USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 694 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 45 LYS NZ :NH3+ 171:sc= 2.42 (180deg=2.34) USER MOD Set 1.2: A 59 MET CE :methyl 157:sc= -0.223 (180deg=-0.228) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -176:sc= 1.56 (180deg=1.47) USER MOD Single : A 25 LYS NZ :NH3+ -146:sc= 1.25 (180deg=1.09) USER MOD Single : A 29 GLN : amide:sc= 0.338 X(o=0.34,f=-0.13) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -130:sc= 0.346 USER MOD Single : A 35 HIS : no HE2:sc= -0.0402 X(o=-0.04,f=-0.065) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 166:sc=-0.00702 (180deg=-0.198) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0292 USER MOD Single : A 43 HIS : no HD1:sc= 0.151 K(o=0.15,f=-1.1) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 167:sc= 2.15 (180deg=1.8) USER MOD Single : A 50 SER OG : rot 82:sc= 1.27 USER MOD Single : A 51 TYR OH : rot -140:sc= -0.173 USER MOD Single : A 52 CYS SG : rot 53:sc= -0.448! USER MOD Single : A 53 GLN :FLIP amide:sc= -0.114 F(o=-0.63,f=-0.11) USER MOD Single : A 55 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.34) USER MOD Single : A 60 ASN : amide:sc= 1.1 K(o=1.1,f=-0.18) USER MOD Single : A 61 SER OG : rot -94:sc= 1.24 USER MOD Single : A 69 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 74 ASN : amide:sc=-0.00919 X(o=-0.0092,f=-0.074) USER MOD Single : A 75 HIS : no HD1:sc= -0.751 K(o=-0.75,f=-4.9!) USER MOD Single : A 76 THR OG1 : rot -67:sc= 1.23 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 165:sc= 0.867 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= -0.0445 K(o=-0.045,f=-1.2!) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.142 USER MOD Single : B 357 ASN : amide:sc= 0 X(o=0,f=0.033) USER MOD Single : B 358 ASN : amide:sc= -0.188 X(o=-0.19,f=-0.51) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 2.665 5.061 10.315 1.00 10.00 N ATOM 2 CA TYR A 21 2.780 4.901 8.849 1.00 10.00 C ATOM 3 C TYR A 21 1.486 4.349 8.281 1.00 10.00 C ATOM 4 O TYR A 21 0.561 4.040 9.030 1.00 10.00 O ATOM 5 CB TYR A 21 3.933 3.958 8.502 1.00 10.00 C ATOM 6 CG TYR A 21 5.291 4.491 8.890 1.00 10.00 C ATOM 7 CD1 TYR A 21 5.651 5.801 8.602 1.00 10.00 C ATOM 8 CD2 TYR A 21 6.218 3.682 9.534 1.00 10.00 C ATOM 9 CE1 TYR A 21 6.890 6.292 8.955 1.00 10.00 C ATOM 10 CE2 TYR A 21 7.462 4.168 9.890 1.00 10.00 C ATOM 11 CZ TYR A 21 7.793 5.473 9.594 1.00 10.00 C ATOM 12 OH TYR A 21 9.025 5.967 9.947 1.00 10.00 O ATOM 0 HA TYR A 21 2.978 5.880 8.412 1.00 10.00 H new ATOM 0 HB2 TYR A 21 3.772 3.002 9.001 1.00 10.00 H new ATOM 0 HB3 TYR A 21 3.922 3.764 7.429 1.00 10.00 H new ATOM 0 HD1 TYR A 21 4.949 6.445 8.093 1.00 10.00 H new ATOM 0 HD2 TYR A 21 5.963 2.657 9.760 1.00 10.00 H new ATOM 0 HE1 TYR A 21 7.151 7.316 8.731 1.00 10.00 H new ATOM 0 HE2 TYR A 21 8.170 3.529 10.397 1.00 10.00 H new ATOM 0 HH TYR A 21 9.544 5.264 10.391 1.00 10.00 H new ATOM 22 N ILE A 22 1.427 4.222 6.964 1.00 10.00 N ATOM 23 CA ILE A 22 0.245 3.701 6.304 1.00 10.00 C ATOM 24 C ILE A 22 0.489 2.255 5.893 1.00 10.00 C ATOM 25 O ILE A 22 1.279 1.983 4.989 1.00 10.00 O ATOM 26 CB ILE A 22 -0.131 4.534 5.059 1.00 10.00 C ATOM 27 CG1 ILE A 22 -0.167 6.028 5.398 1.00 10.00 C ATOM 28 CG2 ILE A 22 -1.473 4.079 4.499 1.00 10.00 C ATOM 29 CD1 ILE A 22 -1.169 6.387 6.476 1.00 10.00 C ATOM 0 H ILE A 22 2.187 4.474 6.332 1.00 10.00 H new ATOM 0 HA ILE A 22 -0.585 3.759 7.008 1.00 10.00 H new ATOM 0 HB ILE A 22 0.632 4.376 4.297 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.826 6.342 5.719 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.402 6.590 4.494 1.00 10.00 H new ATOM 0 HG21 ILE A 22 -1.723 4.676 3.622 1.00 10.00 H new ATOM 0 HG22 ILE A 22 -1.412 3.028 4.217 1.00 10.00 H new ATOM 0 HG23 ILE A 22 -2.246 4.207 5.257 1.00 10.00 H new ATOM 0 HD11 ILE A 22 -1.136 7.461 6.661 1.00 10.00 H new ATOM 0 HD12 ILE A 22 -2.170 6.105 6.150 1.00 10.00 H new ATOM 0 HD13 ILE A 22 -0.923 5.853 7.394 1.00 10.00 H new ATOM 41 N LYS A 23 -0.170 1.332 6.573 1.00 10.00 N ATOM 42 CA LYS A 23 -0.009 -0.082 6.284 1.00 10.00 C ATOM 43 C LYS A 23 -1.081 -0.556 5.307 1.00 10.00 C ATOM 44 O LYS A 23 -2.210 -0.873 5.699 1.00 10.00 O ATOM 45 CB LYS A 23 -0.066 -0.885 7.583 1.00 10.00 C ATOM 46 CG LYS A 23 0.183 -2.373 7.405 1.00 10.00 C ATOM 47 CD LYS A 23 -0.260 -3.150 8.634 1.00 10.00 C ATOM 48 CE LYS A 23 -1.701 -3.629 8.510 1.00 10.00 C ATOM 49 NZ LYS A 23 -2.622 -2.562 8.028 1.00 10.00 N ATOM 0 H LYS A 23 -0.822 1.537 7.330 1.00 10.00 H new ATOM 0 HA LYS A 23 0.963 -0.239 5.817 1.00 10.00 H new ATOM 0 HB2 LYS A 23 0.673 -0.485 8.277 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -1.045 -0.744 8.042 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -0.356 -2.733 6.529 1.00 10.00 H new ATOM 0 HG3 LYS A 23 1.243 -2.549 7.222 1.00 10.00 H new ATOM 0 HD2 LYS A 23 0.397 -4.008 8.779 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -0.161 -2.520 9.518 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -1.741 -4.475 7.824 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -2.045 -3.989 9.480 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.598 -2.921 8.026 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.557 -1.737 8.658 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -2.354 -2.282 7.063 1.00 10.00 H new ATOM 63 N LEU A 24 -0.723 -0.588 4.035 1.00 10.00 N ATOM 64 CA LEU A 24 -1.643 -1.011 2.988 1.00 10.00 C ATOM 65 C LEU A 24 -1.683 -2.531 2.891 1.00 10.00 C ATOM 66 O LEU A 24 -0.695 -3.205 3.188 1.00 10.00 O ATOM 67 CB LEU A 24 -1.222 -0.419 1.639 1.00 10.00 C ATOM 68 CG LEU A 24 -1.112 1.107 1.595 1.00 10.00 C ATOM 69 CD1 LEU A 24 -0.424 1.556 0.312 1.00 10.00 C ATOM 70 CD2 LEU A 24 -2.487 1.749 1.712 1.00 10.00 C ATOM 0 H LEU A 24 0.203 -0.325 3.699 1.00 10.00 H new ATOM 0 HA LEU A 24 -2.639 -0.648 3.243 1.00 10.00 H new ATOM 0 HB2 LEU A 24 -0.257 -0.844 1.361 1.00 10.00 H new ATOM 0 HB3 LEU A 24 -1.940 -0.736 0.883 1.00 10.00 H new ATOM 0 HG LEU A 24 -0.509 1.430 2.443 1.00 10.00 H new ATOM 0 HD11 LEU A 24 -0.355 2.644 0.298 1.00 10.00 H new ATOM 0 HD12 LEU A 24 0.577 1.128 0.267 1.00 10.00 H new ATOM 0 HD13 LEU A 24 -1.002 1.218 -0.548 1.00 10.00 H new ATOM 0 HD21 LEU A 24 -2.386 2.834 1.679 1.00 10.00 H new ATOM 0 HD22 LEU A 24 -3.115 1.417 0.885 1.00 10.00 H new ATOM 0 HD23 LEU A 24 -2.946 1.456 2.656 1.00 10.00 H new ATOM 82 N LYS A 25 -2.829 -3.063 2.486 1.00 10.00 N ATOM 83 CA LYS A 25 -2.991 -4.498 2.340 1.00 10.00 C ATOM 84 C LYS A 25 -2.996 -4.879 0.867 1.00 10.00 C ATOM 85 O LYS A 25 -3.950 -4.587 0.139 1.00 10.00 O ATOM 86 CB LYS A 25 -4.284 -4.976 3.007 1.00 10.00 C ATOM 87 CG LYS A 25 -4.187 -5.107 4.517 1.00 10.00 C ATOM 88 CD LYS A 25 -5.346 -5.916 5.083 1.00 10.00 C ATOM 89 CE LYS A 25 -5.157 -7.407 4.845 1.00 10.00 C ATOM 90 NZ LYS A 25 -6.307 -8.203 5.350 1.00 10.00 N ATOM 0 H LYS A 25 -3.660 -2.519 2.253 1.00 10.00 H new ATOM 0 HA LYS A 25 -2.150 -4.985 2.834 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -5.086 -4.279 2.764 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -4.563 -5.942 2.586 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -3.244 -5.586 4.782 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -4.179 -4.115 4.969 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -5.435 -5.726 6.153 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -6.278 -5.589 4.623 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -5.030 -7.590 3.778 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -4.243 -7.739 5.336 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -5.966 -9.118 5.707 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -6.776 -7.685 6.120 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -6.984 -8.363 4.577 1.00 10.00 H new ATOM 104 N VAL A 26 -1.919 -5.505 0.424 1.00 10.00 N ATOM 105 CA VAL A 26 -1.807 -5.934 -0.958 1.00 10.00 C ATOM 106 C VAL A 26 -2.375 -7.336 -1.098 1.00 10.00 C ATOM 107 O VAL A 26 -1.930 -8.265 -0.419 1.00 10.00 O ATOM 108 CB VAL A 26 -0.346 -5.928 -1.455 1.00 10.00 C ATOM 109 CG1 VAL A 26 -0.298 -5.920 -2.974 1.00 10.00 C ATOM 110 CG2 VAL A 26 0.424 -4.745 -0.885 1.00 10.00 C ATOM 0 H VAL A 26 -1.109 -5.727 1.003 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.369 -5.227 -1.568 1.00 10.00 H new ATOM 0 HB VAL A 26 0.134 -6.840 -1.100 1.00 10.00 H new ATOM 0 HG11 VAL A 26 0.740 -5.916 -3.305 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -0.798 -6.809 -3.359 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -0.802 -5.029 -3.349 1.00 10.00 H new ATOM 0 HG21 VAL A 26 1.450 -4.767 -1.253 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.053 -3.816 -1.197 1.00 10.00 H new ATOM 0 HG23 VAL A 26 0.427 -4.803 0.203 1.00 10.00 H new ATOM 120 N ILE A 27 -3.368 -7.479 -1.956 1.00 10.00 N ATOM 121 CA ILE A 27 -4.006 -8.765 -2.169 1.00 10.00 C ATOM 122 C ILE A 27 -3.265 -9.570 -3.225 1.00 10.00 C ATOM 123 O ILE A 27 -3.264 -9.217 -4.406 1.00 10.00 O ATOM 124 CB ILE A 27 -5.478 -8.601 -2.596 1.00 10.00 C ATOM 125 CG1 ILE A 27 -6.231 -7.717 -1.594 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.154 -9.962 -2.725 1.00 10.00 C ATOM 127 CD1 ILE A 27 -6.249 -8.266 -0.180 1.00 10.00 C ATOM 0 H ILE A 27 -3.751 -6.719 -2.518 1.00 10.00 H new ATOM 0 HA ILE A 27 -3.974 -9.298 -1.219 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.502 -8.114 -3.571 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -5.774 -6.727 -1.583 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -7.258 -7.590 -1.937 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -7.192 -9.825 -3.027 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -5.633 -10.557 -3.475 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.120 -10.477 -1.765 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -6.800 -7.584 0.468 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -6.733 -9.242 -0.175 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -5.227 -8.366 0.184 1.00 10.00 H new ATOM 139 N GLY A 28 -2.622 -10.641 -2.785 1.00 10.00 N ATOM 140 CA GLY A 28 -1.895 -11.496 -3.696 1.00 10.00 C ATOM 141 C GLY A 28 -2.822 -12.443 -4.430 1.00 10.00 C ATOM 142 O GLY A 28 -3.934 -12.710 -3.968 1.00 10.00 O ATOM 0 H GLY A 28 -2.592 -10.933 -1.808 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -1.354 -10.884 -4.417 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -1.151 -12.070 -3.143 1.00 10.00 H new ATOM 146 N GLN A 29 -2.365 -12.971 -5.557 1.00 10.00 N ATOM 147 CA GLN A 29 -3.175 -13.884 -6.357 1.00 10.00 C ATOM 148 C GLN A 29 -3.508 -15.160 -5.586 1.00 10.00 C ATOM 149 O GLN A 29 -4.580 -15.735 -5.761 1.00 10.00 O ATOM 150 CB GLN A 29 -2.454 -14.230 -7.661 1.00 10.00 C ATOM 151 CG GLN A 29 -3.288 -15.075 -8.615 1.00 10.00 C ATOM 152 CD GLN A 29 -4.595 -14.407 -9.005 1.00 10.00 C ATOM 153 OE1 GLN A 29 -4.662 -13.670 -9.989 1.00 10.00 O ATOM 154 NE2 GLN A 29 -5.646 -14.662 -8.240 1.00 10.00 N ATOM 0 H GLN A 29 -1.438 -12.784 -5.939 1.00 10.00 H new ATOM 0 HA GLN A 29 -4.112 -13.379 -6.589 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -2.167 -13.306 -8.164 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -1.533 -14.764 -7.426 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -2.707 -15.279 -9.515 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -3.502 -16.037 -8.149 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -5.552 -15.278 -7.433 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -6.550 -14.242 -8.458 1.00 10.00 H new ATOM 163 N ASP A 30 -2.601 -15.585 -4.718 1.00 10.00 N ATOM 164 CA ASP A 30 -2.810 -16.797 -3.934 1.00 10.00 C ATOM 165 C ASP A 30 -3.471 -16.484 -2.591 1.00 10.00 C ATOM 166 O ASP A 30 -3.294 -17.214 -1.613 1.00 10.00 O ATOM 167 CB ASP A 30 -1.478 -17.530 -3.726 1.00 10.00 C ATOM 168 CG ASP A 30 -0.530 -16.805 -2.787 1.00 10.00 C ATOM 169 OD1 ASP A 30 -0.073 -15.691 -3.130 1.00 10.00 O ATOM 170 OD2 ASP A 30 -0.222 -17.355 -1.709 1.00 10.00 O ATOM 0 H ASP A 30 -1.716 -15.111 -4.538 1.00 10.00 H new ATOM 0 HA ASP A 30 -3.485 -17.448 -4.489 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -1.678 -18.526 -3.331 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -0.990 -17.662 -4.692 1.00 10.00 H new ATOM 175 N SER A 31 -4.240 -15.395 -2.563 1.00 10.00 N ATOM 176 CA SER A 31 -4.955 -14.960 -1.362 1.00 10.00 C ATOM 177 C SER A 31 -3.983 -14.612 -0.237 1.00 10.00 C ATOM 178 O SER A 31 -4.236 -14.895 0.933 1.00 10.00 O ATOM 179 CB SER A 31 -5.945 -16.039 -0.906 1.00 10.00 C ATOM 180 OG SER A 31 -6.773 -16.456 -1.982 1.00 10.00 O ATOM 0 H SER A 31 -4.385 -14.790 -3.371 1.00 10.00 H new ATOM 0 HA SER A 31 -5.514 -14.058 -1.611 1.00 10.00 H new ATOM 0 HB2 SER A 31 -5.399 -16.895 -0.510 1.00 10.00 H new ATOM 0 HB3 SER A 31 -6.563 -15.652 -0.096 1.00 10.00 H new ATOM 0 HG SER A 31 -7.395 -17.145 -1.668 1.00 10.00 H new ATOM 186 N SER A 32 -2.867 -14.004 -0.606 1.00 10.00 N ATOM 187 CA SER A 32 -1.863 -13.600 0.359 1.00 10.00 C ATOM 188 C SER A 32 -2.094 -12.152 0.773 1.00 10.00 C ATOM 189 O SER A 32 -2.495 -11.327 -0.050 1.00 10.00 O ATOM 190 CB SER A 32 -0.474 -13.762 -0.248 1.00 10.00 C ATOM 191 OG SER A 32 -0.523 -13.626 -1.661 1.00 10.00 O ATOM 0 H SER A 32 -2.635 -13.779 -1.574 1.00 10.00 H new ATOM 0 HA SER A 32 -1.938 -14.232 1.244 1.00 10.00 H new ATOM 0 HB2 SER A 32 0.200 -13.015 0.171 1.00 10.00 H new ATOM 0 HB3 SER A 32 -0.069 -14.740 0.014 1.00 10.00 H new ATOM 0 HG SER A 32 -0.062 -14.384 -2.079 1.00 10.00 H new ATOM 197 N GLU A 33 -1.850 -11.841 2.036 1.00 10.00 N ATOM 198 CA GLU A 33 -2.051 -10.491 2.526 1.00 10.00 C ATOM 199 C GLU A 33 -0.715 -9.819 2.812 1.00 10.00 C ATOM 200 O GLU A 33 -0.112 -10.024 3.867 1.00 10.00 O ATOM 201 CB GLU A 33 -2.930 -10.504 3.778 1.00 10.00 C ATOM 202 CG GLU A 33 -4.249 -11.230 3.573 1.00 10.00 C ATOM 203 CD GLU A 33 -4.919 -11.606 4.874 1.00 10.00 C ATOM 204 OE1 GLU A 33 -5.585 -10.734 5.474 1.00 10.00 O ATOM 205 OE2 GLU A 33 -4.793 -12.773 5.296 1.00 10.00 O ATOM 0 H GLU A 33 -1.514 -12.503 2.736 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.561 -9.915 1.754 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.384 -10.979 4.593 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -3.131 -9.477 4.084 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -4.921 -10.597 2.993 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -4.075 -12.131 2.986 1.00 10.00 H new ATOM 212 N ILE A 34 -0.247 -9.029 1.859 1.00 10.00 N ATOM 213 CA ILE A 34 1.022 -8.334 2.012 1.00 10.00 C ATOM 214 C ILE A 34 0.802 -7.002 2.716 1.00 10.00 C ATOM 215 O ILE A 34 -0.036 -6.203 2.300 1.00 10.00 O ATOM 216 CB ILE A 34 1.716 -8.081 0.656 1.00 10.00 C ATOM 217 CG1 ILE A 34 1.405 -9.205 -0.344 1.00 10.00 C ATOM 218 CG2 ILE A 34 3.215 -7.943 0.852 1.00 10.00 C ATOM 219 CD1 ILE A 34 1.943 -10.562 0.055 1.00 10.00 C ATOM 0 H ILE A 34 -0.724 -8.853 0.975 1.00 10.00 H new ATOM 0 HA ILE A 34 1.671 -8.976 2.608 1.00 10.00 H new ATOM 0 HB ILE A 34 1.328 -7.150 0.244 1.00 10.00 H new ATOM 0 HG12 ILE A 34 0.324 -9.278 -0.466 1.00 10.00 H new ATOM 0 HG13 ILE A 34 1.818 -8.935 -1.316 1.00 10.00 H new ATOM 0 HG21 ILE A 34 3.693 -7.765 -0.111 1.00 10.00 H new ATOM 0 HG22 ILE A 34 3.419 -7.105 1.519 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.611 -8.860 1.289 1.00 10.00 H new ATOM 0 HD11 ILE A 34 1.679 -11.296 -0.706 1.00 10.00 H new ATOM 0 HD12 ILE A 34 3.028 -10.510 0.148 1.00 10.00 H new ATOM 0 HD13 ILE A 34 1.511 -10.858 1.011 1.00 10.00 H new ATOM 231 N HIS A 35 1.546 -6.775 3.782 1.00 10.00 N ATOM 232 CA HIS A 35 1.429 -5.549 4.553 1.00 10.00 C ATOM 233 C HIS A 35 2.588 -4.618 4.230 1.00 10.00 C ATOM 234 O HIS A 35 3.711 -4.815 4.701 1.00 10.00 O ATOM 235 CB HIS A 35 1.414 -5.849 6.057 1.00 10.00 C ATOM 236 CG HIS A 35 0.228 -6.645 6.519 1.00 10.00 C ATOM 237 ND1 HIS A 35 0.120 -7.073 7.819 1.00 10.00 N ATOM 238 CD2 HIS A 35 -0.856 -7.067 5.823 1.00 10.00 C ATOM 239 CE1 HIS A 35 -1.015 -7.744 7.886 1.00 10.00 C ATOM 240 NE2 HIS A 35 -1.643 -7.770 6.702 1.00 10.00 N ATOM 0 H HIS A 35 2.244 -7.429 4.137 1.00 10.00 H new ATOM 0 HA HIS A 35 0.489 -5.067 4.285 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.323 -6.391 6.316 1.00 10.00 H new ATOM 0 HB3 HIS A 35 1.439 -4.906 6.603 1.00 10.00 H new ATOM 0 HD1 HIS A 35 0.781 -6.907 8.578 1.00 10.00 H new ATOM 0 HD2 HIS A 35 -1.061 -6.885 4.778 1.00 10.00 H new ATOM 0 HE1 HIS A 35 -1.391 -8.214 8.783 1.00 10.00 H new ATOM 248 N PHE A 36 2.323 -3.609 3.421 1.00 10.00 N ATOM 249 CA PHE A 36 3.356 -2.662 3.047 1.00 10.00 C ATOM 250 C PHE A 36 3.255 -1.418 3.913 1.00 10.00 C ATOM 251 O PHE A 36 2.249 -0.706 3.881 1.00 10.00 O ATOM 252 CB PHE A 36 3.251 -2.293 1.565 1.00 10.00 C ATOM 253 CG PHE A 36 4.590 -2.133 0.895 1.00 10.00 C ATOM 254 CD1 PHE A 36 5.639 -1.500 1.548 1.00 10.00 C ATOM 255 CD2 PHE A 36 4.802 -2.622 -0.385 1.00 10.00 C ATOM 256 CE1 PHE A 36 6.868 -1.356 0.936 1.00 10.00 C ATOM 257 CE2 PHE A 36 6.031 -2.479 -1.000 1.00 10.00 C ATOM 258 CZ PHE A 36 7.065 -1.848 -0.338 1.00 10.00 C ATOM 0 H PHE A 36 1.407 -3.425 3.012 1.00 10.00 H new ATOM 0 HA PHE A 36 4.328 -3.129 3.208 1.00 10.00 H new ATOM 0 HB2 PHE A 36 2.682 -3.064 1.045 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.690 -1.363 1.468 1.00 10.00 H new ATOM 0 HD1 PHE A 36 5.492 -1.116 2.547 1.00 10.00 H new ATOM 0 HD2 PHE A 36 3.998 -3.120 -0.907 1.00 10.00 H new ATOM 0 HE1 PHE A 36 7.675 -0.859 1.454 1.00 10.00 H new ATOM 0 HE2 PHE A 36 6.183 -2.861 -1.999 1.00 10.00 H new ATOM 0 HZ PHE A 36 8.027 -1.740 -0.817 1.00 10.00 H new ATOM 268 N LYS A 37 4.292 -1.178 4.697 1.00 10.00 N ATOM 269 CA LYS A 37 4.337 -0.024 5.576 1.00 10.00 C ATOM 270 C LYS A 37 4.905 1.171 4.822 1.00 10.00 C ATOM 271 O LYS A 37 6.124 1.335 4.731 1.00 10.00 O ATOM 272 CB LYS A 37 5.187 -0.336 6.813 1.00 10.00 C ATOM 273 CG LYS A 37 4.474 -0.052 8.127 1.00 10.00 C ATOM 274 CD LYS A 37 5.404 -0.215 9.320 1.00 10.00 C ATOM 275 CE LYS A 37 5.952 -1.632 9.429 1.00 10.00 C ATOM 276 NZ LYS A 37 6.705 -1.841 10.695 1.00 10.00 N ATOM 0 H LYS A 37 5.120 -1.772 4.742 1.00 10.00 H new ATOM 0 HA LYS A 37 3.327 0.217 5.907 1.00 10.00 H new ATOM 0 HB2 LYS A 37 5.480 -1.386 6.787 1.00 10.00 H new ATOM 0 HB3 LYS A 37 6.104 0.252 6.772 1.00 10.00 H new ATOM 0 HG2 LYS A 37 4.075 0.962 8.113 1.00 10.00 H new ATOM 0 HG3 LYS A 37 3.625 -0.727 8.233 1.00 10.00 H new ATOM 0 HD2 LYS A 37 6.232 0.488 9.232 1.00 10.00 H new ATOM 0 HD3 LYS A 37 4.867 0.037 10.235 1.00 10.00 H new ATOM 0 HE2 LYS A 37 5.129 -2.344 9.375 1.00 10.00 H new ATOM 0 HE3 LYS A 37 6.606 -1.835 8.580 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 7.061 -2.818 10.730 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 7.506 -1.179 10.736 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 6.075 -1.673 11.505 1.00 10.00 H new ATOM 290 N VAL A 38 4.018 1.995 4.276 1.00 10.00 N ATOM 291 CA VAL A 38 4.430 3.158 3.504 1.00 10.00 C ATOM 292 C VAL A 38 4.328 4.442 4.327 1.00 10.00 C ATOM 293 O VAL A 38 3.678 4.475 5.375 1.00 10.00 O ATOM 294 CB VAL A 38 3.598 3.305 2.204 1.00 10.00 C ATOM 295 CG1 VAL A 38 3.458 1.960 1.508 1.00 10.00 C ATOM 296 CG2 VAL A 38 2.226 3.898 2.482 1.00 10.00 C ATOM 0 H VAL A 38 3.008 1.878 4.355 1.00 10.00 H new ATOM 0 HA VAL A 38 5.474 2.998 3.233 1.00 10.00 H new ATOM 0 HB VAL A 38 4.132 3.992 1.547 1.00 10.00 H new ATOM 0 HG11 VAL A 38 2.871 2.081 0.597 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.446 1.577 1.255 1.00 10.00 H new ATOM 0 HG13 VAL A 38 2.956 1.257 2.173 1.00 10.00 H new ATOM 0 HG21 VAL A 38 1.672 3.986 1.548 1.00 10.00 H new ATOM 0 HG22 VAL A 38 1.681 3.249 3.167 1.00 10.00 H new ATOM 0 HG23 VAL A 38 2.340 4.885 2.931 1.00 10.00 H new ATOM 306 N LYS A 39 4.977 5.492 3.848 1.00 10.00 N ATOM 307 CA LYS A 39 4.973 6.780 4.527 1.00 10.00 C ATOM 308 C LYS A 39 4.238 7.814 3.675 1.00 10.00 C ATOM 309 O LYS A 39 4.350 7.807 2.447 1.00 10.00 O ATOM 310 CB LYS A 39 6.412 7.229 4.795 1.00 10.00 C ATOM 311 CG LYS A 39 6.533 8.341 5.825 1.00 10.00 C ATOM 312 CD LYS A 39 7.986 8.719 6.057 1.00 10.00 C ATOM 313 CE LYS A 39 8.114 10.002 6.863 1.00 10.00 C ATOM 314 NZ LYS A 39 9.499 10.540 6.826 1.00 10.00 N ATOM 0 H LYS A 39 5.518 5.477 2.984 1.00 10.00 H new ATOM 0 HA LYS A 39 4.454 6.684 5.481 1.00 10.00 H new ATOM 0 HB2 LYS A 39 6.992 6.370 5.133 1.00 10.00 H new ATOM 0 HB3 LYS A 39 6.857 7.566 3.859 1.00 10.00 H new ATOM 0 HG2 LYS A 39 5.977 9.215 5.487 1.00 10.00 H new ATOM 0 HG3 LYS A 39 6.083 8.020 6.765 1.00 10.00 H new ATOM 0 HD2 LYS A 39 8.493 7.909 6.581 1.00 10.00 H new ATOM 0 HD3 LYS A 39 8.488 8.841 5.097 1.00 10.00 H new ATOM 0 HE2 LYS A 39 7.423 10.748 6.471 1.00 10.00 H new ATOM 0 HE3 LYS A 39 7.825 9.812 7.897 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 9.547 11.415 7.387 