USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1055 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 123 HIS : no HD1:sc= -0.0289 X(o=-0.029,f=-0.32) USER MOD Set 1.2: A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 62 HIS :FLIP no HD1:sc= -1.72 F(o=-5.3!,f=-1.7) USER MOD Set 2.2: A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 35:sc= 0.0397 USER MOD Single : A 11 TYR OH : rot 75:sc= -0.539 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc=-0.00274 K(o=-0.0027,f=-0.9) USER MOD Single : A 16 LYS NZ :NH3+ 165:sc=-0.00933 (180deg=-0.136) USER MOD Single : A 20 SER OG : rot 70:sc= 0.794 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 MET CE :methyl -162:sc= -0.283 (180deg=-0.998) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 CYS SG : rot -140:sc= -0.446 USER MOD Single : A 42 SER OG : rot 79:sc=-0.00823 USER MOD Single : A 43 ASN : amide:sc= -0.104 K(o=-0.1,f=-1.9!) USER MOD Single : A 44 ASN : amide:sc= -0.0089 X(o=-0.0089,f=-0.21) USER MOD Single : A 45 GLN : amide:sc= -4.02! C(o=-4!,f=-6.7!) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 33:sc= 0.576 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 70 THR OG1 : rot 115:sc= 0.734 USER MOD Single : A 79 ASN : amide:sc= -0.564 K(o=-0.56,f=-1.8!) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0661 USER MOD Single : A 85 MET CE :methyl 141:sc= -1.92 (180deg=-2.18!) USER MOD Single : A 88 GLN : amide:sc=-0.00889 X(o=-0.0089,f=-4.3e-05) USER MOD Single : A 89 TYR OH : rot 30:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0162 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -3.49! C(o=-3.5!,f=-3.4!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.0529 K(o=-0.053,f=-1.2!) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -2.06 K(o=-2.1,f=-6.4!) USER MOD Single : A 136 SER OG : rot 34:sc= 1.18 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.697 1.404 1.080 1.00 0.00 N ATOM 2 CA GLY A 1 -21.956 2.100 1.272 1.00 0.00 C ATOM 3 C GLY A 1 -22.110 3.288 0.343 1.00 0.00 C ATOM 4 O GLY A 1 -22.813 3.209 -0.664 1.00 0.00 O ATOM 0 H1 GLY A 1 -20.641 0.601 1.738 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.639 1.055 0.102 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.908 2.057 1.262 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -22.780 1.406 1.108 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.026 2.439 2.305 1.00 0.00 H new ATOM 8 N SER A 2 -21.452 4.392 0.682 1.00 0.00 N ATOM 9 CA SER A 2 -21.524 5.603 -0.126 1.00 0.00 C ATOM 10 C SER A 2 -20.184 5.888 -0.799 1.00 0.00 C ATOM 11 O SER A 2 -19.135 5.851 -0.157 1.00 0.00 O ATOM 12 CB SER A 2 -21.936 6.796 0.739 1.00 0.00 C ATOM 13 OG SER A 2 -21.044 6.970 1.826 1.00 0.00 O ATOM 0 H SER A 2 -20.863 4.472 1.511 1.00 0.00 H new ATOM 0 HA SER A 2 -22.275 5.448 -0.901 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.954 7.701 0.131 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.948 6.644 1.115 1.00 0.00 H new ATOM 0 HG SER A 2 -21.328 7.739 2.362 1.00 0.00 H new ATOM 19 N SER A 3 -20.229 6.171 -2.097 1.00 0.00 N ATOM 20 CA SER A 3 -19.020 6.458 -2.859 1.00 0.00 C ATOM 21 C SER A 3 -17.922 5.449 -2.536 1.00 0.00 C ATOM 22 O SER A 3 -16.778 5.821 -2.278 1.00 0.00 O ATOM 23 CB SER A 3 -18.529 7.876 -2.562 1.00 0.00 C ATOM 24 OG SER A 3 -19.487 8.841 -2.960 1.00 0.00 O ATOM 0 H SER A 3 -21.090 6.208 -2.643 1.00 0.00 H new ATOM 0 HA SER A 3 -19.261 6.379 -3.919 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.326 7.978 -1.496 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.589 8.055 -3.084 1.00 0.00 H new ATOM 0 HG SER A 3 -19.150 9.739 -2.758 1.00 0.00 H new ATOM 30 N GLY A 4 -18.280 4.169 -2.551 1.00 0.00 N ATOM 31 CA GLY A 4 -17.315 3.125 -2.258 1.00 0.00 C ATOM 32 C GLY A 4 -17.643 1.820 -2.956 1.00 0.00 C ATOM 33 O GLY A 4 -18.103 1.817 -4.097 1.00 0.00 O ATOM 0 H GLY A 4 -19.221 3.836 -2.761 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.322 3.457 -2.562 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.280 2.959 -1.181 1.00 0.00 H new ATOM 37 N SER A 5 -17.403 0.707 -2.269 1.00 0.00 N ATOM 38 CA SER A 5 -17.671 -0.611 -2.833 1.00 0.00 C ATOM 39 C SER A 5 -18.238 -1.550 -1.772 1.00 0.00 C ATOM 40 O SER A 5 -17.856 -1.488 -0.604 1.00 0.00 O ATOM 41 CB SER A 5 -16.391 -1.205 -3.425 1.00 0.00 C ATOM 42 OG SER A 5 -16.674 -2.360 -4.196 1.00 0.00 O ATOM 0 H SER A 5 -17.024 0.692 -1.322 1.00 0.00 H new ATOM 0 HA SER A 5 -18.411 -0.497 -3.626 1.00 0.00 H new ATOM 0 HB2 SER A 5 -15.895 -0.461 -4.048 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.700 -1.460 -2.622 1.00 0.00 H new ATOM 0 HG SER A 5 -15.840 -2.720 -4.565 1.00 0.00 H new ATOM 48 N SER A 6 -19.152 -2.420 -2.189 1.00 0.00 N ATOM 49 CA SER A 6 -19.776 -3.370 -1.276 1.00 0.00 C ATOM 50 C SER A 6 -19.133 -4.748 -1.404 1.00 0.00 C ATOM 51 O SER A 6 -18.972 -5.271 -2.506 1.00 0.00 O ATOM 52 CB SER A 6 -21.277 -3.467 -1.554 1.00 0.00 C ATOM 53 OG SER A 6 -21.523 -3.859 -2.893 1.00 0.00 O ATOM 0 H SER A 6 -19.477 -2.487 -3.154 1.00 0.00 H new ATOM 0 HA SER A 6 -19.625 -3.011 -0.258 1.00 0.00 H new ATOM 0 HB2 SER A 6 -21.731 -4.186 -0.872 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.749 -2.503 -1.361 1.00 0.00 H new ATOM 0 HG SER A 6 -20.826 -4.484 -3.184 1.00 0.00 H new ATOM 59 N GLY A 7 -18.767 -5.332 -0.267 1.00 0.00 N ATOM 60 CA GLY A 7 -18.146 -6.643 -0.272 1.00 0.00 C ATOM 61 C GLY A 7 -16.716 -6.606 -0.772 1.00 0.00 C ATOM 62 O GLY A 7 -16.447 -6.933 -1.928 1.00 0.00 O ATOM 0 H GLY A 7 -18.890 -4.920 0.658 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -18.164 -7.054 0.737 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.730 -7.316 -0.900 1.00 0.00 H new ATOM 66 N ALA A 8 -15.796 -6.204 0.099 1.00 0.00 N ATOM 67 CA ALA A 8 -14.386 -6.125 -0.261 1.00 0.00 C ATOM 68 C ALA A 8 -13.528 -6.941 0.700 1.00 0.00 C ATOM 69 O ALA A 8 -12.981 -6.407 1.665 1.00 0.00 O ATOM 70 CB ALA A 8 -13.927 -4.675 -0.279 1.00 0.00 C ATOM 0 H ALA A 8 -16.002 -5.928 1.059 1.00 0.00 H new ATOM 0 HA ALA A 8 -14.267 -6.545 -1.260 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -12.872 -4.631 -0.549 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -14.513 -4.117 -1.010 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -14.067 -4.237 0.709 1.00 0.00 H new ATOM 76 N GLU A 9 -13.415 -8.238 0.429 1.00 0.00 N ATOM 77 CA GLU A 9 -12.624 -9.127 1.271 1.00 0.00 C ATOM 78 C GLU A 9 -11.331 -9.535 0.570 1.00 0.00 C ATOM 79 O GLU A 9 -10.277 -9.637 1.197 1.00 0.00 O ATOM 80 CB GLU A 9 -13.433 -10.374 1.637 1.00 0.00 C ATOM 81 CG GLU A 9 -14.488 -10.124 2.702 1.00 0.00 C ATOM 82 CD GLU A 9 -15.700 -9.391 2.161 1.00 0.00 C ATOM 83 OE1 GLU A 9 -15.628 -8.153 2.016 1.00 0.00 O ATOM 84 OE2 GLU A 9 -16.721 -10.055 1.885 1.00 0.00 O ATOM 0 H GLU A 9 -13.861 -8.695 -0.366 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.368 -8.587 2.183 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -13.918 -10.758 0.740 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.751 -11.149 1.987 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -14.804 -11.077 3.126 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -14.049 -9.544 3.514 1.00 0.00 H new ATOM 91 N PHE A 10 -11.421 -9.766 -0.736 1.00 0.00 N ATOM 92 CA PHE A 10 -10.260 -10.164 -1.524 1.00 0.00 C ATOM 93 C PHE A 10 -9.153 -9.119 -1.426 1.00 0.00 C ATOM 94 O PHE A 10 -7.970 -9.455 -1.361 1.00 0.00 O ATOM 95 CB PHE A 10 -10.657 -10.368 -2.987 1.00 0.00 C ATOM 96 CG PHE A 10 -9.824 -11.398 -3.696 1.00 0.00 C ATOM 97 CD1 PHE A 10 -8.456 -11.229 -3.831 1.00 0.00 C ATOM 98 CD2 PHE A 10 -10.410 -12.536 -4.227 1.00 0.00 C ATOM 99 CE1 PHE A 10 -7.687 -12.175 -4.481 1.00 0.00 C ATOM 100 CE2 PHE A 10 -9.647 -13.486 -4.878 1.00 0.00 C ATOM 101 CZ PHE A 10 -8.283 -13.305 -5.007 1.00 0.00 C ATOM 0 H PHE A 10 -12.286 -9.684 -1.271 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.884 -11.105 -1.122 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -11.705 -10.665 -3.033 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -10.572 -9.418 -3.514 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.985 -10.347 -3.423 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -11.476 -12.682 -4.131 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -6.621 -12.031 -4.578 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -10.116 -14.369 -5.286 1.00 0.00 H new ATOM 0 HZ PHE A 10 -7.685 -14.045 -5.518 1.00 0.00 H new ATOM 111 N TYR A 11 -9.545 -7.849 -1.416 1.00 0.00 N ATOM 112 CA TYR A 11 -8.586 -6.754 -1.329 1.00 0.00 C ATOM 113 C TYR A 11 -8.141 -6.533 0.113 1.00 0.00 C ATOM 114 O TYR A 11 -6.946 -6.501 0.408 1.00 0.00 O ATOM 115 CB TYR A 11 -9.197 -5.468 -1.889 1.00 0.00 C ATOM 116 CG TYR A 11 -8.181 -4.534 -2.506 1.00 0.00 C ATOM 117 CD1 TYR A 11 -7.054 -4.136 -1.798 1.00 0.00 C ATOM 118 CD2 TYR A 11 -8.348 -4.049 -3.798 1.00 0.00 C ATOM 119 CE1 TYR A 11 -6.123 -3.282 -2.358 1.00 0.00 C ATOM 120 CE2 TYR A 11 -7.422 -3.196 -4.366 1.00 0.00 C ATOM 121 CZ TYR A 11 -6.312 -2.815 -3.642 1.00 0.00 C ATOM 122 OH TYR A 11 -5.387 -1.965 -4.204 1.00 0.00 O ATOM 0 H TYR A 11 -10.520 -7.553 -1.467 1.00 0.00 H new ATOM 0 HA TYR A 11 -7.712 -7.022 -1.923 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -9.943 -5.727 -2.640 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -9.720 -4.945 -1.088 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -6.903 -4.500 -0.793 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -9.217 -4.344 -4.367 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -5.252 -2.982 -1.794 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -7.566 -2.829 -5.372 1.00 0.00 H new ATOM 0 HH TYR A 11 -4.588 -2.473 -4.459 1.00 0.00 H new ATOM 132 N ASP A 12 -9.111 -6.382 1.008 1.00 0.00 N ATOM 133 CA ASP A 12 -8.821 -6.165 2.421 1.00 0.00 C ATOM 134 C ASP A 12 -7.851 -7.220 2.944 1.00 0.00 C ATOM 135 O ASP A 12 -6.901 -6.904 3.661 1.00 0.00 O ATOM 136 CB ASP A 12 -10.113 -6.192 3.239 1.00 0.00 C ATOM 137 CG ASP A 12 -10.811 -4.847 3.263 1.00 0.00 C ATOM 138 OD1 ASP A 12 -11.029 -4.272 2.176 1.00 0.00 O ATOM 139 OD2 ASP A 12 -11.137 -4.367 4.370 1.00 0.00 O ATOM 0 H ASP A 12 -10.105 -6.406 0.780 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.355 -5.185 2.525 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -10.787 -6.941 2.823 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -9.887 -6.499 4.260 1.00 0.00 H new ATOM 144 N LYS A 13 -8.097 -8.474 2.582 1.00 0.00 N ATOM 145 CA LYS A 13 -7.246 -9.577 3.014 1.00 0.00 C ATOM 146 C LYS A 13 -5.774 -9.181 2.961 1.00 0.00 C ATOM 147 O LYS A 13 -4.968 -9.647 3.766 1.00 0.00 O ATOM 148 CB LYS A 13 -7.486 -10.808 2.137 1.00 0.00 C ATOM 149 CG LYS A 13 -8.700 -11.622 2.551 1.00 0.00 C ATOM 150 CD LYS A 13 -8.391 -12.520 3.737 1.00 0.00 C ATOM 151 CE LYS A 13 -9.617 -13.305 4.176 1.00 0.00 C ATOM 152 NZ LYS A 13 -9.383 -14.028 5.457 1.00 0.00 N ATOM 0 H LYS A 13 -8.879 -8.753 1.990 1.00 0.00 H new ATOM 0 HA LYS A 13 -7.503 -9.818 4.046 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -7.609 -10.488 1.102 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.603 -11.446 2.171 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.520 -10.950 2.806 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -9.035 -12.230 1.711 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -7.591 -13.211 3.473 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -8.028 -11.915 4.568 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -10.461 -12.625 4.292 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -9.888 -14.020 3.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -10.242 -14.551 5.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -8.594 -14.695 5.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -9.150 -13.343 6.204 1.00 0.00 H new ATOM 166 N GLN A 14 -5.432 -8.319 2.009 1.00 0.00 N ATOM 167 CA GLN A 14 -4.056 -7.860 1.853 1.00 0.00 C ATOM 168 C GLN A 14 -3.674 -6.895 2.970 1.00 0.00 C ATOM 169 O GLN A 14 -2.653 -7.073 3.636 1.00 0.00 O ATOM 170 CB GLN A 14 -3.873 -7.184 0.493 1.00 0.00 C ATOM 171 CG GLN A 14 -3.971 -8.144 -0.682 1.00 0.00 C ATOM 172 CD GLN A 14 -4.160 -7.428 -2.005 1.00 0.00 C ATOM 173 OE1 GLN A 14 -4.087 -6.201 -2.077 1.00 0.00 O ATOM 174 NE2 GLN A 14 -4.406 -8.194 -3.062 1.00 0.00 N ATOM 0 H GLN A 14 -6.088 -7.924 1.335 1.00 0.00 H new ATOM 0 HA GLN A 14 -3.401 -8.729 1.910 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -4.627 -6.405 0.379 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -2.901 -6.692 0.469 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -3.067 -8.751 -0.727 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -4.805 -8.827 -0.520 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -4.458 -9.207 -2.957 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -4.543 -7.769 -3.979 1.00 0.00 H new ATOM 183 N LEU A 15 -4.498 -5.873 3.170 1.00 0.00 N ATOM 184 CA LEU A 15 -4.246 -4.878 4.207 1.00 0.00 C ATOM 185 C LEU A 15 -3.622 -5.523 5.440 1.00 0.00 C ATOM 186 O LEU A 15 -2.456 -5.286 5.756 1.00 0.00 O ATOM 187 CB LEU A 15 -5.547 -4.171 4.590 1.00 0.00 C ATOM 188 CG LEU A 15 -6.272 -3.441 3.459 1.00 0.00 C ATOM 189 CD1 LEU A 15 -7.445 -2.641 4.005 1.00 0.00 C ATOM 190 CD2 LEU A 15 -5.310 -2.533 2.707 1.00 0.00 C ATOM 0 H LEU A 15 -5.347 -5.711 2.628 1.00 0.00 H new ATOM 0 HA LEU A 15 -3.545 -4.144 3.809 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.227 -4.910 5.014 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -5.327 -3.451 5.378 1.00 0.00 H new ATOM 0 HG LEU A 15 -6.659 -4.185 2.762 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -7.949 -2.128 3.185 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -8.147 -3.314 4.498 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -7.081 -1.906 4.724 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -5.843 -2.022 1.906 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.893 -1.796 3.394 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.503 -3.130 2.282 1.00 0.00 H new ATOM 202 N LYS A 16 -4.406 -6.342 6.133 1.00 0.00 N ATOM 203 CA LYS A 16 -3.931 -7.026 7.330 1.00 0.00 C ATOM 204 C LYS A 16 -2.523 -7.574 7.122 1.00 0.00 C ATOM 205 O LYS A 16 -1.662 -7.450 7.993 1.00 0.00 O ATOM 206 CB LYS A 16 -4.883 -8.164 7.704 1.00 0.00 C ATOM 207 CG LYS A 16 -5.113 -9.159 6.579 1.00 0.00 C ATOM 208 CD LYS A 16 -6.232 -10.130 6.914 1.00 0.00 C ATOM 209 CE LYS A 16 -6.033 -11.470 6.222 1.00 0.00 C ATOM 210 NZ LYS A 16 -4.925 -12.252 6.838 1.00 0.00 N ATOM 0 H LYS A 16 -5.374 -6.548 5.886 1.00 0.00 H new ATOM 0 HA LYS A 16 -3.903 -6.302 8.144 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -4.482 -8.692 8.569 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.841 -7.741 8.005 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.358 -8.623 5.662 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.194 -9.713 6.389 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -6.275 -10.279 7.993 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -7.188 -9.702 6.613 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.957 -12.046 6.273 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.818 -11.305 5.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.980 -13.241 6.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.012 -11.846 6.