USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1027 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 105 ASN :FLIP amide:sc= -0.203 F(o=-1.4!,f=0.87) USER MOD Set 1.2: A 110 THR OG1 : rot 139:sc= 1.07 USER MOD Set 2.1: A 85 MET CE :methyl -167:sc= -0.668 (180deg=-0.489) USER MOD Set 2.2: A 91 MET CE :methyl -157:sc= -3.51 (180deg=-4.12!) USER MOD Set 3.1: A 73 THR OG1 : rot 180:sc= 0.629 USER MOD Set 3.2: A 96 LYS NZ :NH3+ -147:sc= 0.518 (180deg=-0.24) USER MOD Set 4.1: A 51 THR OG1 : rot -79:sc= 0.903 USER MOD Set 4.2: A 60 HIS :FLIP no HD1:sc= 0.563 F(o=-3.8!,f=1.5) USER MOD Set 5.1: A 30 GLN : amide:sc= -0.447 K(o=1.7,f=-9.8!) USER MOD Set 5.2: A 33 LYS NZ :NH3+ -160:sc= 2.11 (180deg=0.846) USER MOD Single : A 1 MET CE :methyl 170:sc= -0.0144 (180deg=-0.203) USER MOD Single : A 1 MET N :NH3+ 176:sc= 0 (180deg=-0.0131) USER MOD Single : A 2 ASN : amide:sc=-0.00173 K(o=-0.0017,f=-1.6) USER MOD Single : A 4 SER OG : rot -17:sc= 1.26 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 30:sc= -1.01 USER MOD Single : A 8 GLN :FLIP amide:sc= -0.0668 F(o=-1.4!,f=-0.067) USER MOD Single : A 10 GLN : amide:sc= -0.105 X(o=-0.1,f=-0.035) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -6.55! C(o=-6.6!,f=-7.9!) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -178:sc= 1.33 (180deg=1.31) USER MOD Single : A 22 MET CE :methyl 159:sc= -0.303 (180deg=-0.985) USER MOD Single : A 31 LYS NZ :NH3+ 168:sc= -0.0185 (180deg=-0.165) USER MOD Single : A 36 LYS NZ :NH3+ -138:sc= 1.16 (180deg=0.953) USER MOD Single : A 39 SER OG : rot 180:sc= -0.0188 USER MOD Single : A 43 HIS : no HD1:sc= -3.05! C(o=-3!,f=-5.2!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 177:sc= 0.65 (180deg=0.646) USER MOD Single : A 49 LYS NZ :NH3+ -146:sc= 1.23 (180deg=0.173) USER MOD Single : A 53 THR OG1 : rot 75:sc= 0.33 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0.00449 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.263! C(o=-0.26!,f=-4.2!) USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.0832 USER MOD Single : A 69 CYS SG : rot -57:sc= -0.0431 USER MOD Single : A 74 MET CE :methyl -161:sc= -0.291 (180deg=-0.964) USER MOD Single : A 75 THR OG1 : rot -63:sc= 1.11 USER MOD Single : A 78 LYS NZ :NH3+ -167:sc= 0.767 (180deg=-0.144!) USER MOD Single : A 80 LYS NZ :NH3+ -109:sc= -1.39 (180deg=-3.75!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -1.29! C(o=-1.3!,f=-1.7!) USER MOD Single : A 90 LYS NZ :NH3+ 151:sc= -0.0469 (180deg=-1.19) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 169:sc= 0.895 (180deg=0.808) USER MOD Single : A 100 SER OG : rot 180:sc= -0.194 USER MOD Single : A 102 THR OG1 : rot 68:sc= 0.579 USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.0127 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -170:sc= -1.56 (180deg=-2.02!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot -62:sc= 0.438 USER MOD Single : A 121 LYS NZ :NH3+ 179:sc= 1.22 (180deg=1.15) USER MOD Single : A 124 SER OG : rot 180:sc= -0.216 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.613 -16.503 2.778 1.00 0.00 N ATOM 2 CA MET A 1 9.289 -15.271 3.241 1.00 0.00 C ATOM 3 C MET A 1 8.467 -14.558 4.314 1.00 0.00 C ATOM 4 O MET A 1 7.533 -13.808 4.020 1.00 0.00 O ATOM 5 CB MET A 1 9.570 -14.323 2.067 1.00 0.00 C ATOM 6 CG MET A 1 8.358 -14.011 1.201 1.00 0.00 C ATOM 7 SD MET A 1 8.593 -12.548 0.175 1.00 0.00 S ATOM 8 CE MET A 1 10.103 -12.964 -0.695 1.00 0.00 C ATOM 0 H1 MET A 1 9.160 -16.929 2.003 1.00 0.00 H new ATOM 0 H2 MET A 1 8.545 -17.178 3.566 1.00 0.00 H new ATOM 0 H3 MET A 1 7.658 -16.269 2.439 1.00 0.00 H new ATOM 0 HA MET A 1 10.241 -15.566 3.682 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.970 -13.388 2.460 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.345 -14.763 1.439 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.144 -14.867 0.562 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.488 -13.865 1.841 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.276 -12.239 -1.490 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.941 -12.946 0.002 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.011 -13.961 -1.127 1.00 0.00 H new ATOM 20 N ASN A 2 8.790 -14.816 5.570 1.00 0.00 N ATOM 21 CA ASN A 2 8.193 -14.072 6.663 1.00 0.00 C ATOM 22 C ASN A 2 9.208 -13.100 7.234 1.00 0.00 C ATOM 23 O ASN A 2 10.330 -13.482 7.553 1.00 0.00 O ATOM 24 CB ASN A 2 7.671 -14.990 7.764 1.00 0.00 C ATOM 25 CG ASN A 2 6.979 -14.203 8.864 1.00 0.00 C ATOM 26 OD1 ASN A 2 6.441 -13.118 8.621 1.00 0.00 O ATOM 27 ND2 ASN A 2 6.978 -14.744 10.071 1.00 0.00 N ATOM 0 H ASN A 2 9.459 -15.531 5.856 1.00 0.00 H new ATOM 0 HA ASN A 2 7.339 -13.524 6.264 1.00 0.00 H new ATOM 0 HB2 ASN A 2 6.974 -15.711 7.338 1.00 0.00 H new ATOM 0 HB3 ASN A 2 8.499 -15.559 8.188 1.00 0.00 H new ATOM 0 HD21 ASN A 2 6.521 -14.263 10.845 1.00 0.00 H new ATOM 0 HD22 ASN A 2 7.435 -15.643 10.228 1.00 0.00 H new ATOM 34 N PHE A 3 8.821 -11.842 7.329 1.00 0.00 N ATOM 35 CA PHE A 3 9.690 -10.819 7.882 1.00 0.00 C ATOM 36 C PHE A 3 9.024 -10.176 9.089 1.00 0.00 C ATOM 37 O PHE A 3 9.516 -10.300 10.208 1.00 0.00 O ATOM 38 CB PHE A 3 10.014 -9.763 6.822 1.00 0.00 C ATOM 39 CG PHE A 3 10.772 -10.297 5.640 1.00 0.00 C ATOM 40 CD1 PHE A 3 10.105 -10.890 4.580 1.00 0.00 C ATOM 41 CD2 PHE A 3 12.153 -10.199 5.588 1.00 0.00 C ATOM 42 CE1 PHE A 3 10.801 -11.376 3.493 1.00 0.00 C ATOM 43 CE2 PHE A 3 12.853 -10.686 4.501 1.00 0.00 C ATOM 44 CZ PHE A 3 12.178 -11.275 3.452 1.00 0.00 C ATOM 0 H PHE A 3 7.907 -11.503 7.029 1.00 0.00 H new ATOM 0 HA PHE A 3 10.625 -11.281 8.199 1.00 0.00 H new ATOM 0 HB2 PHE A 3 9.083 -9.316 6.472 1.00 0.00 H new ATOM 0 HB3 PHE A 3 10.596 -8.966 7.284 1.00 0.00 H new ATOM 0 HD1 PHE A 3 9.028 -10.973 4.605 1.00 0.00 H new ATOM 0 HD2 PHE A 3 12.688 -9.737 6.405 1.00 0.00 H new ATOM 0 HE1 PHE A 3 10.269 -11.836 2.673 1.00 0.00 H new ATOM 0 HE2 PHE A 3 13.930 -10.605 4.473 1.00 0.00 H new ATOM 0 HZ PHE A 3 12.724 -11.656 2.602 1.00 0.00 H new ATOM 54 N SER A 4 7.891 -9.510 8.838 1.00 0.00 N ATOM 55 CA SER A 4 7.060 -8.889 9.869 1.00 0.00 C ATOM 56 C SER A 4 7.801 -7.780 10.635 1.00 0.00 C ATOM 57 O SER A 4 8.855 -7.997 11.235 1.00 0.00 O ATOM 58 CB SER A 4 6.484 -9.950 10.820 1.00 0.00 C ATOM 59 OG SER A 4 7.442 -10.394 11.766 1.00 0.00 O ATOM 0 H SER A 4 7.522 -9.387 7.895 1.00 0.00 H new ATOM 0 HA SER A 4 6.227 -8.403 9.361 1.00 0.00 H new ATOM 0 HB2 SER A 4 5.622 -9.537 11.344 1.00 0.00 H new ATOM 0 HB3 SER A 4 6.127 -10.801 10.240 1.00 0.00 H new ATOM 0 HG SER A 4 8.340 -10.146 11.463 1.00 0.00 H new ATOM 65 N GLY A 5 7.236 -6.586 10.588 1.00 0.00 N ATOM 66 CA GLY A 5 7.819 -5.439 11.247 1.00 0.00 C ATOM 67 C GLY A 5 7.282 -4.156 10.660 1.00 0.00 C ATOM 68 O GLY A 5 6.334 -4.187 9.876 1.00 0.00 O ATOM 0 H GLY A 5 6.366 -6.389 10.094 1.00 0.00 H new ATOM 0 HA2 GLY A 5 7.600 -5.476 12.314 1.00 0.00 H new ATOM 0 HA3 GLY A 5 8.904 -5.466 11.143 1.00 0.00 H new ATOM 72 N LYS A 6 7.873 -3.028 11.014 1.00 0.00 N ATOM 73 CA LYS A 6 7.451 -1.757 10.451 1.00 0.00 C ATOM 74 C LYS A 6 8.399 -1.371 9.313 1.00 0.00 C ATOM 75 O LYS A 6 9.603 -1.625 9.379 1.00 0.00 O ATOM 76 CB LYS A 6 7.452 -0.667 11.525 1.00 0.00 C ATOM 77 CG LYS A 6 6.563 0.517 11.226 1.00 0.00 C ATOM 78 CD LYS A 6 5.131 0.293 11.663 1.00 0.00 C ATOM 79 CE LYS A 6 4.598 1.504 12.387 1.00 0.00 C ATOM 80 NZ LYS A 6 5.130 1.628 13.769 1.00 0.00 N ATOM 0 H LYS A 6 8.640 -2.966 11.683 1.00 0.00 H new ATOM 0 HA LYS A 6 6.436 -1.857 10.066 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.139 -1.109 12.471 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.473 -0.312 11.661 1.00 0.00 H new ATOM 0 HG2 LYS A 6 6.959 1.400 11.728 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.585 0.722 10.156 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.509 0.080 10.793 1.00 0.00 H new ATOM 0 HD3 LYS A 6 5.077 -0.579 12.314 1.00 0.00 H new ATOM 0 HE2 LYS A 6 4.853 2.401 11.822 1.00 0.00 H new ATOM 0 HE3 LYS A 6 3.510 1.450 12.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 4.731 2.476 14.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 4.865 0.786 14.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 6.166 1.708 13.736 1.00 0.00 H new ATOM 94 N TYR A 7 7.848 -0.782 8.268 1.00 0.00 N ATOM 95 CA TYR A 7 8.614 -0.346 7.111 1.00 0.00 C ATOM 96 C TYR A 7 8.195 1.060 6.735 1.00 0.00 C ATOM 97 O TYR A 7 7.050 1.297 6.365 1.00 0.00 O ATOM 98 CB TYR A 7 8.387 -1.277 5.920 1.00 0.00 C ATOM 99 CG TYR A 7 8.694 -2.720 6.220 1.00 0.00 C ATOM 100 CD1 TYR A 7 7.803 -3.484 6.943 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.868 -3.313 5.785 1.00 0.00 C ATOM 102 CE1 TYR A 7 8.066 -4.799 7.238 1.00 0.00 C ATOM 103 CE2 TYR A 7 10.143 -4.634 6.071 1.00 0.00 C ATOM 104 CZ TYR A 7 9.238 -5.371 6.804 1.00 0.00 C ATOM 105 OH TYR A 7 9.511 -6.682 7.112 1.00 0.00 O ATOM 0 H TYR A 7 6.849 -0.590 8.196 1.00 0.00 H new ATOM 0 HA TYR A 7 9.673 -0.368 7.369 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.349 -1.194 5.596 1.00 0.00 H new ATOM 0 HB3 TYR A 7 9.008 -0.947 5.087 1.00 0.00 H new ATOM 0 HD1 TYR A 7 6.880 -3.039 7.284 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.578 -2.733 5.214 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.356 -5.380 7.808 1.00 0.00 H new ATOM 0 HE2 TYR A 7 11.060 -5.087 5.723 1.00 0.00 H new ATOM 0 HH TYR A 7 8.671 -7.181 7.191 1.00 0.00 H new ATOM 115 N GLN A 8 9.111 1.993 6.825 1.00 0.00 N ATOM 116 CA GLN A 8 8.790 3.374 6.551 1.00 0.00 C ATOM 117 C GLN A 8 9.044 3.673 5.074 1.00 0.00 C ATOM 118 O GLN A 8 10.111 3.365 4.545 1.00 0.00 O ATOM 119 CB GLN A 8 9.612 4.279 7.472 1.00 0.00 C ATOM 120 CG GLN A 8 11.028 4.535 7.000 1.00 0.00 C ATOM 121 CD GLN A 8 11.755 5.566 7.837 1.00 0.00 C ATOM 122 OE1 GLN A 8 11.019 6.519 8.385 1.00 0.00 O flip ATOM 123 NE2 GLN A 8 12.972 5.507 7.986 1.00 0.00 N flip ATOM 0 H GLN A 8 10.083 1.823 7.085 1.00 0.00 H new ATOM 0 HA GLN A 8 7.736 3.567 6.750 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.098 5.235 7.574 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.649 3.829 8.464 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.587 3.599 7.021 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.004 4.869 5.963 1.00 0.00 H new ATOM 0 HE21 GLN A 8 13.504 4.756 7.546 1.00 0.00 H new ATOM 0 HE22 GLN A 8 13.451 6.209 8.549 1.00 0.00 H new ATOM 132 N VAL A 9 8.043 4.210 4.392 1.00 0.00 N ATOM 133 CA VAL A 9 8.179 4.515 2.975 1.00 0.00 C ATOM 134 C VAL A 9 9.239 5.587 2.776 1.00 0.00 C ATOM 135 O VAL A 9 9.379 6.498 3.593 1.00 0.00 O ATOM 136 CB VAL A 9 6.852 4.967 2.342 1.00 0.00 C ATOM 137 CG1 VAL A 9 6.999 5.082 0.835 1.00 0.00 C ATOM 138 CG2 VAL A 9 5.737 4.004 2.692 1.00 0.00 C ATOM 0 H VAL A 9 7.134 4.442 4.793 1.00 0.00 H new ATOM 0 HA VAL A 9 8.481 3.596 2.473 1.00 0.00 H new ATOM 0 HB VAL A 9 6.596 5.947 2.744 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.052 5.403 0.400 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.772 5.813 0.600 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.278 4.113 0.422 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.807 4.342 2.234 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.984 3.010 2.319 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.616 3.966 3.775 1.00 0.00 H new ATOM 148 N GLN A 10 9.999 5.459 1.706 1.00 0.00 N ATOM 149 CA GLN A 10 11.097 6.359 1.440 1.00 0.00 C ATOM 150 C GLN A 10 10.921 7.028 0.107 1.00 0.00 C ATOM 151 O GLN A 10 10.764 8.231 0.014 1.00 0.00 O ATOM 152 CB GLN A 10 12.392 5.588 1.459 1.00 0.00 C ATOM 153 CG GLN A 10 12.612 4.885 2.769 1.00 0.00 C ATOM 154 CD GLN A 10 13.178 5.801 3.836 1.00 0.00 C ATOM 155 OE1 GLN A 10 14.396 5.909 3.994 1.00 0.00 O ATOM 156 NE2 GLN A 10 12.303 6.487 4.557 1.00 0.00 N ATOM 0 H GLN A 10 9.872 4.732 1.002 1.00 0.00 H new ATOM 0 HA GLN A 10 11.117 7.129 2.212 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.390 4.856 0.651 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.222 6.269 1.270 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.666 4.469 3.117 1.00 0.00 H new ATOM 0 HG3 GLN A 10 13.292 4.047 2.617 1.00 0.00 H new ATOM 0 HE21 GLN A 10 11.303 6.368 4.394 1.00 0.00 H new ATOM 0 HE22 GLN A 10 12.629 7.134 5.275 1.00 0.00 H new ATOM 165 N SER A 11 10.927 6.238 -0.927 1.00 0.00 N ATOM 166 CA SER A 11 10.717 6.767 -2.243 1.00 0.00 C ATOM 167 C SER A 11 9.288 6.514 -2.644 1.00 0.00 C ATOM 168 O SER A 11 8.673 5.582 -2.160 1.00 0.00 O ATOM 169 CB SER A 11 11.658 6.138 -3.240 1.00 0.00 C ATOM 170 OG SER A 11 12.153 7.103 -4.153 1.00 0.00 O ATOM 0 H SER A 11 11.074 5.230 -0.885 1.00 0.00 H new ATOM 0 HA SER A 11 10.918 7.838 -2.232 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.490 5.670 -2.714 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.141 5.349 -3.785 1.00 0.00 H new ATOM 0 HG SER A 11 12.762 6.671 -4.788 1.00 0.00 H new ATOM 176 N GLN A 12 8.748 7.369 -3.467 1.00 0.00 N ATOM 177 CA GLN A 12 7.461 7.118 -4.083 1.00 0.00 C ATOM 178 C GLN A 12 7.427 7.776 -5.443 1.00 0.00 C ATOM 179 O GLN A 12 8.172 8.716 -5.711 1.00 0.00 O ATOM 180 CB GLN A 12 6.282 7.649 -3.267 1.00 0.00 C ATOM 181 CG GLN A 12 6.155 7.115 -1.849 1.00 0.00 C ATOM 182 CD GLN A 12 5.187 7.933 -1.013 1.00 0.00 C ATOM 183 OE1 GLN A 12 4.551 7.415 -0.105 1.00 0.00 O ATOM 184 NE2 GLN A 12 5.073 9.218 -1.313 1.00 0.00 N ATOM 0 H GLN A 12 9.178 8.255 -3.733 1.00 0.00 H new ATOM 0 HA GLN A 12 7.354 6.035 -4.150 1.00 0.00 H new ATOM 0 HB2 GLN A 12 6.360 8.735 -3.219 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.362 7.419 -3.804 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.818 6.079 -1.882 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.135 7.117 -1.373 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.620 9.614 -2.077 1.00 0.00 H new ATOM 0 HE22 GLN A 12 4.438 9.812 -0.780 1.00 0.00 H new ATOM 193 N GLU A 13 6.560 7.284 -6.286 1.00 0.00 N ATOM 194 CA GLU A 13 6.420 7.813 -7.623 1.00 0.00 C ATOM 195 C GLU A 13 4.979 8.049 -7.972 1.00 0.00 C ATOM 196 O GLU A 13 4.089 7.305 -7.557 1.00 0.00 O ATOM 197 CB GLU A 13 7.013 6.891 -8.667 1.00 0.00 C ATOM 198 CG GLU A 13 8.477 6.613 -8.452 1.00 0.00 C ATOM 199 CD GLU A 13 9.115 5.862 -9.601 1.00 0.00 C ATOM 200 OE1 GLU A 13 9.159 6.402 -10.725 1.00 0.00 O ATOM 201 OE2 GLU A 13 9.581 4.725 -9.382 1.00 0.00 O ATOM 0 H GLU A 13 5.932 6.509 -6.071 1.00 0.00 H new ATOM 0 HA GLU A 13 6.964 8.758 -7.627 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.466 5.948 -8.662 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.875 7.334 -9.653 1.00 0.00 H new ATOM 0 HG2 GLU A 13 9.002 7.557 -8.307 1.00 0.00 H new ATOM 0 HG3 GLU A 13 8.600 6.036 -7.536 1.00 0.00 H new ATOM 208 N ASN A 14 4.788 9.084 -8.763 1.00 0.00 N ATOM 209 CA ASN A 14 3.498 9.464 -9.285 1.00 0.00 C ATOM 210 C ASN A 14 2.488 9.671 -8.161 1.00 0.00 C ATOM 211 O ASN A 14 1.315 9.321 -8.290 1.00 0.00 O ATOM 212 CB ASN A 14 2.953 8.444 -10.292 1.00 0.00 C ATOM 213 CG ASN A 14 3.913 8.150 -11.431 1.00 0.00 C ATOM 214 OD1 ASN A 14 3.925 8.849 -12.442 1.00 0.00 O ATOM 215 ND2 ASN A 14 4.701 7.095 -11.288 1.00 0.00 N ATOM 0 H ASN A 14 5.545 9.697 -9.066 1.00 0.00 H new ATOM 0 HA ASN A 14 3.645 10.407 -9.811 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.725 7.515 -9.770 1.00 0.00 H new ATOM 0 HB3 ASN A 14 2.015 8.817 -10.704 1.00 0.00 H new ATOM 0 HD21 ASN A 14 5.348 6.837 -12.033 1.00 0.00 H new ATOM 0 HD22 ASN A 14 4.661 6.540 -10.433 1.00 0.00 H new ATOM 222 N PHE A 15 2.948 10.241 -7.058 1.00 0.00 N ATOM 223 CA PHE A 15 2.075 10.523 -5.932 1.00 0.00 C ATOM 224 C PHE A 15 1.127 