USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1080 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 65 THR OG1 : rot -170:sc= 0.0215 USER MOD Set 1.2: A 67 THR OG1 : rot 180:sc= 0.00102 USER MOD Set 2.1: A 50 MET CE :methyl -163:sc= -0.561 (180deg=-0.707) USER MOD Set 2.2: A 62 HIS : no HD1:sc= -2.87! C(o=-3.4!,f=-11!) USER MOD Single : A 1 GLY N :NH3+ -169:sc= 1.29 (180deg=1.07) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 173:sc= 1.17 (180deg=1.01) USER MOD Single : A 11 TYR OH : rot -5:sc= 0.0265 USER MOD Single : A 12 SER OG : rot 38:sc= 0.00377 USER MOD Single : A 13 GLN : amide:sc= 0.00272 X(o=0.0027,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -6.36! C(o=-6.4!,f=-5.3!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -166:sc= 2.34 (180deg=1.42) USER MOD Single : A 40 ASN : amide:sc= -0.608 X(o=-0.61,f=-0.45) USER MOD Single : A 43 ASN : amide:sc= -0.337 X(o=-0.34,f=-0.23) USER MOD Single : A 45 LYS NZ :NH3+ 164:sc= -0.0752 (180deg=-0.419) USER MOD Single : A 48 MET CE :methyl 177:sc= -0.899 (180deg=-0.928) USER MOD Single : A 54 GLN : amide:sc= -0.547 X(o=-0.55,f=-0.32) USER MOD Single : A 57 LYS NZ :NH3+ 171:sc= 1.29 (180deg=1.24) USER MOD Single : A 59 CYS SG : rot 37:sc= 0.531 USER MOD Single : A 61 ASN : amide:sc= -1.66! C(o=-1.7!,f=-10!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.0449 USER MOD Single : A 68 MET CE :methyl -161:sc= -0.174 (180deg=-1.26) USER MOD Single : A 69 ASN : amide:sc= -0.336 X(o=-0.34,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 170:sc= 0.106 USER MOD Single : A 81 MET CE :methyl -171:sc= -0.952 (180deg=-1.17) USER MOD Single : A 85 SER OG : rot 180:sc= -0.141 USER MOD Single : A 88 SER OG : rot -150:sc= -2.17! USER MOD Single : A 93 LYS NZ :NH3+ -173:sc= 1.31 (180deg=1.11) USER MOD Single : A 96 GLN : amide:sc= -0.363 K(o=-0.36,f=-1.2) USER MOD Single : A 100 LYS NZ :NH3+ -148:sc= 1.28 (180deg=1.11) USER MOD Single : A 102 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0392) USER MOD Single : A 103 THR OG1 : rot -170:sc= -0.581 USER MOD Single : A 111 LYS NZ :NH3+ -163:sc= -1.3! (180deg=-1.79!) USER MOD Single : A 112 GLN : amide:sc= -0.995 K(o=-1,f=-3.7e-05) USER MOD Single : A 113 LYS NZ :NH3+ 150:sc= 1.24 (180deg=1.15) USER MOD Single : A 117 CYS SG : rot 82:sc= 0.205 USER MOD Single : A 118 GLN : amide:sc= -3.43! C(o=-3.4!,f=-3.8!) USER MOD Single : A 127 GLN : amide:sc= -1.38! C(o=-1.4!,f=-2.7!) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.713 -10.228 -15.691 1.00 0.00 N ATOM 2 CA GLY A 1 -13.364 -9.126 -16.402 1.00 0.00 C ATOM 3 C GLY A 1 -13.424 -7.889 -15.545 1.00 0.00 C ATOM 4 O GLY A 1 -13.350 -7.988 -14.310 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.517 -11.003 -16.357 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.820 -9.894 -15.275 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.339 -10.572 -14.935 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.819 -8.910 -17.321 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.373 -9.421 -16.691 1.00 0.00 H new ATOM 10 N SER A 2 -13.551 -6.735 -16.180 1.00 0.00 N ATOM 11 CA SER A 2 -13.597 -5.460 -15.501 1.00 0.00 C ATOM 12 C SER A 2 -14.818 -5.371 -14.580 1.00 0.00 C ATOM 13 O SER A 2 -15.965 -5.516 -15.015 1.00 0.00 O ATOM 14 CB SER A 2 -13.611 -4.342 -16.533 1.00 0.00 C ATOM 15 OG SER A 2 -12.513 -4.487 -17.425 1.00 0.00 O ATOM 0 H SER A 2 -13.626 -6.662 -17.195 1.00 0.00 H new ATOM 0 HA SER A 2 -12.711 -5.358 -14.875 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.548 -4.363 -17.090 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.559 -3.375 -16.033 1.00 0.00 H new ATOM 0 HG SER A 2 -12.531 -3.764 -18.087 1.00 0.00 H new ATOM 21 N GLY A 3 -14.554 -5.202 -13.321 1.00 0.00 N ATOM 22 CA GLY A 3 -15.594 -5.087 -12.340 1.00 0.00 C ATOM 23 C GLY A 3 -15.365 -6.047 -11.214 1.00 0.00 C ATOM 24 O GLY A 3 -15.897 -5.881 -10.117 1.00 0.00 O ATOM 0 H GLY A 3 -13.609 -5.139 -12.942 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -15.627 -4.068 -11.955 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -16.561 -5.285 -12.802 1.00 0.00 H new ATOM 28 N GLU A 4 -14.577 -7.066 -11.485 1.00 0.00 N ATOM 29 CA GLU A 4 -14.210 -8.036 -10.470 1.00 0.00 C ATOM 30 C GLU A 4 -13.055 -7.500 -9.676 1.00 0.00 C ATOM 31 O GLU A 4 -12.945 -7.715 -8.471 1.00 0.00 O ATOM 32 CB GLU A 4 -13.791 -9.341 -11.102 1.00 0.00 C ATOM 33 CG GLU A 4 -14.864 -10.043 -11.883 1.00 0.00 C ATOM 34 CD GLU A 4 -14.338 -11.303 -12.474 1.00 0.00 C ATOM 35 OE1 GLU A 4 -14.178 -12.293 -11.742 1.00 0.00 O ATOM 36 OE2 GLU A 4 -14.028 -11.323 -13.672 1.00 0.00 O ATOM 0 H GLU A 4 -14.175 -7.246 -12.405 1.00 0.00 H new ATOM 0 HA GLU A 4 -15.074 -8.211 -9.829 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -12.946 -9.152 -11.764 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -13.437 -10.010 -10.317 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -15.710 -10.265 -11.232 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -15.233 -9.390 -12.674 1.00 0.00 H new ATOM 43 N GLU A 5 -12.189 -6.812 -10.368 1.00 0.00 N ATOM 44 CA GLU A 5 -11.035 -6.216 -9.770 1.00 0.00 C ATOM 45 C GLU A 5 -11.357 -4.820 -9.377 1.00 0.00 C ATOM 46 O GLU A 5 -11.367 -4.465 -8.199 1.00 0.00 O ATOM 47 CB GLU A 5 -9.771 -6.334 -10.664 1.00 0.00 C ATOM 48 CG GLU A 5 -9.801 -5.467 -11.867 1.00 0.00 C ATOM 49 CD GLU A 5 -10.776 -5.934 -12.905 1.00 0.00 C ATOM 50 OE1 GLU A 5 -11.975 -5.600 -12.785 1.00 0.00 O ATOM 51 OE2 GLU A 5 -10.367 -6.676 -13.823 1.00 0.00 O ATOM 0 H GLU A 5 -12.269 -6.650 -11.372 1.00 0.00 H new ATOM 0 HA GLU A 5 -10.775 -6.769 -8.867 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.893 -6.083 -10.069 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -9.657 -7.371 -10.979 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -10.057 -4.450 -11.568 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -8.804 -5.429 -12.305 1.00 0.00 H new ATOM 58 N ASP A 6 -11.779 -4.130 -10.348 1.00 0.00 N ATOM 59 CA ASP A 6 -12.124 -2.732 -10.325 1.00 0.00 C ATOM 60 C ASP A 6 -10.969 -1.775 -10.001 1.00 0.00 C ATOM 61 O ASP A 6 -11.137 -0.563 -9.980 1.00 0.00 O ATOM 62 CB ASP A 6 -13.287 -2.612 -9.444 1.00 0.00 C ATOM 63 CG ASP A 6 -13.846 -1.230 -9.254 1.00 0.00 C ATOM 64 OD1 ASP A 6 -14.741 -0.820 -10.042 1.00 0.00 O ATOM 65 OD2 ASP A 6 -13.437 -0.549 -8.282 1.00 0.00 O ATOM 0 H ASP A 6 -11.913 -4.541 -11.272 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.374 -2.397 -11.332 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -14.079 -3.249 -9.837 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -13.016 -3.007 -8.465 1.00 0.00 H new ATOM 70 N GLU A 7 -9.815 -2.278 -9.843 1.00 0.00 N ATOM 71 CA GLU A 7 -8.734 -1.433 -9.590 1.00 0.00 C ATOM 72 C GLU A 7 -7.774 -1.440 -10.703 1.00 0.00 C ATOM 73 O GLU A 7 -7.482 -2.468 -11.314 1.00 0.00 O ATOM 74 CB GLU A 7 -8.118 -1.594 -8.184 1.00 0.00 C ATOM 75 CG GLU A 7 -7.466 -2.918 -7.834 1.00 0.00 C ATOM 76 CD GLU A 7 -8.370 -4.063 -7.663 1.00 0.00 C ATOM 77 OE1 GLU A 7 -9.033 -4.161 -6.613 1.00 0.00 O ATOM 78 OE2 GLU A 7 -8.361 -4.928 -8.515 1.00 0.00 O ATOM 0 H GLU A 7 -9.596 -3.273 -9.885 1.00 0.00 H new ATOM 0 HA GLU A 7 -9.128 -0.418 -9.551 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -7.371 -0.811 -8.056 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.904 -1.407 -7.453 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.748 -3.163 -8.616 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -6.900 -2.788 -6.911 1.00 0.00 H new ATOM 85 N LYS A 8 -7.296 -0.278 -10.962 1.00 0.00 N ATOM 86 CA LYS A 8 -6.452 -0.050 -12.091 1.00 0.00 C ATOM 87 C LYS A 8 -5.084 0.529 -11.700 1.00 0.00 C ATOM 88 O LYS A 8 -4.943 1.102 -10.624 1.00 0.00 O ATOM 89 CB LYS A 8 -7.155 0.822 -13.135 1.00 0.00 C ATOM 90 CG LYS A 8 -7.457 2.242 -12.689 1.00 0.00 C ATOM 91 CD LYS A 8 -8.317 2.943 -13.716 1.00 0.00 C ATOM 92 CE LYS A 8 -8.567 4.393 -13.356 1.00 0.00 C ATOM 93 NZ LYS A 8 -9.625 4.979 -14.196 1.00 0.00 N ATOM 0 H LYS A 8 -7.477 0.551 -10.397 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.255 -1.023 -12.540 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.534 0.863 -14.030 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -8.091 0.340 -13.418 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.968 2.227 -11.726 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.526 2.792 -12.548 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.832 2.890 -14.691 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -9.271 2.423 -13.806 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -8.852 4.465 -12.306 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -7.646 4.964 -13.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -9.856 5.932 -13.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.293 5.040 -15.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -10.474 4.380 -14.153 1.00 0.00 H new ATOM 107 N VAL A 9 -4.112 0.421 -12.599 1.00 0.00 N ATOM 108 CA VAL A 9 -2.746 0.817 -12.357 1.00 0.00 C ATOM 109 C VAL A 9 -2.610 2.322 -12.306 1.00 0.00 C ATOM 110 O VAL A 9 -2.932 3.039 -13.259 1.00 0.00 O ATOM 111 CB VAL A 9 -1.778 0.253 -13.445 1.00 0.00 C ATOM 112 CG1 VAL A 9 -0.326 0.623 -13.146 1.00 0.00 C ATOM 113 CG2 VAL A 9 -1.924 -1.252 -13.571 1.00 0.00 C ATOM 0 H VAL A 9 -4.264 0.046 -13.535 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.470 0.398 -11.389 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.053 0.710 -14.396 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.321 0.215 -13.923 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -0.224 1.708 -13.122 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -0.037 0.210 -12.179 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -1.240 -1.621 -14.335 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.689 -1.722 -12.616 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.948 -1.496 -13.853 1.00 0.00 H new ATOM 123 N LEU A 10 -2.172 2.773 -11.191 1.00 0.00 N ATOM 124 CA LEU A 10 -1.880 4.179 -10.969 1.00 0.00 C ATOM 125 C LEU A 10 -0.413 4.477 -11.305 1.00 0.00 C ATOM 126 O LEU A 10 -0.111 5.155 -12.295 1.00 0.00 O ATOM 127 CB LEU A 10 -2.216 4.594 -9.527 1.00 0.00 C ATOM 128 CG LEU A 10 -2.121 6.096 -9.195 1.00 0.00 C ATOM 129 CD1 LEU A 10 -3.129 6.900 -10.004 1.00 0.00 C ATOM 130 CD2 LEU A 10 -2.331 6.330 -7.708 1.00 0.00 C ATOM 0 H LEU A 10 -1.996 2.182 -10.378 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.510 4.770 -11.634 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.230 4.261 -9.305 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.549 4.055 -8.854 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.121 6.435 -9.464 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.040 7.956 -9.750 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.933 6.765 -11.068 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.137 6.555 -9.775 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.260 7.396 -7.494 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.317 5.966 -7.418 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.567 5.795 -7.144 1.00 0.00 H new ATOM 142 N TYR A 11 0.479 3.952 -10.510 1.00 0.00 N ATOM 143 CA TYR A 11 1.917 4.131 -10.717 1.00 0.00 C ATOM 144 C TYR A 11 2.661 2.829 -10.415 1.00 0.00 C ATOM 145 O TYR A 11 2.177 2.022 -9.621 1.00 0.00 O ATOM 146 CB TYR A 11 2.480 5.321 -9.898 1.00 0.00 C ATOM 147 CG TYR A 11 2.436 5.185 -8.382 1.00 0.00 C ATOM 148 CD1 TYR A 11 3.494 4.607 -7.686 1.00 0.00 C ATOM 149 CD2 TYR A 11 1.361 5.665 -7.648 1.00 0.00 C ATOM 150 CE1 TYR A 11 3.475 4.504 -6.312 1.00 0.00 C ATOM 151 CE2 TYR A 11 1.338 5.573 -6.269 1.00 0.00 C ATOM 152 CZ TYR A 11 2.397 4.991 -5.607 1.00 0.00 C ATOM 153 OH TYR A 11 2.380 4.902 -4.233 1.00 0.00 O ATOM 0 H TYR A 11 0.244 3.385 -9.695 1.00 0.00 H new ATOM 0 HA TYR A 11 2.078 4.380 -11.766 1.00 0.00 H new ATOM 0 HB2 TYR A 11 3.516 5.480 -10.196 1.00 0.00 H new ATOM 0 HB3 TYR A 11 1.927 6.218 -10.176 1.00 0.00 H new ATOM 0 HD1 TYR A 11 4.346 4.232 -8.233 1.00 0.00 H new ATOM 0 HD2 TYR A 11 0.527 6.119 -8.163 1.00 0.00 H new ATOM 0 HE1 TYR A 11 4.301 4.044 -5.791 1.00 0.00 H new ATOM 0 HE2 TYR A 11 0.494 5.955 -5.713 1.00 0.00 H new ATOM 0 HH TYR A 11 3.165 4.401 -3.928 1.00 0.00 H new ATOM 163 N SER A 12 3.778 2.604 -11.100 1.00 0.00 N ATOM 164 CA SER A 12 4.565 1.420 -10.987 1.00 0.00 C ATOM 165 C SER A 12 6.070 1.747 -10.774 1.00 0.00 C ATOM 166 O SER A 12 6.640 2.576 -11.502 1.00 0.00 O ATOM 167 CB SER A 12 4.332 0.661 -12.268 1.00 0.00 C ATOM 168 OG SER A 12 4.416 1.511 -13.411 1.00 0.00 O ATOM 0 H SER A 12 4.158 3.276 -11.767 1.00 0.00 H new ATOM 0 HA SER A 12 4.278 0.830 -10.117 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.067 -0.139 -12.355 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.350 0.189 -12.237 1.00 0.00 H new ATOM 0 HG SER A 12 5.127 2.171 -13.276 1.00 0.00 H new ATOM 174 N GLN A 13 6.683 1.156 -9.741 1.00 0.00 N ATOM 175 CA GLN A 13 8.125 1.346 -9.460 1.00 0.00 C ATOM 176 C GLN A 13 8.775 0.146 -8.783 1.00 0.00 C ATOM 177 O GLN A 13 8.126 -0.586 -8.086 1.00 0.00 O ATOM 178 CB GLN A 13 8.419 2.674 -8.757 1.00 0.00 C ATOM 179 CG GLN A 13 7.680 2.880 -7.442 1.00 0.00 C ATOM 180 CD GLN A 13 7.932 4.256 -6.854 1.00 0.00 C ATOM 181 OE1 GLN A 13 7.206 5.206 -7.133 1.00 0.00 O ATOM 182 NE2 GLN A 13 8.959 4.377 -6.059 1.00 0.00 N ATOM 0 H GLN A 13 6.208 0.540 -9.081 1.00 0.00 H new ATOM 0 HA GLN A 13 8.609 1.412 -10.434 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.491 2.739 -8.569 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.163 3.490 -9.432 1.00 0.00 H new ATOM 0 HG2 GLN A 13 6.610 2.746 -7.603 1.00 0.00 H new ATOM 0 HG3 GLN A 13 7.993 2.118 -6.728 1.00 0.00 H new ATOM 0 HE21 GLN A 13 9.540 3.565 -5.850 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.181 5.283 -5.647 1.00 0.00 H new ATOM 191 N ARG A 14 10.076 -0.012 -8.961 1.00 0.00 N ATOM 192 CA ARG A 14 10.772 -1.183 -8.475 1.00 0.00 C ATOM 193 C ARG A 14 11.058 -1.115 -6.984 1.00 0.00 C ATOM 194 O ARG A 14 11.712 -0.193 -6.480 1.00 0.00 O ATOM 195 CB ARG A 14 12.052 -1.456 -9.265 1.00 0.00 C ATOM 196 CG ARG A 14 12.744 -2.759 -8.874 1.00 0.00 C ATOM 197 CD ARG A 14 13.918 -3.049 -9.777 1.00 0.00 C ATOM 198 NE ARG A 14 13.500 -3.162 -11.178 1.00 0.00 N ATOM 199 CZ ARG A 14 14.311 -3.059 -12.229 1.00 0.00 C ATOM 200 NH1 ARG A 14 15.619 -2.905 -12.061 1.00 0.00 N ATOM 201 NH2 ARG A 14 13.810 -3.137 -13.444 1.00 0.00 N ATOM 0 H ARG A 14 10.671 0.663 -9.442 1.00 0.00 H new ATOM 0 HA ARG A 14 10.096 -2.023 -8.634 1.00 0.00 H new ATOM 0 HB2 ARG A 14 11.814 -1.486 -10.328 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.745 -0.628 -9.116 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.084 -2.697 -7.840 1.00 0.00 H new ATOM 0 HG3 ARG A 14 12.031 -3.582 -8.926 1.00 0.00 H new ATOM 0 HD2 ARG A 14 14.659 -2.255 -9.680 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.400 -3.975 -9.464 1.00 0.00 H new ATOM 0 HE ARG A 14 12.511 -3.333 -11.362 1.00 0.00 H new ATOM 0 HH11 ARG A 14 16.011 -2.865 -11.120 1.00 0.00 H new ATOM 0 HH12 ARG A 14 16.232 -2.827 -12.873 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.808 -3.275 -13.575 1.00 0.00 H new ATOM 0 HH22 ARG A 14 14.424 -3.059 -14.255 1.00 0.00 H new ATOM 215 N VAL A 15 10.601 -2.112 -6.324 1.00 0.00 N ATOM 216 CA VAL A 15 10.698 -2.276 -4.912 1.00 0.00 C ATOM 217 C VAL A 15 11.319 -3.659 -4.648 1.00 0.00 C ATOM 218 O VAL A 15 11.555 -4.428 -5.595 1.00 0.00 O ATOM 219 CB VAL A 15 9.254 -2.248 -4.301 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.491 -3.550 -4.580 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.258 -1.903 -2.820 1.00 0.00 C ATOM 0 H VAL A 15 10.118 -2.887 -6.778 1.00 0.00 H new ATOM 0 HA VAL A 15 11.303 -1.485 -4.468 1.00 0.00 H new ATOM 0 HB VAL A 15 8.718 -1.445 -4.807 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.496 -3.490 -4.140 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.404 -3.697 -5.657 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.031 -4.389 -4.142 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.235 -1.897 -2.445 1.00 0.00 H new ATOM 0 HG22 VAL A 15 9.840 -2.646 -2.275 1.00 0.00 H new ATOM 0 HG23 VAL A 15 9.703 -0.918 -2.677 1.00 0.00 H new ATOM 231 N LYS A 16 11.624 -3.939 -3.419 1.00 0.00 N ATOM 232 CA LYS A 16 12.001 -5.257 -3.009 1.00 0.00 C ATOM 233 C LYS A 16 10.918 -5.727 -2.080 1.00 0.00 C ATOM 234 O LYS A 16 10.548 -4.977 -1.164 1.00 0.00 O ATOM 235 CB LYS A 16 13.337 -5.272 -2.267 1.00 0.00 C ATOM 236 CG LYS A 16 14.539 -4.821 -3.069 1.00 0.00 C ATOM 237 CD LYS A 16 15.814 -5.143 -2.308 1.00 0.00 C ATOM 238 CE LYS A 16 17.067 -4.885 -3.131 1.00 0.00 C ATOM 239 NZ LYS A 16 18.276 -5.364 -2.421 1.00 0.00 N ATOM 0 H LYS A 16 11.618 -3.253 -2.664 1.00 0.00 H new ATOM 0 HA LYS A 16 12.119 -5.897 -3.883 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.250 -4.634 -1.387 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.521 -6.285 -1.909 1.00 0.00 H new ATOM 0 HG2 LYS A 16 14.548 -5.318 -4.039 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.479 -3.750 -3.260 1.00 0.00 H new ATOM 0 HD2 LYS A 16 15.851 -4.543 -1.399 1.00 0.00 H new ATOM 0 HD3 LYS A 16 15.795 -6.188 -2.000 1.00 0.00 H new ATOM 0 HE2 LYS A 16 16.984 -5.388 -4.095 1.00 0.00 H new ATOM 0 HE3 LYS A 16 17.159 -3.818 -3.