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 10.155 9.838 7.224 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 9.766 10.745 5.842 1.00 10.00 H new ATOM 328 N MET A 40 3.490 8.697 4.324 1.00 10.00 N ATOM 329 CA MET A 40 2.723 9.722 3.618 1.00 10.00 C ATOM 330 C MET A 40 3.601 10.906 3.215 1.00 10.00 C ATOM 331 O MET A 40 3.578 11.960 3.854 1.00 10.00 O ATOM 332 CB MET A 40 1.546 10.196 4.480 1.00 10.00 C ATOM 333 CG MET A 40 0.651 11.220 3.795 1.00 10.00 C ATOM 334 SD MET A 40 -0.029 10.633 2.230 1.00 10.00 S ATOM 335 CE MET A 40 -1.113 9.323 2.796 1.00 10.00 C ATOM 0 H MET A 40 3.396 8.726 5.339 1.00 10.00 H new ATOM 0 HA MET A 40 2.334 9.274 2.703 1.00 10.00 H new ATOM 0 HB2 MET A 40 0.944 9.332 4.761 1.00 10.00 H new ATOM 0 HB3 MET A 40 1.935 10.627 5.402 1.00 10.00 H new ATOM 0 HG2 MET A 40 -0.168 11.483 4.464 1.00 10.00 H new ATOM 0 HG3 MET A 40 1.222 12.131 3.617 1.00 10.00 H new ATOM 0 HE1 MET A 40 -1.785 9.032 1.988 1.00 10.00 H new ATOM 0 HE2 MET A 40 -0.516 8.463 3.100 1.00 10.00 H new ATOM 0 HE3 MET A 40 -1.698 9.676 3.645 1.00 10.00 H new ATOM 345 N THR A 41 4.386 10.706 2.160 1.00 10.00 N ATOM 346 CA THR A 41 5.273 11.737 1.622 1.00 10.00 C ATOM 347 C THR A 41 6.148 11.145 0.516 1.00 10.00 C ATOM 348 O THR A 41 6.446 11.806 -0.482 1.00 10.00 O ATOM 349 CB THR A 41 6.164 12.394 2.714 1.00 10.00 C ATOM 350 OG1 THR A 41 7.017 13.387 2.125 1.00 10.00 O ATOM 351 CG2 THR A 41 7.011 11.362 3.446 1.00 10.00 C ATOM 0 H THR A 41 4.426 9.823 1.652 1.00 10.00 H new ATOM 0 HA THR A 41 4.639 12.524 1.214 1.00 10.00 H new ATOM 0 HB THR A 41 5.500 12.864 3.440 1.00 10.00 H new ATOM 0 HG1 THR A 41 7.573 13.796 2.821 1.00 10.00 H new ATOM 0 HG21 THR A 41 7.620 11.860 4.201 1.00 10.00 H new ATOM 0 HG22 THR A 41 6.360 10.633 3.928 1.00 10.00 H new ATOM 0 HG23 THR A 41 7.661 10.853 2.734 1.00 10.00 H new ATOM 359 N THR A 42 6.537 9.889 0.690 1.00 10.00 N ATOM 360 CA THR A 42 7.356 9.198 -0.285 1.00 10.00 C ATOM 361 C THR A 42 6.520 8.826 -1.503 1.00 10.00 C ATOM 362 O THR A 42 5.403 8.322 -1.367 1.00 10.00 O ATOM 363 CB THR A 42 7.961 7.930 0.333 1.00 10.00 C ATOM 364 OG1 THR A 42 8.041 8.098 1.751 1.00 10.00 O ATOM 365 CG2 THR A 42 9.345 7.646 -0.233 1.00 10.00 C ATOM 0 H THR A 42 6.294 9.328 1.506 1.00 10.00 H new ATOM 0 HA THR A 42 8.163 9.863 -0.594 1.00 10.00 H new ATOM 0 HB THR A 42 7.321 7.082 0.090 1.00 10.00 H new ATOM 0 HG1 THR A 42 8.425 7.292 2.155 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.747 6.742 0.224 1.00 10.00 H new ATOM 0 HG22 THR A 42 9.275 7.507 -1.312 1.00 10.00 H new ATOM 0 HG23 THR A 42 10.006 8.486 -0.018 1.00 10.00 H new ATOM 373 N HIS A 43 7.044 9.109 -2.685 1.00 10.00 N ATOM 374 CA HIS A 43 6.341 8.795 -3.922 1.00 10.00 C ATOM 375 C HIS A 43 6.192 7.286 -4.069 1.00 10.00 C ATOM 376 O HIS A 43 6.981 6.519 -3.514 1.00 10.00 O ATOM 377 CB HIS A 43 7.091 9.364 -5.130 1.00 10.00 C ATOM 378 CG HIS A 43 7.526 10.789 -4.960 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.723 11.107 -4.367 1.00 10.00 N ATOM 380 CD2 HIS A 43 6.887 11.928 -5.306 1.00 10.00 C ATOM 381 CE1 HIS A 43 8.785 12.427 -4.364 1.00 10.00 C ATOM 382 NE2 HIS A 43 7.694 12.969 -4.924 1.00 10.00 N ATOM 0 H HIS A 43 7.952 9.555 -2.816 1.00 10.00 H new ATOM 0 HA HIS A 43 5.352 9.251 -3.881 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.969 8.747 -5.324 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.451 9.292 -6.009 1.00 10.00 H new ATOM 0 HD2 HIS A 43 5.925 12.004 -5.791 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.610 12.997 -3.962 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.501 13.964 -5.043 1.00 10.00 H new ATOM 390 N LEU A 44 5.193 6.860 -4.833 1.00 10.00 N ATOM 391 CA LEU A 44 4.953 5.440 -5.040 1.00 10.00 C ATOM 392 C LEU A 44 5.991 4.851 -5.989 1.00 10.00 C ATOM 393 O LEU A 44 5.976 3.653 -6.273 1.00 10.00 O ATOM 394 CB LEU A 44 3.534 5.207 -5.562 1.00 10.00 C ATOM 395 CG LEU A 44 2.432 5.412 -4.517 1.00 10.00 C ATOM 396 CD1 LEU A 44 1.079 5.580 -5.185 1.00 10.00 C ATOM 397 CD2 LEU A 44 2.399 4.247 -3.537 1.00 10.00 C ATOM 0 H LEU A 44 4.540 7.476 -5.317 1.00 10.00 H new ATOM 0 HA LEU A 44 5.049 4.930 -4.082 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.353 5.881 -6.400 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.465 4.191 -5.950 1.00 10.00 H new ATOM 0 HG LEU A 44 2.656 6.324 -3.964 1.00 10.00 H new ATOM 0 HD11 LEU A 44 0.313 5.724 -4.423 1.00 10.00 H new ATOM 0 HD12 LEU A 44 1.104 6.448 -5.844 1.00 10.00 H new ATOM 0 HD13 LEU A 44 0.848 4.689 -5.768 1.00 10.00 H new ATOM 0 HD21 LEU A 44 1.610 4.411 -2.803 1.00 10.00 H new ATOM 0 HD22 LEU A 44 2.204 3.321 -4.079 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.359 4.173 -3.027 1.00 10.00 H new ATOM 409 N LYS A 45 6.896 5.704 -6.466 1.00 10.00 N ATOM 410 CA LYS A 45 7.972 5.283 -7.350 1.00 10.00 C ATOM 411 C LYS A 45 8.819 4.238 -6.641 1.00 10.00 C ATOM 412 O LYS A 45 8.961 3.109 -7.115 1.00 10.00 O ATOM 413 CB LYS A 45 8.843 6.485 -7.732 1.00 10.00 C ATOM 414 CG LYS A 45 10.085 6.119 -8.533 1.00 10.00 C ATOM 415 CD LYS A 45 9.840 6.229 -10.028 1.00 10.00 C ATOM 416 CE LYS A 45 10.974 5.608 -10.830 1.00 10.00 C ATOM 417 NZ LYS A 45 10.895 4.125 -10.844 1.00 10.00 N ATOM 0 H LYS A 45 6.901 6.701 -6.250 1.00 10.00 H new ATOM 0 HA LYS A 45 7.547 4.857 -8.259 1.00 10.00 H new ATOM 0 HB2 LYS A 45 8.243 7.186 -8.312 1.00 10.00 H new ATOM 0 HB3 LYS A 45 9.149 7.003 -6.823 1.00 10.00 H new ATOM 0 HG2 LYS A 45 10.908 6.775 -8.250 1.00 10.00 H new ATOM 0 HG3 LYS A 45 10.390 5.102 -8.288 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.902 5.735 -10.281 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.731 7.278 -10.303 1.00 10.00 H new ATOM 0 HE2 LYS A 45 10.943 5.983 -11.853 1.00 10.00 H new ATOM 0 HE3 LYS A 45 11.930 5.917 -10.406 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.589 3.747 -11.520 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 11.102 3.757 -9.893 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 9.939 3.831 -11.128 1.00 10.00 H new ATOM 431 N LYS A 46 9.346 4.623 -5.480 1.00 10.00 N ATOM 432 CA LYS A 46 10.174 3.744 -4.667 1.00 10.00 C ATOM 433 C LYS A 46 9.399 2.489 -4.279 1.00 10.00 C ATOM 434 O LYS A 46 9.953 1.395 -4.223 1.00 10.00 O ATOM 435 CB LYS A 46 10.637 4.490 -3.407 1.00 10.00 C ATOM 436 CG LYS A 46 11.497 3.660 -2.463 1.00 10.00 C ATOM 437 CD LYS A 46 12.975 3.788 -2.779 1.00 10.00 C ATOM 438 CE LYS A 46 13.529 5.150 -2.386 1.00 10.00 C ATOM 439 NZ LYS A 46 13.771 5.261 -0.921 1.00 10.00 N ATOM 0 H LYS A 46 9.210 5.551 -5.080 1.00 10.00 H new ATOM 0 HA LYS A 46 11.046 3.444 -5.248 1.00 10.00 H new ATOM 0 HB2 LYS A 46 11.200 5.373 -3.709 1.00 10.00 H new ATOM 0 HB3 LYS A 46 9.759 4.841 -2.865 1.00 10.00 H new ATOM 0 HG2 LYS A 46 11.317 3.977 -1.436 1.00 10.00 H new ATOM 0 HG3 LYS A 46 11.201 2.613 -2.530 1.00 10.00 H new ATOM 0 HD2 LYS A 46 13.526 3.008 -2.254 1.00 10.00 H new ATOM 0 HD3 LYS A 46 13.132 3.627 -3.846 1.00 10.00 H new ATOM 0 HE2 LYS A 46 14.462 5.328 -2.921 1.00 10.00 H new ATOM 0 HE3 LYS A 46 12.831 5.927 -2.696 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 14.148 6.205 -0.702 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 12.877 5.118 -0.410 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 14.458 4.538 -0.627 1.00 10.00 H new ATOM 453 N LEU A 47 8.104 2.653 -4.047 1.00 10.00 N ATOM 454 CA LEU A 47 7.244 1.546 -3.651 1.00 10.00 C ATOM 455 C LEU A 47 7.134 0.493 -4.755 1.00 10.00 C ATOM 456 O LEU A 47 7.305 -0.701 -4.502 1.00 10.00 O ATOM 457 CB LEU A 47 5.847 2.069 -3.281 1.00 10.00 C ATOM 458 CG LEU A 47 5.693 2.612 -1.852 1.00 10.00 C ATOM 459 CD1 LEU A 47 6.074 1.554 -0.837 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.527 3.871 -1.649 1.00 10.00 C ATOM 0 H LEU A 47 7.623 3.549 -4.127 1.00 10.00 H new ATOM 0 HA LEU A 47 7.695 1.070 -2.781 1.00 10.00 H new ATOM 0 HB2 LEU A 47 5.579 2.860 -3.981 1.00 10.00 H new ATOM 0 HB3 LEU A 47 5.128 1.262 -3.422 1.00 10.00 H new ATOM 0 HG LEU A 47 4.646 2.875 -1.704 1.00 10.00 H new ATOM 0 HD11 LEU A 47 5.959 1.957 0.169 1.00 10.00 H new ATOM 0 HD12 LEU A 47 5.427 0.685 -0.957 1.00 10.00 H new ATOM 0 HD13 LEU A 47 7.111 1.258 -0.992 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.398 4.232 -0.629 1.00 10.00 H new ATOM 0 HD22 LEU A 47 7.579 3.643 -1.823 1.00 10.00 H new ATOM 0 HD23 LEU A 47 6.202 4.640 -2.350 1.00 10.00 H new ATOM 472 N LYS A 48 6.871 0.942 -5.979 1.00 10.00 N ATOM 473 CA LYS A 48 6.721 0.040 -7.120 1.00 10.00 C ATOM 474 C LYS A 48 7.972 -0.810 -7.345 1.00 10.00 C ATOM 475 O LYS A 48 7.881 -2.031 -7.486 1.00 10.00 O ATOM 476 CB LYS A 48 6.395 0.830 -8.394 1.00 10.00 C ATOM 477 CG LYS A 48 4.984 1.400 -8.419 1.00 10.00 C ATOM 478 CD LYS A 48 4.725 2.204 -9.685 1.00 10.00 C ATOM 479 CE LYS A 48 4.502 1.304 -10.894 1.00 10.00 C ATOM 480 NZ LYS A 48 4.200 2.088 -12.124 1.00 10.00 N ATOM 0 H LYS A 48 6.757 1.929 -6.208 1.00 10.00 H new ATOM 0 HA LYS A 48 5.894 -0.632 -6.890 1.00 10.00 H new ATOM 0 HB2 LYS A 48 7.109 1.647 -8.496 1.00 10.00 H new ATOM 0 HB3 LYS A 48 6.529 0.179 -9.258 1.00 10.00 H new ATOM 0 HG2 LYS A 48 4.262 0.587 -8.350 1.00 10.00 H new ATOM 0 HG3 LYS A 48 4.833 2.036 -7.547 1.00 10.00 H new ATOM 0 HD2 LYS A 48 3.851 2.839 -9.539 1.00 10.00 H new ATOM 0 HD3 LYS A 48 5.571 2.864 -9.875 1.00 10.00 H new ATOM 0 HE2 LYS A 48 5.390 0.695 -11.061 1.00 10.00 H new ATOM 0 HE3 LYS A 48 3.679 0.619 -10.689 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 4.272 1.469 -12.957 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 3.236 2.474 -12.062 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 4.880 2.869 -12.213 1.00 10.00 H new ATOM 494 N GLU A 49 9.132 -0.169 -7.355 1.00 10.00 N ATOM 495 CA GLU A 49 10.391 -0.879 -7.583 1.00 10.00 C ATOM 496 C GLU A 49 10.772 -1.767 -6.396 1.00 10.00 C ATOM 497 O GLU A 49 11.385 -2.820 -6.574 1.00 10.00 O ATOM 498 CB GLU A 49 11.521 0.107 -7.904 1.00 10.00 C ATOM 499 CG GLU A 49 11.494 1.376 -7.074 1.00 10.00 C ATOM 500 CD GLU A 49 12.399 2.454 -7.627 1.00 10.00 C ATOM 501 OE1 GLU A 49 13.463 2.701 -7.026 1.00 10.00 O ATOM 502 OE2 GLU A 49 12.051 3.061 -8.665 1.00 10.00 O ATOM 0 H GLU A 49 9.232 0.836 -7.209 1.00 10.00 H new ATOM 0 HA GLU A 49 10.242 -1.532 -8.443 1.00 10.00 H new ATOM 0 HB2 GLU A 49 12.478 -0.393 -7.752 1.00 10.00 H new ATOM 0 HB3 GLU A 49 11.465 0.375 -8.959 1.00 