11.652 -6.297 1.00 0.00 C ATOM 225 O PHE A 15 -0.066 11.607 -5.989 1.00 0.00 O ATOM 226 CB PHE A 15 2.906 10.896 -4.700 1.00 0.00 C ATOM 227 CG PHE A 15 2.088 11.312 -3.507 1.00 0.00 C ATOM 228 CD1 PHE A 15 1.645 12.620 -3.373 1.00 0.00 C ATOM 229 CD2 PHE A 15 1.764 10.397 -2.523 1.00 0.00 C ATOM 230 CE1 PHE A 15 0.893 13.002 -2.281 1.00 0.00 C ATOM 231 CE2 PHE A 15 1.012 10.773 -1.427 1.00 0.00 C ATOM 232 CZ PHE A 15 0.576 12.078 -1.306 1.00 0.00 C ATOM 0 H PHE A 15 3.920 10.517 -6.920 1.00 0.00 H new ATOM 0 HA PHE A 15 1.492 9.633 -5.695 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.526 10.044 -4.422 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.582 11.709 -4.964 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.892 13.348 -4.132 1.00 0.00 H new ATOM 0 HD2 PHE A 15 2.103 9.375 -2.612 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.553 14.023 -2.189 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.765 10.048 -0.666 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.012 12.375 -0.450 1.00 0.00 H new ATOM 242 N GLU A 16 1.673 12.655 -6.969 1.00 0.00 N ATOM 243 CA GLU A 16 0.902 13.814 -7.382 1.00 0.00 C ATOM 244 C GLU A 16 -0.231 13.402 -8.291 1.00 0.00 C ATOM 245 O GLU A 16 -1.373 13.624 -7.965 1.00 0.00 O ATOM 246 CB GLU A 16 1.781 14.832 -8.108 1.00 0.00 C ATOM 247 CG GLU A 16 3.251 14.668 -7.810 1.00 0.00 C ATOM 248 CD GLU A 16 4.084 15.879 -8.193 1.00 0.00 C ATOM 249 OE1 GLU A 16 3.507 16.962 -8.420 1.00 0.00 O ATOM 250 OE2 GLU A 16 5.327 15.757 -8.257 1.00 0.00 O ATOM 0 H GLU A 16 2.656 12.687 -7.241 1.00 0.00 H new ATOM 0 HA GLU A 16 0.498 14.275 -6.481 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.622 14.739 -9.182 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.470 15.838 -7.826 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.378 14.471 -6.746 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.627 13.795 -8.343 1.00 0.00 H new ATOM 257 N PRO A 17 0.061 12.765 -9.429 1.00 0.00 N ATOM 258 CA PRO A 17 -0.964 12.448 -10.420 1.00 0.00 C ATOM 259 C PRO A 17 -2.074 11.581 -9.838 1.00 0.00 C ATOM 260 O PRO A 17 -3.222 11.649 -10.278 1.00 0.00 O ATOM 261 CB PRO A 17 -0.212 11.695 -11.501 1.00 0.00 C ATOM 262 CG PRO A 17 1.021 11.203 -10.834 1.00 0.00 C ATOM 263 CD PRO A 17 1.378 12.250 -9.819 1.00 0.00 C ATOM 0 HA PRO A 17 -1.461 13.346 -10.788 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -0.806 10.869 -11.894 1.00 0.00 H new ATOM 0 HB3 PRO A 17 0.026 12.345 -12.343 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.850 10.238 -10.357 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.827 11.065 -11.554 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.918 11.828 -8.971 1.00 0.00 H new ATOM 0 HD3 PRO A 17 2.011 13.030 -10.243 1.00 0.00 H new ATOM 271 N PHE A 18 -1.731 10.782 -8.832 1.00 0.00 N ATOM 272 CA PHE A 18 -2.709 9.934 -8.185 1.00 0.00 C ATOM 273 C PHE A 18 -3.633 10.770 -7.307 1.00 0.00 C ATOM 274 O PHE A 18 -4.852 10.692 -7.430 1.00 0.00 O ATOM 275 CB PHE A 18 -2.027 8.850 -7.348 1.00 0.00 C ATOM 276 CG PHE A 18 -2.999 7.843 -6.822 1.00 0.00 C ATOM 277 CD1 PHE A 18 -3.727 7.071 -7.701 1.00 0.00 C ATOM 278 CD2 PHE A 18 -3.208 7.684 -5.463 1.00 0.00 C ATOM 279 CE1 PHE A 18 -4.643 6.153 -7.250 1.00 0.00 C ATOM 280 CE2 PHE A 18 -4.129 6.766 -4.997 1.00 0.00 C ATOM 281 CZ PHE A 18 -4.848 5.998 -5.893 1.00 0.00 C ATOM 0 H PHE A 18 -0.787 10.709 -8.454 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.300 9.446 -8.960 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.276 8.344 -7.955 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -1.502 9.315 -6.514 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -3.574 7.190 -8.764 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.646 8.283 -4.761 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.201 5.554 -7.954 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -4.287 6.649 -3.935 1.00 0.00 H new ATOM 0 HZ PHE A 18 -5.568 5.278 -5.533 1.00 0.00 H new ATOM 291 N MET A 19 -3.043 11.597 -6.446 1.00 0.00 N ATOM 292 CA MET A 19 -3.815 12.500 -5.596 1.00 0.00 C ATOM 293 C MET A 19 -4.470 13.585 -6.429 1.00 0.00 C ATOM 294 O MET A 19 -5.557 14.047 -6.112 1.00 0.00 O ATOM 295 CB MET A 19 -2.921 13.128 -4.526 1.00 0.00 C ATOM 296 CG MET A 19 -2.876 12.337 -3.225 1.00 0.00 C ATOM 297 SD MET A 19 -2.234 10.664 -3.436 1.00 0.00 S ATOM 298 CE MET A 19 -2.515 9.985 -1.803 1.00 0.00 C ATOM 0 H MET A 19 -2.033 11.660 -6.319 1.00 0.00 H new ATOM 0 HA MET A 19 -4.594 11.919 -5.103 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.909 13.221 -4.920 1.00 0.00 H new ATOM 0 HB3 MET A 19 -3.275 14.137 -4.315 1.00 0.00 H new ATOM 0 HG2 MET A 19 -2.256 12.870 -2.504 1.00 0.00 H new ATOM 0 HG3 MET A 19 -3.880 12.284 -2.804 1.00 0.00 H new ATOM 0 HE1 MET A 19 -2.169 8.952 -1.774 1.00 0.00 H new ATOM 0 HE2 MET A 19 -1.967 10.572 -1.066 1.00 0.00 H new ATOM 0 HE3 MET A 19 -3.580 10.017 -1.574 1.00 0.00 H new ATOM 308 N LYS A 20 -3.809 13.977 -7.503 1.00 0.00 N ATOM 309 CA LYS A 20 -4.341 14.977 -8.405 1.00 0.00 C ATOM 310 C LYS A 20 -5.655 14.488 -8.962 1.00 0.00 C ATOM 311 O LYS A 20 -6.674 15.168 -8.848 1.00 0.00 O ATOM 312 CB LYS A 20 -3.357 15.214 -9.537 1.00 0.00 C ATOM 313 CG LYS A 20 -2.490 16.429 -9.334 1.00 0.00 C ATOM 314 CD LYS A 20 -1.139 16.222 -9.960 1.00 0.00 C ATOM 315 CE LYS A 20 -0.299 17.459 -9.861 1.00 0.00 C ATOM 316 NZ LYS A 20 -0.681 18.492 -10.858 1.00 0.00 N ATOM 0 H LYS A 20 -2.895 13.613 -7.772 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.498 15.913 -7.869 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.720 14.336 -9.644 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.909 15.323 -10.471 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.971 17.303 -9.773 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.377 16.629 -8.268 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.630 15.394 -9.467 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.259 15.944 -11.007 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.391 17.876 -8.858 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.749 17.194 -10.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.047 19.312 -10.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.601 18.096 -11.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.662 18.792 -10.688 1.00 0.00 H new ATOM 330 N ALA A 21 -5.634 13.239 -9.434 1.00 0.00 N ATOM 331 CA ALA A 21 -6.818 12.590 -9.968 1.00 0.00 C ATOM 332 C ALA A 21 -7.785 12.249 -8.848 1.00 0.00 C ATOM 333 O ALA A 21 -8.973 12.004 -9.064 1.00 0.00 O ATOM 334 CB ALA A 21 -6.440 11.356 -10.750 1.00 0.00 C ATOM 0 H ALA A 21 -4.796 12.657 -9.454 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.316 13.280 -10.649 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.341 10.884 -11.142 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.787 11.635 -11.577 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.919 10.657 -10.096 1.00 0.00 H new ATOM 340 N MET A 22 -7.246 12.248 -7.647 1.00 0.00 N ATOM 341 CA MET A 22 -8.019 12.034 -6.434 1.00 0.00 C ATOM 342 C MET A 22 -8.746 13.313 -6.046 1.00 0.00 C ATOM 343 O MET A 22 -9.607 13.322 -5.165 1.00 0.00 O ATOM 344 CB MET A 22 -7.086 11.570 -5.315 1.00 0.00 C ATOM 345 CG MET A 22 -7.090 10.071 -5.130 1.00 0.00 C ATOM 346 SD MET A 22 -6.043 9.527 -3.765 1.00 0.00 S ATOM 347 CE MET A 22 -6.763 10.433 -2.398 1.00 0.00 C ATOM 0 H MET A 22 -6.251 12.397 -7.480 1.00 0.00 H new ATOM 0 HA MET A 22 -8.768 11.262 -6.606 1.00 0.00 H new ATOM 0 HB2 MET A 22 -6.071 11.901 -5.534 1.00 0.00 H new ATOM 0 HB3 MET A 22 -7.382 12.047 -4.381 1.00 0.00 H new ATOM 0 HG2 MET A 22 -8.112 9.735 -4.953 1.00 0.00 H new ATOM 0 HG3 MET A 22 -6.753 9.596 -6.051 1.00 0.00 H new ATOM 0 HE1 MET A 22 -6.497 9.947 -1.459 1.00 0.00 H new ATOM 0 HE2 MET A 22 -6.383 11.455 -2.398 1.00 0.00 H new ATOM 0 HE3 MET A 22 -7.848 10.449 -2.503 1.00 0.00 H new ATOM 357 N GLY A 23 -8.382 14.385 -6.727 1.00 0.00 N ATOM 358 CA GLY A 23 -9.027 15.667 -6.530 1.00 0.00 C ATOM 359 C GLY A 23 -8.152 16.630 -5.761 1.00 0.00 C ATOM 360 O GLY A 23 -8.617 17.671 -5.299 1.00 0.00 O ATOM 0 H GLY A 23 -7.638 14.391 -7.425 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.277 16.099 -7.499 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.965 15.522 -5.994 1.00 0.00 H new ATOM 364 N LEU A 24 -6.886 16.279 -5.610 1.00 0.00 N ATOM 365 CA LEU A 24 -5.968 17.088 -4.821 1.00 0.00 C ATOM 366 C LEU A 24 -5.309 18.145 -5.687 1.00 0.00 C ATOM 367 O LEU A 24 -4.771 17.856 -6.756 1.00 0.00 O ATOM 368 CB LEU A 24 -4.914 16.216 -4.136 1.00 0.00 C ATOM 369 CG LEU A 24 -4.290 16.828 -2.889 1.00 0.00 C ATOM 370 CD1 LEU A 24 -5.343 16.975 -1.804 1.00 0.00 C ATOM 371 CD2 LEU A 24 -3.121 15.991 -2.379 1.00 0.00 C ATOM 0 H LEU A 24 -6.470 15.443 -6.021 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.544 17.589 -4.043 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.370 15.264 -3.867 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.122 15.999 -4.852 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.902 17.812 -3.154 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.890 17.413 -0.915 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.144 17.623 -2.160 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.751 15.995 -1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.700 16.458 -1.488 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.471 14.989 -2.132 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.355 15.927 -3.152 1.00 0.00 H new ATOM 383 N PRO A 25 -5.366 19.387 -5.217 1.00 0.00 N ATOM 384 CA PRO A 25 -4.703 20.513 -5.857 1.00 0.00 C ATOM 385 C PRO A 25 -3.202 20.391 -5.699 1.00 0.00 C ATOM 386 O PRO A 25 -2.726 19.925 -4.670 1.00 0.00 O ATOM 387 CB PRO A 25 -5.205 21.733 -5.091 1.00 0.00 C ATOM 388 CG PRO A 25 -5.870 21.227 -3.860 1.00 0.00 C ATOM 389 CD PRO A 25 -6.069 19.759 -3.993 1.00 0.00 C ATOM 0 HA PRO A 25 -4.914 20.569 -6.925 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.379 22.397 -4.838 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.903 22.310 -5.698 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -5.260 21.448 -2.984 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -6.828 21.726 -3.716 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -5.667 19.227 -3.131 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -7.128 19.509 -4.056 1.00 0.00 H new ATOM 397 N GLU A 26 -2.465 20.795 -6.729 1.00 0.00 N ATOM 398 CA GLU A 26 -1.020 20.644 -6.752 1.00 0.00 C ATOM 399 C GLU A 26 -0.348 21.269 -5.529 1.00 0.00 C ATOM 400 O GLU A 26 0.708 20.811 -5.110 1.00 0.00 O ATOM 401 CB GLU A 26 -0.435 21.215 -8.039 1.00 0.00 C ATOM 402 CG GLU A 26 1.034 20.887 -8.198 1.00 0.00 C ATOM 403 CD GLU A 26 1.553 21.110 -9.599 1.00 0.00 C ATOM 404 OE1 GLU A 26 1.253 20.281 -10.483 1.00 0.00 O ATOM 405 OE2 GLU A 26 2.289 22.087 -9.818 1.00 0.00 O ATOM 0 H GLU A 26 -2.852 21.233 -7.565 1.00 0.00 H new ATOM 0 HA GLU A 26 -0.813 19.574 -6.718 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.987 20.821 -8.892 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.566 22.297 -8.046 1.00 0.00 H new ATOM 0 HG2 GLU A 26 1.612 21.497 -7.504 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.198 19.846 -7.920 1.00 0.00 H new ATOM 412 N ASP A 27 -0.954 22.304 -4.961 1.00 0.00 N ATOM 413 CA ASP A 27 -0.424 22.906 -3.738 1.00 0.00 C ATOM 414 C ASP A 27 -0.503 21.917 -2.579 1.00 0.00 C ATOM 415 O ASP A 27 0.455 21.759 -1.822 1.00 0.00 O ATOM 416 CB ASP A 27 -1.146 24.220 -3.385 1.00 0.00 C ATOM 417 CG ASP A 27 -2.652 24.077 -3.221 1.00 0.00 C ATOM 418 OD1 ASP A 27 -3.109 23.628 -2.153 1.00 0.00 O ATOM 419 OD2 ASP A 27 -3.393 24.446 -4.160 1.00 0.00 O ATOM 0 H ASP A 27 -1.803 22.742 -5.320 1.00 0.00 H new ATOM 0 HA ASP A 27 0.623 23.151 -3.919 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -0.727 24.615 -2.460 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -0.944 24.954 -4.165 1.00 0.00 H new ATOM 424 N LEU A 28 -1.627 21.220 -2.467 1.00 0.00 N ATOM 425 CA LEU A 28 -1.776 20.172 -1.466 1.00 0.00 C ATOM 426 C LEU A 28 -0.982 18.942 -1.881 1.00 0.00 C ATOM 427 O LEU A 28 -0.469 18.203 -1.041 1.00 0.00 O ATOM 428 CB LEU A 28 -3.242 19.817 -1.269 1.00 0.00 C ATOM 429 CG LEU A 28 -4.028 20.808 -0.425 1.00 0.00 C ATOM 430 CD1 LEU A 28 -5.480 20.394 -0.346 1.00 0.00 C ATOM 431 CD2 LEU A 28 -3.427 20.908 0.963 1.00 0.00 C ATOM 0 H LEU A 28 -2.447 21.361 -3.056 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.388 20.541 -0.517 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.717 19.737 -2.247 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.304 18.834 -0.803 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.974 21.789 -0.896 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.031 21.112 0.261 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.905 20.365 -1.349 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.552 19.405 0.107 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.999 21.621 1.557 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.456 19.930 1.443 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -2.393 21.245 0.888 1.00 0.00 H new ATOM 443 N ILE A 29 -0.891 18.747 -3.186 1.00 0.00 N ATOM 444 CA ILE A 29 -0.094 17.695 -3.774 1.00 0.00 C ATOM 445 C ILE A 29 1.362 17.817 -3.360 1.00 0.00 C ATOM 446 O ILE A 29 1.959 16.851 -2.913 1.00 0.00 O ATOM 447 CB ILE A 29 -0.197 17.795 -5.306 1.00 0.00 C ATOM 448 CG1 ILE A 29 -1.467 17.117 -5.782 1.00 0.00 C ATOM 449 CG2 ILE A 29 1.008 17.204 -5.985 1.00 0.00 C ATOM 450 CD1 ILE A 29 -1.386 15.619 -5.789 1.00 0.00 C ATOM 0 H ILE A 29 -1.377 19.325 -3.872 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.469 16.733 -3.426 1.00 0.00 H new ATOM 0 HB ILE A 29 -0.233 18.851 -5.575 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -2.294 17.424 -5.142 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.698 17.464 -6.789 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.897 17.294 -7.066 1.00 0.00 H new ATOM 0 HG22 ILE A 29 1.903 17.738 -5.666 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.098 16.152 -5.716 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.331 15.205 -6.141 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.581 15.301 -6.452 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.187 15.261 -4.779 1.00 0.00 H new ATOM 462 N GLN A 30 1.913 19.016 -3.481 1.00 0.00 N ATOM 463 CA GLN A 30 3.311 19.249 -3.152 1.00 0.00 C ATOM 464 C GLN A 30 3.567 19.057 -1.659 1.00 0.00 C ATOM 465 O GLN A 30 4.678 18.729 -1.247 1.00 0.00 O ATOM 466 CB GLN A 30 3.742 20.656 -3.589 1.00 0.00 C ATOM 467 CG GLN A 30 3.726 20.867 -5.092 1.00 0.00 C ATOM 468 CD GLN A 30 4.410 19.754 -5.865 1.00 0.00 C ATOM 469 OE1 GLN A 30 5.368 19.141 -5.396 1.00 0.00 O ATOM 470 NE2 GLN A 30 3.909 19.481 -7.057 1.00 0.00 N ATOM 0 H GLN A 30 1.412 19.843 -3.805 1.00 0.00 H new ATOM 0 HA GLN A 30 3.907 18.516 -3.695 1.00 0.00 H new ATOM 0 HB2 GLN A 30 3.083 21.388 -3.123 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.748 20.849 -3.216 1.00 0.00 H new ATOM 0 HG2 GLN A 30 2.693 20.951 -5.429 1.00 0.00 H new ATOM 0 HG3 GLN A 30 4.215 21.813 -5.324 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.113 20.013 -7.410 1.00 0.00 H new ATOM 0 HE22 GLN A 30 4.318 18.738 -7.624 1.00 0.00 H new ATOM 479 N LYS A 31 2.530 19.258 -0.857 1.00 0.00 N ATOM 480 CA LYS A 31 2.634 19.097 0.583 1.00 0.00 C ATOM 481 C LYS A 31 2.570 17.632 0.950 1.00 0.00 C ATOM 482 O LYS A 31 3.434 17.110 1.651 1.00 0.00 O ATOM 483 CB LYS A 31 1.525 19.854 1.278 1.00 0.00 C ATOM 484 CG LYS A 31 1.717 21.348 1.208 1.00 0.00 C ATOM 485 CD LYS A 31 0.396 22.049 1.265 1.00 0.00 C ATOM 486 CE LYS A 31 -0.308 21.798 2.583 1.00 0.00 C ATOM 487 NZ LYS A 31 0.436 22.366 3.739 1.00 0.00 N ATOM 0 H LYS A 31 1.604 19.534 -1.183 1.00 0.00 H new ATOM 0 HA LYS A 31 3.592 19.501 0.910 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.570 19.592 0.824 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.477 19.545 2.322 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.347 21.679 2.034 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.236 21.611 0.286 1.00 0.00 H new ATOM 0 HD2 LYS A 31 0.545 23.120 1.129 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.234 21.708 0.444 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -1.307 22.234 2.547 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -0.433 20.725 2.