USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1127 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 22 SER OG : rot 109:sc= 0.291 USER MOD Set 1.2: A 66 GLN : amide:sc= 1.1 K(o=1.4,f=0.18) USER MOD Set 2.1: A 1 SER N :NH3+ -168:sc= 1.73 (180deg=0.337) USER MOD Set 2.2: A 1 SER OG : rot 9:sc= 1.16 USER MOD Set 2.3: A 28 GLN : amide:sc= 2.03 K(o=4.9,f=-2.1!) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-1.8) USER MOD Single : A 5 THR OG1 : rot 0:sc= 1.32 USER MOD Single : A 6 THR OG1 : rot -17:sc= 0.335 USER MOD Single : A 7 LYS NZ :NH3+ -167:sc= -0.0102 (180deg=-0.182) USER MOD Single : A 9 ASN : amide:sc=-0.00267 X(o=-0.0027,f=0) USER MOD Single : A 10 THR OG1 : rot -69:sc= 1.21 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 17 SER OG : rot -168:sc= 1.33 USER MOD Single : A 19 SER OG : rot -83:sc= 0.269 USER MOD Single : A 20 SER OG : rot 95:sc= 1.33 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0.073 USER MOD Single : A 34 LYS NZ :NH3+ 178:sc= 1.94 (180deg=1.93) USER MOD Single : A 38 MET CE :methyl 147:sc= 0 (180deg=-0.315) USER MOD Single : A 40 LYS NZ :NH3+ -118:sc= 0.727 (180deg=-0.00337) USER MOD Single : A 42 TYR OH : rot 168:sc= 0.46 USER MOD Single : A 43 MET CE :methyl -165:sc= -0.0977 (180deg=-0.517) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc=-0.000433 K(o=-0.00043,f=-0.76) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 178:sc= 1.15 (180deg=1.14) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl -125:sc= -0.129 (180deg=-1.15) USER MOD Single : A 61 ASN : amide:sc= -0.0659 K(o=-0.066,f=-2.8!) USER MOD Single : A 62 HIS : no HD1:sc= -0.293 K(o=-0.29,f=-1.3) USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 68 LYS NZ :NH3+ -179:sc= 1.15 (180deg=1.15) USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-3) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.0627 X(o=-0.063,f=-0.17) USER MOD Single : A 76 GLN : amide:sc= 1.18 K(o=1.2,f=-1.1) USER MOD Single : A 78 SER OG : rot 92:sc= 1.24 USER MOD Single : A 81 LYS NZ :NH3+ -158:sc= 1.22 (180deg=0.901) USER MOD Single : A 91 ASN : amide:sc= -0.31 K(o=-0.31,f=-2.4!) USER MOD Single : A 92 GLN : amide:sc= 0.422 K(o=0.42,f=-0.84) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot -36:sc= 1.21 USER MOD Single : A 107 ASN : amide:sc= -0.0488 K(o=-0.049,f=-1.7!) USER MOD Single : A 110 LYS NZ :NH3+ -163:sc= 1.27 (180deg=1.19) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 116 SER OG : rot 180:sc= -0.268 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= 0.0883 X(o=0.088,f=-0.048) USER MOD Single : A 121 ASN : amide:sc= -0.0725 K(o=-0.073,f=-1.6!) USER MOD Single : A 126 SER OG : rot -163:sc= 1.11 USER MOD Single : A 133 HIS : no HD1:sc=-0.00848 X(o=-0.0085,f=-0.0085) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.539 -3.674 0.221 1.00 0.00 N ATOM 2 CA SER A 1 3.269 -2.744 -0.632 1.00 0.00 C ATOM 3 C SER A 1 2.557 -1.400 -0.717 1.00 0.00 C ATOM 4 O SER A 1 2.359 -0.859 -1.805 1.00 0.00 O ATOM 5 CB SER A 1 