N ATOM 9 CA SER A 2 -0.078 1.936 -0.674 1.00 0.00 C ATOM 10 C SER A 2 0.779 1.189 -1.691 1.00 0.00 C ATOM 11 O SER A 2 1.281 1.779 -2.648 1.00 0.00 O ATOM 12 CB SER A 2 0.030 3.444 -0.908 1.00 0.00 C ATOM 13 OG SER A 2 -0.121 4.161 0.306 1.00 0.00 O ATOM 0 H SER A 2 1.330 1.647 0.853 1.00 0.00 H new ATOM 0 HA SER A 2 -1.116 1.629 -0.805 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.997 3.678 -1.354 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.734 3.761 -1.618 1.00 0.00 H new ATOM 0 HG SER A 2 -0.046 5.122 0.130 1.00 0.00 H new ATOM 19 N SER A 3 0.943 -0.112 -1.475 1.00 0.00 N ATOM 20 CA SER A 3 1.744 -0.940 -2.370 1.00 0.00 C ATOM 21 C SER A 3 0.926 -1.378 -3.581 1.00 0.00 C ATOM 22 O SER A 3 -0.210 -1.831 -3.447 1.00 0.00 O ATOM 23 CB SER A 3 2.272 -2.168 -1.626 1.00 0.00 C ATOM 24 OG SER A 3 3.372 -2.744 -2.309 1.00 0.00 O ATOM 0 H SER A 3 0.532 -0.616 -0.689 1.00 0.00 H new ATOM 0 HA SER A 3 2.588 -0.345 -2.719 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.574 -1.884 -0.618 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.476 -2.906 -1.525 1.00 0.00 H new ATOM 0 HG SER A 3 3.692 -3.526 -1.813 1.00 0.00 H new ATOM 30 N GLY A 4 1.513 -1.239 -4.766 1.00 0.00 N ATOM 31 CA GLY A 4 0.826 -1.624 -5.985 1.00 0.00 C ATOM 32 C GLY A 4 1.094 -0.665 -7.128 1.00 0.00 C ATOM 33 O GLY A 4 1.095 0.551 -6.941 1.00 0.00 O ATOM 0 H GLY A 4 2.453 -0.866 -4.903 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.140 -2.627 -6.275 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.247 -1.668 -5.796 1.00 0.00 H new ATOM 37 N SER A 5 1.322 -1.215 -8.317 1.00 0.00 N ATOM 38 CA SER A 5 1.598 -0.400 -9.495 1.00 0.00 C ATOM 39 C SER A 5 0.364 0.398 -9.905 1.00 0.00 C ATOM 40 O SER A 5 0.405 1.625 -9.991 1.00 0.00 O ATOM 41 CB SER A 5 2.056 -1.284 -10.657 1.00 0.00 C ATOM 42 OG SER A 5 1.129 -2.329 -10.898 1.00 0.00 O ATOM 0 H SER A 5 1.321 -2.220 -8.490 1.00 0.00 H new ATOM 0 HA SER A 5 2.395 0.300 -9.243 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.169 -0.679 -11.556 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.035 -1.707 -10.433 1.00 0.00 H new ATOM 0 HG SER A 5 1.443 -2.879 -11.646 1.00 0.00 H new ATOM 48 N SER A 6 -0.734 -0.309 -10.156 1.00 0.00 N ATOM 49 CA SER A 6 -1.980 0.332 -10.561 1.00 0.00 C ATOM 50 C SER A 6 -1.762 1.221 -11.781 1.00 0.00 C ATOM 51 O SER A 6 -0.697 1.199 -12.397 1.00 0.00 O ATOM 52 CB SER A 6 -2.549 1.161 -9.407 1.00 0.00 C ATOM 53 OG SER A 6 -3.927 1.428 -9.604 1.00 0.00 O ATOM 0 H SER A 6 -0.786 -1.325 -10.086 1.00 0.00 H new ATOM 0 HA SER A 6 -2.693 -0.449 -10.825 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.409 0.627 -8.467 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.001 2.100 -9.324 1.00 0.00 H new ATOM 0 HG SER A 6 -4.268 1.957 -8.853 1.00 0.00 H new ATOM 59 N GLY A 7 -2.781 2.003 -12.126 1.00 0.00 N ATOM 60 CA GLY A 7 -2.682 2.889 -13.271 1.00 0.00 C ATOM 61 C GLY A 7 -3.090 2.211 -14.564 1.00 0.00 C ATOM 62 O GLY A 7 -2.366 1.363 -15.086 1.00 0.00 O ATOM 0 H GLY A 7 -3.673 2.038 -11.633 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.314 3.762 -13.107 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.657 3.249 -13.361 1.00 0.00 H new ATOM 66 N LYS A 8 -4.255 2.584 -15.083 1.00 0.00 N ATOM 67 CA LYS A 8 -4.760 2.007 -16.323 1.00 0.00 C ATOM 68 C LYS A 8 -4.601 2.985 -17.483 1.00 0.00 C ATOM 69 O LYS A 8 -4.409 4.183 -17.275 1.00 0.00 O ATOM 70 CB LYS A 8 -6.233 1.620 -16.167 1.00 0.00 C ATOM 71 CG LYS A 8 -6.442 0.164 -15.789 1.00 0.00 C ATOM 72 CD LYS A 8 -7.754 -0.372 -16.336 1.00 0.00 C ATOM 73 CE LYS A 8 -7.548 -1.661 -17.116 1.00 0.00 C ATOM 74 NZ LYS A 8 -6.788 -1.432 -18.375 1.00 0.00 N ATOM 0 H LYS A 8 -4.867 3.284 -14.664 1.00 0.00 H new ATOM 0 HA LYS A 8 -4.177 1.113 -16.542 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.688 2.253 -15.405 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -6.754 1.822 -17.103 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -5.616 -0.434 -16.172 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.431 0.064 -14.704 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -8.447 -0.550 -15.513 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.213 0.376 -16.982 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.014 -2.380 -16.495 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.517 -2.102 -17.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -6.884 -2.262 -18.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.164 -0.592 -18.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -5.783 -1.282 -18.152 1.00 0.00 H new ATOM 88 N TYR A 9 -4.685 2.468 -18.703 1.00 0.00 N ATOM 89 CA TYR A 9 -4.549 3.295 -19.896 1.00 0.00 C ATOM 90 C TYR A 9 -3.216 4.037 -19.895 1.00 0.00 C ATOM 91 O TYR A 9 -3.139 5.203 -20.286 1.00 0.00 O ATOM 92 CB TYR A 9 -5.702 4.297 -19.981 1.00 0.00 C ATOM 93 CG TYR A 9 -7.062 3.645 -20.103 1.00 0.00 C ATOM 94 CD1 TYR A 9 -7.554 3.245 -21.339 1.00 0.00 C ATOM 95 CD2 TYR A 9 -7.853 3.430 -18.981 1.00 0.00 C ATOM 96 CE1 TYR A 9 -8.796 2.651 -21.454 1.00 0.00 C ATOM 97 CE2 TYR A 9 -9.095 2.834 -19.087 1.00 0.00 C ATOM 98 CZ TYR A 9 -9.562 2.447 -20.325 1.00 0.00 C ATOM 99 OH TYR A 9 -10.799 1.854 -20.436 1.00 0.00 O ATOM 0 H TYR A 9 -4.847 1.479 -18.892 1.00 0.00 H new ATOM 0 HA TYR A 9 -4.580 2.640 -20.767 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -5.689 4.929 -19.093 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -5.543 4.950 -20.839 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -6.956 3.401 -22.225 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -7.491 3.734 -18.010 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -9.165 2.348 -22.423 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -9.697 2.672 -18.205 1.00 0.00 H new ATOM 0 HH TYR A 9 -11.208 1.783 -19.548 1.00 0.00 H new ATOM 109 N THR A 10 -2.165 3.353 -19.453 1.00 0.00 N ATOM 110 CA THR A 10 -0.835 3.945 -19.400 1.00 0.00 C ATOM 111 C THR A 10 -0.037 3.618 -20.658 1.00 0.00 C ATOM 112 O THR A 10 0.450 4.515 -21.345 1.00 0.00 O ATOM 113 CB THR A 10 -0.051 3.456 -18.168 1.00 0.00 C ATOM 114 OG1 THR A 10 -0.261 2.052 -17.979 1.00 0.00 O ATOM 115 CG2 THR A 10 -0.481 4.211 -16.919 1.00 0.00 C ATOM 0 H THR A 10 -2.210 2.388 -19.126 1.00 0.00 H new ATOM 0 HA THR A 10 -0.972 5.024 -19.330 1.00 0.00 H new ATOM 0 HB THR A 10 1.009 3.644 -18.341 1.00 0.00 H new ATOM 0 HG1 THR A 10 0.242 1.749 -17.195 1.00 0.00 H new ATOM 0 HG21 THR A 10 0.086 3.849 -16.062 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.293 5.276 -17.055 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.545 4.050 -16.745 1.00 0.00 H new ATOM 123 N GLN A 11 0.092 2.328 -20.953 1.00 0.00 N ATOM 124 CA GLN A 11 0.831 1.884 -22.129 1.00 0.00 C ATOM 125 C GLN A 11 2.264 2.404 -22.099 1.00 0.00 C ATOM 126 O GLN A 11 2.646 3.244 -22.913 1.00 0.00 O ATOM 127 CB GLN A 11 0.131 2.355 -23.405 1.00 0.00 C ATOM 128 CG GLN A 11 -1.279 1.809 -23.562 1.00 0.00 C ATOM 129 CD GLN A 11 -1.505 1.156 -24.911 1.00 0.00 C ATOM 130 OE1 GLN A 11 -1.947 0.009 -24.993 1.00 0.00 O ATOM 131 NE2 GLN A 11 -1.203 1.884 -25.980 1.00 0.00 N ATOM 0 H GLN A 11 -0.305 1.573 -20.394 1.00 0.00 H new ATOM 0 HA GLN A 11 0.859 0.794 -22.120 1.00 0.00 H new ATOM 0 HB2 GLN A 11 0.092 3.444 -23.407 1.00 0.00 H new ATOM 0 HB3 GLN A 11 0.726 2.055 -24.268 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -1.473 1.082 -22.774 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -1.995 2.620 -23.431 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -0.839 2.830 -25.867 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -1.335 1.497 -26.914 1.00 0.00 H new ATOM 140 N ASN A 12 3.052 1.900 -21.155 1.00 0.00 N ATOM 141 CA ASN A 12 4.444 2.315 -21.019 1.00 0.00 C ATOM 142 C ASN A 12 5.352 1.471 -21.908 1.00 0.00 C ATOM 143 O ASN A 12 5.035 0.327 -22.229 1.00 0.00 O ATOM 144 CB ASN A 12 4.891 2.202 -19.561 1.00 0.00 C ATOM 145 CG ASN A 12 4.630 0.826 -18.980 1.00 0.00 C ATOM 146 OD1 ASN A 12 4.364 -0.128 -19.712 1.00 0.00 O ATOM 147 ND2 ASN A 12 4.704 0.717 -17.659 1.00 0.00 N ATOM 0 H ASN A 12 2.751 1.204 -20.473 1.00 0.00 H new ATOM 0 HA ASN A 12 4.520 3.355 -21.336 1.00 0.00 H new ATOM 0 HB2 ASN A 12 5.955 2.426 -19.492 1.00 0.00 H new ATOM 0 HB3 ASN A 12 4.368 2.950 -18.965 1.00 0.00 H new ATOM 0 HD21 ASN A 12 4.537 -0.184 -17.212 1.00 0.00 H new ATOM 0 HD22 ASN A 12 4.928 1.535 -17.092 1.00 0.00 H new ATOM 154 N ASN A 13 6.484 2.046 -22.302 1.00 0.00 N ATOM 155 CA ASN A 13 7.440 1.347 -23.154 1.00 0.00 C ATOM 156 C ASN A 13 8.328 0.420 -22.330 1.00 0.00 C ATOM 157 O ASN A 13 8.842 -0.578 -22.836 1.00 0.00 O ATOM 158 CB ASN A 13 8.303 2.352 -23.919 1.00 0.00 C ATOM 159 CG ASN A 13 8.072 2.291 -25.417 1.00 0.00 C ATOM 160 OD1 ASN A 13 7.125 2.884 -25.934 1.00 0.00 O ATOM 161 ND2 ASN A 13 8.939 1.573 -26.121 1.00 0.00 N ATOM 0 H ASN A 13 6.762 2.993 -22.045 1.00 0.00 H new ATOM 0 HA ASN A 13 6.879 0.743 -23.867 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.087 3.359 -23.562 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.355 2.158 -23.708 1.00 0.00 H new ATOM 0 HD21 ASN A 13 8.835 1.496 -27.133 1.00 0.00 H new ATOM 0 HD22 ASN A 13 9.709 1.098 -25.650 1.00 0.00 H new ATOM 168 N PHE A 14 8.502 0.756 -21.056 1.00 0.00 N ATOM 169 CA PHE A 14 9.328 -0.045 -20.160 1.00 0.00 C ATOM 170 C PHE A 14 8.463 -0.941 -19.279 1.00 0.00 C ATOM 171 O PHE A 14 7.280 -0.670 -19.071 1.00 0.00 O ATOM 172 CB PHE A 14 10.199 0.861 -19.287 1.00 0.00 C ATOM 173 CG PHE A 14 10.951 1.901 -20.067 1.00 0.00 C ATOM 174 CD1 PHE A 14 10.381 3.137 -20.327 1.00 0.00 C ATOM 175 CD2 PHE A 14 12.228 1.643 -20.540 1.00 0.00 C ATOM 176 CE1 PHE A 14 11.071 4.097 -21.044 1.00 0.00 C ATOM 177 CE2 PHE A 14 12.922 2.599 -21.256 1.00 0.00 C ATOM 178 CZ PHE A 14 12.343 3.827 -21.510 1.00 0.00 C ATOM 0 H PHE A 14 8.082 1.577 -20.621 1.00 0.00 H new ATOM 0 HA PHE A 14 9.973 -0.678 -20.770 1.00 0.00 H new ATOM 0 HB2 PHE A 14 9.568 1.357 -18.549 1.00 0.00 H new ATOM 0 HB3 PHE A 14 10.911 0.246 -18.736 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.386 3.353 -19.965 1.00 0.00 H new ATOM 0 HD2 PHE A 14 12.686 0.684 -20.347 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.616 5.057 -21.239 1.00 0.00 H new ATOM 0 HE2 PHE A 14 13.917 2.386 -21.617 1.00 0.00 H new ATOM 0 HZ PHE A 14 12.884 4.574 -22.072 1.00 0.00 H new ATOM 188 N ILE A 15 9.062 -2.010 -18.764 1.00 0.00 N ATOM 189 CA ILE A 15 8.347 -2.946 -17.904 1.00 0.00 C ATOM 190 C ILE A 15 9.163 -3.284 -16.661 1.00 0.00 C ATOM 191 O ILE A 15 10.302 -3.742 -16.757 1.00 0.00 O ATOM 192 CB ILE A 15 8.007 -4.249 -18.651 1.00 0.00 C ATOM 193 CG1 ILE A 15 7.287 -5.225 -17.718 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.270 -4.881 -19.216 1.00 0.00 C ATOM 195 CD1 ILE A 15 6.905 -6.528 -18.384 1.00 0.00 C ATOM 0 H ILE A 15 10.040 -2.249 -18.927 1.00 0.00 H new ATOM 0 HA ILE A 15 7.421 -2.456 -17.605 1.00 0.00 H new ATOM 0 HB ILE A 15 7.341 -4.011 -19.481 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.929 -5.438 -16.863 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.387 -4.747 -17.330 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.013 -5.801 -19.741 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.745 -4.188 -19.910 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.959 -5.108 -18.402 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.399 -7.170 -17.663 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.238 -6.326 -19.222 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.803 -7.028 -18.748 1.00 0.00 H new ATOM 207 N THR A 16 8.572 -3.056 -15.492 1.00 0.00 N ATOM 208 CA THR A 16 9.242 -3.337 -14.229 1.00 0.00 C ATOM 209 C THR A 16 9.535 -4.825 -14.081 1.00 0.00 C ATOM 210 O THR A 16 8.914 -5.658 -14.740 1.00 0.00 O ATOM 211 CB THR A 16 8.398 -2.869 -13.029 1.00 0.00 C ATOM 212 OG1 THR A 16 8.993 -3.319 -11.806 1.00 0.00 O ATOM 213 CG2 THR A 16 6.975 -3.396 -13.130 1.00 0.00 C ATOM 0 H THR A 16 7.630 -2.677 -15.394 1.00 0.00 H new ATOM 0 HA THR A 16 10.181 -2.784 -14.240 1.00 0.00 H new ATOM 0 HB THR A 16 8.367 -1.779 -13.038 1.00 0.00 H new ATOM 0 HG1 THR A 16 8.451 -3.016 -11.048 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.398 -3.052 -12.271 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.515 -3.028 -14.047 1.00 0.00 H new ATOM 0 HG23 THR A 16 6.991 -4.486 -13.144 1.00 0.00 H new ATOM 221 N GLY A 17 10.484 -5.154 -13.210 1.00 0.00 N ATOM 222 CA GLY A 17 10.842 -6.543 -12.990 1.00 0.00 C ATOM 223 C GLY A 17 9.659 -7.384 -12.553 1.00 0.00 C ATOM 224 O GLY A 17 9.383 -8.432 -13.136 1.00 0.00 O ATOM 0 H GLY A 17 11.012 -4.483 -12.652 1.00 0.00 H new ATOM 0 HA2 GLY A 17 11.259 -6.957 -13.908 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.623 -6.598 -12.232 1.00 0.00 H new ATOM 228 N VAL A 18 8.957 -6.924 -11.521 1.00 0.00 N ATOM 229 CA VAL A 18 7.798 -7.641 -11.005 1.00 0.00 C ATOM 230 C VAL A 18 6.815 -7.974 -12.122 1.00 0.00 C ATOM 231 O