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.171 22.352 4.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.289 21.798 3.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.711 23.346 3.527 1.00 0.00 H new ATOM 501 N GLY A 32 1.532 16.976 0.450 1.00 0.00 N ATOM 502 CA GLY A 32 1.362 15.554 0.662 1.00 0.00 C ATOM 503 C GLY A 32 2.496 14.758 0.056 1.00 0.00 C ATOM 504 O GLY A 32 2.806 13.657 0.505 1.00 0.00 O ATOM 0 H GLY A 32 0.796 17.411 -0.106 1.00 0.00 H new ATOM 0 HA2 GLY A 32 1.305 15.350 1.731 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.417 15.231 0.225 1.00 0.00 H new ATOM 508 N LYS A 33 3.116 15.340 -0.963 1.00 0.00 N ATOM 509 CA LYS A 33 4.177 14.701 -1.723 1.00 0.00 C ATOM 510 C LYS A 33 5.397 14.359 -0.865 1.00 0.00 C ATOM 511 O LYS A 33 6.156 13.445 -1.185 1.00 0.00 O ATOM 512 CB LYS A 33 4.571 15.629 -2.867 1.00 0.00 C ATOM 513 CG LYS A 33 5.787 15.201 -3.613 1.00 0.00 C ATOM 514 CD LYS A 33 5.766 15.779 -5.009 1.00 0.00 C ATOM 515 CE LYS A 33 7.043 16.508 -5.324 1.00 0.00 C ATOM 516 NZ LYS A 33 6.971 17.191 -6.641 1.00 0.00 N ATOM 0 H LYS A 33 2.892 16.281 -1.287 1.00 0.00 H new ATOM 0 HA LYS A 33 3.802 13.752 -2.107 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.737 15.700 -3.565 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.738 16.629 -2.467 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.682 15.532 -3.087 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.830 14.113 -3.661 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.615 14.978 -5.733 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.922 16.462 -5.108 1.00 0.00 H new ATOM 0 HE2 LYS A 33 7.246 17.241 -4.544 1.00 0.00 H new ATOM 0 HE3 LYS A 33 7.875 15.803 -5.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 7.933 17.388 -6.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 6.480 16.579 -7.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.449 18.085 -6.540 1.00 0.00 H new ATOM 530 N ASP A 34 5.567 15.067 0.240 1.00 0.00 N ATOM 531 CA ASP A 34 6.757 14.897 1.069 1.00 0.00 C ATOM 532 C ASP A 34 6.523 13.771 2.055 1.00 0.00 C ATOM 533 O ASP A 34 7.452 13.202 2.630 1.00 0.00 O ATOM 534 CB ASP A 34 7.089 16.193 1.815 1.00 0.00 C ATOM 535 CG ASP A 34 8.365 16.086 2.632 1.00 0.00 C ATOM 536 OD1 ASP A 34 9.457 16.009 2.025 1.00 0.00 O ATOM 537 OD2 ASP A 34 8.287 16.077 3.883 1.00 0.00 O ATOM 0 H ASP A 34 4.903 15.761 0.585 1.00 0.00 H new ATOM 0 HA ASP A 34 7.603 14.651 0.428 1.00 0.00 H new ATOM 0 HB2 ASP A 34 7.189 17.006 1.096 1.00 0.00 H new ATOM 0 HB3 ASP A 34 6.260 16.451 2.474 1.00 0.00 H new ATOM 542 N ILE A 35 5.257 13.462 2.236 1.00 0.00 N ATOM 543 CA ILE A 35 4.831 12.401 3.094 1.00 0.00 C ATOM 544 C ILE A 35 4.886 11.065 2.377 1.00 0.00 C ATOM 545 O ILE A 35 4.208 10.845 1.372 1.00 0.00 O ATOM 546 CB ILE A 35 3.397 12.658 3.570 1.00 0.00 C ATOM 547 CG1 ILE A 35 3.351 13.804 4.580 1.00 0.00 C ATOM 548 CG2 ILE A 35 2.770 11.409 4.145 1.00 0.00 C ATOM 549 CD1 ILE A 35 3.650 15.163 4.010 1.00 0.00 C ATOM 0 H ILE A 35 4.490 13.955 1.779 1.00 0.00 H new ATOM 0 HA ILE A 35 5.506 12.368 3.949 1.00 0.00 H new ATOM 0 HB ILE A 35 2.812 12.949 2.698 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.361 13.827 5.036 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.065 13.595 5.377 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.754 11.629 4.472 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.745 10.630 3.383 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.358 11.065 4.996 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.593 15.910 4.802 1.00 0.00 H new ATOM 0 HD12 ILE A 35 4.652 15.165 3.580 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.922 15.400 3.234 1.00 0.00 H new ATOM 561 N LYS A 36 5.713 10.196 2.895 1.00 0.00 N ATOM 562 CA LYS A 36 5.767 8.826 2.428 1.00 0.00 C ATOM 563 C LYS A 36 5.014 7.931 3.398 1.00 0.00 C ATOM 564 O LYS A 36 4.382 6.948 3.019 1.00 0.00 O ATOM 565 CB LYS A 36 7.212 8.361 2.239 1.00 0.00 C ATOM 566 CG LYS A 36 7.744 8.559 0.822 1.00 0.00 C ATOM 567 CD LYS A 36 7.823 10.029 0.421 1.00 0.00 C ATOM 568 CE LYS A 36 8.793 10.815 1.286 1.00 0.00 C ATOM 569 NZ LYS A 36 10.210 10.624 0.883 1.00 0.00 N ATOM 0 H LYS A 36 6.367 10.411 3.648 1.00 0.00 H new ATOM 0 HA LYS A 36 5.287 8.764 1.451 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.852 8.902 2.936 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.280 7.304 2.498 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.735 8.112 0.745 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.100 8.029 0.120 1.00 0.00 H new ATOM 0 HD2 LYS A 36 8.130 10.102 -0.622 1.00 0.00 H new ATOM 0 HD3 LYS A 36 6.832 10.476 0.494 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.544 11.875 1.231 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.672 10.512 2.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.801 10.518 1.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.292 9.770 0.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.531 11.450 0.339 1.00 0.00 H new ATOM 583 N GLY A 37 5.071 8.316 4.653 1.00 0.00 N ATOM 584 CA GLY A 37 4.321 7.634 5.684 1.00 0.00 C ATOM 585 C GLY A 37 5.022 6.397 6.204 1.00 0.00 C ATOM 586 O GLY A 37 5.998 5.926 5.619 1.00 0.00 O ATOM 0 H GLY A 37 5.631 9.101 4.985 1.00 0.00 H new ATOM 0 HA2 GLY A 37 4.145 8.321 6.512 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.344 7.353 5.290 1.00 0.00 H new ATOM 590 N VAL A 38 4.529 5.874 7.313 1.00 0.00 N ATOM 591 CA VAL A 38 5.079 4.663 7.889 1.00 0.00 C ATOM 592 C VAL A 38 4.138 3.490 7.645 1.00 0.00 C ATOM 593 O VAL A 38 2.920 3.623 7.793 1.00 0.00 O ATOM 594 CB VAL A 38 5.325 4.833 9.397 1.00 0.00 C ATOM 595 CG1 VAL A 38 5.982 3.597 9.991 1.00 0.00 C ATOM 596 CG2 VAL A 38 6.184 6.056 9.617 1.00 0.00 C ATOM 0 H VAL A 38 3.747 6.272 7.833 1.00 0.00 H new ATOM 0 HA VAL A 38 6.035 4.462 7.406 1.00 0.00 H new ATOM 0 HB VAL A 38 4.368 4.963 9.903 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.143 3.748 11.058 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.335 2.733 9.840 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.940 3.423 9.501 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.365 6.186 10.684 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.135 5.930 9.100 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.672 6.935 9.226 1.00 0.00 H new ATOM 606 N SER A 39 4.698 2.361 7.250 1.00 0.00 N ATOM 607 CA SER A 39 3.915 1.169 6.989 1.00 0.00 C ATOM 608 C SER A 39 4.307 0.058 7.959 1.00 0.00 C ATOM 609 O SER A 39 5.439 -0.002 8.401 1.00 0.00 O ATOM 610 CB SER A 39 4.127 0.712 5.547 1.00 0.00 C ATOM 611 OG SER A 39 3.793 1.741 4.630 1.00 0.00 O ATOM 0 H SER A 39 5.701 2.246 7.102 1.00 0.00 H new ATOM 0 HA SER A 39 2.860 1.400 7.134 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.167 0.418 5.405 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.516 -0.169 5.348 1.00 0.00 H new ATOM 0 HG SER A 39 3.939 1.423 3.714 1.00 0.00 H new ATOM 617 N GLU A 40 3.364 -0.791 8.319 1.00 0.00 N ATOM 618 CA GLU A 40 3.662 -1.949 9.150 1.00 0.00 C ATOM 619 C GLU A 40 3.239 -3.213 8.425 1.00 0.00 C ATOM 620 O GLU A 40 2.099 -3.322 7.978 1.00 0.00 O ATOM 621 CB GLU A 40 2.925 -1.866 10.485 1.00 0.00 C ATOM 622 CG GLU A 40 3.343 -2.944 11.471 1.00 0.00 C ATOM 623 CD GLU A 40 2.239 -3.303 12.448 1.00 0.00 C ATOM 624 OE1 GLU A 40 1.220 -2.582 12.493 1.00 0.00 O ATOM 625 OE2 GLU A 40 2.379 -4.311 13.175 1.00 0.00 O ATOM 0 H GLU A 40 2.384 -0.704 8.051 1.00 0.00 H new ATOM 0 HA GLU A 40 4.735 -1.967 9.344 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.104 -0.887 10.930 1.00 0.00 H new ATOM 0 HB3 GLU A 40 1.853 -1.944 10.305 1.00 0.00 H new ATOM 0 HG2 GLU A 40 3.641 -3.837 10.922 1.00 0.00 H new ATOM 0 HG3 GLU A 40 4.217 -2.604 12.026 1.00 0.00 H new ATOM 632 N ILE A 41 4.153 -4.160 8.299 1.00 0.00 N ATOM 633 CA ILE A 41 3.874 -5.390 7.578 1.00 0.00 C ATOM 634 C ILE A 41 4.151 -6.596 8.461 1.00 0.00 C ATOM 635 O ILE A 41 5.298 -6.865 8.792 1.00 0.00 O ATOM 636 CB ILE A 41 4.763 -5.509 6.326 1.00 0.00 C ATOM 637 CG1 ILE A 41 4.890 -4.163 5.619 1.00 0.00 C ATOM 638 CG2 ILE A 41 4.222 -6.563 5.379 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.598 -3.649 5.043 1.00 0.00 C ATOM 0 H ILE A 41 5.095 -4.101 8.687 1.00 0.00 H new ATOM 0 HA ILE A 41 2.824 -5.364 7.286 1.00 0.00 H new ATOM 0 HB ILE A 41 5.758 -5.818 6.647 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.279 -3.429 6.325 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.623 -4.253 4.817 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.866 -6.629 4.502 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.197 -7.528 5.885 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.213 -6.290 5.069 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.773 -2.689 4.558 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.217 -4.361 4.311 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.867 -3.524 5.842 1.00 0.00 H new ATOM 651 N VAL A 42 3.118 -7.335 8.815 1.00 0.00 N ATOM 652 CA VAL A 42 3.288 -8.540 9.617 1.00 0.00 C ATOM 653 C VAL A 42 2.596 -9.707 8.939 1.00 0.00 C ATOM 654 O VAL A 42 1.379 -9.732 8.833 1.00 0.00 O ATOM 655 CB VAL A 42 2.723 -8.376 11.040 1.00 0.00 C ATOM 656 CG1 VAL A 42 3.049 -9.599 11.875 1.00 0.00 C ATOM 657 CG2 VAL A 42 3.258 -7.115 11.694 1.00 0.00 C ATOM 0 H VAL A 42 2.152 -7.126 8.563 1.00 0.00 H new ATOM 0 HA VAL A 42 4.359 -8.727 9.700 1.00 0.00 H new ATOM 0 HB VAL A 42 1.639 -8.281 10.973 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.645 -9.472 12.879 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.607 -10.482 11.415 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.130 -9.723 11.932 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.844 -7.022 12.698 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.345 -7.169 11.753 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.970 -6.247 11.101 1.00 0.00 H new ATOM 667 N HIS A 43 3.364 -10.677 8.487 1.00 0.00 N ATOM 668 CA HIS A 43 2.795 -11.752 7.692 1.00 0.00 C ATOM 669 C HIS A 43 2.705 -13.040 8.501 1.00 0.00 C ATOM 670 O HIS A 43 3.709 -13.665 8.834 1.00 0.00 O ATOM 671 CB HIS A 43 3.618 -11.906 6.401 1.00 0.00 C ATOM 672 CG HIS A 43 3.455 -13.198 5.655 1.00 0.00 C ATOM 673 ND1 HIS A 43 4.505 -13.812 5.002 1.00 0.00 N ATOM 674 CD2 HIS A 43 2.362 -13.951 5.389 1.00 0.00 C ATOM 675 CE1 HIS A 43 4.062 -14.876 4.368 1.00 0.00 C ATOM 676 NE2 HIS A 43 2.769 -14.983 4.585 1.00 0.00 N ATOM 0 H HIS A 43 4.368 -10.746 8.651 1.00 0.00 H new ATOM 0 HA HIS A 43 1.771 -11.509 7.410 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.356 -11.088 5.729 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.672 -11.787 6.652 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.358 -13.772 5.744 1.00 0.00 H new ATOM 0 HE1 HIS A 43 4.659 -15.548 3.770 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.166 -15.717 4.214 1.00 0.00 H new ATOM 685 N GLU A 44 1.474 -13.412 8.801 1.00 0.00 N ATOM 686 CA GLU A 44 1.157 -14.617 9.520 1.00 0.00 C ATOM 687 C GLU A 44 0.666 -15.706 8.571 1.00 0.00 C ATOM 688 O GLU A 44 -0.453 -15.627 8.068 1.00 0.00 O ATOM 689 CB GLU A 44 0.071 -14.272 10.515 1.00 0.00 C ATOM 690 CG GLU A 44 -0.260 -15.380 11.468 1.00 0.00 C ATOM 691 CD GLU A 44 -1.633 -15.978 11.232 1.00 0.00 C ATOM 692 OE1 GLU A 44 -1.766 -16.866 10.367 1.00 0.00 O ATOM 693 OE2 GLU A 44 -2.593 -15.563 11.918 1.00 0.00 O ATOM 0 H GLU A 44 0.652 -12.866 8.542 1.00 0.00 H new ATOM 0 HA GLU A 44 2.045 -14.999 10.023 1.00 0.00 H new ATOM 0 HB2 GLU A 44 0.381 -13.397 11.086 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.831 -13.994 9.970 1.00 0.00 H new ATOM 0 HG2 GLU A 44 0.491 -16.164 11.379 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.206 -15.001 12.489 1.00 0.00 H new ATOM 700 N GLY A 45 1.506 -16.709 8.328 1.00 0.00 N ATOM 701 CA GLY A 45 1.121 -17.828 7.476 1.00 0.00 C ATOM 702 C GLY A 45 0.781 -17.404 6.057 1.00 0.00 C ATOM 703 O GLY A 45 1.655 -17.341 5.197 1.00 0.00 O ATOM 0 H GLY A 45 2.451 -16.769 8.707 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.935 -18.553 7.448 1.00 0.00 H new ATOM 0 HA3 GLY A 45 0.260 -18.332 7.915 1.00 0.00 H new ATOM 707 N LYS A 46 -0.499 -17.149 5.817 1.00 0.00 N ATOM 708 CA LYS A 46 -0.975 -16.592 4.557 1.00 0.00 C ATOM 709 C LYS A 46 -1.236 -15.112 4.694 1.00 0.00 C ATOM 710 O LYS A 46 -0.824 -14.307 3.867 1.00 0.00 O ATOM 711 CB LYS A 46 -2.258 -17.263 4.131 1.00 0.00 C ATOM 712 CG LYS A 46 -2.046 -18.404 3.161 1.00 0.00 C ATOM 713 CD LYS A 46 -1.442 -19.634 3.829 1.00 0.00 C ATOM 714 CE LYS A 46 -2.336 -20.179 4.937 1.00 0.00 C ATOM 715 NZ LYS A 46 -1.814 -21.459 5.492 1.00 0.00 N ATOM 0 H LYS A 46 -1.241 -17.324 6.495 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.201 -16.763 3.809 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.774 -17.638 5.015 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.912 -16.522 3.671 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.000 -18.673 2.707 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.391 -18.074 2.355 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.279 -20.409 3.081 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.466 -19.380 4.243 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -2.414 -19.442 5.736 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.342 -20.335 4.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.450 -21.797 6.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.763 -22.170 4.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.864 -21.305 5.886 1.00 0.00 H new ATOM 729 N LYS A 47 -1.903 -14.765 5.764 1.00 0.00 N ATOM 730 CA LYS A 47 -2.369 -13.414 5.967 1.00 0.00 C ATOM 731 C LYS A 47 -1.225 -12.479 6.288 1.00 0.00 C ATOM 732 O LYS A 47 -0.366 -12.774 7.106 1.00 0.00 O ATOM 733 CB LYS A 47 -3.366 -13.386 7.110 1.00 0.00 C ATOM 734 CG LYS A 47 -4.323 -14.554 7.096 1.00 0.00 C ATOM 735 CD LYS A 47 -5.420 -14.352 8.101 1.00 0.00 C ATOM 736 CE LYS A 47 -4.893 -14.393 9.525 1.00 0.00 C ATOM 737 NZ LYS A 47 -4.430 -15.755 9.900 1.00 0.00 N ATOM 0 H LYS A 47 -2.139 -15.408 6.519 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.842 -13.079 5.044 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.824 -13.380 8.056 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.936 -12.458 7.064 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.751 -14.668 6.100 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.784 -15.475 7.318 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.907 -13.393 7.921 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.179 -15.124 7.972 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.069 -13.687 9.629 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -5.676 -14.072 10.