3.432 -3.328 -2.022 1.00 0.00 C ATOM 6 OG SER A 1 4.242 -4.471 -1.994 1.00 0.00 O ATOM 0 H1 SER A 1 3.137 -4.500 0.426 1.00 0.00 H new ATOM 0 H2 SER A 1 2.284 -3.201 1.112 1.00 0.00 H new ATOM 0 H3 SER A 1 1.674 -3.985 -0.265 1.00 0.00 H new ATOM 0 HA SER A 1 4.252 -2.583 -0.190 1.00 0.00 H new ATOM 0 HB2 SER A 1 2.454 -3.581 -2.431 1.00 0.00 H new ATOM 0 HB3 SER A 1 3.872 -2.582 -2.684 1.00 0.00 H new ATOM 0 HG SER A 1 4.412 -4.729 -1.064 1.00 0.00 H new ATOM 14 N GLU A 2 2.175 -0.865 0.438 1.00 0.00 N ATOM 15 CA GLU A 2 1.411 0.376 0.491 1.00 0.00 C ATOM 16 C GLU A 2 2.288 1.577 0.163 1.00 0.00 C ATOM 17 O GLU A 2 1.787 2.657 -0.153 1.00 0.00 O ATOM 18 CB GLU A 2 0.781 0.556 1.874 1.00 0.00 C ATOM 19 CG GLU A 2 -0.297 -0.464 2.211 1.00 0.00 C ATOM 20 CD GLU A 2 0.262 -1.819 2.544 1.00 0.00 C ATOM 21 OE1 GLU A 2 1.452 -1.993 2.432 1.00 0.00 O ATOM 22 OE2 GLU A 2 -0.501 -2.681 2.910 1.00 0.00 O ATOM 0 H GLU A 2 2.382 -1.272 1.350 1.00 0.00 H new ATOM 0 HA GLU A 2 0.621 0.313 -0.257 1.00 0.00 H new ATOM 0 HB2 GLU A 2 1.566 0.499 2.628 1.00 0.00 H new ATOM 0 HB3 GLU A 2 0.351 1.556 1.937 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -0.882 -0.101 3.056 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -0.980 -0.556 1.366 1.00 0.00 H new ATOM 29 N GLN A 3 3.601 1.384 0.238 1.00 0.00 N ATOM 30 CA GLN A 3 4.552 2.432 -0.112 1.00 0.00 C ATOM 31 C GLN A 3 4.493 2.753 -1.600 1.00 0.00 C ATOM 32 O GLN A 3 4.974 3.798 -2.039 1.00 0.00 O ATOM 33 CB GLN A 3 5.973 2.018 0.278 1.00 0.00 C ATOM 34 CG GLN A 3 6.204 1.920 1.776 1.00 0.00 C ATOM 35 CD GLN A 3 7.611 1.468 2.117 1.00 0.00 C ATOM 36 OE1 GLN A 3 8.395 1.111 1.232 1.00 0.00 O ATOM 37 NE2 GLN A 3 7.940 1.478 3.403 1.00 0.00 N ATOM 0 H GLN A 3 4.031 0.509 0.539 1.00 0.00 H new ATOM 0 HA GLN A 3 4.279 3.329 0.443 1.00 0.00 H new ATOM 0 HB2 GLN A 3 6.196 1.053 -0.177 1.00 0.00 H new ATOM 0 HB3 GLN A 3 6.677 2.737 -0.141 1.00 0.00 H new ATOM 0 HG2 GLN A 3 6.017 2.891 2.234 1.00 0.00 H new ATOM 0 HG3 GLN A 3 5.487 1.221 2.206 1.00 0.00 H new ATOM 0 HE21 GLN A 3 7.261 1.781 4.101 1.00 0.00 H new ATOM 0 HE22 GLN A 3 8.872 1.183 3.693 1.00 0.00 H new ATOM 46 N PHE A 4 3.902 1.849 -2.373 1.00 0.00 N ATOM 47 CA PHE A 4 3.666 2.089 -3.792 1.00 0.00 C ATOM 48 C PHE A 4 3.072 3.472 -4.025 1.00 0.00 C ATOM 49 O PHE A 4 3.425 4.156 -4.985 1.00 0.00 O ATOM 50 CB PHE A 4 2.731 1.023 -4.367 1.00 0.00 C ATOM 51 CG PHE A 4 2.334 1.272 -5.794 1.00 0.00 C ATOM 52 CD1 PHE A 4 3.264 1.166 -6.817 1.00 0.00 C ATOM 53 CD2 PHE A 4 1.029 1.614 -6.116 1.00 0.00 C ATOM 54 CE1 PHE A 4 2.900 1.394 -8.130 1.00 0.00 C ATOM 55 CE2 PHE A 4 0.662 1.842 -7.428 1.00 0.00 C ATOM 56 CZ PHE A 4 1.599 1.732 -8.436 1.00 0.00 C ATOM 0 H PHE A 4 3.577 0.941 -2.040 1.00 0.00 H new ATOM 0 HA PHE A 4 4.628 2.035 -4.301 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.219 0.051 -4.300 1.00 0.00 H new ATOM 0 HB3 PHE A 4 1.832 0.972 -3.753 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.285 0.902 -6.585 1.00 0.00 H new ATOM 0 HD2 