USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 836 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -172:sc= 0 (180deg=-0.0568) 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 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.225 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 ASN : amide:sc= -0.0305 X(o=-0.03,f=-0.44) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 22 ASN : amide:sc= -0.0715 X(o=-0.071,f=-0.053) 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= -0.0337 USER MOD Single : A 29 SER OG : rot 180:sc= 0.124 USER MOD Single : A 33 GLN : amide:sc= -0.139 X(o=-0.14,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 139:sc= -0.0525 (180deg=-0.306) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.0558 X(o=-0.056,f=-0.17) 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 180:sc= 0 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+ -149:sc= -0.354 (180deg=-0.909) USER MOD Single : A 61 SER OG : rot -160:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= -0.218 USER MOD Single : A 75 LYS NZ :NH3+ 151:sc= 0.951 (180deg=0.404) 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=-0.00976 K(o=-0.0098,f=-1.2) USER MOD Single : A 93 GLN : amide:sc= -0.136 K(o=-0.14,f=-2!) 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 -1.922 21.165 -16.498 1.00 0.00 N ATOM 2 CA GLY A 1 -2.005 22.563 -16.880 1.00 0.00 C ATOM 3 C GLY A 1 -2.602 22.751 -18.261 1.00 0.00 C ATOM 4 O GLY A 1 -3.384 23.675 -18.486 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.636 21.094 -15.501 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.851 20.715 -16.625 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.219 20.683 -17.094 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -2.609 23.101 -16.150 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.008 23.003 -16.855 1.00 0.00 H new ATOM 8 N SER A 2 -2.232 21.875 -19.189 1.00 0.00 N ATOM 9 CA SER A 2 -2.732 21.952 -20.557 1.00 0.00 C ATOM 10 C SER A 2 -2.992 20.558 -21.120 1.00 0.00 C ATOM 11 O SER A 2 -2.115 19.695 -21.099 1.00 0.00 O ATOM 12 CB SER A 2 -1.733 22.695 -21.446 1.00 0.00 C ATOM 13 OG SER A 2 -1.741 24.085 -21.170 1.00 0.00 O ATOM 0 H SER A 2 -1.587 21.103 -19.019 1.00 0.00 H new ATOM 0 HA SER A 2 -3.674 22.501 -20.543 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.732 22.295 -21.286 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.980 22.528 -22.494 1.00 0.00 H new ATOM 0 HG SER A 2 -1.093 24.537 -21.750 1.00 0.00 H new ATOM 19 N SER A 3 -4.204 20.347 -21.622 1.00 0.00 N ATOM 20 CA SER A 3 -4.583 19.057 -22.188 1.00 0.00 C ATOM 21 C SER A 3 -5.580 19.236 -23.328 1.00 0.00 C ATOM 22 O SER A 3 -6.773 19.434 -23.100 1.00 0.00 O ATOM 23 CB SER A 3 -5.184 18.159 -21.106 1.00 0.00 C ATOM 24 OG SER A 3 -4.836 16.802 -21.317 1.00 0.00 O ATOM 0 H SER A 3 -4.941 21.052 -21.649 1.00 0.00 H new ATOM 0 HA SER A 3 -3.685 18.584 -22.585 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.831 18.480 -20.126 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.269 18.263 -21.104 1.00 0.00 H new ATOM 0 HG SER A 3 -5.231 16.249 -20.611 1.00 0.00 H new ATOM 30 N GLY A 4 -5.082 19.166 -24.559 1.00 0.00 N ATOM 31 CA GLY A 4 -5.941 19.322 -25.718 1.00 0.00 C ATOM 32 C GLY A 4 -6.669 18.042 -26.077 1.00 0.00 C ATOM 33 O GLY A 4 -7.330 17.438 -25.232 1.00 0.00 O ATOM 0 H GLY A 4 -4.098 19.004 -24.774 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.670 20.108 -25.523 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.342 19.647 -26.569 1.00 0.00 H new ATOM 37 N SER A 5 -6.549 17.627 -27.334 1.00 0.00 N ATOM 38 CA SER A 5 -7.206 16.413 -27.804 1.00 0.00 C ATOM 39 C SER A 5 -6.252 15.224 -27.750 1.00 0.00 C ATOM 40 O SER A 5 -5.564 14.920 -28.724 1.00 0.00 O ATOM 41 CB SER A 5 -7.718 16.606 -29.233 1.00 0.00 C ATOM 42 OG SER A 5 -8.746 17.579 -29.279 1.00 0.00 O ATOM 0 H SER A 5 -6.003 18.113 -28.045 1.00 0.00 H new ATOM 0 HA SER A 5 -8.051 16.209 -27.147 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.895 16.911 -29.879 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.093 15.658 -29.620 1.00 0.00 H new ATOM 0 HG SER A 5 -9.055 17.685 -30.203 1.00 0.00 H new ATOM 48 N SER A 6 -6.217 14.553 -26.603 1.00 0.00 N ATOM 49 CA SER A 6 -5.346 13.399 -26.418 1.00 0.00 C ATOM 50 C SER A 6 -5.688 12.661 -25.127 1.00 0.00 C ATOM 51 O SER A 6 -6.346 13.206 -24.243 1.00 0.00 O ATOM 52 CB SER A 6 -3.880 13.838 -26.395 1.00 0.00 C ATOM 53 OG SER A 6 -3.092 13.030 -27.252 1.00 0.00 O ATOM 0 H SER A 6 -6.782 14.789 -25.788 1.00 0.00 H new ATOM 0 HA SER A 6 -5.501 12.720 -27.256 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.805 14.881 -26.703 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.495 13.777 -25.377 1.00 0.00 H new ATOM 0 HG SER A 6 -2.160 13.332 -27.221 1.00 0.00 H new ATOM 59 N GLY A 7 -5.234 11.415 -25.027 1.00 0.00 N ATOM 60 CA GLY A 7 -5.501 10.621 -23.842 1.00 0.00 C ATOM 61 C GLY A 7 -4.329 10.601 -22.881 1.00 0.00 C ATOM 62 O GLY A 7 -3.795 11.649 -22.517 1.00 0.00 O ATOM 0 H GLY A 7 -4.686 10.942 -25.745 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.378 11.019 -23.332 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.741 9.600 -24.139 1.00 0.00 H new ATOM 66 N LYS A 8 -3.926 9.404 -22.468 1.00 0.00 N ATOM 67 CA LYS A 8 -2.809 9.249 -21.543 1.00 0.00 C ATOM 68 C LYS A 8 -1.719 8.371 -22.148 1.00 0.00 C ATOM 69 O LYS A 8 -1.023 7.648 -21.434 1.00 0.00 O ATOM 70 CB LYS A 8 -3.293 8.644 -20.223 1.00 0.00 C ATOM 71 CG LYS A 8 -4.016 7.319 -20.391 1.00 0.00 C ATOM 72 CD LYS A 8 -3.741 6.382 -19.227 1.00 0.00 C ATOM 73 CE LYS A 8 -2.675 5.354 -19.579 1.00 0.00 C ATOM 74 NZ LYS A 8 -2.980 4.018 -18.996 1.00 0.00 N ATOM 0 H LYS A 8 -4.357 8.526 -22.759 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.390 10.237 -21.351 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -2.437 8.500 -19.563 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -3.960 9.352 -19.731 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -5.089 7.496 -20.471 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -3.701 6.847 -21.322 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -3.419 6.960 -18.361 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -4.661 5.871 -18.944 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.597 5.268 -20.663 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.706 5.696 -19.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -2.231 3.346 -19.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -3.030 4.094 -17.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -3.893 3.680 -19.362 1.00 0.00 H new ATOM 88 N TYR A 9 -1.576 8.438 -23.467 1.00 0.00 N ATOM 89 CA TYR A 9 -0.571 7.648 -24.168 1.00 0.00 C ATOM 90 C TYR A 9 0.618 8.514 -24.574 1.00 0.00 C ATOM 91 O TYR A 9 0.484 9.724 -24.766 1.00 0.00 O ATOM 92 CB TYR A 9 -1.182 6.988 -25.405 1.00 0.00 C ATOM 93 CG TYR A 9 -2.090 5.823 -25.084 1.00 0.00 C ATOM 94 CD1 TYR A 9 -3.329 6.027 -24.488 1.00 0.00 C ATOM 95 CD2 TYR A 9 -1.710 4.519 -25.375 1.00 0.00 C ATOM 96 CE1 TYR A 9 -4.162 4.966 -24.192 1.00 0.00 C ATOM 97 CE2 TYR A 9 -2.537 3.452 -25.084 1.00 0.00 C ATOM 98 CZ TYR A 9 -3.762 3.680 -24.492 1.00 0.00 C ATOM 99 OH TYR A 9 -4.589 2.620 -24.199 1.00 0.00 O ATOM 0 H TYR A 9 -2.143 9.031 -24.072 1.00 0.00 H new ATOM 0 HA TYR A 9 -0.217 6.873 -23.489 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -1.747 7.735 -25.963 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -0.379 6.643 -26.056 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -3.646 7.032 -24.252 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -0.751 4.336 -25.837 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -5.121 5.142 -23.728 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -2.226 2.445 -25.319 1.00 0.00 H new ATOM 0 HH TYR A 9 -4.159 1.784 -24.475 1.00 0.00 H new ATOM 109 N THR A 10 1.782 7.887 -24.705 1.00 0.00 N ATOM 110 CA THR A 10 2.995 8.598 -25.088 1.00 0.00 C ATOM 111 C THR A 10 4.004 7.656 -25.736 1.00 0.00 C ATOM 112 O THR A 10 5.213 7.842 -25.605 1.00 0.00 O ATOM 113 CB THR A 10 3.654 9.280 -23.874 1.00 0.00 C ATOM 114 OG1 THR A 10 2.726 9.343 -22.785 1.00 0.00 O ATOM 115 CG2 THR A 10 4.122 10.683 -24.229 1.00 0.00 C ATOM 0 H THR A 10 1.911 6.887 -24.551 1.00 0.00 H new ATOM 0 HA THR A 10 2.699 9.361 -25.808 1.00 0.00 H new ATOM 0 HB THR A 10 4.521 8.689 -23.579 1.00 0.00 H new ATOM 0 HG1 THR A 10 3.152 9.776 -22.016 1.00 0.00 H new ATOM 0 HG21 THR A 10 4.584 11.144 -23.356 1.00 0.00 H new ATOM 0 HG22 THR A 10 4.850 10.630 -25.039 1.00 0.00 H new ATOM 0 HG23 THR A 10 3.268 11.282 -24.547 1.00 0.00 H new ATOM 123 N GLN A 11 3.498 6.646 -26.436 1.00 0.00 N ATOM 124 CA GLN A 11 4.356 5.675 -27.104 1.00 0.00 C ATOM 125 C GLN A 11 5.369 5.082 -26.131 1.00 0.00 C ATOM 126 O GLN A 11 6.576 5.157 -26.355 1.00 0.00 O ATOM 127 CB GLN A 11 5.083 6.330 -28.280 1.00 0.00 C ATOM 128 CG GLN A 11 4.231 6.446 -29.534 1.00 0.00 C ATOM 129 CD GLN A 11 4.168 7.864 -30.067 1.00 0.00 C ATOM 130 OE1 GLN A 11 3.097 8.466 -30.139 1.00 0.00 O ATOM 131 NE2 GLN A 11 5.320 8.406 -30.445 1.00 0.00 N ATOM 0 H GLN A 11 2.499 6.479 -26.555 1.00 0.00 H new ATOM 0 HA GLN A 11 3.726 4.868 -27.479 1.00 0.00 H new ATOM 0 HB2 GLN A 11 5.414 7.325 -27.983 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.978 5.752 -28.511 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.635 5.790 -30.305 1.00 0.00 H new ATOM 0 HG3 GLN A 11 3.221 6.098 -29.316 1.00 0.00 H new ATOM 0 HE21 GLN A 11 6.185 7.871 -30.368 1.00 0.00 H new ATOM 0 HE22 GLN A 11 5.340 9.357 -30.812 1.00 0.00 H new ATOM 140 N ASN A 12 4.869 4.494 -25.049 1.00 0.00 N ATOM 141 CA ASN A 12 5.731 3.890 -24.040 1.00 0.00 C ATOM 142 C ASN A 12 6.073 2.449 -24.409 1.00 0.00 C ATOM 143 O ASN A 12 5.223 1.704 -24.893 1.00 0.00 O ATOM 144 CB ASN A 12 5.053 3.930 -22.669 1.00 0.00 C ATOM 145 CG ASN A 12 5.744 4.879 -21.710 1.00 0.00 C ATOM 146 OD1 ASN A 12 5.859 6.075 -21.977 1.00 0.00 O ATOM 147 ND2 ASN A 12 6.210 4.348 -20.585 1.00 0.00 N ATOM 0 H ASN A 12 3.871 4.423 -24.849 1.00 0.00 H new ATOM 0 HA ASN A 12 6.656 4.465 -23.997 1.00 0.00 H new ATOM 0 HB2 ASN A 12 4.013 4.233 -22.790 1.00 0.00 H new ATOM 0 HB3 ASN A 12 5.045 2.927 -22.241 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.685 4.937 -19.902 1.00 0.00 H new ATOM 0 HD22 ASN A 12 6.092 3.351 -20.405 1.00 0.00 H new ATOM 154 N ASN A 13 7.324 2.066 -24.176 1.00 0.00 N ATOM 155 CA ASN A 13 7.779 0.715 -24.484 1.00 0.00 C ATOM 156 C ASN A 13 8.569 0.128 -23.318 1.00 0.00 C ATOM 157 O ASN A 13 9.661 -0.411 -23.502 1.00 0.00 O ATOM 158 CB ASN A 13 8.642 0.720 -25.747 1.00 0.00 C ATOM 159 CG ASN A 13 8.657 -0.628 -26.442 1.00 0.00 C ATOM 160 OD1 ASN A 13 7.615 -1.257 -26.626 1.00 0.00 O ATOM 161 ND2 ASN A 13 9.844 -1.079 -26.832 1.00 0.00 N ATOM 0 H ASN A 13 8.040 2.671 -23.775 1.00 0.00 H new ATOM 0 HA ASN A 13 6.900 0.093 -24.655 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.268 1.477 -26.436 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.662 1.003 -25.486 1.00 0.00 H new ATOM 0 HD21 ASN A 13 9.917 -1.980 -27.305 1.00 0.00 H new ATOM 0 HD22 ASN A 13 10.682 -0.524 -26.659 1.00 0.00 H new ATOM 168 N PHE A 14 8.009 0.235 -22.117 1.00 0.00 N ATOM 169 CA PHE A 14 8.660 -0.284 -20.921 1.00 0.00 C ATOM 170 C PHE A 14 7.762 -1.288 -20.204 1.00 0.00 C ATOM 171 O PHE A 14 6.541 -1.273 -20.369 1.00 0.00 O ATOM 172 CB PHE A 14 9.021 0.861 -19.972 1.00 0.00 C ATOM 173 CG PHE A 14 10.305 1.553 -20.330 1.00 0.00 C ATOM 174 CD1 PHE A 14 10.395 2.329 -21.474 1.00 0.00 C ATOM 175 CD2 PHE A 14 11.424 1.427 -19.521 1.00 0.00 C ATOM 176 CE1 PHE A 14 11.575 2.967 -21.805 1.00 0.00 C ATOM 177 CE2 PHE A 14 12.606 2.063 -19.847 1.00 0.00 C ATOM 178 CZ PHE A 14 12.683 2.833 -20.991 1.00 0.00 C ATOM 0 H PHE A 14 7.105 0.677 -21.947 1.00 0.00 H new ATOM 0 HA PHE A 14 9.573 -0.794 -21.229 1.00 0.00 H new ATOM 0 HB2 PHE A 14 8.212 1.591 -19.972 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.098 0.471 -18.957 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.532 2.437 -22.115 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.371 0.825 -18.626 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.631 3.570 -22.699 1.00 0.00 H new ATOM 0 HE2 PHE A 14 13.470 1.958 -19.207 1.00 0.00 H new ATOM 0 HZ PHE A 14 13.607 3.329 -21.248 1.00 0.00 H new ATOM 188 N ILE A 15 8.374 -2.160 -19.410 1.00 0.00 N ATOM 189 CA ILE A 15 7.630 -3.171 -18.668 1.00 0.00 C ATOM 190 C ILE A 15 8.052 -3.199 -17.203 1.00 0.00 C ATOM 191 O ILE A 15 9.229 -3.035 -16.881 1.00 0.00 O ATOM 192 CB ILE A 15 7.827 -4.573 -19.275 1.00 0.00 C ATOM 193 CG1 ILE A 15 6.983 -5.602 -18.520 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.298 -4.961 -19.244 1.00 0.00 C ATOM 195 CD1 ILE A 15 6.919 -6.949 -19.204 1.00 0.00 C ATOM 0 H ILE A 15 9.383 -2.187 -19.264 1.00 0.00 H new ATOM 0 HA ILE A 15 6.576 -2.900 -18.735 1.00 0.00 H new ATOM 0 HB ILE A 15 7.498 -4.553 -20.314 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.393 -5.731 -17.518 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.971 -5.214 -18.403 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.422 -5.954 -19.676 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.877 -4.240 -19.821 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.651 -4.968 -18.213 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.304 -7.628 -18.613 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.481 -6.833 -20.196 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.925 -7.358 -19.297 1.00 0.00 H new ATOM 207 N THR A 16 7.082 -3.410 -16.318 1.00 0.00 N ATOM 208 CA THR A 16 7.352 -3.461 -14.887 1.00 0.00 C ATOM 209 C THR A 16 8.139 -4.714 -14.520 1.00 0.00 C ATOM 210 O THR A 16 8.127 -5.703 -15.252 1.00 0.00 O ATOM 211 CB THR A 16 6.048 -3.429 -14.068 1.00 0.00 C ATOM 212 OG1 THR A 16 4.928 -3.235 -14.938 1.00 0.00 O ATOM 213 CG2 THR A 16 6.088 -2.317 -13.030 1.00 0.00 C ATOM 0 H THR A 16 6.103 -3.548 -16.568 1.00 0.00 H new ATOM 0 HA THR A 16 7.946 -2.579 -14.646 1.00 0.00 H new ATOM 0 HB THR A 16 5.946 -4.383 -13.552 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.103 -3.218 -14.410 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.157 -2.314 -12.464 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.925 -2.483 -12.351 1.00 0.00 H new ATOM 0 HG23 THR A 16 6.212 -1.357 -13.530 1.00 0.00 H new ATOM 221 N GLY A 17 8.822 -4.666 -13.380 1.00 0.00 N ATOM 222 CA GLY A 17 9.604 -5.804 -12.935 1.00 0.00 C ATOM 223 C GLY A 17 8.749 -7.028 -12.673 1.00 0.00 C ATOM 224 O GLY A 17 8.854 -8.031 -13.381 1.00 0.00 O ATOM 0 H GLY A 17 8.847 -3.859 -12.757 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.354 -6.043 -13.689 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.141 -5.538 -12.025 1.00 0.00 H new ATOM 228 N VAL A 18 7.902 -6.949 -11.652 1.00 0.00 N ATOM 229 CA VAL A 18 7.026 -8.059 -11.298 1.00 0.00 C ATOM 230 C VAL A 18 6.236 -8.544 -12.508 1.00 0.00 C ATOM 231 O VAL A 18 5.913 -9.727 -12.618 1.00 0.00 O ATOM 232 CB VAL A 18 6.042 -7.663 -10.181 1.00 0.00 C ATOM 233 CG1 VAL A 18 5.144 -6.523 -10.639 1.00 0.00 C ATOM 234 CG2 VAL A 18 5.214 -8.864 -9.750 1.00 0.00 C ATOM 0 H VAL A 18 7.804 -6.128 -11.055 1.00 0.00 H new ATOM 0 HA VAL A 18 7.666 -8.865 -10.939 1.00 0.00 H new ATOM 0 HB VAL A 18 6.616 -7.318 -9.321 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.456 -6.257 -9.837 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.756 -5.658 -10.894 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.576 -6.837 -11.515 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.524 -8.566 -8.960 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.649 -9.241 -10.602 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.875 -9.647 -9.378 1.00 0.00 H new ATOM 244 N ARG A 19 5.928 -7.622 -13.414 1.00 0.00 N ATOM 245 CA ARG A 19 5.174 -7.955 -14.617 1.00 0.00 C ATOM 246 C ARG A 19 5.956 -8.927 -15.497 1.00 0.00 C ATOM 247 O ARG A 19 5.404 -9.903 -16.003 1.00 0.00 O ATOM 248 CB ARG A 19 4.846 -6.687 -15.407 1.00 0.00 C ATOM 249 CG ARG A 19 3.413 -6.213 -15.230 1.00 0.00 C ATOM 250 CD ARG A 19 2.817 -5.737 -16.546 1.00 0.00 C ATOM 251 NE ARG A 19 1.773 -6.636 -17.030 1.00 0.00 N ATOM 252 CZ ARG A 19 0.569 -6.729 -16.477 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.258 -5.982 -15.427 1.00 0.00 N ATOM 254 NH2 ARG A 19 -0.328 -7.570 -16.976 1.00 0.00 N ATOM 0 H ARG A 19 6.189 -6.639 -13.338 1.00 0.00 H new ATOM 0 HA ARG A 19 4.244 -8.435 -14.311 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.524 -5.891 -15.098 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.031 -6.870 -16.465 1.00 0.00 H new ATOM 0 HG2 ARG A 19 2.807 -7.025 -14.827 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.384 -5.402 -14.502 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.403 -4.737 -16.416 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.606 -5.661 -17.295 1.00 0.00 H new ATOM 0 HE ARG A 19 1.980 -7.225 -17.837 1.00 0.00 H new ATOM 0 HH11 ARG A 19 0.944 -5.333 -15.041 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.668 -6.056 -15.005 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -0.093 -8.146 -17.785 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.252 -7.641 -16.551 1.00 0.00 H new ATOM 268 N ALA A 20 7.244 -8.652 -15.673 1.00 0.00 N ATOM 269 CA ALA A 20 8.102 -9.502 -16.490 1.00 0.00 C ATOM 270 C ALA A 20 8.374 -10.833 -15.798 1.00 0.00 C ATOM 271 O ALA A 20 8.422 -11.880 -16.444 1.00 0.00 O ATOM 272 CB ALA A 20 9.410 -8.789 -16.800 1.00 0.00 C ATOM 0 H ALA A 20 7.716 -7.847 -15.261 1.00 0.00 H new ATOM 0 HA ALA A 20 7.583 -9.708 -17.426 1.00 0.00 H new ATOM 0 HB1 ALA A 20 10.041 -9.435 -17.411 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.202 -7.867 -17.343 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.926 -8.553 -15.869 1.00 0.00 H new ATOM 278 N ILE A 21 8.552 -10.785 -14.482 1.00 0.00 N ATOM 279 CA ILE A 21 8.819 -11.988 -13.704 1.00 0.00 C ATOM 280 C ILE A 21 7.677 -12.991 -13.832 1.00 0.00 C ATOM 281 O ILE A 21 7.889 -14.201 -13.760 1.00 0.00 O ATOM 282 CB ILE A 21 9.033 -11.659 -12.214 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.186 -10.667 -12.049 1.00 0.00 C ATOM 284 CG2 ILE A 21 9.304 -12.931 -11.425 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.237 -10.021 -10.682 1.00 0.00 C ATOM 0 H ILE A 21 8.516 -9.926 -13.933 1.00 0.00 H new ATOM 0 HA ILE A 21 9.732 -12.427 -14.106 1.00 0.00 H new ATOM 0 HB ILE A 21 8.125 -11.199 -11.824 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.128 -11.184 -12.233 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.096 -9.889 -12.807 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.453 -12.683 -10.374 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.454 -13.607 -11.521 1.00 0.00 H new ATOM 0 HG23 ILE A 21 10.199 -13.416 -11.814 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.079 -9.330 -10.637 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.310 -9.476 -10.502 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.359 -10.791 -9.920 1.00 0.00 H new ATOM 297 N ASN A 22 6.466 -12.479 -14.025 1.00 0.00 N ATOM 298 CA ASN A 22 5.290 -13.329 -14.166 1.00 0.00 C ATOM 299 C ASN A 22 5.023 -13.651 -15.633 1.00 0.00 C ATOM 300 O ASN A 22 4.887 -14.815 -16.008 1.00 0.00 O ATOM 301 CB ASN A 22 4.066 -12.648 -13.550 1.00 0.00 C ATOM 302 CG ASN A 22 3.932 -12.930 -12.066 1.00 0.00 C ATOM 303 OD1 ASN A 22 3.790 -14.081 -11.652 1.00 0.00 O ATOM 304 ND2 ASN A 22 3.977 -11.878 -11.258 1.00 0.00 N ATOM 0 H ASN A 22 6.273 -11.479 -14.087 1.00 0.00 H new ATOM 0 HA ASN A 22 5.482 -14.263 -13.638 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.135 -11.572 -13.708 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.167 -12.988 -14.064 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.892 -12.006 -10.250 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.096 -10.942 -11.646 1.00 0.00 H new ATOM 311 N GLU A 23 4.951 -12.611 -16.458 1.00 0.00 N ATOM 312 CA GLU A 23 4.700 -12.783 -17.884 1.00 0.00 C ATOM 313 C GLU A 23 5.710 -13.746 -18.501 1.00 0.00 C ATOM 314 O GLU A 23 5.338 -14.767 -19.080 1.00 0.00 O ATOM 315 CB GLU A 23 4.761 -11.433 -18.602 1.00 0.00 C ATOM 316 CG GLU A 23 3.534 -10.567 -18.375 1.00 0.00 C ATOM 317 CD GLU A 23 2.604 -10.548 -19.573 1.00 0.00 C ATOM 318 OE1 GLU A 23 2.335 -11.631 -20.133 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.146 -9.449 -19.950 1.00 0.00 O ATOM 0 H GLU A 23 5.063 -11.641 -16.163 1.00 0.00 H new ATOM 0 HA GLU A 23 3.702 -13.204 -18.003 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.645 -10.891 -18.265 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.881 -11.605 -19.672 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.991 -10.934 -17.504 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.849 -9.549 -18.148 1.00 0.00 H new ATOM 326 N PHE A 24 6.991 -13.414 -18.373 1.00 0.00 N ATOM 327 CA PHE A 24 8.055 -14.247 -18.919 1.00 0.00 C ATOM 328 C PHE A 24 8.328 -15.444 -18.013 1.00 0.00 C ATOM 329 O PHE A 24 8.965 -16.415 -18.424 1.00 0.00 O ATOM 330 CB PHE A 24 9.334 -13.426 -19.098 1.00 0.00 C ATOM 331 CG PHE A 24 9.210 -12.341 -20.129 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.550 -11.159 -19.834 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.754 -12.503 -21.393 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.435 -10.158 -20.781 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.643 -11.505 -22.343 1.00 0.00 C ATOM 336 CZ PHE A 24 8.981 -10.332 -22.037 1.00 0.00 C ATOM 0 H PHE A 24 7.317 -12.573 -17.896 1.00 0.00 H new ATOM 0 HA PHE A 24 7.730 -14.617 -19.892 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.606 -12.978 -18.142 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.148 -14.093 -19.380 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.120 -11.018 -18.853 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.270 -13.419 -21.639 1.00 0.00 H new ATOM 0 HE1 PHE A 24 7.919 -9.241 -20.538 1.00 0.00 H new ATOM 0 HE2 PHE A 24 10.074 -11.642 -23.324 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.891 -9.552 -22.779 1.00 0.00 H new ATOM 346 N CYS A 25 7.843 -15.366 -16.779 1.00 0.00 N ATOM 347 CA CYS A 25 8.035 -16.442 -15.813 1.00 0.00 C ATOM 348 C CYS A 25 9.516 -16.637 -15.504 1.00 0.00 C ATOM 349 O CYS A 25 10.041 -17.747 -15.603 1.00 0.00 O ATOM 350 CB CYS A 25 7.436 -17.745 -16.343 1.00 0.00 C ATOM 351 SG CYS A 25 6.841 -18.863 -15.053 1.00 0.00 S ATOM 0 H CYS A 25 7.314 -14.569 -16.424 1.00 0.00 H new ATOM 0 HA CYS A 25 7.523 -16.165 -14.891 1.00 0.00 H new ATOM 0 HB2 CYS A 25 6.609 -17.506 -17.012 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.188 -18.262 -16.938 1.00 0.00 H new ATOM 0 HG CYS A 25 6.351 -19.935 -15.600 1.00 0.00 H new ATOM 357 N LEU A 26 10.185 -15.552 -15.131 1.00 0.00 N ATOM 358 CA LEU A 26 11.607 -15.603 -14.809 1.00 0.00 C ATOM 359 C LEU A 26 11.826 -15.546 -13.301 1.00 0.00 C ATOM 360 O LEU A 26 10.878 -15.639 -12.521 1.00 0.00 O ATOM 361 CB LEU A 26 12.345 -14.447 -15.487 1.00 0.00 C ATOM 362 CG LEU A 26 11.996 -14.196 -16.954 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.533 -12.848 -17.408 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.544 -15.313 -17.831 1.00 0.00 C ATOM 0 H LEU A 26 9.766 -14.626 -15.044 1.00 0.00 H new ATOM 0 HA LEU A 26 12.005 -16.548 -15.180 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.144 -13.535 -14.925 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.416 -14.635 -15.416 1.00 0.00 H new ATOM 0 HG LEU A 26 10.910 -14.183 -17.052 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.275 -12.687 -18.455 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.093 -12.058 -16.800 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.617 -12.831 -17.295 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.286 -15.118 -18.872 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.628 -15.358 -17.728 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.111 -16.264 -17.522 1.00 0.00 H new ATOM 376 N LYS A 27 13.082 -15.391 -12.896 1.00 0.00 N ATOM 377 CA LYS A 27 13.427 -15.318 -11.481 1.00 0.00 C ATOM 378 C LYS A 27 13.839 -13.901 -11.094 1.00 0.00 C ATOM 379 O LYS A 27 14.434 -13.178 -11.893 1.00 0.00 O ATOM 380 CB LYS A 27 14.560 -16.296 -11.160 1.00 0.00 C ATOM 381 CG LYS A 27 14.081 -17.602 -10.550 1.00 0.00 C ATOM 382 CD LYS A 27 14.206 -18.755 -11.531 1.00 0.00 C ATOM 383 CE LYS A 27 15.660 -19.145 -11.751 1.00 0.00 C ATOM 384 NZ LYS A 27 15.841 -20.623 -11.764 1.00 0.00 N ATOM 0 H LYS A 27 13.879 -15.313 -13.528 1.00 0.00 H new ATOM 0 HA LYS A 27 12.544 -15.592 -10.903 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.112 -16.513 -12.075 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.258 -15.818 -10.473 1.00 0.00 H new ATOM 0 HG2 LYS A 27 14.662 -17.821 -9.654 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.042 -17.499 -10.238 1.00 0.00 H new ATOM 0 HD2 LYS A 27 13.650 -19.615 -11.156 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.755 -18.475 -12.483 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.009 -18.728 -12.696 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.276 -18.710 -10.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 16.845 -20.848 -11.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 15.532 -21.019 -10.