VAL A 18 6.105 -8.978 -12.059 1.00 0.00 O ATOM 232 CB VAL A 18 7.069 -6.824 -9.921 1.00 0.00 C ATOM 233 CG1 VAL A 18 6.433 -5.582 -10.526 1.00 0.00 C ATOM 234 CG2 VAL A 18 6.025 -7.681 -9.221 1.00 0.00 C ATOM 0 H VAL A 18 9.172 -6.058 -11.027 1.00 0.00 H new ATOM 0 HA VAL A 18 8.169 -8.566 -10.564 1.00 0.00 H new ATOM 0 HB VAL A 18 7.800 -6.503 -9.179 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.923 -5.018 -9.746 1.00 0.00 H new ATOM 0 HG12 VAL A 18 7.206 -4.960 -10.977 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.713 -5.877 -11.290 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.520 -7.088 -8.458 1.00 0.00 H new ATOM 0 HG22 VAL A 18 5.295 -8.033 -9.950 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.511 -8.537 -8.752 1.00 0.00 H new ATOM 244 N ARG A 19 6.780 -7.125 -13.144 1.00 0.00 N ATOM 245 CA ARG A 19 5.884 -7.328 -14.275 1.00 0.00 C ATOM 246 C ARG A 19 6.417 -8.417 -15.203 1.00 0.00 C ATOM 247 O ARG A 19 5.656 -9.238 -15.714 1.00 0.00 O ATOM 248 CB ARG A 19 5.706 -6.023 -15.053 1.00 0.00 C ATOM 249 CG ARG A 19 4.634 -5.112 -14.477 1.00 0.00 C ATOM 250 CD ARG A 19 3.238 -5.640 -14.768 1.00 0.00 C ATOM 251 NE ARG A 19 2.360 -5.537 -13.606 1.00 0.00 N ATOM 252 CZ ARG A 19 1.146 -6.072 -13.553 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.668 -6.744 -14.591 1.00 0.00 N ATOM 254 NH2 ARG A 19 0.406 -5.935 -12.459 1.00 0.00 N ATOM 0 H ARG A 19 7.362 -6.290 -13.212 1.00 0.00 H new ATOM 0 HA ARG A 19 4.917 -7.647 -13.887 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.655 -5.488 -15.070 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.454 -6.258 -16.087 1.00 0.00 H new ATOM 0 HG2 ARG A 19 4.773 -5.021 -13.400 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.741 -4.112 -14.897 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.806 -5.083 -15.599 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.303 -6.682 -15.082 1.00 0.00 H new ATOM 0 HE ARG A 19 2.698 -5.026 -12.790 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.233 -6.851 -15.433 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.265 -7.154 -14.547 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.770 -5.418 -11.658 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -0.527 -6.346 -12.419 1.00 0.00 H new ATOM 268 N ALA A 20 7.729 -8.416 -15.415 1.00 0.00 N ATOM 269 CA ALA A 20 8.364 -9.403 -16.278 1.00 0.00 C ATOM 270 C ALA A 20 8.398 -10.775 -15.612 1.00 0.00 C ATOM 271 O ALA A 20 8.340 -11.804 -16.285 1.00 0.00 O ATOM 272 CB ALA A 20 9.771 -8.957 -16.645 1.00 0.00 C ATOM 0 H ALA A 20 8.373 -7.742 -15.000 1.00 0.00 H new ATOM 0 HA ALA A 20 7.772 -9.486 -17.190 1.00 0.00 H new ATOM 0 HB1 ALA A 20 10.233 -9.704 -17.290 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.725 -8.003 -17.170 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.365 -8.844 -15.738 1.00 0.00 H new ATOM 278 N ILE A 21 8.494 -10.781 -14.287 1.00 0.00 N ATOM 279 CA ILE A 21 8.536 -12.026 -13.530 1.00 0.00 C ATOM 280 C ILE A 21 7.172 -12.709 -13.519 1.00 0.00 C ATOM 281 O ILE A 21 7.077 -13.925 -13.361 1.00 0.00 O ATOM 282 CB ILE A 21 8.989 -11.787 -12.078 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.380 -11.150 -12.053 1.00 0.00 C ATOM 284 CG2 ILE A 21 8.987 -13.095 -11.301 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.682 -10.408 -10.770 1.00 0.00 C ATOM 0 H ILE A 21 8.544 -9.938 -13.715 1.00 0.00 H new ATOM 0 HA ILE A 21 9.260 -12.673 -14.026 1.00 0.00 H new ATOM 0 HB ILE A 21 8.287 -11.102 -11.602 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.130 -11.928 -12.198 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.470 -10.460 -12.892 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.309 -12.910 -10.276 1.00 0.00 H new ATOM 0 HG22 ILE A 21 7.980 -13.513 -11.295 1.00 0.00 H new ATOM 0 HG23 ILE A 21 9.670 -13.800 -11.774 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.684 -9.983 -10.823 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.955 -9.608 -10.633 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.625 -11.098 -9.928 1.00 0.00 H new ATOM 297 N ASN A 22 6.119 -11.916 -13.690 1.00 0.00 N ATOM 298 CA ASN A 22 4.759 -12.445 -13.701 1.00 0.00 C ATOM 299 C ASN A 22 4.315 -12.774 -15.123 1.00 0.00 C ATOM 300 O ASN A 22 3.458 -13.631 -15.333 1.00 0.00 O ATOM 301 CB ASN A 22 3.793 -11.438 -13.074 1.00 0.00 C ATOM 302 CG ASN A 22 3.974 -11.322 -11.572 1.00 0.00 C ATOM 303 OD1 ASN A 22 4.881 -11.923 -10.997 1.00 0.00 O ATOM 304 ND2 ASN A 22 3.108 -10.547 -10.930 1.00 0.00 N ATOM 0 H ASN A 22 6.181 -10.907 -13.823 1.00 0.00 H new ATOM 0 HA ASN A 22 4.748 -13.363 -13.114 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.943 -10.460 -13.532 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.768 -11.738 -13.292 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.179 -10.431 -9.919 1.00 0.00 H new ATOM 0 HD22 ASN A 22 2.371 -10.067 -11.448 1.00 0.00 H new ATOM 311 N GLU A 23 4.906 -12.086 -16.096 1.00 0.00 N ATOM 312 CA GLU A 23 4.570 -12.306 -17.498 1.00 0.00 C ATOM 313 C GLU A 23 5.460 -13.385 -18.108 1.00 0.00 C ATOM 314 O GLU A 23 4.975 -14.416 -18.573 1.00 0.00 O ATOM 315 CB GLU A 23 4.713 -11.004 -18.289 1.00 0.00 C ATOM 316 CG GLU A 23 3.603 -10.003 -18.019 1.00 0.00 C ATOM 317 CD GLU A 23 3.325 -9.106 -19.210 1.00 0.00 C ATOM 318 OE1 GLU A 23 3.471 -9.578 -20.356 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.959 -7.931 -18.994 1.00 0.00 O ATOM 0 H GLU A 23 5.618 -11.373 -15.939 1.00 0.00 H new ATOM 0 HA GLU A 23 3.534 -12.642 -17.549 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.672 -10.545 -18.047 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.731 -11.236 -19.354 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.692 -10.539 -17.752 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.874 -9.388 -17.161 1.00 0.00 H new ATOM 326 N PHE A 24 6.766 -13.140 -18.102 1.00 0.00 N ATOM 327 CA PHE A 24 7.725 -14.089 -18.655 1.00 0.00 C ATOM 328 C PHE A 24 7.886 -15.297 -17.737 1.00 0.00 C ATOM 329 O PHE A 24 8.407 -16.336 -18.146 1.00 0.00 O ATOM 330 CB PHE A 24 9.081 -13.412 -18.868 1.00 0.00 C ATOM 331 CG PHE A 24 9.045 -12.303 -19.880 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.533 -11.059 -19.547 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.523 -12.504 -21.165 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.498 -10.038 -20.478 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.491 -11.486 -22.100 1.00 0.00 C ATOM 336 CZ PHE A 24 8.979 -10.251 -21.755 1.00 0.00 C ATOM 0 H PHE A 24 7.185 -12.292 -17.720 1.00 0.00 H new ATOM 0 HA PHE A 24 7.344 -14.433 -19.616 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.433 -13.013 -17.916 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.806 -14.161 -19.187 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.157 -10.885 -18.549 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.926 -13.468 -21.440 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.094 -9.074 -20.207 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.866 -11.657 -23.098 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.955 -9.453 -22.482 1.00 0.00 H new ATOM 346 N CYS A 25 7.435 -15.154 -16.496 1.00 0.00 N ATOM 347 CA CYS A 25 7.530 -16.233 -15.519 1.00 0.00 C ATOM 348 C CYS A 25 8.983 -16.640 -15.298 1.00 0.00 C ATOM 349 O CYS A 25 9.375 -17.768 -15.599 1.00 0.00 O ATOM 350 CB CYS A 25 6.713 -17.440 -15.981 1.00 0.00 C ATOM 351 SG CYS A 25 4.975 -17.389 -15.487 1.00 0.00 S ATOM 0 H CYS A 25 7.000 -14.302 -16.142 1.00 0.00 H new ATOM 0 HA CYS A 25 7.126 -15.871 -14.574 1.00 0.00 H new ATOM 0 HB2 CYS A 25 6.769 -17.508 -17.067 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.167 -18.347 -15.581 1.00 0.00 H new ATOM 0 HG CYS A 25 4.368 -18.451 -15.926 1.00 0.00 H new ATOM 357 N LEU A 26 9.777 -15.715 -14.771 1.00 0.00 N ATOM 358 CA LEU A 26 11.189 -15.977 -14.511 1.00 0.00 C ATOM 359 C LEU A 26 11.499 -15.857 -13.022 1.00 0.00 C ATOM 360 O LEU A 26 10.594 -15.751 -12.194 1.00 0.00 O ATOM 361 CB LEU A 26 12.063 -15.005 -15.306 1.00 0.00 C ATOM 362 CG LEU A 26 11.738 -14.874 -16.794 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.116 -13.492 -17.303 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.455 -15.953 -17.593 1.00 0.00 C ATOM 0 H LEU A 26 9.468 -14.777 -14.515 1.00 0.00 H new ATOM 0 HA LEU A 26 11.409 -16.996 -14.828 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.983 -14.019 -14.849 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.102 -15.319 -15.208 1.00 0.00 H new ATOM 0 HG LEU A 26 10.664 -15.006 -16.925 1.00 0.00 H new ATOM 0 HD11 LEU A 26 11.877 -13.417 -18.364 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.558 -12.736 -16.751 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.184 -13.331 -17.159 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.212 -15.845 -18.650 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.532 -15.852 -17.456 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.135 -16.936 -17.246 1.00 0.00 H new ATOM 376 N LYS A 27 12.785 -15.871 -12.688 1.00 0.00 N ATOM 377 CA LYS A 27 13.217 -15.760 -11.300 1.00 0.00 C ATOM 378 C LYS A 27 13.405 -14.300 -10.903 1.00 0.00 C ATOM 379 O LYS A 27 13.351 -13.405 -11.748 1.00 0.00 O ATOM 380 CB LYS A 27 14.523 -16.530 -11.088 1.00 0.00 C ATOM 381 CG LYS A 27 14.366 -18.036 -11.199 1.00 0.00 C ATOM 382 CD LYS A 27 13.621 -18.609 -10.005 1.00 0.00 C ATOM 383 CE LYS A 27 12.905 -19.902 -10.364 1.00 0.00 C ATOM 384 NZ LYS A 27 13.193 -20.986 -9.384 1.00 0.00 N ATOM 0 H LYS A 27 13.547 -15.958 -13.361 1.00 0.00 H new ATOM 0 HA LYS A 27 12.441 -16.192 -10.669 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.256 -16.195 -11.822 1.00 0.00 H new ATOM 0 HB3 LYS A 27 14.923 -16.286 -10.104 1.00 0.00 H new ATOM 0 HG2 LYS A 27 13.829 -18.280 -12.115 1.00 0.00 H new ATOM 0 HG3 LYS A 27 15.349 -18.501 -11.273 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.322 -18.794 -9.191 1.00 0.00 H new ATOM 0 HD3 LYS A 27 12.897 -17.879 -9.642 1.00 0.00 H new ATOM 0 HE2 LYS A 27 11.830 -19.723 -10.403 1.00 0.00 H new ATOM 0 HE3 LYS A 27 13.211 -20.222 -11.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 12.687 -21.850 -9.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.216 -21.174 -9.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 12.878 -20.691 -8.438 1.00 0.00 H new ATOM 398 N SER A 28 13.627 -14.065 -9.614 1.00 0.00 N ATOM 399 CA SER A 28 13.821 -12.712 -9.106 1.00 0.00 C ATOM 400 C SER A 28 15.231 -12.214 -9.410 1.00 0.00 C ATOM 401 O SER A 28 15.412 -11.121 -9.947 1.00 0.00 O ATOM 402 CB SER A 28 13.568 -12.670 -7.598 1.00 0.00 C ATOM 403 OG SER A 28 12.634 -11.658 -7.265 1.00 0.00 O ATOM 0 H SER A 28 13.677 -14.794 -8.902 1.00 0.00 H new ATOM 0 HA SER A 28 13.107 -12.057 -9.606 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.196 -13.638 -7.262 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.506 -12.490 -7.074 1.00 0.00 H new ATOM 0 HG SER A 28 12.488 -11.653 -6.296 1.00 0.00 H new ATOM 409 N SER A 29 16.226 -13.024 -9.063 1.00 0.00 N ATOM 410 CA SER A 29 17.620 -12.665 -9.295 1.00 0.00 C ATOM 411 C SER A 29 17.886 -12.454 -10.782 1.00 0.00 C ATOM 412 O SER A 29 18.787 -11.707 -11.163 1.00 0.00 O ATOM 413 CB SER A 29 18.546 -13.754 -8.749 1.00 0.00 C ATOM 414 OG SER A 29 19.836 -13.663 -9.328 1.00 0.00 O ATOM 0 H SER A 29 16.093 -13.933 -8.620 1.00 0.00 H new ATOM 0 HA SER A 29 17.821 -11.730 -8.772 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.623 -13.661 -7.666 1.00 0.00 H new ATOM 0 HB3 SER A 29 18.120 -14.736 -8.955 1.00 0.00 H new ATOM 0 HG SER A 29 20.409 -14.368 -8.962 1.00 0.00 H new ATOM 420 N ASP A 30 17.096 -13.118 -11.618 1.00 0.00 N ATOM 421 CA ASP A 30 17.244 -13.004 -13.064 1.00 0.00 C ATOM 422 C ASP A 30 17.154 -11.546 -13.506 1.00 0.00 C ATOM 423 O ASP A 30 18.074 -11.018 -14.132 1.00 0.00 O ATOM 424 CB ASP A 30 16.173 -13.832 -13.776 1.00 0.00 C ATOM 425 CG ASP A 30 16.532 -15.304 -13.847 1.00 0.00 C ATOM 426 OD1 ASP A 30 17.643 -15.665 -13.404 1.00 0.00 O ATOM 427 OD2 ASP A 30 15.703 -16.094 -14.346 1.00 0.00 O ATOM 0 H ASP A 30 16.346 -13.741 -11.319 1.00 0.00 H new ATOM 0 HA ASP A 30 18.228 -13.388 -13.334 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.223 -13.717 -13.254 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.031 -13.446 -14.786 1.00 0.00 H new ATOM 432 N LEU A 31 16.040 -10.902 -13.178 1.00 0.00 N ATOM 433 CA LEU A 31 15.828 -9.505 -13.541 1.00 0.00 C ATOM 434 C LEU A 31 16.987 -8.636 -13.063 1.00 0.00 C ATOM 435 O LEU A 31 17.428 -7.731 -13.770 1.00 0.00 O ATOM 436 CB LEU A 31 14.515 -8.996 -12.945 1.00 0.00 C ATOM 437 CG LEU A 31 13.254 -9.274 -13.764 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.274 -8.480 -15.061 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.121 -10.762 -14.050 1.00 0.00 C ATOM 0 H LEU A 31 15.269 -11.325 -12.661 1.00 0.00 H new ATOM 0 HA LEU A 31 15.775 -9.442 -14.628 