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 19.117 -5.177 -3.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 18.365 -4.866 -1.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 18.195 -6.386 -2.249 1.00 0.00 H new ATOM 253 N LEU A 17 10.428 -6.938 -2.264 1.00 0.00 N ATOM 254 CA LEU A 17 9.351 -7.423 -1.460 1.00 0.00 C ATOM 255 C LEU A 17 9.931 -8.367 -0.461 1.00 0.00 C ATOM 256 O LEU A 17 10.882 -9.025 -0.763 1.00 0.00 O ATOM 257 CB LEU A 17 8.348 -8.133 -2.368 1.00 0.00 C ATOM 258 CG LEU A 17 7.344 -9.061 -1.715 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.408 -8.318 -0.780 1.00 0.00 C ATOM 260 CD2 LEU A 17 6.585 -9.833 -2.774 1.00 0.00 C ATOM 0 H LEU A 17 10.767 -7.595 -2.967 1.00 0.00 H new ATOM 0 HA LEU A 17 8.834 -6.616 -0.941 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.794 -7.371 -2.917 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.910 -8.710 -3.103 1.00 0.00 H new ATOM 0 HG LEU A 17 7.891 -9.773 -1.097 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.705 -9.022 -0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.987 -7.836 0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.858 -7.562 -1.341 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.866 -10.497 -2.295 1.00 0.00 H new ATOM 0 HD22 LEU A 17 6.057 -9.136 -3.425 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.285 -10.423 -3.366 1.00 0.00 H new ATOM 272 N PHE A 18 9.399 -8.378 0.727 1.00 0.00 N ATOM 273 CA PHE A 18 9.894 -9.195 1.838 1.00 0.00 C ATOM 274 C PHE A 18 8.756 -9.858 2.595 1.00 0.00 C ATOM 275 O PHE A 18 7.710 -9.253 2.794 1.00 0.00 O ATOM 276 CB PHE A 18 10.621 -8.317 2.860 1.00 0.00 C ATOM 277 CG PHE A 18 11.996 -7.790 2.524 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.220 -7.008 1.411 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.069 -8.081 3.351 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.476 -6.535 1.123 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.330 -7.609 3.072 1.00 0.00 C ATOM 282 CZ PHE A 18 14.537 -6.837 1.955 1.00 0.00 C ATOM 0 H PHE A 18 8.588 -7.811 0.974 1.00 0.00 H new ATOM 0 HA PHE A 18 10.554 -9.943 1.399 1.00 0.00 H new ATOM 0 HB2 PHE A 18 9.982 -7.459 3.071 1.00 0.00 H new ATOM 0 HB3 PHE A 18 10.704 -8.888 3.785 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.396 -6.764 0.757 1.00 0.00 H new ATOM 0 HD2 PHE A 18 12.912 -8.689 4.230 1.00 0.00 H new ATOM 0 HE1 PHE A 18 13.635 -5.926 0.245 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.154 -7.844 3.729 1.00 0.00 H new ATOM 0 HZ PHE A 18 15.526 -6.467 1.728 1.00 0.00 H new ATOM 292 N ARG A 19 8.959 -11.093 3.005 1.00 0.00 N ATOM 293 CA ARG A 19 8.110 -11.759 3.866 1.00 0.00 C ATOM 294 C ARG A 19 8.772 -12.110 5.142 1.00 0.00 C ATOM 295 O ARG A 19 9.984 -12.295 5.225 1.00 0.00 O ATOM 296 CB ARG A 19 7.455 -12.949 3.254 1.00 0.00 C ATOM 297 CG ARG A 19 8.335 -14.031 2.638 1.00 0.00 C ATOM 298 CD ARG A 19 8.822 -15.015 3.664 1.00 0.00 C ATOM 299 NE ARG A 19 9.738 -16.002 3.104 1.00 0.00 N ATOM 300 CZ ARG A 19 10.105 -17.098 3.741 1.00 0.00 C ATOM 301 NH1 ARG A 19 9.385 -17.519 4.767 1.00 0.00 N ATOM 302 NH2 ARG A 19 11.135 -17.812 3.303 1.00 0.00 N ATOM 0 H ARG A 19 9.763 -11.650 2.714 1.00 0.00 H new ATOM 0 HA ARG A 19 7.312 -11.050 4.087 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.840 -13.420 4.021 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.778 -12.592 2.478 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.774 -14.559 1.867 1.00 0.00 H new ATOM 0 HG3 ARG A 19 9.190 -13.566 2.147 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.322 -14.477 4.470 1.00 0.00 H new ATOM 0 HD3 ARG A 19 7.967 -15.527 4.105 1.00 0.00 H new ATOM 0 HE ARG A 19 10.115 -15.837 2.171 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.557 -16.998 5.057 1.00 0.00 H new ATOM 0 HH12 ARG A 19 9.657 -18.365 5.268 1.00 0.00 H new ATOM 0 HH21 ARG A 19 11.645 -17.514 2.472 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.416 -18.659 3.798 1.00 0.00 H new ATOM 316 N PHE A 20 7.985 -12.120 6.096 1.00 0.00 N ATOM 317 CA PHE A 20 8.325 -12.459 7.422 1.00 0.00 C ATOM 318 C PHE A 20 8.098 -13.922 7.555 1.00 0.00 C ATOM 319 O PHE A 20 7.045 -14.438 7.185 1.00 0.00 O ATOM 320 CB PHE A 20 7.396 -11.780 8.413 1.00 0.00 C ATOM 321 CG PHE A 20 7.779 -11.901 9.865 1.00 0.00 C ATOM 322 CD1 PHE A 20 8.824 -11.165 10.387 1.00 0.00 C ATOM 323 CD2 PHE A 20 7.072 -12.746 10.708 1.00 0.00 C ATOM 324 CE1 PHE A 20 9.159 -11.268 11.723 1.00 0.00 C ATOM 325 CE2 PHE A 20 7.403 -12.855 12.041 1.00 0.00 C ATOM 326 CZ PHE A 20 8.448 -12.115 12.550 1.00 0.00 C ATOM 0 H PHE A 20 7.000 -11.876 5.991 1.00 0.00 H new ATOM 0 HA PHE A 20 9.352 -12.156 7.624 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.338 -10.721 8.160 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.396 -12.194 8.286 1.00 0.00 H new ATOM 0 HD1 PHE A 20 9.385 -10.502 9.745 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.251 -13.326 10.314 1.00 0.00 H new ATOM 0 HE1 PHE A 20 9.977 -10.686 12.121 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.845 -13.519 12.685 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.711 -12.197 13.594 1.00 0.00 H new ATOM 336 N ASP A 21 9.064 -14.566 8.003 1.00 0.00 N ATOM 337 CA ASP A 21 8.948 -15.958 8.332 1.00 0.00 C ATOM 338 C ASP A 21 8.521 -16.044 9.717 1.00 0.00 C ATOM 339 O ASP A 21 9.127 -15.498 10.567 1.00 0.00 O ATOM 340 CB ASP A 21 10.198 -16.824 8.193 1.00 0.00 C ATOM 341 CG ASP A 21 9.762 -18.253 7.855 1.00 0.00 C ATOM 342 OD1 ASP A 21 8.875 -18.776 8.516 1.00 0.00 O ATOM 343 OD2 ASP A 21 10.261 -18.837 6.878 1.00 0.00 O ATOM 0 H ASP A 21 9.989 -14.168 8.168 1.00 0.00 H new ATOM 0 HA ASP A 21 8.247 -16.356 7.598 1.00 0.00 H new ATOM 0 HB2 ASP A 21 10.847 -16.430 7.410 1.00 0.00 H new ATOM 0 HB3 ASP A 21 10.772 -16.812 9.119 1.00 0.00 H new ATOM 348 N ALA A 22 7.469 -16.631 9.892 1.00 0.00 N ATOM 349 CA ALA A 22 6.901 -16.900 11.186 1.00 0.00 C ATOM 350 C ALA A 22 7.764 -17.917 11.905 1.00 0.00 C ATOM 351 O ALA A 22 8.003 -17.816 13.102 1.00 0.00 O ATOM 352 CB ALA A 22 5.490 -17.421 11.036 1.00 0.00 C ATOM 0 H ALA A 22 6.900 -16.983 9.122 1.00 0.00 H new ATOM 0 HA ALA A 22 6.867 -15.979 11.768 1.00 0.00 H new ATOM 0 HB1 ALA A 22 5.069 -17.621 12.021 1.00 0.00 H new ATOM 0 HB2 ALA A 22 4.879 -16.676 10.526 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.502 -18.342 10.453 1.00 0.00 H new ATOM 358 N GLU A 23 8.283 -18.858 11.140 1.00 0.00 N ATOM 359 CA GLU A 23 9.079 -19.931 11.664 1.00 0.00 C ATOM 360 C GLU A 23 10.506 -19.486 11.865 1.00 0.00 C ATOM 361 O GLU A 23 11.223 -20.053 12.692 1.00 0.00 O ATOM 362 CB GLU A 23 9.037 -21.120 10.724 1.00 0.00 C ATOM 363 CG GLU A 23 7.639 -21.616 10.451 1.00 0.00 C ATOM 364 CD GLU A 23 7.624 -22.730 9.461 1.00 0.00 C ATOM 365 OE1 GLU A 23 7.641 -22.451 8.239 1.00 0.00 O ATOM 366 OE2 GLU A 23 7.583 -23.905 9.875 1.00 0.00 O ATOM 0 H GLU A 23 8.158 -18.892 10.128 1.00 0.00 H new ATOM 0 HA GLU A 23 8.667 -20.224 12.629 1.00 0.00 H new ATOM 0 HB2 GLU A 23 9.508 -20.845 9.780 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.626 -21.932 11.150 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.186 -21.954 11.383 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.029 -20.793 10.080 1.00 0.00 H new ATOM 373 N VAL A 24 10.938 -18.480 11.101 1.00 0.00 N ATOM 374 CA VAL A 24 12.309 -17.987 11.276 1.00 0.00 C ATOM 375 C VAL A 24 12.280 -16.754 12.088 1.00 0.00 C ATOM 376 O VAL A 24 13.305 -16.285 12.600 1.00 0.00 O ATOM 377 CB VAL A 24 13.047 -17.664 9.946 1.00 0.00 C ATOM 378 CG1 VAL A 24 14.553 -17.494 10.125 1.00 0.00 C ATOM 379 CG2 VAL A 24 12.763 -18.701 8.968 1.00 0.00 C ATOM 0 H VAL A 24 10.388 -18.007 10.384 1.00 0.00 H new ATOM 0 HA VAL A 24 12.857 -18.795 11.761 1.00 0.00 H new ATOM 0 HB VAL A 24 12.672 -16.704 9.591 1.00 0.00 H new ATOM 0 HG11 VAL A 24 15.011 -17.270 9.162 1.00 0.00 H new ATOM 0 HG12 VAL A 24 14.747 -16.675 10.818 1.00 0.00 H new ATOM 0 HG13 VAL A 24 14.978 -18.415 10.524 1.00 0.00 H new ATOM 0 HG21 VAL A 24 13.281 -18.474 8.036 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.106 -19.663 9.348 1.00 0.00 H new ATOM 0 HG23 VAL A 24 11.689 -18.745 8.785 1.00 0.00 H new ATOM 389 N SER A 25 11.065 -16.284 12.277 1.00 0.00 N ATOM 390 CA SER A 25 10.801 -14.979 12.783 1.00 0.00 C ATOM 391 C SER A 25 11.562 -14.003 11.989 1.00 0.00 C ATOM 392 O SER A 25 12.040 -12.996 12.525 1.00 0.00 O ATOM 393 CB SER A 25 11.150 -14.910 14.210 1.00 0.00 C ATOM 394 OG SER A 25 10.120 -15.424 15.034 1.00 0.00 O ATOM 0 H SER A 25 10.222 -16.822 12.074 1.00 0.00 H new ATOM 0 HA SER A 25 9.739 -14.747 12.698 1.00 0.00 H new ATOM 0 HB2 SER A 25 12.068 -15.470 14.386 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.351 -13.874 14.484 1.00 0.00 H new ATOM 0 HG SER A 25 10.391 -15.362 15.974 1.00 0.00 H new ATOM 400 N GLN A 26 11.671 -14.223 10.683 1.00 0.00 N ATOM 401 CA GLN A 26 12.545 -13.298 10.063 1.00 0.00 C ATOM 402 C GLN A 26 12.026 -12.720 8.759 1.00 0.00 C ATOM 403 O GLN A 26 11.405 -13.409 7.974 1.00 0.00 O ATOM 404 CB GLN A 26 13.948 -13.912 9.943 1.00 0.00 C ATOM 405 CG GLN A 26 15.009 -13.068 9.266 1.00 0.00 C ATOM 406 CD GLN A 26 16.365 -13.734 9.340 1.00 0.00 C ATOM 407 OE1 GLN A 26 17.131 -13.500 10.265 1.00 0.00 O ATOM 408 NE2 GLN A 26 16.647 -14.604 8.410 1.00 0.00 N ATOM 0 H GLN A 26 11.222 -14.940 10.113 1.00 0.00 H new ATOM 0 HA GLN A 26 12.605 -12.424 10.712 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.298 -14.157 10.946 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.862 -14.851 9.397 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.737 -12.905 8.223 1.00 0.00 H new ATOM 0 HG3 GLN A 26 15.056 -12.088 9.740 1.00 0.00 H new ATOM 0 HE21 GLN A 26 15.985 -14.774 7.653 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.530 -15.114 8.440 1.00 0.00 H new ATOM 417 N TRP A 27 12.341 -11.472 8.523 1.00 0.00 N ATOM 418 CA TRP A 27 11.974 -10.778 7.375 1.00 0.00 C ATOM 419 C TRP A 27 13.056 -10.937 6.310 1.00 0.00 C ATOM 420 O TRP A 27 14.240 -10.689 6.568 1.00 0.00 O ATOM 421 CB TRP A 27 11.761 -9.305 7.770 1.00 0.00 C ATOM 422 CG TRP A 27 12.820 -8.716 8.684 1.00 0.00 C ATOM 423 CD1 TRP A 27 14.043 -8.230 8.320 1.00 0.00 C ATOM 424 CD2 TRP A 27 12.731 -8.533 10.107 1.00 0.00 C ATOM 425 NE1 TRP A 27 14.724 -7.793 9.422 1.00 0.00 N ATOM 426 CE2 TRP A 27 13.942 -7.959 10.530 1.00 0.00 C ATOM 427 CE3 TRP A 27 11.749 -8.809 11.062 1.00 0.00 C ATOM 428 CZ2 TRP A 27 14.197 -7.651 11.864 1.00 0.00 C ATOM 429 CZ3 TRP A 27 12.001 -8.501 12.384 1.00 0.00 C ATOM 430 CH2 TRP A 27 13.217 -7.929 12.774 1.00 0.00 C ATOM 0 H TRP A 27 12.887 -10.910 9.175 1.00 0.00 H new ATOM 0 HA TRP A 27 11.050 -11.169 6.949 1.00 0.00 H new ATOM 0 HB2 TRP A 27 11.716 -8.706 6.861 1.00 0.00 H new ATOM 0 HB3 TRP A 27 10.791 -9.214 8.260 1.00 0.00 H new ATOM 0 HD1 TRP A 27 14.418 -8.196 7.308 1.00 0.00 H new ATOM 0 HE1 TRP A 27 15.667 -7.404 9.418 1.00 0.00 H new ATOM 0 HE3 TRP A 27 10.810 -9.255 10.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 15.134 -7.209 12.168 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 11.247 -8.705 13.130 1.00 0.00 H new ATOM 0 HH2 TRP A 27 13.384 -7.703 13.817 1.00 0.00 H new ATOM 441 N LYS A 28 12.678 -11.424 5.164 1.00 0.00 N ATOM 442 CA LYS A 28 13.615 -11.544 4.061 1.00 0.00 C ATOM 443 C LYS A 28 12.900 -11.442 2.757 1.00 0.00 C ATOM 444 O LYS A 28 11.709 -11.789 2.652 1.00 0.00 O ATOM 445 CB LYS A 28 14.494 -12.808 4.162 1.00 0.00 C ATOM 446 CG LYS A 28 15.556 -12.931 3.069 1.00 0.00 C ATOM 447 CD LYS A 28 16.469 -14.121 3.282 1.00 0.00 C ATOM 448 CE LYS A 28 17.260 -13.978 4.566 1.00 0.00 C ATOM 449 NZ LYS A 28 18.248 -15.049 4.740 1.00 0.00 N ATOM 0 H LYS A 28 11.732 -11.747 4.959 1.00 0.00 H new ATOM 0 HA LYS A 28 14.310 -10.707 4.123 1.00 0.00 H new ATOM 0 HB2 LYS A 28 14.988 -12.815 5.133 1.00 0.00 H new ATOM 0 HB3 LYS A 28 13.850 -13.687 4.126 1.00 0.00 H new ATOM 0 HG2 LYS A 28 15.067 -13.021 2.099 1.00 0.00 H new ATOM 0 HG3 LYS A 28 16.153 -12.019 3.042 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.877 -15.036 3.316 1.00 0.00 H new ATOM 0 HD3 LYS A 28 17.153 -14.214 2.438 1.00 0.00 H new ATOM 0 HE2 LYS A 28 17.769 -13.014 4.570 1.00 0.00 H new ATOM 0 HE3 LYS A 28 16.574 -13.979 5.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 18.762 -14.905 5.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 17.763 -15.968 4.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 18.920 -15.033 3.947 1.00 0.00 H new ATOM 463 N GLU A 29 13.613 -10.931 1.780 1.00 0.00 N ATOM 464 CA GLU A 29 13.124 -10.651 0.541 1.00 0.00 C ATOM 465 C GLU A 29 12.538 -11.817 -0.173 1.00 0.00 C ATOM 466 O GLU A 29 12.980 -12.965 -0.070 1.00 0.00 O ATOM 467 CB GLU A 29 14.076 -9.763 -0.305 1.00 0.00 C ATOM 468 CG GLU A 29 15.558 -10.145 -0.315 1.00 0.00 C ATOM 469 CD GLU A 29 15.872 -11.381 -1.102 1.00 0.00 C ATOM 470 OE1 GLU A 29 15.922 -11.300 -2.347 1.00 0.00 O ATOM 471 OE2 GLU A 29 16.105 -12.438 -0.503 1.00 0.00 O ATOM 0 H GLU A 29 14.602 -10.703 1.882 1.00 0.00 H new ATOM 0 HA GLU A 29 12.251 -10.021 0.714 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.718 -9.768 -1.335 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.993 -8.738 0.056 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.133 -9.313 -0.723 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.891 -10.289 0.713 1.00 0.00 H new ATOM 478 N ARG A 30 11.503 -11.506 -0.813 1.00 0.00 N ATOM 479 CA ARG A 30 10.753 -12.430 -1.596 1.00 0.00 C ATOM 480 C ARG A 30 11.196 -12.298 -3.013 1.00 0.00 C ATOM 481 O ARG A 30 10.985 -13.176 -3.827 1.00 0.00 O ATOM 482 CB ARG A 30 9.260 -12.149 -1.551 1.00 0.00 C ATOM 483 CG ARG A 30 8.607 -12.476 -0.241 1.00 0.00 C ATOM 484 CD ARG A 30 7.093 -12.259 -0.263 1.00 0.00 C ATOM 485 NE ARG A 30 6.396 -13.077 -1.260 1.00 0.00 N ATOM 486 CZ ARG A 30 5.081 -12.984 -1.531 1.00 0.00 C ATOM 487 NH1 ARG A 30 4.332 -12.086 -0.910 1.00 0.00 N ATOM 488 NH2 ARG A 30 4.527 -13.788 -2.417 1.00 0.00 N ATOM 0 H ARG A 30 11.119 -10.561 -0.820 1.00 0.00 H new ATOM 0 HA ARG A 30 10.925 -13.428 -1.194 1.00 0.00 H new ATOM 0 HB2 ARG A 30 9.094 -11.095 -1.772 1.00 0.00 H new ATOM 0 HB3 ARG A 30 8.771 -12.721 -2.340 1.00 0.00 H new ATOM 0 HG2 ARG A 30 8.817 -13.514 0.015 1.00 0.00 H new ATOM 0 HG3 ARG A 30 9.047 -11.859 0.543 1.00 0.00 H new ATOM 0 HD2 ARG A 30 6.688 -12.482 0.724 1.00 0.00 H new ATOM 0 HD3 ARG A 30 6.888 -11.207 -0.461 1.00 0.00 H new ATOM 0 HE ARG A 30 6.943 -13.761 -1.782 1.00 0.00 H new ATOM 0 HH11 ARG A 30 4.751 -11.460 -0.222 1.00 0.00 H new ATOM 0 HH12 ARG A 30 3.336 -12.020 -1.119 1.00 0.00 H new ATOM 0 HH21 ARG A 30 5.095 -14.484 -2.900 1.00 0.00 H new ATOM 0 HH22 ARG A 30 3.530 -13.714 -2.619 1.00 0.00 H new ATOM 502 N GLY A 31 11.742 -11.149 -3.309 1.00 0.00 N ATOM 503 CA GLY A 31 12.225 -10.865 -4.587 1.00 0.00 C ATOM 504 C GLY A 31 12.369 -9.386 -4.779 1.00 0.00 C ATOM 505 O GLY A 31 12.497 -8.626 -3.810 1.00 0.00 O ATOM 0 H GLY A 31 11.854 -10.387 -2.641 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.189 -11.352 -4.734 1.00 0.00 H new ATOM 0 HA3 GLY A 31 11.546 -11.270 -5.337 1.00 0.00 H new ATOM 509 N LEU A 32 12.237 -9.000 -5.991 1.00 0.00 N ATOM 510 CA LEU A 32 12.448 -7.662 -6.492 1.00 0.00 C ATOM 511 C LEU A 32 11.344 -7.448 -7.491 1.00 0.00 C ATOM 512 O LEU A 32 10.798 -8.434 -8.003 1.00 0.00 O ATOM 513 CB LEU A 32 13.785 -7.552 -7.313 1.00 0.00 C ATOM 514 