PHE A 4 0.291 1.703 -5.332 1.00 0.00 H new ATOM 0 HE1 PHE A 4 3.635 1.307 -8.917 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -0.358 2.106 -7.665 1.00 0.00 H new ATOM 0 HZ PHE A 4 1.313 1.910 -9.462 1.00 0.00 H new ATOM 66 N THR A 5 2.168 3.879 -3.140 1.00 0.00 N ATOM 67 CA THR A 5 1.523 5.182 -3.248 1.00 0.00 C ATOM 68 C THR A 5 2.547 6.286 -3.480 1.00 0.00 C ATOM 69 O THR A 5 2.368 7.139 -4.349 1.00 0.00 O ATOM 70 CB THR A 5 0.698 5.498 -1.986 1.00 0.00 C ATOM 71 OG1 THR A 5 -0.317 4.501 -1.814 1.00 0.00 O ATOM 72 CG2 THR A 5 0.045 6.867 -2.106 1.00 0.00 C ATOM 0 H THR A 5 1.865 3.324 -2.339 1.00 0.00 H new ATOM 0 HA THR A 5 0.852 5.140 -4.106 1.00 0.00 H new ATOM 0 HB THR A 5 1.365 5.499 -1.124 1.00 0.00 H new ATOM 0 HG1 THR A 5 -0.254 3.842 -2.536 1.00 0.00 H new ATOM 0 HG21 THR A 5 -0.534 7.074 -1.206 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.816 7.629 -2.225 1.00 0.00 H new ATOM 0 HG23 THR A 5 -0.615 6.880 -2.973 1.00 0.00 H new ATOM 80 N THR A 6 3.621 6.264 -2.697 1.00 0.00 N ATOM 81 CA THR A 6 4.598 7.346 -2.707 1.00 0.00 C ATOM 82 C THR A 6 5.717 7.068 -3.702 1.00 0.00 C ATOM 83 O THR A 6 6.331 7.993 -4.234 1.00 0.00 O ATOM 84 CB THR A 6 5.195 7.566 -1.304 1.00 0.00 C ATOM 85 OG1 THR A 6 5.886 6.381 -0.885 1.00 0.00 O ATOM 86 CG2 THR A 6 4.098 7.889 -0.302 1.00 0.00 C ATOM 0 H THR A 6 3.836 5.508 -2.047 1.00 0.00 H new ATOM 0 HA THR A 6 4.074 8.252 -3.013 1.00 0.00 H new ATOM 0 HB THR A 6 5.890 8.404 -1.349 1.00 0.00 H new ATOM 0 HG1 THR A 6 5.607 5.625 -1.443 1.00 0.00 H new ATOM 0 HG21 THR A 6 4.539 8.041 0.683 1.00 0.00 H new ATOM 0 HG22 THR A 6 3.578 8.796 -0.611 1.00 0.00 H new ATOM 0 HG23 THR A 6 3.390 7.062 -0.259 1.00 0.00 H new ATOM 94 N LYS A 7 5.979 5.789 -3.949 1.00 0.00 N ATOM 95 CA LYS A 7 6.996 5.388 -4.913 1.00 0.00 C ATOM 96 C LYS A 7 6.571 5.730 -6.336 1.00 0.00 C ATOM 97 O LYS A 7 7.392 6.138 -7.157 1.00 0.00 O ATOM 98 CB LYS A 7 7.283 3.890 -4.797 1.00 0.00 C ATOM 99 CG LYS A 7 8.032 3.489 -3.533 1.00 0.00 C ATOM 100 CD LYS A 7 8.330 1.998 -3.516 1.00 0.00 C ATOM 101 CE LYS A 7 9.078 1.596 -2.254 1.00 0.00 C ATOM 102 NZ LYS A 7 10.413 2.248 -2.166 1.00 0.00 N ATOM 0 H LYS A 7 5.500 5.012 -3.494 1.00 0.00 H new ATOM 0 HA LYS A 7 7.907 5.942 -4.686 1.00 0.00 H new ATOM 0 HB2 LYS A 7 6.338 3.348 -4.832 1.00 0.00 H new ATOM 0 HB3 LYS A 7 7.864 3.575 -5.664 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.965 4.049 -3.468 1.00 0.00 H new ATOM 0 HG3 LYS A 7 7.439 3.753 -2.657 1.00 0.00 H new ATOM 0 HD2 LYS A 7 7.397 1.438 -3.582 1.00 0.00 H new ATOM 0 HD3 LYS A 7 8.923 1.734 -4.392 1.00 0.00 H new ATOM 0 HE2 LYS A 7 8.485 1.865 -1.380 1.00 0.00 H new ATOM 0 HE3 LYS A 7 9.201 0.513 -2.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 10.975 1.789 -1.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 10.905 2.156 -3.