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.389 -9.443 -11.959 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.599 -7.919 -12.799 1.00 0.00 H new ATOM 0 HG LEU A 31 12.389 -8.958 -13.181 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.369 -8.691 -15.631 1.00 0.00 H new ATOM 0 HD12 LEU A 31 13.321 -7.415 -14.835 1.00 0.00 H new ATOM 0 HD13 LEU A 31 14.147 -8.765 -15.649 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.218 -10.941 -14.634 1.00 0.00 H new ATOM 0 HD22 LEU A 31 13.990 -11.104 -14.612 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.059 -11.309 -13.109 1.00 0.00 H new ATOM 451 N GLU A 32 17.477 -8.921 -11.860 1.00 0.00 N ATOM 452 CA GLU A 32 18.586 -8.166 -11.290 1.00 0.00 C ATOM 453 C GLU A 32 19.789 -8.173 -12.228 1.00 0.00 C ATOM 454 O GLU A 32 20.614 -7.261 -12.202 1.00 0.00 O ATOM 455 CB GLU A 32 18.982 -8.747 -9.931 1.00 0.00 C ATOM 456 CG GLU A 32 18.343 -8.031 -8.753 1.00 0.00 C ATOM 457 CD GLU A 32 19.349 -7.252 -7.928 1.00 0.00 C ATOM 458 OE1 GLU A 32 20.267 -6.651 -8.526 1.00 0.00 O ATOM 459 OE2 GLU A 32 19.220 -7.243 -6.686 1.00 0.00 O ATOM 0 H GLU A 32 17.124 -9.668 -11.263 1.00 0.00 H new ATOM 0 HA GLU A 32 18.259 -7.135 -11.155 1.00 0.00 H new ATOM 0 HB2 GLU A 32 18.702 -9.800 -9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 32 20.066 -8.702 -9.828 1.00 0.00 H new ATOM 0 HG2 GLU A 32 17.575 -7.350 -9.120 1.00 0.00 H new ATOM 0 HG3 GLU A 32 17.844 -8.761 -8.116 1.00 0.00 H new ATOM 466 N GLN A 33 19.881 -9.210 -13.055 1.00 0.00 N ATOM 467 CA GLN A 33 20.984 -9.337 -14.001 1.00 0.00 C ATOM 468 C GLN A 33 20.892 -8.273 -15.089 1.00 0.00 C ATOM 469 O GLN A 33 21.901 -7.885 -15.679 1.00 0.00 O ATOM 470 CB GLN A 33 20.984 -10.730 -14.632 1.00 0.00 C ATOM 471 CG GLN A 33 22.295 -11.089 -15.312 1.00 0.00 C ATOM 472 CD GLN A 33 22.092 -11.878 -16.591 1.00 0.00 C ATOM 473 OE1 GLN A 33 21.326 -12.841 -16.625 1.00 0.00 O ATOM 474 NE2 GLN A 33 22.780 -11.472 -17.652 1.00 0.00 N ATOM 0 H GLN A 33 19.206 -9.974 -13.089 1.00 0.00 H new ATOM 0 HA GLN A 33 21.917 -9.193 -13.455 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.770 -11.469 -13.860 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.177 -10.789 -15.363 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.846 -10.175 -15.537 1.00 0.00 H new ATOM 0 HG3 GLN A 33 22.909 -11.670 -14.624 1.00 0.00 H new ATOM 0 HE21 GLN A 33 23.404 -10.668 -17.578 1.00 0.00 H new ATOM 0 HE22 GLN A 33 22.685 -11.964 -18.540 1.00 0.00 H new ATOM 483 N LEU A 34 19.677 -7.805 -15.351 1.00 0.00 N ATOM 484 CA LEU A 34 19.453 -6.785 -16.370 1.00 0.00 C ATOM 485 C LEU A 34 19.736 -5.392 -15.817 1.00 0.00 C ATOM 486 O LEU A 34 19.801 -5.196 -14.604 1.00 0.00 O ATOM 487 CB LEU A 34 18.015 -6.859 -16.887 1.00 0.00 C ATOM 488 CG LEU A 34 17.553 -8.227 -17.391 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.035 -8.286 -17.457 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.160 -8.527 -18.753 1.00 0.00 C ATOM 0 H LEU A 34 18.832 -8.115 -14.872 1.00 0.00 H new ATOM 0 HA LEU A 34 20.139 -6.974 -17.196 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.346 -6.544 -16.087 1.00 0.00 H new ATOM 0 HB3 LEU A 34 17.904 -6.139 -17.698 1.00 0.00 H new ATOM 0 HG LEU A 34 17.896 -8.986 -16.688 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.724 -9.267 -17.818 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.621 -8.117 -16.463 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.670 -7.517 -18.138 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.820 -9.504 -19.096 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.848 -7.764 -19.466 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.247 -8.528 -18.675 1.00 0.00 H new ATOM 502 N ARG A 35 19.900 -4.426 -16.716 1.00 0.00 N ATOM 503 CA ARG A 35 20.174 -3.051 -16.318 1.00 0.00 C ATOM 504 C ARG A 35 18.902 -2.361 -15.834 1.00 0.00 C ATOM 505 O ARG A 35 17.880 -2.367 -16.520 1.00 0.00 O ATOM 506 CB ARG A 35 20.778 -2.270 -17.487 1.00 0.00 C ATOM 507 CG ARG A 35 22.162 -1.713 -17.197 1.00 0.00 C ATOM 508 CD ARG A 35 23.104 -1.921 -18.373 1.00 0.00 C ATOM 509 NE ARG A 35 24.501 -1.981 -17.952 1.00 0.00 N ATOM 510 CZ ARG A 35 25.181 -0.930 -17.509 1.00 0.00 C ATOM 511 NH1 ARG A 35 24.596 0.257 -17.429 1.00 0.00 N ATOM 512 NH2 ARG A 35 26.450 -1.065 -17.144 1.00 0.00 N ATOM 0 H ARG A 35 19.848 -4.571 -17.724 1.00 0.00 H new ATOM 0 HA ARG A 35 20.890 -3.073 -15.496 1.00 0.00 H new ATOM 0 HB2 ARG A 35 20.833 -2.922 -18.359 1.00 0.00 H new ATOM 0 HB3 ARG A 35 20.112 -1.447 -17.746 1.00 0.00 H new ATOM 0 HG2 ARG A 35 22.088 -0.649 -16.973 1.00 0.00 H new ATOM 0 HG3 ARG A 35 22.572 -2.197 -16.311 1.00 0.00 H new ATOM 0 HD2 ARG A 35 22.841 -2.844 -18.889 1.00 0.00 H new ATOM 0 HD3 ARG A 35 22.976 -1.109 -19.088 1.00 0.00 H new ATOM 0 HE ARG A 35 24.981 -2.880 -18.001 1.00 0.00 H new ATOM 0 HH11 ARG A 35 23.621 0.365 -17.708 1.00 0.00 H new ATOM 0 HH12 ARG A 35 25.121 1.062 -17.088 1.00 0.00 H new ATOM 0 HH21 ARG A 35 26.904 -1.977 -17.204 1.00 0.00 H new ATOM 0 HH22 ARG A 35 26.972 -0.257 -16.804 1.00 0.00 H new ATOM 526 N LYS A 36 18.972 -1.766 -14.648 1.00 0.00 N ATOM 527 CA LYS A 36 17.828 -1.071 -14.072 1.00 0.00 C ATOM 528 C LYS A 36 17.552 0.232 -14.815 1.00 0.00 C ATOM 529 O LYS A 36 18.155 1.265 -14.521 1.00 0.00 O ATOM 530 CB LYS A 36 18.074 -0.783 -12.589 1.00 0.00 C ATOM 531 CG LYS A 36 18.444 -2.015 -11.783 1.00 0.00 C ATOM 532 CD LYS A 36 18.800 -1.658 -10.349 1.00 0.00 C ATOM 533 CE LYS A 36 19.845 -2.607 -9.782 1.00 0.00 C ATOM 534 NZ LYS A 36 20.201 -2.264 -8.377 1.00 0.00 N ATOM 0 H LYS A 36 19.810 -1.751 -14.067 1.00 0.00 H new ATOM 0 HA LYS A 36 16.955 -1.716 -14.171 1.00 0.00 H new ATOM 0 HB2 LYS A 36 18.873 -0.047 -12.498 1.00 0.00 H new ATOM 0 HB3 LYS A 36 17.177 -0.335 -12.161 1.00 0.00 H new ATOM 0 HG2 LYS A 36 17.611 -2.718 -11.788 1.00 0.00 H new ATOM 0 HG3 LYS A 36 19.288 -2.519 -12.254 1.00 0.00 H new ATOM 0 HD2 LYS A 36 19.176 -0.636 -10.310 1.00 0.00 H new ATOM 0 HD3 LYS A 36 17.903 -1.692 -9.731 1.00 0.00 H new ATOM 0 HE2 LYS A 36 19.468 -3.629 -9.822 1.00 0.00 H new ATOM 0 HE3 LYS A 36 20.741 -2.574 -10.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 20.916 -2.933 -8.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 20.585 -1.298 -8.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 19.351 -2.321 -7.780 1.00 0.00 H new ATOM 548 N ILE A 37 16.637 0.177 -15.777 1.00 0.00 N ATOM 549 CA ILE A 37 16.280 1.354 -16.560 1.00 0.00 C ATOM 550 C ILE A 37 15.465 2.340 -15.729 1.00 0.00 C ATOM 551 O ILE A 37 14.282 2.119 -15.469 1.00 0.00 O ATOM 552 CB ILE A 37 15.477 0.972 -17.817 1.00 0.00 C ATOM 553 CG1 ILE A 37 16.174 -0.164 -18.568 1.00 0.00 C ATOM 554 CG2 ILE A 37 15.301 2.182 -18.721 1.00 0.00 C ATOM 555 CD1 ILE A 37 17.585 0.172 -18.997 1.00 0.00 C ATOM 0 H ILE A 37 16.129 -0.670 -16.033 1.00 0.00 H new ATOM 0 HA ILE A 37 17.214 1.825 -16.866 1.00 0.00 H new ATOM 0 HB ILE A 37 14.490 0.627 -17.509 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.197 -1.049 -17.932 1.00 0.00 H new ATOM 0 HG13 ILE A 37 15.586 -0.420 -19.449 1.00 0.00 H new ATOM 0 HG21 ILE A 37 14.731 1.896 -19.605 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.766 2.964 -18.182 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.279 2.555 -19.025 1.00 0.00 H new ATOM 0 HD11 ILE A 37 18.018 -0.679 -19.523 1.00 0.00 H new ATOM 0 HD12 ILE A 37 17.568 1.038 -19.659 1.00 0.00 H new ATOM 0 HD13 ILE A 37 18.188 0.400 -18.118 1.00 0.00 H new ATOM 567 N ARG A 38 16.105 3.429 -15.318 1.00 0.00 N ATOM 568 CA ARG A 38 15.440 4.450 -14.518 1.00 0.00 C ATOM 569 C ARG A 38 14.932 5.587 -15.400 1.00 0.00 C ATOM 570 O ARG A 38 14.817 6.728 -14.953 1.00 0.00 O ATOM 571 CB ARG A 38 16.395 5.001 -13.457 1.00 0.00 C ATOM 572 CG ARG A 38 15.692 5.522 -12.215 1.00 0.00 C ATOM 573 CD ARG A 38 16.518 5.276 -10.962 1.00 0.00 C ATOM 574 NE ARG A 38 16.592 3.857 -10.625 1.00 0.00 N ATOM 575 CZ ARG A 38 17.129 3.395 -9.501 1.00 0.00 C ATOM 576 NH1 ARG A 38 17.636 4.237 -8.611 1.00 0.00 N ATOM 577 NH2 ARG A 38 17.159 2.090 -9.266 1.00 0.00 N ATOM 0 H ARG A 38 17.084 3.627 -15.526 1.00 0.00 H new ATOM 0 HA ARG A 38 14.586 3.988 -14.023 1.00 0.00 H new ATOM 0 HB2 ARG A 38 17.093 4.216 -13.166 1.00 0.00 H new ATOM 0 HB3 ARG A 38 16.985 5.806 -13.895 1.00 0.00 H new ATOM 0 HG2 ARG A 38 15.503 6.590 -12.324 1.00 0.00 H new ATOM 0 HG3 ARG A 38 14.722 5.035 -12.114 1.00 0.00 H new ATOM 0 HD2 ARG A 38 17.525 5.667 -11.109 1.00 0.00 H new ATOM 0 HD3 ARG A 38 16.082 5.825 -10.127 1.00 0.00 H new ATOM 0 HE ARG A 38 16.210 3.183 -11.289 1.00 0.00 H new ATOM 0 HH11 ARG A 38 17.614 5.241 -8.789 1.00 0.00 H new ATOM 0 HH12 ARG A 38 18.048 3.881 -7.749 1.00 0.00 H new ATOM 0 HH21 ARG A 38 16.770 1.440 -9.949 1.00 0.00 H new ATOM 0 HH22 ARG A 38 17.572 1.737 -8.403 1.00 0.00 H new ATOM 591 N ARG A 39 14.630 5.266 -16.654 1.00 0.00 N ATOM 592 CA ARG A 39 14.137 6.261 -17.599 1.00 0.00 C ATOM 593 C ARG A 39 15.075 7.462 -17.664 1.00 0.00 C ATOM 594 O ARG A 39 16.179 7.430 -17.119 1.00 0.00 O ATOM 595 CB ARG A 39 12.732 6.719 -17.203 1.00 0.00 C ATOM 596 CG ARG A 39 11.787 5.573 -16.877 1.00 0.00 C ATOM 597 CD ARG A 39 10.396 5.821 -17.441 1.00 0.00 C ATOM 598 NE ARG A 39 9.353 5.592 -16.444 1.00 0.00 N ATOM 599 CZ ARG A 39 9.106 6.421 -15.436 1.00 0.00 C ATOM 600 NH1 ARG A 39 9.822 7.527 -15.291 1.00 0.00 N ATOM 601 NH2 ARG A 39 8.140 6.144 -14.570 1.00 0.00 N ATOM 0 H ARG A 39 14.718 4.325 -17.039 1.00 0.00 H new ATOM 0 HA ARG A 39 14.097 5.799 -18.586 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.804 7.377 -16.337 1.00 0.00 H new ATOM 0 HB3 ARG A 39 12.308 7.308 -18.016 1.00 0.00 H new ATOM 0 HG2 ARG A 39 12.186 4.644 -17.284 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.726 5.447 -15.796 1.00 0.00 H new ATOM 0 HD2 ARG A 39 10.330 6.846 -17.806 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.230 5.167 -18.297 1.00 0.00 H new ATOM 0 HE ARG A 39 8.784 4.750 -16.526 1.00 0.00 H new ATOM 0 HH11 ARG A 39 10.566 7.744 -15.955 1.00 0.00 H new ATOM 0 HH12 ARG A 39 9.629 8.161 -14.516 1.00 0.00 H new ATOM 0 HH21 ARG A 39 7.587 5.294 -14.678 1.00 0.00 H new ATOM 0 HH22 ARG A 39 7.951 6.781 -13.796 1.00 0.00 H new ATOM 615 N ARG A 40 14.629 8.520 -18.334 1.00 0.00 N ATOM 616 CA ARG A 40 15.429 9.730 -18.471 1.00 0.00 C ATOM 617 C ARG A 40 14.597 10.971 -18.161 1.00 0.00 C ATOM 618 O ARG A 40 13.590 11.234 -18.818 1.00 0.00 O ATOM 619 CB ARG A 40 16.004 9.829 -19.886 1.00 0.00 C ATOM 620 CG ARG A 40 17.433 10.346 -19.928 1.00 0.00 C ATOM 621 CD ARG A 40 17.961 10.408 -21.352 1.00 0.00 C ATOM 622 NE ARG A 40 18.761 11.607 -21.588 1.00 0.00 N ATOM 623 CZ ARG A 40 18.254 12.835 -21.617 1.00 0.00 C ATOM 624 NH1 ARG A 40 16.956 13.024 -21.425 1.00 0.00 N ATOM 625 NH2 ARG A 40 19.046 13.876 -21.837 1.00 0.00 N ATOM 0 H ARG A 40 13.718 8.563 -18.790 1.00 0.00 H new ATOM 0 HA ARG A 40 16.249 9.676 -17.755 1.00 0.00 H new ATOM 0 HB2 ARG A 40 15.969 8.845 -20.353 1.00 0.00 H new ATOM 0 HB3 ARG A 40 15.371 10.487 -20.481 1.00 0.00 H new ATOM 0 HG2 ARG A 40 17.475 11.339 -19.480 1.00 0.00 H new ATOM 0 HG3 ARG A 40 18.073 9.698 -19.329 1.00 0.00 H new ATOM 0 HD2 ARG A 40 18.566 9.524 -21.553 1.00 0.00 H new ATOM 0 HD3 ARG A 40 17.124 10.388 -22.050 1.00 0.00 H new ATOM 0 HE ARG A 40 19.764 11.496 -21.739 1.00 0.00 H new ATOM 0 HH11 ARG A 40 16.344 12.226 -21.255 1.00 0.00 H new ATOM 0 HH12 ARG A 40 16.569 13.968 -21.448 1.00 0.00 H new ATOM 0 HH21 ARG A 40 20.045 13.734 -21.984 1.00 0.00 H new ATOM 0 HH22 ARG A 40 18.656 14.818 -21.859 1.00 0.00 H new ATOM 639 N SER A 41 15.024 11.728 -17.156 1.00 0.00 N ATOM 640 CA SER A 41 14.316 12.938 -16.756 1.00 0.00 C ATOM 641 C SER A 41 15.244 13.887 -16.004 1.00 0.00 C ATOM 642 O SER A 41 16.291 13.494 -15.488 1.00 0.00 O ATOM 643 CB SER A 41 13.112 12.584 -15.882 1.00 0.00 C ATOM 644 OG SER A 41 11.917 12.567 -16.643 1.00 0.00 O ATOM 0 H SER A 41 15.857 11.525 -16.604 1.00 0.00 H new ATOM 0 HA SER A 41 13.966 13.440 -17.658 1.00 0.00 H new ATOM 0 HB2 SER A 41 13.267 11.608 -15.421 1.00 0.00 H new ATOM 0 HB3 SER A 41 13.021 13.308 -15.072 1.00 0.00 H new ATOM 0 HG SER A 41 12.088 12.145 -17.511 1.00 0.00 H new ATOM 650 N PRO A 42 14.852 15.168 -15.938 1.00 0.00 N ATOM 651 CA PRO A 42 15.634 16.201 -15.250 1.00 0.00 C ATOM 652 C PRO A 42 15.628 16.019 -13.736 1.00 0.00 C ATOM 653 O PRO A 42 14.743 15.368 -13.182 1.00 0.00 O ATOM 654 CB PRO A 42 14.922 17.500 -15.636 1.00 0.00 C ATOM 655 CG PRO A 42 13.523 17.089 -15.942 1.00 0.00 C ATOM 656 CD PRO A 42 13.616 15.708 -16.530 1.00 0.00 C ATOM 0 HA PRO A 42 16.686 16.175 -15.535 1.00 0.00 H new ATOM 0 HB2 PRO A 42 14.953 18.225 -14.823 1.00 0.00 H new ATOM 0 HB3 PRO A 42 15.395 17.969 -16.499 1.00 0.00 H new ATOM 0 HG2 PRO A 42 12.910 17.089 -15.040 1.00 0.00 H new ATOM 0 HG3 PRO A 42 13.058 17.781 -16.644 1.00 0.00 H new ATOM 0 HD2 PRO A 42 12.748 15.102 -16.271 1.00 0.00 H new ATOM 0 HD3 PRO A 42 13.671 