CG LEU A 32 15.141 -7.989 -6.696 1.00 0.00 C ATOM 515 CD1 LEU A 32 15.417 -7.312 -5.386 1.00 0.00 C ATOM 516 CD2 LEU A 32 15.282 -9.504 -6.589 1.00 0.00 C ATOM 0 H LEU A 32 11.958 -9.647 -6.729 1.00 0.00 H new ATOM 0 HA LEU A 32 12.478 -6.956 -5.662 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.648 -8.132 -8.226 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.891 -6.509 -7.611 1.00 0.00 H new ATOM 0 HG LEU A 32 15.907 -7.655 -7.396 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.377 -7.651 -4.996 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.447 -6.232 -5.533 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.629 -7.560 -4.675 1.00 0.00 H new ATOM 0 HD21 LEU A 32 16.249 -9.749 -6.151 1.00 0.00 H new ATOM 0 HD22 LEU A 32 14.487 -9.900 -5.957 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.211 -9.947 -7.582 1.00 0.00 H new ATOM 528 N GLY A 33 10.991 -6.232 -7.775 1.00 0.00 N ATOM 529 CA GLY A 33 10.044 -6.048 -8.823 1.00 0.00 C ATOM 530 C GLY A 33 9.316 -4.753 -8.776 1.00 0.00 C ATOM 531 O GLY A 33 9.548 -3.932 -7.923 1.00 0.00 O ATOM 0 H GLY A 33 11.329 -5.386 -7.316 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.560 -6.125 -9.780 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.318 -6.860 -8.786 1.00 0.00 H new ATOM 535 N ASN A 34 8.421 -4.613 -9.685 1.00 0.00 N ATOM 536 CA ASN A 34 7.627 -3.452 -9.885 1.00 0.00 C ATOM 537 C ASN A 34 6.450 -3.495 -9.041 1.00 0.00 C ATOM 538 O ASN A 34 5.588 -4.392 -9.139 1.00 0.00 O ATOM 539 CB ASN A 34 7.209 -3.376 -11.306 1.00 0.00 C ATOM 540 CG ASN A 34 6.448 -2.133 -11.627 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.031 -1.115 -11.981 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.150 -2.212 -11.569 1.00 0.00 N ATOM 0 H ASN A 34 8.209 -5.354 -10.353 1.00 0.00 H new ATOM 0 HA ASN A 34 8.218 -2.574 -9.626 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.093 -3.428 -11.942 1.00 0.00 H new ATOM 0 HB3 ASN A 34 6.593 -4.243 -11.544 1.00 0.00 H new ATOM 0 HD21 ASN A 34 4.578 -1.407 -11.824 1.00 0.00 H new ATOM 0 HD22 ASN A 34 4.705 -3.079 -11.269 1.00 0.00 H new ATOM 549 N LEU A 35 6.430 -2.556 -8.215 1.00 0.00 N ATOM 550 CA LEU A 35 5.378 -2.309 -7.367 1.00 0.00 C ATOM 551 C LEU A 35 4.466 -1.378 -8.056 1.00 0.00 C ATOM 552 O LEU A 35 4.865 -0.292 -8.445 1.00 0.00 O ATOM 553 CB LEU A 35 5.845 -1.788 -5.978 1.00 0.00 C ATOM 554 CG LEU A 35 4.784 -1.393 -4.893 1.00 0.00 C ATOM 555 CD1 LEU A 35 5.469 -1.232 -3.547 1.00 0.00 C ATOM 556 CD2 LEU A 35 4.085 -0.070 -5.217 1.00 0.00 C ATOM 0 H LEU A 35 7.201 -1.896 -8.108 1.00 0.00 H new ATOM 0 HA LEU A 35 4.851 -3.236 -7.141 1.00 0.00 H new ATOM 0 HB2 LEU A 35 6.485 -2.555 -5.542 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.471 -0.913 -6.153 1.00 0.00 H new ATOM 0 HG LEU A 35 4.040 -2.189 -4.874 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.731 -0.957 -2.794 1.00 0.00 H new ATOM 0 HD12 LEU A 35 5.943 -2.172 -3.265 1.00 0.00 H new ATOM 0 HD13 LEU A 35 6.226 -0.451 -3.615 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.360 0.159 -4.436 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.825 0.729 -5.271 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.572 -0.155 -6.175 1.00 0.00 H new ATOM 568 N LYS A 36 3.291 -1.787 -8.241 1.00 0.00 N ATOM 569 CA LYS A 36 2.358 -0.962 -8.822 1.00 0.00 C ATOM 570 C LYS A 36 1.181 -0.805 -7.915 1.00 0.00 C ATOM 571 O LYS A 36 0.920 -1.655 -7.066 1.00 0.00 O ATOM 572 CB LYS A 36 1.974 -1.417 -10.225 1.00 0.00 C ATOM 573 CG LYS A 36 1.346 -2.787 -10.313 1.00 0.00 C ATOM 574 CD LYS A 36 0.989 -3.118 -11.744 1.00 0.00 C ATOM 575 CE LYS A 36 0.363 -4.492 -11.864 1.00 0.00 C ATOM 576 NZ LYS A 36 0.027 -4.826 -13.258 1.00 0.00 N ATOM 0 H LYS A 36 2.952 -2.715 -7.989 1.00 0.00 H new ATOM 0 HA LYS A 36 2.806 0.023 -8.958 1.00 0.00 H new ATOM 0 HB2 LYS A 36 1.280 -0.690 -10.647 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.867 -1.405 -10.850 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.036 -3.535 -9.922 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.451 -2.823 -9.692 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.297 -2.369 -12.129 1.00 0.00 H new ATOM 0 HD3 LYS A 36 1.885 -3.072 -12.362 1.00 0.00 H new ATOM 0 HE2 LYS A 36 1.051 -5.239 -11.468 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.539 -4.534 -11.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.399 -5.774 -13.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.649 -4.128 -13.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.891 -4.812 -13.836 1.00 0.00 H new ATOM 590 N ILE A 37 0.482 0.240 -8.099 1.00 0.00 N ATOM 591 CA ILE A 37 -0.658 0.525 -7.323 1.00 0.00 C ATOM 592 C ILE A 37 -1.846 0.328 -8.159 1.00 0.00 C ATOM 593 O ILE A 37 -1.888 0.761 -9.319 1.00 0.00 O ATOM 594 CB ILE A 37 -0.638 2.020 -6.864 1.00 0.00 C ATOM 595 CG1 ILE A 37 0.252 2.205 -5.654 1.00 0.00 C ATOM 596 CG2 ILE A 37 -2.054 2.595 -6.590 1.00 0.00 C ATOM 597 CD1 ILE A 37 -0.431 1.865 -4.336 1.00 0.00 C ATOM 0 H ILE A 37 0.689 0.941 -8.810 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.671 -0.128 -6.450 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.226 2.587 -7.699 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.138 1.580 -5.766 1.00 0.00 H new ATOM 0 HG13 ILE A 37 0.594 3.239 -5.620 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.970 3.635 -6.275 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.652 2.538 -7.500 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.536 2.016 -5.802 1.00 0.00 H new ATOM 0 HD11 ILE A 37 0.267 2.021 -3.514 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.301 2.508 -4.201 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.749 0.822 -4.349 1.00 0.00 H new ATOM 609 N LEU A 38 -2.782 -0.360 -7.609 1.00 0.00 N ATOM 610 CA LEU A 38 -4.049 -0.433 -8.231 1.00 0.00 C ATOM 611 C LEU A 38 -5.005 0.376 -7.374 1.00 0.00 C ATOM 612 O LEU A 38 -5.010 0.270 -6.142 1.00 0.00 O ATOM 613 CB LEU A 38 -4.540 -1.871 -8.356 1.00 0.00 C ATOM 614 CG LEU A 38 -3.669 -2.853 -9.132 1.00 0.00 C ATOM 615 CD1 LEU A 38 -4.302 -4.233 -9.160 1.00 0.00 C ATOM 616 CD2 LEU A 38 -3.409 -2.373 -10.535 1.00 0.00 C ATOM 0 H LEU A 38 -2.693 -0.877 -6.734 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.988 -0.039 -9.245 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.677 -2.267 -7.350 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.523 -1.850 -8.827 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.712 -2.916 -8.614 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.662 -4.916 -9.719 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.420 -4.600 -8.140 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.279 -4.176 -9.641 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.785 -3.098 -11.058 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.356 -2.262 -11.063 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.897 -1.411 -10.502 1.00 0.00 H new ATOM 628 N LYS A 39 -5.764 1.194 -8.026 1.00 0.00 N ATOM 629 CA LYS A 39 -6.680 2.115 -7.400 1.00 0.00 C ATOM 630 C LYS A 39 -8.089 1.727 -7.837 1.00 0.00 C ATOM 631 O LYS A 39 -8.368 1.715 -9.043 1.00 0.00 O ATOM 632 CB LYS A 39 -6.285 3.541 -7.931 1.00 0.00 C ATOM 633 CG LYS A 39 -6.930 4.795 -7.287 1.00 0.00 C ATOM 634 CD LYS A 39 -8.435 4.928 -7.515 1.00 0.00 C ATOM 635 CE LYS A 39 -8.806 5.009 -8.998 1.00 0.00 C ATOM 636 NZ LYS A 39 -10.261 5.156 -9.182 1.00 0.00 N ATOM 0 H LYS A 39 -5.770 1.248 -9.045 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.642 2.101 -6.311 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.204 3.640 -7.831 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.510 3.568 -8.997 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.739 4.774 -6.214 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.437 5.683 -7.681 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.943 4.075 -7.064 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.797 5.821 -7.005 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.293 5.854 -9.457 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.462 4.110 -9.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.506 4.971 -10.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.759 4.477 -8.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -10.547 6.123 -8.929 1.00 0.00 H new ATOM 650 N ASN A 40 -8.957 1.370 -6.886 1.00 0.00 N ATOM 651 CA ASN A 40 -10.362 1.009 -7.240 1.00 0.00 C ATOM 652 C ASN A 40 -11.185 2.150 -7.795 1.00 0.00 C ATOM 653 O ASN A 40 -11.123 3.277 -7.311 1.00 0.00 O ATOM 654 CB ASN A 40 -11.138 0.359 -6.095 1.00 0.00 C ATOM 655 CG ASN A 40 -10.845 -1.101 -5.945 1.00 0.00 C ATOM 656 OD1 ASN A 40 -9.986 -1.491 -5.186 1.00 0.00 O ATOM 657 ND2 ASN A 40 -11.560 -1.903 -6.669 1.00 0.00 N ATOM 0 H ASN A 40 -8.737 1.319 -5.891 1.00 0.00 H new ATOM 0 HA ASN A 40 -10.220 0.277 -8.035 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.896 0.870 -5.163 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -12.206 0.494 -6.265 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.410 -2.910 -6.614 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -12.273 -1.527 -7.294 1.00 0.00 H new ATOM 664 N GLU A 41 -11.984 1.838 -8.790 1.00 0.00 N ATOM 665 CA GLU A 41 -12.871 2.699 -9.432 1.00 0.00 C ATOM 666 C GLU A 41 -14.127 2.882 -8.573 1.00 0.00 C ATOM 667 O GLU A 41 -14.819 3.904 -8.641 1.00 0.00 O ATOM 668 CB GLU A 41 -13.201 2.010 -10.712 1.00 0.00 C ATOM 669 CG GLU A 41 -12.044 1.911 -11.689 1.00 0.00 C ATOM 670 CD GLU A 41 -11.620 3.256 -12.216 1.00 0.00 C ATOM 671 OE1 GLU A 41 -11.022 4.046 -11.460 1.00 0.00 O ATOM 672 OE2 GLU A 41 -11.886 3.565 -13.401 1.00 0.00 O ATOM 0 H GLU A 41 -12.010 0.896 -9.180 1.00 0.00 H new ATOM 0 HA GLU A 41 -12.454 3.692 -9.600 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -13.558 1.005 -10.488 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.023 2.540 -11.194 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -11.197 1.433 -11.197 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.331 1.271 -12.523 1.00 0.00 H new ATOM 679 N VAL A 42 -14.381 1.889 -7.757 1.00 0.00 N ATOM 680 CA VAL A 42 -15.448 1.862 -6.794 1.00 0.00 C ATOM 681 C VAL A 42 -15.038 2.710 -5.603 1.00 0.00 C ATOM 682 O VAL A 42 -15.876 3.143 -4.792 1.00 0.00 O ATOM 683 CB VAL A 42 -15.638 0.373 -6.399 1.00 0.00 C ATOM 684 CG1 VAL A 42 -15.762 0.127 -4.918 1.00 0.00 C ATOM 685 CG2 VAL A 42 -16.782 -0.255 -7.156 1.00 0.00 C ATOM 0 H VAL A 42 -13.820 1.037 -7.748 1.00 0.00 H new ATOM 0 HA VAL A 42 -16.384 2.264 -7.182 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.710 -0.118 -6.692 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.892 -0.940 -4.736 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -14.860 0.474 -4.415 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -16.625 0.669 -4.530 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -16.888 -1.298 -6.856 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -17.704 0.282 -6.933 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -16.582 -0.204 -8.226 1.00 0.00 H new ATOM 695 N ASN A 43 -13.725 2.952 -5.563 1.00 0.00 N ATOM 696 CA ASN A 43 -13.043 3.718 -4.526 1.00 0.00 C ATOM 697 C ASN A 43 -13.037 2.876 -3.253 1.00 0.00 C ATOM 698 O ASN A 43 -13.041 3.359 -2.130 1.00 0.00 O ATOM 699 CB ASN A 43 -13.736 5.095 -4.405 1.00 0.00 C ATOM 700 CG ASN A 43 -13.260 6.016 -3.279 1.00 0.00 C ATOM 701 OD1 ASN A 43 -12.288 6.753 -3.443 1.00 0.00 O ATOM 702 ND2 ASN A 43 -13.975 6.041 -2.176 1.00 0.00 N ATOM 0 H ASN A 43 -13.088 2.605 -6.280 1.00 0.00 H new ATOM 0 HA ASN A 43 -11.999 3.931 -4.756 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -13.609 5.622 -5.350 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -14.805 4.926 -4.275 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.730 6.685 -1.424 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -14.775 5.416 -2.072 1.00 0.00 H new ATOM 709 N GLY A 44 -12.921 1.575 -3.482 1.00 0.00 N ATOM 710 CA GLY A 44 -12.966 0.624 -2.406 1.00 0.00 C ATOM 711 C GLY A 44 -11.697 0.627 -1.607 1.00 0.00 C ATOM 712 O GLY A 44 -11.669 1.098 -0.463 1.00 0.00 O ATOM 0 H GLY A 44 -12.795 1.165 -4.407 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -13.808 0.854 -1.753 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.139 -0.374 -2.810 1.00 0.00 H new ATOM 716 N LYS A 45 -10.651 0.107 -2.185 1.00 0.00 N ATOM 717 CA LYS A 45 -9.360 0.063 -1.552 1.00 0.00 C ATOM 718 C LYS A 45 -8.312 0.365 -2.592 1.00 0.00 C ATOM 719 O LYS A 45 -8.628 0.486 -3.787 1.00 0.00 O ATOM 720 CB LYS A 45 -9.116 -1.327 -0.956 1.00 0.00 C ATOM 721 CG LYS A 45 -10.066 -1.698 0.163 1.00 0.00 C ATOM 722 CD LYS A 45 -9.877 -3.125 0.615 1.00 0.00 C ATOM 723 CE LYS A 45 -10.871 -3.478 1.706 1.00 0.00 C ATOM 724 NZ LYS A 45 -12.277 -3.307 1.259 1.00 0.00 N ATOM 0 H LYS A 45 -10.669 -0.303 -3.119 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.314 0.797 -0.748 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.199 -2.070 -1.749 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.094 -1.375 -0.581 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.911 -1.027 1.008 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.094 -1.557 -0.172 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -10.004 -3.800 -0.232 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -8.861 -3.263 0.983 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -10.714 -4.510 2.019 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -10.690 -2.850 2.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -12.913 -3.804 1.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.516 -2.295 1.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -12.388 -3.702 0.303 1.00 0.00 H new ATOM 738 N LEU A 46 -7.105 0.557 -2.165 1.00 0.00 N ATOM 739 CA LEU A 46 -6.043 0.743 -3.021 1.00 0.00 C ATOM 740 C LEU A 46 -5.025 -0.280 -2.649 1.00 0.00 C ATOM 741 O LEU A 46 -4.839 -0.589 -1.464 1.00 0.00 O ATOM 742 CB LEU A 46 -5.382 2.071 -2.828 1.00 0.00 C ATOM 743 CG LEU A 46 -6.230 3.376 -2.738 1.00 0.00 C ATOM 744 CD1 LEU A 46 -7.205 3.503 -3.884 1.00 0.00 C ATOM 745 CD2 LEU A 46 -6.913 3.556 -1.379 1.00 0.00 C ATOM 0 H LEU A 46 -6.853 0.585 -1.177 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.405 0.675 -4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -4.794 2.007 -1.912 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.678 2.202 -3.650 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.521 4.199 -2.829 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -7.773 4.427 -3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.658 3.519 -4.827 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.889 2.654 -3.876 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.487 4.482 -1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.581 2.715 -1.193 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.157 3.599 -0.595 1.00 0.00 H new ATOM 757 N ARG A 47 -4.354 -0.758 -3.599 1.00 0.00 N ATOM 758 CA ARG A 47 -3.342 -1.800 -3.354 1.00 0.00 C ATOM 759 C ARG A 47 -2.050 -1.468 -4.001 1.00 0.00 C ATOM 760 O ARG A 47 -1.993 -0.781 -4.995 1.00 0.00 O ATOM 761 CB ARG A 47 -3.680 -3.126 -3.974 1.00 0.00 C ATOM 762 CG ARG A 47 -5.113 -3.332 -4.425 1.00 0.00 C ATOM 763 CD ARG A 47 -5.246 -4.710 -5.008 1.00 0.00 C ATOM 764 NE ARG A 47 -6.614 -5.099 -5.300 1.00 0.00 N ATOM 765 CZ ARG A 47 -7.054 -6.358 -5.311 1.00 0.00 C ATOM 766 NH1 ARG A 47 -6.291 -7.339 -4.837 1.00 0.00 N ATOM 767 NH2 ARG A 47 -8.264 -6.620 -5.768 1.00 0.00 N ATOM 0 H ARG A 47 -4.452 -0.475 -4.574 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.299 -1.852 -2.266 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.030 -3.272 -4.836 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.436 -3.908 -3.255 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -5.794 -3.212 -3.583 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -5.387 -2.581 -5.166 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.660 -4.763 -5.926 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.815 -5.430 -4.313 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.284 -4.359 -5.511 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.365 -7.130 -4.463 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.632 -8.300 -4.847 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.855 -5.862 -6.109 