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 10.293 3.255 -1.937 1.00 0.00 H new ATOM 116 N LEU A 8 5.285 5.563 -6.620 1.00 0.00 N ATOM 117 CA LEU A 8 4.716 6.006 -7.888 1.00 0.00 C ATOM 118 C LEU A 8 4.608 7.525 -7.941 1.00 0.00 C ATOM 119 O LEU A 8 4.982 8.149 -8.934 1.00 0.00 O ATOM 120 CB LEU A 8 3.331 5.381 -8.095 1.00 0.00 C ATOM 121 CG LEU A 8 2.584 5.823 -9.360 1.00 0.00 C ATOM 122 CD1 LEU A 8 3.452 5.554 -10.582 1.00 0.00 C ATOM 123 CD2 LEU A 8 1.261 5.079 -9.455 1.00 0.00 C ATOM 0 H LEU A 8 4.615 5.123 -5.989 1.00 0.00 H new ATOM 0 HA LEU A 8 5.383 5.680 -8.686 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.442 4.297 -8.121 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.713 5.617 -7.229 1.00 0.00 H new ATOM 0 HG LEU A 8 2.375 6.892 -9.315 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.922 5.868 -11.481 1.00 0.00 H new ATOM 0 HD12 LEU A 8 4.384 6.113 -10.497 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.673 4.488 -10.644 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.731 5.393 -10.354 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.449 4.006 -9.501 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.654 5.303 -8.578 1.00 0.00 H new ATOM 135 N ASN A 9 4.093 8.114 -6.868 1.00 0.00 N ATOM 136 CA ASN A 9 3.931 9.561 -6.792 1.00 0.00 C ATOM 137 C ASN A 9 5.241 10.279 -7.091 1.00 0.00 C ATOM 138 O ASN A 9 5.260 11.291 -7.791 1.00 0.00 O ATOM 139 CB ASN A 9 3.399 9.968 -5.430 1.00 0.00 C ATOM 140 CG ASN A 9 3.032 11.425 -5.365 1.00 0.00 C ATOM 141 OD1 ASN A 9 2.106 11.876 -6.049 1.00 0.00 O ATOM 142 ND2 ASN A 9 3.741 12.170 -4.555 1.00 0.00 N ATOM 0 H ASN A 9 3.780 7.611 -6.038 1.00 0.00 H new ATOM 0 HA ASN A 9 3.206 9.857 -7.550 1.00 0.00 H new ATOM 0 HB2 ASN A 9 2.523 9.365 -5.191 1.00 0.00 H new ATOM 0 HB3 ASN A 9 4.151 9.752 -4.671 1.00 0.00 H new ATOM 0 HD21 ASN A 9 3.538 13.166 -4.469 1.00 0.00 H new ATOM 0 HD22 ASN A 9 4.496 11.755 -4.010 1.00 0.00 H new ATOM 149 N THR A 10 6.336 9.748 -6.558 1.00 0.00 N ATOM 150 CA THR A 10 7.656 10.325 -6.783 1.00 0.00 C ATOM 151 C THR A 10 8.531 9.392 -7.609 1.00 0.00 C ATOM 152 O THR A 10 9.738 9.297 -7.386 1.00 0.00 O ATOM 153 CB THR A 10 8.356 10.646 -5.449 1.00 0.00 C ATOM 154 OG1 THR A 10 8.467 9.450 -4.666 1.00 0.00 O ATOM 155 CG2 THR A 10 7.567 11.687 -4.670 1.00 0.00 C ATOM 0 H THR A 10 6.335 8.917 -5.966 1.00 0.00 H new ATOM 0 HA THR A 10 7.512 11.253 -7.337 1.00 0.00 H new ATOM 0 HB THR A 10 9.349 11.043 -5.662 1.00 0.00 H new ATOM 0 HG1 THR A 10 7.576 9.171 -4.367 1.00 0.00 H new ATOM 0 HG21 THR A 10 8.076 11.901 -3.730 1.00 0.00 H new ATOM 0 HG22 THR A 10 7.491 12.601 -5.258 1.00 0.00 H new ATOM 0 HG23 THR A 10 6.567 11.305 -4.462 1.00 0.00 H new ATOM 163 N LEU A 11 7.917 8.704 -8.565 1.00 0.00 N ATOM 164 CA LEU A 11 8.640 7.778 -9.429 1.00 0.00 C ATOM 165 C LEU A 11 9.700 8.502 -10.247 1.00 0.00 C ATOM 166 O LEU A 11 9.397 9.443 -10.981 1.00 0.00 O ATOM 167 CB LEU A 11 7.664 7.057 -10.367 1.00 0.00 C ATOM 168 CG LEU A 11 8.270 5.937 -11.223 1.00 0.00 C ATOM 169 CD1 LEU A 11 8.775 4.822 -10.317 1.00 0.00 C ATOM 170 CD2 LEU A 11 7.221 5.417 -12.196 1.00 0.00 C ATOM 0 H LEU A 11 6.918 8.770 -8.762 1.00 