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.008 -12.215 7.874 1.00 0.00 H new ATOM 224 N VAL A 17 -2.294 -8.179 5.960 1.00 0.00 N ATOM 225 CA VAL A 17 -0.990 -8.743 5.636 1.00 0.00 C ATOM 226 C VAL A 17 0.074 -7.654 5.549 1.00 0.00 C ATOM 227 O VAL A 17 1.164 -7.790 6.105 1.00 0.00 O ATOM 228 CB VAL A 17 -1.028 -9.516 4.304 1.00 0.00 C ATOM 229 CG1 VAL A 17 0.350 -10.062 3.964 1.00 0.00 C ATOM 230 CG2 VAL A 17 -2.053 -10.638 4.369 1.00 0.00 C ATOM 0 H VAL A 17 -2.995 -8.291 5.228 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.735 -9.433 6.441 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.325 -8.828 3.513 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.303 -10.605 3.020 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.056 -9.237 3.874 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.679 -10.736 4.755 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.067 -11.174 3.420 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.788 -11.327 5.171 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -3.040 -10.218 4.563 1.00 0.00 H new ATOM 240 N LEU A 18 -0.250 -6.574 4.848 1.00 0.00 N ATOM 241 CA LEU A 18 0.677 -5.459 4.687 1.00 0.00 C ATOM 242 C LEU A 18 1.196 -4.984 6.041 1.00 0.00 C ATOM 243 O LEU A 18 2.402 -4.996 6.295 1.00 0.00 O ATOM 244 CB LEU A 18 -0.006 -4.303 3.955 1.00 0.00 C ATOM 245 CG LEU A 18 -0.364 -4.554 2.490 1.00 0.00 C ATOM 246 CD1 LEU A 18 -1.292 -3.465 1.974 1.00 0.00 C ATOM 247 CD2 LEU A 18 0.895 -4.632 1.639 1.00 0.00 C ATOM 0 H LEU A 18 -1.148 -6.446 4.382 1.00 0.00 H new ATOM 0 HA LEU A 18 1.524 -5.805 4.094 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.919 -4.048 4.493 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.647 -3.432 4.004 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.884 -5.509 2.421 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.536 -3.660 0.930 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.208 -3.457 2.565 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.798 -2.497 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 18 0.621 -4.811 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 18 1.443 -3.693 1.713 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.524 -5.448 1.994 1.00 0.00 H new ATOM 259 N LEU A 19 0.280 -4.567 6.907 1.00 0.00 N ATOM 260 CA LEU A 19 0.644 -4.090 8.236 1.00 0.00 C ATOM 261 C LEU A 19 1.563 -5.084 8.939 1.00 0.00 C ATOM 262 O LEU A 19 2.582 -4.702 9.514 1.00 0.00 O ATOM 263 CB LEU A 19 -0.612 -3.856 9.078 1.00 0.00 C ATOM 264 CG LEU A 19 -1.644 -2.892 8.491 1.00 0.00 C ATOM 265 CD1 LEU A 19 -2.989 -3.066 9.179 1.00 0.00 C ATOM 266 CD2 LEU A 19 -1.161 -1.454 8.614 1.00 0.00 C ATOM 0 H LEU A 19 -0.721 -4.549 6.713 1.00 0.00 H new ATOM 0 HA LEU A 19 1.178 -3.147 8.122 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.097 -4.818 9.246 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -0.306 -3.479 10.054 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.768 -3.123 7.433 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.711 -2.372 8.748 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.340 -4.088 9.038 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.882 -2.863 10.244 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.908 -0.782 8.191 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.007 -1.210 9.665 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.221 -1.338 8.074 1.00 0.00 H new ATOM 278 N SER A 20 1.197 -6.360 8.886 1.00 0.00 N ATOM 279 CA SER A 20 1.987 -7.409 9.519 1.00 0.00 C ATOM 280 C SER A 20 3.480 -7.123 9.381 1.00 0.00 C ATOM 281 O SER A 20 4.222 -7.153 10.361 1.00 0.00 O ATOM 282 CB SER A 20 1.659 -8.769 8.899 1.00 0.00 C ATOM 283 OG SER A 20 0.258 -8.974 8.834 1.00 0.00 O ATOM 0 H SER A 20 0.358 -6.693 8.411 1.00 0.00 H new ATOM 0 HA SER A 20 1.734 -7.430 10.579 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.085 -8.828 7.898 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.119 -9.562 9.489 1.00 0.00 H new ATOM 0 HG SER A 20 -0.130 -8.371 8.166 1.00 0.00 H new ATOM 289 N GLY A 21 3.912 -6.845 8.155 1.00 0.00 N ATOM 290 CA GLY A 21 5.313 -6.557 7.909 1.00 0.00 C ATOM 291 C GLY A 21 6.131 -7.812 7.681 1.00 0.00 C ATOM 292 O GLY A 21 5.945 -8.816 8.368 1.00 0.00 O ATOM 0 H GLY A 21 3.317 -6.814 7.327 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.400 -5.907 7.038 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.723 -6.009 8.758 1.00 0.00 H new ATOM 296 N ALA A 22 7.040 -7.756 6.713 1.00 0.00 N ATOM 297 CA ALA A 22 7.890 -8.897 6.396 1.00 0.00 C ATOM 298 C ALA A 22 9.358 -8.490 6.343 1.00 0.00 C ATOM 299 O ALA A 22 9.683 -7.303 6.291 1.00 0.00 O ATOM 300 CB ALA A 22 7.465 -9.521 5.075 1.00 0.00 C ATOM 0 H ALA A 22 7.207 -6.932 6.135 1.00 0.00 H new ATOM 0 HA ALA A 22 7.774 -9.636 7.188 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.108 -10.372 4.851 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.431 -9.857 5.148 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.551 -8.781 4.279 1.00 0.00 H new ATOM 306 N THR A 23 10.244 -9.481 6.359 1.00 0.00 N ATOM 307 CA THR A 23 11.678 -9.226 6.315 1.00 0.00 C ATOM 308 C THR A 23 12.160 -9.043 4.880 1.00 0.00 C ATOM 309 O THR A 23 11.624 -9.650 3.952 1.00 0.00 O ATOM 310 CB THR A 23 12.473 -10.372 6.969 1.00 0.00 C ATOM 311 OG1 THR A 23 11.909 -10.692 8.246 1.00 0.00 O ATOM 312 CG2 THR A 23 13.936 -9.989 7.137 1.00 0.00 C ATOM 0 H THR A 23 9.993 -10.469 6.402 1.00 0.00 H new ATOM 0 HA THR A 23 11.853 -8.307 6.874 1.00 0.00 H new ATOM 0 HB THR A 23 12.415 -11.244 6.317 1.00 0.00 H new ATOM 0 HG1 THR A 23 12.419 -11.422 8.655 1.00 0.00 H new ATOM 0 HG21 THR A 23 14.477 -10.814 7.601 1.00 0.00 H new ATOM 0 HG22 THR A 23 14.370 -9.774 6.161 1.00 0.00 H new ATOM 0 HG23 THR A 23 14.010 -9.105 7.770 1.00 0.00 H new ATOM 320 N PHE A 24 13.175 -8.204 4.704 1.00 0.00 N ATOM 321 CA PHE A 24 13.730 -7.941 3.381 1.00 0.00 C ATOM 322 C PHE A 24 15.139 -7.365 3.487 1.00 0.00 C ATOM 323 O PHE A 24 15.609 -7.040 4.578 1.00 0.00 O ATOM 324 CB PHE A 24 12.828 -6.974 2.610 1.00 0.00 C ATOM 325 CG PHE A 24 11.422 -7.473 2.440 1.00 0.00 C ATOM 326 CD1 PHE A 24 11.156 -8.580 1.651 1.00 0.00 C ATOM 327 CD2 PHE A 24 10.365 -6.835 3.069 1.00 0.00 C ATOM 328 CE1 PHE A 24 9.863 -9.041 1.491 1.00 0.00 C ATOM 329 CE2 PHE A 24 9.070 -7.291 2.914 1.00 0.00 C ATOM 330 CZ PHE A 24 8.819 -8.396 2.125 1.00 0.00 C ATOM 0 H PHE A 24 13.630 -7.694 5.461 1.00 0.00 H new ATOM 0 HA PHE A 24 13.783 -8.887 2.842 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.805 -6.017 3.131 1.00 0.00 H new ATOM 0 HB3 PHE A 24 13.261 -6.791 1.627 1.00 0.00 H new ATOM 0 HD1 PHE A 24 11.969 -9.089 1.155 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.556 -5.971 3.688 1.00 0.00 H new ATOM 0 HE1 PHE A 24 9.669 -9.904 0.871 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.255 -6.784 3.409 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.808 -8.755 2.004 1.00 0.00 H new ATOM 340 N LEU A 25 15.808 -7.243 2.346 1.00 0.00 N ATOM 341 CA LEU A 25 17.164 -6.707 2.308 1.00 0.00 C ATOM 342 C LEU A 25 17.188 -5.331 1.651 1.00 0.00 C ATOM 343 O LEU A 25 16.903 -5.194 0.461 1.00 0.00 O ATOM 344 CB LEU A 25 18.090 -7.662 1.552 1.00 0.00 C ATOM 345 CG LEU A 25 18.410 -8.982 2.254 1.00 0.00 C ATOM 346 CD1 LEU A 25 19.130 -9.930 1.306 1.00 0.00 C ATOM 347 CD2 LEU A 25 19.247 -8.735 3.501 1.00 0.00 C ATOM 0 H LEU A 25 15.434 -7.508 1.435 1.00 0.00 H new ATOM 0 HA LEU A 25 17.517 -6.605 3.334 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.637 -7.887 0.587 1.00 0.00 H new ATOM 0 HB3 LEU A 25 19.028 -7.144 1.351 1.00 0.00 H new ATOM 0 HG LEU A 25 17.472 -9.446 2.557 1.00 0.00 H new ATOM 0 HD11 LEU A 25 19.350 -10.864 1.823 1.00 0.00 H new ATOM 0 HD12 LEU A 25 18.496 -10.133 0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 25 20.061 -9.473 0.972 1.00 0.00 H new ATOM 0 HD21 LEU A 25 19.465 -9.686 3.987 1.00 0.00 H new ATOM 0 HD22 LEU A 25 20.181 -8.248 3.222 1.00 0.00 H new ATOM 0 HD23 LEU A 25 18.695 -8.094 4.189 1.00 0.00 H new ATOM 359 N VAL A 26 17.532 -4.313 2.434 1.00 0.00 N ATOM 360 CA VAL A 26 17.597 -2.947 1.927 1.00 0.00 C ATOM 361 C VAL A 26 19.031 -2.551 1.596 1.00 0.00 C ATOM 362 O VAL A 26 19.896 -2.517 2.471 1.00 0.00 O ATOM 363 CB VAL A 26 17.021 -1.944 2.944 1.00 0.00 C ATOM 364 CG1 VAL A 26 17.177 -0.519 2.435 1.00 0.00 C ATOM 365 CG2 VAL A 26 15.561 -2.258 3.235 1.00 0.00 C ATOM 0 H VAL A 26 17.770 -4.408 3.421 1.00 0.00 H new ATOM 0 HA VAL A 26 16.996 -2.918 1.018 1.00 0.00 H new ATOM 0 HB VAL A 26 17.581 -2.036 3.875 1.00 0.00 H new ATOM 0 HG11 VAL A 26 16.764 0.176 3.167 1.00 0.00 H new ATOM 0 HG12 VAL A 26 18.234 -0.301 2.283 1.00 0.00 H new ATOM 0 HG13 VAL A 26 16.644 -0.410 1.490 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.171 -1.539 3.956 1.00 0.00 H new ATOM 0 HG22 VAL A 26 14.985 -2.196 2.312 1.00 0.00 H new ATOM 0 HG23 VAL A 26 15.480 -3.264 3.646 1.00 0.00 H new ATOM 375 N THR A 27 19.278 -2.252 0.324 1.00 0.00 N ATOM 376 CA THR A 27 20.607 -1.859 -0.125 1.00 0.00 C ATOM 377 C THR A 27 20.704 -0.348 -0.300 1.00 0.00 C ATOM 378 O THR A 27 20.240 0.203 -1.298 1.00 0.00 O ATOM 379 CB THR A 27 20.976 -2.543 -1.455 1.00 0.00 C ATOM 380 OG1 THR A 27 20.501 -3.894 -1.460 1.00 0.00 O ATOM 381 CG2 THR A 27 22.482 -2.530 -1.671 1.00 0.00 C ATOM 0 H THR A 27 18.574 -2.275 -0.413 1.00 0.00 H new ATOM 0 HA THR A 27 21.308 -2.178 0.646 1.00 0.00 H new ATOM 0 HB THR A 27 20.503 -1.989 -2.266 1.00 0.00 H new ATOM 0 HG1 THR A 27 20.738 -4.321 -2.310 1.00 0.00 H new ATOM 0 HG21 THR A 27 22.718 -3.018 -2.616 1.00 0.00 H new ATOM 0 HG22 THR A 27 22.837 -1.500 -1.696 1.00 0.00 H new ATOM 0 HG23 THR A 27 22.971 -3.062 -0.855 1.00 0.00 H new ATOM 389 N PHE A 28 21.312 0.318 0.677 1.00 0.00 N ATOM 390 CA PHE A 28 21.469 1.767 0.630 1.00 0.00 C ATOM 391 C PHE A 28 22.691 2.155 -0.197 1.00 0.00 C ATOM 392 O PHE A 28 23.712 1.468 -0.178 1.00 0.00 O ATOM 393 CB PHE A 28 21.598 2.333 2.046 1.00 0.00 C ATOM 394 CG PHE A 28 20.286 2.444 2.769 1.00 0.00 C ATOM 395 CD1 PHE A 28 19.263 3.226 2.257 1.00 0.00 C ATOM 396 CD2 PHE A 28 20.075 1.767 3.959 1.00 0.00 C ATOM 397 CE1 PHE A 28 18.055 3.331 2.921 1.00 0.00 C ATOM 398 CE2 PHE A 28 18.869 1.867 4.626 1.00 0.00 C ATOM 399 CZ PHE A 28 17.857 2.650 4.106 1.00 0.00 C ATOM 0 H PHE A 28 21.703 -0.122 1.510 1.00 0.00 H new ATOM 0 HA PHE A 28 20.582 2.188 0.156 1.00 0.00 H new ATOM 0 HB2 PHE A 28 22.269 1.697 2.623 1.00 0.00 H new ATOM 0 HB3 PHE A 28 22.060 3.319 1.994 1.00 0.00 H new ATOM 0 HD1 PHE A 28 19.411 3.759 1.329 1.00 0.00 H new ATOM 0 HD2 PHE A 28 20.863 1.153 4.371 1.00 0.00 H new ATOM 0 HE1 PHE A 28 17.266 3.946 2.513 1.00 0.00 H new ATOM 0 HE2 PHE A 28 18.718 1.334 5.553 1.00 0.00 H new ATOM 0 HZ PHE A 28 16.913 2.730 4.625 1.00 0.00 H new ATOM 409 N GLY A 29 22.578 3.262 -0.926 1.00 0.00 N ATOM 410 CA GLY A 29 23.679 3.722 -1.751 1.00 0.00 C ATOM 411 C GLY A 29 25.006 3.686 -1.020 1.00 0.00 C ATOM 412 O GLY A 29 26.042 3.386 -1.613 1.00 0.00 O ATOM 0 H GLY A 29 21.744 3.848 -0.959 1.00 0.00 H new ATOM 0 HA2 GLY A 29 23.743 3.101 -2.645 1.00 0.00 H new ATOM 0 HA3 GLY A 29 23.479 4.740 -2.084 1.00 0.00 H new ATOM 416 N ASN A 30 24.977 3.995 0.273 1.00 0.00 N ATOM 417 CA ASN A 30 26.188 3.999 1.086 1.00 0.00 C ATOM 418 C ASN A 30 26.647 2.575 1.384 1.00 0.00 C ATOM 419 O ASN A 30 27.798 2.218 1.133 1.00 0.00 O ATOM 420 CB ASN A 30 25.946 4.753 2.395 1.00 0.00 C ATOM 421 CG ASN A 30 27.091 4.592 3.375 1.00 0.00 C ATOM 422 OD1 ASN A 30 28.163 5.170 3.195 1.00 0.00 O ATOM 423 ND2 ASN A 30 26.869 3.802 4.419 1.00 0.00 N ATOM 0 H ASN A 30 24.128 4.246 0.780 1.00 0.00 H new ATOM 0 HA ASN A 30 26.972 4.505 0.523 1.00 0.00 H new ATOM 0 HB2 ASN A 30 25.802 5.812 2.180 1.00 0.00 H new ATOM 0 HB3 ASN A 30 25.025 4.393 2.854 1.00 0.00 H new ATOM 0 HD21 ASN A 30 27.603 3.654 5.112 1.00 0.00 H new ATOM 0 HD22 ASN A 30 25.965 3.343 4.528 1.00 0.00 H new ATOM 430 N SER A 31 25.739 1.766 1.920 1.00 0.00 N ATOM 431 CA SER A 31 26.051 0.381 2.255 1.00 0.00 C ATOM 432 C SER A 31 26.156 -0.473 0.995 1.00 0.00 C ATOM 433 O SER A 31 25.188 -0.620 0.251 1.00 0.00 O ATOM 434 CB SER A 31 24.982 -0.194 3.187 1.00 0.00 C ATOM 435 OG SER A 31 24.816 0.620 4.335 1.00 0.00 O ATOM 0 H SER A 31 24.781 2.045 2.132 1.00 0.00 H new ATOM 0 HA SER A 31 27.014 0.365 2.765 1.00 0.00 H new ATOM 0 HB2 SER A 31 24.035 -0.274 2.654 1.00 0.00 H new ATOM 0 HB3 SER A 31 25.263 -1.203 3.490 1.00 0.00 H new ATOM 0 HG SER A 31 24.127 0.233 4.914 1.00 0.00 H new ATOM 441 N GLU A 32 27.340 -1.032 0.764 1.00 0.00 N ATOM 442 CA GLU A 32 27.572 -1.870 -0.406 1.00 0.00 C ATOM 443 C GLU A 32 27.055 -3.286 -0.172 1.00 0.00 C ATOM 444 O GLU A 32 27.041 -4.113 -1.084 1.00 0.00 O ATOM 445 CB GLU A 32 29.064 -1.910 -0.745 1.00 0.00 C ATOM 446 CG GLU A 32 29.935 -2.399 0.400 1.00 0.00 C ATOM 447 CD GLU A 32 31.231 -3.024 -0.079 1.00 0.00 C ATOM 448 OE1 GLU A 32 31.201 -4.194 -0.515 1.00 0.00 O ATOM 449 OE2 GLU A 32 32.276 -2.343 -0.017 1.00 0.00 O ATOM 0 H GLU A 32 28.152 -0.920 1.371 1.00 0.00 H new ATOM 0 HA GLU A 32 27.027 -1.437 -1.245 1.00 0.00 H new ATOM 0 HB2 GLU A 32 29.215 -2.559 -1.608 1.00 0.00 H new ATOM 0 HB3 GLU A 32 29.389 -0.911 -1.037 1.00 0.00 H new ATOM 0 HG2 GLU A 32 30.162 -1.563 1.062 1.00 0.00 H new ATOM 0 HG3 GLU A 32 29.379 -3.129 0.988 1.00 0.00 H new ATOM 456 N LYS A 33 26.631 -3.559 1.057 1.00 0.00 N ATOM 457 CA LYS A 33 26.112 -4.874 1.413 1.00 0.00 C ATOM 458 C LYS A 33 24.695 -4.768 1.968 1.00 0.00 C ATOM 459 O LYS A 33 24.375 -3.874 2.753 1.00 0.00 O ATOM 460 CB LYS A 33 27.025 -5.544 2.442 1.00 0.00 C ATOM 461 CG LYS A 33 26.295 -6.494 3.377 1.00 0.00 C ATOM 462 CD LYS A 33 27.221 -7.573 3.911 1.00 0.00 C ATOM 463 CE LYS A 33 28.457 -6.973 4.564 1.00 0.00 C ATOM 464 NZ LYS A 33 29.529 -7.988 4.761 1.00 0.00 N ATOM 0 H LYS A 33 26.637 -2.886 1.824 1.00 0.00 H new ATOM 0 HA LYS A 33 26.085 -5.483 0.509 1.00 0.00 H new ATOM 0 HB2 LYS A 33 27.807 -6.093 1.918 1.00 0.00 H new ATOM 0 HB3 LYS A 33 27.518 -4.773 3.034 1.00 0.00 H new ATOM 0 HG2 LYS A 33 25.871 -5.932 4.210 1.00 0.00 H new ATOM 0 HG3 LYS A 33 25.462 -6.957 2.848 1.00 0.00 H new ATOM 0 HD2 LYS A 33 26.686 -8.187 4.636 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.522 -8.232 3.096 1.00 0.00 H new ATOM 0 HE2 LYS A 33 28.836 -6.160 3.945 1.00 0.00 H new ATOM 0 HE3 LYS A 33 28.185 -6.540 5.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 30.354 -7.539 5.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 29.176 -8.752 5.