15.737 -17.618 1.00 0.00 H new ATOM 664 N HIS A 43 16.622 16.601 -13.072 1.00 0.00 N ATOM 665 CA HIS A 43 16.731 16.504 -11.621 1.00 0.00 C ATOM 666 C HIS A 43 16.836 15.047 -11.180 1.00 0.00 C ATOM 667 O HIS A 43 16.941 14.144 -12.009 1.00 0.00 O ATOM 668 CB HIS A 43 15.526 17.165 -10.952 1.00 0.00 C ATOM 669 CG HIS A 43 15.896 18.128 -9.866 1.00 0.00 C ATOM 670 ND1 HIS A 43 16.853 19.108 -10.024 1.00 0.00 N ATOM 671 CD2 HIS A 43 15.431 18.257 -8.601 1.00 0.00 C ATOM 672 CE1 HIS A 43 16.961 19.798 -8.902 1.00 0.00 C ATOM 673 NE2 HIS A 43 16.109 19.302 -8.023 1.00 0.00 N ATOM 0 H HIS A 43 17.363 17.144 -13.515 1.00 0.00 H new ATOM 0 HA HIS A 43 17.638 17.025 -11.315 1.00 0.00 H new ATOM 0 HB2 HIS A 43 14.944 17.690 -11.709 1.00 0.00 H new ATOM 0 HB3 HIS A 43 14.882 16.390 -10.535 1.00 0.00 H new ATOM 0 HD2 HIS A 43 14.669 17.651 -8.134 1.00 0.00 H new ATOM 0 HE1 HIS A 43 17.632 20.627 -8.733 1.00 0.00 H new ATOM 0 HE2 HIS A 43 15.976 19.640 -7.070 1.00 0.00 H new ATOM 681 N GLU A 44 16.808 14.827 -9.869 1.00 0.00 N ATOM 682 CA GLU A 44 16.902 13.479 -9.319 1.00 0.00 C ATOM 683 C GLU A 44 16.328 13.427 -7.906 1.00 0.00 C ATOM 684 O GLU A 44 16.799 12.666 -7.061 1.00 0.00 O ATOM 685 CB GLU A 44 18.358 13.009 -9.308 1.00 0.00 C ATOM 686 CG GLU A 44 19.228 13.748 -8.304 1.00 0.00 C ATOM 687 CD GLU A 44 20.707 13.625 -8.613 1.00 0.00 C ATOM 688 OE1 GLU A 44 21.208 12.483 -8.670 1.00 0.00 O ATOM 689 OE2 GLU A 44 21.364 14.671 -8.799 1.00 0.00 O ATOM 0 H GLU A 44 16.721 15.564 -9.169 1.00 0.00 H new ATOM 0 HA GLU A 44 16.318 12.813 -9.954 1.00 0.00 H new ATOM 0 HB2 GLU A 44 18.385 11.943 -9.084 1.00 0.00 H new ATOM 0 HB3 GLU A 44 18.780 13.136 -10.305 1.00 0.00 H new ATOM 0 HG2 GLU A 44 18.949 14.802 -8.293 1.00 0.00 H new ATOM 0 HG3 GLU A 44 19.036 13.357 -7.305 1.00 0.00 H new ATOM 696 N ASP A 45 15.308 14.242 -7.658 1.00 0.00 N ATOM 697 CA ASP A 45 14.669 14.289 -6.348 1.00 0.00 C ATOM 698 C ASP A 45 13.316 13.585 -6.378 1.00 0.00 C ATOM 699 O ASP A 45 12.282 14.190 -6.093 1.00 0.00 O ATOM 700 CB ASP A 45 14.494 15.739 -5.894 1.00 0.00 C ATOM 701 CG ASP A 45 14.447 15.872 -4.385 1.00 0.00 C ATOM 702 OD1 ASP A 45 15.522 16.028 -3.769 1.00 0.00 O ATOM 703 OD2 ASP A 45 13.335 15.820 -3.819 1.00 0.00 O ATOM 0 H ASP A 45 14.906 14.878 -8.346 1.00 0.00 H new ATOM 0 HA ASP A 45 15.313 13.770 -5.638 1.00 0.00 H new ATOM 0 HB2 ASP A 45 15.316 16.340 -6.283 1.00 0.00 H new ATOM 0 HB3 ASP A 45 13.575 16.142 -6.320 1.00 0.00 H new ATOM 708 N THR A 46 13.329 12.302 -6.727 1.00 0.00 N ATOM 709 CA THR A 46 12.104 11.516 -6.797 1.00 0.00 C ATOM 710 C THR A 46 12.361 10.062 -6.418 1.00 0.00 C ATOM 711 O THR A 46 13.317 9.449 -6.890 1.00 0.00 O ATOM 712 CB THR A 46 11.485 11.566 -8.206 1.00 0.00 C ATOM 713 OG1 THR A 46 12.506 11.798 -9.182 1.00 0.00 O ATOM 714 CG2 THR A 46 10.432 12.661 -8.296 1.00 0.00 C ATOM 0 H THR A 46 14.175 11.785 -6.966 1.00 0.00 H new ATOM 0 HA THR A 46 11.405 11.956 -6.085 1.00 0.00 H new ATOM 0 HB THR A 46 11.007 10.607 -8.403 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.104 11.827 -10.075 1.00 0.00 H new ATOM 0 HG21 THR A 46 10.009 12.677 -9.300 1.00 0.00 H new ATOM 0 HG22 THR A 46 9.641 12.465 -7.572 1.00 0.00 H new ATOM 0 HG23 THR A 46 10.891 13.626 -8.080 1.00 0.00 H new ATOM 722 N GLU A 47 11.501 9.517 -5.564 1.00 0.00 N ATOM 723 CA GLU A 47 11.636 8.134 -5.122 1.00 0.00 C ATOM 724 C GLU A 47 10.581 7.248 -5.777 1.00 0.00 C ATOM 725 O GLU A 47 9.436 7.193 -5.330 1.00 0.00 O ATOM 726 CB GLU A 47 11.516 8.048 -3.599 1.00 0.00 C ATOM 727 CG GLU A 47 12.736 7.441 -2.926 1.00 0.00 C ATOM 728 CD GLU A 47 13.890 8.420 -2.818 1.00 0.00 C ATOM 729 OE1 GLU A 47 13.647 9.639 -2.935 1.00 0.00 O ATOM 730 OE2 GLU A 47 15.035 7.965 -2.616 1.00 0.00 O ATOM 0 H GLU A 47 10.704 10.012 -5.164 1.00 0.00 H new ATOM 0 HA GLU A 47 12.622 7.778 -5.422 1.00 0.00 H new ATOM 0 HB2 GLU A 47 11.351 9.048 -3.199 1.00 0.00 H new ATOM 0 HB3 GLU A 47 10.638 7.454 -3.345 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.462 7.096 -1.929 1.00 0.00 H new ATOM 0 HG3 GLU A 47 13.059 6.565 -3.489 1.00 0.00 H new ATOM 737 N SER A 48 10.976 6.555 -6.841 1.00 0.00 N ATOM 738 CA SER A 48 10.064 5.675 -7.561 1.00 0.00 C ATOM 739 C SER A 48 10.803 4.458 -8.109 1.00 0.00 C ATOM 740 O SER A 48 11.942 4.562 -8.565 1.00 0.00 O ATOM 741 CB SER A 48 9.387 6.432 -8.705 1.00 0.00 C ATOM 742 OG SER A 48 7.998 6.152 -8.751 1.00 0.00 O ATOM 0 H SER A 48 11.921 6.586 -7.223 1.00 0.00 H new ATOM 0 HA SER A 48 9.302 5.332 -6.861 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.541 7.503 -8.577 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.849 6.154 -9.652 1.00 0.00 H new ATOM 0 HG SER A 48 7.588 6.649 -9.490 1.00 0.00 H new ATOM 748 N PHE A 49 10.147 3.303 -8.061 1.00 0.00 N ATOM 749 CA PHE A 49 10.741 2.065 -8.551 1.00 0.00 C ATOM 750 C PHE A 49 11.240 2.231 -9.984 1.00 0.00 C ATOM 751 O PHE A 49 10.757 3.086 -10.727 1.00 0.00 O ATOM 752 CB PHE A 49 9.724 0.924 -8.483 1.00 0.00 C ATOM 753 CG PHE A 49 8.447 1.214 -9.219 1.00 0.00 C ATOM 754 CD1 PHE A 49 8.387 1.101 -10.599 1.00 0.00 C ATOM 755 CD2 PHE A 49 7.308 1.599 -8.531 1.00 0.00 C ATOM 756 CE1 PHE A 49 7.214 1.368 -11.278 1.00 0.00 C ATOM 757 CE2 PHE A 49 6.131 1.867 -9.206 1.00 0.00 C ATOM 758 CZ PHE A 49 6.084 1.750 -10.581 1.00 0.00 C ATOM 0 H PHE A 49 9.204 3.199 -7.688 1.00 0.00 H new ATOM 0 HA PHE A 49 11.592 1.823 -7.914 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.175 0.021 -8.895 1.00 0.00 H new ATOM 0 HB3 PHE A 49 9.493 0.716 -7.438 1.00 0.00 H new ATOM 0 HD1 PHE A 49 9.267 0.801 -11.149 1.00 0.00 H new ATOM 0 HD2 PHE A 49 7.339 1.691 -7.455 1.00 0.00 H new ATOM 0 HE1 PHE A 49 7.180 1.278 -12.354 1.00 0.00 H new ATOM 0 HE2 PHE A 49 5.250 2.167 -8.658 1.00 0.00 H new ATOM 0 HZ PHE A 49 5.166 1.957 -11.111 1.00 0.00 H new ATOM 768 N THR A 50 12.212 1.408 -10.365 1.00 0.00 N ATOM 769 CA THR A 50 12.778 1.463 -11.707 1.00 0.00 C ATOM 770 C THR A 50 12.134 0.425 -12.619 1.00 0.00 C ATOM 771 O THR A 50 11.499 -0.520 -12.150 1.00 0.00 O ATOM 772 CB THR A 50 14.301 1.235 -11.683 1.00 0.00 C ATOM 773 OG1 THR A 50 14.849 1.448 -12.989 1.00 0.00 O ATOM 774 CG2 THR A 50 14.631 -0.173 -11.213 1.00 0.00 C ATOM 0 H THR A 50 12.624 0.695 -9.763 1.00 0.00 H new ATOM 0 HA THR A 50 12.573 2.460 -12.096 1.00 0.00 H new ATOM 0 HB THR A 50 14.741 1.946 -10.984 1.00 0.00 H new ATOM 0 HG1 THR A 50 14.274 2.064 -13.489 1.00 0.00 H new ATOM 0 HG21 THR A 50 15.712 -0.310 -11.205 1.00 0.00 H new ATOM 0 HG22 THR A 50 14.239 -0.322 -10.207 1.00 0.00 H new ATOM 0 HG23 THR A 50 14.179 -0.898 -11.890 1.00 0.00 H new ATOM 782 N VAL A 51 12.303 0.606 -13.925 1.00 0.00 N ATOM 783 CA VAL A 51 11.739 -0.316 -14.903 1.00 0.00 C ATOM 784 C VAL A 51 12.837 -0.996 -15.714 1.00 0.00 C ATOM 785 O VAL A 51 14.005 -0.613 -15.640 1.00 0.00 O ATOM 786 CB VAL A 51 10.778 0.405 -15.866 1.00 0.00 C ATOM 787 CG1 VAL A 51 9.468 0.734 -15.166 1.00 0.00 C ATOM 788 CG2 VAL A 51 11.426 1.664 -16.422 1.00 0.00 C ATOM 0 H VAL A 51 12.826 1.383 -14.330 1.00 0.00 H new ATOM 0 HA VAL A 51 11.184 -1.069 -14.344 1.00 0.00 H new ATOM 0 HB VAL A 51 10.559 -0.262 -16.700 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.801 1.243 -15.862 1.00 0.00 H new ATOM 0 HG12 VAL A 51 8.998 -0.187 -14.822 1.00 0.00 H new ATOM 0 HG13 VAL A 51 9.665 1.382 -14.312 1.00 0.00 H new ATOM 0 HG21 VAL A 51 10.733 2.161 -17.101 1.00 0.00 H new ATOM 0 HG22 VAL A 51 11.676 2.337 -15.602 1.00 0.00 H new ATOM 0 HG23 VAL A 51 12.334 1.397 -16.962 1.00 0.00 H new ATOM 798 N TYR A 52 12.455 -2.007 -16.486 1.00 0.00 N ATOM 799 CA TYR A 52 13.408 -2.742 -17.310 1.00 0.00 C ATOM 800 C TYR A 52 13.049 -2.630 -18.789 1.00 0.00 C ATOM 801 O TYR A 52 11.890 -2.410 -19.144 1.00 0.00 O ATOM 802 CB TYR A 52 13.446 -4.213 -16.892 1.00 0.00 C ATOM 803 CG TYR A 52 14.095 -4.443 -15.546 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.343 -3.908 -15.255 1.00 0.00 C ATOM 805 CD2 TYR A 52 13.460 -5.197 -14.567 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.941 -4.117 -14.026 1.00 0.00 C ATOM 807 CE2 TYR A 52 14.049 -5.410 -13.336 1.00 0.00 C ATOM 808 CZ TYR A 52 15.289 -4.868 -13.070 1.00 0.00 C ATOM 809 OH TYR A 52 15.880 -5.079 -11.845 1.00 0.00 O ATOM 0 H TYR A 52 11.492 -2.336 -16.559 1.00 0.00 H new ATOM 0 HA TYR A 52 14.394 -2.303 -17.160 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.428 -4.601 -16.866 1.00 0.00 H new ATOM 0 HB3 TYR A 52 13.985 -4.783 -17.648 1.00 0.00 H new ATOM 0 HD1 TYR A 52 15.855 -3.319 -16.001 1.00 0.00 H new ATOM 0 HD2 TYR A 52 12.489 -5.624 -14.772 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.913 -3.695 -13.816 1.00 0.00 H new ATOM 0 HE2 TYR A 52 13.541 -5.998 -12.586 1.00 0.00 H new ATOM 0 HH TYR A 52 15.289 -5.627 -11.287 1.00 0.00 H new ATOM 819 N LEU A 53 14.051 -2.785 -19.647 1.00 0.00 N ATOM 820 CA LEU A 53 13.844 -2.703 -21.088 1.00 0.00 C ATOM 821 C LEU A 53 13.132 -3.948 -21.608 1.00 0.00 C ATOM 822 O LEU A 53 13.633 -5.064 -21.470 1.00 0.00 O ATOM 823 CB LEU A 53 15.183 -2.530 -21.807 1.00 0.00 C ATOM 824 CG LEU A 53 15.280 -1.344 -22.767 1.00 0.00 C ATOM 825 CD1 LEU A 53 14.191 -1.423 -23.826 1.00 0.00 C ATOM 826 CD2 LEU A 53 15.190 -0.030 -22.004 1.00 0.00 C ATOM 0 H LEU A 53 15.015 -2.968 -19.369 1.00 0.00 H new ATOM 0 HA LEU A 53 13.215 -1.836 -21.291 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.966 -2.429 -21.055 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.393 -3.442 -22.365 1.00 0.00 H new ATOM 0 HG LEU A 53 16.248 -1.385 -23.267 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.276 -0.571 -24.500 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.302 -2.347 -24.394 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.213 -1.408 -23.344 1.00 0.00 H new ATOM 0 HD21 LEU A 53 15.261 0.803 -22.704 1.00 0.00 H new ATOM 0 HD22 LEU A 53 14.238 0.020 -21.476 1.00 0.00 H new ATOM 0 HD23 LEU A 53 16.007 0.030 -21.285 1.00 0.00 H new ATOM 838 N ARG A 54 11.963 -3.749 -22.207 1.00 0.00 N ATOM 839 CA ARG A 54 11.183 -4.856 -22.749 1.00 0.00 C ATOM 840 C ARG A 54 12.033 -5.713 -23.682 1.00 0.00 C ATOM 841 O ARG A 54 11.890 -6.935 -23.720 1.00 0.00 O ATOM 842 CB ARG A 54 9.959 -4.326 -23.498 1.00 0.00 C ATOM 843 CG ARG A 54 8.848 -5.353 -23.651 1.00 0.00 C ATOM 844 CD ARG A 54 7.475 -4.703 -23.579 1.00 0.00 C ATOM 845 NE ARG A 54 6.811 -4.682 -24.879 1.00 0.00 N ATOM 846 CZ ARG A 54 5.552 -4.297 -25.055 1.00 0.00 C ATOM 847 NH1 ARG A 54 4.825 -3.903 -24.018 1.00 0.00 N ATOM 848 NH2 ARG A 54 5.017 -4.305 -26.269 1.00 0.00 N ATOM 0 H ARG A 54 11.535 -2.832 -22.330 1.00 0.00 H new ATOM 0 HA ARG A 54 10.850 -5.476 -21.917 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.568 -3.456 -22.970 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.267 -3.986 -24.487 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.958 -5.870 -24.604 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.937 -6.106 -22.868 1.00 0.00 H new ATOM 0 HD2 ARG A 54 6.855 -5.244 -22.864 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.576 -3.683 -23.207 1.00 0.00 H new ATOM 0 HE ARG A 54 7.343 -4.979 -25.697 1.00 0.00 H new ATOM 0 HH11 ARG A 54 5.233 -3.895 -23.083 1.00 0.00 H new ATOM 0 HH12 ARG A 54 3.858 -3.608 -24.156 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.573 -4.607 -27.069 1.00 0.00 H new ATOM 0 HH22 ARG A 54 4.050 -4.009 -26.402 1.00 0.00 H new ATOM 862 N SER A 55 12.916 -5.064 -24.434 1.00 0.00 N ATOM 863 CA SER A 55 13.785 -5.767 -25.371 1.00 0.00 C ATOM 864 C SER A 55 14.811 -6.617 -24.628 1.00 0.00 C ATOM 865 O SER A 55 15.235 -7.665 -25.115 1.00 0.00 O ATOM 866 CB SER A 55 14.499 -4.768 -26.284 1.00 0.00 C ATOM 867 OG SER A 55 13.624 -4.274 -27.283 1.00 0.00 O ATOM 0 H SER A 55 13.049 -4.053 -24.413 1.00 0.00 H new ATOM 0 HA SER A 55 13.165 -6.426 -25.979 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.883 -3.939 -25.690 1.00 0.00 H new ATOM 0 HB3 SER A 55 15.357 -5.249 -26.753 1.00 0.00 H new ATOM 0 HG SER A 55 14.104 -3.636 -27.852 1.00 0.00 H new ATOM 873 N ASP A 56 15.204 -6.158 -23.445 1.00 0.00 N ATOM 874 CA ASP A 56 16.179 -6.876 -22.632 1.00 0.00 C ATOM 875 C ASP A 56 15.561 -8.130 -22.023 1.00 0.00 C ATOM 876 O ASP A 56 16.094 -9.230 -22.167 1.00 0.00 O ATOM 877 CB ASP A 56 16.719 -5.968 -21.525 1.00 0.00 C ATOM 878 CG ASP A 56 17.939 -5.183 -21.963 1.00 0.00 C ATOM 879 OD1 ASP A 56 18.893 -5.806 -22.473 1.00 0.00 O ATOM 880 OD2 ASP A 56 17.940 -3.945 -21.795 1.00 0.00 O ATOM 0 H ASP A 56 14.863 -5.292 -23.028 1.00 0.00 H new ATOM 0 HA ASP A 56 17.003 -7.177 -23.278 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.937 -5.275 -21.214 1.00 0.00 H new ATOM 0 HB3 ASP A 56 16.973 -6.573 -20.655 1.00 0.00 H new ATOM 885 N VAL A 57 14.433 -7.956 -21.341 1.00 0.00 N ATOM 886 CA VAL A 57 13.742 -9.074 -20.709 1.00 0.00 C ATOM 887 C VAL A 57 13.321 -10.114 -21.742 1.00 0.00 C ATOM 888 O VAL A 57 13.214 -11.300 -21.434 1.00 0.00 O ATOM 889 CB VAL A 57 12.497 -8.599 -19.937 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.900 -9.743 -19.131 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.845 -7.425 -19.035 1.00 0.00 C ATOM 0 H VAL A 57 13.979 -7.052 -21.212 1.00 0.00 H new ATOM 0 HA VAL A 57 14.444 -9.526 -20.008 1.00 0.00 H new ATOM 0 HB VAL A 57 11.750 -8.265 -20.657 1.00 0.00 H new ATOM 0 HG11 VAL A 57 11.021 -9.389 -18.592 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.612 -10.551 -19.804 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.639 -10.110 -18.419 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.953 -7.103 -18.497 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.610 -7.729 -18.320 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.222 -6.600 -19.640 1.00 0.00 H new ATOM 901 N GLU A 58 13.082 -9.659 -22.968 1.00 0.00 N ATOM 902 CA GLU A 58 12.672 -10.551 -24.046 1.00 0.00 C ATOM 903 C GLU A 58 13.674 -11.688 -24.223 1.00 0.00 C ATOM 904 O GLU A 58 13.298 -12.819 -24.528 1.00 0.00 O ATOM 905 CB GLU A 58 12.531 -9.773 -25.356 1.00 0.00 C ATOM 906 CG GLU A 58 12.107 -10.634 -26.534 1.00 0.00 C ATOM 907 CD GLU A 58 11.594 -9.815 -27.702 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.214 -8.645 -27.485 1.00 0.00 O ATOM 909 OE2 GLU A 58 11.574 -10.343 -28.833 1.00 0.00 O ATOM 0 H GLU A 58 13.165 -8.679 -23.239 1.00 0.00 H new ATOM 0 HA GLU A 58 11.706 -10.980 -23.780 1.00 0.00 H new ATOM 0 HB2 GLU A 58 11.801 -8.976 -25.218 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.483 -9.296 -25.590 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.954 -11.236 -26.862 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.329 -11.326 -26.212 1.00 0.00 H new ATOM 916 N ALA A 59 14.952 -11.378 -24.030 1.00 0.00 N ATOM 917 CA ALA A 59 16.009 -12.373 -24.166 1.00 0.00 C ATOM 918 C ALA A 59 16.215 -13.136 -22.863 1.00 0.00 C ATOM 919 O ALA A 59 16.579 -14.312 -22.871 1.00 0.00 O ATOM 920 CB ALA A 59 17.306 -11.708 -24.602 1.00 0.00 C ATOM 0 H ALA A 59 15.280 -10.446 -23.779 1.00 0.00 H new ATOM 0 HA ALA A 59 15.705 -13.088 -24.931 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.087 -12.462 -24.700 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.157 -11.214 -25.562 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.605 -10.971 -23.857 1.00 0.00 H new ATOM 926 N LYS A 60 15.982 -12.460 -21.743 1.00 0.00 N ATOM 927 CA LYS A 60 16.141 -13.074 -20.430 1.00 0.00 C ATOM 928 C LYS A 60 15.299 -14.341 -20.316 1.00 0.00 C ATOM 929 O LYS A 60 15.621 -15.244 -19.545 1.00 0.00 O ATOM 930 CB LYS A 60 15.746 -12.086 -19.331 1.00 0.00 C ATOM 931 CG LYS A 60 15.950 -12.626 -17.926 1.00 0.00 C ATOM 932 CD LYS A 60 17.409 -12.960 -17.663 1.00 0.00 C ATOM 933 CE LYS A 60 18.289 -11.723 -17.752 1.00 0.00 C ATOM 934 NZ LYS A 60 19.041 -11.668 -19.036 1.00 0.00 N ATOM 0 H LYS A 60 15.682 -11.485 -21.718 1.00 0.00 H new ATOM 0 HA LYS A 60 17.190 -13.344 -20.308 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.329 -11.173 -19.448 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.698 -11.814 -19.458 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.608 -11.890 -17.199 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.341 -13.519 -17.786 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.508 -13.408 -16.674 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.749 -13.702 -18.385 1.00 0.00 H new ATOM 0 HE2 LYS A 60 17.671 -10.830 -17.654 1.00 0.00 H new ATOM 0 HE3 LYS A 60 18.992 -11.717 -16.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 19.667 -10.837 -19.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 19.611 -12.531 -19.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 18.371 -11.597 -19.828 1.00 0.00 H new ATOM 948 N SER A 61 14.220 -14.401 -21.090 1.00 0.00 N ATOM 949 CA SER A 61 13.331 -15.556 -21.074 1.00 0.00 C ATOM 950 C SER A 61 13.862 -16.663 -21.979 1.00 0.00 C ATOM 951 O SER A 61 13.580 -17.844 -21.767 1.00 0.00 O ATOM 952 CB SER A 61 11.924 -15.150 -21.518 1.00 0.00 C ATOM 953 OG SER A 61 11.666 -15.574 -22.846 1.00 0.00 O ATOM 0 H SER A 61 13.941 -13.663 -21.736 1.00 0.00 H new ATOM 0 HA SER A 61 13.287 -15.935 -20.053 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.187 -15.586 -20.844 1.00 0.00 H new ATOM 0 HB3 SER A 61 11.816 -14.067 -21.451 1.00 0.00 H new ATOM 0 HG SER A 61 10.760 -15.304 -23.105 1.00 0.00 H new ATOM 959 N LEU A 62 14.634 -16.275 -22.988 1.00 0.00 N ATOM 960 CA LEU A 62 15.206 -17.233 -23.927 1.00 0.00 C ATOM 961 C LEU A 62 16.438 -17.908 -23.333 1.00 0.00 C ATOM 962 O LEU A 62 16.696 -19.084 -23.587 1.00 0.00 O ATOM 963 CB LEU A 62 15.574 -16.536 -25.238 1.00 0.00 C ATOM 964 CG LEU A 62 14.518 -15.593 -25.817 1.00 0.00 C ATOM 965 CD1 LEU A 62 14.965 -15.055 -27.167 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.179 -16.305 -25.941 1.00 0.00 C ATOM 0 H LEU A 62 14.878 -15.303 -23.177 1.00 0.00 H new ATOM 0 HA LEU A 62 14.457 -17.998 -24.128 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.491 -15.969 -25.079 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.797 -17.300 -25.982 1.00 0.00 H new ATOM 0 HG LEU A 62 14.398 -14.751 -25.136 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.201 -14.386 -27.563 1.00 0.00 H new ATOM 0 HD12 LEU A 62 15.900 -14.508 -27.049 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.115 -15.885 -27.858 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.439 -15.619 -26.355 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.285 -17.166 -26.601 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.853 -16.640 -24.957 1.00 0.00 H new ATOM 978 N GLU A 63 17.194 -17.155 -22.540 1.00 0.00 N ATOM 979 CA GLU A 63 18.398 -17.682 -21.908 1.00 0.00 C ATOM 980 C GLU A 63 18.044 -18.620 -20.758 1.00 0.00 C ATOM 981 O GLU A 63 18.824 -19.501 -20.397 1.00 0.00 O ATOM 982 CB GLU A 63 19.275 -16.537 -21.397 1.00 0.00 C ATOM 983 CG GLU A 63 18.735 -15.871 -20.142 1.00 0.00 C ATOM 984 CD GLU A 63 19.465 -16.312 -18.888 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.821 -17.506 -18.798 1.00 0.00 O ATOM 986 OE2 GLU A 63 19.680 -15.464 -17.997 1.00 0.00 O ATOM 0 H GLU A 63 16.994 -16.179 -22.320 1.00 0.00 H new ATOM 0 HA GLU A 63 18.952 -18.248 -22.657 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.275 -16.919 -21.194 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.374 -15.788 -22.182 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.818 -14.789 -20.245 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.674 -16.101 -20.041 1.00 0.00 H new ATOM 993 N VAL A 64 16.861 -18.422 -20.184 1.00 0.00 N ATOM 994 CA VAL A 64 16.402 -19.249 -19.075 1.00 0.00 C ATOM 995 C VAL A 64 15.637 -20.469 -19.578 1.00 0.00 C ATOM 996 O VAL A 64 16.138 -21.592 -19.528 1.00 0.00 O ATOM 997 CB VAL A 64 15.499 -18.451 -18.116 1.00 0.00 C ATOM 998 CG1 VAL A 64 14.986 -19.345 -16.997 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.249 -17.254 -17.551 1.00 0.00 C ATOM 0 H VAL A 64 16.204 -17.696 -20.469 1.00 0.00 H new ATOM 0 HA VAL A 64 17.291 -19.578 -18.537 1.00 0.00 H new ATOM 0 HB VAL A 64 14.640 -18.082 -18.676 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.350 -18.764 -16.330 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.410 -20.167 -17.423 1.00 0.00 H new ATOM 0 HG13 VAL A 64 15.830 -19.746 -16.436 1.00 0.00 H new ATOM 0 HG21 VAL A 64 15.596 -16.701 -16.875 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.127 -17.599 -17.005 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.562 -16.602 -18.367 1.00 0.00 H new ATOM 1009 N TRP A 65 14.423 -20.239 -20.063 1.00 0.00 N ATOM 1010 CA TRP A 65 13.588 -21.320 -20.576 1.00 0.00 C ATOM 1011 C TRP A 65 14.261 -22.015 -21.754 1.00 0.00 C ATOM 1012 O TRP A 65 14.000 -23.185 -22.029 1.00 0.00 O ATOM 1013 CB TRP A 65 12.222 -20.779 -21.000 1.00 0.00 C ATOM 1014 CG TRP A 65 11.272 -20.600 -19.854 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.051 -19.454 -19.144 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.419 -21.598 -19.284 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.111 -19.680 -18.168 1.00 0.00 N ATOM 1018 CE2 TRP A 65 9.707 -20.987 -18.233 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.185 -22.948 -19.560 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 8.780 -21.681 -17.460 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.265 -23.635 -18.792 1.00 0.00 C ATOM 1022 CH2 TRP A 65 8.571 -23.001 -17.752 1.00 0.00 C ATOM 0 H TRP A 65 13.994 -19.315 -20.112 1.00 0.00 H new ATOM 0 HA TRP A 65 13.450 -22.050 -19.778 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.358 -19.821 -21.502 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.779 -21.460 -21.727 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.543 -18.509 -19.324 1.00 0.00 H new ATOM 0 HE1 TRP A 65 9.769 -18.987 -17.503 1.00 0.00 H new ATOM 0 HE3 TRP A 65 10.714 -23.445 -20.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.245 -21.194 -16.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.077 -24.679 -18.996 1.00 0.00 H new ATOM 0 HH2 TRP A 65 7.858 -23.566 -17.170 1.00 0.00 H new ATOM 1033 N GLY A 66 15.130 -21.285 -22.448 1.00 0.00 N ATOM 1034 CA GLY A 66 15.827 -21.849 -23.590 1.00 0.00 C ATOM 1035 C GLY A 66 15.337 -21.282 -24.907 1.00 0.00 C ATOM 1036 O GLY A 66 16.131 -21.012 -25.808 1.00 0.00 O ATOM 0 H GLY A 66 15.363 -20.314 -22.240 1.00 0.00 H new ATOM 0 HA2 GLY A 66 16.895 -21.657 -23.491 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.697 -22.931 -23.593 1.00 0.00 H new ATOM 1040 N SER A 67 14.025 -21.102 -25.020 1.00 0.00 N ATOM 1041 CA SER A 67 13.430 -20.568 -26.240 1.00 0.00 C ATOM 1042 C SER A 67 12.097 -19.888 -25.940 1.00 0.00 C ATOM 1043 O SER A 67 11.470 -20.122 -24.907 1.00 0.00 O ATOM 1044 CB SER A 67 13.226 -21.685 -27.265 1.00 0.00 C ATOM 1045 OG SER A 67 13.293 -22.960 -26.650 1.00 0.00 O ATOM 0 H SER A 67 13.354 -21.318 -24.283 1.00 0.00 H new ATOM 0 HA SER A 67 14.113 -19.826 -26.654 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.259 -21.563 -27.752 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.986 -21.612 -28.043 1.00 0.00 H new ATOM 0 HG SER A 67 13.158 -23.657 -27.326 1.00 0.00 H new ATOM 1051 N PRO A 68 11.653 -19.025 -26.866 1.00 0.00 N ATOM 1052 CA PRO A 68 10.391 -18.293 -26.726 1.00 0.00 C ATOM 1053 C PRO A 68 9.175 -19.205 -26.851 1.00 0.00 C ATOM 1054 O PRO A 68 8.070 -18.840 -26.451 1.00 0.00 O ATOM 1055 CB PRO A 68 10.430 -17.293 -27.883 1.00 0.00 C ATOM 1056 CG PRO A 68 11.321 -17.922 -28.898 1.00 0.00 C ATOM 1057 CD PRO A 68 12.349 -18.698 -28.122 1.00 0.00 C ATOM 0 HA PRO A 68 10.297 -17.827 -25.745 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.433 -17.116 -28.287 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.819 -16.328 -27.559 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.756 -18.577 -29.561 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.794 -17.166 -29.525 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.660 -19.597 -28.655 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.247 -18.107 -27.942 1.00 0.00 H new ATOM 1065 N GLU A 69 9.387 -20.393 -27.409 1.00 0.00 N ATOM 1066 CA GLU A 69 8.306 -21.356 -27.587 1.00 0.00 C ATOM 1067 C GLU A 69 7.925 -21.998 -26.255 1.00 0.00 C ATOM 1068 O GLU A 69 6.754 -22.280 -26.003 1.00 0.00 O ATOM 1069 CB GLU A 69 8.718 -22.439 -28.587 1.00 0.00 C ATOM 1070 CG GLU A 69 9.250 -21.885 -29.898 1.00 0.00 C ATOM 1071 CD GLU A 69 8.674 -22.594 -31.108 1.00 0.00 C ATOM 1072 OE1 GLU A 69 7.432 -22.650 -31.226 1.00 0.00 O ATOM 1073 OE2 GLU A 69 9.464 -23.093 -31.936 1.00 0.00 O ATOM 0 H GLU A 69 10.296 -20.711 -27.745 1.00 0.00 H new ATOM 0 HA GLU A 69 7.439 -20.823 -27.976 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.482 -23.070 -28.132 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.859 -23.077 -28.794 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.017 -20.822 -29.960 1.00 0.00 H new ATOM 0 HG3 GLU A 69 10.336 -21.975 -29.912 1.00 0.00 H new ATOM 1080 N ALA A 70 8.923 -22.226 -25.408 1.00 0.00 N ATOM 1081 CA ALA A 70 8.693 -22.832 -24.102 1.00 0.00 C ATOM 1082 C ALA A 70 7.754 -21.977 -23.258 1.00 0.00 C ATOM 1083 O ALA A 70 6.827 -22.490 -22.629 1.00 0.00 O ATOM 1084 CB ALA A 70 10.014 -23.042 -23.378 1.00 0.00 C ATOM 0 H ALA A 70 9.899 -22.000 -25.603 1.00 0.00 H new ATOM 0 HA ALA A 70 8.219 -23.801 -24.257 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.827 -23.495 -22.404 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.652 -23.700 -23.968 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.511 -22.082 -23.242 1.00 0.00 H new ATOM 1090 N LEU A 71 8.000 -20.671 -23.247 1.00 0.00 N ATOM 1091 CA LEU A 71 7.176 -19.744 -22.478 1.00 0.00 C ATOM 1092 C LEU A 71 5.813 -19.554 -23.135 1.00 0.00 C ATOM 1093 O LEU A 71 4.791 -19.468 -22.454 1.00 0.00 O ATOM 1094 CB LEU A 71 7.883 -18.395 -22.344 1.00 0.00 C ATOM 1095 CG LEU A 71 7.062 -17.266 -21.720 1.00 0.00 C ATOM 1096 CD1 LEU A 