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.273 -21.036 -12.531 1.00 0.00 H new ATOM 398 N SER A 28 13.521 -13.512 -9.864 1.00 0.00 N ATOM 399 CA SER A 28 13.856 -12.181 -9.372 1.00 0.00 C ATOM 400 C SER A 28 15.362 -11.944 -9.431 1.00 0.00 C ATOM 401 O SER A 28 15.816 -10.847 -9.756 1.00 0.00 O ATOM 402 CB SER A 28 13.357 -12.004 -7.937 1.00 0.00 C ATOM 403 OG SER A 28 14.225 -12.638 -7.013 1.00 0.00 O ATOM 0 H SER A 28 13.031 -14.100 -9.189 1.00 0.00 H new ATOM 0 HA SER A 28 13.364 -11.449 -10.013 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.284 -10.942 -7.702 1.00 0.00 H new ATOM 0 HB3 SER A 28 12.354 -12.421 -7.843 1.00 0.00 H new ATOM 0 HG SER A 28 13.885 -12.509 -6.103 1.00 0.00 H new ATOM 409 N SER A 29 16.131 -12.980 -9.115 1.00 0.00 N ATOM 410 CA SER A 29 17.586 -12.885 -9.129 1.00 0.00 C ATOM 411 C SER A 29 18.096 -12.561 -10.530 1.00 0.00 C ATOM 412 O SER A 29 19.158 -11.958 -10.692 1.00 0.00 O ATOM 413 CB SER A 29 18.209 -14.193 -8.637 1.00 0.00 C ATOM 414 OG SER A 29 17.232 -15.033 -8.047 1.00 0.00 O ATOM 0 H SER A 29 15.771 -13.896 -8.846 1.00 0.00 H new ATOM 0 HA SER A 29 17.879 -12.077 -8.459 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.682 -14.711 -9.472 1.00 0.00 H new ATOM 0 HB3 SER A 29 18.993 -13.976 -7.911 1.00 0.00 H new ATOM 0 HG SER A 29 17.655 -15.863 -7.742 1.00 0.00 H new ATOM 420 N ASP A 30 17.333 -12.966 -11.539 1.00 0.00 N ATOM 421 CA ASP A 30 17.706 -12.719 -12.927 1.00 0.00 C ATOM 422 C ASP A 30 17.398 -11.278 -13.324 1.00 0.00 C ATOM 423 O ASP A 30 18.236 -10.592 -13.911 1.00 0.00 O ATOM 424 CB ASP A 30 16.968 -13.685 -13.855 1.00 0.00 C ATOM 425 CG ASP A 30 17.592 -15.067 -13.865 1.00 0.00 C ATOM 426 OD1 ASP A 30 17.736 -15.661 -12.776 1.00 0.00 O ATOM 427 OD2 ASP A 30 17.935 -15.554 -14.962 1.00 0.00 O ATOM 0 H ASP A 30 16.452 -13.467 -11.422 1.00 0.00 H new ATOM 0 HA ASP A 30 18.779 -12.883 -13.024 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.927 -13.762 -13.542 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.967 -13.282 -14.868 1.00 0.00 H new ATOM 432 N LEU A 31 16.191 -10.826 -13.001 1.00 0.00 N ATOM 433 CA LEU A 31 15.772 -9.467 -13.325 1.00 0.00 C ATOM 434 C LEU A 31 16.741 -8.444 -12.740 1.00 0.00 C ATOM 435 O LEU A 31 17.167 -7.516 -13.427 1.00 0.00 O ATOM 436 CB LEU A 31 14.360 -9.208 -12.797 1.00 0.00 C ATOM 437 CG LEU A 31 13.212 -9.629 -13.715 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.151 -8.728 -14.940 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.366 -11.085 -14.129 1.00 0.00 C ATOM 0 H LEU A 31 15.486 -11.380 -12.515 1.00 0.00 H new ATOM 0 HA LEU A 31 15.773 -9.362 -14.410 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.248 -9.729 -11.846 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.261 -8.142 -12.590 1.00 0.00 H new ATOM 0 HG LEU A 31 12.276 -9.526 -13.166 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.328 -9.042 -15.582 1.00 0.00 H new ATOM 0 HD12 LEU A 31 12.992 -7.697 -14.625 1.00 0.00 H new ATOM 0 HD13 LEU A 31 14.089 -8.799 -15.491 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.540 -11.367 -14.782 1.00 0.00 H new ATOM 0 HD22 LEU A 31 14.309 -11.214 -14.660 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.359 -11.718 -13.242 1.00 0.00 H new ATOM 451 N GLU A 32 17.086 -8.622 -11.469 1.00 0.00 N ATOM 452 CA GLU A 32 18.006 -7.715 -10.793 1.00 0.00 C ATOM 453 C GLU A 32 19.357 -7.683 -11.502 1.00 0.00 C ATOM 454 O GLU A 32 20.081 -6.690 -11.433 1.00 0.00 O ATOM 455 CB GLU A 32 18.193 -8.136 -9.334 1.00 0.00 C ATOM 456 CG GLU A 32 18.880 -9.482 -9.173 1.00 0.00 C ATOM 457 CD GLU A 32 19.377 -9.718 -7.760 1.00 0.00 C ATOM 458 OE1 GLU A 32 18.829 -9.096 -6.826 1.00 0.00 O ATOM 459 OE2 GLU A 32 20.314 -10.525 -7.588 1.00 0.00 O ATOM 0 H GLU A 32 16.742 -9.386 -10.887 1.00 0.00 H new ATOM 0 HA GLU A 32 17.576 -6.714 -10.822 1.00 0.00 H new ATOM 0 HB2 GLU A 32 18.777 -7.375 -8.817 1.00 0.00 H new ATOM 0 HB3 GLU A 32 17.218 -8.174 -8.848 1.00 0.00 H new ATOM 0 HG2 GLU A 32 18.185 -10.276 -9.447 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.720 -9.542 -9.865 1.00 0.00 H new ATOM 466 N GLN A 33 19.688 -8.776 -12.183 1.00 0.00 N ATOM 467 CA GLN A 33 20.952 -8.873 -12.903 1.00 0.00 C ATOM 468 C GLN A 33 20.961 -7.945 -14.113 1.00 0.00 C ATOM 469 O GLN A 33 22.019 -7.491 -14.553 1.00 0.00 O ATOM 470 CB GLN A 33 21.199 -10.315 -13.349 1.00 0.00 C ATOM 471 CG GLN A 33 22.639 -10.769 -13.172 1.00 0.00 C ATOM 472 CD GLN A 33 22.802 -11.762 -12.038 1.00 0.00 C ATOM 473 OE1 GLN A 33 23.594 -11.549 -11.120 1.00 0.00 O ATOM 474 NE2 GLN A 33 22.052 -12.856 -12.097 1.00 0.00 N ATOM 0 H GLN A 33 19.099 -9.606 -12.251 1.00 0.00 H new ATOM 0 HA GLN A 33 21.751 -8.567 -12.228 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.545 -10.979 -12.783 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.922 -10.414 -14.399 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.990 -11.221 -14.099 1.00 0.00 H new ATOM 0 HG3 GLN A 33 23.269 -9.900 -12.983 1.00 0.00 H new ATOM 0 HE21 GLN A 33 21.409 -12.992 -12.877 1.00 0.00 H new ATOM 0 HE22 GLN A 33 22.119 -13.561 -11.363 1.00 0.00 H new ATOM 483 N LEU A 34 19.778 -7.667 -14.649 1.00 0.00 N ATOM 484 CA LEU A 34 19.649 -6.793 -15.809 1.00 0.00 C ATOM 485 C LEU A 34 19.863 -5.334 -15.418 1.00 0.00 C ATOM 486 O LEU A 34 20.200 -5.030 -14.274 1.00 0.00 O ATOM 487 CB LEU A 34 18.272 -6.964 -16.452 1.00 0.00 C ATOM 488 CG LEU A 34 17.922 -8.376 -16.923 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.417 -8.530 -17.076 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.628 -8.691 -18.233 1.00 0.00 C ATOM 0 H LEU A 34 18.894 -8.035 -14.298 1.00 0.00 H new ATOM 0 HA LEU A 34 20.417 -7.073 -16.530 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.516 -6.644 -15.735 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.206 -6.291 -17.307 1.00 0.00 H new ATOM 0 HG LEU A 34 18.264 -9.085 -16.169 1.00 0.00 H new ATOM 0 HD11 LEU A 34 16.187 -9.541 -17.412 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.933 -8.347 -16.116 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.050 -7.812 -17.810 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.367 -9.700 -18.553 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.317 -7.977 -18.995 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.707 -8.623 -18.091 1.00 0.00 H new ATOM 502 N ARG A 35 19.662 -4.434 -16.376 1.00 0.00 N ATOM 503 CA ARG A 35 19.831 -3.007 -16.132 1.00 0.00 C ATOM 504 C ARG A 35 18.666 -2.453 -15.317 1.00 0.00 C ATOM 505 O ARG A 35 17.506 -2.576 -15.709 1.00 0.00 O ATOM 506 CB ARG A 35 19.946 -2.251 -17.457 1.00 0.00 C ATOM 507 CG ARG A 35 20.743 -0.961 -17.355 1.00 0.00 C ATOM 508 CD ARG A 35 21.527 -0.688 -18.629 1.00 0.00 C ATOM 509 NE ARG A 35 22.654 0.211 -18.397 1.00 0.00 N ATOM 510 CZ ARG A 35 23.436 0.674 -19.366 1.00 0.00 C ATOM 511 NH1 ARG A 35 23.214 0.325 -20.625 1.00 0.00 N ATOM 512 NH2 ARG A 35 24.442 1.489 -19.075 1.00 0.00 N ATOM 0 H ARG A 35 19.382 -4.669 -17.328 1.00 0.00 H new ATOM 0 HA ARG A 35 20.749 -2.868 -15.562 1.00 0.00 H new ATOM 0 HB2 ARG A 35 20.415 -2.900 -18.196 1.00 0.00 H new ATOM 0 HB3 ARG A 35 18.945 -2.022 -17.823 1.00 0.00 H new ATOM 0 HG2 ARG A 35 20.067 -0.129 -17.157 1.00 0.00 H new ATOM 0 HG3 ARG A 35 21.429 -1.022 -16.510 1.00 0.00 H new ATOM 0 HD2 ARG A 35 21.893 -1.630 -19.038 1.00 0.00 H new ATOM 0 HD3 ARG A 35 20.864 -0.252 -19.376 1.00 0.00 H new ATOM 0 HE ARG A 35 22.852 0.499 -17.439 1.00 0.00 H new ATOM 0 HH11 ARG A 35 22.441 -0.301 -20.852 1.00 0.00 H new ATOM 0 HH12 ARG A 35 23.816 0.682 -21.367 1.00 0.00 H new ATOM 0 HH21 ARG A 35 24.615 1.760 -18.107 1.00 0.00 H new ATOM 0 HH22 ARG A 35 25.042 1.844 -19.819 1.00 0.00 H new ATOM 526 N LYS A 36 18.984 -1.843 -14.180 1.00 0.00 N ATOM 527 CA LYS A 36 17.965 -1.269 -13.309 1.00 0.00 C ATOM 528 C LYS A 36 17.610 0.148 -13.747 1.00 0.00 C ATOM 529 O LYS A 36 18.336 1.099 -13.452 1.00 0.00 O ATOM 530 CB LYS A 36 18.452 -1.259 -11.858 1.00 0.00 C ATOM 531 CG LYS A 36 18.164 -2.550 -11.111 1.00 0.00 C ATOM 532 CD LYS A 36 18.871 -3.733 -11.750 1.00 0.00 C ATOM 533 CE LYS A 36 20.383 -3.567 -11.711 1.00 0.00 C ATOM 534 NZ LYS A 36 20.885 -3.384 -10.321 1.00 0.00 N ATOM 0 H LYS A 36 19.939 -1.733 -13.840 1.00 0.00 H new ATOM 0 HA LYS A 36 17.070 -1.887 -13.381 1.00 0.00 H new ATOM 0 HB2 LYS A 36 19.526 -1.074 -11.845 1.00 0.00 H new ATOM 0 HB3 LYS A 36 17.979 -0.431 -11.331 1.00 0.00 H new ATOM 0 HG2 LYS A 36 18.484 -2.451 -10.074 1.00 0.00 H new ATOM 0 HG3 LYS A 36 17.089 -2.731 -11.097 1.00 0.00 H new ATOM 0 HD2 LYS A 36 18.591 -4.649 -11.230 1.00 0.00 H new ATOM 0 HD3 LYS A 36 18.542 -3.840 -12.784 1.00 0.00 H new ATOM 0 HE2 LYS A 36 20.856 -4.443 -12.156 1.00 0.00 H new ATOM 0 HE3 LYS A 36 20.670 -2.707 -12.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 21.763 -3.928 -10.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 21.075 -2.376 -10.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 20.169 -3.721 -9.646 1.00 0.00 H new ATOM 548 N ILE A 37 16.490 0.283 -14.449 1.00 0.00 N ATOM 549 CA ILE A 37 16.039 1.585 -14.925 1.00 0.00 C ATOM 550 C ILE A 37 15.110 2.247 -13.914 1.00 0.00 C ATOM 551 O ILE A 37 14.032 1.732 -13.615 1.00 0.00 O ATOM 552 CB ILE A 37 15.310 1.469 -16.277 1.00 0.00 C ATOM 553 CG1 ILE A 37 16.226 0.826 -17.321 1.00 0.00 C ATOM 554 CG2 ILE A 37 14.842 2.838 -16.745 1.00 0.00 C ATOM 555 CD1 ILE A 37 16.005 -0.661 -17.485 1.00 0.00 C ATOM 0 H ILE A 37 15.878 -0.493 -14.701 1.00 0.00 H new ATOM 0 HA ILE A 37 16.930 2.200 -15.054 1.00 0.00 H new ATOM 0 HB ILE A 37 14.435 0.832 -16.148 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.069 1.317 -18.282 1.00 0.00 H new ATOM 0 HG13 ILE A 37 17.264 1.002 -17.039 1.00 0.00 H new ATOM 0 HG21 ILE A 37 14.329 2.740 -17.702 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.159 3.260 -16.008 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.703 3.497 -16.861 1.00 0.00 H new ATOM 0 HD11 ILE A 37 16.688 -1.049 -18.240 1.00 0.00 H new ATOM 0 HD12 ILE A 37 16.190 -1.163 -16.536 1.00 0.00 H new ATOM 0 HD13 ILE A 37 14.977 -0.844 -17.797 1.00 0.00 H new ATOM 567 N ARG A 38 15.533 3.393 -13.391 1.00 0.00 N ATOM 568 CA ARG A 38 14.739 4.127 -12.414 1.00 0.00 C ATOM 569 C ARG A 38 14.295 5.475 -12.976 1.00 0.00 C ATOM 570 O ARG A 38 15.108 6.382 -13.155 1.00 0.00 O ATOM 571 CB ARG A 38 15.540 4.338 -11.128 1.00 0.00 C ATOM 572 CG ARG A 38 15.571 3.117 -10.224 1.00 0.00 C ATOM 573 CD ARG A 38 16.212 3.434 -8.881 1.00 0.00 C ATOM 574 NE ARG A 38 17.557 3.983 -9.033 1.00 0.00 N ATOM 575 CZ ARG A 38 18.614 3.254 -9.372 1.00 0.00 C ATOM 576 NH1 ARG A 38 18.484 1.953 -9.594 1.00 0.00 N ATOM 577 NH2 ARG A 38 19.806 3.826 -9.490 1.00 0.00 N ATOM 0 H ARG A 38 16.422 3.833 -13.628 1.00 0.00 H new ATOM 0 HA ARG A 38 13.851 3.536 -12.188 1.00 0.00 H new ATOM 0 HB2 ARG A 38 16.562 4.614 -11.388 1.00 0.00 H new ATOM 0 HB3 ARG A 38 15.114 5.177 -10.578 1.00 0.00 H new ATOM 0 HG2 ARG A 38 14.556 2.753 -10.067 1.00 0.00 H new ATOM 0 HG3 ARG A 38 16.125 2.315 -10.712 1.00 0.00 H new ATOM 0 HD2 ARG A 38 15.588 4.146 -8.341 1.00 0.00 H new ATOM 0 HD3 ARG A 38 16.256 2.527 -8.277 1.00 0.00 H new ATOM 0 HE ARG A 38 17.692 4.981 -8.870 1.00 0.00 H new ATOM 0 HH11 ARG A 38 17.570 1.509 -9.505 1.00 0.00 H new ATOM 0 HH12 ARG A 38 19.298 1.396 -9.854 1.00 0.00 H new ATOM 0 HH21 ARG A 38 19.911 4.826 -9.320 1.00 0.00 H new ATOM 0 HH22 ARG A 38 20.617 3.265 -9.750 1.00 0.00 H new ATOM 591 N ARG A 39 13.001 5.598 -13.252 1.00 0.00 N ATOM 592 CA ARG A 39 12.450 6.834 -13.796 1.00 0.00 C ATOM 593 C ARG A 39 11.717 7.623 -12.715 1.00 0.00 C ATOM 594 O ARG A 39 11.808 8.850 -12.659 1.00 0.00 O ATOM 595 CB ARG A 39 11.497 6.527 -14.953 1.00 0.00 C ATOM 596 CG ARG A 39 12.191 5.954 -16.177 1.00 0.00 C ATOM 597 CD ARG A 39 11.188 5.415 -17.185 1.00 0.00 C ATOM 598 NE ARG A 39 10.377 6.478 -17.772 1.00 0.00 N ATOM 599 CZ ARG A 39 10.806 7.280 -18.740 1.00 0.00 C ATOM 600 NH1 ARG A 39 12.032 7.141 -19.227 1.00 0.00 N ATOM 601 NH2 ARG A 39 10.009 8.225 -19.223 1.00 0.00 N ATOM 0 H ARG A 39 12.315 4.857 -13.108 1.00 0.00 H new ATOM 0 HA ARG A 39 13.277 7.439 -14.167 1.00 0.00 H new ATOM 0 HB2 ARG A 39 10.740 5.821 -14.611 1.00 0.00 H new ATOM 0 HB3 ARG A 39 10.976 7.442 -15.236 1.00 0.00 H new ATOM 0 HG2 ARG A 39 12.800 6.726 -16.646 1.00 0.00 H new ATOM 0 HG3 ARG A 39 12.867 5.155 -15.873 1.00 0.00 H new ATOM 0 HD2 ARG A 39 11.718 4.885 -17.976 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.537 4.690 -16.696 1.00 0.00 H new ATOM 0 HE ARG A 39 9.429 6.612 -17.419 1.00 0.00 H new ATOM 0 HH11 ARG A 39 12.648 6.417 -18.858 1.00 0.00 H new ATOM 0 HH12 ARG A 39 12.359 7.758 -19.970 1.00 0.00 H new ATOM 0 HH21 ARG A 39 9.066 8.336 -18.851 1.00 0.00 H new ATOM 0 HH22 ARG A 39 10.340 8.840 -19.966 1.00 0.00 H new ATOM 615 N ARG A 40 10.990 6.912 -11.860 1.00 0.00 N ATOM 616 CA ARG A 40 10.240 7.546 -10.782 1.00 0.00 C ATOM 617 C ARG A 40 11.101 7.686 -9.530 1.00 0.00 C ATOM 618 O ARG A 40 11.353 6.709 -8.825 1.00 0.00 O ATOM 619 CB ARG A 40 8.983 6.735 -10.461 1.00 0.00 C ATOM 620 CG ARG A 40 7.991 6.669 -11.611 1.00 0.00 C ATOM 621 CD ARG A 40 6.559 6.811 -11.120 1.00 0.00 C ATOM 622 NE ARG A 40 6.109 8.201 -11.140 1.00 0.00 N ATOM 623 CZ ARG A 40 4.962 8.609 -10.609 1.00 0.00 C ATOM 624 NH1 ARG A 40 4.154 7.739 -10.018 1.00 0.00 N ATOM 625 NH2 ARG A 40 4.621 9.890 -10.667 1.00 0.00 N ATOM 0 H ARG A 40 10.904 5.896 -11.893 1.00 0.00 H new ATOM 0 HA ARG A 40 9.947 8.542 -11.114 1.00 0.00 H new ATOM 0 HB2 ARG A 40 9.275 5.722 -10.186 1.00 0.00 H new ATOM 0 HB3 ARG A 40 8.491 7.172 -9.592 1.00 0.00 H new ATOM 0 HG2 ARG A 40 8.211 7.460 -12.328 1.00 0.00 H new ATOM 0 HG3 ARG A 40 8.104 5.721 -12.137 1.00 0.00 H new ATOM 0 HD2 ARG A 40 5.900 6.208 -11.744 1.00 0.00 H new ATOM 0 HD3 ARG A 40 6.483 6.420 -10.105 1.00 0.00 H new ATOM 0 HE ARG A 40 6.708 8.896 -11.586 1.00 0.00 H new ATOM 0 HH11 ARG A 40 4.413 6.754 -9.970 1.00 0.00 H new ATOM 0 HH12 ARG A 40 3.274 8.055 -9.611 1.00 0.00 H new ATOM 0 HH21 ARG A 40 5.240 10.563 -11.120 1.00 0.00 H new ATOM 0 HH22 ARG A 40 3.740 10.202 -10.259 