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 29.807 -8.383 3.840 1.00 0.00 H new ATOM 478 N PRO A 34 23.824 -5.700 1.554 1.00 0.00 N ATOM 479 CA PRO A 34 22.428 -5.733 1.999 1.00 0.00 C ATOM 480 C PRO A 34 22.297 -6.123 3.467 1.00 0.00 C ATOM 481 O PRO A 34 23.032 -6.978 3.960 1.00 0.00 O ATOM 482 CB PRO A 34 21.795 -6.801 1.104 1.00 0.00 C ATOM 483 CG PRO A 34 22.928 -7.685 0.710 1.00 0.00 C ATOM 484 CD PRO A 34 24.136 -6.794 0.619 1.00 0.00 C ATOM 0 HA PRO A 34 21.952 -4.755 1.921 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.025 -7.358 1.637 1.00 0.00 H new ATOM 0 HB3 PRO A 34 21.319 -6.355 0.231 1.00 0.00 H new ATOM 0 HG2 PRO A 34 23.080 -8.475 1.445 1.00 0.00 H new ATOM 0 HG3 PRO A 34 22.729 -8.172 -0.245 1.00 0.00 H new ATOM 0 HD2 PRO A 34 25.046 -7.321 0.906 1.00 0.00 H new ATOM 0 HD3 PRO A 34 24.288 -6.425 -0.395 1.00 0.00 H new ATOM 492 N GLU A 35 21.356 -5.490 4.161 1.00 0.00 N ATOM 493 CA GLU A 35 21.130 -5.772 5.574 1.00 0.00 C ATOM 494 C GLU A 35 19.682 -6.188 5.821 1.00 0.00 C ATOM 495 O GLU A 35 18.756 -5.652 5.212 1.00 0.00 O ATOM 496 CB GLU A 35 21.470 -4.545 6.422 1.00 0.00 C ATOM 497 CG GLU A 35 21.312 -4.774 7.916 1.00 0.00 C ATOM 498 CD GLU A 35 22.472 -5.546 8.514 1.00 0.00 C ATOM 499 OE1 GLU A 35 23.616 -5.351 8.052 1.00 0.00 O ATOM 500 OE2 GLU A 35 22.236 -6.344 9.445 1.00 0.00 O ATOM 0 H GLU A 35 20.739 -4.779 3.768 1.00 0.00 H new ATOM 0 HA GLU A 35 21.782 -6.597 5.862 1.00 0.00 H new ATOM 0 HB2 GLU A 35 22.497 -4.245 6.216 1.00 0.00 H new ATOM 0 HB3 GLU A 35 20.829 -3.717 6.120 1.00 0.00 H new ATOM 0 HG2 GLU A 35 21.223 -3.812 8.420 1.00 0.00 H new ATOM 0 HG3 GLU A 35 20.385 -5.317 8.100 1.00 0.00 H new ATOM 507 N THR A 36 19.495 -7.150 6.719 1.00 0.00 N ATOM 508 CA THR A 36 18.162 -7.641 7.046 1.00 0.00 C ATOM 509 C THR A 36 17.335 -6.565 7.740 1.00 0.00 C ATOM 510 O THR A 36 17.558 -6.256 8.910 1.00 0.00 O ATOM 511 CB THR A 36 18.228 -8.886 7.952 1.00 0.00 C ATOM 512 OG1 THR A 36 19.108 -9.861 7.381 1.00 0.00 O ATOM 513 CG2 THR A 36 16.846 -9.491 8.141 1.00 0.00 C ATOM 0 H THR A 36 20.250 -7.605 7.233 1.00 0.00 H new ATOM 0 HA THR A 36 17.685 -7.911 6.104 1.00 0.00 H new ATOM 0 HB THR A 36 18.609 -8.580 8.926 1.00 0.00 H new ATOM 0 HG1 THR A 36 19.146 -10.648 7.963 1.00 0.00 H new ATOM 0 HG21 THR A 36 16.918 -10.368 8.784 1.00 0.00 H new ATOM 0 HG22 THR A 36 16.187 -8.756 8.603 1.00 0.00 H new ATOM 0 HG23 THR A 36 16.441 -9.783 7.172 1.00 0.00 H new ATOM 521 N MET A 37 16.379 -5.999 7.012 1.00 0.00 N ATOM 522 CA MET A 37 15.516 -4.958 7.560 1.00 0.00 C ATOM 523 C MET A 37 14.048 -5.359 7.458 1.00 0.00 C ATOM 524 O MET A 37 13.682 -6.217 6.654 1.00 0.00 O ATOM 525 CB MET A 37 15.748 -3.636 6.826 1.00 0.00 C ATOM 526 CG MET A 37 17.037 -2.937 7.226 1.00 0.00 C ATOM 527 SD MET A 37 17.174 -1.280 6.528 1.00 0.00 S ATOM 528 CE MET A 37 16.452 -0.299 7.841 1.00 0.00 C ATOM 0 H MET A 37 16.182 -6.243 6.041 1.00 0.00 H new ATOM 0 HA MET A 37 15.766 -4.830 8.613 1.00 0.00 H new ATOM 0 HB2 MET A 37 15.764 -3.824 5.752 1.00 0.00 H new ATOM 0 HB3 MET A 37 14.908 -2.970 7.020 1.00 0.00 H new ATOM 0 HG2 MET A 37 17.090 -2.875 8.313 1.00 0.00 H new ATOM 0 HG3 MET A 37 17.887 -3.536 6.899 1.00 0.00 H new ATOM 0 HE1 MET A 37 16.170 0.679 7.451 1.00 0.00 H new ATOM 0 HE2 MET A 37 15.567 -0.804 8.228 1.00 0.00 H new ATOM 0 HE3 MET A 37 17.179 -0.174 8.644 1.00 0.00 H new ATOM 538 N THR A 38 13.210 -4.733 8.278 1.00 0.00 N ATOM 539 CA THR A 38 11.782 -5.026 8.282 1.00 0.00 C ATOM 540 C THR A 38 10.987 -3.890 7.649 1.00 0.00 C ATOM 541 O THR A 38 11.041 -2.749 8.109 1.00 0.00 O ATOM 542 CB THR A 38 11.262 -5.268 9.711 1.00 0.00 C ATOM 543 OG1 THR A 38 12.079 -6.239 10.372 1.00 0.00 O ATOM 544 CG2 THR A 38 9.817 -5.745 9.687 1.00 0.00 C ATOM 0 H THR A 38 13.496 -4.019 8.948 1.00 0.00 H new ATOM 0 HA THR A 38 11.644 -5.934 7.695 1.00 0.00 H new ATOM 0 HB THR A 38 11.308 -4.325 10.255 1.00 0.00 H new ATOM 0 HG1 THR A 38 11.742 -6.386 11.281 1.00 0.00 H new ATOM 0 HG21 THR A 38 9.471 -5.909 10.708 1.00 0.00 H new ATOM 0 HG22 THR A 38 9.193 -4.990 9.209 1.00 0.00 H new ATOM 0 HG23 THR A 38 9.751 -6.678 9.127 1.00 0.00 H new ATOM 552 N CYS A 39 10.248 -4.209 6.592 1.00 0.00 N ATOM 553 CA CYS A 39 9.440 -3.214 5.895 1.00 0.00 C ATOM 554 C CYS A 39 7.954 -3.454 6.137 1.00 0.00 C ATOM 555 O CYS A 39 7.443 -4.546 5.888 1.00 0.00 O ATOM 556 CB CYS A 39 9.737 -3.245 4.395 1.00 0.00 C ATOM 557 SG CYS A 39 11.495 -3.140 3.988 1.00 0.00 S ATOM 0 H CYS A 39 10.192 -5.149 6.199 1.00 0.00 H new ATOM 0 HA CYS A 39 9.699 -2.231 6.289 1.00 0.00 H new ATOM 0 HB2 CYS A 39 9.332 -4.165 3.974 1.00 0.00 H new ATOM 0 HB3 CYS A 39 9.214 -2.418 3.915 1.00 0.00 H new ATOM 0 HG CYS A 39 11.655 -2.376 2.948 1.00 0.00 H new ATOM 563 N ARG A 40 7.265 -2.427 6.625 1.00 0.00 N ATOM 564 CA ARG A 40 5.838 -2.528 6.904 1.00 0.00 C ATOM 565 C ARG A 40 5.130 -1.211 6.598 1.00 0.00 C ATOM 566 O ARG A 40 5.774 -0.181 6.392 1.00 0.00 O ATOM 567 CB ARG A 40 5.608 -2.915 8.366 1.00 0.00 C ATOM 568 CG ARG A 40 5.911 -1.794 9.347 1.00 0.00 C ATOM 569 CD ARG A 40 5.879 -2.288 10.785 1.00 0.00 C ATOM 570 NE ARG A 40 6.721 -1.479 11.661 1.00 0.00 N ATOM 571 CZ ARG A 40 6.741 -1.605 12.984 1.00 0.00 C ATOM 572 NH1 ARG A 40 5.970 -2.505 13.579 1.00 0.00 N ATOM 573 NH2 ARG A 40 7.534 -0.831 13.713 1.00 0.00 N ATOM 0 H ARG A 40 7.672 -1.516 6.835 1.00 0.00 H new ATOM 0 HA ARG A 40 5.422 -3.303 6.261 1.00 0.00 H new ATOM 0 HB2 ARG A 40 4.571 -3.226 8.492 1.00 0.00 H new ATOM 0 HB3 ARG A 40 6.231 -3.776 8.608 1.00 0.00 H new ATOM 0 HG2 ARG A 40 6.892 -1.372 9.128 1.00 0.00 H new ATOM 0 HG3 ARG A 40 5.184 -0.992 9.220 1.00 0.00 H new ATOM 0 HD2 ARG A 40 4.853 -2.270 11.151 1.00 0.00 H new ATOM 0 HD3 ARG A 40 6.212 -3.325 10.819 1.00 0.00 H new ATOM 0 HE ARG A 40 7.327 -0.778 11.234 1.00 0.00 H new ATOM 0 HH11 ARG A 40 5.360 -3.102 13.021 1.00 0.00 H new ATOM 0 HH12 ARG A 40 5.987 -2.600 14.594 1.00 0.00 H new ATOM 0 HH21 ARG A 40 8.129 -0.138 13.258 1.00 0.00 H new ATOM 0 HH22 ARG A 40 7.549 -0.928 14.728 1.00 0.00 H new ATOM 587 N LEU A 41 3.803 -1.252 6.568 1.00 0.00 N ATOM 588 CA LEU A 41 3.007 -0.063 6.286 1.00 0.00 C ATOM 589 C LEU A 41 2.401 0.503 7.566 1.00 0.00 C ATOM 590 O LEU A 41 2.025 -0.244 8.470 1.00 0.00 O ATOM 591 CB LEU A 41 1.898 -0.392 5.285 1.00 0.00 C ATOM 592 CG LEU A 41 2.259 -0.238 3.808 1.00 0.00 C ATOM 593 CD1 LEU A 41 1.323 -1.065 2.940 1.00 0.00 C ATOM 594 CD2 LEU A 41 2.214 1.227 3.398 1.00 0.00 C ATOM 0 H LEU A 41 3.255 -2.096 6.736 1.00 0.00 H new ATOM 0 HA LEU A 41 3.666 0.690 5.854 1.00 0.00 H new ATOM 0 HB2 LEU A 41 1.577 -1.420 5.454 1.00 0.00 H new ATOM 0 HB3 LEU A 41 1.042 0.249 5.498 1.00 0.00 H new ATOM 0 HG LEU A 41 3.275 -0.605 3.662 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.596 -0.943 1.892 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.405 -2.116 3.216 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.297 -0.730 3.090 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.474 1.318 2.343 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.210 1.619 3.560 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.926 1.795 3.997 1.00 0.00 H new ATOM 606 N SER A 42 2.307 1.827 7.636 1.00 0.00 N ATOM 607 CA SER A 42 1.748 2.493 8.807 1.00 0.00 C ATOM 608 C SER A 42 0.332 1.998 9.089 1.00 0.00 C ATOM 609 O SER A 42 -0.230 1.220 8.319 1.00 0.00 O ATOM 610 CB SER A 42 1.738 4.009 8.601 1.00 0.00 C ATOM 611 OG SER A 42 1.487 4.688 9.819 1.00 0.00 O ATOM 0 H SER A 42 2.611 2.460 6.896 1.00 0.00 H new ATOM 0 HA SER A 42 2.376 2.254 9.665 1.00 0.00 H new ATOM 0 HB2 SER A 42 2.696 4.330 8.193 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.975 4.275 7.869 1.00 0.00 H new ATOM 0 HG SER A 42 2.309 4.720 10.351 1.00 0.00 H new ATOM 617 N ASN A 43 -0.237 2.455 10.200 1.00 0.00 N ATOM 618 CA ASN A 43 -1.586 2.058 10.586 1.00 0.00 C ATOM 619 C ASN A 43 -2.537 2.134 9.395 1.00 0.00 C ATOM 620 O ASN A 43 -3.221 1.164 9.072 1.00 0.00 O ATOM 621 CB ASN A 43 -2.098 2.951 11.718 1.00 0.00 C ATOM 622 CG ASN A 43 -3.086 2.233 12.618 1.00 0.00 C ATOM 623 OD1 ASN A 43 -3.405 1.064 12.401 1.00 0.00 O ATOM 624 ND2 ASN A 43 -3.575 2.933 13.636 1.00 0.00 N ATOM 0 H ASN A 43 0.215 3.100 10.848 1.00 0.00 H new ATOM 0 HA ASN A 43 -1.549 1.026 10.934 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -1.254 3.298 12.314 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -2.573 3.835 11.293 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -4.243 2.504 14.276 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -3.282 3.900 13.778 1.00 0.00 H new ATOM 631 N ASN A 44 -2.573 3.293 8.746 1.00 0.00 N ATOM 632 CA ASN A 44 -3.439 3.496 7.590 1.00 0.00 C ATOM 633 C ASN A 44 -2.675 3.267 6.290 1.00 0.00 C ATOM 634 O ASN A 44 -3.193 3.517 5.202 1.00 0.00 O ATOM 635 CB ASN A 44 -4.027 4.908 7.608 1.00 0.00 C ATOM 636 CG ASN A 44 -5.343 4.997 6.860 1.00 0.00 C ATOM 637 OD1 ASN A 44 -5.367 5.179 5.643 1.00 0.00 O ATOM 638 ND2 ASN A 44 -6.447 4.869 7.587 1.00 0.00 N ATOM 0 H ASN A 44 -2.013 4.106 9.001 1.00 0.00 H new ATOM 0 HA ASN A 44 -4.251 2.771 7.645 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -4.177 5.223 8.641 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -3.313 5.602 7.164 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -7.362 4.920 7.139 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -6.380 4.719 8.594 1.00 0.00 H new ATOM 645 N GLN A 45 -1.440 2.792 6.412 1.00 0.00 N ATOM 646 CA GLN A 45 -0.604 2.530 5.246 1.00 0.00 C ATOM 647 C GLN A 45 -0.320 3.818 4.480 1.00 0.00 C ATOM 648 O GLN A 45 -0.385 3.847 3.251 1.00 0.00 O ATOM 649 CB GLN A 45 -1.280 1.513 4.325 1.00 0.00 C ATOM 650 CG GLN A 45 -2.011 0.408 5.071 1.00 0.00 C ATOM 651 CD GLN A 45 -3.103 -0.233 4.240 1.00 0.00 C ATOM 652 OE1 GLN A 45 -4.197 -0.507 4.735 1.00 0.00 O ATOM 653 NE2 GLN A 45 -2.813 -0.478 2.967 1.00 0.00 N ATOM 0 H GLN A 45 -0.996 2.581 7.306 1.00 0.00 H new ATOM 0 HA GLN A 45 0.344 2.119 5.595 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -1.987 2.034 3.680 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -0.527 1.065 3.677 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -1.295 -0.356 5.374 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -2.446 0.817 5.983 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -1.894 -0.235 2.597 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -3.509 -0.909 2.359 1.00 0.00 H new ATOM 662 N ARG A 46 -0.005 4.880 5.214 1.00 0.00 N ATOM 663 CA ARG A 46 0.288 6.171 4.603 1.00 0.00 C ATOM 664 C ARG A 46 1.793 6.399 4.508 1.00 0.00 C ATOM 665 O ARG A 46 2.249 7.339 3.857 1.00 0.00 O ATOM 666 CB ARG A 46 -0.360 7.299 5.409 1.00 0.00 C ATOM 667 CG ARG A 46 -1.876 7.327 5.308 1.00 0.00 C ATOM 668 CD ARG A 46 -2.473 8.418 6.183 1.00 0.00 C ATOM 669 NE ARG A 46 -3.914 8.255 6.354 1.00 0.00 N ATOM 670 CZ ARG A 46 -4.703 9.191 6.871 1.00 0.00 C ATOM 671 NH1 ARG A 46 -4.193 10.349 7.265 1.00 0.00 N ATOM 672 NH2 ARG A 46 -6.006 8.968 6.994 1.00 0.00 N ATOM 0 H ARG A 46 0.054 4.872 6.232 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.126 6.170 3.595 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -0.076 7.195 6.456 1.00 0.00 H new ATOM 0 HB3 ARG A 46 0.036 8.254 5.064 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.170 7.490 4.271 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -2.279 6.359 5.606 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -1.988 8.405 7.159 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -2.269 9.392 5.738 1.00 0.00 H new ATOM 0 HE ARG A 46 -4.338 7.375 6.061 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -3.192 10.524 7.172 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -4.801 11.066 7.661 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -6.402 8.078 6.692 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.611 9.687 7.391 1.00 0.00 H new ATOM 686 N TYR A 47 2.560 5.534 5.163 1.00 0.00 N ATOM 687 CA TYR A 47 4.014 5.642 5.155 1.00 0.00 C ATOM 688 C TYR A 47 4.663 4.285 5.410 1.00 0.00 C ATOM 689 O TYR A 47 4.036 3.378 5.959 1.00 0.00 O ATOM 690 CB TYR A 47 4.477 6.649 6.209 1.00 0.00 C ATOM 691 CG TYR A 47 3.872 8.024 6.041 1.00 0.00 C ATOM 692 CD1 TYR A 47 2.532 8.255 6.328 1.00 0.00 C ATOM 693 CD2 TYR A 47 4.640 9.093 5.595 1.00 0.00 C ATOM 694 CE1 TYR A 47 1.975 9.510 6.175 1.00 0.00 C ATOM 695 CE2 TYR A 47 4.092 10.351 5.440 1.00 0.00 C ATOM 696 CZ TYR A 47 2.759 10.555 5.731 1.00 0.00 C ATOM 697 OH TYR A 47 2.208 11.806 5.579 1.00 0.00 O ATOM 0 H TYR A 47 2.199 4.750 5.706 1.00 0.00 H new ATOM 0 HA TYR A 47 4.322 5.991 4.169 1.00 0.00 H new ATOM 0 HB2 TYR A 47 4.224 6.269 7.199 1.00 0.00 H new ATOM 0 HB3 TYR A 47 5.563 6.732 6.168 1.00 0.00 H new ATOM 0 HD1 TYR A 47 1.916 7.440 6.677 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.684 8.937 5.366 1.00 0.00 H new ATOM 0 HE1 TYR A 47 0.932 9.672 6.402 1.00 0.00 H new ATOM 0 HE2 TYR A 47 4.704 11.171 5.093 1.00 0.00 H new ATOM 0 HH TYR A 47 2.894 12.429 5.260 1.00 0.00 H new ATOM 707 N LEU A 48 5.922 4.155 5.010 1.00 0.00 N ATOM 708 CA LEU A 48 6.659 2.909 5.195 1.00 0.00 C ATOM 709 C LEU A 48 7.714 3.058 6.287 1.00 0.00 C ATOM 710 O LEU A 48 8.405 4.075 6.363 1.00 0.00 O ATOM 711 CB LEU A 48 7.322 2.486 3.884 1.00 0.00 C ATOM 712 CG LEU A 48 6.382 1.979 2.789 1.00 0.00 C ATOM 713 CD1 LEU A 48 7.136 1.796 1.481 1.00 0.00 C ATOM 714 CD2 LEU A 48 5.722 0.676 3.214 1.00 0.00 C ATOM 0 H LEU A 48 6.455 4.897 4.555 1.00 0.00 H new ATOM 0 HA LEU A 48 5.951 2.139 5.502 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.880 3.336 3.491 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.048 1.703 4.103 1.00 0.00 H new ATOM 0 HG LEU A 48 5.601 2.724 2.633 1.00 0.00 H new ATOM 0 HD11 LEU A 48 6.451 1.435 0.714 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.560 2.750 1.169 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.938 1.071 1.622 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.057 0.330 2.423 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.488 -0.077 3.399 1.00 0.00 H new ATOM 0 HD23 LEU A 48 5.147 0.840 4.126 1.00 0.00 H new ATOM 726 N PHE A 49 7.835 2.037 7.129 1.00 0.00 N ATOM 727 CA PHE A 49 8.807 2.054 8.216 1.00 0.00 C ATOM 728 C PHE A 49 9.844 0.949 8.035 1.00 0.00 C ATOM 729 O PHE A 49 9.515 -0.166 7.628 1.00 0.00 O ATOM 730 CB PHE A 49 8.100 1.891 9.563 1.00 0.00 C ATOM 731 CG PHE A 49 6.993 2.882 9.783 1.00 0.00 C ATOM 732 CD1 PHE A 49 7.054 4.145 9.218 1.00 0.00 C ATOM 733 CD2 PHE A 49 5.892 2.550 10.555 1.00 0.00 C ATOM 734 CE1 PHE A 49 6.037 5.060 9.418 1.00 0.00 C ATOM 735 CE2 PHE A 49 4.871 3.460 10.758 1.00 0.00 C ATOM 736 CZ PHE A 49 4.945 4.716 10.190 1.00 0.00 C ATOM 0 H PHE A 49 7.272 1.188 7.080 1.00 0.00 H new ATOM 0 HA PHE A 49 9.320 3.016 8.197 1.00 0.00 H new ATOM 0 HB2 PHE A 49 7.693 0.882 9.631 1.00 0.00 H new ATOM 0 HB3 PHE A 49 8.833 1.993 10.364 1.00 0.00 H new ATOM 0 HD1 PHE A 49 7.906 4.418 8.614 1.00 0.00 H new ATOM 0 HD2 PHE A 49 5.830 1.569 11.003 1.00 0.00 H new ATOM 0 HE1 PHE A 49 6.097 6.042 8.971 1.00 0.00 H new ATOM 0 HE2 PHE A 49 4.017 3.188 11.360 1.00 0.00 H new ATOM 0 HZ PHE A 49 4.150 5.429 10.349 1.00 0.00 H new ATOM 746 N LEU A 50 11.097 1.266 8.341 1.00 0.00 N ATOM 747 CA LEU A 50 12.183 0.300 8.213 1.00 0.00 C ATOM 748 C LEU A 50 12.929 0.142 9.534 1.00 0.00 C ATOM 749 O LEU A 50 13.152 1.116 10.253 1.00 0.00 O ATOM 750 CB LEU A 50 13.154 0.739 7.115 1.00 0.00 C ATOM 751 CG LEU A 50 12.519 1.192 5.800 1.00 0.00 C ATOM 752 CD1 LEU A 50 13.547 1.893 4.925 1.00 0.00 C ATOM 753 CD2 LEU A 50 11.911 0.006 5.065 1.00 0.00 C ATOM 0 H LEU A 50 11.386 2.184 8.679 1.00 0.00 H new ATOM 0 HA LEU A 50 11.751 -0.664 7.944 1.00 0.00 H new ATOM 0 HB2 LEU A 50 13.763 1.556 7.502 1.00 0.00 H new ATOM 0 HB3 LEU A 50 13.830 -0.089 6.903 1.00 0.00 H new ATOM 0 HG LEU A 50 11.722 1.900 6.028 1.00 0.00 H new ATOM 0 HD11 LEU A 50 13.077 2.208 3.993 1.00 0.00 H new ATOM 0 HD12 LEU A 50 13.936 2.766 5.449 1.00 0.00 H new ATOM 0 HD13 LEU A 50 14.365 1.208 4.705 1.00 0.00 H new ATOM 0 HD21 LEU A 50 11.464 0.347 4.131 1.00 0.00 H new ATOM 0 HD22 LEU A 50 12.689 -0.726 4.848 1.00 0.00 H new ATOM 0 HD23 LEU A 50 11.144 -0.454 5.688 1.00 0.00 H new ATOM 765 N ASP A 51 13.315 -1.091 9.845 1.00 0.00 N ATOM 766 CA ASP A 51 14.039 -1.377 11.078 1.00 0.00 C ATOM 767 C ASP A 51 15.385 -2.030 10.778 1.00 0.00 C ATOM 768 O ASP A 51 15.467 -2.977 9.997 1.00 0.00 O ATOM 769 CB ASP A 51 13.208 -2.286 11.984 1.00 0.00 C ATOM 770 CG ASP A 51 14.069 -3.178 12.857 1.00 0.00 C ATOM 771 OD1 ASP A 51 14.642 -4.153 12.327 1.00 0.00 O ATOM 772 OD2 ASP A 51 14.171 -2.900 14.070 1.00 0.00 O ATOM 0 H ASP A 51 13.139 -1.908 9.260 1.00 0.00 H new ATOM 0 HA ASP A 51 14.219 -0.433 11.592 1.00 0.00 H new ATOM 0 HB2 ASP A 51 12.566 -1.674 12.617 1.00 0.00 H new ATOM 0 HB3 ASP A 51 12.554 -2.905 11.371 1.00 0.00 H new ATOM 777 N GLY A 52 16.439 -1.516 11.404 1.00 0.00 N ATOM 778 CA GLY A 52 17.767 -2.061 11.190 1.00 0.00 C ATOM 779 C GLY A 52 18.863 -1.071 11.534 1.00 0.00 C ATOM 780 O GLY A 52 18.845 -0.461 12.603 1.00 0.00 O ATOM 0 H GLY A 52 16.397 -0.732 12.055 1.00 0.00 H new ATOM 0 HA2 GLY A 52 17.890 -2.959 11.796 1.00 0.00 H new ATOM 0 HA3 GLY A 52 17.869 -2.363 10.148 1.00 0.00 H new ATOM 784 N ASP A 53 19.819 -0.911 10.626 1.00 0.00 N ATOM 785 CA ASP A 53 20.928 0.012 10.838 1.00 0.00 C ATOM 786 C ASP A 53 20.471 1.241 11.618 1.00 0.00 C ATOM 787 O ASP A 53 21.114 1.650 12.584 1.00 0.00 O ATOM 788 CB ASP A 53 21.528 0.438 9.497 1.00 0.00 C ATOM 789 CG ASP A 53 22.161 -0.721 8.752 1.00 0.00 C ATOM 790 OD1 ASP A 53 22.987 -1.436 9.357 1.00 0.00 O ATOM 791 OD2 ASP A 53 21.829 -0.913 7.564 1.00 0.00 O ATOM 0 H ASP A 53 19.849 -1.408 9.736 1.00 0.00 H new ATOM 0 HA ASP A 53 21.691 -0.503 11.422 1.00 0.00 H new ATOM 0 HB2 ASP A 53 20.748 0.882 8.878 1.00 0.00 H new ATOM 0 HB3 ASP A 53 22.278 1.210 9.667 1.00 0.00 H new ATOM 796 N SER A 54 19.356 1.826 11.191 1.00 0.00 N ATOM 797 CA SER A 54 18.815 3.011 11.846 1.00 0.00 C ATOM 798 C SER A 54 17.326 3.164 11.550 1.00 0.00 C ATOM 799 O SER A 54 16.752 2.393 10.779 1.00 0.00 O ATOM 800 CB SER A 54 19.568 4.261 11.388 1.00 0.00 C ATOM 801 OG SER A 54 20.713 4.491 12.191 1.00 0.00 O ATOM 0 H SER A 54 18.810 1.498 10.394 1.00 0.00 H new ATOM 0 HA SER A 54 18.943 2.891 12.922 1.00 0.00 H new ATOM 0 HB2 SER A 54 19.868 4.147 10.346 1.00 0.00 H new ATOM 0 HB3 SER A 54 18.906 5.126 11.437 1.00 0.00 H new ATOM 0 HG SER A 54 21.082 3.633 12.488 1.00 0.00 H new ATOM 807 N HIS A 55 16.706 4.164 12.168 1.00 0.00 N ATOM 808 CA HIS A 55 15.283 4.419 11.971 1.00 0.00 C ATOM 809 C HIS A 55 15.024 5.017 10.592 1.00 0.00 C ATOM 810 O HIS A 55 15.001 6.237 10.428 1.00 0.00 O ATOM 811 CB HIS A 55 14.758 5.360 13.056 1.00 0.00 C ATOM 812 CG HIS A 55 14.621 4.710 14.398 1.00 0.00 C ATOM 813 ND1 HIS A 55 13.876 3.569 14.609 1.00 0.00 N ATOM 814 CD2 HIS A 55 15.140 5.047 15.602 1.00 0.00 C ATOM 815 CE1 HIS A 55 13.941 3.233 15.885 1.00 0.00 C ATOM 816 NE2 HIS A 55 14.703 4.114 16.509 1.00 0.00 N ATOM 0 H HIS A 55 17.166 4.811 12.809 1.00 0.00 H new ATOM 0 HA HIS A 55 14.755 3.468 12.039 1.00 0.00 H new ATOM 0 HB2 HIS A 55 15.431 6.213 13.142 1.00 0.00 H new ATOM 0 HB3 HIS A 55 13.787 5.749 12.749 1.00 0.00 H new ATOM 0 HD2 HIS A 55 15.779 5.892 15.810 1.00 0.00 H new ATOM 0 HE1 HIS A 55 13.454 2.383 16.340 1.00 0.00 H new ATOM 0 HE2 HIS A 55 14.930 4.103 17.503 1.00 0.00 H new ATOM 824 N TYR A 56 14.831 4.151 9.604 1.00 0.00 N ATOM 825 CA TYR A 56 14.577 4.594 8.238 1.00 0.00 C ATOM 826 C TYR A 56 13.095 4.477 7.894 1.00 0.00 C ATOM 827 O TYR A 56 12.401 3.589 8.387 1.00 0.00 O ATOM 828 CB TYR A 56 15.408 3.773 7.250 1.00 0.00 C ATOM 829 CG TYR A 56 16.792 4.333 7.012 1.00 0.00 C ATOM 830 CD1 TYR A 56 16.968 5.643 6.584 1.00 0.00 C ATOM 831 CD2 TYR A 56 17.923 3.552 7.213 1.00 0.00 C ATOM 832 CE1 TYR A 56 18.231 6.159 6.364 1.00 0.00 C ATOM 833 CE2 TYR A 56 19.189 4.059 6.997 1.00 0.00 C ATOM 834 CZ TYR A 56 19.338 5.363 6.573 1.00 0.00 C ATOM 835 OH TYR A 56 20.598 5.872 6.355 1.00 0.00 O ATOM 0 H TYR A 56 14.846 3.138 9.723 1.00 0.00 H new ATOM 0 HA TYR A 56 14.867 5.642 8.163 1.00 0.00 H new ATOM 0 HB2 TYR A 56 15.497 2.753 7.623 1.00 0.00 H new ATOM 0 HB3 TYR A 56 14.878 3.720 6.299 1.00 0.00 H new ATOM 0 HD1 TYR A 56 16.103 6.269 6.420 1.00 0.00 H new ATOM 0 HD2 TYR A 56 17.810 2.530 7.544 1.00 0.00 H new ATOM 0 HE1 TYR A 56 18.351 7.179 6.030 1.00 0.00 H new ATOM 0 HE2 TYR A 56 20.058 3.438 7.159 1.00 0.00 H new ATOM 0 HH TYR A 56 21.267 5.183 6.549 1.00 0.00 H new ATOM 845 N GLU A 57 12.618 5.381 7.043 1.00 0.00 N ATOM 846 CA GLU A 57 11.219 5.379 6.633 1.00 0.00 C ATOM 847 C GLU A 57 11.058 5.997 5.247 1.00 0.00 C ATOM 848 O GLU A 57 11.832 6.869 4.851 1.00 0.00 O ATOM 849 CB GLU A 57 10.367 6.145 7.647 1.00 0.00 C ATOM 850 CG GLU A 57 10.843 7.567 7.892 1.00 0.00 C ATOM 851 CD GLU A 57 11.907 7.649 8.969 1.00 0.00 C ATOM 852 OE1 GLU A 57 12.411 6.586 9.387 1.00 0.00 O ATOM 853 OE2 GLU A 57 12.235 8.777 9.394 1.00 0.00 O ATOM 0 H GLU A 57 13.179 6.123 6.625 1.00 0.00 H new ATOM 0 HA GLU A 57 10.880 4.344 6.592 1.00 0.00 H new ATOM 0 HB2 GLU A 57 9.336 6.172 7.296 1.00 0.00 H new ATOM 0 HB3 GLU A 57 10.368 5.603 8.593 1.00 0.00 H new ATOM 0 HG2 GLU A 57 11.239 7.979 6.964 1.00 0.00 H new ATOM 0 HG3 GLU A 57 9.993 8.186 8.178 1.00 0.00 H new ATOM 860 N ILE A 58 10.049 5.538 4.515 1.00 0.00 N ATOM 861 CA ILE A 58 9.786 6.045 3.174 1.00 0.00 C ATOM 862 C ILE A 58 8.333 6.484 3.027 1.00 0.00 C ATOM 863 O ILE A 58 7.441 5.659 2.833 1.00 0.00 O ATOM 864 CB ILE A 58 10.101 4.987 2.100 1.00 0.00 C ATOM 865 CG1 ILE A 58 11.554 4.524 2.220 1.00 0.00 C ATOM 866 CG2 ILE A 58 9.829 5.544 0.711 1.00 0.00 C ATOM 867 CD1 ILE A 58 11.862 3.283 1.412 1.00 0.00 C ATOM 0 H ILE A 58 9.400 4.816 4.828 1.00 0.00 H new ATOM 0 HA ILE A 58 10.440 6.905 3.029 1.00 0.00 H new ATOM 0 HB ILE A 58 9.451 4.126 2.258 1.00 0.00 H new ATOM 0 HG12 ILE A 58 12.212 5.331 1.896 1.00 0.00 H new ATOM 0 HG13 ILE A 58 11.780 4.330 3.269 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.057 4.784 -0.037 1.00 0.00 H new ATOM 0 HG22 ILE A 58 8.780 5.828 0.632 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.456 6.419 0.541 1.00 0.00 H new ATOM 0 HD11 ILE A 58 12.910 3.013 1.545 1.00 0.00 H new ATOM 0 HD12 ILE A 58 11.230 2.462 1.751 1.00 0.00 H new ATOM 0 HD13 ILE A 58 11.669 3.478 0.357 1.00 0.00 H new ATOM 879 N GLU A 59 8.103 7.791 3.121 1.00 0.00 N ATOM 880 CA GLU A 59 6.758 8.339 2.997 1.00 0.00 C ATOM 881 C GLU A 59 6.205 8.114 1.593 1.00 0.00 C ATOM 882 O GLU A 59 6.804 8.535 0.604 1.00 0.00 O ATOM 883 CB GLU A 59 6.762 9.835 3.322 1.00 0.00 C ATOM 884 CG GLU A 59 7.682 10.649 2.428 1.00 0.00 C ATOM 885 CD GLU A 59 8.144 11.936 3.084 1.00 0.00 C ATOM 886 OE1 GLU A 59 7.284 12.681 3.599 1.00 0.00 O ATOM 887 OE2 GLU A 59 9.365 12.198 3.083 1.00 0.00 O ATOM 0 H GLU A 59 8.830 8.488 3.282 1.00 0.00 H new ATOM 0 HA GLU A 59 6.115 7.821 3.708 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.747 10.221 3.232 1.00 0.00 H new ATOM 0 HB3 GLU A 59 7.064 9.972 4.360 1.00 0.00 H new ATOM 0 HG2 GLU A 59 8.552 10.047 2.164 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.164 10.885 1.498 1.00 0.00 H new ATOM 894 N ILE A 60 5.058 7.446 1.516 1.00 0.00 N ATOM 895 CA ILE A 60 4.424 7.165 0.234 1.00 0.00 C ATOM 896 C ILE A 60 4.105 8.453 -0.516 1.00 0.00 C ATOM 897 O ILE A 60 4.206 8.512 -1.742 1.00 0.00 O ATOM 898 CB ILE A 60 3.127 6.355 0.414 1.00 0.00 C ATOM 899 CG1 ILE A 60 3.400 5.086 1.224 1.00 0.00 C ATOM 900 CG2 ILE A 60 2.528 6.006 -0.940 1.00 0.00 C ATOM 901 CD1 ILE A 60 2.148 4.314 1.579 1.00 0.00 C ATOM 0 H ILE A 60 4.550 7.090 2.326 1.00 0.00 H new ATOM 0 HA ILE A 60 5.134 6.576 -0.347 1.00 0.00 H new ATOM 0 HB ILE A 60 2.409 6.965 0.961 1.00 0.00 H new ATOM 0 HG12 ILE A 60 4.067 4.438 0.655 1.00 0.00 H new ATOM 0 HG13 ILE A 60 3.923 5.356 2.141 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.612 5.433 -0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 60 2.301 6.923 -1.485 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.241 5.412 -1.511 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.418 3.427 2.153 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.488 4.945 2.175 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.635 4.013 0.666 1.00 0.00 H new ATOM 913 N VAL A 61 3.721 9.486 0.228 1.00 0.00 N ATOM 914 CA VAL A 61 3.391 10.776 -0.366 1.00 0.00 C ATOM 915 C VAL A 61 4.464 11.216 -1.355 1.00 0.00 C ATOM 916 O VAL A 61 4.180 11.927 -2.320 1.00 0.00 O ATOM 917 CB VAL A 61 3.224 11.864 0.711 1.00 0.00 C ATOM 918 CG1 VAL A 61 2.166 11.453 1.725 1.00 0.00 C ATOM 919 CG2 VAL A 61 4.552 12.142 1.397 1.00 0.00 C ATOM 0 H VAL A 61 3.631 9.454 1.244 1.00 0.00 H new ATOM 0 HA VAL A 61 2.445 10.649 -0.893 1.00 0.00 H new ATOM 0 HB VAL A 61 2.892 12.783 0.227 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.061 12.234 2.478 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.212 11.308 1.217 1.00 0.00 H new ATOM 0 HG13 VAL A 61 2.466 10.522 2.206 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.416 12.913 2.155 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.916 11.229 1.869 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.278 12.483 0.659 1.00 0.00 H new ATOM 929 N HIS A 62 5.699 10.790 -1.110 1.00 0.00 N ATOM 930 CA HIS A 62 6.816 11.139 -1.980 1.00 0.00 C ATOM 931 C HIS A 62 6.973 10.116 -3.100 1.00 0.00 C ATOM 932 O HIS A 62 7.075 10.476 -4.273 1.00 0.00 O ATOM 933 CB HIS A 62 8.110 11.231 -1.172 1.00 0.00 C ATOM 934 CG HIS A 62 8.337 12.577 -0.555 1.00 0.00 C ATOM 935 ND1 HIS A 62 7.674 13.220 0.434 1.00 0.00 N flip ATOM 936 CD2 HIS A 62 9.350 13.425 -0.951 1.00 0.00 C flip ATOM 937 CE1 HIS A 62 8.293 14.433 0.617 1.00 0.00 C flip ATOM 938 NE2 HIS A 62 9.301 14.532 -0.231 1.00 0.00 N flip ATOM 0 H HIS A 62 5.951 10.202 -0.316 1.00 0.00 H new ATOM 0 HA HIS A 62 6.606 12.111 -2.427 1.00 0.00 H new ATOM 0 HB2 HIS A 62 8.091 10.478 -0.384 1.00 0.00 H new ATOM 0 HB3 HIS A 62 8.952 10.992 -1.822 1.00 0.00 H new ATOM 0 HD2 HIS A 62 10.071 13.217 -1.728 1.00 0.00 H new ATOM 0 HE1 HIS A 62 8.003 15.184 1.337 1.00 0.00 H new ATOM 0 HE2 HIS A 62 9.934 15.327 -0.316 1.00 0.00 H new ATOM 946 N ILE A 63 6.993 8.840 -2.730 1.00 0.00 N ATOM 947 CA ILE A 63 7.137 7.765 -3.704 1.00 0.00 C ATOM 948 C ILE A 63 6.402 8.094 -4.999 1.00 0.00 C ATOM 949 O ILE A 63 5.213 8.410 -4.987 1.00 0.00 O ATOM 950 CB ILE A 63 6.606 6.429 -3.151 1.00 0.00 C ATOM 951 CG1 ILE A 63 7.341 6.058 -1.861 1.00 0.00 C ATOM 952 CG2 ILE A 63 6.759 5.327 -4.189 1.00 0.00 C ATOM 953 CD1 ILE A 63 6.912 4.727 -1.283 1.00 0.00 C ATOM 0 H ILE A 63 6.911 8.525 -1.763 1.00 0.00 H new ATOM 0 HA ILE A 63 8.203 7.666 -3.909 1.00 0.00 H new ATOM 0 HB ILE A 63 5.546 6.543 -2.924 1.00 0.00 H new ATOM 0 HG12 ILE A 63 8.413 6.031 -2.058 1.00 0.00 H new ATOM 0 HG13 ILE A 63 7.173 6.839 -1.119 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.379 4.389 -3.783 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.195 5.590 -5.084 1.00 0.00 H new ATOM 0 HG23 ILE A 63 7.812 5.212 -4.445 1.00 0.00 H new ATOM 0 HD11 ILE A 63 7.474 4.529 -0.370 1.00 0.00 H new ATOM 0 HD12 ILE A 63 5.847 4.756 -1.054 1.00 0.00 H new ATOM 0 HD13 ILE A 63 7.106 3.936 -2.008 1.00 0.00 H new ATOM 965 N SER A 64 7.119 8.015 -6.116 1.00 0.00 N ATOM 966 CA SER A 64 6.536 8.306 -7.420 1.00 0.00 C ATOM 967 C SER A 64 6.294 7.021 -8.207 1.00 0.00 C ATOM 968 O SER A 64 5.185 6.765 -8.676 1.00 0.00 O ATOM 969 CB SER A 64 7.451 9.239 -8.215 1.00 0.00 C ATOM 970 OG SER A 64 6.875 9.577 -9.465 1.00 0.00 O ATOM 0 H SER A 64 8.104 7.752 -6.144 1.00 0.00 H new ATOM 0 HA SER A 64 5.577 8.799 -7.259 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.638 10.146 -7.640 1.00 0.00 H new ATOM 0 HB3 SER A 64 8.416 8.758 -8.374 1.00 0.00 H new ATOM 0 HG SER A 64 7.479 10.175 -9.953 1.00 0.00 H new ATOM 976 N THR A 65 7.342 6.215 -8.347 1.00 0.00 N ATOM 977 CA THR A 65 7.246 4.957 -9.077 1.00 0.00 C ATOM 978 C THR A 65 7.231 3.768 -8.124 1.00 0.00 C ATOM 979 O THR A 65 7.991 3.726 -7.156 1.00 0.00 O ATOM 980 CB THR A 65 8.414 4.792 -10.068 1.00 0.00 C ATOM 981 OG1 THR A 65 8.451 5.902 -10.971 1.00 0.00 O ATOM 982 CG2 THR A 65 8.279 3.496 -10.853 1.00 0.00 C ATOM 0 H THR A 65 8.267 6.411 -7.964 1.00 0.00 H new ATOM 0 HA THR A 65 6.309 4.985 -9.633 1.00 0.00 H new ATOM 0 HB THR A 65 9.343 4.757 -9.498 1.00 0.00 H new ATOM 0 HG1 THR A 65 9.197 5.790 -11.596 1.00 0.00 H new ATOM 0 HG21 THR A 65 9.115 3.402 -11.546 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.282 2.651 -10.164 1.00 0.00 H new ATOM 0 HG23 THR A 65 7.343 3.505 -11.412 1.00 0.00 H new ATOM 990 N VAL A 66 6.362 2.802 -8.403 1.00 0.00 N ATOM 991 CA VAL A 66 6.250 1.610 -7.571 1.00 0.00 C ATOM 992 C VAL A 66 6.096 0.356 -8.425 1.00 0.00 C ATOM 993 O VAL A 66 5.030 0.102 -8.985 1.00 0.00 O ATOM 994 CB VAL A 66 5.054 1.710 -6.605 1.00 0.00 C ATOM 995 CG1 VAL A 66 4.962 0.464 -5.738 1.00 0.00 C ATOM 996 CG2 VAL A 66 5.167 2.961 -5.747 1.00 0.00 C ATOM 0 H VAL A 66 5.725 2.822 -9.199 1.00 0.00 H new ATOM 0 HA VAL A 66 7.171 1.541 -6.992 1.00 0.00 H new ATOM 0 HB VAL A 66 4.139 1.782 -7.193 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.111 0.553 -5.062 1.00 0.00 H new ATOM 0 HG12 VAL A 66 4.831 -0.412 -6.373 1.00 0.00 H new ATOM 0 HG13 VAL A 66 5.878 0.357 -5.157 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.314 3.016 -5.070 1.00 0.00 H new ATOM 0 HG22 VAL A 66 6.089 2.922 -5.167 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.179 3.842 -6.388 1.00 0.00 H new ATOM 1006 N GLN A 67 7.167 -0.425 -8.518 1.00 0.00 N ATOM 1007 CA GLN A 67 7.151 -1.653 -9.304 1.00 0.00 C ATOM 1008 C GLN A 67 7.821 -2.794 -8.545 1.00 0.00 C ATOM 1009 O GLN A 67 8.617 -2.563 -7.635 1.00 0.00 O ATOM 1010 CB GLN A 67 7.854 -1.435 -10.645 1.00 0.00 C ATOM 1011 CG GLN A 67 9.367 -1.348 -10.532 1.00 0.00 C ATOM 1012 CD GLN A 67 10.021 -0.853 -11.807 1.00 0.00 C ATOM 1013 OE1 GLN A 67 9.643 0.186 -12.348 1.00 0.00 O ATOM 1014 NE2 GLN A 67 11.008 -1.596 -12.293 1.00 0.00 N ATOM 0 H GLN A 67 8.057 -0.229 -8.059 1.00 0.00 H new ATOM 0 HA GLN A 67 6.111 -1.924 -9.487 1.00 0.00 H new ATOM 0 HB2 GLN A 67 7.595 -2.252 -11.319 1.00 0.00 H new ATOM 0 HB3 GLN A 67 7.478 -0.517 -11.098 1.00 0.00 H new ATOM 0 HG2 GLN A 67 9.628 -0.680 -9.711 1.00 0.00 H new ATOM 0 HG3 GLN A 67 9.766 -2.331 -10.282 1.00 0.00 H new ATOM 0 HE21 GLN A 67 11.288 -2.450 -11.811 1.00 0.00 H new ATOM 0 HE22 GLN A 67 11.486 -1.313 -13.148 1.00 0.00 H new ATOM 1023 N ILE A 68 7.492 -4.024 -8.925 1.00 0.00 N ATOM 1024 CA ILE A 68 8.062 -5.200 -8.281 1.00 0.00 C ATOM 1025 C ILE A 68 9.105 -5.864 -9.173 1.00 0.00 C ATOM 1026 O ILE A 68 8.904 -6.010 -10.380 1.00 0.00 O ATOM 1027 CB ILE A 68 6.974 -6.231 -7.926 1.00 0.00 C ATOM 1028 CG1 ILE A 68 5.911 -5.595 -7.029 1.00 0.00 C ATOM 1029 CG2 ILE A 68 7.594 -7.442 -7.246 1.00 0.00 C ATOM 1030 CD1 ILE A 68 4.696 -6.471 -6.817 1.00 0.00 C ATOM 0 H ILE A 68 6.834 -4.232 -9.676 1.00 0.00 H new ATOM 0 HA ILE A 68 8.539 -4.857 -7.363 1.00 0.00 H new ATOM 0 HB ILE A 68 6.494 -6.562 -8.847 1.00 0.00 H new ATOM 0 HG12 ILE A 68 6.355 -5.364 -6.061 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.595 -4.649 -7.469 1.00 0.00 H new ATOM 0 HG21 ILE A 68 6.813 -8.162 -7.001 1.00 0.00 H new ATOM 0 HG22 ILE A 68 8.317 -7.906 -7.917 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.097 -7.128 -6.332 1.00 0.00 H new ATOM 0 HD11 ILE A 68 3.984 -5.956 -6.171 1.00 0.00 H new ATOM 0 HD12 ILE A 68 4.227 -6.682 -7.778 1.00 0.00 H new ATOM 0 HD13 ILE A 68 5.000 -7.407 -6.348 1.00 0.00 H new ATOM 1042 N LEU A 69 10.219 -6.267 -8.572 1.00 0.00 N ATOM 1043 CA LEU A 69 11.295 -6.919 -9.312 1.00 0.00 C ATOM 1044 C LEU A 69 11.012 -8.408 -9.485 1.00 0.00 C ATOM 1045 O LEU A 69 10.711 -9.111 -8.520 1.00 0.00 O ATOM 1046 CB LEU A 69 12.629 -6.723 -8.590 1.00 0.00 C ATOM 1047 CG LEU A 69 13.068 -5.274 -8.375 1.00 0.00 C ATOM 1048 CD1 LEU A 69 14.310 -5.218 -7.499 1.00 0.00 C ATOM 1049 CD2 LEU A 69 13.324 -4.590 -9.710 1.00 0.00 C ATOM 0 H LEU A 69 10.401 -6.154 -7.575 1.00 0.00 H new ATOM 0 HA LEU A 69 11.353 -6.461 -10.300 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.568 -7.212 -7.618 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.405 -7.237 -9.157 1.00 0.00 H new ATOM 0 HG LEU A 69 12.264 -4.743 -7.866 1.00 0.00 H new ATOM 0 HD11 LEU A 69 14.608 -4.179 -7.357 1.00 0.00 H new ATOM 0 HD12 LEU A 69 14.093 -5.669 -6.531 1.00 0.00 H new ATOM 0 HD13 LEU A 69 15.120 -5.765 -7.981 1.00 0.00 H new ATOM 0 HD21 LEU A 69 13.635 -3.560 -9.537 1.00 0.00 H new ATOM 0 HD22 LEU A 69 14.110 -5.122 -10.246 