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.608 -7.580 -5.780 1.00 0.00 H new ATOM 781 N MET A 48 -1.062 -2.046 -3.460 1.00 0.00 N ATOM 782 CA MET A 48 0.257 -2.100 -3.960 1.00 0.00 C ATOM 783 C MET A 48 0.532 -3.548 -4.198 1.00 0.00 C ATOM 784 O MET A 48 0.483 -4.368 -3.281 1.00 0.00 O ATOM 785 CB MET A 48 1.288 -1.623 -2.917 1.00 0.00 C ATOM 786 CG MET A 48 1.156 -0.196 -2.524 1.00 0.00 C ATOM 787 SD MET A 48 2.408 0.384 -1.390 1.00 0.00 S ATOM 788 CE MET A 48 1.924 2.109 -1.294 1.00 0.00 C ATOM 0 H MET A 48 -1.156 -2.542 -2.574 1.00 0.00 H new ATOM 0 HA MET A 48 0.340 -1.468 -4.844 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.195 -2.242 -2.025 1.00 0.00 H new ATOM 0 HB3 MET A 48 2.290 -1.785 -3.315 1.00 0.00 H new ATOM 0 HG2 MET A 48 1.187 0.419 -3.423 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.176 -0.047 -2.070 1.00 0.00 H new ATOM 0 HE1 MET A 48 2.566 2.628 -0.582 1.00 0.00 H new ATOM 0 HE2 MET A 48 2.024 2.570 -2.276 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.887 2.178 -0.965 1.00 0.00 H new ATOM 798 N LEU A 49 0.791 -3.866 -5.371 1.00 0.00 N ATOM 799 CA LEU A 49 1.235 -5.193 -5.704 1.00 0.00 C ATOM 800 C LEU A 49 2.544 -5.133 -6.386 1.00 0.00 C ATOM 801 O LEU A 49 2.851 -4.162 -7.055 1.00 0.00 O ATOM 802 CB LEU A 49 0.333 -5.961 -6.599 1.00 0.00 C ATOM 803 CG LEU A 49 0.048 -5.389 -7.993 1.00 0.00 C ATOM 804 CD1 LEU A 49 -0.566 -6.438 -8.846 1.00 0.00 C ATOM 805 CD2 LEU A 49 -0.894 -4.221 -7.922 1.00 0.00 C ATOM 0 H LEU A 49 0.712 -3.233 -6.167 1.00 0.00 H new ATOM 0 HA LEU A 49 1.270 -5.707 -4.744 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.757 -6.957 -6.727 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.621 -6.084 -6.087 1.00 0.00 H new ATOM 0 HG LEU A 49 0.995 -5.054 -8.416 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.768 -6.030 -9.836 1.00 0.00 H new ATOM 0 HD12 LEU A 49 0.118 -7.282 -8.934 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.500 -6.774 -8.395 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.076 -3.838 -8.926 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.837 -4.541 -7.479 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.453 -3.435 -7.309 1.00 0.00 H new ATOM 817 N MET A 50 3.306 -6.155 -6.254 1.00 0.00 N ATOM 818 CA MET A 50 4.539 -6.210 -6.784 1.00 0.00 C ATOM 819 C MET A 50 4.751 -7.543 -7.358 1.00 0.00 C ATOM 820 O MET A 50 4.493 -8.588 -6.761 1.00 0.00 O ATOM 821 CB MET A 50 5.567 -5.862 -5.790 1.00 0.00 C ATOM 822 CG MET A 50 5.461 -6.660 -4.525 1.00 0.00 C ATOM 823 SD MET A 50 5.869 -5.733 -3.035 1.00 0.00 S ATOM 824 CE MET A 50 4.473 -4.613 -2.943 1.00 0.00 C ATOM 0 H MET A 50 3.037 -6.995 -5.742 1.00 0.00 H new ATOM 0 HA MET A 50 4.627 -5.470 -7.579 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.553 -6.017 -6.228 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.487 -4.802 -5.551 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.445 -7.044 -4.434 1.00 0.00 H new ATOM 0 HG3 MET A 50 6.123 -7.523 -4.596 1.00 0.00 H new ATOM 0 HE1 MET A 50 4.712 -3.788 -2.273 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.254 -4.222 -3.937 1.00 0.00 H new ATOM 0 HE3 MET A 50 3.602 -5.148 -2.564 1.00 0.00 H new ATOM 834 N ARG A 51 5.095 -7.442 -8.485 1.00 0.00 N ATOM 835 CA ARG A 51 5.422 -8.481 -9.425 1.00 0.00 C ATOM 836 C ARG A 51 6.872 -8.471 -9.621 1.00 0.00 C ATOM 837 O ARG A 51 7.505 -7.428 -9.584 1.00 0.00 O ATOM 838 CB ARG A 51 4.763 -8.129 -10.728 1.00 0.00 C ATOM 839 CG ARG A 51 5.055 -8.923 -11.992 1.00 0.00 C ATOM 840 CD ARG A 51 4.699 -8.021 -13.169 1.00 0.00 C ATOM 841 NE ARG A 51 4.838 -8.635 -14.484 1.00 0.00 N ATOM 842 CZ ARG A 51 5.591 -8.146 -15.500 1.00 0.00 C ATOM 843 NH1 ARG A 51 6.498 -7.186 -15.282 1.00 0.00 N ATOM 844 NH2 ARG A 51 5.434 -8.629 -16.726 1.00 0.00 N ATOM 0 H ARG A 51 5.193 -6.520 -8.911 1.00 0.00 H new ATOM 0 HA ARG A 51 5.092 -9.458 -9.072 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.686 -8.174 -10.564 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.010 -7.089 -10.940 1.00 0.00 H new ATOM 0 HG2 ARG A 51 6.104 -9.215 -12.032 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.468 -9.841 -12.017 1.00 0.00 H new ATOM 0 HD2 ARG A 51 3.669 -7.684 -13.050 1.00 0.00 H new ATOM 0 HD3 ARG A 51 5.331 -7.134 -13.131 1.00 0.00 H new ATOM 0 HE ARG A 51 4.328 -9.502 -14.653 1.00 0.00 H new ATOM 0 HH11 ARG A 51 6.630 -6.813 -14.342 1.00 0.00 H new ATOM 0 HH12 ARG A 51 7.057 -6.828 -16.056 1.00 0.00 H new ATOM 0 HH21 ARG A 51 4.749 -9.365 -16.901 1.00 0.00 H new ATOM 0 HH22 ARG A 51 5.998 -8.265 -17.494 1.00 0.00 H new ATOM 858 N ARG A 52 7.367 -9.599 -9.861 1.00 0.00 N ATOM 859 CA ARG A 52 8.693 -9.763 -10.167 1.00 0.00 C ATOM 860 C ARG A 52 8.708 -9.480 -11.622 1.00 0.00 C ATOM 861 O ARG A 52 7.979 -10.093 -12.385 1.00 0.00 O ATOM 862 CB ARG A 52 9.133 -11.173 -9.824 1.00 0.00 C ATOM 863 CG ARG A 52 9.157 -11.563 -8.337 1.00 0.00 C ATOM 864 CD ARG A 52 9.520 -13.049 -8.231 1.00 0.00 C ATOM 865 NE ARG A 52 9.763 -13.556 -6.870 1.00 0.00 N ATOM 866 CZ ARG A 52 9.994 -14.861 -6.583 1.00 0.00 C ATOM 867 NH1 ARG A 52 9.914 -15.787 -7.536 1.00 0.00 N ATOM 868 NH2 ARG A 52 10.304 -15.227 -5.357 1.00 0.00 N ATOM 0 H ARG A 52 6.831 -10.467 -9.847 1.00 0.00 H new ATOM 0 HA ARG A 52 9.383 -9.123 -9.617 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.474 -11.868 -10.344 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.135 -11.321 -10.228 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.884 -10.956 -7.798 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.185 -11.377 -7.881 1.00 0.00 H new ATOM 0 HD2 ARG A 52 8.715 -13.633 -8.677 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.413 -13.229 -8.830 1.00 0.00 H new ATOM 0 HE ARG A 52 9.757 -12.888 -6.099 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.677 -15.517 -8.491 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.089 -16.766 -7.311 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.371 -14.528 -4.618 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.477 -16.210 -5.147 1.00 0.00 H new ATOM 882 N GLU A 53 9.489 -8.536 -11.961 1.00 0.00 N ATOM 883 CA GLU A 53 9.547 -7.941 -13.298 1.00 0.00 C ATOM 884 C GLU A 53 9.800 -8.875 -14.383 1.00 0.00 C ATOM 885 O GLU A 53 8.909 -9.101 -15.208 1.00 0.00 O ATOM 886 CB GLU A 53 10.428 -6.696 -13.343 1.00 0.00 C ATOM 887 CG GLU A 53 9.766 -5.426 -12.850 1.00 0.00 C ATOM 888 CD GLU A 53 10.706 -4.235 -12.863 1.00 0.00 C ATOM 889 OE1 GLU A 53 11.297 -3.919 -13.934 1.00 0.00 O ATOM 890 OE2 GLU A 53 10.891 -3.595 -11.816 1.00 0.00 O ATOM 0 H GLU A 53 10.150 -8.113 -11.309 1.00 0.00 H new ATOM 0 HA GLU A 53 8.528 -7.608 -13.494 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.320 -6.879 -12.744 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.759 -6.540 -14.370 1.00 0.00 H new ATOM 0 HG2 GLU A 53 8.899 -5.207 -13.474 1.00 0.00 H new ATOM 0 HG3 GLU A 53 9.398 -5.583 -11.836 1.00 0.00 H new ATOM 897 N GLN A 54 10.914 -9.467 -14.410 1.00 0.00 N ATOM 898 CA GLN A 54 11.177 -10.296 -15.521 1.00 0.00 C ATOM 899 C GLN A 54 10.514 -11.659 -15.300 1.00 0.00 C ATOM 900 O GLN A 54 10.343 -12.468 -16.214 1.00 0.00 O ATOM 901 CB GLN A 54 12.662 -10.406 -15.794 1.00 0.00 C ATOM 902 CG GLN A 54 13.031 -10.961 -17.166 1.00 0.00 C ATOM 903 CD GLN A 54 12.503 -10.099 -18.302 1.00 0.00 C ATOM 904 OE1 GLN A 54 13.164 -9.154 -18.744 1.00 0.00 O ATOM 905 NE2 GLN A 54 11.338 -10.419 -18.800 1.00 0.00 N ATOM 0 H GLN A 54 11.647 -9.405 -13.704 1.00 0.00 H new ATOM 0 HA GLN A 54 10.746 -9.849 -16.417 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.109 -9.418 -15.688 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.109 -11.042 -15.030 1.00 0.00 H new ATOM 0 HG2 GLN A 54 14.116 -11.036 -17.245 1.00 0.00 H new ATOM 0 HG3 GLN A 54 12.633 -11.971 -17.265 1.00 0.00 H new ATOM 0 HE21 GLN A 54 10.816 -11.205 -18.413 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.950 -9.882 -19.576 1.00 0.00 H new ATOM 914 N VAL A 55 10.124 -11.864 -14.083 1.00 0.00 N ATOM 915 CA VAL A 55 9.498 -13.058 -13.646 1.00 0.00 C ATOM 916 C VAL A 55 7.951 -13.030 -13.910 1.00 0.00 C ATOM 917 O VAL A 55 7.256 -14.049 -13.738 1.00 0.00 O ATOM 918 CB VAL A 55 9.824 -13.156 -12.132 1.00 0.00 C ATOM 919 CG1 VAL A 55 8.954 -14.147 -11.413 1.00 0.00 C ATOM 920 CG2 VAL A 55 11.290 -13.517 -11.932 1.00 0.00 C ATOM 0 H VAL A 55 10.240 -11.173 -13.341 1.00 0.00 H new ATOM 0 HA VAL A 55 9.863 -13.929 -14.191 1.00 0.00 H new ATOM 0 HB VAL A 55 9.620 -12.175 -11.702 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.227 -14.173 -10.358 1.00 0.00 H new ATOM 0 HG12 VAL A 55 7.909 -13.852 -11.510 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.093 -15.137 -11.848 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.506 -13.583 -10.866 1.00 0.00 H new ATOM 0 HG22 VAL A 55 11.496 -14.478 -12.404 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.919 -12.749 -12.383 1.00 0.00 H new ATOM 930 N LEU A 56 7.456 -11.875 -14.423 1.00 0.00 N ATOM 931 CA LEU A 56 6.097 -11.610 -14.834 1.00 0.00 C ATOM 932 C LEU A 56 5.033 -11.931 -13.748 1.00 0.00 C ATOM 933 O LEU A 56 3.824 -11.835 -13.958 1.00 0.00 O ATOM 934 CB LEU A 56 5.952 -12.544 -15.967 1.00 0.00 C ATOM 935 CG LEU A 56 4.584 -12.829 -16.438 1.00 0.00 C ATOM 936 CD1 LEU A 56 3.930 -11.645 -17.156 1.00 0.00 C ATOM 937 CD2 LEU A 56 4.460 -14.141 -17.183 1.00 0.00 C ATOM 0 H LEU A 56 8.056 -11.062 -14.561 1.00 0.00 H new ATOM 0 HA LEU A 56 5.934 -10.555 -15.056 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.522 -12.146 -16.807 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.416 -13.490 -15.686 1.00 0.00 H new ATOM 0 HG LEU A 56 3.993 -12.970 -15.533 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.926 -11.923 -17.476 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.872 -10.795 -16.477 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.526 -11.373 -18.027 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.427 -14.284 -17.499 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.108 -14.125 -18.059 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.755 -14.961 -16.528 1.00 0.00 H new ATOM 949 N LYS A 57 5.467 -12.156 -12.606 1.00 0.00 N ATOM 950 CA LYS A 57 4.546 -12.563 -11.595 1.00 0.00 C ATOM 951 C LYS A 57 4.490 -11.723 -10.304 1.00 0.00 C ATOM 952 O LYS A 57 5.419 -11.750 -9.484 1.00 0.00 O ATOM 953 CB LYS A 57 4.870 -13.994 -11.299 1.00 0.00 C ATOM 954 CG LYS A 57 3.915 -14.748 -10.358 1.00 0.00 C ATOM 955 CD LYS A 57 2.714 -15.407 -11.064 1.00 0.00 C ATOM 956 CE LYS A 57 1.753 -14.428 -11.720 1.00 0.00 C ATOM 957 NZ LYS A 57 0.562 -15.129 -12.250 1.00 0.00 N ATOM 0 H LYS A 57 6.441 -12.076 -12.315 1.00 0.00 H new ATOM 0 HA LYS A 57 3.543 -12.410 -11.992 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.910 -14.534 -12.245 1.00 0.00 H new ATOM 0 HB3 LYS A 57 5.870 -14.032 -10.868 1.00 0.00 H new ATOM 0 HG2 LYS A 57 4.478 -15.518 -9.830 1.00 0.00 H new ATOM 0 HG3 LYS A 57 3.542 -14.053 -9.606 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.087 -16.094 -11.823 1.00 0.00 H new ATOM 0 HD3 LYS A 57 2.164 -16.004 -10.337 1.00 0.00 H new ATOM 0 HE2 LYS A 57 1.444 -13.675 -10.995 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.260 -13.902 -12.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -0.145 -14.430 -12.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 0.838 -15.718 -13.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 0.155 -15.732 -11.507 1.00 0.00 H new ATOM 971 N VAL A 58 3.454 -10.891 -10.214 1.00 0.00 N ATOM 972 CA VAL A 58 2.879 -10.409 -8.954 1.00 0.00 C ATOM 973 C VAL A 58 2.929 -11.462 -7.844 1.00 0.00 C ATOM 974 O VAL A 58 2.459 -12.601 -7.992 1.00 0.00 O ATOM 975 CB VAL A 58 1.406 -9.927 -9.158 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.491 -11.026 -9.710 1.00 0.00 C ATOM 977 CG2 VAL A 58 0.864 -9.384 -7.862 1.00 0.00 C ATOM 0 H VAL A 58 2.977 -10.522 -11.036 1.00 0.00 H new ATOM 0 HA VAL A 58 3.495 -9.566 -8.639 1.00 0.00 H new ATOM 0 HB VAL A 58 1.423 -9.136 -9.908 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.518 -10.633 -9.831 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.867 -11.362 -10.676 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.472 -11.866 -9.016 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.163 -9.049 -8.009 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.886 -10.166 -7.103 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.476 -8.544 -7.535 1.00 0.00 H new ATOM 987 N CYS A 59 3.525 -11.081 -6.767 1.00 0.00 N ATOM 988 CA CYS A 59 3.661 -11.928 -5.639 1.00 0.00 C ATOM 989 C CYS A 59 2.908 -11.377 -4.429 1.00 0.00 C ATOM 990 O CYS A 59 2.394 -12.157 -3.630 1.00 0.00 O ATOM 991 CB CYS A 59 5.135 -12.088 -5.294 1.00 0.00 C ATOM 992 SG CYS A 59 6.165 -12.727 -6.636 1.00 0.00 S ATOM 0 H CYS A 59 3.938 -10.156 -6.646 1.00 0.00 H new ATOM 0 HA CYS A 59 3.230 -12.897 -5.892 1.00 0.00 H new ATOM 0 HB2 CYS A 59 5.528 -11.120 -4.983 1.00 0.00 H new ATOM 0 HB3 CYS A 59 5.222 -12.757 -4.438 1.00 0.00 H new ATOM 0 HG CYS A 59 5.748 -12.246 -7.770 1.00 0.00 H new ATOM 998 N ALA A 60 2.746 -10.042 -4.339 1.00 0.00 N ATOM 999 CA ALA A 60 2.254 -9.459 -3.149 1.00 0.00 C ATOM 1000 C ALA A 60 1.227 -8.505 -3.420 1.00 0.00 C ATOM 1001 O ALA A 60 1.420 -7.586 -4.177 1.00 0.00 O ATOM 1002 CB ALA A 60 3.307 -8.697 -2.426 1.00 0.00 C ATOM 0 H ALA A 60 2.956 -9.382 -5.087 1.00 0.00 H new ATOM 0 HA ALA A 60 1.887 -10.296 -2.555 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.885 -8.266 -1.518 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.126 -9.367 -2.164 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.683 -7.899 -3.066 1.00 0.00 H new ATOM 1008 N ASN A 61 0.156 -8.755 -2.872 1.00 0.00 N ATOM 1009 CA ASN A 61 -0.893 -7.794 -2.760 1.00 0.00 C ATOM 1010 C ASN A 61 -0.888 -7.181 -1.390 1.00 0.00 C ATOM 1011 O ASN A 61 -1.158 -7.824 -0.411 1.00 0.00 O ATOM 1012 CB ASN A 61 -2.204 -8.435 -2.991 1.00 0.00 C ATOM 1013 CG ASN A 61 -3.402 -7.556 -2.739 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -3.865 -6.895 -3.632 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -3.916 -7.556 -1.536 1.00 0.00 N ATOM 0 H ASN A 61 -0.066 -9.660 -2.458 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.728 -7.021 -3.510 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.242 -8.786 -4.022 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.278 -9.315 -2.352 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -4.735 -6.983 -1.331 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -3.498 -8.129 -0.803 1.00 0.00 H new ATOM 1022 N HIS A 62 -0.494 -6.007 -1.327 1.00 0.00 N ATOM 1023 CA HIS A 62 -0.602 -5.223 -0.106 1.00 0.00 C ATOM 1024 C HIS A 62 -1.541 -4.046 -0.337 1.00 0.00 C ATOM 1025 O HIS A 62 -1.341 -3.293 -1.228 1.00 0.00 O ATOM 1026 CB HIS A 62 0.770 -4.658 0.314 1.00 0.00 C ATOM 1027 CG HIS A 62 1.835 -5.665 0.536 1.00 0.00 C ATOM 1028 ND1 HIS A 62 3.166 -5.412 0.306 1.00 0.00 N ATOM 1029 CD2 HIS A 62 1.769 -6.926 0.952 1.00 0.00 C ATOM 1030 CE1 HIS A 62 3.860 -6.494 0.571 1.00 0.00 C ATOM 1031 NE2 HIS A 62 3.031 -7.425 0.961 1.00 0.00 N ATOM 0 H HIS A 62 -0.072 -5.508 -2.110 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.981 -5.878 0.678 1.00 0.00 H new ATOM 0 HB2 HIS A 62 1.107 -3.962 -0.454 1.00 0.00 H new ATOM 0 HB3 HIS A 62 0.641 -4.083 1.231 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.872 -7.458 1.232 1.00 0.00 H new ATOM 0 HE1 HIS A 62 4.931 -6.597 0.482 1.00 0.00 H new ATOM 0 HE2 HIS A 62 3.290 -8.374 1.229 1.00 0.00 H new ATOM 1039 N TRP A 63 -2.551 -3.912 0.457 1.00 0.00 N ATOM 1040 CA TRP A 63 -3.390 -2.744 0.434 1.00 0.00 C ATOM 1041 C TRP A 63 -2.765 -1.691 1.293 1.00 0.00 C ATOM 1042 O TRP A 63 -2.086 -1.998 2.257 1.00 0.00 O ATOM 1043 CB TRP A 63 -4.798 -3.046 0.957 1.00 0.00 C ATOM 1044 CG TRP A 63 -5.618 -3.903 0.050 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -6.224 -3.499 -1.090 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -5.955 -5.286 0.213 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -6.896 -4.536 -1.666 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -6.754 -5.646 -0.890 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -5.657 -6.254 1.168 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -7.259 -6.930 -1.061 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -6.162 -7.529 0.999 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -6.953 -7.857 -0.107 1.00 0.00 C ATOM 0 H TRP A 63 -2.825 -4.611 1.148 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.481 -2.406 -0.598 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -4.715 -3.538 1.926 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -5.322 -2.104 1.121 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -6.181 -2.496 -1.488 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.421 -4.488 -2.539 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -5.044 -6.013 2.