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.030 -15.734 10.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.234 -16.414 9.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -3.701 -16.071 9.229 1.00 0.00 H new ATOM 751 N VAL A 48 -1.228 -11.352 5.620 1.00 0.00 N ATOM 752 CA VAL A 48 -0.219 -10.350 5.809 1.00 0.00 C ATOM 753 C VAL A 48 -0.887 -9.067 6.290 1.00 0.00 C ATOM 754 O VAL A 48 -1.894 -8.635 5.725 1.00 0.00 O ATOM 755 CB VAL A 48 0.554 -10.080 4.504 1.00 0.00 C ATOM 756 CG1 VAL A 48 1.678 -9.085 4.744 1.00 0.00 C ATOM 757 CG2 VAL A 48 1.097 -11.369 3.901 1.00 0.00 C ATOM 0 H VAL A 48 -1.936 -11.107 4.928 1.00 0.00 H new ATOM 0 HA VAL A 48 0.496 -10.706 6.550 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.145 -9.648 3.788 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.212 -8.907 3.811 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.261 -8.146 5.108 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.368 -9.487 5.486 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.637 -11.142 2.982 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.773 -11.846 4.610 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.270 -12.043 3.679 1.00 0.00 H new ATOM 767 N LYS A 49 -0.351 -8.482 7.340 1.00 0.00 N ATOM 768 CA LYS A 49 -0.894 -7.262 7.889 1.00 0.00 C ATOM 769 C LYS A 49 -0.258 -6.044 7.224 1.00 0.00 C ATOM 770 O LYS A 49 0.958 -6.015 7.023 1.00 0.00 O ATOM 771 CB LYS A 49 -0.634 -7.206 9.383 1.00 0.00 C ATOM 772 CG LYS A 49 -1.033 -5.882 9.986 1.00 0.00 C ATOM 773 CD LYS A 49 -0.225 -5.543 11.226 1.00 0.00 C ATOM 774 CE LYS A 49 -0.381 -6.581 12.320 1.00 0.00 C ATOM 775 NZ LYS A 49 0.276 -6.149 13.583 1.00 0.00 N ATOM 0 H LYS A 49 0.468 -8.837 7.833 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.968 -7.251 7.701 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.185 -8.007 9.875 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.425 -7.384 9.572 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.903 -5.094 9.244 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.092 -5.907 10.242 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.828 -5.457 10.958 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.538 -4.570 11.605 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.440 -6.761 12.503 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.050 -7.526 11.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.664 -6.980 14.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.046 -5.486 13.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.422 -5.679 14.194 1.00 0.00 H new ATOM 789 N LEU A 50 -1.076 -5.053 6.885 1.00 0.00 N ATOM 790 CA LEU A 50 -0.585 -3.796 6.335 1.00 0.00 C ATOM 791 C LEU A 50 -1.157 -2.610 7.106 1.00 0.00 C ATOM 792 O LEU A 50 -2.372 -2.388 7.122 1.00 0.00 O ATOM 793 CB LEU A 50 -0.951 -3.660 4.854 1.00 0.00 C ATOM 794 CG LEU A 50 0.200 -3.840 3.858 1.00 0.00 C ATOM 795 CD1 LEU A 50 0.822 -5.218 3.982 1.00 0.00 C ATOM 796 CD2 LEU A 50 -0.284 -3.594 2.437 1.00 0.00 C ATOM 0 H LEU A 50 -2.090 -5.098 6.983 1.00 0.00 H new ATOM 0 HA LEU A 50 0.501 -3.800 6.431 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.724 -4.393 4.622 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.390 -2.674 4.698 1.00 0.00 H new ATOM 0 HG LEU A 50 0.970 -3.105 4.095 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.635 -5.316 3.263 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.212 -5.352 4.991 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.067 -5.978 3.781 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.545 -3.726 1.742 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.076 -4.302 2.195 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.668 -2.577 2.354 1.00 0.00 H new ATOM 808 N THR A 51 -0.285 -1.872 7.764 1.00 0.00 N ATOM 809 CA THR A 51 -0.656 -0.613 8.377 1.00 0.00 C ATOM 810 C THR A 51 0.010 0.515 7.606 1.00 0.00 C ATOM 811 O THR A 51 1.228 0.593 7.574 1.00 0.00 O ATOM 812 CB THR A 51 -0.203 -0.542 9.845 1.00 0.00 C ATOM 813 OG1 THR A 51 -0.470 -1.785 10.510 1.00 0.00 O ATOM 814 CG2 THR A 51 -0.918 0.589 10.554 1.00 0.00 C ATOM 0 H THR A 51 0.695 -2.126 7.888 1.00 0.00 H new ATOM 0 HA THR A 51 -1.742 -0.524 8.351 1.00 0.00 H new ATOM 0 HB THR A 51 0.871 -0.355 9.871 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.418 -1.827 10.756 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.591 0.632 11.593 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.685 1.533 10.061 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.994 0.418 10.519 1.00 0.00 H new ATOM 822 N ILE A 52 -0.762 1.381 6.974 1.00 0.00 N ATOM 823 CA ILE A 52 -0.170 2.392 6.113 1.00 0.00 C ATOM 824 C ILE A 52 -0.679 3.785 6.462 1.00 0.00 C ATOM 825 O ILE A 52 -1.884 4.008 6.569 1.00 0.00 O ATOM 826 CB ILE A 52 -0.441 2.135 4.607 1.00 0.00 C ATOM 827 CG1 ILE A 52 -0.307 0.649 4.247 1.00 0.00 C ATOM 828 CG2 ILE A 52 0.512 2.963 3.753 1.00 0.00 C ATOM 829 CD1 ILE A 52 -1.582 -0.139 4.448 1.00 0.00 C ATOM 0 H ILE A 52 -1.780 1.407 7.037 1.00 0.00 H new ATOM 0 HA ILE A 52 0.904 2.330 6.288 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.469 2.435 4.403 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.004 0.562 3.206 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.483 0.207 4.853 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.312 2.774 2.698 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.365 4.022 3.966 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.541 2.686 3.983 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.413 -1.180 4.174 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.883 -0.083 5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.370 0.278 3.821 1.00 0.00 H new ATOM 841 N THR A 53 0.247 4.716 6.644 1.00 0.00 N ATOM 842 CA THR A 53 -0.106 6.105 6.882 1.00 0.00 C ATOM 843 C THR A 53 -0.038 6.902 5.583 1.00 0.00 C ATOM 844 O THR A 53 1.012 6.977 4.940 1.00 0.00 O ATOM 845 CB THR A 53 0.844 6.751 7.902 1.00 0.00 C ATOM 846 OG1 THR A 53 1.130 5.818 8.951 1.00 0.00 O ATOM 847 CG2 THR A 53 0.228 8.010 8.495 1.00 0.00 C ATOM 0 H THR A 53 1.250 4.532 6.631 1.00 0.00 H new ATOM 0 HA THR A 53 -1.122 6.120 7.276 1.00 0.00 H new ATOM 0 HB THR A 53 1.766 7.025 7.389 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.753 5.137 8.622 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.919 8.449 9.214 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.028 8.727 7.699 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.706 7.756 8.997 1.00 0.00 H new ATOM 855 N TYR A 54 -1.160 7.478 5.191 1.00 0.00 N ATOM 856 CA TYR A 54 -1.191 8.392 4.070 1.00 0.00 C ATOM 857 C TYR A 54 -1.426 9.794 4.597 1.00 0.00 C ATOM 858 O TYR A 54 -2.563 10.185 4.870 1.00 0.00 O ATOM 859 CB TYR A 54 -2.315 8.018 3.098 1.00 0.00 C ATOM 860 CG TYR A 54 -2.271 6.584 2.619 1.00 0.00 C ATOM 861 CD1 TYR A 54 -1.551 6.233 1.490 1.00 0.00 C ATOM 862 CD2 TYR A 54 -2.966 5.585 3.292 1.00 0.00 C ATOM 863 CE1 TYR A 54 -1.519 4.928 1.038 1.00 0.00 C ATOM 864 CE2 TYR A 54 -2.937 4.278 2.850 1.00 0.00 C ATOM 865 CZ TYR A 54 -2.214 3.955 1.723 1.00 0.00 C ATOM 866 OH TYR A 54 -2.190 2.654 1.277 1.00 0.00 O ATOM 0 H TYR A 54 -2.065 7.326 5.637 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.242 8.339 3.536 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -3.274 8.197 3.584 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.267 8.680 2.233 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -1.004 6.994 0.953 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -3.537 5.836 4.174 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -0.953 4.672 0.154 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.479 3.512 3.385 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.730 2.094 1.873 1.00 0.00 H new ATOM 876 N GLY A 55 -0.350 10.547 4.738 1.00 0.00 N ATOM 877 CA GLY A 55 -0.459 11.881 5.286 1.00 0.00 C ATOM 878 C GLY A 55 -0.890 11.836 6.734 1.00 0.00 C ATOM 879 O GLY A 55 -0.123 11.420 7.603 1.00 0.00 O ATOM 0 H GLY A 55 0.595 10.261 4.484 1.00 0.00 H new ATOM 0 HA2 GLY A 55 0.500 12.392 5.204 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.179 12.459 4.706 1.00 0.00 H new ATOM 883 N SER A 56 -2.122 12.243 6.995 1.00 0.00 N ATOM 884 CA SER A 56 -2.671 12.191 8.338 1.00 0.00 C ATOM 885 C SER A 56 -3.585 10.978 8.513 1.00 0.00 C ATOM 886 O SER A 56 -3.999 10.655 9.629 1.00 0.00 O ATOM 887 CB SER A 56 -3.428 13.485 8.635 1.00 0.00 C ATOM 888 OG SER A 56 -4.319 13.809 7.581 1.00 0.00 O ATOM 0 H SER A 56 -2.761 12.614 6.292 1.00 0.00 H new ATOM 0 HA SER A 56 -1.849 12.089 9.046 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.985 13.379 9.566 1.00 0.00 H new ATOM 0 HB3 SER A 56 -2.719 14.300 8.779 1.00 0.00 H new ATOM 0 HG SER A 56 -4.792 14.640 7.796 1.00 0.00 H new ATOM 894 N LYS A 57 -3.888 10.297 7.412 1.00 0.00 N ATOM 895 CA LYS A 57 -4.776 9.161 7.440 1.00 0.00 C ATOM 896 C LYS A 57 -3.983 7.886 7.671 1.00 0.00 C ATOM 897 O LYS A 57 -2.893 7.718 7.137 1.00 0.00 O ATOM 898 CB LYS A 57 -5.492 9.040 6.112 1.00 0.00 C ATOM 899 CG LYS A 57 -6.916 8.554 6.216 1.00 0.00 C ATOM 900 CD LYS A 57 -7.869 9.673 6.586 1.00 0.00 C ATOM 901 CE LYS A 57 -7.703 10.839 5.642 1.00 0.00 C ATOM 902 NZ LYS A 57 -8.318 10.586 4.308 1.00 0.00 N ATOM 0 H LYS A 57 -3.523 10.522 6.486 1.00 0.00 H new ATOM 0 HA LYS A 57 -5.496 9.303 8.246 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.488 10.013 5.620 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.933 8.357 5.472 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.221 8.117 5.265 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.976 7.764 6.964 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.897 9.311 6.550 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.681 9.996 7.610 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -8.155 11.727 6.084 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -6.641 11.051 5.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -8.177 11.416 3.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -7.870 9.755 3.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.337 10.410 4.423 1.00 0.00 H new ATOM 916 N VAL A 58 -4.535 7.001 8.462 1.00 0.00 N ATOM 917 CA VAL A 58 -3.912 5.716 8.733 1.00 0.00 C ATOM 918 C VAL A 58 -4.881 4.587 8.425 1.00 0.00 C ATOM 919 O VAL A 58 -5.951 4.498 9.023 1.00 0.00 O ATOM 920 CB VAL A 58 -3.440 5.606 10.193 1.00 0.00 C ATOM 921 CG1 VAL A 58 -2.585 4.368 10.389 1.00 0.00 C ATOM 922 CG2 VAL A 58 -2.688 6.862 10.591 1.00 0.00 C ATOM 0 H VAL A 58 -5.426 7.143 8.938 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.037 5.636 8.088 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.312 5.509 10.839 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.262 4.310 11.428 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.167 3.481 10.140 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.711 4.423 9.740 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -2.357 6.776 11.626 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -1.821 6.988 9.943 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.345 7.726 10.491 1.00 0.00 H new ATOM 932 N ILE A 59 -4.513 3.740 7.482 1.00 0.00 N ATOM 933 CA ILE A 59 -5.341 2.609 7.111 1.00 0.00 C ATOM 934 C ILE A 59 -4.696 1.306 7.576 1.00 0.00 C ATOM 935 O ILE A 59 -3.537 1.029 7.264 1.00 0.00 O ATOM 936 CB ILE A 59 -5.579 2.568 5.582 1.00 0.00 C ATOM 937 CG1 ILE A 59 -6.218 3.874 5.117 1.00 0.00 C ATOM 938 CG2 ILE A 59 -6.475 1.419 5.216 1.00 0.00 C ATOM 939 CD1 ILE A 59 -6.462 3.947 3.623 1.00 0.00 C ATOM 0 H ILE A 59 -3.642 3.815 6.957 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.307 2.724 7.602 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.615 2.437 5.090 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.167 4.006 5.636 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.576 4.705 5.410 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.630 1.408 4.137 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.011 0.483 5.526 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.435 1.532 5.719 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.918 4.906 3.375 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.514 3.848 3.094 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -7.130 3.139 3.324 1.00 0.00 H new ATOM 951 N HIS A 60 -5.445 0.523 8.339 1.00 0.00 N ATOM 952 CA HIS A 60 -4.951 -0.745 8.853 1.00 0.00 C ATOM 953 C HIS A 60 -5.798 -1.888 8.319 1.00 0.00 C ATOM 954 O HIS A 60 -7.000 -1.942 8.569 1.00 0.00 O ATOM 955 CB HIS A 60 -4.982 -0.741 10.389 1.00 0.00 C ATOM 956 CG HIS A 60 -4.456 -1.999 11.015 1.00 0.00 C ATOM 957 ND1 HIS A 60 -3.207 -2.503 11.056 1.00 0.00 N flip ATOM 958 CD2 HIS A 60 -5.243 -2.885 11.718 1.00 0.00 C flip ATOM 959 CE1 HIS A 60 -3.251 -3.670 11.778 1.00 0.00 C flip ATOM 960 NE2 HIS A 60 -4.495 -3.876 12.164 1.00 0.00 N flip ATOM 0 H HIS A 60 -6.401 0.745 8.616 1.00 0.00 H new ATOM 0 HA HIS A 60 -3.922 -0.882 8.522 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -4.397 0.105 10.751 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -6.008 -0.584 10.721 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -6.306 -2.784 11.879 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -2.409 -4.311 11.993 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -4.824 -4.669 12.715 1.00 0.00 H new ATOM 969 N ASN A 61 -5.173 -2.802 7.592 1.00 0.00 N ATOM 970 CA ASN A 61 -5.878 -3.948 7.038 1.00 0.00 C ATOM 971 C ASN A 61 -4.995 -5.172 7.077 1.00 0.00 C ATOM 972 O ASN A 61 -3.781 -5.077 6.913 1.00 0.00 O ATOM 973 CB ASN A 61 -6.314 -3.692 5.590 1.00 0.00 C ATOM 974 CG ASN A 61 -7.614 -2.917 5.485 1.00 0.00 C ATOM 975 OD1 ASN A 61 -8.699 -3.499 5.456 1.00 0.00 O ATOM 976 ND2 ASN A 61 -7.516 -1.602 5.406 1.00 0.00 N ATOM 0 H ASN A 61 -4.178 -2.772 7.372 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.767 -4.111 7.647 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.528 -3.142 5.073 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.426 -4.647 5.077 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.357 -1.032 5.318 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.599 -1.156 5.434 1.00 0.00 H new ATOM 983 N GLU A 62 -5.601 -6.315 7.312 1.00 0.00 N ATOM 984 CA GLU A 62 -4.891 -7.569 7.235 1.00 0.00 C ATOM 985 C GLU A 62 -5.597 -8.451 6.228 1.00 0.00 C ATOM 986 O GLU A 62 -6.828 -8.473 6.164 1.00 0.00 O ATOM 987 CB GLU A 62 -4.831 -8.241 8.598 1.00 0.00 C ATOM 988 CG GLU A 62 -3.718 -9.264 8.732 1.00 0.00 C ATOM 989 CD GLU A 62 -3.872 -10.120 9.971 1.00 0.00 C ATOM 990 OE1 GLU A 62 -4.576 -11.149 9.898 1.00 0.00 O ATOM 991 OE2 GLU A 62 -3.311 -9.752 11.029 1.00 0.00 O ATOM 0 H GLU A 62 -6.587 -6.400 7.559 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.863 -7.395 6.917 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.702 -7.476 9.364 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.786 -8.730 8.793 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.707 -9.904 7.850 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.757 -8.750 8.765 1.00 0.00 H new ATOM 998 N PHE A 63 -4.829 -9.177 5.453 1.00 0.00 N ATOM 999 CA PHE A 63 -5.377 -9.891 4.311 1.00 0.00 C ATOM 1000 C PHE A 63 -4.746 -11.260 4.175 1.00 0.00 C ATOM 1001 O PHE A 63 -3.581 -11.432 4.484 1.00 0.00 O ATOM 1002 CB PHE A 63 -5.166 -9.072 3.034 1.00 0.00 C ATOM 1003 CG PHE A 63 -3.759 -8.560 2.848 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -2.746 -9.379 2.366 