10.00 H new ATOM 0 HG2 GLU A 49 10.472 1.753 -7.028 1.00 10.00 H new ATOM 0 HG3 GLU A 49 11.795 1.144 -6.052 1.00 10.00 H new ATOM 509 N SER A 50 10.398 -1.359 -5.190 1.00 10.00 N ATOM 510 CA SER A 50 10.718 -2.141 -4.001 1.00 10.00 C ATOM 511 C SER A 50 9.876 -3.411 -3.940 1.00 10.00 C ATOM 512 O SER A 50 10.362 -4.463 -3.528 1.00 10.00 O ATOM 513 CB SER A 50 10.520 -1.307 -2.739 1.00 10.00 C ATOM 514 OG SER A 50 11.377 -0.179 -2.750 1.00 10.00 O ATOM 0 H SER A 50 9.878 -0.500 -5.009 1.00 10.00 H new ATOM 0 HA SER A 50 11.767 -2.432 -4.062 1.00 10.00 H new ATOM 0 HB2 SER A 50 9.482 -0.982 -2.670 1.00 10.00 H new ATOM 0 HB3 SER A 50 10.722 -1.916 -1.858 1.00 10.00 H new ATOM 0 HG SER A 50 10.972 0.534 -3.286 1.00 10.00 H new ATOM 520 N TYR A 51 8.620 -3.323 -4.363 1.00 10.00 N ATOM 521 CA TYR A 51 7.744 -4.488 -4.353 1.00 10.00 C ATOM 522 C TYR A 51 8.263 -5.542 -5.325 1.00 10.00 C ATOM 523 O TYR A 51 8.224 -6.741 -5.038 1.00 10.00 O ATOM 524 CB TYR A 51 6.313 -4.101 -4.716 1.00 10.00 C ATOM 525 CG TYR A 51 5.296 -5.180 -4.396 1.00 10.00 C ATOM 526 CD1 TYR A 51 4.752 -5.294 -3.122 1.00 10.00 C ATOM 527 CD2 TYR A 51 4.891 -6.095 -5.363 1.00 10.00 C ATOM 528 CE1 TYR A 51 3.831 -6.278 -2.823 1.00 10.00 C ATOM 529 CE2 TYR A 51 3.968 -7.082 -5.070 1.00 10.00 C ATOM 530 CZ TYR A 51 3.446 -7.172 -3.798 1.00 10.00 C ATOM 531 OH TYR A 51 2.532 -8.155 -3.502 1.00 10.00 O ATOM 0 H TYR A 51 8.189 -2.467 -4.713 1.00 10.00 H new ATOM 0 HA TYR A 51 7.740 -4.901 -3.344 1.00 10.00 H new ATOM 0 HB2 TYR A 51 6.045 -3.190 -4.182 1.00 10.00 H new ATOM 0 HB3 TYR A 51 6.266 -3.872 -5.781 1.00 10.00 H new ATOM 0 HD1 TYR A 51 5.055 -4.600 -2.352 1.00 10.00 H new ATOM 0 HD2 TYR A 51 5.304 -6.033 -6.359 1.00 10.00 H new ATOM 0 HE1 TYR A 51 3.414 -6.347 -1.829 1.00 10.00 H new ATOM 0 HE2 TYR A 51 3.658 -7.779 -5.834 1.00 10.00 H new ATOM 0 HH TYR A 51 2.798 -8.991 -3.939 1.00 10.00 H new ATOM 541 N CYS A 52 8.754 -5.087 -6.475 1.00 10.00 N ATOM 542 CA CYS A 52 9.304 -5.989 -7.477 1.00 10.00 C ATOM 543 C CYS A 52 10.509 -6.718 -6.889 1.00 10.00 C ATOM 544 O CYS A 52 10.735 -7.898 -7.155 1.00 10.00 O ATOM 545 CB CYS A 52 9.713 -5.216 -8.733 1.00 10.00 C ATOM 546 SG CYS A 52 8.387 -4.213 -9.450 1.00 10.00 S ATOM 0 H CYS A 52 8.781 -4.101 -6.734 1.00 10.00 H new ATOM 0 HA CYS A 52 8.542 -6.715 -7.761 1.00 10.00 H new ATOM 0 HB2 CYS A 52 10.554 -4.566 -8.489 1.00 10.00 H new ATOM 0 HB3 CYS A 52 10.065 -5.924 -9.484 1.00 10.00 H new ATOM 0 HG CYS A 52 7.885 -3.438 -8.534 1.00 10.00 H new ATOM 552 N GLN A 53 11.264 -5.999 -6.062 1.00 10.00 N ATOM 553 CA GLN A 53 12.438 -6.559 -5.407 1.00 10.00 C ATOM 554 C GLN A 53 12.026 -7.635 -4.411 1.00 10.00 C ATOM 555 O GLN A 53 12.686 -8.665 -4.291 1.00 10.00 O ATOM 556 CB GLN A 53 13.228 -5.463 -4.691 1.00 10.00 C ATOM 557 CG GLN A 53 14.086 -4.624 -5.621 1.00 10.00 C ATOM 558 CD GLN A 53 14.713 -3.439 -4.915 1.00 10.00 C ATOM 559 OE1 GLN A 53 14.046 -2.298 -4.966 1.00 10.00 O flip ATOM 560 NE2 GLN A 53 15.789 -3.546 -4.335 1.00 10.00 N flip ATOM 0 H GLN A 53 11.080 -5.023 -5.830 1.00 10.00 H new ATOM 0 HA GLN A 53 13.074 -7.007 -6.171 1.00 10.00 H new ATOM 0 HB2 GLN A 53 12.532 -4.810 -4.165 1.00 10.00 H new ATOM 0 HB3 GLN A 53 13.867 -5.922 -3.936 1.00 10.00 H new ATOM 0 HG2 GLN A 53 14.872 -5.247 -6.047 1.00 10.00 H new ATOM 0 HG3 GLN A 53 13.476 -4.268 -6.451 1.00 10.00 H new ATOM 0 HE21 GLN A 53 16.272 -4.444 -4.318 1.00 10.00 H new ATOM 0 HE22 GLN A 53 16.200 -2.737 -3.869 1.00 10.00 H new ATOM 569 N ARG A 54 10.924 -7.382 -3.711 1.00 10.00 N ATOM 570 CA ARG A 54 10.396 -8.320 -2.726 1.00 10.00 C ATOM 571 C ARG A 54 9.978 -9.625 -3.397 1.00 10.00 C ATOM 572 O ARG A 54 10.225 -10.712 -2.875 1.00 10.00 O ATOM 573 CB ARG A 54 9.194 -7.701 -2.008 1.00 10.00 C ATOM 574 CG ARG A 54 8.677 -8.529 -0.841 1.00 10.00 C ATOM 575 CD ARG A 54 9.660 -8.520 0.314 1.00 10.00 C ATOM 576 NE ARG A 54 9.034 -8.885 1.585 1.00 10.00 N ATOM 577 CZ ARG A 54 9.415 -8.401 2.766 1.00 10.00 C ATOM 578 NH1 ARG A 54 10.421 -7.535 2.841 1.00 10.00 N ATOM 579 NH2 ARG A 54 8.798 -8.787 3.873 1.00 10.00 N ATOM 0 H ARG A 54 10.376 -6.528 -3.809 1.00 10.00 H new ATOM 0 HA ARG A 54 11.180 -8.536 -2.000 1.00 10.00 H new ATOM 0 HB2 ARG A 54 9.471 -6.712 -1.644 1.00 10.00 H new ATOM 0 HB3 ARG A 54 8.387 -7.561 -2.727 1.00 10.00 H new ATOM 0 HG2 ARG A 54 7.717 -8.134 -0.508 1.00 10.00 H new ATOM 0 HG3 ARG A 54 8.504 -9.555 -1.167 1.00 10.00 H new ATOM 0 HD2 ARG A 54 10.473 -9.214 0.100 1.00 10.00 H new ATOM 0 HD3 ARG A 54 10.103 -7.528 0.402 1.00 10.00 H new ATOM 0 HE ARG A 54 8.260 -9.549 1.566 1.00 10.00 H new ATOM 0 HH11 ARG A 54 10.904 -7.239 1.992 1.00 10.00 H new ATOM 0 HH12 ARG A 54 10.710 -7.166 3.747 1.00 10.00 H new ATOM 0 HH21 ARG A 54 8.030 -9.456 3.822 1.00 10.00 H new ATOM 0 HH22 ARG A 54 9.091 -8.415 4.776 1.00 10.00 H new ATOM 593 N GLN A 55 9.351 -9.502 -4.560 1.00 10.00 N ATOM 594 CA GLN A 55 8.890 -10.665 -5.309 1.00 10.00 C ATOM 595 C GLN A 55 10.050 -11.330 -6.047 1.00 10.00 C ATOM 596 O GLN A 55 9.944 -12.474 -6.486 1.00 10.00 O ATOM 597 CB GLN A 55 7.799 -10.257 -6.299 1.00 10.00 C ATOM 598 CG GLN A 55 6.496 -9.841 -5.630 1.00 10.00 C ATOM 599 CD GLN A 55 5.910 -10.937 -4.764 1.00 10.00 C ATOM 600 OE1 GLN A 55 6.168 -11.003 -3.562 1.00 10.00 O ATOM 601 NE2 GLN A 55 5.119 -11.809 -5.369 1.00 10.00 N ATOM 0 H GLN A 55 9.150 -8.607 -5.006 1.00 10.00 H new ATOM 0 HA GLN A 55 8.476 -11.385 -4.603 1.00 10.00 H new ATOM 0 HB2 GLN A 55 8.164 -9.431 -6.910 1.00 10.00 H new ATOM 0 HB3 GLN A 55 7.602 -11.090 -6.974 1.00 10.00 H new ATOM 0 HG2 GLN A 55 6.672 -8.956 -5.019 1.00 10.00 H new ATOM 0 HG3 GLN A 55 5.772 -9.562 -6.395 1.00 10.00 H new ATOM 0 HE21 GLN A 55 4.930 -11.719 -6.367 1.00 10.00 H new ATOM 0 HE22 GLN A 55 4.698 -12.571 -4.837 1.00 10.00 H new ATOM 610 N GLY A 56 11.154 -10.608 -6.182 1.00 10.00 N ATOM 611 CA GLY A 56 12.317 -11.146 -6.861 1.00 10.00 C ATOM 612 C GLY A 56 12.181 -11.095 -8.369 1.00 10.00 C ATOM 613 O GLY A 56 12.704 -11.956 -9.079 1.00 10.00 O ATOM 0 H GLY A 56 11.265 -9.656 -5.832 1.00 10.00 H new ATOM 0 HA2 GLY A 56 13.202 -10.585 -6.560 1.00 10.00 H new ATOM 0 HA3 GLY A 56 12.472 -12.178 -6.548 1.00 10.00 H new ATOM 617 N VAL A 57 11.476 -10.086 -8.858 1.00 10.00 N ATOM 618 CA VAL A 57 11.264 -9.918 -10.288 1.00 10.00 C ATOM 619 C VAL A 57 11.642 -8.505 -10.726 1.00 10.00 C ATOM 620 O VAL A 57 11.703 -7.594 -9.898 1.00 10.00 O ATOM 621 CB VAL A 57 9.791 -10.187 -10.678 1.00 10.00 C ATOM 622 CG1 VAL A 57 9.451 -11.660 -10.521 1.00 10.00 C ATOM 623 CG2 VAL A 57 8.845 -9.334 -9.851 1.00 10.00 C ATOM 0 H VAL A 57 11.039 -9.367 -8.282 1.00 10.00 H new ATOM 0 HA VAL A 57 11.901 -10.643 -10.794 1.00 10.00 H new ATOM 0 HB VAL A 57 9.668 -9.915 -11.726 1.00 10.00 H new ATOM 0 HG11 VAL A 57 8.411 -11.825 -10.801 1.00 10.00 H new ATOM 0 HG12 VAL A 57 10.099 -12.254 -11.166 1.00 10.00 H new ATOM 0 HG13 VAL A 57 9.599 -11.959 -9.483 1.00 10.00 H new ATOM 0 HG21 VAL A 57 7.816 -9.542 -10.145 1.00 10.00 H new ATOM 0 HG22 VAL A 57 8.975 -9.567 -8.794 1.00 10.00 H new ATOM 0 HG23 VAL A 57 9.064 -8.280 -10.020 1.00 10.00 H new ATOM 633 N PRO A 58 11.938 -8.312 -12.023 1.00 10.00 N ATOM 634 CA PRO A 58 12.285 -6.991 -12.562 1.00 10.00 C ATOM 635 C PRO A 58 11.106 -6.027 -12.469 1.00 10.00 C ATOM 636 O PRO A 58 9.958 -6.452 -12.326 1.00 10.00 O ATOM 637 CB PRO A 58 12.632 -7.278 -14.028 1.00 10.00 C ATOM 638 CG PRO A 58 11.962 -8.571 -14.339 1.00 10.00 C ATOM 639 CD PRO A 58 11.981 -9.359 -13.060 1.00 10.00 C ATOM 0 HA PRO A 58 13.099 -6.518 -12.013 1.00 10.00 H new ATOM 0 HB2 PRO A 58 12.275 -6.482 -14.681 1.00 10.00 H new ATOM 0 HB3 PRO A 58 13.710 -7.348 -14.172 1.00 10.00 H new ATOM 0 HG2 PRO A 58 10.941 -8.409 -14.684 1.00 10.00 H new ATOM 0 HG3 PRO A 58 12.486 -9.102 -15.133 1.00 10.00 H new ATOM 0 HD2 PRO A 58 11.127 -10.033 -12.989 1.00 10.00 H new ATOM 0 HD3 PRO A 58 12.878 -9.972 -12.977 1.00 10.00 H new ATOM 647 N MET A 59 11.380 -4.737 -12.563 1.00 10.00 N ATOM 648 CA MET A 59 10.326 -3.737 -12.470 1.00 10.00 C ATOM 649 C MET A 59 9.456 -3.735 -13.727 1.00 10.00 C ATOM 650 O MET A 59 9.910 -4.124 -14.805 1.00 10.00 O ATOM 651 CB MET A 59 10.918 -2.346 -12.239 1.00 10.00 C ATOM 652 CG MET A 59 9.901 -1.338 -11.729 1.00 10.00 C ATOM 653 SD MET A 59 10.618 0.276 -11.388 1.00 10.00 S ATOM 654 CE MET A 59 9.178 1.143 -10.773 1.00 10.00 C ATOM 0 H MET A 59 12.316 -4.358 -12.703 1.00 10.00 H new ATOM 0 HA MET A 59 9.698 -3.997 -11.618 1.00 10.00 H new ATOM 0 HB2 MET A 59 11.736 -2.421 -11.522 1.00 10.00 H new ATOM 0 HB3 MET A 59 11.345 -1.981 -13.173 1.00 10.00 H new ATOM 0 HG2 MET A 59 9.106 -1.227 -12.467 1.00 10.00 H new ATOM 0 HG3 MET A 59 9.440 -1.724 -10.820 1.00 10.00 H new ATOM 0 HE1 MET A 59 9.495 1.980 -10.152 1.00 10.00 H new ATOM 0 HE2 MET A 59 8.592 1.516 -11.613 1.00 10.00 H new ATOM 0 HE3 MET A 59 8.569 0.461 -10.180 1.00 10.00 H new ATOM 664 N ASN A 60 8.195 -3.329 -13.552 1.00 10.00 N ATOM 665 CA ASN A 60 7.201 -3.241 -14.633 1.00 10.00 C ATOM 666 C ASN A 60 6.610 -4.607 -14.977 1.00 10.00 C ATOM 667 O ASN A 60 5.704 -4.705 -15.800 1.00 10.00 O ATOM 668 CB ASN A 60 7.781 -2.576 -15.892 1.00 10.00 C ATOM 669 CG ASN A 60 6.704 -2.027 -16.814 1.00 10.00 C ATOM 670 OD1 ASN A 60 6.054 -1.029 -16.503 1.00 10.00 O ATOM 671 ND2 ASN A 60 6.515 -2.660 -17.962 1.00 10.00 N ATOM 0 H ASN A 60 7.828 -3.047 -12.643 1.00 10.00 H new ATOM 0 HA ASN A 60 6.395 -2.610 -14.259 1.00 10.00 H new ATOM 0 HB2 ASN A 60 8.448 -1.766 -15.596 1.00 10.00 H new ATOM 0 HB3 ASN A 60 8.384 -3.302 -16.437 1.00 10.00 H new ATOM 0 HD21 ASN A 60 5.813 -2.323 -18.621 1.00 10.00 H new ATOM 0 HD22 ASN A 60 7.072 -3.484 -18.188 1.00 10.00 H new ATOM 678 N SER A 61 7.105 -5.661 -14.335 1.00 10.00 N ATOM 679 CA SER A 61 6.590 -7.002 -14.583 1.00 10.00 C ATOM 680 C SER A 61 5.269 -7.193 -13.844 1.00 10.00 C ATOM 681 O SER A 61 4.486 -8.092 -14.156 1.00 10.00 O ATOM 682 CB SER A 61 7.604 -8.059 -14.139 1.00 10.00 C ATOM 683 OG SER A 61 7.877 -7.953 -12.756 1.00 10.00 O ATOM 0 H SER A 61 7.855 -5.613 -13.645 1.00 10.00 H new ATOM 0 HA SER A 61 6.420 -7.120 -15.653 1.00 10.00 H new ATOM 0 HB2 SER A 61 7.218 -9.054 -14.361 1.00 10.00 H new ATOM 0 HB3 SER A 61 8.528 -7.942 -14.705 1.00 10.00 H new ATOM 0 HG SER A 61 8.673 -7.398 -12.621 1.00 10.00 H new ATOM 689 N LEU A 62 5.034 -6.330 -12.864 1.00 10.00 N ATOM 690 CA LEU A 62 