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.869 -7.184 -1.915 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -5.942 -8.287 1.736 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -7.329 -8.864 -0.208 1.00 0.00 H new ATOM 1063 N ILE A 64 -2.961 -0.470 0.937 1.00 0.00 N ATOM 1064 CA ILE A 64 -2.414 0.597 1.642 1.00 0.00 C ATOM 1065 C ILE A 64 -3.579 1.308 2.330 1.00 0.00 C ATOM 1066 O ILE A 64 -4.418 1.957 1.695 1.00 0.00 O ATOM 1067 CB ILE A 64 -1.512 1.480 0.668 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -1.003 2.789 1.300 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -2.194 1.738 -0.681 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -2.058 3.832 1.405 1.00 0.00 C ATOM 0 H ILE A 64 -3.520 -0.197 0.129 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.720 0.300 2.428 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.625 0.874 0.483 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.609 2.577 2.294 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.176 3.176 0.705 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.541 2.343 -1.309 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.394 0.787 -1.175 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.133 2.267 -0.519 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.638 4.730 1.858 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.435 4.070 0.410 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -2.875 3.462 2.024 1.00 0.00 H new ATOM 1082 N THR A 65 -3.720 1.027 3.587 1.00 0.00 N ATOM 1083 CA THR A 65 -4.790 1.561 4.364 1.00 0.00 C ATOM 1084 C THR A 65 -4.363 1.862 5.787 1.00 0.00 C ATOM 1085 O THR A 65 -3.352 1.357 6.265 1.00 0.00 O ATOM 1086 CB THR A 65 -6.015 0.610 4.342 1.00 0.00 C ATOM 1087 OG1 THR A 65 -7.067 1.087 5.184 1.00 0.00 O ATOM 1088 CG2 THR A 65 -5.637 -0.827 4.704 1.00 0.00 C ATOM 0 H THR A 65 -3.090 0.415 4.106 1.00 0.00 H new ATOM 0 HA THR A 65 -5.081 2.508 3.908 1.00 0.00 H new ATOM 0 HB THR A 65 -6.383 0.601 3.316 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.755 0.394 5.273 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.527 -1.456 4.675 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.905 -1.202 3.989 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.209 -0.849 5.706 1.00 0.00 H new ATOM 1096 N THR A 66 -5.162 2.659 6.457 1.00 0.00 N ATOM 1097 CA THR A 66 -5.001 2.960 7.866 1.00 0.00 C ATOM 1098 C THR A 66 -5.470 1.784 8.727 1.00 0.00 C ATOM 1099 O THR A 66 -5.324 1.777 9.945 1.00 0.00 O ATOM 1100 CB THR A 66 -5.758 4.209 8.257 1.00 0.00 C ATOM 1101 OG1 THR A 66 -7.074 4.202 7.671 1.00 0.00 O ATOM 1102 CG2 THR A 66 -5.027 5.434 7.844 1.00 0.00 C ATOM 0 H THR A 66 -5.961 3.128 6.031 1.00 0.00 H new ATOM 0 HA THR A 66 -3.939 3.133 8.041 1.00 0.00 H new ATOM 0 HB THR A 66 -5.849 4.216 9.343 1.00 0.00 H new ATOM 0 HG1 THR A 66 -7.553 5.015 7.934 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.597 6.315 8.139 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.050 5.455 8.327 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.896 5.432 6.762 1.00 0.00 H new ATOM 1110 N THR A 67 -6.000 0.775 8.064 1.00 0.00 N ATOM 1111 CA THR A 67 -6.518 -0.423 8.689 1.00 0.00 C ATOM 1112 C THR A 67 -5.325 -1.364 8.958 1.00 0.00 C ATOM 1113 O THR A 67 -5.446 -2.469 9.485 1.00 0.00 O ATOM 1114 CB THR A 67 -7.548 -1.064 7.699 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.610 -0.120 7.442 1.00 0.00 O ATOM 1116 CG2 THR A 67 -8.138 -2.367 8.214 1.00 0.00 C ATOM 0 H THR A 67 -6.084 0.767 7.047 1.00 0.00 H new ATOM 0 HA THR A 67 -7.021 -0.220 9.634 1.00 0.00 H new ATOM 0 HB THR A 67 -7.009 -1.302 6.782 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.257 -0.516 6.821 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.844 -2.761 7.483 1.00 0.00 H new ATOM 0 HG22 THR A 67 -7.339 -3.091 8.373 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.655 -2.185 9.156 1.00 0.00 H new ATOM 1124 N MET A 68 -4.174 -0.846 8.663 1.00 0.00 N ATOM 1125 CA MET A 68 -2.977 -1.490 8.745 1.00 0.00 C ATOM 1126 C MET A 68 -2.001 -0.442 9.235 1.00 0.00 C ATOM 1127 O MET A 68 -2.322 0.756 9.263 1.00 0.00 O ATOM 1128 CB MET A 68 -2.613 -1.912 7.362 1.00 0.00 C ATOM 1129 CG MET A 68 -1.343 -2.722 7.250 1.00 0.00 C ATOM 1130 SD MET A 68 -0.806 -2.892 5.543 1.00 0.00 S ATOM 1131 CE MET A 68 -2.255 -3.659 4.819 1.00 0.00 C ATOM 0 H MET A 68 -4.081 0.116 8.337 1.00 0.00 H new ATOM 0 HA MET A 68 -2.987 -2.361 9.400 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.435 -2.497 6.949 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.513 -1.021 6.742 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.555 -2.245 7.833 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.503 -3.710 7.680 1.00 0.00 H new ATOM 0 HE1 MET A 68 -1.983 -4.133 3.876 1.00 0.00 H new ATOM 0 HE2 MET A 68 -2.649 -4.411 5.503 1.00 0.00 H new ATOM 0 HE3 MET A 68 -3.016 -2.900 4.637 1.00 0.00 H new ATOM 1141 N ASN A 69 -0.893 -0.880 9.618 1.00 0.00 N ATOM 1142 CA ASN A 69 0.160 -0.062 10.144 1.00 0.00 C ATOM 1143 C ASN A 69 1.501 -0.558 9.626 1.00 0.00 C ATOM 1144 O ASN A 69 1.692 -1.767 9.444 1.00 0.00 O ATOM 1145 CB ASN A 69 0.144 -0.242 11.639 1.00 0.00 C ATOM 1146 CG ASN A 69 1.166 0.593 12.395 1.00 0.00 C ATOM 1147 OD1 ASN A 69 1.738 0.142 13.395 1.00 0.00 O ATOM 1148 ND2 ASN A 69 1.333 1.829 12.007 1.00 0.00 N ATOM 0 H ASN A 69 -0.652 -1.871 9.584 1.00 0.00 H new ATOM 0 HA ASN A 69 0.020 0.979 9.852 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.851 0.005 12.010 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.317 -1.294 11.866 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.948 2.450 12.533 1.00 0.00 H new ATOM 0 HD22 ASN A 69 0.848 2.173 11.178 1.00 0.00 H new ATOM 1155 N LEU A 70 2.395 0.369 9.372 1.00 0.00 N ATOM 1156 CA LEU A 70 3.697 0.129 9.036 1.00 0.00 C ATOM 1157 C LEU A 70 4.600 0.231 10.258 1.00 0.00 C ATOM 1158 O LEU A 70 4.442 1.083 11.129 1.00 0.00 O ATOM 1159 CB LEU A 70 4.114 0.950 7.827 1.00 0.00 C ATOM 1160 CG LEU A 70 3.846 2.448 7.775 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.479 3.143 8.924 1.00 0.00 C ATOM 1162 CD2 LEU A 70 4.445 2.934 6.512 1.00 0.00 C ATOM 0 H LEU A 70 2.173 1.364 9.409 1.00 0.00 H new ATOM 0 HA LEU A 70 3.810 -0.903 8.703 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.188 0.812 7.700 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.630 0.507 6.956 1.00 0.00 H new ATOM 0 HG LEU A 70 2.775 2.647 7.823 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.272 4.211 8.862 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.074 2.748 9.856 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.557 2.980 8.899 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.282 4.008 6.422 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.515 2.728 6.514 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.979 2.424 5.669 1.00 0.00 H new ATOM 1174 N LYS A 71 5.429 -0.683 10.336 1.00 0.00 N ATOM 1175 CA LYS A 71 6.339 -0.908 11.455 1.00 0.00 C ATOM 1176 C LYS A 71 7.773 -1.046 10.922 1.00 0.00 C ATOM 1177 O LYS A 71 7.969 -1.660 9.900 1.00 0.00 O ATOM 1178 CB LYS A 71 5.914 -2.222 12.137 1.00 0.00 C ATOM 1179 CG LYS A 71 6.705 -2.612 13.368 1.00 0.00 C ATOM 1180 CD LYS A 71 6.253 -3.963 13.887 1.00 0.00 C ATOM 1181 CE LYS A 71 6.939 -4.322 15.190 1.00 0.00 C ATOM 1182 NZ LYS A 71 6.559 -5.672 15.657 1.00 0.00 N ATOM 0 H LYS A 71 5.542 -1.374 9.594 1.00 0.00 H new ATOM 0 HA LYS A 71 6.303 -0.078 12.161 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.863 -2.142 12.414 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.991 -3.029 11.408 1.00 0.00 H new ATOM 0 HG2 LYS A 71 7.768 -2.645 13.128 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.577 -1.857 14.144 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.173 -3.953 14.035 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.465 -4.729 13.141 1.00 0.00 H new ATOM 0 HE2 LYS A 71 8.020 -4.274 15.057 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.679 -3.587 15.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.049 -5.881 16.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.531 -5.710 15.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.830 -6.376 14.941 1.00 0.00 H new ATOM 1196 N PRO A 72 8.780 -0.459 11.573 1.00 0.00 N ATOM 1197 CA PRO A 72 10.157 -0.572 11.116 1.00 0.00 C ATOM 1198 C PRO A 72 10.865 -1.834 11.646 1.00 0.00 C ATOM 1199 O PRO A 72 10.599 -2.299 12.765 1.00 0.00 O ATOM 1200 CB PRO A 72 10.809 0.687 11.685 1.00 0.00 C ATOM 1201 CG PRO A 72 10.046 0.990 12.941 1.00 0.00 C ATOM 1202 CD PRO A 72 8.672 0.371 12.790 1.00 0.00 C ATOM 0 HA PRO A 72 10.220 -0.659 10.031 1.00 0.00 H new ATOM 0 HB2 PRO A 72 11.866 0.523 11.896 1.00 0.00 H new ATOM 0 HB3 PRO A 72 10.750 1.515 10.979 1.00 0.00 H new ATOM 0 HG2 PRO A 72 10.559 0.581 13.811 1.00 0.00 H new ATOM 0 HG3 PRO A 72 9.968 2.066 13.094 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.408 -0.230 13.660 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.901 1.134 12.684 1.00 0.00 H new ATOM 1210 N LEU A 73 11.720 -2.405 10.824 1.00 0.00 N ATOM 1211 CA LEU A 73 12.527 -3.504 11.181 1.00 0.00 C ATOM 1212 C LEU A 73 13.872 -3.024 11.690 1.00 0.00 C ATOM 1213 O LEU A 73 14.103 -1.818 11.841 1.00 0.00 O ATOM 1214 CB LEU A 73 12.769 -4.390 9.960 1.00 0.00 C ATOM 1215 CG LEU A 73 12.759 -3.760 8.557 1.00 0.00 C ATOM 1216 CD1 LEU A 73 13.654 -4.565 7.629 1.00 0.00 C ATOM 1217 CD2 LEU A 73 11.353 -3.778 7.984 1.00 0.00 C ATOM 0 H LEU A 73 11.861 -2.091 9.864 1.00 0.00 H new ATOM 0 HA LEU A 73 12.013 -4.066 11.961 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.736 -4.875 10.094 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.014 -5.176 9.971 1.00 0.00 H new ATOM 0 HG LEU A 73 13.116 -2.733 8.639 1.00 0.00 H new ATOM 0 HD11 LEU A 73 13.645 -4.117 6.636 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.673 -4.567 8.017 1.00 0.00 H new ATOM 0 HD13 LEU A 73 13.287 -5.590 7.568 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.359 -3.329 6.991 1.00 0.00 H new ATOM 0 HD22 LEU A 73 11.001 -4.807 7.915 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.688 -3.210 8.634 1.00 0.00 H new ATOM 1229 N SER A 74 14.743 -3.960 11.967 1.00 0.00 N ATOM 1230 CA SER A 74 16.100 -3.657 12.301 1.00 0.00 C ATOM 1231 C SER A 74 16.924 -3.648 11.072 1.00 0.00 C ATOM 1232 O SER A 74 16.667 -4.423 10.138 1.00 0.00 O ATOM 1233 CB SER A 74 16.700 -4.709 13.191 1.00 0.00 C ATOM 1234 OG SER A 74 16.125 -4.707 14.484 1.00 0.00 O ATOM 0 H SER A 74 14.524 -4.956 11.966 1.00 0.00 H new ATOM 0 HA SER A 74 16.092 -2.690 12.805 1.00 0.00 H new ATOM 0 HB2 SER A 74 16.562 -5.690 12.735 1.00 0.00 H new ATOM 0 HB3 SER A 74 17.774 -4.544 13.273 1.00 0.00 H new ATOM 0 HG SER A 74 16.542 -5.407 15.029 1.00 0.00 H new ATOM 1240 N GLY A 75 17.879 -2.779 11.035 1.00 0.00 N ATOM 1241 CA GLY A 75 18.827 -2.829 9.994 1.00 0.00 C ATOM 1242 C GLY A 75 18.348 -2.176 8.705 1.00 0.00 C ATOM 1243 O GLY A 75 19.072 -2.130 7.713 1.00 0.00 O ATOM 0 H GLY A 75 18.016 -2.031 11.715 1.00 0.00 H new ATOM 0 HA2 GLY A 75 19.742 -2.337 10.323 1.00 0.00 H new ATOM 0 HA3 GLY A 75 19.079 -3.870 9.793 1.00 0.00 H new ATOM 1247 N SER A 76 17.144 -1.669 8.729 1.00 0.00 N ATOM 1248 CA SER A 76 16.549 -0.977 7.654 1.00 0.00 C ATOM 1249 C SER A 76 17.051 0.437 7.564 1.00 0.00 C ATOM 1250 O SER A 76 17.358 1.099 8.572 1.00 0.00 O ATOM 1251 CB SER A 76 15.063 -1.050 7.904 1.00 0.00 C ATOM 1252 OG SER A 76 14.778 -0.840 9.271 1.00 0.00 O ATOM 0 H SER A 76 16.536 -1.739 9.545 1.00 0.00 H new ATOM 0 HA SER A 76 16.803 -1.422 6.692 1.00 0.00 H new ATOM 0 HB2 SER A 76 14.550 -0.301 7.301 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.684 -2.024 7.593 1.00 0.00 H new ATOM 0 HG SER A 76 13.812 -0.730 9.391 1.00 0.00 H new ATOM 1258 N ASP A 77 17.182 0.862 6.347 1.00 0.00 N ATOM 1259 CA ASP A 77 17.584 2.175 5.999 1.00 0.00 C ATOM 1260 C ASP A 77 16.397 2.982 6.159 1.00 0.00 C ATOM 1261 O ASP A 77 16.394 3.981 6.857 1.00 0.00 O ATOM 1262 CB ASP A 77 18.060 2.274 4.539 1.00 0.00 C ATOM 1263 CG ASP A 77 17.610 1.122 3.656 1.00 0.00 C ATOM 1264 OD1 ASP A 77 16.400 0.783 3.663 1.00 0.00 O ATOM 1265 OD2 ASP A 77 18.479 0.512 2.968 1.00 0.00 O ATOM 0 H ASP A 77 17.002 0.270 5.536 1.00 0.00 H new ATOM 0 HA ASP A 77 18.420 2.494 6.621 1.00 0.00 H new ATOM 0 HB2 ASP A 77 17.694 3.208 4.112 1.00 0.00 H new ATOM 0 HB3 ASP A 77 19.149 2.322 4.526 1.00 0.00 H new ATOM 1270 N ARG A 78 15.362 2.488 5.538 1.00 0.00 N ATOM 1271 CA ARG A 78 14.062 3.037 5.676 1.00 0.00 C ATOM 1272 C ARG A 78 13.030 2.100 5.056 1.00 0.00 C ATOM 1273 O ARG A 78 12.139 2.456 4.270 1.00 0.00 O ATOM 1274 CB ARG A 78 13.956 4.485 5.216 1.00 0.00 C ATOM 1275 CG ARG A 78 12.844 5.256 5.935 1.00 0.00 C ATOM 1276 CD ARG A 78 13.097 5.384 7.440 1.00 0.00 C ATOM 1277 NE ARG A 78 14.267 6.216 7.723 1.00 0.00 N ATOM 1278 CZ ARG A 78 15.091 6.071 8.756 1.00 0.00 C ATOM 1279 NH1 ARG A 78 14.798 5.227 9.728 1.00 0.00 N ATOM 1280 NH2 ARG A 78 16.187 6.817 8.840 1.00 0.00 N ATOM 0 H ARG A 78 15.409 1.681 4.915 1.00 0.00 H new ATOM 0 HA ARG A 78 13.836 3.104 6.740 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.909 4.986 5.387 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.772 4.508 4.142 1.00 0.00 H new ATOM 0 HG2 ARG A 78 12.756 6.251 5.499 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.892 4.751 5.772 1.00 0.00 H new ATOM 0 HD2 ARG A 78 12.219 5.815 7.921 1.00 0.00 H new ATOM 0 HD3 ARG A 78 13.242 4.393 7.870 1.00 0.00 H new ATOM 0 HE ARG A 78 14.468 6.974 7.070 1.00 0.00 H new ATOM 0 HH11 ARG A 78 13.936 4.683 9.688 1.00 0.00 H new ATOM 0 HH12 ARG A 78 15.433 5.119 10.519 1.00 0.00 H new ATOM 0 HH21 ARG A 78 16.396 7.500 8.112 1.00 0.00 H new ATOM 0 HH22 ARG A 78 16.820 6.706 9.632 1.00 0.00 H new ATOM 1294 N ALA A 79 13.136 0.921 5.477 1.00 0.00 N ATOM 1295 CA ALA A 79 12.299 -0.143 5.076 1.00 0.00 C ATOM 1296 C ALA A 79 11.385 -0.450 6.254 1.00 0.00 C ATOM 1297 O ALA A 79 11.822 -0.413 7.394 1.00 0.00 O ATOM 1298 CB ALA A 79 13.148 -1.348 4.772 1.00 0.00 C ATOM 0 H ALA A 79 13.847 0.640 6.152 1.00 0.00 H new ATOM 0 HA ALA A 79 11.722 0.115 4.188 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.509 -2.174 4.461 1.00 0.00 H new ATOM 0 HB2 ALA A 79 13.846 -1.108 3.970 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.705 -1.635 5.664 1.00 0.00 H new ATOM 1304 N TRP A 80 10.137 -0.731 5.978 1.00 0.00 N ATOM 1305 CA TRP A 80 9.125 -0.914 6.995 1.00 0.00 C ATOM 1306 C TRP A 80 8.311 -2.092 6.567 1.00 0.00 C ATOM 1307 O TRP A 80 8.373 -2.481 5.379 1.00 0.00 O ATOM 1308 CB TRP A 80 8.192 0.323 7.177 1.00 0.00 C ATOM 1309 CG TRP A 80 8.854 1.628 7.622 1.00 0.00 C ATOM 1310 CD1 TRP A 80 9.831 2.337 6.980 1.00 0.00 C ATOM 1311 CD2 TRP A 80 8.530 2.396 8.795 1.00 0.00 C ATOM 1312 NE1 TRP A 80 10.133 3.474 7.676 1.00 0.00 N ATOM 1313 CE2 TRP A 80 9.353 3.536 8.790 1.00 0.00 C ATOM 1314 CE3 TRP A 80 7.631 2.232 9.842 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 9.301 4.499 9.792 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 7.579 3.191 10.838 1.00 0.00 C ATOM 1317 CH2 TRP A 80 8.408 4.309 10.805 1.00 0.00 C ATOM 0 H TRP A 80 9.787 -0.841 5.026 1.00 0.00 H new ATOM 0 HA TRP A 80 9.614 -1.059 7.958 1.00 0.00 H new ATOM 0 HB2 TRP A 80 7.683 0.506 6.231 1.00 0.00 H new ATOM 0 HB3 TRP A 80 7.425 0.065 7.907 1.00 0.00 H new ATOM 0 HD1 TRP A 80 10.299 2.040 6.053 1.00 0.00 H new ATOM 0 HE1 TRP A 80 10.831 4.166 7.404 1.00 0.00 H new ATOM 0 HE3 TRP A 80 6.983 1.369 9.878 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 9.945 5.366 9.769 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 6.883 3.070 11.655 1.00 0.00 H new ATOM 0 HH2 TRP A 80 8.343 5.040 11.597 1.00 0.00 H new ATOM 1328 N MET A 81 7.590 -2.645 7.477 1.00 0.00 N ATOM 1329 CA MET A 81 