1.00 0.00 H new ATOM 639 N SER A 41 11.550 8.908 -9.261 1.00 0.00 N ATOM 640 CA SER A 41 12.387 9.175 -8.097 1.00 0.00 C ATOM 641 C SER A 41 13.606 8.259 -8.082 1.00 0.00 C ATOM 642 O SER A 41 13.735 7.368 -7.242 1.00 0.00 O ATOM 643 CB SER A 41 11.580 8.991 -6.810 1.00 0.00 C ATOM 644 OG SER A 41 10.968 10.206 -6.413 1.00 0.00 O ATOM 0 H SER A 41 11.348 9.728 -9.833 1.00 0.00 H new ATOM 0 HA SER A 41 12.732 10.207 -8.157 1.00 0.00 H new ATOM 0 HB2 SER A 41 10.816 8.228 -6.962 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.234 8.633 -6.015 1.00 0.00 H new ATOM 0 HG SER A 41 10.457 10.061 -5.589 1.00 0.00 H new ATOM 650 N PRO A 42 14.524 8.482 -9.034 1.00 0.00 N ATOM 651 CA PRO A 42 15.751 7.687 -9.153 1.00 0.00 C ATOM 652 C PRO A 42 16.727 7.954 -8.012 1.00 0.00 C ATOM 653 O PRO A 42 17.604 8.812 -8.120 1.00 0.00 O ATOM 654 CB PRO A 42 16.346 8.150 -10.485 1.00 0.00 C ATOM 655 CG PRO A 42 15.809 9.526 -10.682 1.00 0.00 C ATOM 656 CD PRO A 42 14.436 9.526 -10.068 1.00 0.00 C ATOM 0 HA PRO A 42 15.549 6.617 -9.110 1.00 0.00 H new ATOM 0 HB2 PRO A 42 17.436 8.151 -10.453 1.00 0.00 H new ATOM 0 HB3 PRO A 42 16.052 7.490 -11.301 1.00 0.00 H new ATOM 0 HG2 PRO A 42 16.450 10.267 -10.205 1.00 0.00 H new ATOM 0 HG3 PRO A 42 15.763 9.779 -11.741 1.00 0.00 H new ATOM 0 HD2 PRO A 42 14.188 10.497 -9.639 1.00 0.00 H new ATOM 0 HD3 PRO A 42 13.666 9.297 -10.805 1.00 0.00 H new ATOM 664 N HIS A 43 16.569 7.215 -6.919 1.00 0.00 N ATOM 665 CA HIS A 43 17.438 7.372 -5.757 1.00 0.00 C ATOM 666 C HIS A 43 17.242 6.222 -4.773 1.00 0.00 C ATOM 667 O HIS A 43 18.189 5.511 -4.441 1.00 0.00 O ATOM 668 CB HIS A 43 17.161 8.706 -5.063 1.00 0.00 C ATOM 669 CG HIS A 43 18.280 9.692 -5.193 1.00 0.00 C ATOM 670 ND1 HIS A 43 19.589 9.392 -4.879 1.00 0.00 N ATOM 671 CD2 HIS A 43 18.281 10.981 -5.608 1.00 0.00 C ATOM 672 CE1 HIS A 43 20.346 10.453 -5.093 1.00 0.00 C ATOM 673 NE2 HIS A 43 19.576 11.431 -5.537 1.00 0.00 N ATOM 0 H HIS A 43 15.848 6.502 -6.813 1.00 0.00 H new ATOM 0 HA HIS A 43 18.472 7.359 -6.102 1.00 0.00 H new ATOM 0 HB2 HIS A 43 16.253 9.142 -5.481 1.00 0.00 H new ATOM 0 HB3 HIS A 43 16.970 8.523 -4.006 1.00 0.00 H new ATOM 0 HD2 HIS A 43 17.423 11.549 -5.934 1.00 0.00 H new ATOM 0 HE1 HIS A 43 21.412 10.511 -4.933 1.00 0.00 H new ATOM 0 HE2 HIS A 43 19.893 12.368 -5.786 1.00 0.00 H new ATOM 681 N GLU A 44 16.007 6.049 -4.311 1.00 0.00 N ATOM 682 CA GLU A 44 15.689 4.987 -3.364 1.00 0.00 C ATOM 683 C GLU A 44 15.845 3.614 -4.013 1.00 0.00 C ATOM 684 O GLU A 44 16.001 3.505 -5.229 1.00 0.00 O ATOM 685 CB GLU A 44 14.263 5.154 -2.836 1.00 0.00 C ATOM 686 CG GLU A 44 14.070 6.403 -1.992 1.00 0.00 C ATOM 687 CD GLU A 44 13.474 6.100 -0.630 1.00 0.00 C ATOM 688 OE1 GLU A 44 13.872 5.086 -0.020 1.00 0.00 O ATOM 689 OE2 GLU A 44 12.610 6.879 -0.175 1.00 0.00 O ATOM 0 H GLU A 44 15.212 6.630 -4.577 1.00 0.00 H new ATOM 0 HA GLU A 44 16.388 5.058 -2.531 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.573 5.185 -3.680 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.000 4.279 -2.241 1.00 0.00 H new ATOM 0 HG2 GLU A 44 15.031 6.901 -1.862 1.00 0.00 H new ATOM 0 HG3 GLU A 44 13.420 7.099 -2.522 1.00 0.00 H new ATOM 696 N ASP A 45 15.803 2.571 -3.192 1.00 0.00 N ATOM 697 CA ASP A 45 15.938 1.205 -3.685 1.00 0.00 C ATOM 698 C ASP A 45 15.727 0.197 -2.559 1.00 0.00 C ATOM 699 O ASP A 45 16.457 -0.788 -2.447 1.00 0.00 O ATOM 700 CB ASP A 45 17.317 1.002 -4.316 1.00 0.00 C ATOM 701 CG ASP A 45 18.438 1.519 -3.436 1.00 0.00 C ATOM 702 OD1 ASP A 45 18.459 1.172 -2.236 1.00 0.00 O ATOM 703 OD2 ASP A 45 19.294 2.272 -3.946 1.00 0.00 O ATOM 0 H ASP A 45 15.677 2.645 -2.183 1.00 0.00 H new ATOM 0 HA ASP A 45 15.172 1.041 -4.443 1.00 0.00 H new ATOM 0 HB2 ASP A 45 17.472 -0.059 -4.510 1.00 0.00 H new ATOM 0 HB3 ASP A 45 17.351 1.511 -5.279 1.00 0.00 H new ATOM 708 N THR A 46 14.723 0.451 -1.725 1.00 0.00 N ATOM 709 CA THR A 46 14.417 -0.431 -0.607 1.00 0.00 C ATOM 710 C THR A 46 13.034 -1.052 -0.759 1.00 0.00 C ATOM 711 O THR A 46 12.789 -2.166 -0.295 1.00 0.00 O ATOM 712 CB THR A 46 14.485 0.320 0.737 1.00 0.00 C ATOM 713 OG1 THR A 46 14.037 -0.531 1.797 1.00 0.00 O ATOM 714 CG2 THR A 46 13.632 1.579 0.696 1.00 0.00 C ATOM 0 H THR A 46 14.108 1.261 -1.804 1.00 0.00 H new ATOM 0 HA THR A 46 15.169 -1.220 -0.612 1.00 0.00 H new ATOM 0 HB THR A 46 15.521 0.607 0.916 1.00 0.00 H new ATOM 0 HG1 THR A 46 14.085 -0.047 2.648 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.695 2.093 1.655 1.00 0.00 H new ATOM 0 HG22 THR A 46 13.994 2.238 -0.093 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.595 1.309 0.497 1.00 0.00 H new ATOM 722 N GLU A 47 12.132 -0.326 -1.413 1.00 0.00 N ATOM 723 CA GLU A 47 10.773 -0.808 -1.626 1.00 0.00 C ATOM 724 C GLU A 47 10.134 -0.119 -2.829 1.00 0.00 C ATOM 725 O GLU A 47 8.956 0.239 -2.799 1.00 0.00 O ATOM 726 CB GLU A 47 9.922 -0.569 -0.377 1.00 0.00 C ATOM 727 CG GLU A 47 8.854 -1.628 -0.157 1.00 0.00 C ATOM 728 CD GLU A 47 7.845 -1.227 0.902 1.00 0.00 C ATOM 729 OE1 GLU A 47 7.899 -0.067 1.363 1.00 0.00 O ATOM 730 OE2 GLU A 47 7.002 -2.072 1.269 1.00 0.00 O ATOM 0 H GLU A 47 12.318 0.597 -1.804 1.00 0.00 H new ATOM 0 HA GLU A 47 10.821 -1.879 -1.825 1.00 0.00 H new ATOM 0 HB2 GLU A 47 10.574 -0.536 0.496 1.00 0.00 H new ATOM 0 HB3 GLU A 47 9.443 0.407 -0.455 1.00 0.00 H new ATOM 0 HG2 GLU A 47 8.334 -1.815 -1.097 1.00 0.00 H new ATOM 0 HG3 GLU A 47 9.330 -2.564 0.136 1.00 0.00 H new ATOM 737 N SER A 48 10.919 0.063 -3.885 1.00 0.00 N ATOM 738 CA SER A 48 10.433 0.712 -5.097 1.00 0.00 C ATOM 739 C SER A 48 10.534 -0.227 -6.295 1.00 0.00 C ATOM 740 O SER A 48 11.426 -1.073 -6.361 1.00 0.00 O ATOM 741 CB SER A 48 11.227 1.992 -5.369 1.00 0.00 C ATOM 742 OG SER A 48 11.460 2.712 -4.171 1.00 0.00 O ATOM 0 H SER A 48 11.895 -0.230 -3.926 1.00 0.00 H new ATOM 0 HA SER A 48 9.384 0.968 -4.946 1.00 0.00 H new ATOM 0 HB2 SER A 48 12.179 1.741 -5.837 1.00 0.00 H new ATOM 0 HB3 SER A 48 10.681 2.619 -6.074 1.00 0.00 H new ATOM 0 HG SER A 48 11.970 3.524 -4.371 1.00 0.00 H new ATOM 748 N PHE A 49 9.613 -0.071 -7.240 1.00 0.00 N ATOM 749 CA PHE A 49 9.596 -0.906 -8.436 1.00 0.00 C ATOM 750 C PHE A 49 10.660 -0.451 -9.431 1.00 0.00 C ATOM 751 O PHE A 49 10.917 0.744 -9.581 1.00 0.00 O ATOM 752 CB PHE A 49 8.216 -0.863 -9.094 1.00 0.00 C ATOM 753 CG PHE A 49 7.849 0.490 -9.631 1.00 0.00 C ATOM 754 CD1 PHE A 49 8.210 0.861 -10.917 1.00 0.00 C ATOM 755 CD2 PHE A 49 7.143 1.392 -8.851 1.00 0.00 C ATOM 756 CE1 PHE A 49 7.874 2.106 -11.413 1.00 0.00 C ATOM 757 CE2 PHE A 49 6.804 2.638 -9.343 1.00 0.00 C ATOM 758 CZ PHE A 49 7.169 2.996 -10.626 1.00 0.00 C ATOM 0 H PHE A 49 8.869 0.626 -7.201 1.00 0.00 H new ATOM 0 HA PHE A 49 9.817 -1.931 -8.137 1.00 0.00 H new ATOM 0 HB2 PHE A 49 8.188 -1.588 -9.908 1.00 0.00 H new ATOM 0 HB3 PHE A 49 7.466 -1.172 -8.366 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.760 0.169 -11.538 1.00 0.00 H new ATOM 0 HD2 PHE A 49 6.854 1.118 -7.847 1.00 0.00 H new ATOM 0 HE1 PHE A 49 8.163 2.383 -12.416 1.00 0.00 H new ATOM 0 HE2 PHE A 49 6.254 3.332 -8.724 1.00 0.00 H new ATOM 0 HZ PHE A 49 6.904 3.969 -11.013 1.00 0.00 H new ATOM 768 N THR A 50 11.278 -1.414 -10.108 1.00 0.00 N ATOM 769 CA THR A 50 12.315 -1.114 -11.088 1.00 0.00 C ATOM 770 C THR A 50 11.947 -1.660 -12.463 1.00 0.00 C ATOM 771 O THR A 50 12.052 -2.860 -12.714 1.00 0.00 O ATOM 772 CB THR A 50 13.675 -1.700 -10.662 1.00 0.00 C ATOM 773 OG1 THR A 50 13.863 -1.530 -9.253 1.00 0.00 O ATOM 774 CG2 THR A 50 14.813 -1.028 -11.416 1.00 0.00 C ATOM 0 H THR A 50 11.078 -2.408 -9.996 1.00 0.00 H new ATOM 0 HA THR A 50 12.396 -0.028 -11.142 1.00 0.00 H new ATOM 0 HB THR A 50 13.679 -2.763 -10.902 1.00 0.00 H new ATOM 0 HG1 THR A 50 14.729 -1.907 -8.991 1.00 0.00 H new ATOM 0 HG21 THR A 50 15.763 -1.458 -11.099 1.00 0.00 H new ATOM 0 HG22 THR A 50 14.683 -1.185 -12.487 1.00 0.00 H new ATOM 0 HG23 THR A 50 14.809 0.041 -11.203 1.00 0.00 H new ATOM 782 N VAL A 51 11.517 -0.770 -13.351 1.00 0.00 N ATOM 783 CA VAL A 51 11.135 -1.162 -14.703 1.00 0.00 C ATOM 784 C VAL A 51 12.343 -1.645 -15.497 1.00 0.00 C ATOM 785 O VAL A 51 13.468 -1.200 -15.268 1.00 0.00 O ATOM 786 CB VAL A 51 10.470 0.004 -15.459 1.00 0.00 C ATOM 787 CG1 VAL A 51 9.163 0.399 -14.788 1.00 0.00 C ATOM 788 CG2 VAL A 51 11.416 1.192 -15.543 1.00 0.00 C ATOM 0 H VAL A 51 11.424 0.227 -13.159 1.00 0.00 H new ATOM 0 HA VAL A 51 10.418 -1.977 -14.605 1.00 0.00 H new ATOM 0 HB VAL A 51 10.245 -0.325 -16.474 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.708 1.224 -15.336 1.00 0.00 H new ATOM 0 HG12 VAL A 51 8.484 -0.453 -14.785 1.00 0.00 H new ATOM 0 HG13 VAL A 51 9.360 0.710 -13.762 1.00 0.00 H new ATOM 0 HG21 VAL A 51 10.930 2.007 -16.080 1.00 0.00 H new ATOM 0 HG22 VAL A 51 11.674 1.523 -14.537 1.00 0.00 H new ATOM 0 HG23 VAL A 51 12.323 0.898 -16.072 1.00 0.00 H new ATOM 798 N TYR A 52 12.103 -2.558 -16.431 1.00 0.00 N ATOM 799 CA TYR A 52 13.172 -3.104 -17.259 1.00 0.00 C ATOM 800 C TYR A 52 12.862 -2.919 -18.741 1.00 0.00 C ATOM 801 O TYR A 52 11.776 -2.470 -19.109 1.00 0.00 O ATOM 802 CB TYR A 52 13.378 -4.588 -16.951 1.00 0.00 C ATOM 803 CG TYR A 52 13.670 -4.869 -15.494 1.00 0.00 C ATOM 804 CD1 TYR A 52 14.860 -4.451 -14.911 1.00 0.00 C ATOM 805 CD2 TYR A 52 12.758 -5.554 -14.701 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.133 -4.706 -13.581 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.021 -5.812 -13.370 1.00 0.00 C ATOM 808 CZ TYR A 52 14.210 -5.386 -12.814 1.00 0.00 C ATOM 809 OH TYR A 52 14.477 -5.643 -11.489 1.00 0.00 O ATOM 0 H TYR A 52 11.178 -2.936 -16.634 1.00 0.00 H new ATOM 0 HA TYR A 52 14.089 -2.561 -17.028 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.485 -5.139 -17.247 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.201 -4.965 -17.557 1.00 0.00 H new ATOM 0 HD1 TYR A 52 15.584 -3.917 -15.508 1.00 0.00 H new ATOM 0 HD2 TYR A 52 11.827 -5.891 -15.133 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.064 -4.375 -13.144 1.00 0.00 H new ATOM 0 HE2 TYR A 52 12.300 -6.344 -12.767 1.00 0.00 H new ATOM 0 HH TYR A 52 13.724 -6.129 -11.092 1.00 0.00 H new ATOM 819 N LEU A 53 13.823 -3.270 -19.588 1.00 0.00 N ATOM 820 CA LEU A 53 13.655 -3.144 -21.032 1.00 0.00 C ATOM 821 C LEU A 53 13.042 -4.411 -21.621 1.00 0.00 C ATOM 822 O LEU A 53 13.512 -5.518 -21.360 1.00 0.00 O ATOM 823 CB LEU A 53 15.001 -2.856 -21.699 1.00 0.00 C ATOM 824 CG LEU A 53 15.102 -1.537 -22.466 1.00 0.00 C ATOM 825 CD1 LEU A 53 14.139 -1.529 -23.643 1.00 0.00 C ATOM 826 CD2 LEU A 53 14.826 -0.360 -21.541 1.00 0.00 C ATOM 0 H LEU A 53 14.727 -3.644 -19.300 1.00 0.00 H new ATOM 0 HA LEU A 53 12.977 -2.312 -21.223 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.774 -2.866 -20.931 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.225 -3.671 -22.387 1.00 0.00 H new ATOM 0 HG LEU A 53 16.117 -1.440 -22.852 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.225 -0.583 -24.177 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.382 -2.350 -24.318 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.119 -1.649 -23.279 1.00 0.00 H new ATOM 0 HD21 LEU A 53 14.902 0.571 -22.104 1.00 0.00 H new ATOM 0 HD22 LEU A 53 13.823 -0.452 -21.125 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.555 -0.355 -20.731 1.00 0.00 H new ATOM 838 N ARG A 54 11.992 -4.239 -22.417 1.00 0.00 N ATOM 839 CA ARG A 54 11.316 -5.368 -23.044 1.00 0.00 C ATOM 840 C ARG A 54 12.283 -6.166 -23.914 1.00 0.00 C ATOM 841 O ARG A 54 12.118 -7.372 -24.099 1.00 0.00 O ATOM 842 CB ARG A 54 10.138 -4.880 -23.889 1.00 0.00 C ATOM 843 CG ARG A 54 8.820 -5.554 -23.543 1.00 0.00 C ATOM 844 CD ARG A 54 7.896 -5.621 -24.749 1.00 0.00 C ATOM 845 NE ARG A 54 7.660 -6.995 -25.183 1.00 0.00 N ATOM 846 CZ ARG A 54 6.788 -7.810 -24.600 1.00 0.00 C ATOM 847 NH1 ARG A 54 6.073 -7.391 -23.565 1.00 0.00 N ATOM 848 NH2 ARG A 54 6.630 -9.048 -25.052 1.00 0.00 N ATOM 0 H ARG A 54 11.591 -3.329 -22.643 1.00 0.00 H new ATOM 0 HA ARG A 54 10.942 -6.019 -22.254 1.00 0.00 H new ATOM 0 HB2 ARG A 54 10.031 -3.803 -23.760 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.360 -5.054 -24.942 1.00 0.00 H new ATOM 0 HG2 ARG A 54 9.011 -6.561 -23.173 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.330 -5.006 -22.738 1.00 0.00 H new ATOM 0 HD2 ARG A 54 6.944 -5.150 -24.503 1.00 0.00 H new ATOM 0 HD3 ARG A 54 8.330 -5.051 -25.570 1.00 0.00 H new ATOM 0 HE ARG A 54 8.194 -7.348 -25.977 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.192 -6.441 -23.214 1.00 0.00 H new ATOM 0 HH12 ARG A 54 5.404 -8.019 -23.119 1.00 0.00 H new ATOM 0 HH21 ARG A 54 7.178 -9.374 -25.848 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.960 -9.673 -24.604 1.00 0.00 H new ATOM 862 N SER A 55 13.292 -5.484 -24.446 1.00 0.00 N ATOM 863 CA SER A 55 14.284 -6.128 -25.301 1.00 0.00 C ATOM 864 C SER A 55 15.228 -6.998 -24.477 1.00 0.00 C ATOM 865 O SER A 55 15.724 -8.019 -24.953 1.00 0.00 O ATOM 866 CB SER A 55 15.083 -5.076 -26.072 1.00 0.00 C ATOM 867 OG SER A 55 15.519 -5.582 -27.322 1.00 0.00 O ATOM 0 H SER A 55 13.445 -4.486 -24.301 1.00 0.00 H new ATOM 0 HA SER A 55 13.757 -6.766 -26.011 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.467 -4.190 -26.229 1.00 0.00 H new ATOM 0 HB3 SER A 55 15.945 -4.764 -25.482 1.00 0.00 H new ATOM 0 HG SER A 55 16.026 -4.890 -27.796 1.00 0.00 H new ATOM 873 N ASP A 56 15.472 -6.585 -23.238 1.00 0.00 N ATOM 874 CA ASP A 56 16.356 -7.326 -22.345 1.00 0.00 C ATOM 875 C ASP A 56 15.646 -8.547 -21.768 1.00 0.00 C ATOM 876 O ASP A 56 16.174 -9.659 -21.801 1.00 0.00 O ATOM 877 CB ASP A 56 16.846 -6.423 -21.213 1.00 0.00 C ATOM 878 CG ASP A 56 18.001 -5.537 -21.638 1.00 0.00 C ATOM 879 OD1 ASP A 56 17.754 -4.543 -22.353 1.00 0.00 O ATOM 880 OD2 ASP A 56 19.151 -5.837 -21.255 1.00 0.00 O ATOM 0 H ASP A 56 15.070 -5.741 -22.829 1.00 0.00 H new ATOM 0 HA ASP A 56 17.214 -7.667 -22.924 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.022 -5.799 -20.867 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.156 -7.039 -20.369 1.00 0.00 H new ATOM 885 N VAL A 57 14.446 -8.332 -21.238 1.00 0.00 N ATOM 886 CA VAL A 57 13.664 -9.414 -20.653 1.00 0.00 C ATOM 887 C VAL A 57 13.393 -10.511 -21.676 1.00 0.00 C ATOM 888 O VAL A 57 13.300 -11.688 -21.328 1.00 0.00 O ATOM 889 CB VAL A 57 12.322 -8.900 -20.099 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.553 -10.029 -19.428 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.551 -7.751 -19.129 1.00 0.00 C ATOM 0 H VAL A 57 13.994 -7.418 -21.202 1.00 0.00 H new ATOM 0 HA VAL A 57 14.254 -9.824 -19.833 1.00 0.00 H new ATOM 0 HB VAL A 57 11.724 -8.529 -20.931 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.608 -9.647 -19.043 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.356 -10.817 -20.155 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.143 -10.433 -18.605 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.592 -7.400 -18.747 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.169 -8.093 -18.299 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.057 -6.935 -19.645 1.00 0.00 H new ATOM 901 N GLU A 58 13.267 -10.117 -22.939 1.00 0.00 N ATOM 902 CA GLU A 58 13.006 -11.068 -24.013 1.00 0.00 C ATOM 903 C GLU A 58 14.086 -12.145 -24.061 1.00 0.00 C ATOM 904 O GLU A 58 13.803 -13.331 -23.896 1.00 0.00 O ATOM 905 CB GLU A 58 12.933 -10.344 -25.359 1.00 0.00 C ATOM 906 CG GLU A 58 12.319 -11.182 -26.468 1.00 0.00 C ATOM 907 CD GLU A 58 11.820 -10.341 -27.627 1.00 0.00 C ATOM 908 OE1 GLU A 58 12.647 -9.959 -28.481 1.00 0.00 O ATOM 909 OE2 GLU A 58 10.603 -10.065 -27.679 1.00 0.00 O ATOM 0 H GLU A 58 13.341 -9.146 -23.244 1.00 0.00 H new ATOM 0 HA GLU A 58 12.048 -11.547 -23.814 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.350 -9.431 -25.240 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.938 -10.044 -25.656 1.00 0.00 H new ATOM 0 HG2 GLU A 58 13.060 -11.894 -26.833 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.491 -11.763 -26.063 1.00 0.00 H new ATOM 916 N ALA A 59 15.326 -11.722 -24.287 1.00 0.00 N ATOM 917 CA ALA A 59 16.449 -12.648 -24.355 1.00 0.00 C ATOM 918 C ALA A 59 16.608 -13.415 -23.047 1.00 0.00 C ATOM 919 O ALA A 59 16.946 -14.599 -23.046 1.00 0.00 O ATOM 920 CB ALA A 59 17.731 -11.900 -24.691 1.00 0.00 C ATOM 0 H ALA A 59 15.578 -10.743 -24.426 1.00 0.00 H new ATOM 0 HA ALA A 59 16.245 -13.370 -25.146 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.561 -12.604 -24.738 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.621 -11.404 -25.655 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.930 -11.155 -23.920 1.00 0.00 H new ATOM 926 N LYS A 60 16.364 -12.732 -21.933 1.00 0.00 N ATOM 927 CA LYS A 60 16.480 -13.348 -20.617 1.00 0.00 C ATOM 928 C LYS A 60 15.582 -14.576 -20.510 1.00 0.00 C ATOM 929 O LYS A 60 15.857 -15.493 -19.736 1.00 0.00 O ATOM 930 CB LYS A 60 16.116 -12.340 -19.525 1.00 0.00 C ATOM 931 CG LYS A 60 16.185 -12.912 -18.120 1.00 0.00 C ATOM 932 CD LYS A 60 17.574 -13.440 -17.801 1.00 0.00 C ATOM 933 CE LYS A 60 18.613 -12.330 -17.834 1.00 0.00 C ATOM 934 NZ LYS A 60 19.304 -12.255 -19.151 1.00 0.00 N ATOM 0 H LYS A 60 16.085 -11.751 -21.916 1.00 0.00 H new ATOM 0 HA LYS A 60 17.515 -13.663 -20.481 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.788 -11.485 -19.593 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.108 -11.968 -19.707 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.913 -12.141 -17.399 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.456 -13.716 -18.017 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.570 -13.907 -16.816 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.844 -14.214 -18.519 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.131 -11.375 -17.622 1.00 0.00 H new ATOM 0 HE3 LYS A 60 19.348 -12.498 -17.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 20.278 -11.917 -19.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 19.324 -13.199 -19.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 18.794 -11.597 -19.774 1.00 0.00 H new ATOM 948 N SER A 61 14.507 -14.588 -21.292 1.00 0.00 N ATOM 949 CA SER A 61 13.567 -15.702 -21.283 1.00 0.00 C ATOM 950 C SER A 61 14.055 -16.832 -22.185 1.00 0.00 C ATOM 951 O SER A 61 13.718 -17.998 -21.977 1.00 0.00 O ATOM 952 CB SER A 61 12.183 -15.234 -21.738 1.00 0.00 C ATOM 953 OG SER A 61 11.559 -16.207 -22.557 1.00 0.00 O ATOM 0 H SER A 61 14.266 -13.838 -21.940 1.00 0.00 H new ATOM 0 HA SER A 61 13.498 -16.078 -20.262 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.559 -15.033 -20.867 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.275 -14.297 -22.287 1.00 0.00 H new ATOM 0 HG SER A 61 10.849 -15.784 -23.084 1.00 0.00 H new ATOM 959 N LEU A 62 14.851 -16.478 -23.188 1.00 0.00 N ATOM 960 CA LEU A 62 15.387 -17.461 -24.123 1.00 0.00 C ATOM 961 C LEU A 62 16.586 -18.188 -23.522 1.00 0.00 C ATOM 962 O LEU A 62 16.796 -19.373 -23.776 1.00 0.00 O ATOM 963 CB LEU A 62 15.793 -16.780 -25.432 1.00 0.00 C ATOM 964 CG LEU A 62 14.783 -15.792 -26.016 1.00 0.00 C ATOM 965 CD1 LEU A 62 15.266 -15.266 -27.358 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.417 -16.447 -26.158 1.00 0.00 C ATOM 0 H LEU A 62 15.139 -15.518 -23.375 1.00 0.00 H new ATOM 0 HA LEU A 62 14.607 -18.194 -24.328 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.733 -16.253 -25.268 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.986 -17.553 -26.176 1.00 0.00 H new ATOM 0 HG LEU A 62 14.690 -14.949 -25.331 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.534 -14.564 -27.758 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.222 -14.759 -27.227 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.389 -16.098 -28.052 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.711 -15.729 -26.575 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.494 -17.308 -26.822 1.00 0.00 H new ATOM 0 HD23 LEU A 62 13.067 -16.774 -25.179 1.00 0.00 H new ATOM 978 N GLU A 63 17.367 -17.469 -22.722 1.00 0.00 N ATOM 979 CA GLU A 63 18.543 -18.047 -22.083 1.00 0.00 C ATOM 980 C GLU A 63 18.142 -18.969 -20.936 1.00 0.00 C ATOM 981 O GLU A 63 18.881 -19.884 -20.571 1.00 0.00 O ATOM 982 CB GLU A 63 19.465 -16.941 -21.564 1.00 0.00 C ATOM 983 CG GLU A 63 18.945 -16.253 -20.313 1.00 0.00 C ATOM 984 CD GLU A 63 19.646 -16.725 -19.054 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.910 -17.941 -18.943 1.00 0.00 O ATOM 986 OE2 GLU A 63 19.931 -15.880 -18.180 1.00 0.00 O ATOM 0 H GLU A 63 17.207 -16.486 -22.501 1.00 0.00 H new ATOM 0 HA GLU A 63 19.077 -18.635 -22.829 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.446 -17.366 -21.353 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.602 -16.196 -22.348 1.00 0.00 H new ATOM 0 HG2 GLU A 63 19.075 -15.176 -20.415 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.875 -16.437 -20.220 1.00 0.00 H new ATOM 993 N VAL A 64 16.965 -18.721 -20.369 1.00 0.00 N ATOM 994 CA VAL A 64 16.464 -19.529 -19.263 1.00 0.00 C ATOM 995 C VAL A 64 15.652 -20.715 -19.773 1.00 0.00 C ATOM 996 O VAL A 64 16.106 -21.858 -19.720 1.00 0.00 O ATOM 997 CB VAL A 64 15.588 -18.694 -18.310 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.030 -19.565 -17.196 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.384 -17.529 -17.740 1.00 0.00 C ATOM 0 H VAL A 64 16.341 -17.967 -20.657 1.00 0.00 H new ATOM 0 HA VAL A 64 17.334 -19.895 -18.718 1.00 0.00 H new ATOM 0 HB VAL A 64 14.749 -18.289 -18.876 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.414 -18.957 -16.533 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.423 -20.362 -17.626 1.00 0.00 H new ATOM 0 HG13 VAL A 64 15.852 -20.001 -16.629 1.00 0.00 H new ATOM 0 HG21 VAL A 64 15.750 -16.949 -17.069 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.243 -17.911 -17.189 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.729 -16.891 -18.554 1.00 0.00 H new ATOM 1009 N TRP A 65 14.451 -20.435 -20.266 1.00 0.00 N ATOM 1010 CA TRP A 65 13.576 -21.479 -20.786 1.00 0.00 C ATOM 1011 C TRP A 65 14.228 -22.201 -21.960 1.00 0.00 C ATOM 1012 O TRP A 65 13.920 -23.359 -22.237 1.00 0.00 O ATOM 1013 CB TRP A 65 12.236 -20.882 -21.218 1.00 0.00 C ATOM 1014 CG TRP A 65 11.288 -20.661 -20.078 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.117 -19.509 -19.366 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.384 -21.619 -19.519 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.161 -19.693 -18.397 1.00 0.00 N ATOM 1018 CE2 TRP A 65 9.694 -20.979 -18.470 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.087 -22.955 -19.802 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 8.729 -21.630 -17.707 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.129 -23.600 -19.043 1.00 0.00 C ATOM 1022 CH2 TRP A 65 8.459 -22.938 -18.006 1.00 0.00 C ATOM 0 H TRP A 65 14.061 -19.494 -20.317 1.00 0.00 H new ATOM 0 HA TRP A 65 13.403 -22.203 -19.990 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.415 -19.932 -21.721 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.769 -21.545 -21.946 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.654 -18.588 -19.539 1.00 0.00 H new ATOM 0 HE1 TRP A 65 9.849 -18.986 -17.731 1.00 0.00 H new ATOM 0 HE3 TRP A 65 10.597 -23.474 -20.600 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.212 -21.121 -16.907 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 8.893 -24.633 -19.253 1.00 0.00 H new ATOM 0 HH2 TRP A 65 7.715 -23.470 -17.431 1.00 0.00 H new ATOM 1033 N GLY A 66 15.131 -21.508 -22.648 1.00 0.00 N ATOM 1034 CA GLY A 66 15.812 -22.100 -23.785 1.00 0.00 C ATOM 1035 C GLY A 66 15.360 -21.507 -25.104 1.00 0.00 C ATOM 1036 O GLY A 66 16.168 -21.301 -26.009 1.00 0.00 O ATOM 0 H GLY A 66 15.403 -20.548 -22.438 1.00 0.00 H new ATOM 0 HA2 GLY A 66 16.887 -21.957 -23.675 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.632 -23.175 -23.793 1.00 0.00 H new ATOM 1040 N SER A 67 14.064 -21.232 -25.215 1.00 0.00 N ATOM 1041 CA SER A 67 13.505 -20.664 -26.436 1.00 0.00 C ATOM 1042 C SER A 67 12.201 -19.927 -26.145 1.00 0.00 C ATOM 1043 O SER A 67 11.554 -20.139 -25.119 1.00 0.00 O ATOM 1044 CB SER A 67 13.261 -21.765 -27.471 1.00 0.00 C ATOM 1045 OG SER A 67 13.805 -23.000 -27.039 1.00 0.00 O ATOM 0 H SER A 67 13.382 -21.393 -24.474 1.00 0.00 H new ATOM 0 HA SER A 67 14.224 -19.950 -26.837 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.190 -21.876 -27.643 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.709 -21.480 -28.423 1.00 0.00 H new ATOM 0 HG SER A 67 13.635 -23.687 -27.717 1.00 0.00 H new ATOM 1051 N PRO A 68 11.805 -19.039 -27.069 1.00 0.00 N ATOM 1052 CA PRO A 68 10.575 -18.253 -26.935 1.00 0.00 C ATOM 1053 C PRO A 68 9.321 -19.108 -27.078 1.00 0.00 C ATOM 1054 O PRO A 68 8.232 -18.699 -26.679 1.00 0.00 O ATOM 1055 CB PRO A 68 10.671 -17.247 -28.086 1.00 0.00 C ATOM 1056 CG PRO A 68 11.542 -17.909 -29.096 1.00 0.00 C ATOM 1057 CD PRO A 68 12.527 -18.736 -28.316 1.00 0.00 C ATOM 0 HA PRO A 68 10.492 -17.791 -25.951 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.687 -17.022 -28.498 1.00 0.00 H new ATOM 0 HB3 PRO A 68 11.100 -16.302 -27.751 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.954 -18.534 -29.769 1.00 0.00 H new ATOM 0 HG3 PRO A 68 12.054 -17.171 -29.713 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.802 -19.644 -28.852 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.449 -18.187 -28.124 1.00 0.00 H new ATOM 1065 N GLU A 69 9.484 -20.297 -27.650 1.00 0.00 N ATOM 1066 CA GLU A 69 8.363 -21.210 -27.845 1.00 0.00 C ATOM 1067 C GLU A 69 7.945 -21.849 -26.524 1.00 0.00 C ATOM 1068 O GLU A 69 6.766 -22.119 -26.298 1.00 0.00 O ATOM 1069 CB GLU A 69 8.732 -22.297 -28.856 1.00 0.00 C ATOM 1070 CG GLU A 69 8.636 -21.841 -30.303 1.00 0.00 C ATOM 1071 CD GLU A 69 9.864 -22.208 -31.113 1.00 0.00 C ATOM 1072 OE1 GLU A 69 10.066 -23.414 -31.369 1.00 0.00 O ATOM 1073 OE2 GLU A 69 10.623 -21.292 -31.490 1.00 0.00 O ATOM 0 H GLU A 69 10.380 -20.650 -27.986 1.00 0.00 H new ATOM 0 HA GLU A 69 7.522 -20.634 -28.232 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.749 -22.636 -28.657 1.00 0.00 H new ATOM 0 HB3 GLU A 69 8.076 -23.155 -28.710 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.755 -22.288 -30.763 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.497 -20.760 -30.331 1.00 0.00 H new ATOM 1080 N ALA A 70 8.922 -22.089 -25.655 1.00 0.00 