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.410 -4.598 -10.304 1.00 0.00 H new ATOM 1061 N THR A 70 11.111 -8.884 -10.723 1.00 0.00 N ATOM 1062 CA THR A 70 10.867 -10.289 -11.023 1.00 0.00 C ATOM 1063 C THR A 70 12.096 -10.939 -11.649 1.00 0.00 C ATOM 1064 O THR A 70 13.052 -10.256 -12.015 1.00 0.00 O ATOM 1065 CB THR A 70 9.669 -10.460 -11.976 1.00 0.00 C ATOM 1066 OG1 THR A 70 9.894 -9.722 -13.183 1.00 0.00 O ATOM 1067 CG2 THR A 70 8.382 -9.986 -11.318 1.00 0.00 C ATOM 0 H THR A 70 11.359 -8.316 -11.534 1.00 0.00 H new ATOM 0 HA THR A 70 10.642 -10.780 -10.076 1.00 0.00 H new ATOM 0 HB THR A 70 9.569 -11.519 -12.212 1.00 0.00 H new ATOM 0 HG1 THR A 70 9.965 -10.343 -13.938 1.00 0.00 H new ATOM 0 HG21 THR A 70 7.550 -10.117 -12.010 1.00 0.00 H new ATOM 0 HG22 THR A 70 8.198 -10.569 -10.416 1.00 0.00 H new ATOM 0 HG23 THR A 70 8.474 -8.932 -11.056 1.00 0.00 H new ATOM 1075 N GLU A 71 12.064 -12.263 -11.768 1.00 0.00 N ATOM 1076 CA GLU A 71 13.177 -13.004 -12.350 1.00 0.00 C ATOM 1077 C GLU A 71 13.331 -12.678 -13.832 1.00 0.00 C ATOM 1078 O GLU A 71 14.440 -12.460 -14.319 1.00 0.00 O ATOM 1079 CB GLU A 71 12.968 -14.508 -12.165 1.00 0.00 C ATOM 1080 CG GLU A 71 11.631 -15.006 -12.687 1.00 0.00 C ATOM 1081 CD GLU A 71 11.402 -16.477 -12.397 1.00 0.00 C ATOM 1082 OE1 GLU A 71 11.068 -16.810 -11.241 1.00 0.00 O ATOM 1083 OE2 GLU A 71 11.557 -17.295 -13.328 1.00 0.00 O ATOM 0 H GLU A 71 11.280 -12.844 -11.469 1.00 0.00 H new ATOM 0 HA GLU A 71 14.090 -12.705 -11.834 1.00 0.00 H new ATOM 0 HB2 GLU A 71 13.769 -15.043 -12.675 1.00 0.00 H new ATOM 0 HB3 GLU A 71 13.047 -14.750 -11.105 1.00 0.00 H new ATOM 0 HG2 GLU A 71 10.829 -14.422 -12.236 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.581 -14.840 -13.763 1.00 0.00 H new ATOM 1090 N GLY A 72 12.210 -12.649 -14.546 1.00 0.00 N ATOM 1091 CA GLY A 72 12.242 -12.350 -15.966 1.00 0.00 C ATOM 1092 C GLY A 72 10.979 -11.660 -16.441 1.00 0.00 C ATOM 1093 O GLY A 72 10.153 -11.234 -15.633 1.00 0.00 O ATOM 0 H GLY A 72 11.280 -12.827 -14.167 1.00 0.00 H new ATOM 0 HA2 GLY A 72 13.102 -11.716 -16.181 1.00 0.00 H new ATOM 0 HA3 GLY A 72 12.380 -13.275 -16.526 1.00 0.00 H new ATOM 1097 N PHE A 73 10.828 -11.545 -17.757 1.00 0.00 N ATOM 1098 CA PHE A 73 9.658 -10.898 -18.339 1.00 0.00 C ATOM 1099 C PHE A 73 8.371 -11.489 -17.771 1.00 0.00 C ATOM 1100 O PHE A 73 7.562 -10.798 -17.152 1.00 0.00 O ATOM 1101 CB PHE A 73 9.672 -11.046 -19.862 1.00 0.00 C ATOM 1102 CG PHE A 73 10.293 -9.877 -20.572 1.00 0.00 C ATOM 1103 CD1 PHE A 73 9.762 -8.605 -20.434 1.00 0.00 C ATOM 1104 CD2 PHE A 73 11.406 -10.051 -21.379 1.00 0.00 C ATOM 1105 CE1 PHE A 73 10.331 -7.527 -21.086 1.00 0.00 C ATOM 1106 CE2 PHE A 73 11.979 -8.977 -22.033 1.00 0.00 C ATOM 1107 CZ PHE A 73 11.440 -7.713 -21.887 1.00 0.00 C ATOM 0 H PHE A 73 11.502 -11.892 -18.440 1.00 0.00 H new ATOM 0 HA PHE A 73 9.694 -9.839 -18.083 1.00 0.00 H new ATOM 0 HB2 PHE A 73 10.217 -11.952 -20.126 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.649 -11.174 -20.216 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.894 -8.454 -19.810 1.00 0.00 H new ATOM 0 HD2 PHE A 73 11.830 -11.037 -21.498 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.908 -6.540 -20.969 1.00 0.00 H new ATOM 0 HE2 PHE A 73 12.847 -9.125 -22.658 1.00 0.00 H new ATOM 0 HZ PHE A 73 11.885 -6.872 -22.398 1.00 0.00 H new ATOM 1117 N PRO A 74 8.176 -12.798 -17.986 1.00 0.00 N ATOM 1118 CA PRO A 74 6.990 -13.512 -17.505 1.00 0.00 C ATOM 1119 C PRO A 74 6.979 -13.660 -15.987 1.00 0.00 C ATOM 1120 O PRO A 74 8.011 -13.563 -15.322 1.00 0.00 O ATOM 1121 CB PRO A 74 7.104 -14.883 -18.175 1.00 0.00 C ATOM 1122 CG PRO A 74 8.561 -15.058 -18.433 1.00 0.00 C ATOM 1123 CD PRO A 74 9.100 -13.683 -18.716 1.00 0.00 C ATOM 0 HA PRO A 74 6.069 -12.981 -17.746 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.719 -15.672 -17.530 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.531 -14.920 -19.101 1.00 0.00 H new ATOM 0 HG2 PRO A 74 9.059 -15.503 -17.571 1.00 0.00 H new ATOM 0 HG3 PRO A 74 8.730 -15.725 -19.278 1.00 0.00 H new ATOM 0 HD2 PRO A 74 10.125 -13.573 -18.363 1.00 0.00 H new ATOM 0 HD3 PRO A 74 9.105 -13.465 -19.784 1.00 0.00 H new ATOM 1131 N PRO A 75 5.786 -13.901 -15.424 1.00 0.00 N ATOM 1132 CA PRO A 75 5.612 -14.068 -13.978 1.00 0.00 C ATOM 1133 C PRO A 75 6.225 -15.368 -13.467 1.00 0.00 C ATOM 1134 O PRO A 75 6.723 -15.431 -12.344 1.00 0.00 O ATOM 1135 CB PRO A 75 4.092 -14.090 -13.803 1.00 0.00 C ATOM 1136 CG PRO A 75 3.566 -14.559 -15.115 1.00 0.00 C ATOM 1137 CD PRO A 75 4.514 -14.029 -16.155 1.00 0.00 C ATOM 0 HA PRO A 75 6.108 -13.278 -13.414 1.00 0.00 H new ATOM 0 HB2 PRO A 75 3.796 -14.760 -12.996 1.00 0.00 H new ATOM 0 HB3 PRO A 75 3.708 -13.101 -13.553 1.00 0.00 H new ATOM 0 HG2 PRO A 75 3.518 -15.647 -15.149 1.00 0.00 H new ATOM 0 HG3 PRO A 75 2.555 -14.190 -15.284 1.00 0.00 H new ATOM 0 HD2 PRO A 75 4.604 -14.710 -17.001 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.180 -13.070 -16.552 1.00 0.00 H new ATOM 1145 N GLY A 76 6.186 -16.403 -14.300 1.00 0.00 N ATOM 1146 CA GLY A 76 6.741 -17.687 -13.915 1.00 0.00 C ATOM 1147 C GLY A 76 5.977 -18.852 -14.512 1.00 0.00 C ATOM 1148 O GLY A 76 4.957 -18.662 -15.172 1.00 0.00 O ATOM 0 H GLY A 76 5.780 -16.375 -15.235 1.00 0.00 H new ATOM 0 HA2 GLY A 76 7.782 -17.739 -14.232 1.00 0.00 H new ATOM 0 HA3 GLY A 76 6.734 -17.771 -12.828 1.00 0.00 H new ATOM 1152 N GLY A 77 6.474 -20.064 -14.281 1.00 0.00 N ATOM 1153 CA GLY A 77 5.819 -21.247 -14.810 1.00 0.00 C ATOM 1154 C GLY A 77 4.933 -21.926 -13.784 1.00 0.00 C ATOM 1155 O GLY A 77 4.945 -23.150 -13.657 1.00 0.00 O ATOM 0 H GLY A 77 7.317 -20.248 -13.738 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.219 -20.970 -15.677 1.00 0.00 H new ATOM 0 HA3 GLY A 77 6.574 -21.952 -15.157 1.00 0.00 H new ATOM 1159 N GLY A 78 4.164 -21.130 -13.048 1.00 0.00 N ATOM 1160 CA GLY A 78 3.280 -21.680 -12.037 1.00 0.00 C ATOM 1161 C GLY A 78 2.957 -20.680 -10.944 1.00 0.00 C ATOM 1162 O GLY A 78 1.936 -19.997 -11.001 1.00 0.00 O ATOM 0 H GLY A 78 4.137 -20.114 -13.134 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.354 -22.010 -12.509 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.744 -22.561 -11.594 1.00 0.00 H new ATOM 1166 N ASN A 79 3.829 -20.596 -9.945 1.00 0.00 N ATOM 1167 CA ASN A 79 3.630 -19.674 -8.832 1.00 0.00 C ATOM 1168 C ASN A 79 4.486 -18.423 -9.002 1.00 0.00 C ATOM 1169 O ASN A 79 5.592 -18.484 -9.540 1.00 0.00 O ATOM 1170 CB ASN A 79 3.967 -20.361 -7.507 1.00 0.00 C ATOM 1171 CG ASN A 79 5.340 -21.005 -7.523 1.00 0.00 C ATOM 1172 OD1 ASN A 79 6.342 -20.349 -7.807 1.00 0.00 O ATOM 1173 ND2 ASN A 79 5.392 -22.296 -7.217 1.00 0.00 N ATOM 0 H ASN A 79 4.680 -21.155 -9.883 1.00 0.00 H new ATOM 0 HA ASN A 79 2.582 -19.376 -8.822 1.00 0.00 H new ATOM 0 HB2 ASN A 79 3.921 -19.630 -6.700 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.215 -21.120 -7.293 1.00 0.00 H new ATOM 0 HD21 ASN A 79 6.288 -22.783 -7.211 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.536 -22.801 -6.988 1.00 0.00 H new ATOM 1180 N ALA A 80 3.968 -17.291 -8.539 1.00 0.00 N ATOM 1181 CA ALA A 80 4.686 -16.026 -8.637 1.00 0.00 C ATOM 1182 C ALA A 80 5.837 -15.969 -7.638 1.00 0.00 C ATOM 1183 O ALA A 80 5.639 -16.157 -6.438 1.00 0.00 O ATOM 1184 CB ALA A 80 3.734 -14.860 -8.416 1.00 0.00 C ATOM 0 H ALA A 80 3.054 -17.224 -8.092 1.00 0.00 H new ATOM 0 HA ALA A 80 5.106 -15.952 -9.640 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.284 -13.922 -8.492 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.949 -14.883 -9.172 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.286 -14.939 -7.425 1.00 0.00 H new ATOM 1190 N ARG A 81 7.039 -15.709 -8.142 1.00 0.00 N ATOM 1191 CA ARG A 81 8.222 -15.630 -7.293 1.00 0.00 C ATOM 1192 C ARG A 81 8.859 -14.246 -7.378 1.00 0.00 C ATOM 1193 O ARG A 81 9.821 -14.039 -8.117 1.00 0.00 O ATOM 1194 CB ARG A 81 9.239 -16.698 -7.698 1.00 0.00 C ATOM 1195 CG ARG A 81 8.704 -18.117 -7.602 1.00 0.00 C ATOM 1196 CD ARG A 81 9.680 -19.122 -8.194 1.00 0.00 C ATOM 1197 NE ARG A 81 9.621 -19.148 -9.653 1.00 0.00 N ATOM 1198 CZ ARG A 81 10.234 -20.062 -10.397 1.00 0.00 C ATOM 1199 NH1 ARG A 81 10.949 -21.019 -9.821 1.00 0.00 N ATOM 1200 NH2 ARG A 81 10.134 -20.019 -11.719 1.00 0.00 N ATOM 0 H ARG A 81 7.219 -15.550 -9.133 1.00 0.00 H new ATOM 0 HA ARG A 81 7.913 -15.806 -6.263 1.00 0.00 H new ATOM 0 HB2 ARG A 81 9.563 -16.509 -8.722 1.00 0.00 H new ATOM 0 HB3 ARG A 81 10.120 -16.607 -7.063 1.00 0.00 H new ATOM 0 HG2 ARG A 81 8.513 -18.365 -6.558 1.00 0.00 H new ATOM 0 HG3 ARG A 81 7.750 -18.183 -8.125 1.00 0.00 H new ATOM 0 HD2 ARG A 81 10.693 -18.874 -7.877 1.00 0.00 H new ATOM 0 HD3 ARG A 81 9.458 -20.116 -7.804 1.00 0.00 H new ATOM 0 HE ARG A 81 9.080 -18.425 -10.127 1.00 0.00 H new ATOM 0 HH11 ARG A 81 11.029 -21.054 -8.805 1.00 0.00 H new ATOM 0 HH12 ARG A 81 11.419 -21.720 -10.394 1.00 0.00 H new ATOM 0 HH21 ARG A 81 9.586 -19.284 -12.165 1.00 0.00 H new ATOM 0 HH22 ARG A 81 10.605 -20.721 -12.289 1.00 0.00 H new ATOM 1214 N ALA A 82 8.316 -13.302 -6.615 1.00 0.00 N ATOM 1215 CA ALA A 82 8.833 -11.939 -6.603 1.00 0.00 C ATOM 1216 C ALA A 82 10.212 -11.881 -5.955 1.00 0.00 C ATOM 1217 O ALA A 82 10.332 -11.766 -4.734 1.00 0.00 O ATOM 1218 CB ALA A 82 7.866 -11.015 -5.877 1.00 0.00 C ATOM 0 H ALA A 82 7.519 -13.456 -5.998 1.00 0.00 H new ATOM 0 HA ALA A 82 8.932 -11.604 -7.636 1.00 0.00 H new ATOM 0 HB1 ALA A 82 8.264 -10.000 -5.875 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.902 -11.026 -6.385 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.738 -11.356 -4.850 1.00 0.00 H new ATOM 1224 N THR A 83 11.252 -11.961 -6.779 1.00 0.00 N ATOM 1225 CA THR A 83 12.623 -11.919 -6.286 1.00 0.00 C ATOM 1226 C THR A 83 12.841 -10.720 -5.369 1.00 0.00 C ATOM 1227 O THR A 83 13.420 -10.848 -4.291 1.00 0.00 O ATOM 1228 CB THR A 83 13.635 -11.855 -7.445 1.00 0.00 C ATOM 1229 OG1 THR A 83 13.403 -10.684 -8.234 1.00 0.00 O ATOM 1230 CG2 THR A 83 13.531 -13.094 -8.322 1.00 0.00 C ATOM 0 H THR A 83 11.171 -12.055 -7.791 1.00 0.00 H new ATOM 0 HA THR A 83 12.785 -12.838 -5.723 1.00 0.00 H new ATOM 0 HB THR A 83 14.638 -11.813 -7.021 1.00 0.00 H new ATOM 0 HG1 THR A 83 14.052 -10.650 -8.968 1.00 0.00 H new ATOM 0 HG21 THR A 83 14.255 -13.027 -9.134 1.00 0.00 H new ATOM 0 HG22 THR A 83 13.738 -13.982 -7.724 1.00 0.00 H new ATOM 0 HG23 THR A 83 12.526 -13.162 -8.737 1.00 0.00 H new ATOM 1238 N GLY A 84 12.372 -9.555 -5.805 1.00 0.00 N ATOM 1239 CA GLY A 84 12.525 -8.350 -5.011 1.00 0.00 C ATOM 1240 C GLY A 84 11.564 -7.254 -5.428 1.00 0.00 C ATOM 1241 O GLY A 84 10.754 -7.442 -6.335 1.00 0.00 O ATOM 0 H GLY A 84 11.889 -9.424 -6.694 1.00 0.00 H new ATOM 0 HA2 GLY A 84 12.365 -8.589 -3.960 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.548 -7.986 -5.103 1.00 0.00 H new ATOM 1245 N MET A 85 11.652 -6.107 -4.762 1.00 0.00 N ATOM 1246 CA MET A 85 10.782 -4.978 -5.069 1.00 0.00 C ATOM 1247 C MET A 85 11.599 -3.761 -5.493 1.00 0.00 C ATOM 1248 O MET A 85 12.772 -3.636 -5.140 1.00 0.00 O ATOM 1249 CB MET A 85 9.917 -4.628 -3.856 1.00 0.00 C ATOM 1250 CG MET A 85 9.031 -3.412 -4.072 1.00 0.00 C ATOM 1251 SD MET A 85 7.891 -3.132 -2.703 1.00 0.00 S ATOM 1252 CE MET A 85 6.317 -3.401 -3.514 1.00 0.00 C ATOM 0 H MET A 85 12.316 -5.935 -4.007 1.00 0.00 H new ATOM 0 HA MET A 85 10.135 -5.266 -5.897 1.00 0.00 H new ATOM 0 HB2 MET A 85 9.290 -5.485 -3.608 1.00 0.00 H new ATOM 0 HB3 MET A 85 10.565 -4.448 -2.998 1.00 0.00 H new ATOM 0 HG2 MET A 85 9.657 -2.530 -4.205 1.00 0.00 H new ATOM 0 HG3 MET A 85 8.462 -3.540 -4.993 1.00 0.00 H new ATOM 0 HE1 MET A 85 5.647 -3.934 -2.840 1.00 0.00 H new ATOM 0 HE2 MET A 85 5.876 -2.440 -3.780 1.00 0.00 H new ATOM 0 HE3 MET A 85 6.469 -3.992 -4.417 1.00 0.00 H new ATOM 1262 N PHE A 86 10.973 -2.868 -6.251 1.00 0.00 N ATOM 1263 CA PHE A 86 11.643 -1.662 -6.724 1.00 0.00 C ATOM 1264 C PHE A 86 10.762 -0.434 -6.517 1.00 0.00 C ATOM 1265 O PHE A 86 9.661 -0.346 -7.062 1.00 0.00 O ATOM 1266 CB PHE A 86 12.003 -1.801 -8.204 1.00 0.00 C ATOM 1267 CG PHE A 86 12.926 -0.725 -8.700 1.00 0.00 C ATOM 1268 CD1 PHE A 86 14.300 -0.861 -8.578 1.00 0.00 C ATOM 1269 CD2 PHE A 86 12.420 0.423 -9.288 1.00 0.00 C ATOM 1270 CE1 PHE A 86 15.151 0.129 -9.032 1.00 0.00 C ATOM 1271 CE2 PHE A 86 13.267 1.416 -9.745 1.00 0.00 C ATOM 1272 CZ PHE A 86 14.634 1.268 -9.618 1.00 0.00 C ATOM 0 H PHE A 86 10.002 -2.956 -6.551 1.00 0.00 H new ATOM 0 HA PHE A 86 12.557 -1.533 -6.145 1.00 0.00 H new ATOM 0 HB2 PHE A 86 12.470 -2.772 -8.366 1.00 0.00 H new ATOM 0 HB3 PHE A 86 11.088 -1.784 -8.795 1.00 0.00 H new ATOM 0 HD1 PHE A 86 14.710 -1.750 -8.123 1.00 0.00 H new ATOM 0 HD2 PHE A 86 11.352 0.544 -9.391 1.00 0.00 H new ATOM 0 HE1 PHE A 86 16.220 0.012 -8.929 1.00 0.00 H new ATOM 0 HE2 PHE A 86 12.860 2.306 -10.201 1.00 0.00 H new ATOM 0 HZ PHE A 86 15.298 2.041 -9.976 1.00 0.00 H new ATOM 1282 N LEU A 87 11.254 0.512 -5.724 1.00 0.00 N ATOM 1283 CA LEU A 87 10.512 1.737 -5.443 1.00 0.00 C ATOM 1284 C LEU A 87 11.385 2.966 -5.670 1.00 0.00 C ATOM 1285 O LEU A 87 12.606 2.907 -5.527 1.00 0.00 O ATOM 1286 CB LEU A 87 9.994 1.723 -4.004 1.00 0.00 C ATOM 1287 CG LEU A 87 9.328 0.427 -3.542 1.00 0.00 C ATOM 1288 CD1 LEU A 87 9.328 0.337 -2.024 1.00 0.00 C ATOM 1289 CD2 LEU A 87 7.908 0.334 -4.083 1.00 0.00 C ATOM 0 H LEU A 87 12.163 0.455 -5.264 1.00 0.00 H new ATOM 0 HA LEU A 87 9.665 1.785 -6.127 1.00 0.00 H new ATOM 0 HB2 LEU A 87 10.829 1.937 -3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.278 2.537 -3.889 1.00 0.00 H new ATOM 0 HG LEU A 87 9.901 -0.412 -3.935 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.850 -0.592 -1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.355 0.356 -1.658 1.00 0.00 H new ATOM 0 HD13 LEU A 87 8.780 1.183 -1.609 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.450 -0.595 -3.744 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.324 1.180 -3.720 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.932 0.350 -5.173 1.00 0.00 H new ATOM 1301 N GLN A 88 10.751 4.080 -6.022 1.00 0.00 N ATOM 1302 CA GLN A 88 11.470 5.324 -6.267 1.00 0.00 C ATOM 1303 C GLN A 88 10.826 6.483 -5.514 1.00 0.00 C ATOM 1304 O GLN A 88 9.601 6.576 -5.427 1.00 0.00 O ATOM 1305 CB GLN A 88 11.507 5.631 -7.765 1.00 0.00 C ATOM 1306 CG GLN A 88 12.233 4.577 -8.585 1.00 0.00 C ATOM 1307 CD GLN A 88 12.657 5.088 -9.948 1.00 0.00 C ATOM 1308 OE1 GLN A 88 12.165 4.625 -10.977 1.00 0.00 O ATOM 1309 NE2 GLN A 88 13.575 6.047 -9.961 1.00 0.00 N ATOM 0 H GLN A 88 9.740 4.146 -6.144 1.00 0.00 H new ATOM 0 HA GLN A 88 12.490 5.201 -5.904 1.00 0.00 H new ATOM 0 HB2 GLN A 88 10.485 5.726 -8.133 1.00 0.00 H new ATOM 0 HB3 GLN A 88 11.991 6.595 -7.918 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.113 4.239 -8.038 1.00 0.00 H new ATOM 0 HG3 GLN A 88 11.584 3.710 -8.712 1.00 0.00 H new ATOM 0 HE21 GLN A 88 13.955 6.401 -9.083 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.900 6.430 -10.849 1.00 0.00 H new ATOM 1318 N TYR A 89 11.658 7.364 -4.970 1.00 0.00 N ATOM 1319 CA TYR A 89 11.169 8.516 -4.221 1.00 0.00 C ATOM 1320 C TYR A 89 12.215 9.626 -4.186 1.00 0.00 C ATOM 1321 O TYR A 89 13.412 9.374 -4.323 1.00 0.00 O ATOM 1322 CB TYR A 89 10.798 8.104 -2.796 1.00 0.00 C ATOM 1323 CG TYR A 89 11.856 7.268 -2.112 1.00 0.00 C ATOM 1324 CD1 TYR A 89 12.928 7.866 -1.461 1.00 0.00 C ATOM 1325 CD2 TYR A 89 11.785 5.880 -2.119 1.00 0.00 C ATOM 1326 CE1 TYR A 89 13.898 7.106 -0.835 1.00 0.00 C ATOM 1327 CE2 TYR A 89 12.749 5.113 -1.495 1.00 0.00 C ATOM 1328 CZ TYR A 89 13.804 5.730 -0.855 1.00 0.00 C ATOM 1329 OH TYR A 89 14.767 4.969 -0.233 1.00 