6.823 -3.777 7.285 1.00 0.00 C ATOM 1330 C MET A 81 5.484 -3.487 7.754 1.00 0.00 C ATOM 1331 O MET A 81 5.287 -2.758 8.707 1.00 0.00 O ATOM 1332 CB MET A 81 7.398 -5.001 7.982 1.00 0.00 C ATOM 1333 CG MET A 81 7.750 -4.830 9.458 1.00 0.00 C ATOM 1334 SD MET A 81 8.629 -6.258 10.151 1.00 0.00 S ATOM 1335 CE MET A 81 7.446 -7.567 9.887 1.00 0.00 C ATOM 0 H MET A 81 7.531 -2.279 8.427 1.00 0.00 H new ATOM 0 HA MET A 81 6.813 -4.025 6.224 1.00 0.00 H new ATOM 0 HB2 MET A 81 6.679 -5.816 7.893 1.00 0.00 H new ATOM 0 HB3 MET A 81 8.297 -5.309 7.448 1.00 0.00 H new ATOM 0 HG2 MET A 81 8.366 -3.939 9.577 1.00 0.00 H new ATOM 0 HG3 MET A 81 6.835 -4.663 10.027 1.00 0.00 H new ATOM 0 HE1 MET A 81 7.779 -8.468 10.403 1.00 0.00 H new ATOM 0 HE2 MET A 81 6.474 -7.263 10.276 1.00 0.00 H new ATOM 0 HE3 MET A 81 7.361 -7.771 8.820 1.00 0.00 H new ATOM 1345 N TRP A 82 4.611 -3.996 7.087 1.00 0.00 N ATOM 1346 CA TRP A 82 3.262 -3.777 7.294 1.00 0.00 C ATOM 1347 C TRP A 82 2.597 -5.099 7.229 1.00 0.00 C ATOM 1348 O TRP A 82 3.111 -6.018 6.571 1.00 0.00 O ATOM 1349 CB TRP A 82 2.680 -2.755 6.296 1.00 0.00 C ATOM 1350 CG TRP A 82 3.159 -2.904 4.877 1.00 0.00 C ATOM 1351 CD1 TRP A 82 2.708 -3.778 3.931 1.00 0.00 C ATOM 1352 CD2 TRP A 82 4.178 -2.122 4.244 1.00 0.00 C ATOM 1353 NE1 TRP A 82 3.397 -3.590 2.756 1.00 0.00 N ATOM 1354 CE2 TRP A 82 4.298 -2.581 2.923 1.00 0.00 C ATOM 1355 CE3 TRP A 82 5.003 -1.077 4.673 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 5.205 -2.033 2.026 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 5.902 -0.534 3.781 1.00 0.00 C ATOM 1358 CH2 TRP A 82 5.996 -1.012 2.471 1.00 0.00 C ATOM 0 H TRP A 82 4.805 -4.632 6.313 1.00 0.00 H new ATOM 0 HA TRP A 82 3.088 -3.326 8.271 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.593 -2.838 6.307 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.926 -1.751 6.643 1.00 0.00 H new ATOM 0 HD1 TRP A 82 1.927 -4.508 4.083 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.256 -4.121 1.897 1.00 0.00 H new ATOM 0 HE3 TRP A 82 4.937 -0.703 5.684 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 5.282 -2.400 1.013 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 6.544 0.274 4.099 1.00 0.00 H new ATOM 0 HH2 TRP A 82 6.710 -0.564 1.796 1.00 0.00 H new ATOM 1369 N LEU A 83 1.526 -5.270 7.887 1.00 0.00 N ATOM 1370 CA LEU A 83 0.940 -6.552 7.815 1.00 0.00 C ATOM 1371 C LEU A 83 -0.205 -6.512 6.840 1.00 0.00 C ATOM 1372 O LEU A 83 -1.134 -5.740 6.997 1.00 0.00 O ATOM 1373 CB LEU A 83 0.471 -7.076 9.177 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.487 -6.166 9.997 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -1.285 -7.005 10.978 1.00 0.00 C ATOM 1376 CD2 LEU A 83 0.303 -5.121 10.791 1.00 0.00 C ATOM 0 H LEU A 83 1.047 -4.576 8.461 1.00 0.00 H new ATOM 0 HA LEU A 83 1.705 -7.248 7.473 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -0.026 -8.033 9.018 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.354 -7.272 9.786 1.00 0.00 H new ATOM 0 HG LEU A 83 -1.154 -5.664 9.296 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.954 -6.360 11.548 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.872 -7.744 10.432 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.604 -7.515 11.659 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.387 -4.496 11.357 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.983 -5.624 11.478 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.876 -4.499 10.104 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.181 -7.393 5.900 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.135 -7.333 4.814 1.00 0.00 C ATOM 1390 C ALA A 84 -1.563 -8.676 4.372 1.00 0.00 C ATOM 1391 O ALA A 84 -0.858 -9.663 4.587 1.00 0.00 O ATOM 1392 CB ALA A 84 -0.523 -6.631 3.617 1.00 0.00 C ATOM 0 H ALA A 84 0.482 -8.167 5.849 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.000 -6.788 5.192 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.251 -6.592 2.807 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.237 -5.617 3.897 1.00 0.00 H new ATOM 0 HB3 ALA A 84 0.360 -7.178 3.286 1.00 0.00 H new ATOM 1398 N SER A 85 -2.711 -8.718 3.762 1.00 0.00 N ATOM 1399 CA SER A 85 -3.161 -9.834 3.099 1.00 0.00 C ATOM 1400 C SER A 85 -2.683 -9.848 1.705 1.00 0.00 C ATOM 1401 O SER A 85 -3.207 -9.189 0.788 1.00 0.00 O ATOM 1402 CB SER A 85 -4.594 -9.952 3.236 1.00 0.00 C ATOM 1403 OG SER A 85 -5.156 -8.747 3.780 1.00 0.00 O ATOM 0 H SER A 85 -3.358 -7.930 3.731 1.00 0.00 H new ATOM 0 HA SER A 85 -2.739 -10.729 3.556 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.041 -10.160 2.264 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.834 -10.795 3.884 1.00 0.00 H new ATOM 0 HG SER A 85 -6.127 -8.847 3.863 1.00 0.00 H new ATOM 1409 N ASP A 86 -1.681 -10.599 1.605 1.00 0.00 N ATOM 1410 CA ASP A 86 -0.864 -10.759 0.493 1.00 0.00 C ATOM 1411 C ASP A 86 -1.086 -12.154 -0.101 1.00 0.00 C ATOM 1412 O ASP A 86 -1.729 -12.983 0.546 1.00 0.00 O ATOM 1413 CB ASP A 86 0.574 -10.375 0.899 1.00 0.00 C ATOM 1414 CG ASP A 86 1.763 -10.601 -0.020 1.00 0.00 C ATOM 1415 OD1 ASP A 86 1.747 -11.433 -0.917 1.00 0.00 O ATOM 1416 OD2 ASP A 86 2.784 -9.919 0.195 1.00 0.00 O ATOM 0 H ASP A 86 -1.378 -11.182 2.385 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.107 -10.091 -0.333 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.559 -9.311 1.136 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.790 -10.905 1.827 1.00 0.00 H new ATOM 1421 N PHE A 87 -0.554 -12.378 -1.298 1.00 0.00 N ATOM 1422 CA PHE A 87 -0.757 -13.424 -2.165 1.00 0.00 C ATOM 1423 C PHE A 87 -1.900 -13.143 -3.127 1.00 0.00 C ATOM 1424 O PHE A 87 -3.024 -13.496 -2.940 1.00 0.00 O ATOM 1425 CB PHE A 87 -0.762 -14.758 -1.544 1.00 0.00 C ATOM 1426 CG PHE A 87 0.521 -15.186 -0.857 1.00 0.00 C ATOM 1427 CD1 PHE A 87 1.537 -15.790 -1.576 1.00 0.00 C ATOM 1428 CD2 PHE A 87 0.697 -15.000 0.510 1.00 0.00 C ATOM 1429 CE1 PHE A 87 2.701 -16.197 -0.950 1.00 0.00 C ATOM 1430 CE2 PHE A 87 1.857 -15.401 1.139 1.00 0.00 C ATOM 1431 CZ PHE A 87 2.862 -16.000 0.408 1.00 0.00 C ATOM 0 H PHE A 87 0.112 -11.712 -1.689 1.00 0.00 H new ATOM 0 HA PHE A 87 0.138 -13.483 -2.784 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -1.569 -14.791 -0.812 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -0.999 -15.492 -2.314 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.420 -15.945 -2.638 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -0.087 -14.534 1.088 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.485 -16.669 -1.523 1.00 0.00 H new ATOM 0 HE2 PHE A 87 1.978 -15.247 2.201 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.773 -16.314 0.896 1.00 0.00 H new ATOM 1441 N SER A 88 -1.542 -12.424 -4.125 1.00 0.00 N ATOM 1442 CA SER A 88 -2.396 -11.896 -5.145 1.00 0.00 C ATOM 1443 C SER A 88 -2.863 -12.992 -6.012 1.00 0.00 C ATOM 1444 O SER A 88 -4.005 -13.051 -6.444 1.00 0.00 O ATOM 1445 CB SER A 88 -1.576 -10.940 -5.983 1.00 0.00 C ATOM 1446 OG SER A 88 -1.010 -9.939 -5.219 1.00 0.00 O ATOM 0 H SER A 88 -0.566 -12.163 -4.269 1.00 0.00 H new ATOM 0 HA SER A 88 -3.254 -11.394 -4.697 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.790 -11.492 -6.498 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.209 -10.496 -6.751 1.00 0.00 H new ATOM 0 HG SER A 88 -0.913 -9.129 -5.761 1.00 0.00 H new ATOM 1452 N ASP A 89 -1.947 -13.902 -6.234 1.00 0.00 N ATOM 1453 CA ASP A 89 -2.162 -14.920 -7.177 1.00 0.00 C ATOM 1454 C ASP A 89 -1.889 -16.238 -6.507 1.00 0.00 C ATOM 1455 O ASP A 89 -1.908 -17.310 -7.107 1.00 0.00 O ATOM 1456 CB ASP A 89 -1.286 -14.656 -8.412 1.00 0.00 C ATOM 1457 CG ASP A 89 -1.505 -15.605 -9.562 1.00 0.00 C ATOM 1458 OD1 ASP A 89 -2.637 -15.686 -10.081 1.00 0.00 O ATOM 1459 OD2 ASP A 89 -0.536 -16.265 -9.997 1.00 0.00 O ATOM 0 H ASP A 89 -1.045 -13.940 -5.760 1.00 0.00 H new ATOM 0 HA ASP A 89 -3.192 -14.943 -7.534 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -1.470 -13.639 -8.759 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.239 -14.706 -8.114 1.00 0.00 H new ATOM 1464 N GLY A 90 -1.660 -16.118 -5.224 1.00 0.00 N ATOM 1465 CA GLY A 90 -1.415 -17.198 -4.399 1.00 0.00 C ATOM 1466 C GLY A 90 -2.464 -17.268 -3.358 1.00 0.00 C ATOM 1467 O GLY A 90 -2.477 -18.180 -2.519 1.00 0.00 O ATOM 0 H GLY A 90 -1.646 -15.220 -4.740 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -1.403 -18.119 -4.981 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.433 -17.101 -3.936 1.00 0.00 H new ATOM 1471 N ASP A 91 -3.320 -16.239 -3.397 1.00 0.00 N ATOM 1472 CA ASP A 91 -4.519 -16.106 -2.563 1.00 0.00 C ATOM 1473 C ASP A 91 -4.181 -15.580 -1.187 1.00 0.00 C ATOM 1474 O ASP A 91 -3.284 -16.083 -0.513 1.00 0.00 O ATOM 1475 CB ASP A 91 -5.325 -17.373 -2.542 1.00 0.00 C ATOM 1476 CG ASP A 91 -6.446 -17.363 -1.525 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -7.358 -16.495 -1.624 1.00 0.00 O ATOM 1478 OD2 ASP A 91 -6.446 -18.207 -0.612 1.00 0.00 O ATOM 0 H ASP A 91 -3.192 -15.451 -4.031 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.165 -15.355 -3.018 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.747 -17.542 -3.533 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.662 -18.212 -2.331 1.00 0.00 H new ATOM 1483 N ALA A 92 -4.940 -14.620 -0.764 1.00 0.00 N ATOM 1484 CA ALA A 92 -4.551 -13.783 0.322 1.00 0.00 C ATOM 1485 C ALA A 92 -4.611 -14.418 1.690 1.00 0.00 C ATOM 1486 O ALA A 92 -5.590 -15.078 2.079 1.00 0.00 O ATOM 1487 CB ALA A 92 -5.330 -12.485 0.286 1.00 0.00 C ATOM 0 H ALA A 92 -5.851 -14.395 -1.165 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.490 -13.590 0.167 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.024 -11.854 1.120 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.131 -11.967 -0.652 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.396 -12.698 0.364 1.00 0.00 H new ATOM 1493 N LYS A 93 -3.517 -14.240 2.373 1.00 0.00 N ATOM 1494 CA LYS A 93 -3.330 -14.577 3.750 1.00 0.00 C ATOM 1495 C LYS A 93 -2.633 -13.362 4.307 1.00 0.00 C ATOM 1496 O LYS A 93 -2.094 -12.578 3.543 1.00 0.00 O ATOM 1497 CB LYS A 93 -2.368 -15.745 3.918 1.00 0.00 C ATOM 1498 CG LYS A 93 -2.393 -16.379 5.308 1.00 0.00 C ATOM 1499 CD LYS A 93 -1.177 -17.264 5.566 1.00 0.00 C ATOM 1500 CE LYS A 93 0.123 -16.452 5.637 1.00 0.00 C ATOM 1501 NZ LYS A 93 1.294 -17.287 5.979 1.00 0.00 N ATOM 0 H LYS A 93 -2.682 -13.830 1.955 1.00 0.00 H new ATOM 0 HA LYS A 93 -4.274 -14.846 4.223 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.608 -16.508 3.178 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.356 -15.401 3.705 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.433 -15.593 6.062 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -3.301 -16.973 5.417 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.316 -17.807 6.501 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.096 -18.008 4.774 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.296 -15.965 4.677 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.014 -15.662 6.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.123 -16.677 6.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.096 -17.824 6.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 1.489 -17.948 5.200 1.00 0.00 H new ATOM 1515 N LEU A 94 -2.587 -13.210 5.571 1.00 0.00 N ATOM 1516 CA LEU A 94 -1.926 -12.066 6.116 1.00 0.00 C ATOM 1517 C LEU A 94 -0.609 -12.477 6.669 1.00 0.00 C ATOM 1518 O LEU A 94 -0.491 -13.516 7.312 1.00 0.00 O ATOM 1519 CB LEU A 94 -2.767 -11.275 7.135 1.00 0.00 C ATOM 1520 CG LEU A 94 -2.942 -11.869 8.550 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -3.664 -10.882 9.432 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -3.698 -13.198 8.531 1.00 0.00 C ATOM 0 H LEU A 94 -2.992 -13.850 6.254 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.773 -11.361 5.299 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.320 -10.287 7.241 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.760 -11.131 6.708 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.946 -12.066 8.948 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.785 -11.306 10.429 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.085 -9.961 9.497 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.645 -10.665 9.008 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.796 -13.576 9.549 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.689 -13.047 8.103 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.149 -13.920 7.927 1.00 0.00 H new ATOM 1534 N GLU A 95 0.365 -11.718 6.351 1.00 0.00 N ATOM 1535 CA GLU A 95 1.670 -11.924 6.683 1.00 0.00 C ATOM 1536 C GLU A 95 2.174 -10.569 6.935 1.00 0.00 C ATOM 1537 O GLU A 95 1.528 -9.566 6.574 1.00 0.00 O ATOM 1538 CB GLU A 95 2.383 -12.594 5.513 1.00 0.00 C ATOM 1539 CG GLU A 95 3.670 -13.341 5.862 1.00 0.00 C ATOM 1540 CD GLU A 95 3.416 -14.617 6.636 1.00 0.00 C ATOM 1541 OE1 GLU A 95 3.154 -14.554 7.842 1.00 0.00 O ATOM 1542 OE2 GLU A 95 3.467 -15.721 6.023 1.00 0.00 O ATOM 0 H GLU A 95 0.230 -10.868 5.803 1.00 0.00 H new ATOM 0 HA GLU A 95 1.821 -12.576 7.544 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.693 -13.296 5.044 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.617 -11.832 4.769 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.207 -13.579 4.944 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.316 -12.688 6.449 1.00 0.00 H new ATOM 1549 N GLN A 96 3.232 -10.516 7.545 1.00 0.00 N ATOM 1550 CA GLN A 96 3.830 -9.347 7.836 1.00 0.00 C ATOM 1551 C GLN A 96 4.888 -9.256 6.800 1.00 0.00 C ATOM 1552 O GLN A 96 5.760 -10.098 6.693 1.00 0.00 O ATOM 1553 CB GLN A 96 4.429 -9.283 9.256 1.00 0.00 C ATOM 1554 CG GLN A 96 3.439 -9.359 10.427 1.00 0.00 C ATOM 1555 CD GLN A 96 2.729 -10.691 10.555 1.00 0.00 C ATOM 1556 OE1 GLN A 96 3.265 -11.735 10.198 1.00 0.00 O ATOM 1557 NE2 GLN A 96 1.529 -10.662 11.063 1.00 0.00 N ATOM 0 H GLN A 96 3.737 -11.338 7.876 1.00 0.00 H new ATOM 0 HA GLN A 96 3.121 -8.519 7.830 1.00 0.00 H new ATOM 0 HB2 GLN A 96 5.143 -10.100 9.361 1.00 0.00 H new ATOM 0 HB3 GLN A 96 4.992 -8.354 9.346 1.00 0.00 H new ATOM 0 HG2 GLN A 96 3.974 -9.155 11.354 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.694 -8.573 10.309 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.117 -9.773 11.348 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.002 -11.528 11.175 1.00 0.00 H new ATOM 1566 N LEU A 97 4.748 -8.340 6.019 1.00 0.00 N ATOM 1567 CA LEU A 97 5.544 -8.177 4.906 1.00 0.00 C ATOM 1568 C LEU A 97 6.239 -6.856 4.906 1.00 0.00 C ATOM 1569 O LEU A 97 5.696 -5.857 5.346 1.00 0.00 O ATOM 1570 CB LEU A 97 4.615 -8.296 3.776 1.00 0.00 C ATOM 1571 CG LEU A 97 3.950 -9.656 3.684 1.00 0.00 C ATOM 1572 CD1 LEU A 97 2.483 -9.501 3.439 1.00 0.00 C ATOM 1573 CD2 LEU A 97 4.603 -10.514 2.618 1.00 0.00 C ATOM 0 H LEU A 97 4.033 -7.620 6.123 1.00 0.00 H new ATOM 0 HA LEU A 97 6.345 -8.915 4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 97 3.846 -7.529 3.865 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.155 -8.100 2.849 1.00 0.00 H new ATOM 0 HG LEU A 97 4.082 -10.169 4.636 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.019 -10.485 3.375 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.034 -8.941 4.259 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.325 -8.964 2.504 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.105 -11.483 2.575 1.00 0.00 H new ATOM 0 HD22 LEU A 97 4.518 -10.019 1.650 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.656 -10.658 2.861 1.00 0.00 H new ATOM 1585 N ALA A 98 7.419 -6.856 4.402 1.00 0.00 N ATOM 1586 CA ALA A 98 8.222 -5.684 4.368 1.00 0.00 C ATOM 1587 C ALA A 98 8.550 -5.343 2.951 1.00 0.00 C ATOM 1588 O ALA A 98 8.389 -6.171 2.056 1.00 0.00 O ATOM 1589 CB ALA A 98 9.502 -5.873 5.187 1.00 0.00 C ATOM 0 H ALA A 98 7.862 -7.680 3.995 1.00 0.00 H new ATOM 0 HA ALA A 98 7.662 -4.862 4.813 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.099 -4.962 5.145 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.242 -6.089 6.223 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.077 -6.703 4.777 1.00 0.00 H new ATOM 1595 N ALA A 99 8.953 -4.140 2.737 1.00 0.00 N ATOM 1596 CA ALA A 99 9.407 -3.720 1.448 1.00 0.00 C ATOM 1597 C ALA A 99 10.441 -2.653 1.632 1.00 0.00 C ATOM 1598 O ALA A 99 10.285 -1.743 2.495 1.00 0.00 O ATOM 1599 CB ALA A 99 8.259 -3.218 0.584 1.00 0.00 C ATOM 0 H ALA A 99 8.979 -3.412 3.451 1.00 0.00 H new ATOM 0 HA ALA A 99 9.841 -4.573 0.927 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.644 -2.908 -0.388 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.530 -4.017 0.448 1.00 0.00 H new ATOM 0 HB3 ALA A 99 7.780 -2.369 1.072 1.00 0.00 H new ATOM 1605 N LYS A 100 11.485 -2.724 0.874 1.00 0.00 N ATOM 1606 CA LYS A 100 12.490 -1.809 0.955 1.00 0.00 C ATOM 1607 C LYS A 100 12.841 -1.368 -0.368 1.00 0.00 C ATOM 1608 O LYS A 100 12.702 -2.079 -1.361 1.00 0.00 O ATOM 1609 CB LYS A 100 13.738 -2.257 1.673 1.00 0.00 C ATOM 1610 CG LYS A 100 14.634 -3.259 0.964 1.00 0.00 C ATOM 1611 CD LYS A 100 16.012 -3.339 1.636 1.00 0.00 C ATOM 1612 CE LYS A 100 16.718 -1.974 1.622 1.00 0.00 C ATOM 1613 NZ LYS A 100 18.062 -2.019 2.204 1.00 0.00 N ATOM 0 H LYS A 100 11.633 -3.452 0.175 1.00 0.00 H new ATOM 0 HA LYS A 100 12.084 -1.003 1.567 1.00 0.00 H new ATOM 0 HB2 LYS A 100 14.334 -1.372 1.896 1.00 0.00 H new ATOM 0 HB3 LYS A 100 13.440 -2.689 2.628 1.00 0.00 H new ATOM 0 HG2 LYS A 100 14.164 -4.242 0.973 1.00 0.00 H new ATOM 0 HG3 LYS A 100 14.751 -2.971 -0.081 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.898 -3.682 2.664 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.629 -4.075 1.121 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.785 -1.616 0.595 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.114 -1.253 2.