71 6.775 -17.560 -20.256 1.00 0.00 C ATOM 1097 CD2 LEU A 71 7.786 -15.935 -21.866 1.00 0.00 C ATOM 0 H LEU A 71 8.763 -20.230 -23.761 1.00 0.00 H new ATOM 0 HA LEU A 71 7.024 -20.168 -21.485 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.783 -18.537 -21.745 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.207 -18.077 -23.335 1.00 0.00 H new ATOM 0 HG LEU A 71 6.111 -17.200 -22.249 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.190 -16.745 -19.829 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.214 -18.491 -20.175 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.715 -17.655 -19.713 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.187 -15.144 -21.416 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.752 -15.989 -21.363 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.939 -15.718 -22.923 1.00 0.00 H new ATOM 1109 N ALA A 72 5.805 -19.491 -24.462 1.00 0.00 N ATOM 1110 CA ALA A 72 4.567 -19.315 -25.211 1.00 0.00 C ATOM 1111 C ALA A 72 3.541 -20.378 -24.833 1.00 0.00 C ATOM 1112 O ALA A 72 2.338 -20.116 -24.822 1.00 0.00 O ATOM 1113 CB ALA A 72 4.844 -19.356 -26.707 1.00 0.00 C ATOM 0 H ALA A 72 6.642 -19.559 -25.041 1.00 0.00 H new ATOM 0 HA ALA A 72 4.153 -18.340 -24.956 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.910 -19.223 -27.254 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.536 -18.556 -26.971 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.284 -20.318 -26.969 1.00 0.00 H new ATOM 1119 N ARG A 73 4.024 -21.576 -24.523 1.00 0.00 N ATOM 1120 CA ARG A 73 3.148 -22.679 -24.146 1.00 0.00 C ATOM 1121 C ARG A 73 2.254 -22.287 -22.973 1.00 0.00 C ATOM 1122 O ARG A 73 1.079 -22.648 -22.928 1.00 0.00 O ATOM 1123 CB ARG A 73 3.974 -23.913 -23.781 1.00 0.00 C ATOM 1124 CG ARG A 73 4.867 -24.404 -24.909 1.00 0.00 C ATOM 1125 CD ARG A 73 4.337 -25.692 -25.519 1.00 0.00 C ATOM 1126 NE ARG A 73 3.461 -25.436 -26.660 1.00 0.00 N ATOM 1127 CZ ARG A 73 3.110 -26.368 -27.540 1.00 0.00 C ATOM 1128 NH1 ARG A 73 3.557 -27.609 -27.410 1.00 0.00 N ATOM 1129 NH2 ARG A 73 2.309 -26.058 -28.551 1.00 0.00 N ATOM 0 H ARG A 73 5.017 -21.808 -24.525 1.00 0.00 H new ATOM 0 HA ARG A 73 2.514 -22.915 -25.001 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.592 -23.682 -22.914 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.300 -24.717 -23.487 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.936 -23.637 -25.680 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.876 -24.568 -24.531 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.174 -26.314 -25.837 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.791 -26.254 -24.761 1.00 0.00 H new ATOM 0 HE ARG A 73 3.099 -24.491 -26.788 1.00 0.00 H new ATOM 0 HH11 ARG A 73 4.172 -27.851 -26.633 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.286 -28.322 -28.087 1.00 0.00 H new ATOM 0 HH21 ARG A 73 1.962 -25.104 -28.653 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.040 -26.773 -29.226 1.00 0.00 H new ATOM 1143 N GLU A 74 2.821 -21.546 -22.025 1.00 0.00 N ATOM 1144 CA GLU A 74 2.076 -21.107 -20.852 1.00 0.00 C ATOM 1145 C GLU A 74 1.293 -19.832 -21.151 1.00 0.00 C ATOM 1146 O GLU A 74 0.227 -19.596 -20.581 1.00 0.00 O ATOM 1147 CB GLU A 74 3.026 -20.871 -19.675 1.00 0.00 C ATOM 1148 CG GLU A 74 3.361 -22.135 -18.901 1.00 0.00 C ATOM 1149 CD GLU A 74 2.399 -22.391 -17.758 1.00 0.00 C ATOM 1150 OE1 GLU A 74 1.358 -23.040 -17.993 1.00 0.00 O ATOM 1151 OE2 GLU A 74 2.685 -21.942 -16.628 1.00 0.00 O ATOM 0 H GLU A 74 3.793 -21.238 -22.047 1.00 0.00 H new ATOM 0 HA GLU A 74 1.369 -21.893 -20.587 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.949 -20.428 -20.047 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.576 -20.147 -18.995 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.347 -22.987 -19.581 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.375 -22.058 -18.508 1.00 0.00 H new ATOM 1158 N LYS A 75 1.829 -19.012 -22.049 1.00 0.00 N ATOM 1159 CA LYS A 75 1.182 -17.761 -22.425 1.00 0.00 C ATOM 1160 C LYS A 75 -0.130 -18.026 -23.158 1.00 0.00 C ATOM 1161 O LYS A 75 -1.114 -17.311 -22.969 1.00 0.00 O ATOM 1162 CB LYS A 75 2.113 -16.928 -23.309 1.00 0.00 C ATOM 1163 CG LYS A 75 3.480 -16.684 -22.693 1.00 0.00 C ATOM 1164 CD LYS A 75 3.910 -15.235 -22.846 1.00 0.00 C ATOM 1165 CE LYS A 75 3.094 -14.314 -21.952 1.00 0.00 C ATOM 1166 NZ LYS A 75 2.118 -13.505 -22.733 1.00 0.00 N ATOM 0 H LYS A 75 2.710 -19.192 -22.530 1.00 0.00 H new ATOM 0 HA LYS A 75 0.963 -17.205 -21.513 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.240 -17.434 -24.266 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.641 -15.968 -23.516 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.456 -16.948 -21.636 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.215 -17.335 -23.167 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.967 -15.140 -22.599 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.797 -14.929 -23.886 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.561 -14.907 -21.209 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.764 -13.649 -21.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.998 -12.576 -22.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.471 -13.376 -23.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.202 -13.997 -22.760 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.137 -19.058 -23.994 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.328 -19.420 -24.754 1.00 0.00 C ATOM 1182 C LYS A 76 -2.499 -19.716 -23.821 1.00 0.00 C ATOM 1183 O LYS A 76 -3.630 -19.301 -24.078 1.00 0.00 O ATOM 1184 CB LYS A 76 -1.045 -20.638 -25.636 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.256 -21.120 -26.415 1.00 0.00 C ATOM 1186 CD LYS A 76 -1.850 -21.949 -27.621 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.232 -23.275 -27.204 1.00 0.00 C ATOM 1188 NZ LYS A 76 -1.656 -24.390 -28.096 1.00 0.00 N ATOM 0 H LYS A 76 0.669 -19.659 -24.163 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.595 -18.574 -25.388 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.248 -20.391 -26.337 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.679 -21.452 -25.010 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.896 -21.714 -25.763 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.843 -20.262 -26.743 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -2.723 -22.134 -28.247 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.137 -21.388 -28.226 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.145 -23.190 -27.220 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.519 -23.502 -26.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.214 -25.276 -27.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.691 -24.488 -28.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -1.360 -24.186 -29.072 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.220 -20.433 -22.739 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.250 -20.783 -21.767 1.00 0.00 C ATOM 1204 C LEU A 77 -3.874 -19.530 -21.160 1.00 0.00 C ATOM 1205 O LEU A 77 -5.062 -19.265 -21.342 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.660 -21.659 -20.661 1.00 0.00 C ATOM 1207 CG LEU A 77 -2.688 -23.167 -20.913 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -4.118 -23.651 -21.096 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -1.843 -23.521 -22.128 1.00 0.00 C ATOM 0 H LEU A 77 -1.289 -20.784 -22.512 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.030 -21.341 -22.286 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.625 -21.357 -20.499 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.200 -21.455 -19.736 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.265 -23.669 -20.043 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.118 -24.726 -21.274 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.694 -23.432 -20.197 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.568 -23.142 -21.948 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.875 -24.598 -22.292 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.236 -23.009 -23.006 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.812 -23.210 -21.957 1.00 0.00 H new ATOM 1221 N ARG A 78 -3.064 -18.761 -20.440 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.535 -17.536 -19.807 1.00 0.00 C ATOM 1223 C ARG A 78 -4.174 -16.605 -20.833 1.00 0.00 C ATOM 1224 O ARG A 78 -5.086 -15.842 -20.514 1.00 0.00 O ATOM 1225 CB ARG A 78 -2.379 -16.821 -19.104 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.373 -16.203 -20.061 1.00 0.00 C ATOM 1227 CD ARG A 78 -0.291 -15.440 -19.315 1.00 0.00 C ATOM 1228 NE ARG A 78 -0.077 -14.108 -19.873 1.00 0.00 N ATOM 1229 CZ ARG A 78 -0.892 -13.081 -19.659 1.00 0.00 C ATOM 1230 NH1 ARG A 78 -1.970 -13.233 -18.903 1.00 0.00 N ATOM 1231 NH2 ARG A 78 -0.630 -11.899 -20.202 1.00 0.00 N ATOM 0 H ARG A 78 -2.077 -18.965 -20.281 1.00 0.00 H new ATOM 0 HA ARG A 78 -4.289 -17.806 -19.067 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -2.784 -16.039 -18.461 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.864 -17.531 -18.457 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.916 -16.986 -20.666 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.888 -15.530 -20.747 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -0.568 -15.353 -18.264 1.00 0.00 H new ATOM 0 HD3 ARG A 78 0.642 -16.003 -19.353 1.00 0.00 H new ATOM 0 HE ARG A 78 0.744 -13.958 -20.460 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.175 -14.140 -18.484 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -2.594 -12.443 -18.740 1.00 0.00 H new ATOM 0 HH21 ARG A 78 0.198 -11.778 -20.785 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -1.257 -11.112 -20.037 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.688 -16.672 -22.068 1.00 0.00 N ATOM 1246 CA LYS A 79 -4.210 -15.836 -23.143 1.00 0.00 C ATOM 1247 C LYS A 79 -5.677 -16.154 -23.415 1.00 0.00 C ATOM 1248 O LYS A 79 -6.532 -15.271 -23.360 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.388 -16.038 -24.418 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.899 -15.238 -25.604 1.00 0.00 C ATOM 1251 CD LYS A 79 -2.957 -15.338 -26.792 1.00 0.00 C ATOM 1252 CE LYS A 79 -3.717 -15.315 -28.109 1.00 0.00 C ATOM 1253 NZ LYS A 79 -3.796 -16.667 -28.728 1.00 0.00 N ATOM 0 H LYS A 79 -2.933 -17.297 -22.349 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.134 -14.795 -22.830 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.353 -15.759 -24.221 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.389 -17.097 -24.677 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.886 -15.600 -25.890 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.014 -14.193 -25.317 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.247 -14.511 -26.766 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.377 -16.258 -26.721 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -4.724 -14.933 -27.940 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.227 -14.628 -28.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.322 -16.609 -29.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -2.836 -17.021 -28.