0.00 H new ATOM 0 HA LEU A 11 9.138 7.046 -8.793 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.857 6.635 -9.768 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.215 7.795 -11.032 1.00 0.00 H new ATOM 0 HG LEU A 11 9.112 6.322 -11.798 1.00 0.00 H new ATOM 0 HD11 LEU A 11 9.206 4.026 -10.925 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.536 5.217 -9.644 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.945 4.424 -9.733 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.651 4.621 -12.804 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.369 5.027 -11.639 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.890 6.230 -12.843 1.00 0.00 H new ATOM 182 N GLU A 12 10.946 8.059 -10.117 1.00 0.00 N ATOM 183 CA GLU A 12 12.064 8.703 -10.796 1.00 0.00 C ATOM 184 C GLU A 12 11.995 8.482 -12.302 1.00 0.00 C ATOM 185 O GLU A 12 11.690 7.383 -12.764 1.00 0.00 O ATOM 186 CB GLU A 12 13.394 8.175 -10.254 1.00 0.00 C ATOM 187 CG GLU A 12 14.624 8.860 -10.831 1.00 0.00 C ATOM 188 CD GLU A 12 15.910 8.336 -10.255 1.00 0.00 C ATOM 189 OE1 GLU A 12 15.869 7.347 -9.563 1.00 0.00 O ATOM 190 OE2 GLU A 12 16.935 8.924 -10.508 1.00 0.00 O ATOM 0 H GLU A 12 11.207 7.255 -9.546 1.00 0.00 H new ATOM 0 HA GLU A 12 11.998 9.774 -10.602 1.00 0.00 H new ATOM 0 HB2 GLU A 12 13.403 8.292 -9.170 1.00 0.00 H new ATOM 0 HB3 GLU A 12 13.458 7.107 -10.460 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.635 8.725 -11.913 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.558 9.932 -10.644 1.00 0.00 H new ATOM 197 N ASP A 13 12.279 9.534 -13.063 1.00 0.00 N ATOM 198 CA ASP A 13 12.323 9.438 -14.517 1.00 0.00 C ATOM 199 C ASP A 13 13.540 8.649 -14.981 1.00 0.00 C ATOM 200 O ASP A 13 14.508 9.221 -15.483 1.00 0.00 O ATOM 201 CB ASP A 13 12.341 10.833 -15.146 1.00 0.00 C ATOM 202 CG ASP A 13 12.234 10.800 -16.665 1.00 0.00 C ATOM 203 OD1 ASP A 13 12.076 9.731 -17.206 1.00 0.00 O ATOM 204 OD2 ASP A 13 12.312 11.843 -17.269 1.00 0.00 O ATOM 0 H ASP A 13 12.482 10.464 -12.696 1.00 0.00 H new ATOM 0 HA ASP A 13 11.426 8.910 -14.841 1.00 0.00 H new ATOM 0 HB2 ASP A 13 11.516 11.419 -14.741 1.00 0.00 H new ATOM 0 HB3 ASP A 13 13.262 11.342 -14.863 1.00 0.00 H new ATOM 209 N SER A 14 13.487 7.333 -14.809 1.00 0.00 N ATOM 210 CA SER A 14 14.588 6.463 -15.204 1.00 0.00 C ATOM 211 C SER A 14 14.147 5.007 -15.263 1.00 0.00 C ATOM 212 O SER A 14 13.583 4.480 -14.303 1.00 0.00 O ATOM 213 CB SER A 14 15.744 6.612 -14.234 1.00 0.00 C ATOM 214 OG SER A 14 16.795 5.747 -14.569 1.00 0.00 O ATOM 0 H SER A 14 12.692 6.845 -14.398 1.00 0.00 H new ATOM 0 HA SER A 14 14.911 6.762 -16.201 1.00 0.00 H new ATOM 0 HB2 SER A 14 16.100 7.642 -14.242 1.00 0.00 H new ATOM 0 HB3 SER A 14 15.403 6.400 -13.221 1.00 0.00 H new ATOM 0 HG SER A 14 17.530 5.862 -13.931 1.00 0.00 H new ATOM 220 N GLN A 15 14.405 4.360 -16.394 1.00 0.00 N ATOM 221 CA GLN A 15 13.922 3.005 -16.630 1.00 0.00 C ATOM 222 C GLN A 15 14.487 2.032 -15.603 1.00 0.00 C ATOM 223 O GLN A 15 13.811 1.090 -15.188 