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -3.460 -7.252 3.159 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -1.466 -8.895 2.198 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -2.176 -6.758 2.993 1.00 0.00 C ATOM 1008 CZ PHE A 63 -1.180 -7.583 2.511 1.00 0.00 C ATOM 0 H PHE A 63 -3.824 -9.293 5.586 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.446 -10.030 4.470 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.433 -9.687 2.174 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.850 -8.224 3.044 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.964 -10.408 2.120 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.236 -6.603 3.537 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.688 -9.543 1.822 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.955 -5.730 3.240 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.178 -7.202 2.379 1.00 0.00 H new ATOM 1018 N THR A 64 -5.510 -12.216 3.681 1.00 0.00 N ATOM 1019 CA THR A 64 -5.067 -13.598 3.629 1.00 0.00 C ATOM 1020 C THR A 64 -4.590 -13.958 2.223 1.00 0.00 C ATOM 1021 O THR A 64 -5.249 -13.651 1.231 1.00 0.00 O ATOM 1022 CB THR A 64 -6.210 -14.542 4.009 1.00 0.00 C ATOM 1023 OG1 THR A 64 -6.913 -14.028 5.149 1.00 0.00 O ATOM 1024 CG2 THR A 64 -5.685 -15.930 4.322 1.00 0.00 C ATOM 0 H THR A 64 -6.446 -12.060 3.308 1.00 0.00 H new ATOM 0 HA THR A 64 -4.245 -13.708 4.336 1.00 0.00 H new ATOM 0 HB THR A 64 -6.890 -14.610 3.160 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.644 -14.637 5.385 1.00 0.00 H new ATOM 0 HG21 THR A 64 -6.517 -16.582 4.589 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.175 -16.332 3.446 1.00 0.00 H new ATOM 0 HG23 THR A 64 -4.985 -15.875 5.156 1.00 0.00 H new ATOM 1032 N LEU A 65 -3.440 -14.603 2.156 1.00 0.00 N ATOM 1033 CA LEU A 65 -2.842 -15.020 0.900 1.00 0.00 C ATOM 1034 C LEU A 65 -3.652 -16.100 0.203 1.00 0.00 C ATOM 1035 O LEU A 65 -3.907 -17.164 0.767 1.00 0.00 O ATOM 1036 CB LEU A 65 -1.453 -15.543 1.184 1.00 0.00 C ATOM 1037 CG LEU A 65 -0.306 -14.609 0.831 1.00 0.00 C ATOM 1038 CD1 LEU A 65 0.300 -15.072 -0.467 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -0.781 -13.176 0.686 1.00 0.00 C ATOM 0 H LEU A 65 -2.890 -14.854 2.977 1.00 0.00 H new ATOM 0 HA LEU A 65 -2.813 -14.157 0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.386 -15.784 2.245 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.318 -16.476 0.636 1.00 0.00 H new ATOM 0 HG LEU A 65 0.430 -14.635 1.634 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.126 -14.414 -0.738 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.670 -16.091 -0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.457 -15.047 -1.251 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.065 -12.536 0.434 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.528 -13.119 -0.105 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.221 -12.842 1.626 1.00 0.00 H new ATOM 1051 N GLY A 66 -4.061 -15.811 -1.024 1.00 0.00 N ATOM 1052 CA GLY A 66 -4.768 -16.779 -1.832 1.00 0.00 C ATOM 1053 C GLY A 66 -6.184 -16.962 -1.372 1.00 0.00 C ATOM 1054 O GLY A 66 -6.958 -17.700 -1.980 1.00 0.00 O ATOM 0 H GLY A 66 -3.912 -14.910 -1.478 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.763 -16.456 -2.873 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.247 -17.735 -1.792 1.00 0.00 H new ATOM 1058 N GLU A 67 -6.519 -16.280 -0.300 1.00 0.00 N ATOM 1059 CA GLU A 67 -7.803 -16.429 0.318 1.00 0.00 C ATOM 1060 C GLU A 67 -8.557 -15.111 0.248 1.00 0.00 C ATOM 1061 O GLU A 67 -7.959 -14.040 0.346 1.00 0.00 O ATOM 1062 CB GLU A 67 -7.642 -16.913 1.764 1.00 0.00 C ATOM 1063 CG GLU A 67 -8.957 -17.120 2.495 1.00 0.00 C ATOM 1064 CD GLU A 67 -8.792 -17.751 3.863 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -8.186 -18.839 3.955 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -9.285 -17.167 4.851 1.00 0.00 O ATOM 0 H GLU A 67 -5.905 -15.609 0.162 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.383 -17.181 -0.217 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.087 -17.851 1.763 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.042 -16.188 2.314 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.459 -16.158 2.605 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.606 -17.751 1.888 1.00 0.00 H new ATOM 1073 N GLU A 68 -9.861 -15.192 0.056 1.00 0.00 N ATOM 1074 CA GLU A 68 -10.678 -14.004 -0.091 1.00 0.00 C ATOM 1075 C GLU A 68 -10.773 -13.272 1.244 1.00 0.00 C ATOM 1076 O GLU A 68 -11.297 -13.797 2.228 1.00 0.00 O ATOM 1077 CB GLU A 68 -12.060 -14.391 -0.635 1.00 0.00 C ATOM 1078 CG GLU A 68 -13.073 -13.281 -0.640 1.00 0.00 C ATOM 1079 CD GLU A 68 -14.171 -13.482 0.384 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -15.185 -14.131 0.043 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -14.026 -13.009 1.527 1.00 0.00 O ATOM 0 H GLU A 68 -10.377 -16.070 -0.002 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.219 -13.323 -0.807 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.943 -14.760 -1.654 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.450 -15.216 -0.040 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.569 -12.335 -0.444 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -13.518 -13.206 -1.632 1.00 0.00 H new ATOM 1088 N CYS A 69 -10.214 -12.072 1.261 1.00 0.00 N ATOM 1089 CA CYS A 69 -10.150 -11.238 2.443 1.00 0.00 C ATOM 1090 C CYS A 69 -10.823 -9.912 2.174 1.00 0.00 C ATOM 1091 O CYS A 69 -10.964 -9.504 1.037 1.00 0.00 O ATOM 1092 CB CYS A 69 -8.699 -11.006 2.843 1.00 0.00 C ATOM 1093 SG CYS A 69 -7.522 -11.190 1.480 1.00 0.00 S ATOM 0 H CYS A 69 -9.786 -11.647 0.439 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.666 -11.744 3.259 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.603 -10.003 3.259 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.435 -11.707 3.635 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.649 -12.372 0.954 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.244 -9.237 3.209 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.939 -7.988 3.034 1.00 0.00 C ATOM 1101 C GLU A 70 -11.007 -6.801 3.271 1.00 0.00 C ATOM 1102 O GLU A 70 -10.186 -6.814 4.193 1.00 0.00 O ATOM 1103 CB GLU A 70 -13.129 -7.939 3.971 1.00 0.00 C ATOM 1104 CG GLU A 70 -14.291 -8.790 3.525 1.00 0.00 C ATOM 1105 CD GLU A 70 -15.483 -8.685 4.455 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -15.293 -8.740 5.687 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -16.615 -8.503 3.964 1.00 0.00 O ATOM 0 H GLU A 70 -11.119 -9.528 4.179 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.292 -7.921 2.005 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.813 -8.264 4.962 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.463 -6.906 4.065 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.591 -8.491 2.521 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.972 -9.831 3.465 1.00 0.00 H new ATOM 1114 N LEU A 71 -11.149 -5.780 2.435 1.00 0.00 N ATOM 1115 CA LEU A 71 -10.270 -4.629 2.447 1.00 0.00 C ATOM 1116 C LEU A 71 -11.059 -3.339 2.642 1.00 0.00 C ATOM 1117 O LEU A 71 -12.038 -3.082 1.933 1.00 0.00 O ATOM 1118 CB LEU A 71 -9.556 -4.571 1.112 1.00 0.00 C ATOM 1119 CG LEU A 71 -8.032 -4.435 1.161 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.628 -3.157 1.866 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.413 -5.639 1.849 1.00 0.00 C ATOM 0 H LEU A 71 -11.883 -5.732 1.728 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.563 -4.726 3.271 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.801 -5.475 0.554 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.956 -3.729 0.547 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.661 -4.391 0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.541 -3.082 1.889 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.040 -2.301 1.332 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.012 -3.167 2.886 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.329 -5.526 1.875 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.795 -5.712 2.867 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.670 -6.544 1.299 1.00 0.00 H new ATOM 1133 N GLU A 72 -10.617 -2.519 3.573 1.00 0.00 N ATOM 1134 CA GLU A 72 -11.284 -1.258 3.870 1.00 0.00 C ATOM 1135 C GLU A 72 -10.355 -0.091 3.530 1.00 0.00 C ATOM 1136 O GLU A 72 -9.304 0.069 4.147 1.00 0.00 O ATOM 1137 CB GLU A 72 -11.673 -1.211 5.357 1.00 0.00 C ATOM 1138 CG GLU A 72 -12.790 -0.224 5.700 1.00 0.00 C ATOM 1139 CD GLU A 72 -12.535 1.166 5.179 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -11.863 1.952 5.873 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -13.011 1.478 4.064 1.00 0.00 O ATOM 0 H GLU A 72 -9.792 -2.701 4.144 1.00 0.00 H new ATOM 0 HA GLU A 72 -12.189 -1.178 3.267 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.982 -2.209 5.668 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -10.789 -0.954 5.941 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -13.730 -0.592 5.289 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.910 -0.183 6.783 1.00 0.00 H new ATOM 1148 N THR A 73 -10.746 0.714 2.542 1.00 0.00 N ATOM 1149 CA THR A 73 -10.000 1.922 2.184 1.00 0.00 C ATOM 1150 C THR A 73 -10.940 3.011 1.707 1.00 0.00 C ATOM 1151 O THR A 73 -10.512 4.118 1.373 1.00 0.00 O ATOM 1152 CB THR A 73 -8.953 1.712 1.079 1.00 0.00 C ATOM 1153 OG1 THR A 73 -9.570 1.751 -0.217 1.00 0.00 O ATOM 1154 CG2 THR A 73 -8.249 0.387 1.232 1.00 0.00 C ATOM 0 H THR A 73 -11.577 0.551 1.974 1.00 0.00 H new ATOM 0 HA THR A 73 -9.480 2.204 3.099 1.00 0.00 H new ATOM 0 HB THR A 73 -8.226 2.519 1.172 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.888 1.617 -0.908 1.00 0.00 H new ATOM 0 HG21 THR A 73 -7.515 0.271 0.434 1.00 0.00 H new ATOM 0 HG22 THR A 73 -7.744 0.353 2.197 1.00 0.00 H new ATOM 0 HG23 THR A 73 -8.978 -0.421 1.175 1.00 0.00 H new ATOM 1162 N MET A 74 -12.227 2.694 1.650 1.00 0.00 N ATOM 1163 CA MET A 74 -13.234 3.694 1.345 1.00 0.00 C ATOM 1164 C MET A 74 -13.417 4.552 2.587 1.00 0.00 C ATOM 1165 O MET A 74 -14.182 5.513 2.601 1.00 0.00 O ATOM 1166 CB MET A 74 -14.555 3.035 0.941 1.00 0.00 C ATOM 1167 CG MET A 74 -15.560 3.997 0.329 1.00 0.00 C ATOM 1168 SD MET A 74 -17.085 3.181 -0.181 1.00 0.00 S ATOM 1169 CE MET A 74 -16.454 1.945 -1.317 1.00 0.00 C ATOM 0 H MET A 74 -12.594 1.756 1.811 1.00 0.00 H new ATOM 0 HA MET A 74 -12.914 4.307 0.502 1.00 0.00 H new ATOM 0 HB2 MET A 74 -14.349 2.237 0.227 1.00 0.00 H new ATOM 0 HB3 MET A 74 -15.001 2.569 1.820 1.00 0.00 H new ATOM 0 HG2 MET A 74 -15.795 4.778 1.052 1.00 0.00 H new ATOM 0 HG3 MET A 74 -15.109 4.487 -0.534 1.00 0.00 H new ATOM 0 HE1 MET A 74 -17.262 1.595 -1.959 1.00 0.00 H new ATOM 0 HE2 MET A 74 -15.667 2.383 -1.931 1.00 0.00 H new ATOM 0 HE3 MET A 74 -16.049 1.105 -0.753 1.00 0.00 H new ATOM 1179 N THR A 75 -12.694 4.133 3.628 1.00 0.00 N ATOM 1180 CA THR A 75 -12.605 4.799 4.905 1.00 0.00 C ATOM 1181 C THR A 75 -13.896 4.554 5.647 1.00 0.00 C ATOM 1182 O THR A 75 -14.346 5.332 6.493 1.00 0.00 O ATOM 1183 CB THR A 75 -12.210 6.292 4.803 1.00 0.00 C ATOM 1184 OG1 THR A 75 -13.307 7.108 4.366 1.00 0.00 O ATOM 1185 CG2 THR A 75 -11.044 6.456 3.837 1.00 0.00 C ATOM 0 H THR A 75 -12.134 3.281 3.590 1.00 0.00 H new ATOM 0 HA THR A 75 -11.780 4.374 5.477 1.00 0.00 H new ATOM 0 HB THR A 75 -11.920 6.622 5.801 1.00 0.00 H new ATOM 0 HG1 THR A 75 -13.571 6.843 3.460 1.00 0.00 H new ATOM 0 HG21 THR A 75 -10.772 7.509 3.771 1.00 0.00 H new ATOM 0 HG22 THR A 75 -10.190 5.883 4.197 1.00 0.00 H new ATOM 0 HG23 THR A 75 -11.335 6.094 2.851 1.00 0.00 H new ATOM 1193 N GLY A 76 -14.469 3.412 5.288 1.00 0.00 N ATOM 1194 CA GLY A 76 -15.567 2.846 6.003 1.00 0.00 C ATOM 1195 C GLY A 76 -16.093 1.583 5.355 1.00 0.00 C ATOM 1196 O GLY A 76 -16.036 0.509 5.956 1.00 0.00 O ATOM 0 H GLY A 76 -14.170 2.861 4.483 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.256 2.624 7.024 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -16.371 3.579 6.067 1.00 0.00 H new ATOM 1200 N GLU A 77 -16.614 1.696 4.138 1.00 0.00 N ATOM 1201 CA GLU A 77 -17.126 0.541 3.440 1.00 0.00 C ATOM 1202 C GLU A 77 -16.008 -0.326 2.888 1.00 0.00 C ATOM 1203 O GLU A 77 -15.272 0.064 1.982 1.00 0.00 O ATOM 1204 CB GLU A 77 -18.060 0.954 2.327 1.00 0.00 C ATOM 1205 CG GLU A 77 -19.054 -0.131 2.011 1.00 0.00 C ATOM 1206 CD GLU A 77 -20.054 0.262 0.954 1.00 0.00 C ATOM 1207 OE1 GLU A 77 -21.020 0.974 1.286 1.00 0.00 O ATOM 1208 OE2 GLU A 77 -19.894 -0.167 -0.209 1.00 0.00 O ATOM 0 H GLU A 77 -16.689 2.574 3.624 1.00 0.00 H new ATOM 0 HA GLU A 77 -17.683 -0.051 4.166 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -18.590 1.862 2.613 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -17.482 1.191 1.434 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -18.517 -1.020 1.680 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -19.587 -0.402 2.922 1.00 0.00 H new ATOM 1215 N LYS A 78 -15.911 -1.512 3.447 1.00 0.00 N ATOM 1216 CA LYS A 78 -14.903 -2.474 3.089 1.00 0.00 C ATOM 1217 C LYS A 78 -15.431 -3.495 2.080 1.00 0.00 C ATOM 1218 O LYS A 78 -16.602 -3.873 2.111 1.00 0.00 O ATOM 1219 CB LYS A 78 -14.400 -3.132 4.367 1.00 0.00 C ATOM 1220 CG LYS A 78 -13.961 -4.560 4.217 1.00 0.00 C ATOM 1221 CD LYS A 78 -15.119 -5.508 4.484 1.00 0.00 C ATOM 1222 CE LYS A 78 -15.648 -5.386 5.907 1.00 0.00 C ATOM 1223 NZ LYS A 78 -16.693 -6.405 6.188 1.00 0.00 N ATOM 0 H LYS A 78 -16.545 -1.837 4.177 1.00 0.00 H new ATOM 0 HA LYS A 78 -14.072 -1.974 2.592 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -13.563 -2.549 4.752 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.191 -3.088 5.116 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.575 -4.723 3.211 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -13.146 -4.770 4.909 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -15.925 -5.301 3.780 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -14.795 -6.533 4.306 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.826 -5.502 6.613 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -16.061 -4.389 6.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -17.185 -6.163 7.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -17.377 -6.425 5.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -16.249 -7.340 6.284 1.00 0.00 H new ATOM 1237 N VAL A 79 -14.556 -3.905 1.175 1.00 0.00 N ATOM 1238 CA VAL A 79 -14.908 -4.815 0.095 1.00 0.00 C ATOM 1239 C VAL A 79 -14.032 -6.076 0.124 1.00 0.00 C ATOM 1240 O VAL A 79 -12.833 -6.002 0.389 1.00 0.00 O ATOM 1241 CB VAL A 79 -14.754 -4.110 -1.267 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -13.326 -3.654 -1.490 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -15.202 -5.021 -2.377 1.00 0.00 C ATOM 0 H VAL A 79 -13.578 -3.615 1.168 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.947 -5.113 0.235 1.00 0.00 H new ATOM 0 HB VAL A 79 -15.388 -3.223 -1.265 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.249 -3.160 -2.459 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.040 -2.956 -0.703 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.661 -4.517 -1.469 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -15.088 -4.512 -3.334 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.594 -5.926 -2.373 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -16.249 -5.287 -2.229 1.00 0.00 H new ATOM 1253 N LYS A 80 -14.651 -7.232 -0.113 1.00 0.00 N ATOM 1254 CA LYS A 80 -13.928 -8.495 -0.270 1.00 0.00 C ATOM 1255 C LYS A 80 -13.037 -8.487 -1.509 1.00 0.00 C ATOM 1256 O LYS A 80 -13.472 -8.140 -2.608 1.00 0.00 O ATOM 1257 CB LYS A 80 -14.912 -9.657 -0.380 1.00 0.00 C ATOM 1258 CG LYS A 80 -15.614 -9.971 0.909 1.00 0.00 C ATOM 1259 CD LYS A 80 -16.862 -10.828 0.718 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.978 -10.082 -0.001 1.00 0.00 C ATOM 1261 NZ LYS A 80 -17.838 -10.131 -1.483 1.00 0.00 N ATOM 0 H LYS A 80 -15.663 -7.320 -0.201 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.298 -8.616 0.611 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.656 -9.422 -1.142 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.378 -10.544 -0.719 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.924 -10.489 1.575 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.892 -9.039 1.401 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.602 -11.721 0.150 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.221 -11.163 1.691 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -18.939 -10.511 0.284 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.984 -9.042 0.