0.00 O ATOM 0 H TYR A 89 12.674 7.303 -5.034 1.00 0.00 H new ATOM 0 HA TYR A 89 10.280 8.895 -4.725 1.00 0.00 H new ATOM 0 HB2 TYR A 89 10.616 9.001 -2.203 1.00 0.00 H new ATOM 0 HB3 TYR A 89 9.864 7.543 -2.821 1.00 0.00 H new ATOM 0 HD1 TYR A 89 13.005 8.943 -1.444 1.00 0.00 H new ATOM 0 HD2 TYR A 89 10.962 5.393 -2.621 1.00 0.00 H new ATOM 0 HE1 TYR A 89 14.725 7.587 -0.333 1.00 0.00 H new ATOM 0 HE2 TYR A 89 12.677 4.035 -1.508 1.00 0.00 H new ATOM 0 HH TYR A 89 15.136 5.466 0.527 1.00 0.00 H new ATOM 1339 N THR A 90 11.753 10.859 -4.000 1.00 0.00 N ATOM 1340 CA THR A 90 12.646 12.010 -3.947 1.00 0.00 C ATOM 1341 C THR A 90 12.868 12.467 -2.510 1.00 0.00 C ATOM 1342 O THR A 90 12.028 12.242 -1.639 1.00 0.00 O ATOM 1343 CB THR A 90 12.093 13.189 -4.769 1.00 0.00 C ATOM 1344 OG1 THR A 90 10.773 13.520 -4.324 1.00 0.00 O ATOM 1345 CG2 THR A 90 12.064 12.848 -6.252 1.00 0.00 C ATOM 0 H THR A 90 10.765 11.086 -3.884 1.00 0.00 H new ATOM 0 HA THR A 90 13.596 11.693 -4.376 1.00 0.00 H new ATOM 0 HB THR A 90 12.750 14.046 -4.622 1.00 0.00 H new ATOM 0 HG1 THR A 90 10.429 14.272 -4.850 1.00 0.00 H new ATOM 0 HG21 THR A 90 11.670 13.696 -6.813 1.00 0.00 H new ATOM 0 HG22 THR A 90 13.075 12.625 -6.594 1.00 0.00 H new ATOM 0 HG23 THR A 90 11.427 11.979 -6.413 1.00 0.00 H new ATOM 1353 N VAL A 91 14.005 13.112 -2.268 1.00 0.00 N ATOM 1354 CA VAL A 91 14.337 13.603 -0.936 1.00 0.00 C ATOM 1355 C VAL A 91 14.405 15.126 -0.913 1.00 0.00 C ATOM 1356 O VAL A 91 15.063 15.756 -1.741 1.00 0.00 O ATOM 1357 CB VAL A 91 15.682 13.033 -0.446 1.00 0.00 C ATOM 1358 CG1 VAL A 91 16.059 13.634 0.899 1.00 0.00 C ATOM 1359 CG2 VAL A 91 15.617 11.515 -0.363 1.00 0.00 C ATOM 0 H VAL A 91 14.712 13.307 -2.977 1.00 0.00 H new ATOM 0 HA VAL A 91 13.544 13.267 -0.268 1.00 0.00 H new ATOM 0 HB VAL A 91 16.455 13.302 -1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 91 17.012 13.219 1.229 1.00 0.00 H new ATOM 0 HG12 VAL A 91 16.148 14.716 0.802 1.00 0.00 H new ATOM 0 HG13 VAL A 91 15.288 13.398 1.632 1.00 0.00 H new ATOM 0 HG21 VAL A 91 16.575 11.128 -0.015 1.00 0.00 H new ATOM 0 HG22 VAL A 91 14.833 11.222 0.335 1.00 0.00 H new ATOM 0 HG23 VAL A 91 15.397 11.106 -1.349 1.00 0.00 H new ATOM 1369 N PRO A 92 13.709 15.735 0.059 1.00 0.00 N ATOM 1370 CA PRO A 92 13.675 17.192 0.214 1.00 0.00 C ATOM 1371 C PRO A 92 15.011 17.756 0.684 1.00 0.00 C ATOM 1372 O PRO A 92 15.204 18.015 1.871 1.00 0.00 O ATOM 1373 CB PRO A 92 12.598 17.410 1.281 1.00 0.00 C ATOM 1374 CG PRO A 92 12.575 16.140 2.060 1.00 0.00 C ATOM 1375 CD PRO A 92 12.902 15.047 1.081 1.00 0.00 C ATOM 0 HA PRO A 92 13.469 17.698 -0.729 1.00 0.00 H new ATOM 0 HB2 PRO A 92 12.838 18.261 1.918 1.00 0.00 H new ATOM 0 HB3 PRO A 92 11.628 17.615 0.828 1.00 0.00 H new ATOM 0 HG2 PRO A 92 13.302 16.167 2.872 1.00 0.00 H new ATOM 0 HG3 PRO A 92 11.597 15.978 2.513 1.00 0.00 H new ATOM 0 HD2 PRO A 92 13.458 14.237 1.554 1.00 0.00 H new ATOM 0 HD3 PRO A 92 12.001 14.608 0.653 1.00 0.00 H new ATOM 1383 N GLY A 93 15.932 17.945 -0.257 1.00 0.00 N ATOM 1384 CA GLY A 93 17.239 18.478 0.081 1.00 0.00 C ATOM 1385 C GLY A 93 18.365 17.736 -0.613 1.00 0.00 C ATOM 1386 O GLY A 93 19.460 17.601 -0.066 1.00 0.00 O ATOM 0 H GLY A 93 15.796 17.739 -1.247 1.00 0.00 H new ATOM 0 HA2 GLY A 93 17.280 19.532 -0.193 1.00 0.00 H new ATOM 0 HA3 GLY A 93 17.383 18.423 1.160 1.00 0.00 H new ATOM 1390 N THR A 94 18.096 17.253 -1.822 1.00 0.00 N ATOM 1391 CA THR A 94 19.093 16.519 -2.591 1.00 0.00 C ATOM 1392 C THR A 94 18.873 16.697 -4.088 1.00 0.00 C ATOM 1393 O THR A 94 17.925 17.358 -4.511 1.00 0.00 O ATOM 1394 CB THR A 94 19.067 15.016 -2.255 1.00 0.00 C ATOM 1395 OG1 THR A 94 20.349 14.433 -2.515 1.00 0.00 O ATOM 1396 CG2 THR A 94 18.002 14.298 -3.070 1.00 0.00 C ATOM 0 H THR A 94 17.196 17.357 -2.290 1.00 0.00 H new ATOM 0 HA THR A 94 20.066 16.928 -2.318 1.00 0.00 H new ATOM 0 HB THR A 94 18.827 14.907 -1.197 1.00 0.00 H new ATOM 0 HG1 THR A 94 20.324 13.478 -2.297 1.00 0.00 H new ATOM 0 HG21 THR A 94 18.002 13.238 -2.816 1.00 0.00 H new ATOM 0 HG22 THR A 94 17.024 14.724 -2.847 1.00 0.00 H new ATOM 0 HG23 THR A 94 18.215 14.416 -4.132 1.00 0.00 H new ATOM 1404 N GLU A 95 19.755 16.103 -4.886 1.00 0.00 N ATOM 1405 CA GLU A 95 19.656 16.197 -6.338 1.00 0.00 C ATOM 1406 C GLU A 95 19.474 14.816 -6.962 1.00 0.00 C ATOM 1407 O GLU A 95 20.331 13.944 -6.825 1.00 0.00 O ATOM 1408 CB GLU A 95 20.904 16.869 -6.914 1.00 0.00 C ATOM 1409 CG GLU A 95 20.944 18.372 -6.691 1.00 0.00 C ATOM 1410 CD GLU A 95 19.881 19.107 -7.483 1.00 0.00 C ATOM 1411 OE1 GLU A 95 19.458 18.585 -8.536 1.00 0.00 O ATOM 1412 OE2 GLU A 95 19.472 20.205 -7.051 1.00 0.00 O ATOM 0 H GLU A 95 20.546 15.552 -4.552 1.00 0.00 H new ATOM 0 HA GLU A 95 18.782 16.803 -6.578 1.00 0.00 H new ATOM 0 HB2 GLU A 95 21.789 16.420 -6.463 1.00 0.00 H new ATOM 0 HB3 GLU A 95 20.954 16.667 -7.984 1.00 0.00 H new ATOM 0 HG2 GLU A 95 20.811 18.582 -5.630 1.00 0.00 H new ATOM 0 HG3 GLU A 95 21.927 18.751 -6.970 1.00 0.00 H new ATOM 1419 N GLY A 96 18.351 14.626 -7.647 1.00 0.00 N ATOM 1420 CA GLY A 96 18.076 13.350 -8.281 1.00 0.00 C ATOM 1421 C GLY A 96 17.015 12.555 -7.547 1.00 0.00 C ATOM 1422 O GLY A 96 16.442 13.028 -6.566 1.00 0.00 O ATOM 0 H GLY A 96 17.627 15.333 -7.774 1.00 0.00 H new ATOM 0 HA2 GLY A 96 17.753 13.520 -9.308 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.995 12.766 -8.329 1.00 0.00 H new ATOM 1426 N VAL A 97 16.751 11.342 -8.024 1.00 0.00 N ATOM 1427 CA VAL A 97 15.751 10.479 -7.406 1.00 0.00 C ATOM 1428 C VAL A 97 16.397 9.243 -6.790 1.00 0.00 C ATOM 1429 O VAL A 97 17.283 8.628 -7.385 1.00 0.00 O ATOM 1430 CB VAL A 97 14.687 10.033 -8.427 1.00 0.00 C ATOM 1431 CG1 VAL A 97 13.731 9.031 -7.798 1.00 0.00 C ATOM 1432 CG2 VAL A 97 13.931 11.237 -8.968 1.00 0.00 C ATOM 0 H VAL A 97 17.216 10.935 -8.836 1.00 0.00 H new ATOM 0 HA VAL A 97 15.270 11.063 -6.622 1.00 0.00 H new ATOM 0 HB VAL A 97 15.190 9.544 -9.261 1.00 0.00 H new ATOM 0 HG11 VAL A 97 12.986 8.727 -8.534 1.00 0.00 H new ATOM 0 HG12 VAL A 97 14.289 8.156 -7.464 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.232 9.491 -6.945 1.00 0.00 H new ATOM 0 HG21 VAL A 97 13.183 10.904 -9.688 1.00 0.00 H new ATOM 0 HG22 VAL A 97 13.438 11.756 -8.146 1.00 0.00 H new ATOM 0 HG23 VAL A 97 14.630 11.915 -9.458 1.00 0.00 H new ATOM 1442 N THR A 98 15.949 8.883 -5.591 1.00 0.00 N ATOM 1443 CA THR A 98 16.483 7.721 -4.892 1.00 0.00 C ATOM 1444 C THR A 98 15.539 6.530 -5.005 1.00 0.00 C ATOM 1445 O THR A 98 14.325 6.674 -4.866 1.00 0.00 O ATOM 1446 CB THR A 98 16.731 8.026 -3.403 1.00 0.00 C ATOM 1447 OG1 THR A 98 17.652 9.115 -3.273 1.00 0.00 O ATOM 1448 CG2 THR A 98 17.280 6.803 -2.684 1.00 0.00 C ATOM 0 H THR A 98 15.217 9.380 -5.084 1.00 0.00 H new ATOM 0 HA THR A 98 17.432 7.475 -5.368 1.00 0.00 H new ATOM 0 HB THR A 98 15.779 8.299 -2.947 1.00 0.00 H new ATOM 0 HG1 THR A 98 17.803 9.304 -2.323 1.00 0.00 H new ATOM 0 HG21 THR A 98 17.447 7.043 -1.634 1.00 0.00 H new ATOM 0 HG22 THR A 98 16.564 5.985 -2.760 1.00 0.00 H new ATOM 0 HG23 THR A 98 18.223 6.504 -3.142 1.00 0.00 H new ATOM 1456 N GLN A 99 16.105 5.354 -5.257 1.00 0.00 N ATOM 1457 CA GLN A 99 15.311 4.137 -5.388 1.00 0.00 C ATOM 1458 C GLN A 99 15.589 3.180 -4.234 1.00 0.00 C ATOM 1459 O GLN A 99 16.532 3.373 -3.465 1.00 0.00 O ATOM 1460 CB GLN A 99 15.611 3.449 -6.721 1.00 0.00 C ATOM 1461 CG GLN A 99 17.079 3.101 -6.909 1.00 0.00 C ATOM 1462 CD GLN A 99 17.597 2.160 -5.840 1.00 0.00 C ATOM 1463 OE1 GLN A 99 18.556 2.473 -5.133 1.00 0.00 O ATOM 1464 NE2 GLN A 99 16.965 0.999 -5.716 1.00 0.00 N ATOM 0 H GLN A 99 17.109 5.218 -5.374 1.00 0.00 H new ATOM 0 HA GLN A 99 14.257 4.415 -5.360 1.00 0.00 H new ATOM 0 HB2 GLN A 99 15.018 2.537 -6.791 1.00 0.00 H new ATOM 0 HB3 GLN A 99 15.293 4.099 -7.536 1.00 0.00 H new ATOM 0 HG2 GLN A 99 17.217 2.643 -7.889 1.00 0.00 H new ATOM 0 HG3 GLN A 99 17.670 4.017 -6.899 1.00 0.00 H new ATOM 0 HE21 GLN A 99 16.175 0.781 -6.323 1.00 0.00 H new ATOM 0 HE22 GLN A 99 17.270 0.325 -5.014 1.00 0.00 H new ATOM 1473 N LEU A 100 14.762 2.147 -4.117 1.00 0.00 N ATOM 1474 CA LEU A 100 14.918 1.158 -3.056 1.00 0.00 C ATOM 1475 C LEU A 100 14.781 -0.258 -3.607 1.00 0.00 C ATOM 1476 O LEU A 100 13.867 -0.550 -4.379 1.00 0.00 O ATOM 1477 CB LEU A 100 13.880 1.392 -1.957 1.00 0.00 C ATOM 1478 CG LEU A 100 14.016 0.520 -0.708 1.00 0.00 C ATOM 1479 CD1 LEU A 100 15.083 1.079 0.220 1.00 0.00 C ATOM 1480 CD2 LEU A 100 12.681 0.412 0.015 1.00 0.00 C ATOM 0 H LEU A 100 13.976 1.972 -4.744 1.00 0.00 H new ATOM 0 HA LEU A 100 15.917 1.269 -2.634 1.00 0.00 H new ATOM 0 HB2 LEU A 100 13.932 2.437 -1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 100 12.889 1.232 -2.381 1.00 0.00 H new ATOM 0 HG LEU A 100 14.321 -0.480 -1.018 1.00 0.00 H new ATOM 0 HD11 LEU A 100 15.165 0.445 1.103 1.00 0.00 H new ATOM 0 HD12 LEU A 100 16.041 1.103 -0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 100 14.809 2.090 0.523 1.00 0.00 H new ATOM 0 HD21 LEU A 100 12.797 -0.212 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 100 12.347 1.406 0.312 1.00 0.00 H new ATOM 0 HD23 LEU A 100 11.942 -0.035 -0.650 1.00 0.00 H new ATOM 1492 N LYS A 101 15.694 -1.135 -3.203 1.00 0.00 N ATOM 1493 CA LYS A 101 15.674 -2.522 -3.652 1.00 0.00 C ATOM 1494 C LYS A 101 15.491 -3.473 -2.474 1.00 0.00 C ATOM 1495 O LYS A 101 16.133 -3.321 -1.434 1.00 0.00 O ATOM 1496 CB LYS A 101 16.970 -2.857 -4.395 1.00 0.00 C ATOM 1497 CG LYS A 101 16.798 -3.917 -5.470 1.00 0.00 C ATOM 1498 CD LYS A 101 17.971 -3.927 -6.435 1.00 0.00 C ATOM 1499 CE LYS A 101 17.719 -4.860 -7.609 1.00 0.00 C ATOM 1500 NZ LYS A 101 18.989 -5.321 -8.235 1.00 0.00 N ATOM 0 H LYS A 101 16.457 -0.909 -2.565 1.00 0.00 H new ATOM 0 HA LYS A 101 14.830 -2.646 -4.331 1.00 0.00 H new ATOM 0 HB2 LYS A 101 17.362 -1.948 -4.852 1.00 0.00 H new ATOM 0 HB3 LYS A 101 17.714 -3.199 -3.675 1.00 0.00 H new ATOM 0 HG2 LYS A 101 16.701 -4.897 -5.003 1.00 0.00 H new ATOM 0 HG3 LYS A 101 15.875 -3.733 -6.020 1.00 0.00 H new ATOM 0 HD2 LYS A 101 18.149 -2.917 -6.804 1.00 0.00 H new ATOM 0 HD3 LYS A 101 18.874 -4.238 -5.909 1.00 0.00 H new ATOM 0 HE2 LYS A 101 17.147 -5.724 -7.270 1.00 0.00 H new ATOM 0 HE3 LYS A 101 17.111 -4.348 -8.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 18.774 -5.955 -9.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 19.524 -4.499 -8.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 19.558 -5.832 -7.530 1.00 0.00 H new ATOM 1514 N LEU A 102 14.612 -4.455 -2.643 1.00 0.00 N ATOM 1515 CA LEU A 102 14.346 -5.432 -1.594 1.00 0.00 C ATOM 1516 C LEU A 102 14.576 -6.852 -2.101 1.00 0.00 C ATOM 1517 O LEU A 102 14.460 -7.123 -3.297 1.00 0.00 O ATOM 1518 CB LEU A 102 12.910 -5.286 -1.086 1.00 0.00 C ATOM 1519 CG LEU A 102 12.532 -3.915 -0.525 1.00 0.00 C ATOM 1520 CD1 LEU A 102 11.024 -3.800 -0.366 1.00 0.00 C ATOM 1521 CD2 LEU A 102 13.231 -3.672 0.805 1.00 0.00 C ATOM 0 H LEU A 102 14.072 -4.595 -3.497 1.00 0.00 H new ATOM 0 HA LEU A 102 15.037 -5.243 -0.772 1.00 0.00 H new ATOM 0 HB2 LEU A 102 12.231 -5.521 -1.905 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.743 -6.033 -0.310 1.00 0.00 H new ATOM 0 HG LEU A 102 12.861 -3.152 -1.230 1.00 0.00 H new ATOM 0 HD11 LEU A 102 10.774 -2.817 0.034 1.00 0.00 H new ATOM 0 HD12 LEU A 102 10.545 -3.929 -1.337 1.00 0.00 H new ATOM 0 HD13 LEU A 102 10.670 -4.571 0.318 1.00 0.00 H new ATOM 0 HD21 LEU A 102 12.950 -2.691 1.190 1.00 0.00 H new ATOM 0 HD22 LEU A 102 12.933 -4.440 1.518 1.00 0.00 H new ATOM 0 HD23 LEU A 102 14.311 -3.710 0.661 1.00 0.00 H new ATOM 1533 N THR A 103 14.900 -7.758 -1.183 1.00 0.00 N ATOM 1534 CA THR A 103 15.146 -9.150 -1.536 1.00 0.00 C ATOM 1535 C THR A 103 14.601 -10.093 -0.469 1.00 0.00 C ATOM 1536 O THR A 103 14.613 -9.773 0.720 1.00 0.00 O ATOM 1537 CB THR A 103 16.649 -9.425 -1.729 1.00 0.00 C ATOM 1538 OG1 THR A 103 17.195 -8.512 -2.688 1.00 0.00 O ATOM 1539 CG2 THR A 103 16.884 -10.855 -2.192 1.00 0.00 C ATOM 0 H THR A 103 14.998 -7.552 -0.189 1.00 0.00 H new ATOM 0 HA THR A 103 14.628 -9.333 -2.477 1.00 0.00 H new ATOM 0 HB THR A 103 17.147 -9.285 -0.769 1.00 0.00 H new ATOM 0 HG1 THR A 103 18.151 -8.692 -2.804 1.00 0.00 H new ATOM 0 HG21 THR A 103 17.953 -11.025 -2.321 1.00 0.00 H new ATOM 0 HG22 THR A 103 16.494 -11.548 -1.446 1.00 0.00 H new ATOM 0 HG23 THR A 103 16.373 -11.019 -3.141 1.00 0.00 H new ATOM 1547 N VAL A 104 14.125 -11.256 -0.901 1.00 0.00 N ATOM 1548 CA VAL A 104 13.578 -12.247 0.019 1.00 0.00 C ATOM 1549 C VAL A 104 14.673 -13.156 0.563 1.00 0.00 C ATOM 1550 O VAL A 104 15.343 -13.860 -0.194 1.00 0.00 O ATOM 1551 CB VAL A 104 12.500 -13.110 -0.663 1.00 0.00 C ATOM 1552 CG1 VAL A 104 11.891 -14.087 0.331 1.00 0.00 C ATOM 1553 CG2 VAL A 104 11.426 -12.229 -1.283 1.00 0.00 C ATOM 0 H VAL A 104 14.107 -11.536 -1.882 1.00 0.00 H new ATOM 0 HA VAL A 104 13.125 -11.697 0.844 1.00 0.00 H new ATOM 0 HB VAL A 104 12.970 -13.685 -1.460 1.00 0.00 H new ATOM 0 HG11 VAL A 104 11.131 -14.688 -0.169 1.00 0.00 H new ATOM 0 HG12 VAL A 104 12.671 -14.740 0.723 1.00 0.00 H new ATOM 0 HG13 VAL A 104 11.434 -13.534 1.152 1.00 0.00 H new ATOM 0 HG21 VAL A 104 10.673 -12.855 -1.761 1.00 0.00 H new ATOM 0 HG22 VAL A 104 10.957 -11.626 -0.506 1.00 0.00 H new ATOM 0 HG23 VAL A 104 11.878 -11.574 -2.028 1.00 0.00 H new ATOM 1563 N VAL A 105 14.851 -13.138 1.880 1.00 0.00 N ATOM 1564 CA VAL A 105 15.865 -13.963 2.526 1.00 0.00 C ATOM 1565 C VAL A 105 15.297 -15.320 2.924 1.00 0.00 C ATOM 1566 O VAL A 105 15.910 -16.058 3.695 1.00 0.00 O ATOM 1567 CB VAL A 105 16.437 -13.271 3.778 1.00 0.00 C ATOM 1568 CG1 VAL A 105 17.690 -13.987 4.259 1.00 0.00 C ATOM 1569 CG2 VAL A 105 16.728 -11.806 3.490 1.00 0.00 C ATOM 0 H VAL A 105 14.306 -12.561 2.521 1.00 0.00 H new ATOM 0 HA VAL A 105 16.666 -14.106 1.801 1.00 0.00 H new ATOM 0 HB VAL A 105 15.692 -13.321 4.572 1.00 0.00 H new ATOM 0 HG11 VAL A 105 18.080 -13.484 5.144 1.00 0.00 H new ATOM 0 HG12 VAL A 105 17.446 -15.020 4.507 1.00 0.00 H new ATOM 0 HG13 VAL A 105 18.443 -13.971 3.471 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.131 -11.332 4.385 1.00 0.00 H new ATOM 0 HG22 VAL A 105 17.455 -11.732 2.681 1.00 0.00 H new ATOM 0 HG23 VAL A 105 15.807 -11.303 3.197 1.00 0.00 H new ATOM 1579 N GLU A 106 14.122 -15.643 2.392 1.00 0.00 N ATOM 1580 CA GLU A 106 13.471 -16.913 2.693 1.00 0.00 C ATOM 1581 C GLU A 106 13.253 -17.727 1.421 1.00 0.00 C ATOM 1582 O GLU A 106 12.810 -17.199 0.401 1.00 0.00 O ATOM 1583 CB GLU A 106 12.132 -16.672 3.393 1.00 0.00 C ATOM 1584 CG GLU A 106 12.263 -15.960 4.729 1.00 0.00 C ATOM 1585 CD GLU A 106 12.554 -16.913 5.872 1.00 0.00 C ATOM 1586 OE1 GLU A 106 13.449 -17.770 5.716 1.00 0.00 O ATOM 1587 OE2 GLU A 106 11.887 -16.802 6.922 1.00 0.00 O ATOM 0 H GLU A 106 13.602 -15.044 1.751 1.00 0.00 H new ATOM 0 HA GLU A 106 14.124 -17.478 3.358 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.490 -16.083 2.738 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.635 -17.630 3.548 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.061 -15.220 4.666 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.341 -15.417 4.939 1.00 0.00 H new ATOM 1594 N ASP A 107 13.569 -19.016 1.489 1.00 0.00 N ATOM 1595 CA ASP A 107 13.408 -19.904 0.344 1.00 0.00 C ATOM 1596 C ASP A 107 12.261 -20.884 0.573 1.00 0.00 C ATOM 1597 O ASP A 107 11.613 -21.330 -0.374 1.00 0.00 O ATOM 1598 CB ASP A 107 14.705 -20.671 0.079 1.00 0.00 C ATOM 1599 CG ASP A 107 15.700 -19.862 -0.730 1.00 0.00 C ATOM 1600 OD1 ASP A 107 16.149 -18.808 -0.234 1.00 0.00 O ATOM 1601 OD2 ASP A 107 16.029 -20.283 -1.859 1.00 0.00 O ATOM 0 H ASP A 107 13.938 -19.469 