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.286 -17.317 -28.081 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.960 -17.420 -23.707 1.00 0.00 N ATOM 1268 CA GLU A 80 -7.324 -17.852 -23.987 1.00 0.00 C ATOM 1269 C GLU A 80 -8.229 -17.611 -22.782 1.00 0.00 C ATOM 1270 O GLU A 80 -9.433 -17.403 -22.928 1.00 0.00 O ATOM 1271 CB GLU A 80 -7.345 -19.334 -24.366 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.403 -19.685 -25.505 1.00 0.00 C ATOM 1273 CD GLU A 80 -7.139 -20.068 -26.774 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -8.046 -20.923 -26.699 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -6.807 -19.513 -27.842 1.00 0.00 O ATOM 0 H GLU A 80 -5.263 -18.163 -23.756 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.699 -17.265 -24.825 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.080 -19.928 -23.491 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.360 -19.614 -24.646 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.753 -18.834 -25.709 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.761 -20.511 -25.199 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.639 -17.641 -21.591 1.00 0.00 N ATOM 1283 CA ALA A 81 -8.391 -17.424 -20.361 1.00 0.00 C ATOM 1284 C ALA A 81 -9.007 -16.030 -20.333 1.00 0.00 C ATOM 1285 O ALA A 81 -10.182 -15.868 -20.003 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.492 -17.631 -19.151 1.00 0.00 C ATOM 0 H ALA A 81 -6.643 -17.813 -21.452 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.202 -18.151 -20.326 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -8.066 -17.466 -18.239 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -7.104 -18.650 -19.156 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.662 -16.926 -19.190 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.207 -15.026 -20.680 1.00 0.00 N ATOM 1293 CA GLU A 82 -8.676 -13.646 -20.692 1.00 0.00 C ATOM 1294 C GLU A 82 -9.739 -13.441 -21.767 1.00 0.00 C ATOM 1295 O GLU A 82 -10.699 -12.695 -21.572 1.00 0.00 O ATOM 1296 CB GLU A 82 -7.505 -12.689 -20.929 1.00 0.00 C ATOM 1297 CG GLU A 82 -6.867 -12.179 -19.648 1.00 0.00 C ATOM 1298 CD GLU A 82 -6.436 -10.729 -19.747 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -7.319 -9.856 -19.881 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -5.216 -10.467 -19.692 1.00 0.00 O ATOM 0 H GLU A 82 -7.232 -15.143 -20.956 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.121 -13.432 -19.720 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -6.747 -13.197 -21.525 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.854 -11.839 -21.514 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.574 -12.288 -18.826 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.001 -12.796 -19.408 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.561 -14.110 -22.902 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.505 -14.002 -24.007 1.00 0.00 C ATOM 1309 C ILE A 83 -11.854 -14.611 -23.640 1.00 0.00 C ATOM 1310 O ILE A 83 -12.902 -14.020 -23.895 1.00 0.00 O ATOM 1311 CB ILE A 83 -9.969 -14.696 -25.274 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.606 -14.118 -25.660 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -10.959 -14.544 -26.419 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -7.874 -14.940 -26.697 1.00 0.00 C ATOM 0 H ILE A 83 -8.772 -14.732 -23.080 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.633 -12.939 -24.210 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.846 -15.759 -25.065 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.744 -13.106 -26.041 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.987 -14.040 -24.766 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -10.567 -15.039 -27.307 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.910 -14.998 -26.140 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.111 -13.486 -26.631 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.916 -14.472 -26.923 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.704 -15.945 -26.311 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.473 -14.997 -27.606 1.00 0.00 H new ATOM 1326 N GLU A 84 -11.818 -15.796 -23.037 1.00 0.00 N ATOM 1327 CA GLU A 84 -13.038 -16.484 -22.634 1.00 0.00 C ATOM 1328 C GLU A 84 -13.750 -15.722 -21.520 1.00 0.00 C ATOM 1329 O GLU A 84 -14.969 -15.812 -21.371 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.718 -17.907 -22.169 1.00 0.00 C ATOM 1331 CG GLU A 84 -12.159 -18.794 -23.268 1.00 0.00 C ATOM 1332 CD GLU A 84 -13.233 -19.312 -24.204 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -14.020 -20.184 -23.781 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -13.288 -18.843 -25.361 1.00 0.00 O ATOM 0 H GLU A 84 -10.958 -16.298 -22.817 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.700 -16.532 -23.499 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.999 -17.860 -21.351 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.625 -18.363 -21.771 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.422 -18.233 -23.842 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.637 -19.638 -22.818 1.00 0.00 H new ATOM 1341 N TYR A 85 -12.980 -14.972 -20.739 1.00 0.00 N ATOM 1342 CA TYR A 85 -13.535 -14.196 -19.637 1.00 0.00 C ATOM 1343 C TYR A 85 -14.176 -12.908 -20.145 1.00 0.00 C ATOM 1344 O TYR A 85 -15.354 -12.649 -19.900 1.00 0.00 O ATOM 1345 CB TYR A 85 -12.444 -13.867 -18.616 1.00 0.00 C ATOM 1346 CG TYR A 85 -12.903 -12.937 -17.517 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -13.617 -13.419 -16.426 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -12.624 -11.577 -17.568 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -14.040 -12.573 -15.419 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -13.042 -10.724 -16.565 1.00 0.00 C ATOM 1351 CZ TYR A 85 -13.749 -11.226 -15.493 1.00 0.00 C ATOM 1352 OH TYR A 85 -14.168 -10.380 -14.492 1.00 0.00 O ATOM 0 H TYR A 85 -11.970 -14.885 -20.849 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.305 -14.798 -19.155 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.085 -14.794 -18.169 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.598 -13.414 -19.134 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -13.845 -14.473 -16.365 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.071 -11.180 -18.406 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -14.595 -12.963 -14.579 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -12.816 -9.669 -16.620 1.00 0.00 H new ATOM 0 HH TYR A 85 -13.881 -9.465 -14.695 1.00 0.00 H new ATOM 1362 N ARG A 86 -13.391 -12.105 -20.855 1.00 0.00 N ATOM 1363 CA ARG A 86 -13.880 -10.843 -21.399 1.00 0.00 C ATOM 1364 C ARG A 86 -15.014 -11.082 -22.391 1.00 0.00 C ATOM 1365 O ARG A 86 -15.875 -10.224 -22.582 1.00 0.00 O ATOM 1366 CB ARG A 86 -12.742 -10.082 -22.082 1.00 0.00 C ATOM 1367 CG ARG A 86 -12.155 -10.811 -23.280 1.00 0.00 C ATOM 1368 CD ARG A 86 -12.506 -10.111 -24.584 1.00 0.00 C ATOM 1369 NE ARG A 86 -11.776 -8.856 -24.744 1.00 0.00 N ATOM 1370 CZ ARG A 86 -10.478 -8.790 -25.016 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -9.770 -9.901 -25.158 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -9.885 -7.610 -25.148 1.00 0.00 N ATOM 0 H ARG A 86 -12.414 -12.305 -21.067 1.00 0.00 H new ATOM 0 HA ARG A 86 -14.263 -10.244 -20.573 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -13.110 -9.108 -22.405 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -11.951 -9.899 -21.355 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.071 -10.869 -23.177 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.528 -11.835 -23.303 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.281 -10.771 -25.422 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.578 -9.914 -24.613 1.00 0.00 H new ATOM 0 HE ARG A 86 -12.292 -7.982 -24.641 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -10.222 -10.810 -25.058 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -8.773 -9.847 -25.367 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.426 -6.752 -25.040 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -8.888 -7.561 -25.357 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.006 -12.253 -23.020 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.033 -12.604 -23.994 1.00 0.00 C ATOM 1388 C GLU A 87 -17.422 -12.542 -23.365 1.00 0.00 C ATOM 1389 O GLU A 87 -18.273 -11.760 -23.789 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.778 -14.003 -24.557 1.00 0.00 C ATOM 1391 CG GLU A 87 -15.100 -13.997 -25.917 1.00 0.00 C ATOM 1392 CD GLU A 87 -16.086 -14.131 -27.061 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -17.036 -14.931 -26.936 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -15.907 -13.433 -28.082 1.00 0.00 O ATOM 0 H GLU A 87 -14.300 -12.974 -22.873 1.00 0.00 H new ATOM 0 HA GLU A 87 -15.988 -11.880 -24.808 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.159 -14.561 -23.854 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.727 -14.532 -24.636 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.537 -13.071 -26.034 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.381 -14.815 -25.964 1.00 0.00 H new ATOM 1401 N ARG A 88 -17.644 -13.374 -22.352 1.00 0.00 N ATOM 1402 CA ARG A 88 -18.929 -13.416 -21.666 1.00 0.00 C ATOM 1403 C ARG A 88 -19.240 -12.074 -21.010 1.00 0.00 C ATOM 1404 O ARG A 88 -20.404 -11.724 -20.807 1.00 0.00 O ATOM 1405 CB ARG A 88 -18.932 -14.524 -20.611 1.00 0.00 C ATOM 1406 CG ARG A 88 -17.766 -14.443 -19.639 1.00 0.00 C ATOM 1407 CD ARG A 88 -17.989 -15.331 -18.425 1.00 0.00 C ATOM 1408 NE ARG A 88 -17.113 -16.500 -18.434 1.00 0.00 N ATOM 1409 CZ ARG A 88 -17.325 -17.582 -17.694 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -18.378 -17.645 -16.891 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -16.482 -18.605 -17.757 1.00 0.00 N ATOM 0 H ARG A 88 -16.950 -14.028 -21.989 1.00 0.00 H new ATOM 0 HA ARG A 88 -19.701 -13.626 -22.407 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -19.865 -14.477 -20.050 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -18.909 -15.492 -21.112 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -16.848 -14.741 -20.145 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -17.631 -13.411 -19.316 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -17.814 -14.754 -17.517 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -19.029 -15.657 -18.400 1.00 0.00 H new ATOM 0 HE ARG A 88 -16.294 -16.484 -19.042 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -19.028 -16.861 -16.840 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -18.538 -18.478 -16.324 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -15.671 -18.560 -18.374 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -16.645 -19.436 -17.188 1.00 0.00 H new ATOM 1425 N LEU A 89 -18.193 -11.327 -20.679 1.00 0.00 N ATOM 1426 CA LEU A 89 -18.353 -10.022 -20.045 1.00 0.00 C ATOM 1427 C LEU A 89 -19.207 -9.099 -20.908 1.00 0.00 C ATOM 1428 O LEU A 89 -20.019 -8.328 -20.396 1.00 0.00 O ATOM 1429 CB LEU A 89 -16.985 -9.384 -19.794 1.00 0.00 C ATOM 1430 CG LEU A 89 -16.565 -9.253 -18.330 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -16.122 -10.600 -17.780 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -15.453 -8.224 -18.184 1.00 0.00 C ATOM 0 H LEU A 89 -17.224 -11.602 -20.839 1.00 0.00 H new ATOM 0 HA LEU A 89 -18.859 -10.168 -19.091 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -16.231 -9.972 -20.317 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -16.982 -8.391 -20.243 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.426 -8.913 -17.754 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -15.827 -10.488 -16.737 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -16.946 -11.310 -17.849 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -15.275 -10.969 -18.359 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.167 -8.144 -17.135 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -14.590 -8.535 -18.773 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -15.805 -7.255 -18.539 1.00 0.00 H new ATOM 1444 N PHE A 90 -19.020 -9.183 -22.221 1.00 0.00 N ATOM 1445 CA PHE A 90 -19.774 -8.356 -23.156 1.00 0.00 C ATOM 1446 C PHE A 90 -21.268 -8.651 -23.060 1.00 0.00 C ATOM 1447 O PHE A 90 -22.085 -7.738 -22.936 1.00 0.00 O ATOM 1448 CB PHE A 90 -19.287 -8.593 -24.587 1.00 0.00 C ATOM 1449 CG PHE A 90 -18.461 -7.464 -25.134 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -17.264 -7.109 -24.533 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -18.882 -6.757 -26.249 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -16.503 -6.069 -25.033 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -18.125 -5.717 -26.755 1.00 0.00 C ATOM 1454 CZ PHE A 90 -16.933 -5.374 -26.147 1.00 0.00 C ATOM 0 H PHE A 90 -18.352 -9.816 -22.662 1.00 0.00 H new ATOM 0 HA PHE A 90 -19.610 -7.311 -22.892 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -18.698 -9.510 -24.615 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -20.150 -8.748 -25.235 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -16.922 -7.651 -23.664 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -19.813 -7.022 -26.728 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -15.573 -5.800 -24.553 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -18.465 -5.174 -27.624 1.00 0.00 H new ATOM 0 HZ PHE A 90 -16.338 -4.564 -26.542 1.00 0.00 H new ATOM 1464 N ARG A 91 -21.617 -9.932 -23.118 1.00 0.00 N ATOM 1465 CA ARG A 91 -23.012 -10.348 -23.039 1.00 0.00 C ATOM 1466 C ARG A 91 -23.586 -10.068 -21.653 1.00 0.00 C ATOM 1467 O ARG A 91 -24.774 -9.788 -21.507 1.00 0.00 O ATOM 1468 CB ARG A 91 -23.142 -11.837 -23.366 1.00 0.00 C ATOM 1469 CG ARG A 91 -24.473 -12.208 -23.997 1.00 0.00 C ATOM 1470 CD ARG A 91 -25.227 -13.224 -23.153 1.00 0.00 C ATOM 1471 NE ARG A 91 -25.054 -14.586 -23.653 1.00 0.00 N ATOM 1472 CZ ARG A 91 -25.574 -15.021 -24.795 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -26.295 -14.206 -25.552 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -25.372 -16.274 -25.182 1.00 0.00 N ATOM 0 H ARG A 91 -20.953 -10.700 -23.219 1.00 0.00 H new ATOM 0 HA ARG A 91 -23.578 -9.772 -23.771 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -22.337 -12.123 -24.042 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -23.010 -12.414 -22.451 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -25.081 -11.312 -24.119 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -24.303 -12.616 -24.993 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -24.878 -13.169 -22.122 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -26.288 -12.973 -23.144 1.00 0.00 H new ATOM 0 