N ATOM 1081 CA ALA A 70 8.656 -22.695 -24.356 1.00 0.00 C ATOM 1082 C ALA A 70 7.799 -21.780 -23.488 1.00 0.00 C ATOM 1083 O ALA A 70 6.866 -22.233 -22.823 1.00 0.00 O ATOM 1084 CB ALA A 70 9.963 -23.023 -23.650 1.00 0.00 C ATOM 0 H ALA A 70 9.904 -21.873 -25.827 1.00 0.00 H new ATOM 0 HA ALA A 70 8.102 -23.619 -24.520 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.750 -23.475 -22.681 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.539 -23.721 -24.257 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.538 -22.108 -23.505 1.00 0.00 H new ATOM 1090 N LEU A 71 8.121 -20.491 -23.498 1.00 0.00 N ATOM 1091 CA LEU A 71 7.380 -19.512 -22.711 1.00 0.00 C ATOM 1092 C LEU A 71 6.006 -19.250 -23.320 1.00 0.00 C ATOM 1093 O LEU A 71 5.019 -19.088 -22.603 1.00 0.00 O ATOM 1094 CB LEU A 71 8.166 -18.203 -22.618 1.00 0.00 C ATOM 1095 CG LEU A 71 7.402 -16.999 -22.065 1.00 0.00 C ATOM 1096 CD1 LEU A 71 6.986 -17.246 -20.624 1.00 0.00 C ATOM 1097 CD2 LEU A 71 8.248 -15.738 -22.169 1.00 0.00 C ATOM 0 H LEU A 71 8.890 -20.100 -24.042 1.00 0.00 H new ATOM 0 HA LEU A 71 7.242 -19.918 -21.709 1.00 0.00 H new ATOM 0 HB2 LEU A 71 9.041 -18.372 -21.991 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.531 -17.950 -23.613 1.00 0.00 H new ATOM 0 HG LEU A 71 6.501 -16.859 -22.662 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.444 -16.378 -20.248 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.343 -18.125 -20.577 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.873 -17.412 -20.013 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.689 -14.891 -21.771 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.166 -15.868 -21.597 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.495 -15.551 -23.214 1.00 0.00 H new ATOM 1109 N ALA A 72 5.950 -19.214 -24.647 1.00 0.00 N ATOM 1110 CA ALA A 72 4.696 -18.977 -25.352 1.00 0.00 C ATOM 1111 C ALA A 72 3.636 -19.995 -24.945 1.00 0.00 C ATOM 1112 O ALA A 72 2.438 -19.723 -25.027 1.00 0.00 O ATOM 1113 CB ALA A 72 4.921 -19.019 -26.857 1.00 0.00 C ATOM 0 H ALA A 72 6.758 -19.346 -25.256 1.00 0.00 H new ATOM 0 HA ALA A 72 4.335 -17.986 -25.077 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.977 -18.841 -27.371 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.639 -18.249 -27.139 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.309 -19.998 -27.140 1.00 0.00 H new ATOM 1119 N ARG A 73 4.085 -21.167 -24.508 1.00 0.00 N ATOM 1120 CA ARG A 73 3.175 -22.226 -24.090 1.00 0.00 C ATOM 1121 C ARG A 73 2.323 -21.775 -22.907 1.00 0.00 C ATOM 1122 O ARG A 73 1.175 -22.195 -22.761 1.00 0.00 O ATOM 1123 CB ARG A 73 3.959 -23.484 -23.717 1.00 0.00 C ATOM 1124 CG ARG A 73 4.883 -23.976 -24.819 1.00 0.00 C ATOM 1125 CD ARG A 73 4.504 -25.374 -25.282 1.00 0.00 C ATOM 1126 NE ARG A 73 5.269 -26.406 -24.587 1.00 0.00 N ATOM 1127 CZ ARG A 73 6.534 -26.697 -24.868 1.00 0.00 C ATOM 1128 NH1 ARG A 73 7.174 -26.037 -25.824 1.00 0.00 N ATOM 1129 NH2 ARG A 73 7.163 -27.650 -24.192 1.00 0.00 N ATOM 0 H ARG A 73 5.074 -21.407 -24.434 1.00 0.00 H new ATOM 0 HA ARG A 73 2.514 -22.453 -24.926 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.549 -23.282 -22.823 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.256 -24.278 -23.463 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.842 -23.288 -25.664 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.912 -23.977 -24.459 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.439 -25.536 -25.113 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.673 -25.459 -26.356 1.00 0.00 H new ATOM 0 HE ARG A 73 4.807 -26.932 -23.845 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.695 -25.303 -26.346 1.00 0.00 H new ATOM 0 HH12 ARG A 73 8.146 -26.263 -26.037 1.00 0.00 H new ATOM 0 HH21 ARG A 73 6.675 -28.160 -23.456 1.00 0.00 H new ATOM 0 HH22 ARG A 73 8.135 -27.873 -24.409 1.00 0.00 H new ATOM 1143 N GLU A 74 2.893 -20.918 -22.066 1.00 0.00 N ATOM 1144 CA GLU A 74 2.186 -20.412 -20.896 1.00 0.00 C ATOM 1145 C GLU A 74 1.484 -19.094 -21.212 1.00 0.00 C ATOM 1146 O GLU A 74 0.436 -18.784 -20.645 1.00 0.00 O ATOM 1147 CB GLU A 74 3.157 -20.218 -19.729 1.00 0.00 C ATOM 1148 CG GLU A 74 3.238 -21.417 -18.799 1.00 0.00 C ATOM 1149 CD GLU A 74 3.523 -22.710 -19.537 1.00 0.00 C ATOM 1150 OE1 GLU A 74 2.558 -23.358 -19.993 1.00 0.00 O ATOM 1151 OE2 GLU A 74 4.711 -23.074 -19.660 1.00 0.00 O ATOM 0 H GLU A 74 3.842 -20.560 -22.173 1.00 0.00 H new ATOM 0 HA GLU A 74 1.432 -21.147 -20.614 1.00 0.00 H new ATOM 0 HB2 GLU A 74 4.151 -20.008 -20.125 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.852 -19.343 -19.155 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.020 -21.246 -18.059 1.00 0.00 H new ATOM 0 HG3 GLU A 74 2.299 -21.513 -18.254 1.00 0.00 H new ATOM 1158 N LYS A 75 2.069 -18.322 -22.121 1.00 0.00 N ATOM 1159 CA LYS A 75 1.502 -17.038 -22.515 1.00 0.00 C ATOM 1160 C LYS A 75 0.152 -17.227 -23.200 1.00 0.00 C ATOM 1161 O LYS A 75 -0.766 -16.427 -23.017 1.00 0.00 O ATOM 1162 CB LYS A 75 2.461 -16.299 -23.450 1.00 0.00 C ATOM 1163 CG LYS A 75 3.854 -16.115 -22.871 1.00 0.00 C ATOM 1164 CD LYS A 75 4.418 -14.743 -23.200 1.00 0.00 C ATOM 1165 CE LYS A 75 4.274 -13.786 -22.028 1.00 0.00 C ATOM 1166 NZ LYS A 75 3.804 -12.441 -22.464 1.00 0.00 N ATOM 0 H LYS A 75 2.937 -18.564 -22.599 1.00 0.00 H new ATOM 0 HA LYS A 75 1.353 -16.443 -21.614 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.536 -16.849 -24.388 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.043 -15.321 -23.687 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.820 -16.245 -21.789 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.517 -16.886 -23.264 1.00 0.00 H new ATOM 0 HD2 LYS A 75 5.470 -14.836 -23.468 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.902 -14.335 -24.069 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.571 -14.200 -21.306 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.233 -13.688 -21.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.265 -11.995 -21.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.624 -11.847 -22.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.195 -12.541 -23.301 1.00 0.00 H new ATOM 1180 N LYS A 76 0.037 -18.290 -23.988 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.201 -18.586 -24.699 1.00 0.00 C ATOM 1182 C LYS A 76 -2.351 -18.803 -23.720 1.00 0.00 C ATOM 1183 O LYS A 76 -3.419 -18.205 -23.860 1.00 0.00 O ATOM 1184 CB LYS A 76 -1.025 -19.827 -25.577 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.297 -20.255 -26.287 1.00 0.00 C ATOM 1186 CD LYS A 76 -1.993 -20.998 -27.577 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.462 -22.396 -27.304 1.00 0.00 C ATOM 1188 NZ LYS A 76 -2.287 -23.443 -27.968 1.00 0.00 N ATOM 0 H LYS A 76 0.787 -18.962 -24.151 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.441 -17.732 -25.332 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.253 -19.629 -26.321 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.669 -20.651 -24.959 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.885 -20.894 -25.628 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.905 -19.377 -26.506 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -2.897 -21.063 -28.182 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.261 -20.437 -28.157 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.433 -22.468 -27.655 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.445 -22.575 -26.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.892 -24.382 -27.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.264 -23.391 -27.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -2.282 -23.288 -28.996 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.127 -19.659 -22.730 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.144 -19.953 -21.727 1.00 0.00 C ATOM 1204 C LEU A 77 -3.523 -18.696 -20.951 1.00 0.00 C ATOM 1205 O LEU A 77 -4.700 -18.350 -20.846 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.642 -21.030 -20.763 1.00 0.00 C ATOM 1207 CG LEU A 77 -2.650 -22.463 -21.295 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -2.085 -23.421 -20.257 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -4.059 -22.877 -21.695 1.00 0.00 C ATOM 0 H LEU A 77 -1.249 -20.162 -22.600 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.031 -20.321 -22.242 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.623 -20.779 -20.468 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.253 -20.995 -19.861 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.016 -22.504 -22.181 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.099 -24.436 -20.653 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.059 -23.138 -20.020 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.692 -23.376 -19.352 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.045 -23.900 -22.071 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.716 -22.819 -20.827 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.427 -22.209 -22.474 1.00 0.00 H new ATOM 1221 N ARG A 78 -2.517 -18.015 -20.411 1.00 0.00 N ATOM 1222 CA ARG A 78 -2.745 -16.795 -19.645 1.00 0.00 C ATOM 1223 C ARG A 78 -3.550 -15.786 -20.457 1.00 0.00 C ATOM 1224 O ARG A 78 -4.391 -15.066 -19.917 1.00 0.00 O ATOM 1225 CB ARG A 78 -1.411 -16.177 -19.222 1.00 0.00 C ATOM 1226 CG ARG A 78 -0.769 -16.871 -18.031 1.00 0.00 C ATOM 1227 CD ARG A 78 0.749 -16.793 -18.093 1.00 0.00 C ATOM 1228 NE ARG A 78 1.355 -16.880 -16.768 1.00 0.00 N ATOM 1229 CZ ARG A 78 2.667 -16.929 -16.561 1.00 0.00 C ATOM 1230 NH1 ARG A 78 3.504 -16.900 -17.589 1.00 0.00 N ATOM 1231 NH2 ARG A 78 3.143 -17.008 -15.325 1.00 0.00 N ATOM 0 H ARG A 78 -1.537 -18.287 -20.490 1.00 0.00 H new ATOM 0 HA ARG A 78 -3.316 -17.056 -18.754 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -0.722 -16.209 -20.066 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.568 -15.126 -18.978 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -1.121 -16.411 -17.107 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.080 -17.915 -18.006 1.00 0.00 H new ATOM 0 HD2 ARG A 78 1.128 -17.601 -18.719 1.00 0.00 H new ATOM 0 HD3 ARG A 78 1.045 -15.857 -18.566 1.00 0.00 H new ATOM 0 HE ARG A 78 0.738 -16.905 -15.956 1.00 0.00 H new ATOM 0 HH11 ARG A 78 3.141 -16.840 -18.540 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.511 -16.938 -17.428 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.502 -17.031 -14.532 1.00 0.00 H new ATOM 0 HH22 ARG A 78 4.150 -17.046 -15.168 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.287 -15.737 -21.759 1.00 0.00 N ATOM 1246 CA LYS A 79 -3.987 -14.816 -22.647 1.00 0.00 C ATOM 1247 C LYS A 79 -5.428 -15.264 -22.869 1.00 0.00 C ATOM 1248 O LYS A 79 -6.366 -14.500 -22.643 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.260 -14.719 -23.990 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.797 -13.625 -24.896 1.00 0.00 C ATOM 1251 CD LYS A 79 -2.853 -13.345 -26.053 1.00 0.00 C ATOM 1252 CE LYS A 79 -3.613 -12.926 -27.303 1.00 0.00 C ATOM 1253 NZ LYS A 79 -3.484 -11.466 -27.567 1.00 0.00 N ATOM 0 H LYS A 79 -2.594 -16.325 -22.223 1.00 0.00 H new ATOM 0 HA LYS A 79 -3.999 -13.834 -22.175 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.200 -14.540 -23.808 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.338 -15.676 -24.505 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.772 -13.919 -25.284 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.946 -12.713 -24.318 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.153 -12.559 -25.771 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.263 -14.236 -26.266 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -3.238 -13.485 -28.160 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.666 -13.183 -27.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.016 -11.220 -28.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -3.865 -10.932 -26.