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -17.566 -9.192 -1.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -17.106 -10.823 -1.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.744 -10.412 -1.908 1.00 0.00 H new ATOM 1275 N ALA A 81 -11.792 -8.872 -1.302 1.00 0.00 N ATOM 1276 CA ALA A 81 -10.820 -9.013 -2.385 1.00 0.00 C ATOM 1277 C ALA A 81 -9.861 -10.174 -2.117 1.00 0.00 C ATOM 1278 O ALA A 81 -9.743 -10.645 -0.993 1.00 0.00 O ATOM 1279 CB ALA A 81 -10.043 -7.727 -2.580 1.00 0.00 C ATOM 0 H ALA A 81 -11.419 -9.098 -0.380 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.372 -9.229 -3.300 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.326 -7.855 -3.391 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.732 -6.920 -2.829 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.512 -7.480 -1.661 1.00 0.00 H new ATOM 1285 N VAL A 82 -9.187 -10.647 -3.153 1.00 0.00 N ATOM 1286 CA VAL A 82 -8.281 -11.784 -3.013 1.00 0.00 C ATOM 1287 C VAL A 82 -6.846 -11.404 -3.380 1.00 0.00 C ATOM 1288 O VAL A 82 -6.566 -11.025 -4.517 1.00 0.00 O ATOM 1289 CB VAL A 82 -8.734 -12.969 -3.882 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -7.885 -14.188 -3.612 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -10.165 -13.303 -3.574 1.00 0.00 C ATOM 0 H VAL A 82 -9.247 -10.266 -4.097 1.00 0.00 H new ATOM 0 HA VAL A 82 -8.308 -12.082 -1.965 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.628 -12.683 -4.928 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.224 -15.013 -4.238 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.843 -13.964 -3.840 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.974 -14.468 -2.562 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.484 -14.143 -4.191 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.258 -13.570 -2.521 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.794 -12.438 -3.786 1.00 0.00 H new ATOM 1301 N VAL A 83 -5.947 -11.503 -2.407 1.00 0.00 N ATOM 1302 CA VAL A 83 -4.545 -11.143 -2.602 1.00 0.00 C ATOM 1303 C VAL A 83 -3.628 -12.364 -2.531 1.00 0.00 C ATOM 1304 O VAL A 83 -3.722 -13.178 -1.612 1.00 0.00 O ATOM 1305 CB VAL A 83 -4.097 -10.108 -1.560 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -4.315 -10.644 -0.173 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -2.648 -9.715 -1.771 1.00 0.00 C ATOM 0 H VAL A 83 -6.166 -11.832 -1.467 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.466 -10.712 -3.600 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.701 -9.209 -1.682 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -3.994 -9.902 0.558 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.373 -10.861 -0.029 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.736 -11.558 -0.041 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.357 -8.981 -1.020 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.015 -10.598 -1.681 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.529 -9.283 -2.765 1.00 0.00 H new ATOM 1317 N LYS A 84 -2.777 -12.515 -3.529 1.00 0.00 N ATOM 1318 CA LYS A 84 -1.736 -13.533 -3.498 1.00 0.00 C ATOM 1319 C LYS A 84 -0.482 -13.009 -4.185 1.00 0.00 C ATOM 1320 O LYS A 84 -0.539 -12.000 -4.889 1.00 0.00 O ATOM 1321 CB LYS A 84 -2.186 -14.849 -4.111 1.00 0.00 C ATOM 1322 CG LYS A 84 -1.372 -16.013 -3.597 1.00 0.00 C ATOM 1323 CD LYS A 84 -0.455 -16.580 -4.677 1.00 0.00 C ATOM 1324 CE LYS A 84 -1.230 -17.037 -5.908 1.00 0.00 C ATOM 1325 NZ LYS A 84 -2.001 -18.283 -5.660 1.00 0.00 N ATOM 0 H LYS A 84 -2.784 -11.945 -4.375 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.512 -13.745 -2.452 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.240 -15.014 -3.885 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.097 -14.794 -5.196 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.774 -15.691 -2.744 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.041 -16.796 -3.240 1.00 0.00 H new ATOM 0 HD2 LYS A 84 0.272 -15.822 -4.968 1.00 0.00 H new ATOM 0 HD3 LYS A 84 0.106 -17.421 -4.270 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -1.913 -16.246 -6.219 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -0.535 -17.200 -6.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.511 -18.554 -6.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.349 -19.047 -5.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -2.684 -18.122 -4.892 1.00 0.00 H new ATOM 1339 N MET A 85 0.644 -13.693 -3.993 1.00 0.00 N ATOM 1340 CA MET A 85 1.934 -13.148 -4.379 1.00 0.00 C ATOM 1341 C MET A 85 2.148 -13.335 -5.862 1.00 0.00 C ATOM 1342 O MET A 85 1.877 -14.403 -6.414 1.00 0.00 O ATOM 1343 CB MET A 85 3.101 -13.833 -3.642 1.00 0.00 C ATOM 1344 CG MET A 85 2.794 -14.371 -2.262 1.00 0.00 C ATOM 1345 SD MET A 85 4.214 -15.236 -1.549 1.00 0.00 S ATOM 1346 CE MET A 85 3.511 -15.965 -0.071 1.00 0.00 C ATOM 0 H MET A 85 0.685 -14.622 -3.574 1.00 0.00 H new ATOM 0 HA MET A 85 1.922 -12.091 -4.112 1.00 0.00 H new ATOM 0 HB2 MET A 85 3.460 -14.657 -4.259 1.00 0.00 H new ATOM 0 HB3 MET A 85 3.920 -13.118 -3.557 1.00 0.00 H new ATOM 0 HG2 MET A 85 2.503 -13.549 -1.608 1.00 0.00 H new ATOM 0 HG3 MET A 85 1.944 -15.051 -2.317 1.00 0.00 H new ATOM 0 HE1 MET A 85 4.313 -16.325 0.574 1.00 0.00 H new ATOM 0 HE2 MET A 85 2.926 -15.215 0.461 1.00 0.00 H new ATOM 0 HE3 MET A 85 2.866 -16.799 -0.348 1.00 0.00 H new ATOM 1356 N GLU A 86 2.629 -12.291 -6.500 1.00 0.00 N ATOM 1357 CA GLU A 86 2.939 -12.347 -7.905 1.00 0.00 C ATOM 1358 C GLU A 86 4.416 -12.634 -8.039 1.00 0.00 C ATOM 1359 O GLU A 86 5.208 -12.196 -7.203 1.00 0.00 O ATOM 1360 CB GLU A 86 2.563 -11.046 -8.598 1.00 0.00 C ATOM 1361 CG GLU A 86 2.351 -11.221 -10.090 1.00 0.00 C ATOM 1362 CD GLU A 86 1.931 -9.945 -10.790 1.00 0.00 C ATOM 1363 OE1 GLU A 86 0.710 -9.696 -10.897 1.00 0.00 O ATOM 1364 OE2 GLU A 86 2.811 -9.203 -11.268 1.00 0.00 O ATOM 0 H GLU A 86 2.814 -11.389 -6.062 1.00 0.00 H new ATOM 0 HA GLU A 86 2.362 -13.135 -8.388 1.00 0.00 H new ATOM 0 HB2 GLU A 86 1.652 -10.649 -8.149 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.348 -10.309 -8.430 1.00 0.00 H new ATOM 0 HG2 GLU A 86 3.274 -11.587 -10.540 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.591 -11.985 -10.255 1.00 0.00 H new ATOM 1371 N GLY A 87 4.768 -13.397 -9.060 1.00 0.00 N ATOM 1372 CA GLY A 87 6.099 -13.973 -9.148 1.00 0.00 C ATOM 1373 C GLY A 87 7.200 -12.971 -9.345 1.00 0.00 C ATOM 1374 O GLY A 87 7.693 -12.757 -10.452 1.00 0.00 O ATOM 0 H GLY A 87 4.152 -13.632 -9.838 1.00 0.00 H new ATOM 0 HA2 GLY A 87 6.298 -14.538 -8.237 1.00 0.00 H new ATOM 0 HA3 GLY A 87 6.120 -14.684 -9.974 1.00 0.00 H new ATOM 1378 N ASP A 88 7.562 -12.369 -8.250 1.00 0.00 N ATOM 1379 CA ASP A 88 8.694 -11.483 -8.174 1.00 0.00 C ATOM 1380 C ASP A 88 9.161 -11.391 -6.731 1.00 0.00 C ATOM 1381 O ASP A 88 10.209 -11.919 -6.375 1.00 0.00 O ATOM 1382 CB ASP A 88 8.334 -10.093 -8.695 1.00 0.00 C ATOM 1383 CG ASP A 88 9.538 -9.362 -9.261 1.00 0.00 C ATOM 1384 OD1 ASP A 88 10.558 -9.232 -8.552 1.00 0.00 O ATOM 1385 OD2 ASP A 88 9.479 -8.935 -10.433 1.00 0.00 O ATOM 0 H ASP A 88 7.070 -12.481 -7.364 1.00 0.00 H new ATOM 0 HA ASP A 88 9.495 -11.881 -8.797 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.570 -10.183 -9.467 1.00 0.00 H new ATOM 0 HB3 ASP A 88 7.901 -9.505 -7.886 1.00 0.00 H new ATOM 1390 N ASN A 89 8.344 -10.756 -5.892 1.00 0.00 N ATOM 1391 CA ASN A 89 8.744 -10.463 -4.511 1.00 0.00 C ATOM 1392 C ASN A 89 7.577 -10.480 -3.519 1.00 0.00 C ATOM 1393 O ASN A 89 7.731 -10.909 -2.388 1.00 0.00 O ATOM 1394 CB ASN A 89 9.445 -9.111 -4.435 1.00 0.00 C ATOM 1395 CG ASN A 89 10.908 -9.149 -4.846 1.00 0.00 C ATOM 1396 OD1 ASN A 89 11.421 -8.194 -5.420 1.00 0.00 O ATOM 1397 ND2 ASN A 89 11.603 -10.231 -4.523 1.00 0.00 N ATOM 0 H ASN A 89 7.408 -10.435 -6.139 1.00 0.00 H new ATOM 0 HA ASN A 89 9.425 -11.264 -4.222 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.917 -8.403 -5.074 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.375 -8.734 -3.415 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.595 -10.287 -4.752 1.00 0.00 H new ATOM 0 HD22 ASN A 89 11.145 -11.008 -4.046 1.00 0.00 H new ATOM 1404 N LYS A 90 6.451 -9.913 -3.914 1.00 0.00 N ATOM 1405 CA LYS A 90 5.283 -9.792 -3.040 1.00 0.00 C ATOM 1406 C LYS A 90 3.971 -9.861 -3.818 1.00 0.00 C ATOM 1407 O LYS A 90 3.960 -10.107 -5.023 1.00 0.00 O ATOM 1408 CB LYS A 90 5.312 -8.624 -2.056 1.00 0.00 C ATOM 1409 CG LYS A 90 5.319 -9.096 -0.611 1.00 0.00 C ATOM 1410 CD LYS A 90 4.704 -8.073 0.337 1.00 0.00 C ATOM 1411 CE LYS A 90 3.203 -7.940 0.117 1.00 0.00 C ATOM 1412 NZ LYS A 90 2.563 -7.025 1.100 1.00 0.00 N ATOM 0 H LYS A 90 6.314 -9.522 -4.846 1.00 0.00 H new ATOM 0 HA LYS A 90 5.342 -10.673 -2.400 1.00 0.00 H new ATOM 0 HB2 LYS A 90 6.196 -8.015 -2.243 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.444 -7.986 -2.225 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.769 -10.034 -0.535 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.344 -9.302 -0.304 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.897 -8.369 1.368 1.00 0.00 H new ATOM 0 HD3 LYS A 90 5.182 -7.105 0.189 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.018 -7.571 -0.892 1.00 0.00 H new ATOM 0 HE3 LYS A 90 2.740 -8.924 0.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.727 -6.582 0.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.273 -7.566 1.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.241 -6.287 1.380 1.00 0.00 H new ATOM 1426 N MET A 91 2.868 -9.663 -3.106 1.00 0.00 N ATOM 1427 CA MET A 91 1.543 -10.082 -3.556 1.00 0.00 C ATOM 1428 C MET A 91 0.772 -8.899 -4.112 1.00 0.00 C ATOM 1429 O MET A 91 0.992 -7.752 -3.720 1.00 0.00 O ATOM 1430 CB MET A 91 0.698 -10.610 -2.387 1.00 0.00 C ATOM 1431 CG MET A 91 1.336 -11.699 -1.560 1.00 0.00 C ATOM 1432 SD MET A 91 2.373 -11.038 -0.236 1.00 0.00 S ATOM 1433 CE MET A 91 2.898 -12.532 0.599 1.00 0.00 C ATOM 0 H MET A 91 2.866 -9.205 -2.195 1.00 0.00 H new ATOM 0 HA MET A 91 1.705 -10.855 -4.308 1.00 0.00 H new ATOM 0 HB2 MET A 91 0.457 -9.774 -1.730 1.00 0.00 H new ATOM 0 HB3 MET A 91 -0.245 -10.986 -2.784 1.00 0.00 H new ATOM 0 HG2 MET A 91 0.557 -12.328 -1.129 1.00 0.00 H new ATOM 0 HG3 MET A 91 1.939 -12.337 -2.206 1.00 0.00 H new ATOM 0 HE1 MET A 91 3.180 -12.295 1.625 1.00 0.00 H new ATOM 0 HE2 MET A 91 2.080 -13.252 0.605 1.00 0.00 H new ATOM 0 HE3 MET A 91 3.754 -12.959 0.077 1.00 0.00 H new ATOM 1443 N VAL A 92 -0.126 -9.197 -5.033 1.00 0.00 N ATOM 1444 CA VAL A 92 -0.958 -8.191 -5.660 1.00 0.00 C ATOM 1445 C VAL A 92 -2.409 -8.398 -5.252 1.00 0.00 C ATOM 1446 O VAL A 92 -2.895 -9.532 -5.212 1.00 0.00 O ATOM 1447 CB VAL A 92 -0.835 -8.250 -7.202 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -1.816 -7.301 -7.880 1.00 0.00 C ATOM 1449 CG2 VAL A 92 0.584 -7.929 -7.631 1.00 0.00 C ATOM 0 H VAL A 92 -0.298 -10.145 -5.367 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.619 -7.210 -5.327 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.082 -9.265 -7.514 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.700 -7.370 -8.962 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.835 -7.574 -7.606 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.615 -6.279 -7.558 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.655 -7.975 -8.718 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.849 -6.928 -7.292 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.270 -8.654 -7.192 1.00 0.00 H new ATOM 1459 N THR A 93 -3.083 -7.309 -4.922 1.00 0.00 N ATOM 1460 CA THR A 93 -4.477 -7.363 -4.536 1.00 0.00 C ATOM 1461 C THR A 93 -5.279 -6.306 -5.291 1.00 0.00 C ATOM 1462 O THR A 93 -4.924 -5.125 -5.312 1.00 0.00 O ATOM 1463 CB THR A 93 -4.654 -7.182 -3.009 1.00 0.00 C ATOM 1464 OG1 THR A 93 -6.044 -7.139 -2.668 1.00 0.00 O ATOM 1465 CG2 THR A 93 -3.963 -5.920 -2.511 1.00 0.00 C ATOM 0 H THR A 93 -2.681 -6.372 -4.915 1.00 0.00 H new ATOM 0 HA THR A 93 -4.854 -8.351 -4.799 1.00 0.00 H new ATOM 0 HB THR A 93 -4.189 -8.039 -2.522 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.140 -7.026 -1.699 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.109 -5.826 -1.435 1.00 0.00 H new ATOM 0 HG22 THR A 93 -2.897 -5.979 -2.729 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.388 -5.050 -3.012 1.00 0.00 H new ATOM 1473 N THR A 94 -6.323 -6.750 -5.964 1.00 0.00 N ATOM 1474 CA THR A 94 -7.236 -5.844 -6.630 1.00 0.00 C ATOM 1475 C THR A 94 -8.520 -5.732 -5.816 1.00 0.00 C ATOM 1476 O THR A 94 -9.153 -6.740 -5.504 1.00 0.00 O ATOM 1477 CB THR A 94 -7.548 -6.323 -8.054 1.00 0.00 C ATOM 1478 OG1 THR A 94 -6.332 -6.690 -8.717 1.00 0.00 O ATOM 1479 CG2 THR A 94 -8.251 -5.241 -8.858 1.00 0.00 C ATOM 0 H THR A 94 -6.560 -7.737 -6.064 1.00 0.00 H new ATOM 0 HA THR A 94 -6.765 -4.864 -6.705 1.00 0.00 H new ATOM 0 HB THR A 94 -8.210 -7.186 -7.983 1.00 0.00 H new ATOM 0 HG1 THR A 94 -6.534 -6.997 -9.625 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.459 -5.611 -9.862 1.00 0.00 H new ATOM 0 HG22 THR A 94 -9.188 -4.975 -8.369 1.00 0.00 H new ATOM 0 HG23 THR A 94 -7.611 -4.361 -8.921 1.00 0.00 H new ATOM 1487 N PHE A 95 -8.907 -4.511 -5.484 1.00 0.00 N ATOM 1488 CA PHE A 95 -10.034 -4.281 -4.596 1.00 0.00 C ATOM 1489 C PHE A 95 -10.648 -2.929 -4.900 1.00 0.00 C ATOM 1490 O PHE A 95 -9.943 -2.008 -5.296 1.00 0.00 O ATOM 1491 CB PHE A 95 -9.601 -4.362 -3.125 1.00 0.00 C ATOM 1492 CG PHE A 95 -8.524 -3.389 -2.733 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -7.185 -3.729 -2.851 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -8.852 -2.139 -2.242 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -6.196 -2.837 -2.485 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -7.868 -1.243 -1.873 1.00 0.00 C ATOM 1497 CZ PHE A 95 -6.537 -1.593 -1.995 1.00 0.00 C ATOM 0 H PHE A 95 -8.454 -3.660 -5.818 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.779 -5.059 -4.763 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.473 -4.192 -2.494 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.251 -5.373 -2.919 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -6.912 -4.702 -3.233 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -9.891 -1.860 -2.146 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.156 -3.113 -2.582 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.138 -0.270 -1.490 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.765 -0.894 -1.707 1.00 0.00 H new ATOM 1507 N LYS A 96 -11.967 -2.826 -4.751 1.00 0.00 N ATOM 1508 CA LYS A 96 -12.706 -1.614 -5.112 1.00 0.00 C ATOM 1509 C LYS A 96 -12.637 -1.361 -6.618 1.00 0.00 C ATOM 1510 O LYS A 96 -13.114 -0.342 -7.117 1.00 0.00 O ATOM 1511 CB LYS A 96 -12.175 -0.413 -4.356 1.00 0.00 C ATOM 1512 CG LYS A 96 -12.369 -0.550 -2.867 1.00 0.00 C ATOM 1513 CD LYS A 96 -11.699 0.574 -2.140 1.00 0.00 C ATOM 1514 CE LYS A 96 -12.479 1.874 -2.269 1.00 0.00 C ATOM 1515 NZ LYS A 96 -11.709 3.040 -1.766 1.00 0.00 N ATOM 0 H LYS A 96 -12.552 -3.574 -4.379 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.749 -1.765 -4.834 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.114 -0.288 -4.573 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.680 0.487 -4.706 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -13.434 -0.557 -2.633 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -11.962 -1.503 -2.528 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -11.596 0.315 -1.086 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -10.692 0.713 -2.534 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.741 2.037 -3.314 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.414 1.792 -1.