2.325 1.00 0.00 H new ATOM 0 HA ASP A 107 13.172 -19.293 -0.527 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.158 -20.953 1.030 1.00 0.00 H new ATOM 0 HB3 ASP A 107 14.476 -21.595 -0.451 1.00 0.00 H new ATOM 1606 N VAL A 108 12.017 -21.216 1.837 1.00 0.00 N ATOM 1607 CA VAL A 108 10.949 -22.143 2.191 1.00 0.00 C ATOM 1608 C VAL A 108 9.583 -21.571 1.831 1.00 0.00 C ATOM 1609 O VAL A 108 9.483 -20.486 1.257 1.00 0.00 O ATOM 1610 CB VAL A 108 10.973 -22.478 3.694 1.00 0.00 C ATOM 1611 CG1 VAL A 108 12.400 -22.701 4.170 1.00 0.00 C ATOM 1612 CG2 VAL A 108 10.301 -21.374 4.497 1.00 0.00 C ATOM 0 H VAL A 108 12.545 -20.857 2.633 1.00 0.00 H new ATOM 0 HA VAL A 108 11.119 -23.056 1.620 1.00 0.00 H new ATOM 0 HB VAL A 108 10.415 -23.401 3.851 1.00 0.00 H new ATOM 0 HG11 VAL A 108 12.396 -22.936 5.234 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.843 -23.529 3.617 1.00 0.00 H new ATOM 0 HG13 VAL A 108 12.985 -21.797 4.001 1.00 0.00 H new ATOM 0 HG21 VAL A 108 10.327 -21.627 5.557 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.829 -20.434 4.336 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.265 -21.269 4.175 1.00 0.00 H new ATOM 1622 N THR A 109 8.530 -22.308 2.171 1.00 0.00 N ATOM 1623 CA THR A 109 7.169 -21.875 1.883 1.00 0.00 C ATOM 1624 C THR A 109 6.733 -20.763 2.830 1.00 0.00 C ATOM 1625 O THR A 109 6.265 -19.711 2.395 1.00 0.00 O ATOM 1626 CB THR A 109 6.172 -23.045 1.991 1.00 0.00 C ATOM 1627 OG1 THR A 109 6.347 -23.940 0.887 1.00 0.00 O ATOM 1628 CG2 THR A 109 4.739 -22.535 2.015 1.00 0.00 C ATOM 0 H THR A 109 8.594 -23.208 2.646 1.00 0.00 H new ATOM 0 HA THR A 109 7.168 -21.499 0.860 1.00 0.00 H new ATOM 0 HB THR A 109 6.367 -23.575 2.923 1.00 0.00 H new ATOM 0 HG1 THR A 109 5.711 -24.682 0.963 1.00 0.00 H new ATOM 0 HG21 THR A 109 4.054 -23.379 2.092 1.00 0.00 H new ATOM 0 HG22 THR A 109 4.601 -21.877 2.873 1.00 0.00 H new ATOM 0 HG23 THR A 109 4.534 -21.983 1.098 1.00 0.00 H new ATOM 1636 N VAL A 110 6.892 -21.001 4.128 1.00 0.00 N ATOM 1637 CA VAL A 110 6.517 -20.019 5.138 1.00 0.00 C ATOM 1638 C VAL A 110 6.948 -18.616 4.726 1.00 0.00 C ATOM 1639 O VAL A 110 6.119 -17.779 4.372 1.00 0.00 O ATOM 1640 CB VAL A 110 7.139 -20.354 6.506 1.00 0.00 C ATOM 1641 CG1 VAL A 110 6.920 -19.212 7.487 1.00 0.00 C ATOM 1642 CG2 VAL A 110 6.561 -21.652 7.049 1.00 0.00 C ATOM 0 H VAL A 110 7.278 -21.866 4.505 1.00 0.00 H new ATOM 0 HA VAL A 110 5.431 -20.053 5.224 1.00 0.00 H new ATOM 0 HB VAL A 110 8.213 -20.487 6.375 1.00 0.00 H new ATOM 0 HG11 VAL A 110 7.366 -19.467 8.448 1.00 0.00 H new ATOM 0 HG12 VAL A 110 7.385 -18.306 7.100 1.00 0.00 H new ATOM 0 HG13 VAL A 110 5.851 -19.044 7.617 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.011 -21.874 8.016 1.00 0.00 H new ATOM 0 HG22 VAL A 110 5.482 -21.549 7.166 1.00 0.00 H new ATOM 0 HG23 VAL A 110 6.775 -22.464 6.354 1.00 0.00 H new ATOM 1652 N GLY A 111 8.253 -18.365 4.774 1.00 0.00 N ATOM 1653 CA GLY A 111 8.773 -17.062 4.403 1.00 0.00 C ATOM 1654 C GLY A 111 8.337 -16.639 3.014 1.00 0.00 C ATOM 1655 O GLY A 111 7.571 -15.688 2.859 1.00 0.00 O ATOM 0 H GLY A 111 8.960 -19.041 5.063 1.00 0.00 H new ATOM 0 HA2 GLY A 111 8.437 -16.320 5.128 1.00 0.00 H new ATOM 0 HA3 GLY A 111 9.862 -17.082 4.449 1.00 0.00 H new ATOM 1659 N ARG A 112 8.828 -17.345 2.001 1.00 0.00 N ATOM 1660 CA ARG A 112 8.487 -17.035 0.618 1.00 0.00 C ATOM 1661 C ARG A 112 7.048 -16.539 0.510 1.00 0.00 C ATOM 1662 O ARG A 112 6.795 -15.440 0.017 1.00 0.00 O ATOM 1663 CB ARG A 112 8.680 -18.268 -0.267 1.00 0.00 C ATOM 1664 CG ARG A 112 8.640 -17.963 -1.755 1.00 0.00 C ATOM 1665 CD ARG A 112 9.975 -17.426 -2.250 1.00 0.00 C ATOM 1666 NE ARG A 112 10.945 -18.494 -2.474 1.00 0.00 N ATOM 1667 CZ ARG A 112 12.160 -18.291 -2.971 1.00 0.00 C ATOM 1668 NH1 ARG A 112 12.551 -17.066 -3.294 1.00 0.00 N ATOM 1669 NH2 ARG A 112 12.986 -19.314 -3.146 1.00 0.00 N ATOM 0 H ARG A 112 9.463 -18.135 2.112 1.00 0.00 H new ATOM 0 HA ARG A 112 9.153 -16.243 0.276 1.00 0.00 H new ATOM 0 HB2 ARG A 112 9.636 -18.732 -0.026 1.00 0.00 H new ATOM 0 HB3 ARG A 112 7.904 -18.997 -0.033 1.00 0.00 H new ATOM 0 HG2 ARG A 112 8.384 -18.868 -2.306 1.00 0.00 H new ATOM 0 HG3 ARG A 112 7.856 -17.234 -1.957 1.00 0.00 H new ATOM 0 HD2 ARG A 112 9.822 -16.874 -3.178 1.00 0.00 H new ATOM 0 HD3 ARG A 112 10.374 -16.720 -1.522 1.00 0.00 H new ATOM 0 HE ARG A 112 10.675 -19.448 -2.236 1.00 0.00 H new ATOM 0 HH11 ARG A 112 11.918 -16.277 -3.161 1.00 0.00 H new ATOM 0 HH12 ARG A 112 13.484 -16.913 -3.675 1.00 0.00 H new ATOM 0 HH21 ARG A 112 12.688 -20.258 -2.899 1.00 0.00 H new ATOM 0 HH22 ARG A 112 13.919 -19.157 -3.528 1.00 0.00 H new ATOM 1683 N ARG A 113 6.110 -17.357 0.974 1.00 0.00 N ATOM 1684 CA ARG A 113 4.696 -17.003 0.929 1.00 0.00 C ATOM 1685 C ARG A 113 4.452 -15.653 1.598 1.00 0.00 C ATOM 1686 O ARG A 113 3.750 -14.800 1.057 1.00 0.00 O ATOM 1687 CB ARG A 113 3.856 -18.082 1.613 1.00 0.00 C ATOM 1688 CG ARG A 113 3.555 -19.276 0.721 1.00 0.00 C ATOM 1689 CD ARG A 113 2.507 -18.937 -0.328 1.00 0.00 C ATOM 1690 NE ARG A 113 1.164 -18.869 0.241 1.00 0.00 N ATOM 1691 CZ ARG A 113 0.478 -19.936 0.636 1.00 0.00 C ATOM 1692 NH1 ARG A 113 1.007 -21.147 0.525 1.00 0.00 N ATOM 1693 NH2 ARG A 113 -0.739 -19.793 1.145 1.00 0.00 N ATOM 0 H ARG A 113 6.303 -18.270 1.386 1.00 0.00 H new ATOM 0 HA ARG A 113 4.399 -16.930 -0.117 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.380 -18.428 2.504 1.00 0.00 H new ATOM 0 HB3 ARG A 113 2.916 -17.642 1.946 1.00 0.00 H new ATOM 0 HG2 ARG A 113 4.471 -19.604 0.229 1.00 0.00 H new ATOM 0 HG3 ARG A 113 3.205 -20.108 1.331 1.00 0.00 H new ATOM 0 HD2 ARG A 113 2.753 -17.981 -0.791 1.00 0.00 H new ATOM 0 HD3 ARG A 113 2.528 -19.688 -1.118 1.00 0.00 H new ATOM 0 HE ARG A 113 0.729 -17.952 0.341 1.00 0.00 H new ATOM 0 HH11 ARG A 113 1.943 -21.261 0.136 1.00 0.00 H new ATOM 0 HH12 ARG A 113 0.478 -21.964 0.829 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -1.149 -18.863 1.233 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -1.265 -20.613 1.448 1.00 0.00 H new ATOM 1707 N GLN A 114 5.037 -15.469 2.778 1.00 0.00 N ATOM 1708 CA GLN A 114 4.881 -14.224 3.521 1.00 0.00 C ATOM 1709 C GLN A 114 5.463 -13.049 2.742 1.00 0.00 C ATOM 1710 O GLN A 114 4.736 -12.151 2.319 1.00 0.00 O ATOM 1711 CB GLN A 114 5.561 -14.333 4.887 1.00 0.00 C ATOM 1712 CG GLN A 114 5.288 -13.147 5.798 1.00 0.00 C ATOM 1713 CD GLN A 114 3.929 -13.226 6.466 1.00 0.00 C ATOM 1714 OE1 GLN A 114 3.431 -14.313 6.759 1.00 0.00 O ATOM 1715 NE2 GLN A 114 3.322 -12.071 6.711 1.00 0.00 N ATOM 0 H GLN A 114 5.622 -16.165 3.239 1.00 0.00 H new ATOM 0 HA GLN A 114 3.815 -14.047 3.666 1.00 0.00 H new ATOM 0 HB2 GLN A 114 5.224 -15.245 5.380 1.00 0.00 H new ATOM 0 HB3 GLN A 114 6.637 -14.429 4.742 1.00 0.00 H new ATOM 0 HG2 GLN A 114 6.063 -13.095 6.563 1.00 0.00 H new ATOM 0 HG3 GLN A 114 5.351 -12.226 5.218 1.00 0.00 H new ATOM 0 HE21 GLN A 114 3.772 -11.193 6.451 1.00 0.00 H new ATOM 0 HE22 GLN A 114 2.406 -12.061 7.159 1.00 0.00 H new ATOM 1724 N ALA A 115 6.779 -13.063 2.556 1.00 0.00 N ATOM 1725 CA ALA A 115 7.458 -11.999 1.826 1.00 0.00 C ATOM 1726 C ALA A 115 6.721 -11.662 0.534 1.00 0.00 C ATOM 1727 O ALA A 115 6.240 -10.543 0.356 1.00 0.00 O ATOM 1728 CB ALA A 115 8.896 -12.399 1.527 1.00 0.00 C ATOM 0 H ALA A 115 7.396 -13.799 2.900 1.00 0.00 H new ATOM 0 HA ALA A 115 7.463 -11.108 2.453 1.00 0.00 H new ATOM 0 HB1 ALA A 115 9.391 -11.596 0.982 1.00 0.00 H new ATOM 0 HB2 ALA A 115 9.425 -12.582 2.462 1.00 0.00 H new ATOM 0 HB3 ALA A 115 8.903 -13.306 0.922 1.00 0.00 H new ATOM 1734 N VAL A 116 6.637 -12.637 -0.365 1.00 0.00 N ATOM 1735 CA VAL A 116 5.958 -12.444 -1.641 1.00 0.00 C ATOM 1736 C VAL A 116 4.575 -11.833 -1.440 1.00 0.00 C ATOM 1737 O VAL A 116 4.184 -10.911 -2.154 1.00 0.00 O ATOM 1738 CB VAL A 116 5.815 -13.772 -2.407 1.00 0.00 C ATOM 1739 CG1 VAL A 116 5.015 -13.568 -3.685 1.00 0.00 C ATOM 1740 CG2 VAL A 116 7.183 -14.360 -2.714 1.00 0.00 C ATOM 0 H VAL A 116 7.031 -13.569 -0.233 1.00 0.00 H new ATOM 0 HA VAL A 116 6.572 -11.760 -2.227 1.00 0.00 H new ATOM 0 HB VAL A 116 5.274 -14.478 -1.777 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.924 -14.517 -4.213 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.022 -13.195 -3.437 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.525 -12.846 -4.322 1.00 0.00 H new ATOM 0 HG21 VAL A 116 7.063 -15.298 -3.256 1.00 0.00 H new ATOM 0 HG22 VAL A 116 7.752 -13.659 -3.325 1.00 0.00 H new ATOM 0 HG23 VAL A 116 7.717 -14.545 -1.782 1.00 0.00 H new ATOM 1750 N ALA A 117 3.840 -12.355 -0.464 1.00 0.00 N ATOM 1751 CA ALA A 117 2.502 -11.859 -0.167 1.00 0.00 C ATOM 1752 C ALA A 117 2.510 -10.350 0.048 1.00 0.00 C ATOM 1753 O ALA A 117 1.622 -9.641 -0.424 1.00 0.00 O ATOM 1754 CB ALA A 117 1.937 -12.566 1.056 1.00 0.00 C ATOM 0 H ALA A 117 4.148 -13.121 0.134 1.00 0.00 H new ATOM 0 HA ALA A 117 1.864 -12.073 -1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.937 -12.186 1.267 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.885 -13.638 0.865 1.00 0.00 H new ATOM 0 HB3 ALA A 117 2.583 -12.381 1.914 1.00 0.00 H new ATOM 1760 N TRP A 118 3.518 -9.865 0.765 1.00 0.00 N ATOM 1761 CA TRP A 118 3.641 -8.439 1.043 1.00 0.00 C ATOM 1762 C TRP A 118 4.205 -7.695 -0.162 1.00 0.00 C ATOM 1763 O TRP A 118 3.853 -6.542 -0.414 1.00 0.00 O ATOM 1764 CB TRP A 118 4.536 -8.212 2.263 1.00 0.00 C ATOM 1765 CG TRP A 118 4.527 -6.794 2.751 1.00 0.00 C ATOM 1766 CD1 TRP A 118 3.856 -6.305 3.835 1.00 0.00 C ATOM 1767 CD2 TRP A 118 5.219 -5.684 2.170 1.00 0.00 C ATOM 1768 NE1 TRP A 118 4.090 -4.957 3.963 1.00 0.00 N ATOM 1769 CE2 TRP A 118 4.923 -4.552 2.954 1.00 0.00 C ATOM 1770 CE3 TRP A 118 6.061 -5.536 1.065 1.00 0.00 C ATOM 1771 CZ2 TRP A 118 5.440 -3.291 2.667 1.00 0.00 C ATOM 1772 CZ3 TRP A 118 6.573 -4.284 0.780 1.00 0.00 C ATOM 1773 CH2 TRP A 118 6.262 -3.175 1.579 1.00 0.00 C ATOM 0 H TRP A 118 4.261 -10.438 1.164 1.00 0.00 H new ATOM 0 HA TRP A 118 2.645 -8.048 1.253 1.00 0.00 H new ATOM 0 HB2 TRP A 118 4.211 -8.869 3.070 1.00 0.00 H new ATOM 0 HB3 TRP A 118 5.558 -8.496 2.013 1.00 0.00 H new ATOM 0 HD1 TRP A 118 3.233 -6.891 4.494 1.00 0.00 H new ATOM 0 HE1 TRP A 118 3.706 -4.355 4.691 1.00 0.00 H new ATOM 0 HE3 TRP A 118 6.308 -6.385 0.444 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 5.201 -2.435 3.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 7.224 -4.158 -0.073 1.00 0.00 H new ATOM 0 HH2 TRP A 118 6.679 -2.210 1.331 1.00 0.00 H new ATOM 1784 N LEU A 119 5.082 -8.361 -0.905 1.00 0.00 N ATOM 1785 CA LEU A 119 5.696 -7.763 -2.086 1.00 0.00 C ATOM 1786 C LEU A 119 4.647 -7.470 -3.154 1.00 0.00 C ATOM 1787 O LEU A 119 4.620 -6.382 -3.730 1.00 0.00 O ATOM 1788 CB LEU A 119 6.772 -8.691 -2.651 1.00 0.00 C ATOM 1789 CG LEU A 119 8.024 -8.869 -1.791 1.00 0.00 C ATOM 1790 CD1 LEU A 119 8.894 -9.988 -2.342 1.00 0.00 C ATOM 1791 CD2 LEU A 119 8.809 -7.568 -1.715 1.00 0.00 C ATOM 0 H LEU A 119 5.384 -9.316 -0.711 1.00 0.00 H new ATOM 0 HA LEU A 119 6.158 -6.822 -1.789 1.00 0.00 H new ATOM 0 HB2 LEU A 119 6.327 -9.672 -2.817 1.00 0.00 H new ATOM 0 HB3 LEU A 119 7.076 -8.310 -3.626 1.00 0.00 H new ATOM 0 HG LEU A 119 7.713 -9.141 -0.782 1.00 0.00 H new ATOM 0 HD11 LEU A 119 9.780 -10.101 -1.718 1.00 0.00 H new ATOM 0 HD12 LEU A 119 8.330 -10.921 -2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 119 9.196 -9.746 -3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 119 9.696 -7.714 -1.099 1.00 0.00 H new ATOM 0 HD22 LEU A 119 9.109 -7.265 -2.718 1.00 0.00 H new ATOM 0 HD23 LEU A 119 8.184 -6.791 -1.273 1.00 0.00 H new ATOM 1803 N VAL A 120 3.785 -8.448 -3.413 1.00 0.00 N ATOM 1804 CA VAL A 120 2.732 -8.294 -4.410 1.00 0.00 C ATOM 1805 C VAL A 120 1.560 -7.494 -3.853 1.00 0.00 C ATOM 1806 O VAL A 120 0.964 -6.677 -4.554 1.00 0.00 O ATOM 1807 CB VAL A 120 2.219 -9.661 -4.900 1.00 0.00 C ATOM 1808 CG1 VAL A 120 1.452 -10.371 -3.795 1.00 0.00 C ATOM 1809 CG2 VAL A 120 1.352 -9.492 -6.139 1.00 0.00 C ATOM 0 H VAL A 120 3.795 -9.355 -2.947 1.00 0.00 H new ATOM 0 HA VAL A 120 3.169 -7.755 -5.251 1.00 0.00 H new ATOM 0 HB VAL A 120 3.078 -10.277 -5.167 1.00 0.00 H new ATOM 0 HG11 VAL A 120 1.097 -11.335 -4.160 1.00 0.00 H new ATOM 0 HG12 VAL A 120 2.108 -10.526 -2.939 1.00 0.00 H new ATOM 0 HG13 VAL A 120 0.600 -9.761 -3.494 1.00 0.00 H new ATOM 0 HG21 VAL A 120 0.998 -10.468 -6.471 1.00 0.00 H new ATOM 0 HG22 VAL A 120 0.498 -8.858 -5.902 1.00 0.00 H new ATOM 0 HG23 VAL A 120 1.938 -9.029 -6.933 1.00 0.00 H new ATOM 1819 N ALA A 121 1.235 -7.735 -2.587 1.00 0.00 N ATOM 1820 CA ALA A 121 0.135 -7.035 -1.935 1.00 0.00 C ATOM 1821 C ALA A 121 0.368 -5.528 -1.932 1.00 0.00 C ATOM 1822 O ALA A 121 -0.482 -4.758 -2.379 1.00 0.00 O ATOM 1823 CB ALA A 121 -0.045 -7.545 -0.513 1.00 0.00 C ATOM 0 H ALA A 121 1.718 -8.409 -1.993 1.00 0.00 H new ATOM 0 HA ALA A 121 -0.776 -7.234 -2.500 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -0.870 -7.014 -0.038 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -0.265 -8.612 -0.534 1.00 0.00 H new ATOM 0 HB3 ALA A 121 0.871 -7.375 0.053 1.00 0.00 H new ATOM 1829 N MET A 122 1.525 -5.113 -1.426 1.00 0.00 N ATOM 1830 CA MET A 122 1.869 -3.697 -1.367 1.00 0.00 C ATOM 1831 C MET A 122 1.551 -3.004 -2.688 1.00 0.00 C ATOM 1832 O MET A 122 0.642 -2.177 -2.763 1.00 0.00 O ATOM 1833 CB MET A 122 3.352 -3.525 -1.031 1.00 0.00 C ATOM 1834 CG MET A 122 3.735 -2.094 -0.690 1.00 0.00 C ATOM 1835 SD MET A 122 4.030 -1.085 -2.156 1.00 0.00 S ATOM 1836 CE MET A 122 3.788 0.559 -1.489 1.00 0.00 C ATOM 0 H MET A 122 2.240 -5.737 -1.051 1.00 0.00 H new ATOM 0 HA MET A 122 1.270 -3.235 -0.582 1.00 0.00 H new ATOM 0 HB2 MET A 122 3.603 -4.170 -0.189 1.00 0.00 H new ATOM 0 HB3 MET A 122 3.950 -3.860 -1.879 1.00 0.00 H new ATOM 0 HG2 MET A 122 2.941 -1.641 -0.096 1.00 0.00 H new ATOM 0 HG3 MET A 122 4.632 -2.100 -0.071 1.00 0.00 H new ATOM 0 HE1 MET A 122 3.937 1.297 -2.277 1.00 0.00 H new ATOM 0 HE2 MET A 122 2.775 0.647 -1.096 1.00 0.00 H new ATOM 0 HE3 MET A 122 4.505 0.735 -0.687 1.00 0.00 H new ATOM 1846 N HIS A 123 2.305 -3.347 -3.728 1.00 0.00 N ATOM 1847 CA HIS A 123 2.102 -2.758 -5.046 1.00 0.00 C ATOM 1848 C HIS A 123 0.617 -2.542 -5.323 1.00 0.00 C ATOM 1849 O HIS A 123 0.218 -1.509 -5.861 1.00 0.00 O ATOM 1850 CB HIS A 123 2.709 -3.653 -6.127 1.00 0.00 C ATOM 1851 CG HIS A 123 2.406 -3.198 -7.522 1.00 0.00 C ATOM 1852 ND1 HIS A 123 1.302 -3.623 -8.230 1.00 0.00 N ATOM 1853 CD2 HIS A 123 3.070 -2.347 -8.339 1.00 0.00 C ATOM 1854 CE1 HIS A 123 1.301 -3.056 -9.422 1.00 0.00 C ATOM 1855 NE2 HIS A 123 2.363 -2.276 -9.514 1.00 0.00 N ATOM 0 H HIS A 123 3.062 -4.030 -3.683 1.00 0.00 H new ATOM 0 HA HIS A 123 2.601 -1.789 -5.064 1.00 0.00 H new ATOM 0 HB2 HIS A 123 3.790 -3.689 -5.992 1.00 0.00 H new ATOM 0 HB3 HIS A 123 2.337 -4.669 -5.996 1.00 0.00 H new ATOM 0 HD2 HIS A 123 3.985 -1.822 -8.109 1.00 0.00 H new ATOM 0 HE1 HIS A 123 0.558 -3.205 -10.192 1.00 0.00 H new ATOM 0 HE2 HIS A 123 2.617 -1.713 -10.326 1.00 0.00 H new ATOM 1863 N LYS A 124 -0.198 -3.524 -4.951 1.00 0.00 N ATOM 1864 CA LYS A 124 -1.639 -3.443 -5.158 1.00 0.00 C ATOM 1865 C LYS A 124 -2.259 -2.381 -4.255 1.00 0.00 C ATOM 1866 O LYS A 124 -2.961 -1.486 -4.725 1.00 0.00 O ATOM 1867 CB LYS A 124 -2.291 -4.801 -4.888 1.00 0.00 C ATOM 1868 CG LYS A 124 -2.362 -5.695 -6.113 1.00 0.00 C ATOM 1869 CD LYS A 124 -1.007 -6.299 -6.442 1.00 0.00 C ATOM 1870 CE LYS A 124 -0.941 -6.764 -7.889 1.00 0.00 C ATOM 1871 NZ LYS A 124 -1.576 -8.098 -8.073 1.00 0.00 N ATOM 0 H LYS A 124 0.116 -4.386 -4.504 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.817 -3.162 -6.196 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -1.732 -5.314 -4.106 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.299 -4.641 -4.506 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -3.085 -6.493 -5.941 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -2.721 -5.118 -6.965 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -0.225 -5.562 -6.259 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -0.812 -7.142 -5.779 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -1.438 -6.034 -8.528 1.00 0.00 H new ATOM 0 HE3 LYS A 124 0.100 -6.810 -8.