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -2.481 -11.224 -27.699 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.596 -16.507 -23.311 1.00 0.00 N ATOM 1268 CA GLU A 80 -6.924 -17.055 -23.562 1.00 0.00 C ATOM 1269 C GLU A 80 -7.789 -16.979 -22.307 1.00 0.00 C ATOM 1270 O GLU A 80 -9.009 -16.842 -22.390 1.00 0.00 O ATOM 1271 CB GLU A 80 -6.819 -18.506 -24.036 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.094 -18.662 -25.362 1.00 0.00 C ATOM 1273 CD GLU A 80 -7.045 -18.809 -26.534 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -7.884 -19.733 -26.505 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -6.950 -17.998 -27.479 1.00 0.00 O ATOM 0 H GLU A 80 -4.830 -17.153 -23.502 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.395 -16.458 -24.343 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.300 -19.091 -23.277 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.822 -18.923 -24.129 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.453 -17.795 -25.525 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.443 -19.535 -25.315 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.148 -17.070 -21.147 1.00 0.00 N ATOM 1283 CA ALA A 81 -7.858 -17.011 -19.875 1.00 0.00 C ATOM 1284 C ALA A 81 -8.751 -15.778 -19.802 1.00 0.00 C ATOM 1285 O ALA A 81 -9.875 -15.843 -19.305 1.00 0.00 O ATOM 1286 CB ALA A 81 -6.870 -17.019 -18.718 1.00 0.00 C ATOM 0 H ALA A 81 -6.138 -17.185 -21.061 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.494 -17.893 -19.801 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.414 -16.975 -17.775 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -6.277 -17.933 -18.752 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.210 -16.155 -18.797 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.244 -14.655 -20.300 1.00 0.00 N ATOM 1293 CA GLU A 82 -8.997 -13.406 -20.289 1.00 0.00 C ATOM 1294 C GLU A 82 -10.067 -13.407 -21.377 1.00 0.00 C ATOM 1295 O GLU A 82 -11.110 -12.767 -21.237 1.00 0.00 O ATOM 1296 CB GLU A 82 -8.056 -12.215 -20.485 1.00 0.00 C ATOM 1297 CG GLU A 82 -7.239 -11.876 -19.250 1.00 0.00 C ATOM 1298 CD GLU A 82 -6.189 -10.815 -19.517 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -5.107 -11.168 -20.031 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -6.450 -9.632 -19.214 1.00 0.00 O ATOM 0 H GLU A 82 -7.315 -14.584 -20.716 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.488 -13.316 -19.320 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.378 -12.430 -21.311 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.643 -11.343 -20.773 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.907 -11.530 -18.461 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.752 -12.779 -18.882 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.800 -14.128 -22.461 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.740 -14.212 -23.572 1.00 0.00 C ATOM 1309 C ILE A 83 -11.956 -15.053 -23.201 1.00 0.00 C ATOM 1310 O ILE A 83 -13.086 -14.716 -23.553 1.00 0.00 O ATOM 1311 CB ILE A 83 -10.077 -14.814 -24.825 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.867 -13.975 -25.242 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.082 -14.905 -25.964 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -7.929 -14.694 -26.185 1.00 0.00 C ATOM 0 H ILE A 83 -8.941 -14.662 -22.593 1.00 0.00 H new ATOM 0 HA ILE A 83 -11.059 -13.194 -23.793 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.733 -15.821 -24.588 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.217 -13.059 -25.719 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.315 -13.679 -24.350 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -10.599 -15.332 -26.843 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.916 -15.540 -25.664 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.453 -13.908 -26.203 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.095 -14.039 -26.438 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.550 -15.595 -25.704 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.465 -14.966 -27.094 1.00 0.00 H new ATOM 1326 N GLU A 84 -11.716 -16.148 -22.487 1.00 0.00 N ATOM 1327 CA GLU A 84 -12.794 -17.037 -22.067 1.00 0.00 C ATOM 1328 C GLU A 84 -13.724 -16.336 -21.080 1.00 0.00 C ATOM 1329 O GLU A 84 -14.914 -16.644 -21.007 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.220 -18.305 -21.431 1.00 0.00 C ATOM 1331 CG GLU A 84 -11.404 -19.152 -22.393 1.00 0.00 C ATOM 1332 CD GLU A 84 -12.248 -20.174 -23.131 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -13.104 -20.814 -22.485 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -12.051 -20.334 -24.354 1.00 0.00 O ATOM 0 H GLU A 84 -10.786 -16.441 -22.187 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.370 -17.311 -22.951 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.593 -18.025 -20.585 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.039 -18.906 -21.036 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -10.912 -18.502 -23.117 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.617 -19.666 -21.841 1.00 0.00 H new ATOM 1341 N TYR A 85 -13.172 -15.394 -20.324 1.00 0.00 N ATOM 1342 CA TYR A 85 -13.950 -14.652 -19.339 1.00 0.00 C ATOM 1343 C TYR A 85 -14.834 -13.609 -20.017 1.00 0.00 C ATOM 1344 O TYR A 85 -16.057 -13.629 -19.876 1.00 0.00 O ATOM 1345 CB TYR A 85 -13.021 -13.972 -18.332 1.00 0.00 C ATOM 1346 CG TYR A 85 -13.737 -13.035 -17.385 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -14.647 -13.519 -16.453 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -13.504 -11.666 -17.423 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -15.304 -12.667 -15.587 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -14.155 -10.806 -16.559 1.00 0.00 C ATOM 1351 CZ TYR A 85 -15.054 -11.311 -15.644 1.00 0.00 C ATOM 1352 OH TYR A 85 -15.706 -10.458 -14.783 1.00 0.00 O ATOM 0 H TYR A 85 -12.189 -15.126 -20.374 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.591 -15.359 -18.812 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.505 -14.737 -17.752 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -12.257 -13.414 -18.874 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -14.844 -14.580 -16.405 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.802 -11.267 -18.140 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -16.009 -13.060 -14.869 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.961 -9.744 -16.600 1.00 0.00 H new ATOM 0 HH TYR A 85 -15.416 -9.537 -14.953 1.00 0.00 H new ATOM 1362 N ARG A 86 -14.205 -12.700 -20.755 1.00 0.00 N ATOM 1363 CA ARG A 86 -14.933 -11.648 -21.455 1.00 0.00 C ATOM 1364 C ARG A 86 -15.879 -12.242 -22.494 1.00 0.00 C ATOM 1365 O ARG A 86 -16.899 -11.641 -22.834 1.00 0.00 O ATOM 1366 CB ARG A 86 -13.956 -10.685 -22.131 1.00 0.00 C ATOM 1367 CG ARG A 86 -13.067 -11.349 -23.170 1.00 0.00 C ATOM 1368 CD ARG A 86 -13.411 -10.884 -24.576 1.00 0.00 C ATOM 1369 NE ARG A 86 -12.928 -9.532 -24.840 1.00 0.00 N ATOM 1370 CZ ARG A 86 -11.643 -9.225 -24.984 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -10.718 -10.171 -24.890 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -11.282 -7.971 -25.222 1.00 0.00 N ATOM 0 H ARG A 86 -13.194 -12.671 -20.884 1.00 0.00 H new ATOM 0 HA ARG A 86 -15.524 -11.099 -20.721 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -14.520 -9.883 -22.607 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -13.328 -10.224 -21.369 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -12.023 -11.122 -22.956 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -13.177 -12.432 -23.106 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.977 -11.572 -25.301 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.492 -10.916 -24.714 1.00 0.00 H new ATOM 0 HE ARG A 86 -13.614 -8.782 -24.918 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -10.992 -11.136 -24.707 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -9.732 -9.933 -25.001 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -11.991 -7.241 -25.295 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -10.295 -7.736 -25.332 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.534 -13.423 -22.996 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.352 -14.097 -23.997 1.00 0.00 C ATOM 1388 C GLU A 87 -17.803 -14.198 -23.535 1.00 0.00 C ATOM 1389 O GLU A 87 -18.700 -13.607 -24.137 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.798 -15.493 -24.286 1.00 0.00 C ATOM 1391 CG GLU A 87 -15.008 -15.579 -25.582 1.00 0.00 C ATOM 1392 CD GLU A 87 -15.826 -16.143 -26.727 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -16.514 -15.355 -27.409 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -15.777 -17.372 -26.942 1.00 0.00 O ATOM 0 H GLU A 87 -14.693 -13.933 -22.726 1.00 0.00 H new ATOM 0 HA GLU A 87 -16.321 -13.506 -24.912 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.157 -15.799 -23.459 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.625 -16.202 -24.327 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.650 -14.585 -25.851 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.129 -16.204 -25.426 1.00 0.00 H new ATOM 1401 N ARG A 88 -18.025 -14.953 -22.464 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.366 -15.135 -21.923 1.00 0.00 C ATOM 1403 C ARG A 88 -20.002 -13.790 -21.583 1.00 0.00 C ATOM 1404 O ARG A 88 -21.216 -13.617 -21.703 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.320 -16.019 -20.675 1.00 0.00 C ATOM 1406 CG ARG A 88 -18.278 -15.583 -19.658 1.00 0.00 C ATOM 1407 CD ARG A 88 -18.387 -16.384 -18.370 1.00 0.00 C ATOM 1408 NE ARG A 88 -17.173 -17.147 -18.095 1.00 0.00 N ATOM 1409 CZ ARG A 88 -17.073 -18.044 -17.120 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -18.111 -18.289 -16.331 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -15.934 -18.698 -16.932 1.00 0.00 N ATOM 0 H ARG A 88 -17.293 -15.448 -21.954 1.00 0.00 H new ATOM 0 HA ARG A 88 -19.974 -15.624 -22.684 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -20.302 -16.015 -20.201 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -19.115 -17.047 -20.975 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -17.281 -15.706 -20.081 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -18.403 -14.522 -19.440 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -18.586 -15.708 -17.539 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -19.235 -17.065 -18.437 1.00 0.00 H new ATOM 0 HE ARG A 88 -16.357 -16.982 -18.684 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -18.988 -17.788 -16.472 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -18.032 -18.978 -15.583 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -15.134 -18.512 -17.536 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -15.859 -19.386 -16.183 1.00 0.00 H new ATOM 1425 N LEU A 89 -19.175 -12.841 -21.158 1.00 0.00 N ATOM 1426 CA LEU A 89 -19.656 -11.511 -20.800 1.00 0.00 C ATOM 1427 C LEU A 89 -20.213 -10.786 -22.021 1.00 0.00 C ATOM 1428 O LEU A 89 -21.127 -9.970 -21.908 1.00 0.00 O ATOM 1429 CB LEU A 89 -18.526 -10.690 -20.176 1.00 0.00 C ATOM 1430 CG LEU A 89 -18.000 -11.186 -18.829 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -16.869 -10.296 -18.336 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -19.124 -11.240 -17.804 1.00 0.00 C ATOM 0 H LEU A 89 -18.168 -12.968 -21.053 1.00 0.00 H new ATOM 0 HA LEU A 89 -20.459 -11.626 -20.072 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.694 -10.661 -20.880 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.875 -9.665 -20.052 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.609 -12.194 -18.963 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.508 -10.665 -17.376 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -16.054 -10.309 -19.060 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.234 -9.276 -18.218 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -18.731 -11.595 -16.851 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.546 -10.243 -17.674 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -19.901 -11.920 -18.152 1.00 0.00 H new ATOM 1444 N PHE A 90 -19.657 -11.092 -23.188 1.00 0.00 N ATOM 1445 CA PHE A 90 -20.098 -10.471 -24.432 1.00 0.00 C ATOM 1446 C PHE A 90 -21.481 -10.978 -24.832 1.00 0.00 C ATOM 1447 O PHE A 90 -22.299 -10.227 -25.363 1.00 0.00 O ATOM 1448 CB PHE A 90 -19.095 -10.753 -25.552 1.00 0.00 C ATOM 1449 CG PHE A 90 -18.393 -9.523 -26.052 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -17.516 -8.829 -25.234 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -18.611 -9.060 -27.340 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -16.868 -7.697 -25.691 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -17.966 -7.929 -27.802 1.00 0.00 C ATOM 1454 CZ PHE A 90 -17.094 -7.246 -26.977 1.00 0.00 C ATOM 0 H PHE A 90 -18.900 -11.766 -23.299 1.00 0.00 H new ATOM 0 HA PHE A 90 -20.157 -9.395 -24.270 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -18.352 -11.465 -25.193 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -19.615 -11.228 -26.384 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -17.337 -9.177 -24.227 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -19.293 -9.589 -27.990 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -16.186 -7.166 -25.044 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -18.144 -7.579 -28.808 1.00 0.00 H new ATOM 0 HZ PHE A 90 -16.590 -6.361 -27.337 1.00 0.00 H new ATOM 1464 N ARG A 91 -21.733 -12.257 -24.573 1.00 0.00 N ATOM 1465 CA ARG A 91 -23.015 -12.866 -24.908 1.00 0.00 C ATOM 1466 C ARG A 91 -24.167 -12.086 -24.281 1.00 0.00 C ATOM 1467 O ARG A 91 -25.195 -11.859 -24.918 1.00 0.00 O ATOM 1468 CB ARG A 91 -23.052 -14.320 -24.434 1.00 0.00 C ATOM 1469 CG ARG A 91 -22.495 -15.305 -25.449 1.00 0.00 C ATOM 1470 CD ARG A 91 -22.880 -16.736 -25.105 1.00 0.00 C ATOM 1471 NE ARG A 91 -22.289 -17.699 -26.031 1.00 0.00 N ATOM 1472 CZ ARG A 91 -22.695 -18.959 -26.138 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -23.688 -19.406 -25.381 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -22.107 -19.775 -27.003 1.00 0.00 N ATOM 0 H ARG A 91 -21.067 -12.891 -24.132 1.00 0.00 H new ATOM 0 HA ARG A 91 -23.129 -12.841 -25.992 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -22.484 -14.406 -23.507 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -24.082 -14.592 -24.203 