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.362 3.734 -1.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -11.033 2.723 -1.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -11.192 3.481 -2.554 1.00 0.00 H new ATOM 1529 N GLY A 97 -12.050 -2.312 -7.335 1.00 0.00 N ATOM 1530 CA GLY A 97 -11.810 -2.148 -8.754 1.00 0.00 C ATOM 1531 C GLY A 97 -10.374 -1.766 -9.053 1.00 0.00 C ATOM 1532 O GLY A 97 -9.909 -1.892 -10.189 1.00 0.00 O ATOM 0 H GLY A 97 -11.733 -3.203 -6.952 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.052 -3.077 -9.271 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -12.477 -1.381 -9.147 1.00 0.00 H new ATOM 1536 N ILE A 98 -9.658 -1.317 -8.028 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.308 -0.821 -8.213 1.00 0.00 C ATOM 1538 C ILE A 98 -7.300 -1.932 -7.954 1.00 0.00 C ATOM 1539 O ILE A 98 -7.520 -2.799 -7.109 1.00 0.00 O ATOM 1540 CB ILE A 98 -8.018 0.425 -7.330 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -7.945 0.087 -5.834 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -9.093 1.478 -7.556 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -6.571 -0.304 -5.354 1.00 0.00 C ATOM 0 H ILE A 98 -9.993 -1.288 -7.065 1.00 0.00 H new ATOM 0 HA ILE A 98 -8.210 -0.498 -9.249 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.041 0.806 -7.628 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.286 0.950 -5.261 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.637 -0.729 -5.623 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -8.885 2.349 -6.935 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.098 1.773 -8.605 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -10.067 1.067 -7.290 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -6.608 -0.526 -4.288 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.233 -1.187 -5.897 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.877 0.518 -5.530 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.201 -1.905 -8.680 1.00 0.00 N ATOM 1556 CA LYS A 99 -5.222 -2.980 -8.634 1.00 0.00 C ATOM 1557 C LYS A 99 -3.954 -2.526 -7.922 1.00 0.00 C ATOM 1558 O LYS A 99 -3.391 -1.502 -8.261 1.00 0.00 O ATOM 1559 CB LYS A 99 -4.884 -3.454 -10.053 1.00 0.00 C ATOM 1560 CG LYS A 99 -4.805 -2.345 -11.079 1.00 0.00 C ATOM 1561 CD LYS A 99 -6.173 -1.941 -11.635 1.00 0.00 C ATOM 1562 CE LYS A 99 -6.998 -3.150 -12.048 1.00 0.00 C ATOM 1563 NZ LYS A 99 -8.361 -2.768 -12.500 1.00 0.00 N ATOM 0 H LYS A 99 -5.959 -1.145 -9.315 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.655 -3.810 -8.076 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.930 -3.980 -10.030 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.637 -4.175 -10.372 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.332 -1.473 -10.627 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.165 -2.664 -11.902 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -6.717 -1.371 -10.882 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -6.036 -1.285 -12.494 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.486 -3.681 -12.850 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -7.075 -3.840 -11.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -8.822 -3.588 -12.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -8.923 -2.456 -11.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -8.293 -1.993 -13.190 1.00 0.00 H new ATOM 1577 N SER A 100 -3.503 -3.269 -6.923 1.00 0.00 N ATOM 1578 CA SER A 100 -2.305 -2.875 -6.205 1.00 0.00 C ATOM 1579 C SER A 100 -1.308 -4.028 -6.059 1.00 0.00 C ATOM 1580 O SER A 100 -1.647 -5.100 -5.568 1.00 0.00 O ATOM 1581 CB SER A 100 -2.690 -2.346 -4.834 1.00 0.00 C ATOM 1582 OG SER A 100 -3.649 -1.310 -4.939 1.00 0.00 O ATOM 0 H SER A 100 -3.940 -4.131 -6.597 1.00 0.00 H new ATOM 0 HA SER A 100 -1.812 -2.095 -6.785 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.092 -3.158 -4.227 1.00 0.00 H new ATOM 0 HB3 SER A 100 -1.803 -1.974 -4.322 1.00 0.00 H new ATOM 0 HG SER A 100 -3.881 -0.987 -4.043 1.00 0.00 H new ATOM 1588 N VAL A 101 -0.076 -3.778 -6.480 1.00 0.00 N ATOM 1589 CA VAL A 101 1.012 -4.738 -6.360 1.00 0.00 C ATOM 1590 C VAL A 101 1.936 -4.345 -5.213 1.00 0.00 C ATOM 1591 O VAL A 101 2.227 -3.170 -5.000 1.00 0.00 O ATOM 1592 CB VAL A 101 1.815 -4.891 -7.682 1.00 0.00 C ATOM 1593 CG1 VAL A 101 1.276 -3.971 -8.752 1.00 0.00 C ATOM 1594 CG2 VAL A 101 3.300 -4.685 -7.463 1.00 0.00 C ATOM 0 H VAL A 101 0.198 -2.898 -6.917 1.00 0.00 H new ATOM 0 HA VAL A 101 0.566 -5.709 -6.146 1.00 0.00 H new ATOM 0 HB VAL A 101 1.685 -5.916 -8.030 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.855 -4.098 -9.667 1.00 0.00 H new ATOM 0 HG12 VAL A 101 0.231 -4.213 -8.948 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.352 -2.937 -8.415 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.827 -4.800 -8.410 1.00 0.00 H new ATOM 0 HG22 VAL A 101 3.474 -3.683 -7.070 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.669 -5.423 -6.751 1.00 0.00 H new ATOM 1604 N THR A 102 2.361 -5.330 -4.454 1.00 0.00 N ATOM 1605 CA THR A 102 3.331 -5.126 -3.406 1.00 0.00 C ATOM 1606 C THR A 102 4.483 -6.052 -3.675 1.00 0.00 C ATOM 1607 O THR A 102 4.254 -7.183 -4.070 1.00 0.00 O ATOM 1608 CB THR A 102 2.789 -5.434 -2.004 1.00 0.00 C ATOM 1609 OG1 THR A 102 1.357 -5.421 -2.001 1.00 0.00 O ATOM 1610 CG2 THR A 102 3.305 -4.413 -1.000 1.00 0.00 C ATOM 0 H THR A 102 2.043 -6.295 -4.547 1.00 0.00 H new ATOM 0 HA THR A 102 3.615 -4.074 -3.415 1.00 0.00 H new ATOM 0 HB THR A 102 3.136 -6.427 -1.720 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.022 -6.179 -2.523 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.912 -4.645 -0.010 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.394 -4.446 -0.975 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.979 -3.416 -1.295 1.00 0.00 H new ATOM 1618 N GLU A 103 5.693 -5.556 -3.525 1.00 0.00 N ATOM 1619 CA GLU A 103 6.895 -6.307 -3.790 1.00 0.00 C ATOM 1620 C GLU A 103 7.797 -6.283 -2.554 1.00 0.00 C ATOM 1621 O GLU A 103 8.078 -5.210 -2.022 1.00 0.00 O ATOM 1622 CB GLU A 103 7.587 -5.613 -4.950 1.00 0.00 C ATOM 1623 CG GLU A 103 8.371 -6.517 -5.852 1.00 0.00 C ATOM 1624 CD GLU A 103 9.511 -5.790 -6.535 1.00 0.00 C ATOM 1625 OE1 GLU A 103 10.405 -5.274 -5.830 1.00 0.00 O ATOM 1626 OE2 GLU A 103 9.511 -5.711 -7.777 1.00 0.00 O ATOM 0 H GLU A 103 5.869 -4.602 -3.210 1.00 0.00 H new ATOM 0 HA GLU A 103 6.674 -7.347 -4.028 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.835 -5.095 -5.545 1.00 0.00 H new ATOM 0 HB3 GLU A 103 8.258 -4.852 -4.551 1.00 0.00 H new ATOM 0 HG2 GLU A 103 8.768 -7.351 -5.273 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.708 -6.940 -6.606 1.00 0.00 H new ATOM 1633 N PHE A 104 8.246 -7.445 -2.083 1.00 0.00 N ATOM 1634 CA PHE A 104 9.072 -7.473 -0.883 1.00 0.00 C ATOM 1635 C PHE A 104 10.545 -7.647 -1.219 1.00 0.00 C ATOM 1636 O PHE A 104 10.955 -8.626 -1.836 1.00 0.00 O ATOM 1637 CB PHE A 104 8.625 -8.571 0.068 1.00 0.00 C ATOM 1638 CG PHE A 104 8.779 -8.191 1.510 1.00 0.00 C ATOM 1639 CD1 PHE A 104 10.034 -8.021 2.067 1.00 0.00 C ATOM 1640 CD2 PHE A 104 7.664 -7.983 2.303 1.00 0.00 C ATOM 1641 CE1 PHE A 104 10.172 -7.654 3.390 1.00 0.00 C ATOM 1642 CE2 PHE A 104 7.796 -7.616 3.625 1.00 0.00 C ATOM 1643 CZ PHE A 104 9.050 -7.453 4.169 1.00 0.00 C ATOM 0 H PHE A 104 8.057 -8.356 -2.502 1.00 0.00 H new ATOM 0 HA PHE A 104 8.945 -6.509 -0.389 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.581 -8.813 -0.129 1.00 0.00 H new ATOM 0 HB3 PHE A 104 9.204 -9.473 -0.129 1.00 0.00 H new ATOM 0 HD1 PHE A 104 10.914 -8.177 1.461 1.00 0.00 H new ATOM 0 HD2 PHE A 104 6.678 -8.110 1.881 1.00 0.00 H new ATOM 0 HE1 PHE A 104 11.156 -7.524 3.815 1.00 0.00 H new ATOM 0 HE2 PHE A 104 6.918 -7.457 4.233 1.00 0.00 H new ATOM 0 HZ PHE A 104 9.156 -7.168 5.205 1.00 0.00 H new ATOM 1653 N ASN A 105 11.324 -6.680 -0.788 1.00 0.00 N ATOM 1654 CA ASN A 105 12.763 -6.646 -1.034 1.00 0.00 C ATOM 1655 C ASN A 105 13.502 -6.809 0.289 1.00 0.00 C ATOM 1656 O ASN A 105 12.922 -6.603 1.355 1.00 0.00 O ATOM 1657 CB ASN A 105 13.189 -5.323 -1.697 1.00 0.00 C ATOM 1658 CG ASN A 105 12.737 -5.166 -3.140 1.00 0.00 C ATOM 1659 OD1 ASN A 105 11.598 -5.740 -3.485 1.00 0.00 O flip ATOM 1660 ND2 ASN A 105 13.411 -4.518 -3.943 1.00 0.00 N flip ATOM 0 H ASN A 105 10.981 -5.884 -0.251 1.00 0.00 H new ATOM 0 HA ASN A 105 13.014 -7.462 -1.712 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.790 -4.494 -1.113 1.00 0.00 H new ATOM 0 HB3 ASN A 105 14.276 -5.246 -1.660 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.286 -4.087 -3.644 1.00 0.00 H new ATOM 0 HD22 ASN A 105 13.094 -4.412 -4.907 1.00 0.00 H new ATOM 1667 N GLY A 106 14.755 -7.227 0.228 1.00 0.00 N ATOM 1668 CA GLY A 106 15.555 -7.344 1.437 1.00 0.00 C ATOM 1669 C GLY A 106 15.644 -6.030 2.200 1.00 0.00 C ATOM 1670 O GLY A 106 16.350 -5.108 1.780 1.00 0.00 O ATOM 0 H GLY A 106 15.236 -7.488 -0.633 1.00 0.00 H new ATOM 0 HA2 GLY A 106 15.123 -8.108 2.083 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.559 -7.678 1.175 1.00 0.00 H new ATOM 1674 N ASP A 107 14.900 -5.956 3.308 1.00 0.00 N ATOM 1675 CA ASP A 107 14.847 -4.771 4.180 1.00 0.00 C ATOM 1676 C ASP A 107 14.248 -3.550 3.480 1.00 0.00 C ATOM 1677 O ASP A 107 14.278 -2.440 4.012 1.00 0.00 O ATOM 1678 CB ASP A 107 16.224 -4.433 4.740 1.00 0.00 C ATOM 1679 CG ASP A 107 16.650 -5.382 5.841 1.00 0.00 C ATOM 1680 OD1 ASP A 107 16.338 -5.111 7.018 1.00 0.00 O ATOM 1681 OD2 ASP A 107 17.295 -6.406 5.536 1.00 0.00 O ATOM 0 H ASP A 107 14.310 -6.723 3.631 1.00 0.00 H new ATOM 0 HA ASP A 107 14.185 -5.031 5.006 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.958 -4.463 3.935 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.216 -3.414 5.126 1.00 0.00 H new ATOM 1686 N THR A 108 13.723 -3.755 2.286 1.00 0.00 N ATOM 1687 CA THR A 108 13.064 -2.711 1.535 1.00 0.00 C ATOM 1688 C THR A 108 11.738 -3.218 0.959 1.00 0.00 C ATOM 1689 O THR A 108 11.529 -4.420 0.851 1.00 0.00 O ATOM 1690 CB THR A 108 13.965 -2.223 0.397 1.00 0.00 C ATOM 1691 OG1 THR A 108 14.801 -3.292 -0.064 1.00 0.00 O ATOM 1692 CG2 THR A 108 14.817 -1.068 0.851 1.00 0.00 C ATOM 0 H THR A 108 13.744 -4.657 1.810 1.00 0.00 H new ATOM 0 HA THR A 108 12.862 -1.881 2.212 1.00 0.00 H new ATOM 0 HB THR A 108 13.330 -1.886 -0.422 1.00 0.00 H new ATOM 0 HG1 THR A 108 15.372 -2.970 -0.792 1.00 0.00 H new ATOM 0 HG21 THR A 108 15.450 -0.737 0.027 1.00 0.00 H new ATOM 0 HG22 THR A 108 14.176 -0.246 1.170 1.00 0.00 H new ATOM 0 HG23 THR A 108 15.443 -1.384 1.685 1.00 0.00 H new ATOM 1700 N ILE A 109 10.825 -2.323 0.617 1.00 0.00 N ATOM 1701 CA ILE A 109 9.567 -2.733 0.001 1.00 0.00 C ATOM 1702 C ILE A 109 9.254 -1.888 -1.228 1.00 0.00 C ATOM 1703 O ILE A 109 9.483 -0.686 -1.234 1.00 0.00 O ATOM 1704 CB ILE A 109 8.386 -2.631 0.989 1.00 0.00 C ATOM 1705 CG1 ILE A 109 8.757 -3.288 2.315 1.00 0.00 C ATOM 1706 CG2 ILE A 109 7.134 -3.276 0.401 1.00 0.00 C ATOM 1707 CD1 ILE A 109 7.589 -3.467 3.249 1.00 0.00 C ATOM 0 H ILE A 109 10.927 -1.317 0.752 1.00 0.00 H new ATOM 0 HA ILE A 109 9.693 -3.775 -0.295 1.00 0.00 H new ATOM 0 HB ILE A 109 8.170 -1.578 1.168 1.00 0.00 H new ATOM 0 HG12 ILE A 109 9.204 -4.262 2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 109 9.517 -2.684 2.810 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.313 -3.193 1.113 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.864 -2.768 -0.525 1.00 0.00 H new ATOM 0 HG23 ILE A 109 7.330 -4.328 0.194 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.929 -3.940 4.170 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.155 -2.494 3.479 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.837 -4.097 2.774 1.00 0.00 H new ATOM 1719 N THR A 110 8.739 -2.524 -2.264 1.00 0.00 N ATOM 1720 CA THR A 110 8.287 -1.816 -3.447 1.00 0.00 C ATOM 1721 C THR A 110 6.765 -1.912 -3.541 1.00 0.00 C ATOM 1722 O THR A 110 6.204 -2.999 -3.609 1.00 0.00 O ATOM 1723 CB THR A 110 8.906 -2.405 -4.731 1.00 0.00 C ATOM 1724 OG1 THR A 110 10.259 -2.820 -4.496 1.00 0.00 O ATOM 1725 CG2 THR A 110 8.877 -1.371 -5.824 1.00 0.00 C ATOM 0 H THR A 110 8.623 -3.536 -2.310 1.00 0.00 H new ATOM 0 HA THR A 110 8.603 -0.776 -3.359 1.00 0.00 H new ATOM 0 HB THR A 110 8.323 -3.275 -5.032 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.420 -3.678 -4.941 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.315 -1.788 -6.731 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.846 -1.078 -6.020 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.450 -0.497 -5.513 1.00 0.00 H new ATOM 1733 N ASN A 111 6.103 -0.778 -3.508 1.00 0.00 N ATOM 1734 CA ASN A 111 4.654 -0.724 -3.622 1.00 0.00 C ATOM 1735 C ASN A 111 4.289 -0.223 -4.996 1.00 0.00 C ATOM 1736 O ASN A 111 4.681 0.876 -5.354 1.00 0.00 O ATOM 1737 CB ASN A 111 4.072 0.255 -2.595 1.00 0.00 C ATOM 1738 CG ASN A 111 2.555 0.223 -2.547 1.00 0.00 C ATOM 1739 OD1 ASN A 111 1.886 0.976 -3.249 1.00 0.00 O ATOM 1740 ND2 ASN A 111 2.003 -0.648 -1.714 1.00 0.00 N ATOM 0 H ASN A 111 6.548 0.134 -3.402 1.00 0.00 H new ATOM 0 HA ASN A 111 4.253 -1.723 -3.447 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.467 0.017 -1.608 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.402 1.266 -2.835 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.988 -0.710 -1.640 1.00 0.00 H new ATOM 0 HD22 ASN A 111 2.594 -1.257 -1.147 1.00 0.00 H new ATOM 1747 N THR A 112 3.570 -0.995 -5.786 1.00 0.00 N ATOM 1748 CA THR A 112 3.078 -0.458 -7.031 1.00 0.00 C ATOM 1749 C THR A 112 1.559 -0.461 -7.000 1.00 0.00 C ATOM 1750 O THR A 112 0.937 -1.506 -7.054 1.00 0.00 O ATOM 1751 CB THR A 112 3.578 -1.276 -8.237 1.00 0.00 C ATOM 1752 OG1 THR A 112 4.985 -1.529 -8.107 1.00 0.00 O ATOM 1753 CG2 THR A 112 3.314 -0.537 -9.533 1.00 0.00 C ATOM 0 H THR A 112 3.321 -1.965 -5.595 1.00 0.00 H new ATOM 0 HA THR A 112 3.453 0.559 -7.144 1.00 0.00 H new ATOM 0 HB THR A 112 3.037 -2.222 -8.257 1.00 0.00 H new ATOM 0 HG1 THR A 112 5.296 -2.051 -8.876 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.675 -1.133 -10.371 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.243 -0.367 -9.643 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.834 0.421 -9.518 1.00 0.00 H new ATOM 1761 N MET A 113 0.961 0.696 -6.931 1.00 0.00 N ATOM 1762 CA MET A 113 -0.479 0.785 -6.944 1.00 0.00 C ATOM 1763 C MET A 113 -0.951 1.222 -8.312 1.00 0.00 C ATOM 1764 O MET A 113 -0.330 2.054 -8.959 1.00 0.00 O ATOM 1765 CB MET A 113 -0.989 1.759 -5.894 1.00 0.00 C ATOM 1766 CG MET A 113 -2.495 1.862 -5.908 1.00 0.00 C ATOM 1767 SD MET A 113 -3.122 