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.273 -1.109 2.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 18.109 -2.781 2.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 18.759 -2.199 1.454 1.00 0.00 H new ATOM 1627 N PHE A 101 13.188 -0.213 -0.377 1.00 0.00 N ATOM 1628 CA PHE A 101 13.671 0.425 -1.546 1.00 0.00 C ATOM 1629 C PHE A 101 15.183 0.466 -1.523 1.00 0.00 C ATOM 1630 O PHE A 101 15.791 0.208 -0.485 1.00 0.00 O ATOM 1631 CB PHE A 101 13.049 1.787 -1.703 1.00 0.00 C ATOM 1632 CG PHE A 101 11.616 1.726 -2.148 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.589 1.637 -1.230 1.00 0.00 C ATOM 1634 CD2 PHE A 101 11.303 1.752 -3.500 1.00 0.00 C ATOM 1635 CE1 PHE A 101 9.280 1.575 -1.648 1.00 0.00 C ATOM 1636 CE2 PHE A 101 9.994 1.693 -3.923 1.00 0.00 C ATOM 1637 CZ PHE A 101 8.980 1.604 -2.997 1.00 0.00 C ATOM 0 H PHE A 101 13.162 0.390 0.445 1.00 0.00 H new ATOM 0 HA PHE A 101 13.378 -0.150 -2.425 1.00 0.00 H new ATOM 0 HB2 PHE A 101 13.107 2.319 -0.754 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.625 2.363 -2.427 1.00 0.00 H new ATOM 0 HD1 PHE A 101 10.815 1.616 -0.174 1.00 0.00 H new ATOM 0 HD2 PHE A 101 12.096 1.819 -4.230 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.485 1.504 -0.921 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.764 1.716 -4.978 1.00 0.00 H new ATOM 0 HZ PHE A 101 7.952 1.557 -3.324 1.00 0.00 H new ATOM 1647 N LYS A 102 15.762 0.764 -2.667 1.00 0.00 N ATOM 1648 CA LYS A 102 17.213 0.757 -2.883 1.00 0.00 C ATOM 1649 C LYS A 102 17.967 1.654 -1.907 1.00 0.00 C ATOM 1650 O LYS A 102 18.969 1.252 -1.329 1.00 0.00 O ATOM 1651 CB LYS A 102 17.508 1.182 -4.323 1.00 0.00 C ATOM 1652 CG LYS A 102 16.864 0.271 -5.359 1.00 0.00 C ATOM 1653 CD LYS A 102 15.927 1.024 -6.307 1.00 0.00 C ATOM 1654 CE LYS A 102 16.667 2.043 -7.191 1.00 0.00 C ATOM 1655 NZ LYS A 102 15.776 2.636 -8.224 1.00 0.00 N ATOM 0 H LYS A 102 15.233 1.026 -3.499 1.00 0.00 H new ATOM 0 HA LYS A 102 17.565 -0.259 -2.703 1.00 0.00 H new ATOM 0 HB2 LYS A 102 17.154 2.202 -4.474 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.587 1.193 -4.478 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.644 -0.220 -5.940 1.00 0.00 H new ATOM 0 HG3 LYS A 102 16.305 -0.514 -4.849 1.00 0.00 H new ATOM 0 HD2 LYS A 102 15.408 0.307 -6.943 1.00 0.00 H new ATOM 0 HD3 LYS A 102 15.166 1.541 -5.723 1.00 0.00 H new ATOM 0 HE2 LYS A 102 17.075 2.837 -6.565 1.00 0.00 H new ATOM 0 HE3 LYS A 102 17.511 1.555 -7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 16.267 3.422 -8.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 15.529 1.911 -8.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.909 2.990 -7.772 1.00 0.00 H new ATOM 1669 N THR A 103 17.477 2.841 -1.725 1.00 0.00 N ATOM 1670 CA THR A 103 18.113 3.821 -0.890 1.00 0.00 C ATOM 1671 C THR A 103 17.081 4.359 0.072 1.00 0.00 C ATOM 1672 O THR A 103 15.878 4.224 -0.206 1.00 0.00 O ATOM 1673 CB THR A 103 18.595 4.994 -1.775 1.00 0.00 C ATOM 1674 OG1 THR A 103 17.476 5.484 -2.541 1.00 0.00 O ATOM 1675 CG2 THR A 103 19.681 4.548 -2.729 1.00 0.00 C ATOM 0 H THR A 103 16.611 3.164 -2.157 1.00 0.00 H new ATOM 0 HA THR A 103 18.953 3.375 -0.357 1.00 0.00 H new ATOM 0 HB THR A 103 18.999 5.774 -1.130 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.795 6.117 -3.218 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.000 5.394 -3.338 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.531 4.169 -2.161 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.296 3.760 -3.376 1.00 0.00 H new ATOM 1683 N PRO A 104 17.485 4.985 1.217 1.00 0.00 N ATOM 1684 CA PRO A 104 16.548 5.673 2.093 1.00 0.00 C ATOM 1685 C PRO A 104 15.854 6.826 1.408 1.00 0.00 C ATOM 1686 O PRO A 104 15.086 7.433 1.955 1.00 0.00 O ATOM 1687 CB PRO A 104 17.368 6.224 3.241 1.00 0.00 C ATOM 1688 CG PRO A 104 18.672 5.503 3.192 1.00 0.00 C ATOM 1689 CD PRO A 104 18.850 4.987 1.774 1.00 0.00 C ATOM 0 HA PRO A 104 15.774 4.974 2.410 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.512 7.300 3.138 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.866 6.060 4.194 1.00 0.00 H new ATOM 0 HG2 PRO A 104 19.490 6.170 3.464 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.682 4.679 3.905 1.00 0.00 H new ATOM 0 HD2 PRO A 104 19.515 5.629 1.197 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.285 3.988 1.765 1.00 0.00 H new ATOM 1697 N GLU A 105 16.210 7.132 0.239 1.00 0.00 N ATOM 1698 CA GLU A 105 15.524 8.133 -0.533 1.00 0.00 C ATOM 1699 C GLU A 105 14.185 7.565 -0.900 1.00 0.00 C ATOM 1700 O GLU A 105 13.143 8.084 -0.538 1.00 0.00 O ATOM 1701 CB GLU A 105 16.304 8.500 -1.790 1.00 0.00 C ATOM 1702 CG GLU A 105 15.626 9.559 -2.649 1.00 0.00 C ATOM 1703 CD GLU A 105 16.352 9.811 -3.938 1.00 0.00 C ATOM 1704 OE1 GLU A 105 17.432 10.435 -3.912 1.00 0.00 O ATOM 1705 OE2 GLU A 105 15.862 9.406 -5.011 1.00 0.00 O ATOM 0 H GLU A 105 16.999 6.701 -0.243 1.00 0.00 H new ATOM 0 HA GLU A 105 15.419 9.047 0.051 1.00 0.00 H new ATOM 0 HB2 GLU A 105 17.292 8.858 -1.501 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.453 7.601 -2.389 1.00 0.00 H new ATOM 0 HG2 GLU A 105 14.605 9.245 -2.867 1.00 0.00 H new ATOM 0 HG3 GLU A 105 15.560 10.490 -2.086 1.00 0.00 H new ATOM 1712 N LEU A 106 14.253 6.407 -1.520 1.00 0.00 N ATOM 1713 CA LEU A 106 13.104 5.731 -2.016 1.00 0.00 C ATOM 1714 C LEU A 106 12.374 5.134 -0.890 1.00 0.00 C ATOM 1715 O LEU A 106 11.167 5.146 -0.829 1.00 0.00 O ATOM 1716 CB LEU A 106 13.478 4.710 -3.085 1.00 0.00 C ATOM 1717 CG LEU A 106 13.694 5.241 -4.502 1.00 0.00 C ATOM 1718 CD1 LEU A 106 14.850 6.199 -4.571 1.00 0.00 C ATOM 1719 CD2 LEU A 106 13.905 4.099 -5.454 1.00 0.00 C ATOM 0 H LEU A 106 15.129 5.912 -1.690 1.00 0.00 H new ATOM 0 HA LEU A 106 12.443 6.445 -2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 106 14.391 4.206 -2.768 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.693 3.954 -3.122 1.00 0.00 H new ATOM 0 HG LEU A 106 12.798 5.790 -4.790 1.00 0.00 H new ATOM 0 HD11 LEU A 106 14.969 6.553 -5.595 1.00 0.00 H new ATOM 0 HD12 LEU A 106 14.659 7.048 -3.914 1.00 0.00 H new ATOM 0 HD13 LEU A 106 15.762 5.693 -4.254 1.00 0.00 H new ATOM 0 HD21 LEU A 106 14.058 4.488 -6.461 1.00 0.00 H new ATOM 0 HD22 LEU A 106 14.782 3.528 -5.149 1.00 0.00 H new ATOM 0 HD23 LEU A 106 13.029 3.451 -5.445 1.00 0.00 H new ATOM 1731 N ALA A 107 13.133 4.656 0.031 1.00 0.00 N ATOM 1732 CA ALA A 107 12.631 4.065 1.198 1.00 0.00 C ATOM 1733 C ALA A 107 12.037 5.141 2.117 1.00 0.00 C ATOM 1734 O ALA A 107 10.931 4.958 2.624 1.00 0.00 O ATOM 1735 CB ALA A 107 13.752 3.283 1.845 1.00 0.00 C ATOM 0 H ALA A 107 14.152 4.671 -0.018 1.00 0.00 H new ATOM 0 HA ALA A 107 11.818 3.374 0.977 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.387 2.812 2.758 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.105 2.515 1.156 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.573 3.957 2.088 1.00 0.00 H new ATOM 1741 N GLU A 108 12.723 6.279 2.305 1.00 0.00 N ATOM 1742 CA GLU A 108 12.167 7.302 3.252 1.00 0.00 C ATOM 1743 C GLU A 108 10.952 7.994 2.675 1.00 0.00 C ATOM 1744 O GLU A 108 9.890 8.018 3.317 1.00 0.00 O ATOM 1745 CB GLU A 108 13.233 8.323 3.715 1.00 0.00 C ATOM 1746 CG GLU A 108 12.822 9.353 4.747 1.00 0.00 C ATOM 1747 CD GLU A 108 12.872 8.840 6.147 1.00 0.00 C ATOM 1748 OE1 GLU A 108 13.983 8.674 6.679 1.00 0.00 O ATOM 1749 OE2 GLU A 108 11.823 8.638 6.761 1.00 0.00 O ATOM 0 H GLU A 108 13.606 6.521 1.856 1.00 0.00 H new ATOM 0 HA GLU A 108 11.847 6.759 4.141 1.00 0.00 H new ATOM 0 HB2 GLU A 108 14.079 7.765 4.117 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.592 8.856 2.834 1.00 0.00 H new ATOM 0 HG2 GLU A 108 13.475 10.222 4.663 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.810 9.692 4.528 1.00 0.00 H new ATOM 1756 N GLU A 109 11.081 8.472 1.459 1.00 0.00 N ATOM 1757 CA GLU A 109 10.013 9.213 0.799 1.00 0.00 C ATOM 1758 C GLU A 109 8.765 8.399 0.653 1.00 0.00 C ATOM 1759 O GLU A 109 7.668 8.877 0.965 1.00 0.00 O ATOM 1760 CB GLU A 109 10.447 9.705 -0.572 1.00 0.00 C ATOM 1761 CG GLU A 109 11.346 10.914 -0.547 1.00 0.00 C ATOM 1762 CD GLU A 109 10.627 12.116 -0.006 1.00 0.00 C ATOM 1763 OE1 GLU A 109 9.570 12.485 -0.563 1.00 0.00 O ATOM 1764 OE2 GLU A 109 11.125 12.751 0.945 1.00 0.00 O ATOM 0 H GLU A 109 11.924 8.363 0.895 1.00 0.00 H new ATOM 0 HA GLU A 109 9.797 10.067 1.440 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.963 8.895 -1.088 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.558 9.941 -1.157 1.00 0.00 H new ATOM 0 HG2 GLU A 109 12.223 10.705 0.066 1.00 0.00 H new ATOM 0 HG3 GLU A 109 11.704 11.125 -1.555 1.00 0.00 H new ATOM 1771 N PHE A 110 8.926 7.159 0.240 1.00 0.00 N ATOM 1772 CA PHE A 110 7.798 6.313 -0.015 1.00 0.00 C ATOM 1773 C PHE A 110 7.085 5.990 1.261 1.00 0.00 C ATOM 1774 O PHE A 110 5.895 6.001 1.298 1.00 0.00 O ATOM 1775 CB PHE A 110 8.235 5.032 -0.668 1.00 0.00 C ATOM 1776 CG PHE A 110 7.159 4.328 -1.438 1.00 0.00 C ATOM 1777 CD1 PHE A 110 6.941 4.642 -2.766 1.00 0.00 C ATOM 1778 CD2 PHE A 110 6.380 3.343 -0.848 1.00 0.00 C ATOM 1779 CE1 PHE A 110 5.971 3.996 -3.495 1.00 0.00 C ATOM 1780 CE2 PHE A 110 5.405 2.694 -1.571 1.00 0.00 C ATOM 1781 CZ PHE A 110 5.200 3.020 -2.898 1.00 0.00 C ATOM 0 H PHE A 110 9.833 6.722 0.076 1.00 0.00 H new ATOM 0 HA PHE A 110 7.123 6.849 -0.683 1.00 0.00 H new ATOM 0 HB2 PHE A 110 9.065 5.247 -1.341 1.00 0.00 H new ATOM 0 HB3 PHE A 110 8.614 4.358 0.100 1.00 0.00 H new ATOM 0 HD1 PHE A 110 7.541 5.406 -3.238 1.00 0.00 H new ATOM 0 HD2 PHE A 110 6.540 3.083 0.188 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.813 4.252 -4.532 1.00 0.00 H new ATOM 0 HE2 PHE A 110 4.801 1.931 -1.102 1.00 0.00 H new ATOM 0 HZ PHE A 110 4.437 2.511 -3.468 1.00 0.00 H new ATOM 1791 N LYS A 111 7.825 5.715 2.311 1.00 0.00 N ATOM 1792 CA LYS A 111 7.196 5.315 3.579 1.00 0.00 C ATOM 1793 C LYS A 111 6.431 6.427 4.273 1.00 0.00 C ATOM 1794 O LYS A 111 5.359 6.194 4.855 1.00 0.00 O ATOM 1795 CB LYS A 111 8.118 4.524 4.490 1.00 0.00 C ATOM 1796 CG LYS A 111 8.251 3.048 4.082 1.00 0.00 C ATOM 1797 CD LYS A 111 8.702 2.871 2.639 1.00 0.00 C ATOM 1798 CE LYS A 111 8.955 1.439 2.306 1.00 0.00 C ATOM 1799 NZ LYS A 111 10.015 0.895 3.152 1.00 0.00 N ATOM 0 H LYS A 111 8.844 5.755 2.329 1.00 0.00 H new ATOM 0 HA LYS A 111 6.419 4.607 3.293 1.00 0.00 H new ATOM 0 HB2 LYS A 111 9.105 4.986 4.487 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.744 4.580 5.512 1.00 0.00 H new ATOM 0 HG2 LYS A 111 8.964 2.556 4.743 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.292 2.550 4.221 1.00 0.00 H new ATOM 0 HD2 LYS A 111 7.940 3.270 1.969 1.00 0.00 H new ATOM 0 HD3 LYS A 111 9.610 3.449 2.469 1.00 0.00 H new ATOM 0 HE2 LYS A 111 8.041 0.861 2.442 1.00 0.00 H new ATOM 0 HE3 LYS A 111 9.236 1.348 1.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 10.377 0.015 2.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.788 1.586 3.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 9.635 0.696 4.099 1.00 0.00 H new ATOM 1813 N GLN A 112 6.980 7.616 4.233 1.00 0.00 N ATOM 1814 CA GLN A 112 6.295 8.811 4.736 1.00 0.00 C ATOM 1815 C GLN A 112 5.013 8.993 3.965 1.00 0.00 C ATOM 1816 O GLN A 112 3.932 9.198 4.539 1.00 0.00 O ATOM 1817 CB GLN A 112 7.125 9.995 4.421 1.00 0.00 C ATOM 1818 CG GLN A 112 8.468 10.056 5.135 1.00 0.00 C ATOM 1819 CD GLN A 112 9.323 11.245 4.716 1.00 0.00 C ATOM 1820 OE1 GLN A 112 10.095 11.772 5.507 1.00 0.00 O ATOM 1821 NE2 GLN A 112 9.207 11.668 3.481 1.00 0.00 N ATOM 0 H GLN A 112 7.910 7.797 3.855 1.00 0.00 H new ATOM 0 HA GLN A 112 6.117 8.705 5.806 1.00 0.00 H new ATOM 0 HB2 GLN A 112 7.302 10.018 3.346 1.00 0.00 H new ATOM 0 HB3 GLN A 112 6.558 10.892 4.670 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.297 10.102 6.211 1.00 0.00 H new ATOM 0 HG3 GLN A 112 9.018 9.136 4.938 1.00 0.00 H new ATOM 0 HE21 GLN A 112 8.556 11.210 2.844 1.00 0.00 H new ATOM 0 HE22 GLN A 112 9.768 12.456 3.157 1.00 0.00 H new ATOM 1830 N LYS A 113 5.160 8.897 2.643 1.00 0.00 N ATOM 1831 CA LYS A 113 4.077 9.048 1.698 1.00 0.00 C ATOM 1832 C LYS A 113 3.074 7.954 1.955 1.00 0.00 C ATOM 1833 O LYS A 113 1.894 8.153 1.831 1.00 0.00 O ATOM 1834 CB LYS A 113 4.613 8.852 0.274 1.00 0.00 C ATOM 1835 CG LYS A 113 4.094 9.839 -0.776 1.00 0.00 C ATOM 1836 CD LYS A 113 4.747 11.220 -0.640 1.00 0.00 C ATOM 1837 CE LYS A 113 6.261 11.161 -0.915 1.00 0.00 C ATOM 1838 NZ LYS A 113 6.913 12.476 -0.776 1.00 0.00 N ATOM 0 H LYS A 113 6.059 8.708 2.200 1.00 0.00 H new ATOM 0 HA LYS A 113 3.631 10.037 1.805 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.700 8.920 0.303 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.365 7.841 -0.051 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.288 9.443 -1.773 1.00 0.00 H new ATOM 0 HG3 LYS A 113 3.013 9.938 -0.677 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.277 11.915 -1.336 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.574 11.608 0.364 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.725 10.455 -0.226 1.00 0.00 H new ATOM 0 HE3 LYS A 113 6.429 10.781 -1.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.897 12.345 -0.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 6.901 12.968 -1.