3.821 -6.374 -12.066 1.00 10.00 C ATOM 691 C LEU A 62 3.065 -5.059 -12.188 1.00 10.00 C ATOM 692 O LEU A 62 3.664 -3.983 -12.122 1.00 10.00 O ATOM 693 CB LEU A 62 4.159 -6.636 -10.596 1.00 10.00 C ATOM 694 CG LEU A 62 4.933 -7.926 -10.316 1.00 10.00 C ATOM 695 CD1 LEU A 62 5.425 -7.945 -8.879 1.00 10.00 C ATOM 696 CD2 LEU A 62 4.064 -9.144 -10.593 1.00 10.00 C ATOM 0 H LEU A 62 5.678 -5.583 -12.603 1.00 10.00 H new ATOM 0 HA LEU A 62 3.194 -7.185 -12.437 1.00 10.00 H new ATOM 0 HB2 LEU A 62 4.742 -5.795 -10.220 1.00 10.00 H new ATOM 0 HB3 LEU A 62 3.230 -6.660 -10.027 1.00 10.00 H new ATOM 0 HG LEU A 62 5.796 -7.960 -10.982 1.00 10.00 H new ATOM 0 HD11 LEU A 62 5.974 -8.869 -8.694 1.00 10.00 H new ATOM 0 HD12 LEU A 62 6.082 -7.092 -8.708 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.573 -7.888 -8.202 1.00 10.00 H new ATOM 0 HD21 LEU A 62 4.633 -10.051 -10.388 1.00 10.00 H new ATOM 0 HD22 LEU A 62 3.183 -9.116 -9.952 1.00 10.00 H new ATOM 0 HD23 LEU A 62 3.753 -9.139 -11.638 1.00 10.00 H new ATOM 708 N ARG A 63 1.755 -5.146 -12.371 1.00 10.00 N ATOM 709 CA ARG A 63 0.925 -3.958 -12.492 1.00 10.00 C ATOM 710 C ARG A 63 0.126 -3.739 -11.215 1.00 10.00 C ATOM 711 O ARG A 63 -0.578 -4.636 -10.743 1.00 10.00 O ATOM 712 CB ARG A 63 -0.018 -4.048 -13.702 1.00 10.00 C ATOM 713 CG ARG A 63 -0.882 -5.302 -13.741 1.00 10.00 C ATOM 714 CD ARG A 63 -1.760 -5.324 -14.980 1.00 10.00 C ATOM 715 NE ARG A 63 -2.619 -6.508 -15.035 1.00 10.00 N ATOM 716 CZ ARG A 63 -2.668 -7.354 -16.068 1.00 10.00 C ATOM 717 NH1 ARG A 63 -1.883 -7.186 -17.127 1.00 10.00 N ATOM 718 NH2 ARG A 63 -3.504 -8.383 -16.036 1.00 10.00 N ATOM 0 H ARG A 63 1.245 -6.027 -12.439 1.00 10.00 H new ATOM 0 HA ARG A 63 1.586 -3.106 -12.649 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -0.669 -3.174 -13.704 1.00 10.00 H new ATOM 0 HB3 ARG A 63 0.577 -4.004 -14.614 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -0.245 -6.186 -13.727 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -1.506 -5.345 -12.849 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -2.380 -4.428 -14.998 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -1.130 -5.294 -15.869 1.00 10.00 H new ATOM 0 HE ARG A 63 -3.219 -6.700 -14.233 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -1.231 -6.402 -17.159 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -1.933 -7.841 -17.908 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -4.106 -8.526 -15.225 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -3.545 -9.031 -16.822 1.00 10.00 H new ATOM 732 N PHE A 64 0.264 -2.551 -10.650 1.00 10.00 N ATOM 733 CA PHE A 64 -0.447 -2.193 -9.433 1.00 10.00 C ATOM 734 C PHE A 64 -1.804 -1.607 -9.781 1.00 10.00 C ATOM 735 O PHE A 64 -1.884 -0.570 -10.439 1.00 10.00 O ATOM 736 CB PHE A 64 0.356 -1.175 -8.619 1.00 10.00 C ATOM 737 CG PHE A 64 1.494 -1.776 -7.851 1.00 10.00 C ATOM 738 CD1 PHE A 64 2.777 -1.767 -8.369 1.00 10.00 C ATOM 739 CD2 PHE A 64 1.277 -2.343 -6.605 1.00 10.00 C ATOM 740 CE1 PHE A 64 3.828 -2.313 -7.657 1.00 10.00 C ATOM 741 CE2 PHE A 64 2.321 -2.893 -5.889 1.00 10.00 C ATOM 742 CZ PHE A 64 3.598 -2.875 -6.414 1.00 10.00 C ATOM 0 H PHE A 64 0.866 -1.814 -11.017 1.00 10.00 H new ATOM 0 HA PHE A 64 -0.581 -3.094 -8.835 1.00 10.00 H new ATOM 0 HB2 PHE A 64 0.747 -0.413 -9.293 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -0.314 -0.671 -7.922 1.00 10.00 H new ATOM 0 HD1 PHE A 64 2.959 -1.329 -9.339 1.00 10.00 H new ATOM 0 HD2 PHE A 64 0.280 -2.355 -6.190 1.00 10.00 H new ATOM 0 HE1 PHE A 64 4.826 -2.301 -8.070 1.00 10.00 H new ATOM 0 HE2 PHE A 64 2.140 -3.336 -4.921 1.00 10.00 H new ATOM 0 HZ PHE A 64 4.418 -3.300 -5.854 1.00 10.00 H new ATOM 752 N LEU A 65 -2.862 -2.270 -9.349 1.00 10.00 N ATOM 753 CA LEU A 65 -4.209 -1.809 -9.620 1.00 10.00 C ATOM 754 C LEU A 65 -4.841 -1.255 -8.357 1.00 10.00 C ATOM 755 O LEU A 65 -4.913 -1.934 -7.329 1.00 10.00 O ATOM 756 CB LEU A 65 -5.063 -2.946 -10.181 1.00 10.00 C ATOM 757 CG LEU A 65 -4.610 -3.497 -11.537 1.00 10.00 C ATOM 758 CD1 LEU A 65 -5.531 -4.621 -11.984 1.00 10.00 C ATOM 759 CD2 LEU A 65 -4.569 -2.390 -12.584 1.00 10.00 C ATOM 0 H LEU A 65 -2.812 -3.133 -8.807 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.157 -1.014 -10.364 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.070 -3.763 -9.459 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.090 -2.594 -10.275 1.00 10.00 H new ATOM 0 HG LEU A 65 -3.602 -3.896 -11.426 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -5.197 -5.003 -12.949 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -5.508 -5.425 -11.248 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -6.549 -4.242 -12.076 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -4.245 -2.804 -13.539 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -5.563 -1.957 -12.695 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -3.870 -1.616 -12.268 1.00 10.00 H new ATOM 771 N PHE A 66 -5.277 -0.013 -8.436 1.00 10.00 N ATOM 772 CA PHE A 66 -5.911 0.642 -7.313 1.00 10.00 C ATOM 773 C PHE A 66 -7.254 1.214 -7.740 1.00 10.00 C ATOM 774 O PHE A 66 -7.324 2.286 -8.352 1.00 10.00 O ATOM 775 CB PHE A 66 -5.014 1.746 -6.749 1.00 10.00 C ATOM 776 CG PHE A 66 -5.518 2.320 -5.457 1.00 10.00 C ATOM 777 CD1 PHE A 66 -5.551 1.548 -4.307 1.00 10.00 C ATOM 778 CD2 PHE A 66 -5.963 3.630 -5.392 1.00 10.00 C ATOM 779 CE1 PHE A 66 -6.017 2.072 -3.118 1.00 10.00 C ATOM 780 CE2 PHE A 66 -6.431 4.158 -4.206 1.00 10.00 C ATOM 781 CZ PHE A 66 -6.458 3.378 -3.068 1.00 10.00 C ATOM 0 H PHE A 66 -5.202 0.565 -9.273 1.00 10.00 H new ATOM 0 HA PHE A 66 -6.073 -0.095 -6.526 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -4.012 1.346 -6.594 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -4.928 2.546 -7.485 1.00 10.00 H new ATOM 0 HD1 PHE A 66 -5.208 0.524 -4.341 1.00 10.00 H new ATOM 0 HD2 PHE A 66 -5.944 4.245 -6.279 1.00 10.00 H new ATOM 0 HE1 PHE A 66 -6.036 1.460 -2.228 1.00 10.00 H new ATOM 0 HE2 PHE A 66 -6.776 5.181 -4.169 1.00 10.00 H new ATOM 0 HZ PHE A 66 -6.824 3.790 -2.139 1.00 10.00 H new ATOM 791 N GLU A 67 -8.310 0.469 -7.436 1.00 10.00 N ATOM 792 CA GLU A 67 -9.675 0.865 -7.759 1.00 10.00 C ATOM 793 C GLU A 67 -9.876 0.988 -9.268 1.00 10.00 C ATOM 794 O GLU A 67 -10.387 1.994 -9.763 1.00 10.00 O ATOM 795 CB GLU A 67 -10.035 2.176 -7.050 1.00 10.00 C ATOM 796 CG GLU A 67 -9.968 2.076 -5.532 1.00 10.00 C ATOM 797 CD GLU A 67 -10.783 0.917 -4.993 1.00 10.00 C ATOM 798 OE1 GLU A 67 -10.183 -0.079 -4.535 1.00 10.00 O ATOM 799 OE2 GLU A 67 -12.031 0.995 -5.033 1.00 10.00 O ATOM 0 H GLU A 67 -8.243 -0.429 -6.957 1.00 10.00 H new ATOM 0 HA GLU A 67 -10.346 0.084 -7.401 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -9.358 2.961 -7.386 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -11.041 2.476 -7.344 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -8.929 1.960 -5.224 1.00 10.00 H new ATOM 0 HG3 GLU A 67 -10.329 3.006 -5.093 1.00 10.00 H new ATOM 806 N GLY A 68 -9.450 -0.037 -9.996 1.00 10.00 N ATOM 807 CA GLY A 68 -9.610 -0.046 -11.438 1.00 10.00 C ATOM 808 C GLY A 68 -8.407 0.499 -12.183 1.00 10.00 C ATOM 809 O GLY A 68 -7.893 -0.148 -13.102 1.00 10.00 O ATOM 0 H GLY A 68 -8.995 -0.865 -9.612 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -9.800 -1.067 -11.768 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -10.488 0.543 -11.702 1.00 10.00 H new ATOM 813 N GLN A 69 -7.951 1.677 -11.789 1.00 10.00 N ATOM 814 CA GLN A 69 -6.815 2.321 -12.439 1.00 10.00 C ATOM 815 C GLN A 69 -5.494 1.747 -11.943 1.00 10.00 C ATOM 816 O GLN A 69 -5.442 1.089 -10.906 1.00 10.00 O ATOM 817 CB GLN A 69 -6.850 3.827 -12.190 1.00 10.00 C ATOM 818 CG GLN A 69 -8.185 4.471 -12.527 1.00 10.00 C ATOM 819 CD GLN A 69 -8.263 5.913 -12.081 1.00 10.00 C ATOM 820 OE1 GLN A 69 -7.622 6.312 -11.107 1.00 10.00 O ATOM 821 NE2 GLN A 69 -9.047 6.708 -12.790 1.00 10.00 N ATOM 0 H GLN A 69 -8.351 2.211 -11.018 1.00 10.00 H new ATOM 0 HA GLN A 69 -6.890 2.129 -13.509 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -6.618 4.019 -11.142 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -6.068 4.302 -12.782 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -8.348 4.418 -13.603 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -8.987 3.904 -12.054 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -9.560 6.337 -13.590 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -9.138 7.692 -12.537 1.00 10.00 H new ATOM 830 N ARG A 70 -4.429 1.997 -12.691 1.00 10.00 N ATOM 831 CA ARG A 70 -3.110 1.509 -12.317 1.00 10.00 C ATOM 832 C ARG A 70 -2.283 2.633 -11.700 1.00 10.00 C ATOM 833 O ARG A 70 -2.493 3.809 -12.000 1.00 10.00 O ATOM 834 CB ARG A 70 -2.385 0.901 -13.522 1.00 10.00 C ATOM 835 CG ARG A 70 -2.087 1.893 -14.636 1.00 10.00 C ATOM 836 CD ARG A 70 -1.780 1.186 -15.948 1.00 10.00 C ATOM 837 NE ARG A 70 -0.502 0.475 -15.910 1.00 10.00 N ATOM 838 CZ ARG A 70 -0.283 -0.708 -16.489 1.00 10.00 C ATOM 839 NH1 ARG A 70 -1.276 -1.364 -17.084 1.00 10.00 N ATOM 840 NH2 ARG A 70 0.925 -1.251 -16.450 1.00 10.00 N ATOM 0 H ARG A 70 -4.452 2.533 -13.558 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.237 0.723 -11.573 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.448 0.460 -13.183 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -2.991 0.090 -13.925 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -2.941 2.557 -14.771 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.240 2.517 -14.351 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -2.579 0.480 -16.173 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -1.763 1.917 -16.757 1.00 10.00 H new ATOM 0 HE ARG A 70 0.272 0.911 -15.409 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -2.214 -0.964 -17.100 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -1.099 -2.267 -17.524 1.00 10.00 H new ATOM 0 HH21 ARG A 70 1.687 -0.765 -15.978 1.00 10.00 H new ATOM 0 HH22 ARG A 70 1.092 -2.155 -16.892 1.00 10.00 H new ATOM 854 N ILE A 71 -1.355 2.256 -10.837 1.00 10.00 N ATOM 855 CA ILE A 71 -0.497 3.214 -10.150 1.00 10.00 C ATOM 856 C ILE A 71 0.688 3.643 -11.015 1.00 10.00 C ATOM 857 O ILE A 71 1.503 2.814 -11.433 1.00 10.00 O ATOM 858 CB ILE A 71 0.033 2.623 -8.823 1.00 10.00 C ATOM 859 CG1 ILE A 71 -1.132 2.285 -7.884 1.00 10.00 C ATOM 860 CG2 ILE A 71 1.004 3.584 -8.148 1.00 10.00 C ATOM 861 CD1 ILE A 71 -1.947 3.493 -7.458 