3.181 -4.854 1.00 0.00 S ATOM 1768 CE MET A 113 -4.874 2.812 -4.874 1.00 0.00 C ATOM 0 H MET A 113 1.445 1.592 -6.865 1.00 0.00 H new ATOM 0 HA MET A 113 -0.877 -0.202 -6.711 1.00 0.00 H new ATOM 0 HB2 MET A 113 -0.656 1.437 -4.907 1.00 0.00 H new ATOM 0 HB3 MET A 113 -0.556 2.743 -6.071 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.832 2.031 -6.931 1.00 0.00 H new ATOM 0 HG3 MET A 113 -2.921 0.912 -5.584 1.00 0.00 H new ATOM 0 HE1 MET A 113 -5.424 3.634 -4.417 1.00 0.00 H new ATOM 0 HE2 MET A 113 -5.207 2.681 -5.904 1.00 0.00 H new ATOM 0 HE3 MET A 113 -5.059 1.896 -4.314 1.00 0.00 H new ATOM 1778 N THR A 114 -2.025 0.627 -8.767 1.00 0.00 N ATOM 1779 CA THR A 114 -2.543 0.912 -10.085 1.00 0.00 C ATOM 1780 C THR A 114 -4.024 1.307 -10.042 1.00 0.00 C ATOM 1781 O THR A 114 -4.847 0.604 -9.449 1.00 0.00 O ATOM 1782 CB THR A 114 -2.375 -0.321 -10.975 1.00 0.00 C ATOM 1783 OG1 THR A 114 -1.163 -1.009 -10.628 1.00 0.00 O ATOM 1784 CG2 THR A 114 -2.321 0.087 -12.427 1.00 0.00 C ATOM 0 H THR A 114 -2.562 -0.063 -8.241 1.00 0.00 H new ATOM 0 HA THR A 114 -1.981 1.754 -10.490 1.00 0.00 H new ATOM 0 HB THR A 114 -3.228 -0.982 -10.821 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.060 -1.799 -11.199 1.00 0.00 H new ATOM 0 HG21 THR A 114 -2.201 -0.799 -13.050 1.00 0.00 H new ATOM 0 HG22 THR A 114 -3.246 0.597 -12.696 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.477 0.758 -12.585 1.00 0.00 H new ATOM 1792 N LEU A 115 -4.364 2.426 -10.664 1.00 0.00 N ATOM 1793 CA LEU A 115 -5.760 2.801 -10.829 1.00 0.00 C ATOM 1794 C LEU A 115 -6.029 3.094 -12.294 1.00 0.00 C ATOM 1795 O LEU A 115 -5.644 4.143 -12.794 1.00 0.00 O ATOM 1796 CB LEU A 115 -6.092 4.038 -9.994 1.00 0.00 C ATOM 1797 CG LEU A 115 -7.502 4.056 -9.389 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -7.905 5.467 -9.033 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -8.514 3.456 -10.341 1.00 0.00 C ATOM 0 H LEU A 115 -3.696 3.087 -11.061 1.00 0.00 H new ATOM 0 HA LEU A 115 -6.387 1.976 -10.490 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -5.365 4.117 -9.185 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -5.970 4.923 -10.619 1.00 0.00 H new ATOM 0 HG LEU A 115 -7.483 3.450 -8.483 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -8.908 5.462 -8.605 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.202 5.874 -8.306 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -7.897 6.085 -9.931 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -9.503 3.483 -9.884 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.526 4.030 -11.268 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.242 2.423 -10.557 1.00 0.00 H new ATOM 1811 N GLY A 116 -6.740 2.187 -12.953 1.00 0.00 N ATOM 1812 CA GLY A 116 -7.053 2.348 -14.362 1.00 0.00 C ATOM 1813 C GLY A 116 -5.841 2.694 -15.221 1.00 0.00 C ATOM 1814 O GLY A 116 -5.133 1.807 -15.699 1.00 0.00 O ATOM 0 H GLY A 116 -7.109 1.334 -12.532 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.500 1.426 -14.734 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.802 3.132 -14.472 1.00 0.00 H new ATOM 1818 N ASP A 117 -5.611 3.990 -15.410 1.00 0.00 N ATOM 1819 CA ASP A 117 -4.505 4.473 -16.228 1.00 0.00 C ATOM 1820 C ASP A 117 -3.337 4.955 -15.363 1.00 0.00 C ATOM 1821 O ASP A 117 -2.179 4.874 -15.774 1.00 0.00 O ATOM 1822 CB ASP A 117 -4.980 5.607 -17.139 1.00 0.00 C ATOM 1823 CG ASP A 117 -3.912 6.068 -18.116 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -3.769 5.441 -19.186 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -3.228 7.074 -17.835 1.00 0.00 O ATOM 0 H ASP A 117 -6.183 4.730 -15.003 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.153 3.641 -16.838 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.856 5.276 -17.696 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.293 6.452 -16.526 1.00 0.00 H new ATOM 1830 N ILE A 118 -3.633 5.433 -14.157 1.00 0.00 N ATOM 1831 CA ILE A 118 -2.598 5.997 -13.291 1.00 0.00 C ATOM 1832 C ILE A 118 -1.845 4.912 -12.538 1.00 0.00 C ATOM 1833 O ILE A 118 -2.450 4.003 -11.964 1.00 0.00 O ATOM 1834 CB ILE A 118 -3.148 7.010 -12.278 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -4.375 6.453 -11.604 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -3.487 8.295 -12.964 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -5.018 7.392 -10.651 1.00 0.00 C ATOM 0 H ILE A 118 -4.572 5.442 -13.759 1.00 0.00 H new ATOM 0 HA ILE A 118 -1.918 6.521 -13.963 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.383 7.201 -11.525 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -5.101 6.172 -12.367 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -4.103 5.541 -11.072 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -3.876 9.005 -12.234 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -2.591 8.707 -13.429 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.241 8.111 -13.729 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -5.893 6.918 -10.208 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -4.310 7.654 -9.865 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -5.323 8.295 -11.180 1.00 0.00 H new ATOM 1849 N VAL A 119 -0.529 5.003 -12.548 1.00 0.00 N ATOM 1850 CA VAL A 119 0.291 4.084 -11.789 1.00 0.00 C ATOM 1851 C VAL A 119 0.967 4.837 -10.643 1.00 0.00 C ATOM 1852 O VAL A 119 1.329 6.002 -10.784 1.00 0.00 O ATOM 1853 CB VAL A 119 1.333 3.362 -12.678 1.00 0.00 C ATOM 1854 CG1 VAL A 119 2.613 4.165 -12.823 1.00 0.00 C ATOM 1855 CG2 VAL A 119 1.606 1.964 -12.148 1.00 0.00 C ATOM 0 H VAL A 119 -0.007 5.704 -13.074 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.353 3.307 -11.379 1.00 0.00 H new ATOM 0 HB VAL A 119 0.910 3.271 -13.678 1.00 0.00 H new ATOM 0 HG11 VAL A 119 3.315 3.620 -13.455 1.00 0.00 H new ATOM 0 HG12 VAL A 119 2.388 5.129 -13.279 1.00 0.00 H new ATOM 0 HG13 VAL A 119 3.057 4.323 -11.840 1.00 0.00 H new ATOM 0 HG21 VAL A 119 2.341 1.471 -12.785 1.00 0.00 H new ATOM 0 HG22 VAL A 119 1.993 2.030 -11.131 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.681 1.388 -12.148 1.00 0.00 H new ATOM 1865 N TYR A 120 1.095 4.178 -9.513 1.00 0.00 N ATOM 1866 CA TYR A 120 1.592 4.790 -8.289 1.00 0.00 C ATOM 1867 C TYR A 120 2.596 3.850 -7.628 1.00 0.00 C ATOM 1868 O TYR A 120 2.390 2.650 -7.616 1.00 0.00 O ATOM 1869 CB TYR A 120 0.398 5.067 -7.356 1.00 0.00 C ATOM 1870 CG TYR A 120 0.764 5.647 -6.011 1.00 0.00 C ATOM 1871 CD1 TYR A 120 1.441 6.850 -5.918 1.00 0.00 C ATOM 1872 CD2 TYR A 120 0.412 4.998 -4.835 1.00 0.00 C ATOM 1873 CE1 TYR A 120 1.764 7.394 -4.697 1.00 0.00 C ATOM 1874 CE2 TYR A 120 0.732 5.534 -3.604 1.00 0.00 C ATOM 1875 CZ TYR A 120 1.407 6.734 -3.541 1.00 0.00 C ATOM 1876 OH TYR A 120 1.722 7.279 -2.318 1.00 0.00 O ATOM 0 H TYR A 120 0.856 3.192 -9.411 1.00 0.00 H new ATOM 0 HA TYR A 120 2.096 5.732 -8.507 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -0.285 5.753 -7.858 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.145 4.135 -7.198 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.721 7.372 -6.821 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.120 4.060 -4.884 1.00 0.00 H new ATOM 0 HE1 TYR A 120 2.294 8.333 -4.644 1.00 0.00 H new ATOM 0 HE2 TYR A 120 0.456 5.017 -2.697 1.00 0.00 H new ATOM 0 HH TYR A 120 2.696 7.348 -2.232 1.00 0.00 H new ATOM 1886 N LYS A 121 3.705 4.366 -7.128 1.00 0.00 N ATOM 1887 CA LYS A 121 4.705 3.499 -6.508 1.00 0.00 C ATOM 1888 C LYS A 121 5.213 4.085 -5.201 1.00 0.00 C ATOM 1889 O LYS A 121 5.241 5.298 -5.030 1.00 0.00 O ATOM 1890 CB LYS A 121 5.883 3.283 -7.458 1.00 0.00 C ATOM 1891 CG LYS A 121 6.831 2.170 -7.051 1.00 0.00 C ATOM 1892 CD LYS A 121 8.243 2.698 -6.912 1.00 0.00 C ATOM 1893 CE LYS A 121 9.248 1.820 -7.616 1.00 0.00 C ATOM 1894 NZ LYS A 121 10.470 2.573 -7.996 1.00 0.00 N ATOM 0 H LYS A 121 3.938 5.359 -7.135 1.00 0.00 H new ATOM 0 HA LYS A 121 4.225 2.544 -6.296 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.494 3.065 -8.453 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.447 4.213 -7.533 1.00 0.00 H new ATOM 0 HG2 LYS A 121 6.505 1.734 -6.106 1.00 0.00 H new ATOM 0 HG3 LYS A 121 6.806 1.374 -7.795 1.00 0.00 H new ATOM 0 HD2 LYS A 121 8.294 3.707 -7.321 1.00 0.00 H new ATOM 0 HD3 LYS A 121 8.501 2.769 -5.855 1.00 0.00 H new ATOM 0 HE2 LYS A 121 9.521 0.988 -6.967 1.00 0.00 H new ATOM 0 HE3 LYS A 121 8.793 1.391 -8.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.143 1.931 -8.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 10.215 3.341 -8.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.909 2.975 -7.143 1.00 0.00 H new ATOM 1908 N ARG A 122 5.588 3.212 -4.272 1.00 0.00 N ATOM 1909 CA ARG A 122 6.321 3.613 -3.086 1.00 0.00 C ATOM 1910 C ARG A 122 7.437 2.615 -2.812 1.00 0.00 C ATOM 1911 O ARG A 122 7.291 1.433 -3.078 1.00 0.00 O ATOM 1912 CB ARG A 122 5.439 3.693 -1.839 1.00 0.00 C ATOM 1913 CG ARG A 122 4.097 4.362 -2.015 1.00 0.00 C ATOM 1914 CD ARG A 122 3.283 4.239 -0.736 1.00 0.00 C ATOM 1915 NE ARG A 122 2.445 5.408 -0.501 1.00 0.00 N ATOM 1916 CZ ARG A 122 2.141 5.867 0.710 1.00 0.00 C ATOM 1917 NH1 ARG A 122 2.517 5.200 1.791 1.00 0.00 N ATOM 1918 NH2 ARG A 122 1.455 6.993 0.835 1.00 0.00 N ATOM 0 H ARG A 122 5.392 2.212 -4.323 1.00 0.00 H new ATOM 0 HA ARG A 122 6.716 4.609 -3.287 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.272 2.680 -1.472 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.989 4.226 -1.064 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.236 5.413 -2.268 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.559 3.903 -2.844 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.655 3.350 -0.791 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.957 4.102 0.110 1.00 0.00 H new ATOM 0 HE ARG A 122 2.070 5.902 -1.311 1.00 0.00 H new ATOM 0 HH11 ARG A 122 3.042 4.331 1.697 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.282 5.556 2.717 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.161 7.506 0.004 1.00 0.00 H new ATOM 0 HH22 ARG A 122 1.221 7.347 1.762 1.00 0.00 H new ATOM 1932 N VAL A 123 8.549 3.092 -2.309 1.00 0.00 N ATOM 1933 CA VAL A 123 9.640 2.231 -1.904 1.00 0.00 C ATOM 1934 C VAL A 123 9.889 2.414 -0.411 1.00 0.00 C ATOM 1935 O VAL A 123 10.235 3.504 0.022 1.00 0.00 O ATOM 1936 CB VAL A 123 10.910 2.566 -2.688 1.00 0.00 C ATOM 1937 CG1 VAL A 123 12.038 1.601 -2.337 1.00 0.00 C ATOM 1938 CG2 VAL A 123 10.603 2.536 -4.176 1.00 0.00 C ATOM 0 H VAL A 123 8.726 4.087 -2.168 1.00 0.00 H new ATOM 0 HA VAL A 123 9.374 1.195 -2.111 1.00 0.00 H new ATOM 0 HB VAL A 123 11.246 3.567 -2.416 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.930 1.861 -2.908 1.00 0.00 H new ATOM 0 HG12 VAL A 123 12.257 1.669 -1.271 1.00 0.00 H new ATOM 0 HG13 VAL A 123 11.735 0.583 -2.581 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.506 2.774 -4.739 1.00 0.00 H new ATOM 0 HG22 VAL A 123 10.253 1.542 -4.455 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.830 3.270 -4.403 1.00 0.00 H new ATOM 1948 N SER A 124 9.717 1.362 0.366 1.00 0.00 N ATOM 1949 CA SER A 124 9.788 1.472 1.817 1.00 0.00 C ATOM 1950 C SER A 124 11.062 0.864 2.359 1.00 0.00 C ATOM 1951 O SER A 124 11.681 0.010 1.730 1.00 0.00 O ATOM 1952 CB SER A 124 8.571 0.799 2.446 1.00 0.00 C ATOM 1953 OG SER A 124 7.391 1.136 1.734 1.00 0.00 O ATOM 0 H SER A 124 9.527 0.421 0.021 1.00 0.00 H new ATOM 0 HA SER A 124 9.792 2.531 2.077 1.00 0.00 H new ATOM 0 HB2 SER A 124 8.706 -0.283 2.446 1.00 0.00 H new ATOM 0 HB3 SER A 124 8.475 1.108 3.487 1.00 0.00 H new ATOM 0 HG SER A 124 6.621 0.695 2.150 1.00 0.00 H new ATOM 1959 N LYS A 125 11.441 1.334 3.526 1.00 0.00 N ATOM 1960 CA LYS A 125 12.657 0.915 4.178 1.00 0.00 C ATOM 1961 C LYS A 125 12.365 0.294 5.521 1.00 0.00 C ATOM 1962 O LYS A 125 11.405 0.651 6.201 1.00 0.00 O ATOM 1963 CB LYS A 125 13.562 2.126 4.374 1.00 0.00 C ATOM 1964 CG LYS A 125 14.709 2.232 3.386 1.00 0.00 C ATOM 1965 CD LYS A 125 15.628 1.035 3.484 1.00 0.00 C ATOM 1966 CE LYS A 125 16.883 1.220 2.652 1.00 0.00 C ATOM 1967 NZ LYS A 125 17.831 0.086 2.822 1.00 0.00 N ATOM 0 H LYS A 125 10.907 2.025 4.053 1.00 0.00 H new ATOM 0 HA LYS A 125 13.147 0.170 3.551 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.956 3.029 4.304 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.972 2.095 5.383 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.314 2.308 2.373 1.00 0.00 H new ATOM 0 HG3 LYS A 125 15.274 3.144 3.577 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.903 0.872 4.526 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.099 0.142 3.151 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.612 1.312 1.600 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.374 2.150 2.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.676 0.249 2.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.110 0.013 3.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.371 -0.798 2.526 1.00 0.00 H new ATOM 1981 N ARG A 126 13.210 -0.640 5.893 1.00 0.00 N ATOM 1982 CA ARG A 126 13.083 -1.318 7.153 1.00 0.00 C ATOM 1983 C ARG A 126 13.446 -0.397 8.312 1.00 0.00 C ATOM 1984 O ARG A 126 14.564 0.125 8.372 1.00 0.00 O ATOM 1985 CB ARG A 126 13.988 -2.544 7.172 1.00 0.00 C ATOM 1986 CG ARG A 126 13.254 -3.807 7.543 1.00 0.00 C ATOM 1987 CD ARG A 126 12.215 -3.513 8.601 1.00 0.00 C ATOM 1988 NE ARG A 126 11.614 -4.724 9.152 1.00 0.00 N ATOM 1989 CZ ARG A 126 11.663 -5.043 10.445 1.00 0.00 C ATOM 1990 NH1 ARG A 126 12.265 -4.227 11.308 1.00 0.00 N ATOM 1991 NH2 ARG A 126 11.111 -6.169 10.874 1.00 0.00 N ATOM 0 H ARG A 126 14.002 -0.947 5.328 1.00 0.00 H new ATOM 0 HA ARG A 126 12.044 -1.625 7.271 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.443 -2.669 6.189 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.800 -2.380 7.881 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.775 -4.231 6.660 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.959 -4.552 7.912 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.675 -2.941 9.407 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.433 -2.887 8.172 1.00 0.00 H new ATOM 0 HE ARG A 126 11.132 -5.358 8.515 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.688 -3.359 10.979 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.303 -4.470 12.298 1.00 0.00 H new ATOM 0 HH21 ARG A 126 10.647 -6.793 10.214 1.00 0.00 H new ATOM 0 HH22 ARG A 126 11.150 -6.411 11.864 1.00 0.00 H new ATOM 2005 N ILE A 127 12.504 -0.197 9.225 1.00 0.00 N ATOM 2006 CA ILE A 127 12.800 0.511 10.452 1.00 0.00 C ATOM 2007 C ILE A 127 12.859 -0.470 11.623 1.00 0.00 C ATOM 2008 O ILE A 127 12.121 -0.274 12.613 1.00 0.00 O ATOM 2009 CB ILE A 127 11.785 1.618 10.765 1.00 0.00 C ATOM 2010 CG1 ILE A 127 10.370 1.128 10.534 1.00 0.00 C ATOM 2011 CG2 ILE A 127 12.065 2.841 9.938 1.00 0.00 C ATOM 2012 CD1 ILE A 127 9.347 2.170 10.836 1.00 0.00 C ATOM 2013 OXT ILE A 127 13.612 -1.463 11.529 1.00 0.00 O ATOM 0 H ILE A 127 11.539 -0.514 9.136 1.00 0.00 H new ATOM 0 HA ILE A 127 13.769 0.990 10.309 1.00 0.00 H new ATOM 0 HB ILE A 127 11.885 1.886 11.817 1.00 0.00 H new ATOM 0 HG12 ILE A 127 10.264 0.810 9.497 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.186 0.252 11.156 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.335 3.615 10.174 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.067 3.208 10.159 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.997 2.588 8.880 1.00 0.00 H new ATOM 0 HD11 ILE A 127 8.351 1.766 10.654 1.00 0.00 H new ATOM 0 HD12 ILE A 127 9.431 2.470 11.880 1.00 0.00 H new ATOM 0 HD13 ILE A 127 9.510 3.036 10.195 1.00 0.00 H new TER 2025 ILE A 127