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 6.401 13.044 -0.071 1.00 0.00 H new ATOM 1852 N PHE A 114 3.588 6.815 2.361 1.00 0.00 N ATOM 1853 CA PHE A 114 2.777 5.586 2.537 1.00 0.00 C ATOM 1854 C PHE A 114 1.767 5.768 3.647 1.00 0.00 C ATOM 1855 O PHE A 114 0.567 5.609 3.423 1.00 0.00 O ATOM 1856 CB PHE A 114 3.688 4.363 2.856 1.00 0.00 C ATOM 1857 CG PHE A 114 2.998 2.999 2.929 1.00 0.00 C ATOM 1858 CD1 PHE A 114 2.141 2.668 3.974 1.00 0.00 C ATOM 1859 CD2 PHE A 114 3.225 2.054 1.953 1.00 0.00 C ATOM 1860 CE1 PHE A 114 1.530 1.433 4.034 1.00 0.00 C ATOM 1861 CE2 PHE A 114 2.616 0.811 2.011 1.00 0.00 C ATOM 1862 CZ PHE A 114 1.768 0.503 3.052 1.00 0.00 C ATOM 0 H PHE A 114 4.576 6.693 2.584 1.00 0.00 H new ATOM 0 HA PHE A 114 2.249 5.399 1.602 1.00 0.00 H new ATOM 0 HB2 PHE A 114 4.468 4.311 2.096 1.00 0.00 H new ATOM 0 HB3 PHE A 114 4.184 4.546 3.809 1.00 0.00 H new ATOM 0 HD1 PHE A 114 1.951 3.392 4.753 1.00 0.00 H new ATOM 0 HD2 PHE A 114 3.887 2.285 1.131 1.00 0.00 H new ATOM 0 HE1 PHE A 114 0.865 1.198 4.852 1.00 0.00 H new ATOM 0 HE2 PHE A 114 2.807 0.081 1.238 1.00 0.00 H new ATOM 0 HZ PHE A 114 1.292 -0.466 3.096 1.00 0.00 H new ATOM 1872 N GLU A 115 2.235 6.155 4.828 1.00 0.00 N ATOM 1873 CA GLU A 115 1.328 6.344 5.940 1.00 0.00 C ATOM 1874 C GLU A 115 0.429 7.539 5.687 1.00 0.00 C ATOM 1875 O GLU A 115 -0.724 7.551 6.105 1.00 0.00 O ATOM 1876 CB GLU A 115 2.048 6.479 7.281 1.00 0.00 C ATOM 1877 CG GLU A 115 2.976 7.660 7.405 1.00 0.00 C ATOM 1878 CD GLU A 115 3.398 7.858 8.822 1.00 0.00 C ATOM 1879 OE1 GLU A 115 2.625 8.431 9.606 1.00 0.00 O ATOM 1880 OE2 GLU A 115 4.506 7.446 9.183 1.00 0.00 O ATOM 0 H GLU A 115 3.217 6.339 5.033 1.00 0.00 H new ATOM 0 HA GLU A 115 0.718 5.443 6.009 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.299 6.543 8.070 1.00 0.00 H new ATOM 0 HB3 GLU A 115 2.621 5.569 7.459 1.00 0.00 H new ATOM 0 HG2 GLU A 115 3.854 7.505 6.778 1.00 0.00 H new ATOM 0 HG3 GLU A 115 2.478 8.559 7.040 1.00 0.00 H new ATOM 1887 N GLU A 116 0.958 8.538 4.969 1.00 0.00 N ATOM 1888 CA GLU A 116 0.200 9.700 4.622 1.00 0.00 C ATOM 1889 C GLU A 116 -0.967 9.279 3.765 1.00 0.00 C ATOM 1890 O GLU A 116 -2.106 9.600 4.058 1.00 0.00 O ATOM 1891 CB GLU A 116 1.036 10.719 3.867 1.00 0.00 C ATOM 1892 CG GLU A 116 0.346 12.059 3.726 1.00 0.00 C ATOM 1893 CD GLU A 116 0.293 12.801 5.042 1.00 0.00 C ATOM 1894 OE1 GLU A 116 -0.512 12.445 5.926 1.00 0.00 O ATOM 1895 OE2 GLU A 116 1.090 13.749 5.213 1.00 0.00 O ATOM 0 H GLU A 116 1.918 8.544 4.625 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.143 10.171 5.543 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.985 10.858 4.384 1.00 0.00 H new ATOM 0 HB3 GLU A 116 1.267 10.329 2.876 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.873 12.664 2.988 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -0.667 11.909 3.351 1.00 0.00 H new ATOM 1902 N CYS A 117 -0.664 8.492 2.740 1.00 0.00 N ATOM 1903 CA CYS A 117 -1.585 7.939 1.867 1.00 0.00 C ATOM 1904 C CYS A 117 -2.584 7.074 2.589 1.00 0.00 C ATOM 1905 O CYS A 117 -3.728 7.001 2.176 1.00 0.00 O ATOM 1906 CB CYS A 117 -0.866 7.204 0.808 1.00 0.00 C ATOM 1907 SG CYS A 117 -0.009 8.254 -0.384 1.00 0.00 S ATOM 0 H CYS A 117 0.297 8.233 2.518 1.00 0.00 H new ATOM 0 HA CYS A 117 -2.164 8.736 1.402 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -0.140 6.538 1.275 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -1.577 6.575 0.273 1.00 0.00 H new ATOM 0 HG CYS A 117 1.139 8.619 0.106 1.00 0.00 H new ATOM 1913 N GLN A 118 -2.152 6.409 3.668 1.00 0.00 N ATOM 1914 CA GLN A 118 -3.065 5.597 4.451 1.00 0.00 C ATOM 1915 C GLN A 118 -4.222 6.459 4.888 1.00 0.00 C ATOM 1916 O GLN A 118 -5.353 6.048 4.786 1.00 0.00 O ATOM 1917 CB GLN A 118 -2.388 5.046 5.722 1.00 0.00 C ATOM 1918 CG GLN A 118 -1.328 3.991 5.506 1.00 0.00 C ATOM 1919 CD GLN A 118 -0.620 3.594 6.806 1.00 0.00 C ATOM 1920 OE1 GLN A 118 0.552 3.237 6.811 1.00 0.00 O ATOM 1921 NE2 GLN A 118 -1.321 3.663 7.917 1.00 0.00 N ATOM 0 H GLN A 118 -1.190 6.422 4.007 1.00 0.00 H new ATOM 0 HA GLN A 118 -3.390 4.762 3.831 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -1.937 5.880 6.260 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -3.160 4.629 6.369 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.785 3.107 5.061 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -0.591 4.362 4.794 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -2.295 3.963 7.887 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -0.890 3.416 8.808 1.00 0.00 H new ATOM 1930 N ARG A 119 -3.940 7.628 5.446 1.00 0.00 N ATOM 1931 CA ARG A 119 -5.031 8.532 5.785 1.00 0.00 C ATOM 1932 C ARG A 119 -5.647 9.211 4.576 1.00 0.00 C ATOM 1933 O ARG A 119 -6.859 9.243 4.377 1.00 0.00 O ATOM 1934 CB ARG A 119 -4.664 9.584 6.854 1.00 0.00 C ATOM 1935 CG ARG A 119 -4.265 9.071 8.248 1.00 0.00 C ATOM 1936 CD ARG A 119 -2.817 8.589 8.311 1.00 0.00 C ATOM 1937 NE ARG A 119 -1.870 9.674 7.989 1.00 0.00 N ATOM 1938 CZ ARG A 119 -0.572 9.713 8.330 1.00 0.00 C ATOM 1939 NH1 ARG A 119 -0.028 8.712 9.031 1.00 0.00 N ATOM 1940 NH2 ARG A 119 0.183 10.738 7.937 1.00 0.00 N ATOM 0 H ARG A 119 -3.003 7.965 5.667 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.782 7.874 6.221 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -3.839 10.183 6.467 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -5.516 10.254 6.973 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -4.410 9.867 8.978 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -4.928 8.254 8.532 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.604 8.203 9.308 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -2.677 7.764 7.613 1.00 0.00 H new ATOM 0 HE ARG A 119 -2.235 10.466 7.459 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -0.600 7.914 9.309 1.00 0.00 H new ATOM 0 HH12 ARG A 119 0.959 8.746 9.288 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -0.226 11.488 7.380 1.00 0.00 H new ATOM 0 HH22 ARG A 119 1.170 10.772 8.193 1.00 0.00 H new ATOM 1954 N LEU A 120 -4.789 9.722 3.822 1.00 0.00 N ATOM 1955 CA LEU A 120 -5.081 10.620 2.737 1.00 0.00 C ATOM 1956 C LEU A 120 -5.644 10.072 1.465 1.00 0.00 C ATOM 1957 O LEU A 120 -6.695 10.539 1.061 1.00 0.00 O ATOM 1958 CB LEU A 120 -3.963 11.649 2.479 1.00 0.00 C ATOM 1959 CG LEU A 120 -4.034 12.966 3.271 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -3.901 12.735 4.758 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -2.979 13.944 2.783 1.00 0.00 C ATOM 0 H LEU A 120 -3.792 9.534 3.924 1.00 0.00 H new ATOM 0 HA LEU A 120 -5.950 11.129 3.153 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.007 11.173 2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.964 11.892 1.416 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.018 13.400 3.095 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -3.956 13.690 5.281 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.708 12.087 5.099 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.942 12.261 4.968 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.047 14.868 3.356 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -1.989 13.507 2.915 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.143 14.159 1.727 1.00 0.00 H new ATOM 1973 N LEU A 121 -5.065 8.978 0.928 1.00 0.00 N ATOM 1974 CA LEU A 121 -5.319 8.489 -0.488 1.00 0.00 C ATOM 1975 C LEU A 121 -6.778 8.147 -0.676 1.00 0.00 C ATOM 1976 O LEU A 121 -7.335 8.123 -1.764 1.00 0.00 O ATOM 1977 CB LEU A 121 -4.402 7.287 -0.807 1.00 0.00 C ATOM 1978 CG LEU A 121 -4.437 6.696 -2.228 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -4.090 7.745 -3.274 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -3.470 5.525 -2.326 1.00 0.00 C ATOM 0 H LEU A 121 -4.406 8.394 1.443 1.00 0.00 H new ATOM 0 HA LEU A 121 -5.079 9.287 -1.191 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.375 7.588 -0.598 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.648 6.487 -0.109 1.00 0.00 H new ATOM 0 HG LEU A 121 -5.451 6.348 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -4.124 7.295 -4.266 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -4.809 8.563 -3.222 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.088 8.130 -3.084 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.500 5.112 -3.334 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -2.459 5.868 -2.104 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.757 4.755 -1.610 1.00 0.00 H new ATOM 1992 N LEU A 122 -7.328 7.913 0.411 1.00 0.00 N ATOM 1993 CA LEU A 122 -8.702 7.594 0.643 1.00 0.00 C ATOM 1994 C LEU A 122 -9.686 8.724 0.326 1.00 0.00 C ATOM 1995 O LEU A 122 -10.733 8.499 -0.267 1.00 0.00 O ATOM 1996 CB LEU A 122 -8.736 7.496 2.099 1.00 0.00 C ATOM 1997 CG LEU A 122 -8.374 6.107 2.725 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -7.007 5.576 2.309 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -8.507 6.149 4.238 1.00 0.00 C ATOM 0 H LEU A 122 -6.796 7.934 1.281 1.00 0.00 H new ATOM 0 HA LEU A 122 -8.987 6.733 0.038 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -8.051 8.240 2.505 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -9.737 7.768 2.434 1.00 0.00 H new ATOM 0 HG LEU A 122 -9.097 5.399 2.321 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -6.831 4.611 2.784 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -6.977 5.458 1.226 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -6.234 6.279 2.619 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.251 5.174 4.653 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -7.832 6.904 4.642 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.533 6.399 4.506 1.00 0.00 H new ATOM 2011 N ASP A 123 -9.333 9.917 0.704 1.00 0.00 N ATOM 2012 CA ASP A 123 -10.267 11.042 0.677 1.00 0.00 C ATOM 2013 C ASP A 123 -9.932 11.982 -0.422 1.00 0.00 C ATOM 2014 O ASP A 123 -10.804 12.619 -1.030 1.00 0.00 O ATOM 2015 CB ASP A 123 -10.157 11.801 2.002 1.00 0.00 C ATOM 2016 CG ASP A 123 -11.170 12.915 2.143 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -12.326 12.632 2.527 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -10.823 14.089 1.920 1.00 0.00 O ATOM 0 H ASP A 123 -8.400 10.154 1.040 1.00 0.00 H new ATOM 0 HA ASP A 123 -11.274 10.655 0.523 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -10.284 11.099 2.826 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -9.154 12.219 2.091 1.00 0.00 H new ATOM 2023 N ILE A 124 -8.685 12.042 -0.682 1.00 0.00 N ATOM 2024 CA ILE A 124 -8.124 12.972 -1.573 1.00 0.00 C ATOM 2025 C ILE A 124 -8.429 12.667 -3.043 1.00 0.00 C ATOM 2026 O ILE A 124 -8.567 11.502 -3.432 1.00 0.00 O ATOM 2027 CB ILE A 124 -6.607 13.129 -1.275 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -5.833 11.772 -1.321 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -6.429 13.781 0.092 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -5.557 11.234 -2.719 1.00 0.00 C ATOM 0 H ILE A 124 -7.999 11.416 -0.260 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.603 13.936 -1.404 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.184 13.758 -2.059 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.883 11.896 -0.802 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -6.404 11.027 -0.768 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.366 13.893 0.306 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.905 14.762 0.092 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.889 13.155 0.856 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -5.016 10.290 -2.646 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -6.501 11.072 -3.239 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.956 11.954 -3.274 1.00 0.00 H new ATOM 2042 N PRO A 125 -8.630 13.710 -3.852 1.00 0.00 N ATOM 2043 CA PRO A 125 -8.814 13.566 -5.288 1.00 0.00 C ATOM 2044 C PRO A 125 -7.505 13.141 -5.956 1.00 0.00 C ATOM 2045 O PRO A 125 -6.412 13.454 -5.454 1.00 0.00 O ATOM 2046 CB PRO A 125 -9.208 14.978 -5.754 1.00 0.00 C ATOM 2047 CG PRO A 125 -9.546 15.724 -4.513 1.00 0.00 C ATOM 2048 CD PRO A 125 -8.722 15.112 -3.432 1.00 0.00 C ATOM 0 HA PRO A 125 -9.557 12.810 -5.541 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -8.389 15.458 -6.290 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -10.058 14.944 -6.436 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -9.322 16.785 -4.622 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -10.609 15.644 -4.286 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -7.739 15.578 -3.359 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -9.196 15.212 -2.456 1.00 0.00 H new ATOM 2056 N LEU A 126 -7.601 12.441 -7.061 1.00 0.00 N ATOM 2057 CA LEU A 126 -6.434 12.020 -7.779 1.00 0.00 C ATOM 2058 C LEU A 126 -5.886 13.168 -8.571 1.00 0.00 C ATOM 2059 O LEU A 126 -6.584 13.778 -9.396 1.00 0.00 O ATOM 2060 CB LEU A 126 -6.716 10.823 -8.687 1.00 0.00 C ATOM 2061 CG LEU A 126 -7.148 9.529 -7.990 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -7.348 8.433 -9.007 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -6.126 9.099 -6.940 1.00 0.00 C ATOM 0 H LEU A 126 -8.485 12.152 -7.481 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.692 11.695 -7.050 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.495 11.107 -9.395 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -5.817 10.615 -9.268 1.00 0.00 H new ATOM 0 HG LEU A 126 -8.093 9.718 -7.480 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -7.655 7.518 -8.500 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -8.120 8.731 -9.716 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -6.414 8.257 -9.540 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.460 8.178 -6.463 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.161 8.930 -7.419 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.026 9.882 -6.188 1.00 0.00 H new ATOM 2075 N GLN A 127 -4.673 13.476 -8.292 1.00 0.00 N ATOM 2076 CA GLN A 127 -3.972 14.524 -8.877 1.00 0.00 C ATOM 2077 C GLN A 127 -3.740 14.294 -10.368 1.00 0.00 C ATOM 2078 O GLN A 127 -3.144 13.300 -10.786 1.00 0.00 O ATOM 2079 CB GLN A 127 -2.656 14.768 -8.123 1.00 0.00 C ATOM 2080 CG GLN A 127 -1.654 13.596 -8.052 1.00 0.00 C ATOM 2081 CD GLN A 127 -2.074 12.472 -7.117 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -2.751 11.528 -7.520 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -1.678 12.561 -5.880 1.00 0.00 N ATOM 0 H GLN A 127 -4.122 12.962 -7.604 1.00 0.00 H new ATOM 0 HA GLN A 127 -4.581 15.425 -8.798 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -2.152 15.615 -8.589 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -2.901 15.065 -7.103 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -1.517 13.188 -9.054 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -0.686 13.979 -7.729 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -1.117 13.359 -5.580 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -1.928 11.833 -5.211 1.00 0.00 H new ATOM 2092 N THR A 128 -4.289 15.165 -11.142 1.00 0.00 N ATOM 2093 CA THR A 128 -4.107 15.186 -12.555 1.00 0.00 C ATOM 2094 C THR A 128 -3.509 16.559 -12.876 1.00 0.00 C ATOM 2095 O THR A 128 -4.037 17.578 -12.412 1.00 0.00 O ATOM 2096 CB THR A 128 -5.468 15.009 -13.246 1.00 0.00 C ATOM 2097 OG1 THR A 128 -6.144 13.888 -12.641 1.00 0.00 O ATOM 2098 CG2 THR A 128 -5.293 14.736 -14.732 1.00 0.00 C ATOM 0 H THR A 128 -4.898 15.908 -10.799 1.00 0.00 H new ATOM 0 HA THR A 128 -3.455 14.384 -12.903 1.00 0.00 H new ATOM 0 HB THR A 128 -6.047 15.925 -13.129 1.00 0.00 H new ATOM 0 HG1 THR A 128 -7.016 13.762 -13.070 1.00 0.00 H new ATOM 0 HG21 THR A 128 -6.271 14.615 -15.197 1.00 0.00 H new ATOM 0 HG22 THR A 128 -4.771 15.573 -15.197 1.00 0.00 H new ATOM 0 HG23 THR A 128 -4.711 13.825 -14.868 1.00 0.00 H new ATOM 2106 N PRO A 129 -2.378 16.623 -13.586 1.00 0.00 N ATOM 2107 CA PRO A 129 -1.699 17.884 -13.827 1.00 0.00 C ATOM 2108 C PRO A 129 -2.446 18.808 -14.788 1.00 0.00 C ATOM 2109 O PRO A 129 -2.862 18.408 -15.880 1.00 0.00 O ATOM 2110 CB PRO A 129 -0.363 17.464 -14.405 1.00 0.00 C ATOM 2111 CG PRO A 129 -0.660 16.201 -15.088 1.00 0.00 C ATOM 2112 CD PRO A 129 -1.688 15.502 -14.244 1.00 0.00 C ATOM 0 HA PRO A 129 -1.618 18.470 -12.912 1.00 0.00 H new ATOM 0 HB2 PRO A 129 0.026 18.211 -15.097 1.00 0.00 H new ATOM 0 HB3 PRO A 129 0.386 17.331 -13.625 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -1.039 16.382 -16.094 1.00 0.00 H new ATOM 0 HG3 PRO A 129 0.239 15.593 -15.191 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -2.370 14.904 -14.848 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -1.229 14.828 -13.521 1.00 0.00 H new ATOM 2120 N LYS A 130 -2.594 20.017 -14.345 1.00 0.00 N ATOM 2121 CA LYS A 130 -3.223 21.120 -15.040 1.00 0.00 C ATOM 2122 C LYS A 130 -3.375 22.211 -14.035 1.00 0.00 C ATOM 2123 O LYS A 130 -2.537 23.101 -14.000 1.00 0.00 O ATOM 2124 CB LYS A 130 -4.606 20.800 -15.637 1.00 0.00 C ATOM 2125 CG LYS A 130 -5.145 21.956 -16.481 1.00 0.00 C ATOM 2126 CD LYS A 130 -6.507 21.674 -17.079 1.00 0.00 C ATOM 2127 CE LYS A 130 -7.586 21.565 -16.020 1.00 0.00 C ATOM 2128 NZ LYS A 130 -8.917 21.346 -16.613 1.00 0.00 N ATOM 2129 OXT LYS A 130 -4.298 22.135 -13.200 1.00 0.00 O ATOM 0 H LYS A 130 -2.257 20.289 -13.421 1.00 0.00 H new ATOM 0 HA LYS A 130 -2.595 21.384 -15.891 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -4.537 19.903 -16.252 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.307 20.581 -14.832 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.205 22.851 -15.862 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.440 22.170 -17.284 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -6.766 22.468 -17.779 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -6.466 20.747 -17.650 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -7.350 20.743 -15.344 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -7.601 22.476 -15.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -9.627 21.277 -15.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -9.154 22.143 -17.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -8.911 20.464 -17.164 1.00 0.00 H new TER 2143 LYS A 130