1.00 0.00 O ATOM 224 CB GLN A 15 14.288 2.543 -18.043 1.00 0.00 C ATOM 225 CG GLN A 15 13.529 3.259 -19.147 1.00 0.00 C ATOM 226 CD GLN A 15 13.973 2.822 -20.531 1.00 0.00 C ATOM 227 OE1 GLN A 15 15.093 2.339 -20.715 1.00 0.00 O ATOM 228 NE2 GLN A 15 13.095 2.991 -21.513 1.00 0.00 N ATOM 0 H GLN A 15 14.947 4.753 -17.163 1.00 0.00 H new ATOM 0 HA GLN A 15 12.837 3.018 -16.530 1.00 0.00 H new ATOM 0 HB2 GLN A 15 15.357 2.692 -18.197 1.00 0.00 H new ATOM 0 HB3 GLN A 15 14.100 1.472 -18.123 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.462 3.068 -19.033 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.673 4.335 -19.045 1.00 0.00 H new ATOM 0 HE21 GLN A 15 12.180 3.395 -21.315 1.00 0.00 H new ATOM 0 HE22 GLN A 15 13.336 2.717 -22.465 1.00 0.00 H new ATOM 237 N GLU A 16 15.730 2.265 -15.195 1.00 0.00 N ATOM 238 CA GLU A 16 16.384 1.416 -14.206 1.00 0.00 C ATOM 239 C GLU A 16 15.674 1.490 -12.861 1.00 0.00 C ATOM 240 O GLU A 16 15.460 0.471 -12.204 1.00 0.00 O ATOM 241 CB GLU A 16 17.851 1.821 -14.043 1.00 0.00 C ATOM 242 CG GLU A 16 18.729 1.500 -15.244 1.00 0.00 C ATOM 243 CD GLU A 16 20.149 1.963 -15.071 1.00 0.00 C ATOM 244 OE1 GLU A 16 20.423 2.627 -14.100 1.00 0.00 O ATOM 245 OE2 GLU A 16 20.961 1.651 -15.910 1.00 0.00 O ATOM 0 H GLU A 16 16.305 3.036 -15.535 1.00 0.00 H new ATOM 0 HA GLU A 16 16.334 0.388 -14.564 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.900 2.892 -13.848 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.259 1.319 -13.166 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.721 0.424 -15.416 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.305 1.968 -16.133 1.00 0.00 H new ATOM 252 N SER A 17 15.310 2.702 -12.455 1.00 0.00 N ATOM 253 CA SER A 17 14.608 2.909 -11.194 1.00 0.00 C ATOM 254 C SER A 17 13.173 2.404 -11.273 1.00 0.00 C ATOM 255 O SER A 17 12.642 1.861 -10.304 1.00 0.00 O ATOM 256 CB SER A 17 14.616 4.380 -10.827 1.00 0.00 C ATOM 257 OG SER A 17 15.916 4.820 -10.545 1.00 0.00 O ATOM 0 H SER A 17 15.490 3.557 -12.982 1.00 0.00 H new ATOM 0 HA SER A 17 15.128 2.341 -10.423 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.200 4.965 -11.647 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.976 4.546 -9.960 1.00 0.00 H new ATOM 0 HG SER A 17 15.879 5.709 -10.134 1.00 0.00 H new ATOM 263 N ILE A 18 12.551 2.585 -12.433 1.00 0.00 N ATOM 264 CA ILE A 18 11.181 2.133 -12.646 1.00 0.00 C ATOM 265 C ILE A 18 11.087 0.613 -12.588 1.00 0.00 C ATOM 266 O ILE A 18 10.213 0.061 -11.921 1.00 0.00 O ATOM 267 CB ILE A 18 10.643 2.629 -14.001 1.00 0.00 C ATOM 268 CG1 ILE A 18 10.490 4.153 -13.988 1.00 0.00 C ATOM 269 CG2 ILE A 18 9.316 1.961 -14.323 1.00 0.00 C ATOM 270 CD1 ILE A 18 10.246 4.753 -15.354 1.00 0.00 C ATOM 0 H ILE A 18 12.974 3.042 -13.241 1.00 0.00 H new ATOM 0 HA ILE A 18 10.573 2.553 -11.845 1.00 0.00 H new ATOM 0 HB ILE A 18 11.359 2.361 -14.778 1.00 0.00 H new ATOM 0 HG12 ILE A 18 9.662 4.420 -13.331 1.00 0.00 H new ATOM 0 HG13 ILE A 18 11.391 4.596 -13.562 