1.00 10.00 C ATOM 0 H ILE A 71 -1.173 1.283 -10.592 1.00 10.00 H new ATOM 0 HA ILE A 71 -1.110 4.092 -9.943 1.00 10.00 H new ATOM 0 HB ILE A 71 0.572 1.704 -9.051 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.790 1.571 -8.379 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.738 1.792 -6.995 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.362 3.145 -7.217 1.00 10.00 H new ATOM 0 HG22 ILE A 71 1.850 3.771 -8.810 1.00 10.00 H new ATOM 0 HG23 ILE A 71 0.496 4.524 -7.934 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -2.752 3.174 -6.796 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -1.304 4.199 -6.933 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -2.372 3.974 -8.339 1.00 10.00 H new ATOM 873 N ALA A 72 0.784 4.943 -11.267 1.00 10.00 N ATOM 874 CA ALA A 72 1.874 5.494 -12.061 1.00 10.00 C ATOM 875 C ALA A 72 3.127 5.622 -11.203 1.00 10.00 C ATOM 876 O ALA A 72 3.052 5.582 -9.975 1.00 10.00 O ATOM 877 CB ALA A 72 1.484 6.847 -12.640 1.00 10.00 C ATOM 0 H ALA A 72 0.117 5.637 -10.931 1.00 10.00 H new ATOM 0 HA ALA A 72 2.082 4.817 -12.890 1.00 10.00 H new ATOM 0 HB1 ALA A 72 2.311 7.242 -13.230 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.607 6.731 -13.277 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.254 7.538 -11.828 1.00 10.00 H new ATOM 883 N ASP A 73 4.274 5.789 -11.843 1.00 10.00 N ATOM 884 CA ASP A 73 5.540 5.906 -11.123 1.00 10.00 C ATOM 885 C ASP A 73 5.664 7.251 -10.415 1.00 10.00 C ATOM 886 O ASP A 73 6.442 7.399 -9.477 1.00 10.00 O ATOM 887 CB ASP A 73 6.721 5.706 -12.074 1.00 10.00 C ATOM 888 CG ASP A 73 7.174 4.260 -12.134 1.00 10.00 C ATOM 889 OD1 ASP A 73 6.424 3.421 -12.682 1.00 10.00 O ATOM 890 OD2 ASP A 73 8.281 3.961 -11.640 1.00 10.00 O ATOM 0 H ASP A 73 4.358 5.847 -12.858 1.00 10.00 H new ATOM 0 HA ASP A 73 5.555 5.123 -10.365 1.00 10.00 H new ATOM 0 HB2 ASP A 73 6.440 6.038 -13.073 1.00 10.00 H new ATOM 0 HB3 ASP A 73 7.553 6.332 -11.753 1.00 10.00 H new ATOM 895 N ASN A 74 4.900 8.233 -10.866 1.00 10.00 N ATOM 896 CA ASN A 74 4.937 9.563 -10.263 1.00 10.00 C ATOM 897 C ASN A 74 3.760 9.774 -9.320 1.00 10.00 C ATOM 898 O ASN A 74 3.568 10.871 -8.794 1.00 10.00 O ATOM 899 CB ASN A 74 4.933 10.646 -11.343 1.00 10.00 C ATOM 900 CG ASN A 74 3.615 10.719 -12.097 1.00 10.00 C ATOM 901 OD1 ASN A 74 3.393 9.968 -13.046 1.00 10.00 O ATOM 902 ND2 ASN A 74 2.737 11.626 -11.691 1.00 10.00 N ATOM 0 H ASN A 74 4.248 8.139 -11.645 1.00 10.00 H new ATOM 0 HA ASN A 74 5.860 9.637 -9.687 1.00 10.00 H new ATOM 0 HB2 ASN A 74 5.137 11.613 -10.883 1.00 10.00 H new ATOM 0 HB3 ASN A 74 5.740 10.452 -12.049 1.00 10.00 H new ATOM 0 HD21 ASN A 74 1.841 11.719 -12.170 1.00 10.00 H new ATOM 0 HD22 ASN A 74 2.957 12.231 -10.900 1.00 10.00 H new ATOM 909 N HIS A 75 2.979 8.724 -9.111 1.00 10.00 N ATOM 910 CA HIS A 75 1.818 8.800 -8.237 1.00 10.00 C ATOM 911 C HIS A 75 2.248 8.823 -6.775 1.00 10.00 C ATOM 912 O HIS A 75 3.286 8.265 -6.413 1.00 10.00 O ATOM 913 CB HIS A 75 0.877 7.617 -8.491 1.00 10.00 C ATOM 914 CG HIS A 75 -0.335 7.961 -9.303 1.00 10.00 C ATOM 915 ND1 HIS A 75 -0.930 7.037 -10.128 1.00 10.00 N ATOM 916 CD2 HIS A 75 -1.039 9.116 -9.352 1.00 10.00 C ATOM 917 CE1 HIS A 75 -1.980 7.645 -10.652 1.00 10.00 C ATOM 918 NE2 HIS A 75 -2.087 8.907 -10.212 1.00 10.00 N ATOM 0 H HIS A 75 3.129 7.809 -9.535 1.00 10.00 H new ATOM 0 HA HIS A 75 1.285 9.725 -8.458 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.431 6.829 -9.001 1.00 10.00 H new ATOM 0 HB3 HIS A 75 0.555 7.211 -7.532 1.00 10.00 H new ATOM 0 HD2 HIS A 75 -0.818 10.028 -8.817 1.00 10.00 H new ATOM 0 HE1 HIS A 75 -2.666 7.183 -11.347 1.00 10.00 H new ATOM 0 HE2 HIS A 75 -2.808 9.581 -10.467 1.00 10.00 H new ATOM 926 N THR A 76 1.465 9.492 -5.948 1.00 10.00 N ATOM 927 CA THR A 76 1.752 9.584 -4.528 1.00 10.00 C ATOM 928 C THR A 76 0.569 9.062 -3.719 1.00 10.00 C ATOM 929 O THR A 76 -0.555 9.035 -4.218 1.00 10.00 O ATOM 930 CB THR A 76 2.055 11.037 -4.112 1.00 10.00 C ATOM 931 OG1 THR A 76 1.038 11.920 -4.604 1.00 10.00 O ATOM 932 CG2 THR A 76 3.412 11.480 -4.636 1.00 10.00 C ATOM 0 H THR A 76 0.619 9.983 -6.238 1.00 10.00 H new ATOM 0 HA THR A 76 2.633 8.975 -4.326 1.00 10.00 H new ATOM 0 HB THR A 76 2.070 11.077 -3.023 1.00 10.00 H new ATOM 0 HG1 THR A 76 1.081 11.955 -5.582 1.00 10.00 H new ATOM 0 HG21 THR A 76 3.602 12.508 -4.329 1.00 10.00 H new ATOM 0 HG22 THR A 76 4.188 10.831 -4.231 1.00 10.00 H new ATOM 0 HG23 THR A 76 3.419 11.419 -5.724 1.00 10.00 H new ATOM 940 N PRO A 77 0.795 8.637 -2.464 1.00 10.00 N ATOM 941 CA PRO A 77 -0.277 8.125 -1.598 1.00 10.00 C ATOM 942 C PRO A 77 -1.254 9.223 -1.175 1.00 10.00 C ATOM 943 O PRO A 77 -2.291 8.955 -0.568 1.00 10.00 O ATOM 944 CB PRO A 77 0.470 7.575 -0.372 1.00 10.00 C ATOM 945 CG PRO A 77 1.906 7.517 -0.766 1.00 10.00 C ATOM 946 CD PRO A 77 2.101 8.594 -1.791 1.00 10.00 C ATOM 0 HA PRO A 77 -0.884 7.378 -2.109 1.00 10.00 H new ATOM 0 HB2 PRO A 77 0.328 8.220 0.495 1.00 10.00 H new ATOM 0 HB3 PRO A 77 0.099 6.587 -0.098 1.00 10.00 H new ATOM 0 HG2 PRO A 77 2.553 7.678 0.096 1.00 10.00 H new ATOM 0 HG3 PRO A 77 2.158 6.539 -1.176 1.00 10.00 H new ATOM 0 HD2 PRO A 77 2.352 9.550 -1.332 1.00 10.00 H new ATOM 0 HD3 PRO A 77 2.907 8.352 -2.484 1.00 10.00 H new ATOM 954 N LYS A 78 -0.905 10.463 -1.500 1.00 10.00 N ATOM 955 CA LYS A 78 -1.733 11.611 -1.162 1.00 10.00 C ATOM 956 C LYS A 78 -2.895 11.747 -2.141 1.00 10.00 C ATOM 957 O LYS A 78 -4.003 12.130 -1.760 1.00 10.00 O ATOM 958 CB LYS A 78 -0.883 12.887 -1.159 1.00 10.00 C ATOM 959 CG LYS A 78 -1.652 14.150 -0.789 1.00 10.00 C ATOM 960 CD LYS A 78 -2.158 14.112 0.645 1.00 10.00 C ATOM 961 CE LYS A 78 -1.016 14.185 1.644 1.00 10.00 C ATOM 962 NZ LYS A 78 -1.505 14.308 3.042 1.00 10.00 N ATOM 0 H LYS A 78 -0.048 10.698 -2.001 1.00 10.00 H new ATOM 0 HA LYS A 78 -2.147 11.459 -0.165 1.00 10.00 H new ATOM 0 HB2 LYS A 78 -0.058 12.759 -0.458 1.00 10.00 H new ATOM 0 HB3 LYS A 78 -0.443 13.019 -2.148 1.00 10.00 H new ATOM 0 HG2 LYS A 78 -1.007 15.019 -0.923 1.00 10.00 H new ATOM 0 HG3 LYS A 78 -2.496 14.272 -1.468 1.00 10.00 H new ATOM 0 HD2 LYS A 78 -2.842 14.944 0.812 1.00 10.00 H new ATOM 0 HD3 LYS A 78 -2.726 13.196 0.807 1.00 10.00 H new ATOM 0 HE2 LYS A 78 -0.398 13.292 1.554 1.00 10.00 H new ATOM 0 HE3 LYS A 78 -0.380 15.038 1.406 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 -0.694 14.355 3.691 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 -2.074 15.174 3.136 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 -2.091 13.482 3.279 1.00 10.00 H new ATOM 976 N GLU A 79 -2.642 11.425 -3.403 1.00 10.00 N ATOM 977 CA GLU A 79 -3.672 11.511 -4.426 1.00 10.00 C ATOM 978 C GLU A 79 -4.385 10.173 -4.562 1.00 10.00 C ATOM 979 O GLU A 79 -3.985 9.196 -3.926 1.00 10.00 O ATOM 980 CB GLU A 79 -3.073 11.955 -5.763 1.00 10.00 C ATOM 981 CG GLU A 79 -2.003 11.027 -6.306 1.00 10.00 C ATOM 982 CD GLU A 79 -1.046 11.737 -7.237 1.00 10.00 C ATOM 983 OE1 GLU A 79 -1.513 12.445 -8.155 1.00 10.00 O ATOM 984 OE2 GLU A 79 0.176 11.595 -7.049 1.00 10.00 O ATOM 0 H GLU A 79 -1.735 11.103 -3.741 1.00 10.00 H new ATOM 0 HA GLU A 79 -4.403 12.262 -4.126 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -3.874 12.036 -6.498 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -2.647 12.951 -5.644 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.445 10.594 -5.476 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.477 10.201 -6.836 1.00 10.00 H new ATOM 991 N LEU A 80 -5.453 10.148 -5.366 1.00 10.00 N ATOM 992 CA LEU A 80 -6.259 8.940 -5.590 1.00 10.00 C ATOM 993 C LEU A 80 -7.124 8.627 -4.371 1.00 10.00 C ATOM 994 O LEU A 80 -8.292 8.264 -4.504 1.00 10.00 O ATOM 995 CB LEU A 80 -5.382 7.729 -5.932 1.00 10.00 C ATOM 996 CG LEU A 80 -4.725 7.766 -7.312 1.00 10.00 C ATOM 997 CD1 LEU A 80 -3.587 6.764 -7.383 1.00 10.00 C ATOM 998 CD2 LEU A 80 -5.750 7.480 -8.396 1.00 10.00 C ATOM 0 H LEU A 80 -5.784 10.964 -5.881 1.00 10.00 H new ATOM 0 HA LEU A 80 -6.908 9.142 -6.442 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -4.600 7.643 -5.178 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -5.992 6.828 -5.862 1.00 10.00 H new ATOM 0 HG LEU A 80 -4.319 8.764 -7.475 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -3.130 6.802 -8.372 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -2.840 7.008 -6.628 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -3.973 5.761 -7.201 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -5.266 7.510 -9.372 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -6.183 6.492 -8.236 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -6.538 8.232 -8.359 1.00 10.00 H new ATOM 1010 N GLY A 81 -6.541 8.761 -3.189 1.00 10.00 N ATOM 1011 CA GLY A 81 -7.263 8.502 -1.966 1.00 10.00 C ATOM 1012 C GLY A 81 -6.861 7.196 -1.328 1.00 10.00 C ATOM 1013 O GLY A 81 -7.496 6.168 -1.553 1.00 10.00 O ATOM 0 H GLY A 81 -5.571 9.048 -3.058 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -7.086 9.316 -1.263 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -8.333 8.487 -2.175 1.00 10.00 H new ATOM 1017 N MET A 82 -5.796 7.232 -0.543 1.00 10.00 N ATOM 1018 CA MET A 82 -5.307 6.043 0.139 1.00 10.00 C ATOM 1019 C MET A 82 -5.448 6.216 1.644 1.00 10.00 C ATOM 1020 O MET A 82 -5.366 7.335 2.153 1.00 10.00 O ATOM 1021 CB MET A 82 -3.842 5.777 -0.221 1.00 10.00 C ATOM 1022 CG MET A 82 -3.649 5.171 -1.601 1.00 10.00 C ATOM 1023 SD MET A 82 -1.921 4.815 -1.973 1.00 10.00 S ATOM 1024 CE MET A 82 -2.089 3.930 -3.521 1.00 10.00 C ATOM 0 H MET A 82 -5.251 8.075 -0.362 1.00 10.00 H new ATOM 0 HA MET A 82 -5.902 5.189 -0.183 1.00 10.00 H new ATOM 0 HB2 MET A 82 -3.288 6.714 -0.165 1.00 10.00 H new ATOM 0 HB3 MET A 82 -3.411 5.107 0.523 1.00 10.00 H new ATOM 0 HG2 MET A 82 -4.228 4.250 -1.673 1.00 10.00 H new ATOM 0 HG3 MET A 82 -4.044 5.855 -2.352 1.00 10.00 H new ATOM 0 HE1 MET A 82 -1.103 3.640 -3.883 1.00 10.00 H new ATOM 0 HE2 MET A 82 -2.696 3.038 -3.366 1.00 10.00 H new ATOM 0 HE3 MET A 82 -2.571 4.573 -4.257 1.00 10.00 H new ATOM 1034 N GLU A 83 -5.680 5.119 2.348 1.00 10.00 N ATOM 1035 CA GLU A 83 -5.831 5.159 3.795 1.00 10.00 C ATOM 1036 C GLU A 83 -5.275 3.895 4.436 1.00 10.00 C ATOM 1037 O GLU A 83 -4.862 2.962 3.744 1.00 10.00 O ATOM 1038 CB GLU A 83 -7.305 5.326 4.170 1.00 10.00 C ATOM 1039 CG GLU A 83 -7.674 6.746 4.572 1.00 10.00 C ATOM 1040 CD GLU A 83 -6.927 