HE ARG A 91 -24.504 -15.238 -23.094 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -26.452 -13.242 -25.258 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -26.693 -14.543 -26.429 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -24.817 -16.904 -24.602 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -25.772 -16.608 -26.059 1.00 0.00 H new ATOM 1488 N ASN A 92 -22.731 -10.147 -20.638 1.00 0.00 N ATOM 1489 CA ASN A 92 -23.153 -9.904 -19.263 1.00 0.00 C ATOM 1490 C ASN A 92 -23.727 -8.499 -19.111 1.00 0.00 C ATOM 1491 O ASN A 92 -24.614 -8.266 -18.290 1.00 0.00 O ATOM 1492 CB ASN A 92 -21.975 -10.092 -18.305 1.00 0.00 C ATOM 1493 CG ASN A 92 -22.349 -10.906 -17.081 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -23.008 -11.940 -17.188 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -21.928 -10.441 -15.911 1.00 0.00 N ATOM 0 H ASN A 92 -21.743 -10.377 -20.742 1.00 0.00 H new ATOM 0 HA ASN A 92 -23.932 -10.625 -19.016 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -21.158 -10.586 -18.831 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -21.607 -9.116 -17.990 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -22.148 -10.946 -15.052 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -21.384 -9.579 -15.871 1.00 0.00 H new ATOM 1502 N GLN A 93 -23.215 -7.567 -19.908 1.00 0.00 N ATOM 1503 CA GLN A 93 -23.677 -6.184 -19.861 1.00 0.00 C ATOM 1504 C GLN A 93 -24.833 -5.964 -20.831 1.00 0.00 C ATOM 1505 O GLN A 93 -24.654 -5.398 -21.909 1.00 0.00 O ATOM 1506 CB GLN A 93 -22.529 -5.229 -20.192 1.00 0.00 C ATOM 1507 CG GLN A 93 -22.800 -3.789 -19.790 1.00 0.00 C ATOM 1508 CD GLN A 93 -22.071 -2.790 -20.668 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -21.745 -3.081 -21.819 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -21.812 -1.605 -20.127 1.00 0.00 N ATOM 0 H GLN A 93 -22.481 -7.744 -20.594 1.00 0.00 H new ATOM 0 HA GLN A 93 -24.030 -5.979 -18.850 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -21.625 -5.573 -19.690 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -22.333 -5.267 -21.264 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -23.872 -3.597 -19.841 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -22.499 -3.643 -18.753 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -22.101 -1.408 -19.169 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -21.324 -0.892 -20.670 1.00 0.00 H new ATOM 1519 N LYS A 94 -26.020 -6.415 -20.440 1.00 0.00 N ATOM 1520 CA LYS A 94 -27.207 -6.267 -21.273 1.00 0.00 C ATOM 1521 C LYS A 94 -28.318 -5.548 -20.515 1.00 0.00 C ATOM 1522 O LYS A 94 -28.262 -5.415 -19.292 1.00 0.00 O ATOM 1523 CB LYS A 94 -27.701 -7.638 -21.743 1.00 0.00 C ATOM 1524 CG LYS A 94 -28.102 -8.561 -20.606 1.00 0.00 C ATOM 1525 CD LYS A 94 -28.094 -10.017 -21.041 1.00 0.00 C ATOM 1526 CE LYS A 94 -28.593 -10.933 -19.933 1.00 0.00 C ATOM 1527 NZ LYS A 94 -28.803 -12.325 -20.417 1.00 0.00 N ATOM 0 H LYS A 94 -26.185 -6.886 -19.551 1.00 0.00 H new ATOM 0 HA LYS A 94 -26.937 -5.667 -22.142 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -28.555 -7.500 -22.406 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -26.916 -8.117 -22.329 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -27.418 -8.427 -19.768 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -29.097 -8.292 -20.251 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -28.721 -10.137 -21.924 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -27.083 -10.307 -21.326 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -27.874 -10.938 -19.114 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -29.529 -10.543 -19.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -29.143 -12.918 -19.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -29.508 -12.324 -21.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -27.905 -12.707 -20.776 1.00 0.00 H new ATOM 1541 N ILE A 95 -29.327 -5.088 -21.247 1.00 0.00 N ATOM 1542 CA ILE A 95 -30.451 -4.385 -20.643 1.00 0.00 C ATOM 1543 C ILE A 95 -31.434 -5.363 -20.009 1.00 0.00 C ATOM 1544 O ILE A 95 -32.071 -5.054 -19.001 1.00 0.00 O ATOM 1545 CB ILE A 95 -31.198 -3.522 -21.677 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -32.305 -2.715 -20.996 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -31.774 -4.397 -22.780 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -32.328 -1.258 -21.401 1.00 0.00 C ATOM 0 H ILE A 95 -29.389 -5.190 -22.260 1.00 0.00 H new ATOM 0 HA ILE A 95 -30.038 -3.736 -19.871 1.00 0.00 H new ATOM 0 HB ILE A 95 -30.490 -2.825 -22.126 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -33.269 -3.165 -21.233 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -32.179 -2.781 -19.915 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -32.299 -3.773 -23.503 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -30.966 -4.931 -23.280 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -32.470 -5.116 -22.348 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -33.138 -0.748 -20.879 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -31.378 -0.793 -21.139 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -32.485 -1.182 -22.477 1.00 0.00 H new ATOM 1560 N LEU A 96 -31.552 -6.544 -20.604 1.00 0.00 N ATOM 1561 CA LEU A 96 -32.456 -7.571 -20.097 1.00 0.00 C ATOM 1562 C LEU A 96 -32.345 -8.850 -20.921 1.00 0.00 C ATOM 1563 O LEU A 96 -31.521 -8.945 -21.830 1.00 0.00 O ATOM 1564 CB LEU A 96 -33.899 -7.062 -20.116 1.00 0.00 C ATOM 1565 CG LEU A 96 -34.761 -7.444 -18.913 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -34.878 -6.274 -17.948 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -36.139 -7.902 -19.368 1.00 0.00 C ATOM 0 H LEU A 96 -31.033 -6.815 -21.439 1.00 0.00 H new ATOM 0 HA LEU A 96 -32.170 -7.797 -19.070 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -33.879 -5.975 -20.193 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -34.383 -7.436 -21.018 1.00 0.00 H new ATOM 0 HG LEU A 96 -34.279 -8.271 -18.393 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -35.495 -6.564 -17.098 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -33.886 -5.992 -17.597 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -35.337 -5.427 -18.457 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -36.739 -8.170 -18.498 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -36.629 -7.095 -19.912 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -36.037 -8.770 -20.020 1.00 0.00 H new ATOM 1579 N ARG A 97 -33.183 -9.830 -20.598 1.00 0.00 N ATOM 1580 CA ARG A 97 -33.179 -11.103 -21.308 1.00 0.00 C ATOM 1581 C ARG A 97 -34.421 -11.240 -22.184 1.00 0.00 C ATOM 1582 O ARG A 97 -35.430 -10.574 -21.955 1.00 0.00 O ATOM 1583 CB ARG A 97 -33.112 -12.265 -20.316 1.00 0.00 C ATOM 1584 CG ARG A 97 -34.327 -12.362 -19.408 1.00 0.00 C ATOM 1585 CD ARG A 97 -34.148 -13.441 -18.351 1.00 0.00 C ATOM 1586 NE ARG A 97 -34.592 -12.995 -17.033 1.00 0.00 N ATOM 1587 CZ ARG A 97 -34.588 -13.770 -15.955 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -34.164 -15.024 -16.037 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -35.007 -13.291 -14.790 1.00 0.00 N ATOM 0 H ARG A 97 -33.873 -9.767 -19.849 1.00 0.00 H new ATOM 0 HA ARG A 97 -32.298 -11.130 -21.949 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -33.007 -13.198 -20.869 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -32.218 -12.156 -19.702 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -34.498 -11.401 -18.923 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -35.212 -12.580 -20.005 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -34.709 -14.329 -18.641 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -33.098 -13.729 -18.301 1.00 0.00 H new ATOM 0 HE ARG A 97 -34.923 -12.035 -16.935 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -33.840 -15.395 -16.930 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -34.162 -15.617 -15.207 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -35.332 -12.327 -14.722 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -35.004 -13.887 -13.962 1.00 0.00 H new ATOM 1603 N GLU A 98 -34.338 -12.106 -23.189 1.00 0.00 N ATOM 1604 CA GLU A 98 -35.455 -12.329 -24.100 1.00 0.00 C ATOM 1605 C GLU A 98 -36.486 -13.265 -23.477 1.00 0.00 C ATOM 1606 O GLU A 98 -36.136 -14.288 -22.888 1.00 0.00 O ATOM 1607 CB GLU A 98 -34.954 -12.911 -25.423 1.00 0.00 C ATOM 1608 CG GLU A 98 -34.186 -11.914 -26.275 1.00 0.00 C ATOM 1609 CD GLU A 98 -33.361 -12.584 -27.356 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -32.387 -13.285 -27.011 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -33.690 -12.408 -28.548 1.00 0.00 O ATOM 0 H GLU A 98 -33.509 -12.665 -23.393 1.00 0.00 H new ATOM 0 HA GLU A 98 -35.932 -11.368 -24.292 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -34.313 -13.767 -25.214 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -35.806 -13.282 -25.993 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -34.888 -11.220 -26.737 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -33.529 -11.325 -25.635 1.00 0.00 H new ATOM 1618 N TYR A 99 -37.758 -12.908 -23.612 1.00 0.00 N ATOM 1619 CA TYR A 99 -38.841 -13.713 -23.061 1.00 0.00 C ATOM 1620 C TYR A 99 -38.726 -13.816 -21.543 1.00 0.00 C ATOM 1621 O TYR A 99 -37.877 -13.170 -20.929 1.00 0.00 O ATOM 1622 CB TYR A 99 -38.830 -15.112 -23.679 1.00 0.00 C ATOM 1623 CG TYR A 99 -38.761 -15.105 -25.190 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -39.914 -14.995 -25.958 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -37.542 -15.210 -25.849 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -39.855 -14.989 -27.338 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -37.474 -15.204 -27.229 1.00 0.00 C ATOM 1628 CZ TYR A 99 -38.633 -15.093 -27.969 1.00 0.00 C ATOM 1629 OH TYR A 99 -38.569 -15.088 -29.343 1.00 0.00 O ATOM 0 H TYR A 99 -38.065 -12.066 -24.099 1.00 0.00 H new ATOM 0 HA TYR A 99 -39.783 -13.222 -23.304 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -37.977 -15.667 -23.287 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -39.728 -15.645 -23.367 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -40.873 -14.913 -25.467 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -36.633 -15.298 -25.273 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -40.761 -14.903 -27.920 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -36.519 -15.286 -27.726 1.00 0.00 H new ATOM 0 HH TYR A 99 -37.635 -15.168 -29.627 1.00 0.00 H new ATOM 1639 N ARG A 100 -39.586 -14.633 -20.944 1.00 0.00 N ATOM 1640 CA ARG A 100 -39.583 -14.821 -19.499 1.00 0.00 C ATOM 1641 C ARG A 100 -40.195 -16.168 -19.124 1.00 0.00 C ATOM 1642 O ARG A 100 -41.013 -16.716 -19.862 1.00 0.00 O ATOM 1643 CB ARG A 100 -40.353 -13.690 -18.814 1.00 0.00 C ATOM 1644 CG ARG A 100 -41.835 -13.672 -19.152 1.00 0.00 C ATOM 1645 CD ARG A 100 -42.690 -13.925 -17.920 1.00 0.00 C ATOM 1646 NE ARG A 100 -44.115 -13.764 -18.200 1.00 0.00 N ATOM 1647 CZ ARG A 100 -44.856 -14.691 -18.796 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -44.310 -15.839 -19.174 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -46.146 -14.471 -19.016 1.00 0.00 N ATOM 0 H ARG A 100 -40.294 -15.176 -21.438 1.00 0.00 H new ATOM 0 HA ARG A 100 -38.548 -14.805 -19.158 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -40.236 -13.784 -17.734 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -39.912 -12.735 -19.101 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -42.098 -12.708 -19.587 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -42.047 -14.431 -19.905 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -42.505 -14.934 -17.551 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -42.396 -13.237 -17.127 1.00 0.00 H new ATOM 0 HE ARG A 100 -44.565 -12.892 -17.923 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -43.319 -16.012 -19.007 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -44.881 -16.549 -19.632 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -46.569 -13.589 -18.727 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -46.714 -15.184 -19.474 1.00 0.00 H new ATOM 1663 N ASP A 101 -39.791 -16.695 -17.973 1.00 0.00 N ATOM 1664 CA ASP A 101 -40.300 -17.977 -17.500 1.00 0.00 C ATOM 1665 C ASP A 101 -40.402 -17.992 -15.978 1.00 0.00 C ATOM 1666 O ASP A 101 -40.830 -18.984 -15.385 1.00 0.00 O ATOM 1667 CB ASP A 101 -39.395 -19.115 -17.974 1.00 0.00 C ATOM 1668 CG ASP A 101 -40.061 -20.472 -17.857 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -41.269 -20.568 -18.161 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -39.375 -21.437 -17.462 1.00 0.00 O ATOM 0 H ASP A 101 -39.113 -16.255 -17.351 1.00 0.00 H new ATOM 0 HA ASP A 101 -41.298 -18.120 -17.915 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -39.111 -18.941 -19.012 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -38.476 -19.113 -17.388 1.00 0.00 H new TER 1675 ASP A 101