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.950 2.323 -15.284 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.455 0.881 -14.371 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.590 2.199 -13.545 1.00 0.00 H new ATOM 0 HD11 ILE A 18 10.148 5.835 -15.264 1.00 0.00 H new ATOM 0 HD12 ILE A 18 11.084 4.518 -16.010 1.00 0.00 H new ATOM 0 HD13 ILE A 18 9.329 4.340 -15.775 1.00 0.00 H new ATOM 282 N SER A 19 11.994 -0.057 -13.291 1.00 0.00 N ATOM 283 CA SER A 19 12.016 -1.515 -13.320 1.00 0.00 C ATOM 284 C SER A 19 12.403 -2.087 -11.962 1.00 0.00 C ATOM 285 O SER A 19 11.987 -3.188 -11.601 1.00 0.00 O ATOM 286 CB SER A 19 12.985 -2.002 -14.379 1.00 0.00 C ATOM 287 OG SER A 19 14.302 -1.652 -14.053 1.00 0.00 O ATOM 0 H SER A 19 12.724 0.387 -13.849 1.00 0.00 H new ATOM 0 HA SER A 19 11.012 -1.862 -13.563 1.00 0.00 H new ATOM 0 HB2 SER A 19 12.907 -3.085 -14.479 1.00 0.00 H new ATOM 0 HB3 SER A 19 12.719 -1.573 -15.345 1.00 0.00 H new ATOM 0 HG SER A 19 14.476 -0.731 -14.338 1.00 0.00 H new ATOM 293 N SER A 20 13.201 -1.334 -11.214 1.00 0.00 N ATOM 294 CA SER A 20 13.536 -1.699 -9.843 1.00 0.00 C ATOM 295 C SER A 20 12.312 -1.628 -8.939 1.00 0.00 C ATOM 296 O SER A 20 12.109 -2.491 -8.085 1.00 0.00 O ATOM 297 CB SER A 20 14.623 -0.786 -9.310 1.00 0.00 C ATOM 298 OG SER A 20 15.825 -0.978 -10.004 1.00 0.00 O ATOM 0 H SER A 20 13.629 -0.465 -11.535 1.00 0.00 H new ATOM 0 HA SER A 20 13.898 -2.727 -9.848 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.308 0.253 -9.402 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.777 -0.979 -8.248 1.00 0.00 H new ATOM 0 HG SER A 20 15.895 -0.318 -10.725 1.00 0.00 H new ATOM 304 N ALA A 21 11.499 -0.595 -9.133 1.00 0.00 N ATOM 305 CA ALA A 21 10.253 -0.451 -8.389 1.00 0.00 C ATOM 306 C ALA A 21 9.299 -1.601 -8.684 1.00 0.00 C ATOM 307 O ALA A 21 8.638 -2.118 -7.784 1.00 0.00 O ATOM 308 CB ALA A 21 9.593 0.881 -8.715 1.00 0.00 C ATOM 0 H ALA A 21 11.681 0.155 -9.800 1.00 0.00 H new ATOM 0 HA ALA A 21 10.491 -0.476 -7.326 1.00 0.00 H new ATOM 0 HB1 ALA A 21 8.664 0.974 -8.152 1.00 0.00 H new ATOM 0 HB2 ALA A 21 10.265 1.696 -8.444 1.00 0.00 H new ATOM 0 HB3 ALA A 21 9.377 0.928 -9.782 1.00 0.00 H new ATOM 314 N SER A 22 9.233 -1.998 -9.951 1.00 0.00 N ATOM 315 CA SER A 22 8.360 -3.089 -10.367 1.00 0.00 C ATOM 316 C SER A 22 8.791 -4.409 -9.741 1.00 0.00 C ATOM 317 O SER A 22 7.956 -5.228 -9.358 1.00 0.00 O ATOM 318 CB SER A 22 8.360 -3.211 -11.878 1.00 0.00 C ATOM 319 OG SER A 22 9.617 -3.615 -12.348 1.00 0.00 O ATOM 0 H SER A 22 9.774 -1.580 -10.708 1.00 0.00 H new ATOM 0 HA SER A 22 7.351 -2.862 -10.023 1.00 0.00 H new ATOM 0 HB2 SER A 22 7.603 -3.931 -12.189 1.00 0.00 H new ATOM 0 HB3 SER A 22 8.091 -2.253 -12.324 1.00 0.00 H new ATOM 0 HG SER A 22 9.565 -4.540 -12.667 1.00 0.00 H new ATOM 325 N LYS A 23 10.101 -4.610 -9.640 1.00 0.00 N ATOM 326 CA LYS A 23 10.647 -5.787 -8.975 1.00 0.00 C ATOM 327 C LYS A 23 10.192 -5.859 -7.522 1.00 0.00 C ATOM 328 O LYS A 23 9.788 -6.916 -7.040 1.00 0.00 O ATOM 