7.217 5.803 1.00 10.00 C ATOM 1041 OE1 GLU A 83 -6.425 6.364 6.566 1.00 10.00 O ATOM 1042 OE2 GLU A 83 -6.845 8.446 6.022 1.00 10.00 O ATOM 0 H GLU A 83 -5.768 4.188 1.940 1.00 10.00 H new ATOM 0 HA GLU A 83 -5.267 6.013 4.169 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -7.923 5.025 3.324 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -7.541 4.651 4.993 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -7.462 7.421 3.743 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -8.746 6.799 4.760 1.00 10.00 H new ATOM 1049 N GLU A 84 -5.261 3.872 5.759 1.00 10.00 N ATOM 1050 CA GLU A 84 -4.767 2.722 6.502 1.00 10.00 C ATOM 1051 C GLU A 84 -5.679 1.521 6.267 1.00 10.00 C ATOM 1052 O GLU A 84 -6.906 1.657 6.281 1.00 10.00 O ATOM 1053 CB GLU A 84 -4.694 3.065 7.993 1.00 10.00 C ATOM 1054 CG GLU A 84 -4.398 1.880 8.903 1.00 10.00 C ATOM 1055 CD GLU A 84 -3.043 1.247 8.645 1.00 10.00 C ATOM 1056 OE1 GLU A 84 -2.043 1.987 8.530 1.00 10.00 O ATOM 1057 OE2 GLU A 84 -2.975 0.003 8.566 1.00 10.00 O ATOM 0 H GLU A 84 -5.588 4.641 6.344 1.00 10.00 H new ATOM 0 HA GLU A 84 -3.766 2.466 6.154 1.00 10.00 H new ATOM 0 HB2 GLU A 84 -3.923 3.821 8.141 1.00 10.00 H new ATOM 0 HB3 GLU A 84 -5.641 3.512 8.296 1.00 10.00 H new ATOM 0 HG2 GLU A 84 -4.446 2.208 9.941 1.00 10.00 H new ATOM 0 HG3 GLU A 84 -5.174 1.126 8.770 1.00 10.00 H new ATOM 1064 N GLU A 85 -5.068 0.359 6.028 1.00 10.00 N ATOM 1065 CA GLU A 85 -5.800 -0.885 5.782 1.00 10.00 C ATOM 1066 C GLU A 85 -6.525 -0.853 4.439 1.00 10.00 C ATOM 1067 O GLU A 85 -7.529 -1.544 4.256 1.00 10.00 O ATOM 1068 CB GLU A 85 -6.804 -1.168 6.905 1.00 10.00 C ATOM 1069 CG GLU A 85 -6.200 -1.878 8.104 1.00 10.00 C ATOM 1070 CD GLU A 85 -6.038 -3.364 7.872 1.00 10.00 C ATOM 1071 OE1 GLU A 85 -4.886 -3.834 7.811 1.00 10.00 O ATOM 1072 OE2 GLU A 85 -7.064 -4.069 7.760 1.00 10.00 O ATOM 0 H GLU A 85 -4.054 0.254 6.000 1.00 10.00 H new ATOM 0 HA GLU A 85 -5.063 -1.688 5.758 1.00 10.00 H new ATOM 0 HB2 GLU A 85 -7.241 -0.225 7.235 1.00 10.00 H new ATOM 0 HB3 GLU A 85 -7.618 -1.775 6.508 1.00 10.00 H new ATOM 0 HG2 GLU A 85 -5.228 -1.440 8.330 1.00 10.00 H new ATOM 0 HG3 GLU A 85 -6.834 -1.716 8.976 1.00 10.00 H new ATOM 1079 N ASP A 86 -6.024 -0.054 3.500 1.00 10.00 N ATOM 1080 CA ASP A 86 -6.643 0.030 2.182 1.00 10.00 C ATOM 1081 C ASP A 86 -6.377 -1.249 1.396 1.00 10.00 C ATOM 1082 O ASP A 86 -5.522 -2.056 1.778 1.00 10.00 O ATOM 1083 CB ASP A 86 -6.141 1.243 1.398 1.00 10.00 C ATOM 1084 CG ASP A 86 -7.244 1.883 0.573 1.00 10.00 C ATOM 1085 OD1 ASP A 86 -7.860 1.178 -0.257 1.00 10.00 O ATOM 1086 OD2 ASP A 86 -7.511 3.088 0.766 1.00 10.00 O ATOM 0 H ASP A 86 -5.202 0.537 3.625 1.00 10.00 H new ATOM 0 HA ASP A 86 -7.717 0.150 2.326 1.00 10.00 H new ATOM 0 HB2 ASP A 86 -5.733 1.979 2.091 1.00 10.00 H new ATOM 0 HB3 ASP A 86 -5.327 0.938 0.741 1.00 10.00 H new ATOM 1091 N VAL A 87 -7.089 -1.425 0.295 1.00 10.00 N ATOM 1092 CA VAL A 87 -6.949 -2.626 -0.515 1.00 10.00 C ATOM 1093 C VAL A 87 -6.361 -2.319 -1.887 1.00 10.00 C ATOM 1094 O VAL A 87 -6.954 -1.587 -2.680 1.00 10.00 O ATOM 1095 CB VAL A 87 -8.308 -3.337 -0.698 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -8.143 -4.627 -1.485 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -8.953 -3.611 0.652 1.00 10.00 C ATOM 0 H VAL A 87 -7.769 -0.753 -0.059 1.00 10.00 H new ATOM 0 HA VAL A 87 -6.264 -3.283 0.021 1.00 10.00 H new ATOM 0 HB VAL A 87 -8.964 -2.676 -1.265 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -9.114 -5.109 -1.601 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -7.730 -4.403 -2.468 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -7.467 -5.295 -0.951 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -9.909 -4.112 0.503 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -8.298 -4.248 1.246 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -9.115 -2.669 1.176 1.00 10.00 H new ATOM 1107 N ILE A 88 -5.195 -2.883 -2.153 1.00 10.00 N ATOM 1108 CA ILE A 88 -4.527 -2.700 -3.429 1.00 10.00 C ATOM 1109 C ILE A 88 -4.213 -4.067 -4.036 1.00 10.00 C ATOM 1110 O ILE A 88 -3.835 -5.000 -3.324 1.00 10.00 O ATOM 1111 CB ILE A 88 -3.238 -1.849 -3.287 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -2.563 -1.658 -4.650 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -2.276 -2.479 -2.291 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -1.448 -0.633 -4.642 1.00 10.00 C ATOM 0 H ILE A 88 -4.688 -3.476 -1.496 1.00 10.00 H new ATOM 0 HA ILE A 88 -5.195 -2.153 -4.094 1.00 10.00 H new ATOM 0 HB ILE A 88 -3.521 -0.868 -2.905 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.162 -2.615 -4.983 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -3.316 -1.357 -5.379 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -1.381 -1.863 -2.210 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -2.757 -2.550 -1.315 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.000 -3.477 -2.633 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.019 -0.554 -5.641 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -1.846 0.336 -4.340 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.675 -0.942 -3.939 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.396 -4.197 -5.339 1.00 10.00 N ATOM 1127 CA GLU A 89 -4.148 -5.462 -6.008 1.00 10.00 C ATOM 1128 C GLU A 89 -2.963 -5.356 -6.960 1.00 10.00 C ATOM 1129 O GLU A 89 -2.726 -4.308 -7.558 1.00 10.00 O ATOM 1130 CB GLU A 89 -5.393 -5.900 -6.775 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.613 -6.103 -5.893 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.863 -6.372 -6.698 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -8.173 -7.556 -6.946 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -8.538 -5.398 -7.097 1.00 10.00 O ATOM 0 H GLU A 89 -4.714 -3.446 -5.952 1.00 10.00 H new ATOM 0 HA GLU A 89 -3.910 -6.207 -5.248 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.624 -5.152 -7.533 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -5.177 -6.830 -7.301 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.434 -6.937 -5.215 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -6.764 -5.217 -5.276 1.00 10.00 H new ATOM 1141 N VAL A 90 -2.223 -6.443 -7.092 1.00 10.00 N ATOM 1142 CA VAL A 90 -1.074 -6.481 -7.980 1.00 10.00 C ATOM 1143 C VAL A 90 -1.104 -7.761 -8.810 1.00 10.00 C ATOM 1144 O VAL A 90 -1.315 -8.853 -8.279 1.00 10.00 O ATOM 1145 CB VAL A 90 0.258 -6.376 -7.195 1.00 10.00 C ATOM 1146 CG1 VAL A 90 0.390 -7.505 -6.183 1.00 10.00 C ATOM 1147 CG2 VAL A 90 1.447 -6.357 -8.145 1.00 10.00 C ATOM 0 H VAL A 90 -2.398 -7.315 -6.593 1.00 10.00 H new ATOM 0 HA VAL A 90 -1.131 -5.619 -8.644 1.00 10.00 H new ATOM 0 HB VAL A 90 0.248 -5.435 -6.645 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.334 -7.405 -5.648 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -0.436 -7.456 -5.474 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.367 -8.463 -6.702 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.370 -6.283 -7.571 1.00 10.00 H new ATOM 0 HG22 VAL A 90 1.458 -7.275 -8.733 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.365 -5.500 -8.813 1.00 10.00 H new ATOM 1157 N TYR A 91 -0.935 -7.618 -10.116 1.00 10.00 N ATOM 1158 CA TYR A 91 -0.951 -8.763 -11.016 1.00 10.00 C ATOM 1159 C TYR A 91 0.205 -8.677 -12.002 1.00 10.00 C ATOM 1160 O TYR A 91 0.841 -7.635 -12.126 1.00 10.00 O ATOM 1161 CB TYR A 91 -2.291 -8.836 -11.758 1.00 10.00 C ATOM 1162 CG TYR A 91 -3.474 -9.021 -10.830 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -3.742 -10.258 -10.258 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -4.314 -7.958 -10.518 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -4.808 -10.429 -9.394 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -5.383 -8.123 -9.659 1.00 10.00 C ATOM 1167 CZ TYR A 91 -5.628 -9.361 -9.102 1.00 10.00 C ATOM 1168 OH TYR A 91 -6.687 -9.530 -8.237 1.00 10.00 O ATOM 0 H TYR A 91 -0.785 -6.721 -10.577 1.00 10.00 H new ATOM 0 HA TYR A 91 -0.833 -9.673 -10.428 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -2.430 -7.923 -12.336 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -2.262 -9.662 -12.469 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.107 -11.100 -10.492 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -4.128 -6.988 -10.954 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -4.997 -11.395 -8.950 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -6.024 -7.286 -9.424 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.017 -8.653 -7.948 1.00 10.00 H new ATOM 1178 N GLN A 92 0.479 -9.773 -12.696 1.00 10.00 N ATOM 1179 CA GLN A 92 1.571 -9.813 -13.659 1.00 10.00 C ATOM 1180 C GLN A 92 1.186 -9.090 -14.945 1.00 10.00 C ATOM 1181 O GLN A 92 0.043 -9.174 -15.395 1.00 10.00 O ATOM 1182 CB GLN A 92 1.941 -11.265 -13.974 1.00 10.00 C ATOM 1183 CG GLN A 92 3.165 -11.409 -14.866 1.00 10.00 C ATOM 1184 CD GLN A 92 3.173 -12.714 -15.636 1.00 10.00 C ATOM 1185 OE1 GLN A 92 3.685 -13.727 -15.160 1.00 10.00 O ATOM 1186 NE2 GLN A 92 2.616 -12.696 -16.838 1.00 10.00 N ATOM 0 H GLN A 92 -0.040 -10.647 -12.610 1.00 10.00 H new ATOM 0 HA GLN A 92 2.431 -9.308 -13.220 1.00 10.00 H new ATOM 0 HB2 GLN A 92 2.121 -11.795 -13.039 1.00 10.00 H new ATOM 0 HB3 GLN A 92 1.092 -11.749 -14.457 1.00 10.00 H new ATOM 0 HG2 GLN A 92 3.198 -10.576 -15.569 1.00 10.00 H new ATOM 0 HG3 GLN A 92 4.065 -11.346 -14.255 1.00 10.00 H new ATOM 0 HE21 GLN A 92 2.202 -11.835 -17.196 1.00 10.00 H new ATOM 0 HE22 GLN A 92 2.601 -13.543 -17.406 1.00 10.00 H new ATOM 1195 N GLU A 93 2.137 -8.374 -15.524 1.00 10.00 N ATOM 1196 CA GLU A 93 1.904 -7.652 -16.765 1.00 10.00 C ATOM 1197 C GLU A 93 2.144 -8.562 -17.960 1.00 10.00 C ATOM 1198 O GLU A 93 2.949 -9.493 -17.892 1.00 10.00 O ATOM 1199 CB GLU A 93 2.813 -6.425 -16.855 1.00 10.00 C ATOM 1200 CG GLU A 93 2.152 -5.145 -16.376 1.00 10.00 C ATOM 1201 CD GLU A 93 1.043 -4.675 -17.301 1.00 10.00 C ATOM 1202 OE1 GLU A 93 0.080 -5.436 -17.521 1.00 10.00 O ATOM 1203 OE2 GLU A 93 1.126 -3.534 -17.801 1.00 10.00 O ATOM 0 H GLU A 93 3.082 -8.277 -15.152 1.00 10.00 H new ATOM 0 HA GLU A 93 0.866 -7.319 -16.775 1.00 10.00 H new ATOM 0 HB2 GLU A 93 3.711 -6.604 -16.264 1.00 10.00 H new ATOM 0 HB3 GLU A 93 3.133 -6.295 -17.889 1.00 10.00 H new ATOM 0 HG2 GLU A 93 1.744 -5.304 -15.378 1.00 10.00 H new ATOM 0 HG3 GLU A 93 2.905 -4.362 -16.292 1.00 10.00 H new