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -1.510 -8.379 -9.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -1.086 -8.800 -7.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -2.576 -8.048 -7.793 1.00 0.00 H new ATOM 1885 N ALA A 125 -1.993 -2.486 -2.957 1.00 0.00 N ATOM 1886 CA ALA A 125 -2.522 -1.532 -1.990 1.00 0.00 C ATOM 1887 C ALA A 125 -2.192 -0.099 -2.394 1.00 0.00 C ATOM 1888 O ALA A 125 -2.932 0.831 -2.078 1.00 0.00 O ATOM 1889 CB ALA A 125 -1.975 -1.830 -0.602 1.00 0.00 C ATOM 0 H ALA A 125 -1.415 -3.222 -2.551 1.00 0.00 H new ATOM 0 HA ALA A 125 -3.607 -1.635 -1.972 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -2.378 -1.110 0.110 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -2.267 -2.837 -0.304 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -0.888 -1.757 -0.616 1.00 0.00 H new ATOM 1895 N ALA A 126 -1.075 0.070 -3.094 1.00 0.00 N ATOM 1896 CA ALA A 126 -0.648 1.390 -3.543 1.00 0.00 C ATOM 1897 C ALA A 126 -1.617 1.960 -4.573 1.00 0.00 C ATOM 1898 O ALA A 126 -2.076 3.096 -4.447 1.00 0.00 O ATOM 1899 CB ALA A 126 0.758 1.321 -4.120 1.00 0.00 C ATOM 0 H ALA A 126 -0.450 -0.690 -3.362 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.643 2.056 -2.680 1.00 0.00 H new ATOM 0 HB1 ALA A 126 1.064 2.313 -4.451 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.448 0.965 -3.355 1.00 0.00 H new ATOM 0 HB3 ALA A 126 0.770 0.636 -4.967 1.00 0.00 H new ATOM 1905 N LYS A 127 -1.925 1.166 -5.592 1.00 0.00 N ATOM 1906 CA LYS A 127 -2.840 1.590 -6.645 1.00 0.00 C ATOM 1907 C LYS A 127 -3.919 2.514 -6.088 1.00 0.00 C ATOM 1908 O LYS A 127 -4.091 3.639 -6.558 1.00 0.00 O ATOM 1909 CB LYS A 127 -3.488 0.373 -7.308 1.00 0.00 C ATOM 1910 CG LYS A 127 -2.706 -0.162 -8.495 1.00 0.00 C ATOM 1911 CD LYS A 127 -3.515 -1.179 -9.283 1.00 0.00 C ATOM 1912 CE LYS A 127 -2.614 -2.131 -10.053 1.00 0.00 C ATOM 1913 NZ LYS A 127 -2.192 -3.291 -9.220 1.00 0.00 N ATOM 0 H LYS A 127 -1.554 0.223 -5.711 1.00 0.00 H new ATOM 0 HA LYS A 127 -2.266 2.139 -7.391 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -3.595 -0.420 -6.567 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -4.492 0.640 -7.636 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -2.423 0.664 -9.148 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.782 -0.623 -8.145 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -4.149 -1.747 -8.603 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -4.176 -0.660 -9.977 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -3.138 -2.491 -10.938 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -1.732 -1.594 -10.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -1.579 -3.916 -9.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -1.670 -2.949 -8.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -3.032 -3.819 -8.908 1.00 0.00 H new ATOM 1927 N LEU A 128 -4.642 2.032 -5.083 1.00 0.00 N ATOM 1928 CA LEU A 128 -5.704 2.815 -4.460 1.00 0.00 C ATOM 1929 C LEU A 128 -5.274 4.267 -4.277 1.00 0.00 C ATOM 1930 O LEU A 128 -6.025 5.192 -4.588 1.00 0.00 O ATOM 1931 CB LEU A 128 -6.085 2.210 -3.108 1.00 0.00 C ATOM 1932 CG LEU A 128 -7.108 1.074 -3.145 1.00 0.00 C ATOM 1933 CD1 LEU A 128 -7.081 0.289 -1.843 1.00 0.00 C ATOM 1934 CD2 LEU A 128 -8.502 1.621 -3.412 1.00 0.00 C ATOM 0 H LEU A 128 -4.512 1.103 -4.682 1.00 0.00 H new ATOM 0 HA LEU A 128 -6.572 2.792 -5.119 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -5.178 1.840 -2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -6.478 3.005 -2.474 1.00 0.00 H new ATOM 0 HG LEU A 128 -6.843 0.398 -3.958 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.815 -0.515 -1.888 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -6.088 -0.135 -1.694 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.320 0.953 -1.013 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -9.217 0.799 -3.435 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.777 2.319 -2.621 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.512 2.138 -4.372 1.00 0.00 H new ATOM 1946 N LEU A 129 -4.060 4.460 -3.773 1.00 0.00 N ATOM 1947 CA LEU A 129 -3.528 5.800 -3.551 1.00 0.00 C ATOM 1948 C LEU A 129 -3.912 6.735 -4.693 1.00 0.00 C ATOM 1949 O LEU A 129 -4.548 7.767 -4.477 1.00 0.00 O ATOM 1950 CB LEU A 129 -2.006 5.749 -3.409 1.00 0.00 C ATOM 1951 CG LEU A 129 -1.472 5.065 -2.150 1.00 0.00 C ATOM 1952 CD1 LEU A 129 -0.094 4.474 -2.407 1.00 0.00 C ATOM 1953 CD2 LEU A 129 -1.424 6.048 -0.989 1.00 0.00 C ATOM 0 H LEU A 129 -3.426 3.706 -3.510 1.00 0.00 H new ATOM 0 HA LEU A 129 -3.960 6.187 -2.628 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -1.597 5.235 -4.279 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.624 6.770 -3.433 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.150 4.253 -1.886 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.270 3.991 -1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.157 3.738 -3.209 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.594 5.268 -2.697 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.042 5.544 -0.101 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.769 6.881 -1.244 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.427 6.424 -0.789 1.00 0.00 H new ATOM 1965 N TYR A 130 -3.525 6.366 -5.909 1.00 0.00 N ATOM 1966 CA TYR A 130 -3.829 7.171 -7.086 1.00 0.00 C ATOM 1967 C TYR A 130 -5.102 6.680 -7.768 1.00 0.00 C ATOM 1968 O TYR A 130 -6.039 7.449 -7.983 1.00 0.00 O ATOM 1969 CB TYR A 130 -2.661 7.131 -8.072 1.00 0.00 C ATOM 1970 CG TYR A 130 -1.854 5.854 -8.004 1.00 0.00 C ATOM 1971 CD1 TYR A 130 -0.987 5.613 -6.945 1.00 0.00 C ATOM 1972 CD2 TYR A 130 -1.959 4.889 -8.998 1.00 0.00 C ATOM 1973 CE1 TYR A 130 -0.248 4.448 -6.879 1.00 0.00 C ATOM 1974 CE2 TYR A 130 -1.224 3.721 -8.940 1.00 0.00 C ATOM 1975 CZ TYR A 130 -0.369 3.505 -7.879 1.00 0.00 C ATOM 1976 OH TYR A 130 0.365 2.343 -7.816 1.00 0.00 O ATOM 0 H TYR A 130 -3.000 5.514 -6.105 1.00 0.00 H new ATOM 0 HA TYR A 130 -3.986 8.199 -6.761 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -3.047 7.254 -9.084 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -2.003 7.978 -7.877 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -0.889 6.349 -6.161 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -2.627 5.055 -9.830 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.421 4.276 -6.049 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -1.318 2.981 -9.721 1.00 0.00 H new ATOM 0 HH TYR A 130 0.163 1.786 -8.596 1.00 0.00 H new ATOM 1986 N GLU A 131 -5.128 5.394 -8.104 1.00 0.00 N ATOM 1987 CA GLU A 131 -6.286 4.800 -8.762 1.00 0.00 C ATOM 1988 C GLU A 131 -7.584 5.317 -8.149 1.00 0.00 C ATOM 1989 O GLU A 131 -8.633 5.309 -8.793 1.00 0.00 O ATOM 1990 CB GLU A 131 -6.232 3.275 -8.659 1.00 0.00 C ATOM 1991 CG GLU A 131 -5.309 2.628 -9.678 1.00 0.00 C ATOM 1992 CD GLU A 131 -6.003 2.346 -10.997 1.00 0.00 C ATOM 1993 OE1 GLU A 131 -7.209 2.025 -10.976 1.00 0.00 O ATOM 1994 OE2 GLU A 131 -5.338 2.447 -12.049 1.00 0.00 O ATOM 0 H GLU A 131 -4.361 4.744 -7.932 1.00 0.00 H new ATOM 0 HA GLU A 131 -6.262 5.087 -9.813 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -5.904 2.998 -7.657 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.238 2.875 -8.787 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -4.454 3.280 -9.854 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -4.920 1.695 -9.270 1.00 0.00 H new ATOM 2001 N SER A 132 -7.505 5.764 -6.900 1.00 0.00 N ATOM 2002 CA SER A 132 -8.674 6.281 -6.197 1.00 0.00 C ATOM 2003 C SER A 132 -9.644 6.943 -7.171 1.00 0.00 C ATOM 2004 O SER A 132 -9.467 8.101 -7.550 1.00 0.00 O ATOM 2005 CB SER A 132 -8.248 7.283 -5.123 1.00 0.00 C ATOM 2006 OG SER A 132 -9.255 7.433 -4.137 1.00 0.00 O ATOM 0 H SER A 132 -6.644 5.779 -6.354 1.00 0.00 H new ATOM 0 HA SER A 132 -9.181 5.442 -5.720 1.00 0.00 H new ATOM 0 HB2 SER A 132 -7.323 6.947 -4.654 1.00 0.00 H new ATOM 0 HB3 SER A 132 -8.039 8.248 -5.584 1.00 0.00 H new ATOM 0 HG SER A 132 -8.958 8.077 -3.461 1.00 0.00 H new ATOM 2012 N ARG A 133 -10.670 6.200 -7.572 1.00 0.00 N ATOM 2013 CA ARG A 133 -11.668 6.713 -8.502 1.00 0.00 C ATOM 2014 C ARG A 133 -11.035 7.675 -9.503 1.00 0.00 C ATOM 2015 O ARG A 133 -11.472 8.817 -9.643 1.00 0.00 O ATOM 2016 CB ARG A 133 -12.791 7.420 -7.740 1.00 0.00 C ATOM 2017 CG ARG A 133 -13.440 6.555 -6.671 1.00 0.00 C ATOM 2018 CD ARG A 133 -14.056 5.300 -7.269 1.00 0.00 C ATOM 2019 NE ARG A 133 -15.106 5.613 -8.235 1.00 0.00 N ATOM 2020 CZ ARG A 133 -16.309 6.061 -7.895 1.00 0.00 C ATOM 2021 NH1 ARG A 133 -16.613 6.248 -6.618 1.00 0.00 N ATOM 2022 NH2 ARG A 133 -17.211 6.322 -8.832 1.00 0.00 N ATOM 0 H ARG A 133 -10.832 5.240 -7.267 1.00 0.00 H new ATOM 0 HA ARG A 133 -12.085 5.868 -9.050 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -12.391 8.320 -7.274 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -13.554 7.740 -8.449 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -12.696 6.276 -5.925 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -14.209 7.129 -6.155 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -13.279 4.711 -7.756 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -14.470 4.683 -6.471 1.00 0.00 H new ATOM 0 HE ARG A 133 -14.904 5.480 -9.226 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -15.922 6.048 -5.895 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -17.538 6.592 -6.359 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -16.981 6.179 -9.815 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -18.135 6.666 -8.569 1.00 0.00 H new ATOM 2036 N ASP A 134 -10.004 7.204 -10.196 1.00 0.00 N ATOM 2037 CA ASP A 134 -9.310 8.022 -11.184 1.00 0.00 C ATOM 2038 C ASP A 134 -9.385 7.383 -12.567 1.00 0.00 C ATOM 2039 O ASP A 134 -9.678 8.054 -13.556 1.00 0.00 O ATOM 2040 CB ASP A 134 -7.849 8.220 -10.779 1.00 0.00 C ATOM 2041 CG ASP A 134 -6.999 8.751 -11.917 1.00 0.00 C ATOM 2042 OD1 ASP A 134 -7.532 9.517 -12.747 1.00 0.00 O ATOM 2043 OD2 ASP A 134 -5.802 8.401 -11.977 1.00 0.00 O ATOM 0 H ASP A 134 -9.631 6.261 -10.092 1.00 0.00 H new ATOM 0 HA ASP A 134 -9.802 8.994 -11.225 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -7.799 8.912 -9.938 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -7.439 7.271 -10.435 1.00 0.00 H new ATOM 2048 N GLN A 135 -9.118 6.082 -12.628 1.00 0.00 N ATOM 2049 CA GLN A 135 -9.153 5.354 -13.890 1.00 0.00 C ATOM 2050 C GLN A 135 -10.549 5.395 -14.503 1.00 0.00 C ATOM 2051 O GLN A 135 -11.552 5.388 -13.789 1.00 0.00 O ATOM 2052 CB GLN A 135 -8.719 3.902 -13.678 1.00 0.00 C ATOM 2053 CG GLN A 135 -8.084 3.271 -14.907 1.00 0.00 C ATOM 2054 CD GLN A 135 -9.092 2.979 -16.000 1.00 0.00 C ATOM 2055 OE1 GLN A 135 -10.256 2.684 -15.725 1.00 0.00 O ATOM 2056 NE2 GLN A 135 -8.651 3.061 -17.250 1.00 0.00 N ATOM 0 H GLN A 135 -8.875 5.511 -11.818 1.00 0.00 H new ATOM 0 HA GLN A 135 -8.459 5.836 -14.578 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -8.010 3.861 -12.851 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -9.587 3.311 -13.384 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -7.315 3.938 -15.296 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -7.587 2.344 -14.619 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -7.679 3.309 -17.432 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -9.285 2.876 -18.028 1.00 0.00 H new ATOM 2065 N SER A 136 -10.606 5.438 -15.831 1.00 0.00 N ATOM 2066 CA SER A 136 -11.880 5.485 -16.540 1.00 0.00 C ATOM 2067 C SER A 136 -11.974 4.356 -17.562 1.00 0.00 C ATOM 2068 O SER A 136 -11.412 4.443 -18.653 1.00 0.00 O ATOM 2069 CB SER A 136 -12.049 6.836 -17.238 1.00 0.00 C ATOM 2070 OG SER A 136 -11.077 7.010 -18.254 1.00 0.00 O ATOM 0 H SER A 136 -9.786 5.441 -16.437 1.00 0.00 H new ATOM 0 HA SER A 136 -12.680 5.359 -15.810 1.00 0.00 H new ATOM 0 HB2 SER A 136 -13.047 6.903 -17.670 1.00 0.00 H new ATOM 0 HB3 SER A 136 -11.963 7.640 -16.507 1.00 0.00 H new ATOM 0 HG SER A 136 -10.872 6.143 -18.662 1.00 0.00 H new ATOM 2076 N GLY A 137 -12.690 3.296 -17.198 1.00 0.00 N ATOM 2077 CA GLY A 137 -12.845 2.164 -18.093 1.00 0.00 C ATOM 2078 C GLY A 137 -13.678 2.500 -19.314 1.00 0.00 C ATOM 2079 O GLY A 137 -13.749 3.651 -19.746 1.00 0.00 O ATOM 0 H GLY A 137 -13.165 3.201 -16.300 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -11.861 1.819 -18.412 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -13.312 1.340 -17.554 1.00 0.00 H new ATOM 2083 N PRO A 138 -14.327 1.479 -19.892 1.00 0.00 N ATOM 2084 CA PRO A 138 -15.170 1.647 -21.080 1.00 0.00 C ATOM 2085 C PRO A 138 -16.451 2.418 -20.777 1.00 0.00 C ATOM 2086 O PRO A 138 -16.997 3.099 -21.645 1.00 0.00 O ATOM 2087 CB PRO A 138 -15.496 0.209 -21.490 1.00 0.00 C ATOM 2088 CG PRO A 138 -15.376 -0.580 -20.233 1.00 0.00 C ATOM 2089 CD PRO A 138 -14.289 0.081 -19.431 1.00 0.00 C ATOM 0 HA PRO A 138 -14.668 2.223 -21.858 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -16.499 0.135 -21.910 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -14.805 -0.152 -22.251 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -16.318 -0.585 -19.684 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -15.126 -1.619 -20.447 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -14.477 0.006 -18.360 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -13.318 -0.377 -19.617 1.00 0.00 H new ATOM 2097 N SER A 139 -16.926 2.305 -19.540 1.00 0.00 N ATOM 2098 CA SER A 139 -18.144 2.989 -19.124 1.00 0.00 C ATOM 2099 C SER A 139 -18.130 4.447 -19.574 1.00 0.00 C ATOM 2100 O SER A 139 -17.114 5.133 -19.462 1.00 0.00 O ATOM 2101 CB SER A 139 -18.303 2.914 -17.604 1.00 0.00 C ATOM 2102 OG SER A 139 -19.525 3.499 -17.190 1.00 0.00 O ATOM 0 H SER A 139 -16.485 1.746 -18.809 1.00 0.00 H new ATOM 0 HA SER A 139 -18.990 2.490 -19.596 1.00 0.00 H new ATOM 0 HB2 SER A 139 -18.267 1.873 -17.282 1.00 0.00 H new ATOM 0 HB3 SER A 139 -17.470 3.425 -17.122 1.00 0.00 H new ATOM 0 HG SER A 139 -19.604 3.437 -16.215 1.00 0.00 H new ATOM 2108 N SER A 140 -19.265 4.914 -20.084 1.00 0.00 N ATOM 2109 CA SER A 140 -19.384 6.289 -20.555 1.00 0.00 C ATOM 2110 C SER A 140 -19.046 7.275 -19.442 1.00 0.00 C ATOM 2111 O SER A 140 -19.240 6.987 -18.262 1.00 0.00 O ATOM 2112 CB SER A 140 -20.799 6.552 -21.073 1.00 0.00 C ATOM 2113 OG SER A 140 -21.732 6.595 -20.008 1.00 0.00 O ATOM 0 H SER A 140 -20.116 4.360 -20.182 1.00 0.00 H new ATOM 0 HA SER A 140 -18.674 6.431 -21.370 1.00 0.00 H new ATOM 0 HB2 SER A 140 -20.821 7.496 -21.618 1.00 0.00 H new ATOM 0 HB3 SER A 140 -21.083 5.770 -21.778 1.00 0.00 H new ATOM 0 HG SER A 140 -22.628 6.766 -20.365 1.00 0.00 H new ATOM 2119 N GLY A 141 -18.538 8.442 -19.828 1.00 0.00 N ATOM 2120 CA GLY A 141 -18.180 9.454 -18.851 1.00 0.00 C ATOM 2121 C GLY A 141 -18.754 10.816 -19.191 1.00 0.00 C ATOM 2122 O GLY A 141 -18.952 11.138 -20.362 1.00 0.00 O ATOM 0 H GLY A 141 -18.368 8.704 -20.799 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -18.537 9.148 -17.868 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -17.094 9.526 -18.788 1.00 0.00 H new TER 2126 GLY A 141