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -22.868 -15.055 -26.442 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -21.409 -15.218 -25.485 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -22.557 -16.964 -24.089 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -23.965 -16.834 -25.124 1.00 0.00 H new ATOM 0 HE ARG A 91 -21.523 -17.387 -26.628 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -24.142 -18.782 -24.714 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -23.998 -20.374 -25.465 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -21.343 -19.435 -27.586 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -22.419 -20.743 -27.085 1.00 0.00 H new ATOM 1488 N ASN A 92 -23.987 -11.678 -23.029 1.00 0.00 N ATOM 1489 CA ASN A 92 -25.012 -10.925 -22.316 1.00 0.00 C ATOM 1490 C ASN A 92 -25.423 -9.685 -23.104 1.00 0.00 C ATOM 1491 O ASN A 92 -26.600 -9.331 -23.152 1.00 0.00 O ATOM 1492 CB ASN A 92 -24.504 -10.517 -20.931 1.00 0.00 C ATOM 1493 CG ASN A 92 -25.585 -9.873 -20.085 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -26.774 -9.994 -20.380 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -25.176 -9.183 -19.027 1.00 0.00 N ATOM 0 H ASN A 92 -23.141 -11.856 -22.488 1.00 0.00 H new ATOM 0 HA ASN A 92 -25.885 -11.567 -22.201 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -24.118 -11.396 -20.415 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -23.672 -9.822 -21.043 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -25.858 -8.727 -18.421 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -24.180 -9.109 -18.820 1.00 0.00 H new ATOM 1502 N GLN A 93 -24.444 -9.031 -23.720 1.00 0.00 N ATOM 1503 CA GLN A 93 -24.704 -7.830 -24.506 1.00 0.00 C ATOM 1504 C GLN A 93 -25.140 -8.191 -25.922 1.00 0.00 C ATOM 1505 O GLN A 93 -25.196 -9.366 -26.286 1.00 0.00 O ATOM 1506 CB GLN A 93 -23.457 -6.946 -24.554 1.00 0.00 C ATOM 1507 CG GLN A 93 -23.593 -5.658 -23.757 1.00 0.00 C ATOM 1508 CD GLN A 93 -23.003 -5.769 -22.364 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -22.553 -6.838 -21.951 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -23.002 -4.661 -21.632 1.00 0.00 N ATOM 0 H GLN A 93 -23.464 -9.312 -23.690 1.00 0.00 H new ATOM 0 HA GLN A 93 -25.512 -7.279 -24.025 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -22.606 -7.511 -24.173 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -23.236 -6.699 -25.593 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -23.098 -4.849 -24.294 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -24.647 -5.392 -23.681 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -23.385 -3.797 -22.015 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -22.618 -4.674 -20.687 1.00 0.00 H new ATOM 1519 N LYS A 94 -25.449 -7.173 -26.718 1.00 0.00 N ATOM 1520 CA LYS A 94 -25.880 -7.381 -28.095 1.00 0.00 C ATOM 1521 C LYS A 94 -24.729 -7.145 -29.067 1.00 0.00 C ATOM 1522 O LYS A 94 -24.025 -6.138 -28.978 1.00 0.00 O ATOM 1523 CB LYS A 94 -27.046 -6.448 -28.433 1.00 0.00 C ATOM 1524 CG LYS A 94 -28.179 -6.501 -27.423 1.00 0.00 C ATOM 1525 CD LYS A 94 -28.461 -5.130 -26.831 1.00 0.00 C ATOM 1526 CE LYS A 94 -29.602 -4.434 -27.557 1.00 0.00 C ATOM 1527 NZ LYS A 94 -30.592 -3.854 -26.607 1.00 0.00 N ATOM 0 H LYS A 94 -25.409 -6.195 -26.433 1.00 0.00 H new ATOM 0 HA LYS A 94 -26.210 -8.415 -28.194 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -26.675 -5.425 -28.497 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -27.435 -6.708 -29.417 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -29.079 -6.883 -27.904 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -27.924 -7.198 -26.625 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -28.709 -5.233 -25.775 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -27.563 -4.515 -26.889 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -29.201 -3.643 -28.191 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -30.102 -5.146 -28.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -31.354 -3.389 -27.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -30.994 -4.612 -26.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -30.120 -3.156 -25.997 1.00 0.00 H new ATOM 1541 N ILE A 95 -24.543 -8.078 -29.995 1.00 0.00 N ATOM 1542 CA ILE A 95 -23.478 -7.969 -30.985 1.00 0.00 C ATOM 1543 C ILE A 95 -24.031 -7.549 -32.342 1.00 0.00 C ATOM 1544 O ILE A 95 -23.343 -6.899 -33.131 1.00 0.00 O ATOM 1545 CB ILE A 95 -22.718 -9.299 -31.142 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -21.529 -9.123 -32.089 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -23.652 -10.386 -31.651 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -20.327 -9.959 -31.711 1.00 0.00 C ATOM 0 H ILE A 95 -25.116 -8.918 -30.082 1.00 0.00 H new ATOM 0 HA ILE A 95 -22.788 -7.206 -30.625 1.00 0.00 H new ATOM 0 HB ILE A 95 -22.339 -9.602 -30.166 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -21.839 -9.384 -33.101 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -21.240 -8.072 -32.105 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -23.100 -11.320 -31.757 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -24.468 -10.525 -30.942 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -24.058 -10.093 -32.619 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -19.523 -9.784 -32.426 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -19.991 -9.682 -30.712 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -20.599 -11.014 -31.723 1.00 0.00 H new ATOM 1560 N LEU A 96 -25.278 -7.922 -32.609 1.00 0.00 N ATOM 1561 CA LEU A 96 -25.925 -7.583 -33.871 1.00 0.00 C ATOM 1562 C LEU A 96 -27.381 -8.036 -33.876 1.00 0.00 C ATOM 1563 O LEU A 96 -27.677 -9.204 -34.127 1.00 0.00 O ATOM 1564 CB LEU A 96 -25.175 -8.224 -35.040 1.00 0.00 C ATOM 1565 CG LEU A 96 -25.058 -7.378 -36.308 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -24.067 -8.003 -37.278 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -26.419 -7.213 -36.967 1.00 0.00 C ATOM 0 H LEU A 96 -25.861 -8.460 -31.968 1.00 0.00 H new ATOM 0 HA LEU A 96 -25.901 -6.499 -33.983 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -24.170 -8.480 -34.704 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -25.673 -9.159 -35.296 1.00 0.00 H new ATOM 0 HG LEU A 96 -24.689 -6.391 -36.029 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -23.997 -7.387 -38.174 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -23.087 -8.068 -36.805 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -24.406 -9.003 -37.550 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -26.316 -6.608 -37.868 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -26.816 -8.193 -37.231 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -27.101 -6.720 -36.275 1.00 0.00 H new ATOM 1579 N ARG A 97 -28.287 -7.103 -33.599 1.00 0.00 N ATOM 1580 CA ARG A 97 -29.712 -7.407 -33.572 1.00 0.00 C ATOM 1581 C ARG A 97 -30.539 -6.128 -33.475 1.00 0.00 C ATOM 1582 O ARG A 97 -30.392 -5.354 -32.529 1.00 0.00 O ATOM 1583 CB ARG A 97 -30.037 -8.328 -32.395 1.00 0.00 C ATOM 1584 CG ARG A 97 -30.627 -9.665 -32.813 1.00 0.00 C ATOM 1585 CD ARG A 97 -31.995 -9.495 -33.453 1.00 0.00 C ATOM 1586 NE ARG A 97 -32.974 -8.946 -32.518 1.00 0.00 N ATOM 1587 CZ ARG A 97 -33.463 -9.623 -31.485 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -33.066 -10.867 -31.256 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -34.350 -9.055 -30.678 1.00 0.00 N ATOM 0 H ARG A 97 -28.059 -6.131 -33.390 1.00 0.00 H new ATOM 0 HA ARG A 97 -29.967 -7.915 -34.502 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -29.127 -8.505 -31.821 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -30.739 -7.822 -31.732 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -29.954 -10.157 -33.515 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -30.710 -10.315 -31.942 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -31.911 -8.837 -34.318 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -32.346 -10.460 -33.820 1.00 0.00 H new ATOM 0 HE ARG A 97 -33.300 -7.991 -32.666 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -32.384 -11.306 -31.874 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -33.443 -11.385 -30.462 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -34.657 -8.098 -30.851 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -34.725 -9.576 -29.885 1.00 0.00 H new ATOM 1603 N GLU A 98 -31.406 -5.913 -34.459 1.00 0.00 N ATOM 1604 CA GLU A 98 -32.254 -4.727 -34.484 1.00 0.00 C ATOM 1605 C GLU A 98 -33.724 -5.112 -34.627 1.00 0.00 C ATOM 1606 O GLU A 98 -34.052 -6.276 -34.856 1.00 0.00 O ATOM 1607 CB GLU A 98 -31.843 -3.803 -35.632 1.00 0.00 C ATOM 1608 CG GLU A 98 -30.702 -2.864 -35.279 1.00 0.00 C ATOM 1609 CD GLU A 98 -29.603 -2.862 -36.324 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -28.754 -3.777 -36.293 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -29.592 -1.946 -37.173 1.00 0.00 O ATOM 0 H GLU A 98 -31.540 -6.544 -35.249 1.00 0.00 H new ATOM 0 HA GLU A 98 -32.125 -4.199 -33.539 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -31.551 -4.410 -36.489 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -32.706 -3.213 -35.939 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -31.091 -1.852 -35.165 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -30.282 -3.155 -34.316 1.00 0.00 H new ATOM 1618 N TYR A 99 -34.603 -4.126 -34.490 1.00 0.00 N ATOM 1619 CA TYR A 99 -36.038 -4.361 -34.601 1.00 0.00 C ATOM 1620 C TYR A 99 -36.467 -4.433 -36.064 1.00 0.00 C ATOM 1621 O TYR A 99 -35.811 -3.874 -36.943 1.00 0.00 O ATOM 1622 CB TYR A 99 -36.814 -3.254 -33.885 1.00 0.00 C ATOM 1623 CG TYR A 99 -36.516 -1.868 -34.410 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -37.150 -1.383 -35.547 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -35.599 -1.044 -33.769 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -36.880 -0.118 -36.031 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -35.324 0.224 -34.245 1.00 0.00 C ATOM 1628 CZ TYR A 99 -35.967 0.682 -35.376 1.00 0.00 C ATOM 1629 OH TYR A 99 -35.695 1.943 -35.854 1.00 0.00 O ATOM 0 H TYR A 99 -34.347 -3.157 -34.302 1.00 0.00 H new ATOM 0 HA TYR A 99 -36.261 -5.317 -34.128 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -37.882 -3.449 -33.983 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -36.580 -3.288 -32.821 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -37.867 -2.006 -36.061 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -35.093 -1.400 -32.884 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -37.381 0.243 -36.917 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -34.610 0.853 -33.734 1.00 0.00 H new ATOM 0 HH TYR A 99 -35.031 2.375 -35.277 1.00 0.00 H new ATOM 1639 N ARG A 100 -37.572 -5.126 -36.316 1.00 0.00 N ATOM 1640 CA ARG A 100 -38.090 -5.273 -37.671 1.00 0.00 C ATOM 1641 C ARG A 100 -39.066 -4.148 -38.005 1.00 0.00 C ATOM 1642 O ARG A 100 -39.510 -3.415 -37.122 1.00 0.00 O ATOM 1643 CB ARG A 100 -38.782 -6.627 -37.832 1.00 0.00 C ATOM 1644 CG ARG A 100 -40.016 -6.788 -36.959 1.00 0.00 C ATOM 1645 CD ARG A 100 -41.221 -7.229 -37.775 1.00 0.00 C ATOM 1646 NE ARG A 100 -42.106 -8.108 -37.014 1.00 0.00 N ATOM 1647 CZ ARG A 100 -41.789 -9.352 -36.673 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -40.616 -9.861 -37.023 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -42.648 -10.089 -35.980 1.00 0.00 N ATOM 0 H ARG A 100 -38.126 -5.595 -35.600 1.00 0.00 H new ATOM 0 HA ARG A 100 -37.249 -5.219 -38.362 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -39.066 -6.758 -38.876 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -38.072 -7.419 -37.593 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -39.817 -7.521 -36.177 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -40.237 -5.843 -36.462 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -41.777 -6.351 -38.104 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -40.881 -7.746 -38.673 1.00 0.00 H new ATOM 0 HE ARG A 100 -43.016 -7.747 -36.729 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -39.954 -9.297 -37.556 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -40.376 -10.817 -36.760 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -43.551 -9.700 -35.709 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -42.405 -11.044 -35.718 1.00 0.00 H new ATOM 1663 N ASP A 101 -39.394 -4.018 -39.286 1.00 0.00 N ATOM 1664 CA ASP A 101 -40.318 -2.984 -39.737 1.00 0.00 C ATOM 1665 C ASP A 101 -41.490 -3.596 -40.497 1.00 0.00 C ATOM 1666 O ASP A 101 -42.614 -3.640 -39.994 1.00 0.00 O ATOM 1667 CB ASP A 101 -39.591 -1.973 -40.625 1.00 0.00 C ATOM 1668 CG ASP A 101 -39.660 -0.563 -40.073 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -40.698 0.102 -40.273 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -38.676 -0.123 -39.441 1.00 0.00 O ATOM 0 H ASP A 101 -39.034 -4.616 -40.030 1.00 0.00 H new ATOM 0 HA ASP A 101 -40.707 -2.471 -38.858 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -38.547 -2.269 -40.728 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -40.028 -1.991 -41.624 1.00 0.00 H new TER 1675 ASP A 101