ATOM 1210 N GLN A 94 1.448 -8.286 -19.052 1.00 10.00 N ATOM 1211 CA GLN A 94 1.586 -9.079 -20.266 1.00 10.00 C ATOM 1212 C GLN A 94 2.922 -8.787 -20.938 1.00 10.00 C ATOM 1213 O GLN A 94 3.433 -9.590 -21.717 1.00 10.00 O ATOM 1214 CB GLN A 94 0.436 -8.780 -21.227 1.00 10.00 C ATOM 1215 CG GLN A 94 0.337 -9.764 -22.381 1.00 10.00 C ATOM 1216 CD GLN A 94 -0.535 -9.251 -23.507 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -0.610 -8.045 -23.753 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -1.194 -10.159 -24.205 1.00 10.00 N ATOM 0 H GLN A 94 0.781 -7.518 -19.123 1.00 10.00 H new ATOM 0 HA GLN A 94 1.553 -10.135 -19.998 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -0.502 -8.788 -20.672 1.00 10.00 H new ATOM 0 HB3 GLN A 94 0.560 -7.774 -21.628 1.00 10.00 H new ATOM 0 HG2 GLN A 94 1.336 -9.971 -22.765 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -0.066 -10.709 -22.015 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -1.105 -11.147 -23.969 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -1.792 -9.872 -24.980 1.00 10.00 H new ATOM 1227 N THR A 95 3.479 -7.626 -20.624 1.00 10.00 N ATOM 1228 CA THR A 95 4.754 -7.205 -21.173 1.00 10.00 C ATOM 1229 C THR A 95 5.892 -8.061 -20.622 1.00 10.00 C ATOM 1230 O THR A 95 6.896 -8.290 -21.295 1.00 10.00 O ATOM 1231 CB THR A 95 5.005 -5.730 -20.835 1.00 10.00 C ATOM 1232 OG1 THR A 95 4.044 -5.308 -19.855 1.00 10.00 O ATOM 1233 CG2 THR A 95 4.892 -4.860 -22.080 1.00 10.00 C ATOM 0 H THR A 95 3.059 -6.953 -19.983 1.00 10.00 H new ATOM 0 HA THR A 95 4.720 -7.330 -22.255 1.00 10.00 H new ATOM 0 HB THR A 95 6.015 -5.623 -20.439 1.00 10.00 H new ATOM 0 HG1 THR A 95 4.197 -4.366 -19.631 1.00 10.00 H new ATOM 0 HG21 THR A 95 5.074 -3.819 -21.814 1.00 10.00 H new ATOM 0 HG22 THR A 95 5.629 -5.181 -22.816 1.00 10.00 H new ATOM 0 HG23 THR A 95 3.892 -4.957 -22.502 1.00 10.00 H new ATOM 1241 N GLY A 96 5.722 -8.532 -19.393 1.00 10.00 N ATOM 1242 CA GLY A 96 6.731 -9.365 -18.769 1.00 10.00 C ATOM 1243 C GLY A 96 7.787 -8.566 -18.031 1.00 10.00 C ATOM 1244 O GLY A 96 8.596 -9.130 -17.292 1.00 10.00 O ATOM 0 H GLY A 96 4.901 -8.351 -18.816 1.00 10.00 H new ATOM 0 HA2 GLY A 96 6.248 -10.050 -18.072 1.00 10.00 H new ATOM 0 HA3 GLY A 96 7.213 -9.975 -19.533 1.00 10.00 H new ATOM 1248 N GLY A 97 7.776 -7.255 -18.218 1.00 10.00 N ATOM 1249 CA GLY A 97 8.744 -6.404 -17.563 1.00 10.00 C ATOM 1250 C GLY A 97 9.078 -5.191 -18.402 1.00 10.00 C ATOM 1251 O GLY A 97 8.144 -4.557 -18.928 1.00 10.00 O ATOM 0 H GLY A 97 7.110 -6.764 -18.815 1.00 10.00 H new ATOM 0 HA2 GLY A 97 8.352 -6.083 -16.598 1.00 10.00 H new ATOM 0 HA3 GLY A 97 9.653 -6.972 -17.365 1.00 10.00 H new ATOM 1256 N ASN B 357 -4.588 -17.127 5.794 1.00 10.00 N ATOM 1257 CA ASN B 357 -4.053 -16.081 6.686 1.00 10.00 C ATOM 1258 C ASN B 357 -2.540 -15.964 6.529 1.00 10.00 C ATOM 1259 O ASN B 357 -1.775 -16.520 7.316 1.00 10.00 O ATOM 1260 CB ASN B 357 -4.410 -16.381 8.147 1.00 10.00 C ATOM 1261 CG ASN B 357 -3.993 -15.254 9.081 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -2.865 -15.225 9.569 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -4.895 -14.313 9.331 1.00 10.00 N ATOM 0 HA ASN B 357 -4.508 -15.131 6.405 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -5.485 -16.542 8.231 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -3.924 -17.306 8.456 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -4.662 -13.533 9.946 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -5.822 -14.370 8.908 1.00 10.00 H new ATOM 1270 N ASN B 358 -2.099 -15.272 5.493 1.00 10.00 N ATOM 1271 CA ASN B 358 -0.671 -15.093 5.275 1.00 10.00 C ATOM 1272 C ASN B 358 -0.328 -13.620 5.297 1.00 10.00 C ATOM 1273 O ASN B 358 -0.872 -12.849 4.504 1.00 10.00 O ATOM 1274 CB ASN B 358 -0.276 -15.667 3.913 1.00 10.00 C ATOM 1275 CG ASN B 358 1.221 -15.611 3.673 1.00 10.00 C ATOM 1276 OD1 ASN B 358 2.018 -15.791 4.592 1.00 10.00 O ATOM 1277 ND2 ASN B 358 1.616 -15.362 2.434 1.00 10.00 N ATOM 0 H ASN B 358 -2.699 -14.829 4.797 1.00 10.00 H new ATOM 0 HA ASN B 358 -0.130 -15.612 6.067 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -0.613 -16.701 3.846 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -0.788 -15.113 3.126 1.00 10.00 H new ATOM 0 HD21 ASN B 358 2.611 -15.314 2.216 1.00 10.00 H new ATOM 0 HD22 ASN B 358 0.925 -15.218 1.698 1.00 10.00 H new ATOM 1284 N ARG B 359 0.576 -13.223 6.184 1.00 10.00 N ATOM 1285 CA ARG B 359 0.968 -11.827 6.260 1.00 10.00 C ATOM 1286 C ARG B 359 2.472 -11.641 6.122 1.00 10.00 C ATOM 1287 O ARG B 359 3.261 -12.285 6.813 1.00 10.00 O ATOM 1288 CB ARG B 359 0.459 -11.167 7.554 1.00 10.00 C ATOM 1289 CG ARG B 359 0.792 -11.916 8.835 1.00 10.00 C ATOM 1290 CD ARG B 359 0.453 -11.074 10.058 1.00 10.00 C ATOM 1291 NE ARG B 359 0.919 -11.685 11.301 1.00 10.00 N ATOM 1292 CZ ARG B 359 1.480 -11.009 12.304 1.00 10.00 C ATOM 1293 NH1 ARG B 359 1.604 -9.688 12.235 1.00 10.00 N ATOM 1294 NH2 ARG B 359 1.909 -11.653 13.382 1.00 10.00 N ATOM 0 H ARG B 359 1.043 -13.839 6.850 1.00 10.00 H new ATOM 0 HA ARG B 359 0.497 -11.329 5.413 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.877 -10.163 7.620 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.623 -11.058 7.486 1.00 10.00 H new ATOM 0 HG2 ARG B 359 0.237 -12.853 8.868 1.00 10.00 H new ATOM 0 HG3 ARG B 359 1.851 -12.172 8.847 1.00 10.00 H new ATOM 0 HD2 ARG B 359 0.901 -10.086 9.951 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -0.626 -10.930 10.109 1.00 10.00 H new ATOM 0 HE ARG B 359 0.808 -12.693 11.408 1.00 10.00 H new ATOM 0 HH11 ARG B 359 1.269 -9.187 11.412 1.00 10.00 H new ATOM 0 HH12 ARG B 359 2.034 -9.175 13.005 1.00 10.00 H new ATOM 0 HH21 ARG B 359 1.810 -12.666 13.444 1.00 10.00 H new ATOM 0 HH22 ARG B 359 2.338 -11.135 14.149 1.00 10.00 H new ATOM 1308 N ASP B 360 2.850 -10.759 5.216 1.00 10.00 N ATOM 1309 CA ASP B 360 4.248 -10.423 4.988 1.00 10.00 C ATOM 1310 C ASP B 360 4.396 -8.918 5.172 1.00 10.00 C ATOM 1311 O ASP B 360 3.659 -8.159 4.549 1.00 10.00 O ATOM 1312 CB ASP B 360 4.696 -10.851 3.579 1.00 10.00 C ATOM 1313 CG ASP B 360 6.177 -10.604 3.339 1.00 10.00 C ATOM 1314 OD1 ASP B 360 6.577 -10.355 2.181 1.00 10.00 O ATOM 1315 OD2 ASP B 360 6.958 -10.667 4.306 1.00 10.00 O ATOM 0 H ASP B 360 2.198 -10.254 4.616 1.00 10.00 H new ATOM 0 HA ASP B 360 4.883 -10.955 5.696 1.00 10.00 H new ATOM 0 HB2 ASP B 360 4.480 -11.910 3.439 1.00 10.00 H new ATOM 0 HB3 ASP B 360 4.115 -10.306 2.835 1.00 10.00 H new ATOM 1320 N PRO B 361 5.349 -8.440 5.994 1.00 10.00 N ATOM 1321 CA PRO B 361 5.515 -7.018 6.216 1.00 10.00 C ATOM 1322 C PRO B 361 6.769 -6.455 5.548 1.00 10.00 C ATOM 1323 O PRO B 361 7.887 -6.932 5.751 1.00 10.00 O ATOM 1324 CB PRO B 361 5.665 -6.982 7.747 1.00 10.00 C ATOM 1325 CG PRO B 361 6.253 -8.318 8.129 1.00 10.00 C ATOM 1326 CD PRO B 361 6.202 -9.208 6.904 1.00 10.00 C ATOM 0 HA PRO B 361 4.701 -6.420 5.806 1.00 10.00 H new ATOM 0 HB2 PRO B 361 6.315 -6.164 8.058 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.701 -6.825 8.232 1.00 10.00 H new ATOM 0 HG2 PRO B 361 7.280 -8.200 8.474 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.691 -8.763 8.950 1.00 10.00 H new ATOM 0 HD2 PRO B 361 7.193 -9.379 6.484 1.00 10.00 H new ATOM 0 HD3 PRO B 361 5.778 -10.186 7.130 1.00 10.00 H new ATOM 1334 N ILE B 362 6.550 -5.399 4.774 1.00 10.00 N ATOM 1335 CA ILE B 362 7.604 -4.737 4.018 1.00 10.00 C ATOM 1336 C ILE B 362 7.761 -3.297 4.486 1.00 10.00 C ATOM 1337 O ILE B 362 6.774 -2.596 4.721 1.00 10.00 O ATOM 1338 CB ILE B 362 7.334 -4.748 2.496 1.00 10.00 C ATOM 1339 CG1 ILE B 362 6.612 -6.033 2.064 1.00 10.00 C ATOM 1340 CG2 ILE B 362 8.642 -4.590 1.728 1.00 10.00 C ATOM 1341 CD1 ILE B 362 6.235 -6.035 0.598 1.00 10.00 C ATOM 0 H ILE B 362 5.630 -4.976 4.653 1.00 10.00 H new ATOM 0 HA ILE B 362 8.522 -5.296 4.200 1.00 10.00 H new ATOM 0 HB ILE B 362 6.682 -3.906 2.264 1.00 10.00 H new ATOM 0 HG12 ILE B 362 7.253 -6.890 2.270 1.00 10.00 H new ATOM 0 HG13 ILE B 362 5.711 -6.157 2.665 1.00 10.00 H new ATOM 0 HG21 ILE B 362 8.439 -4.599 0.657 1.00 10.00 H new ATOM 0 HG22 ILE B 362 9.112 -3.645 2.000 1.00 10.00 H new ATOM 0 HG23 ILE B 362 9.312 -5.413 1.977 1.00 10.00 H new ATOM 0 HD11 ILE B 362 5.728 -6.969 0.354 1.00 10.00 H new ATOM 0 HD12 ILE B 362 5.570 -5.197 0.392 1.00 10.00 H new ATOM 0 HD13 ILE B 362 7.135 -5.941 -0.009 1.00 10.00 H new ATOM 1353 N VAL B 363 9.002 -2.868 4.637 1.00 10.00 N ATOM 1354 CA VAL B 363 9.306 -1.524 5.102 1.00 10.00 C ATOM 1355 C VAL B 363 9.954 -0.714 3.989 1.00 10.00 C ATOM 1356 O VAL B 363 10.853 -1.188 3.285 1.00 10.00 O ATOM 1357 CB VAL B 363 10.231 -1.544 6.336 1.00 10.00 C ATOM 1358 CG1 VAL B 363 10.445 -0.139 6.879 1.00 10.00 C ATOM 1359 CG2 VAL B 363 9.665 -2.454 7.414 1.00 10.00 C ATOM 0 H VAL B 363 9.825 -3.438 4.442 1.00 10.00 H new ATOM 0 HA VAL B 363 8.364 -1.057 5.392 1.00 10.00 H new ATOM 0 HB VAL B 363 11.199 -1.937 6.026 1.00 10.00 H new ATOM 0 HG11 VAL B 363 11.101 -0.181 7.749 1.00 10.00 H new ATOM 0 HG12 VAL B 363 10.902 0.483 6.109 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.485 0.289 7.168 1.00 10.00 H new ATOM 0 HG21 VAL B 363 10.332 -2.455 8.276 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.682 -2.093 7.716 1.00 10.00 H new ATOM 0 HG23 VAL B 363 9.575 -3.468 7.024 1.00 10.00 H new ATOM 1369 N ILE B 364 9.483 0.514 3.861 1.00 10.00 N ATOM 1370 CA ILE B 364 9.915 1.439 2.830 1.00 10.00 C ATOM 1371 C ILE B 364 10.685 2.604 3.439 1.00 10.00 C ATOM 1372 O ILE B 364 10.401 3.045 4.555 1.00 10.00 O ATOM 1373 CB ILE B 364 8.734 1.969 1.969 1.00 10.00 C ATOM 1374 CG1 ILE B 364 9.253 2.442 0.606 1.00 10.00 C ATOM 1375 CG2 ILE B 364 7.982 3.100 2.670 1.00 10.00 C ATOM 1376 CD1 ILE B 364 9.764 1.320 -0.274 1.00 10.00 C ATOM 0 H ILE B 364 8.775 0.903 4.484 1.00 10.00 H new ATOM 0 HA ILE B 364 10.574 0.880 2.166 1.00 10.00 H new ATOM 0 HB ILE B 364 8.031 1.148 1.826 1.00 10.00 H new ATOM 0 HG12 ILE B 364 8.452 2.965 0.084 1.00 10.00 H new ATOM 0 HG13 ILE B 364 10.055 3.163 0.763 1.00 10.00 H new ATOM 0 HG21 ILE B 364 7.165 3.442 2.035 1.00 10.00 H new ATOM 0 HG22 ILE B 364 7.579 2.738 3.616 1.00 10.00 H new ATOM 0 HG23 ILE B 364 8.665 3.928 2.860 1.00 10.00 H new ATOM 0 HD11 ILE B 364 10.114 1.731 -1.221 1.00 10.00 H new ATOM 0 HD12 ILE B 364 10.587 0.811 0.227 1.00 10.00 H new ATOM 0 HD13 ILE B 364 8.959 0.610 -0.462 1.00 10.00 H new