329 CB LYS A 23 12.174 -5.784 -9.048 1.00 0.00 C ATOM 330 CG LYS A 23 12.838 -6.996 -8.407 1.00 0.00 C ATOM 331 CD LYS A 23 14.349 -6.949 -8.570 1.00 0.00 C ATOM 332 CE LYS A 23 15.016 -8.144 -7.904 1.00 0.00 C ATOM 333 NZ LYS A 23 16.496 -8.111 -8.055 1.00 0.00 N ATOM 0 H LYS A 23 10.805 -3.972 -10.011 1.00 0.00 H new ATOM 0 HA LYS A 23 10.270 -6.668 -9.495 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.475 -5.731 -10.094 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.547 -4.882 -8.563 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.585 -7.034 -7.347 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.449 -7.908 -8.860 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.602 -6.933 -9.630 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.735 -6.026 -8.136 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.760 -8.159 -6.845 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.628 -9.065 -8.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.911 -8.942 -7.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.742 -8.123 -9.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.870 -7.245 -7.618 1.00 0.00 H new ATOM 347 N TRP A 24 10.261 -4.727 -6.830 1.00 0.00 N ATOM 348 CA TRP A 24 9.810 -4.647 -5.445 1.00 0.00 C ATOM 349 C TRP A 24 8.332 -4.996 -5.326 1.00 0.00 C ATOM 350 O TRP A 24 7.927 -5.724 -4.420 1.00 0.00 O ATOM 351 CB TRP A 24 10.054 -3.245 -4.885 1.00 0.00 C ATOM 352 CG TRP A 24 9.541 -3.061 -3.489 1.00 0.00 C ATOM 353 CD1 TRP A 24 10.106 -3.536 -2.343 1.00 0.00 C ATOM 354 CD2 TRP A 24 8.350 -2.345 -3.081 1.00 0.00 C ATOM 355 NE1 TRP A 24 9.352 -3.169 -1.256 1.00 0.00 N ATOM 356 CE2 TRP A 24 8.275 -2.438 -1.689 1.00 0.00 C ATOM 357 CE3 TRP A 24 7.358 -1.642 -3.776 1.00 0.00 C ATOM 358 CZ2 TRP A 24 7.243 -1.856 -0.970 1.00 0.00 C ATOM 359 CZ3 TRP A 24 6.324 -1.058 -3.055 1.00 0.00 C ATOM 360 CH2 TRP A 24 6.269 -1.162 -1.688 1.00 0.00 C ATOM 0 H TRP A 24 10.625 -3.851 -7.206 1.00 0.00 H new ATOM 0 HA TRP A 24 10.384 -5.371 -4.867 1.00 0.00 H new ATOM 0 HB2 TRP A 24 11.124 -3.037 -4.901 1.00 0.00 H new ATOM 0 HB3 TRP A 24 9.578 -2.514 -5.538 1.00 0.00 H new ATOM 0 HD1 TRP A 24 11.015 -4.117 -2.297 1.00 0.00 H new ATOM 0 HE1 TRP A 24 9.559 -3.402 -0.285 1.00 0.00 H new ATOM 0 HE3 TRP A 24 7.396 -1.556 -4.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 7.195 -1.937 0.106 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 5.552 -0.514 -3.578 1.00 0.00 H new ATOM 0 HH2 TRP A 24 5.453 -0.696 -1.156 1.00 0.00 H new ATOM 371 N LEU A 25 7.530 -4.471 -6.247 1.00 0.00 N ATOM 372 CA LEU A 25 6.088 -4.686 -6.218 1.00 0.00 C ATOM 373 C LEU A 25 5.747 -6.161 -6.380 1.00 0.00 C ATOM 374 O LEU A 25 4.781 -6.653 -5.798 1.00 0.00 O ATOM 375 CB LEU A 25 5.410 -3.873 -7.328 1.00 0.00 C ATOM 376 CG LEU A 25 5.397 -2.352 -7.126 1.00 0.00 C ATOM 377 CD1 LEU A 25 4.876 -1.676 -8.387 1.00 0.00 C ATOM 378 CD2 LEU A 25 4.531 -2.007 -5.923 1.00 0.00 C ATOM 0 H LEU A 25 7.855 -3.894 -7.023 1.00 0.00 H new ATOM 0 HA LEU A 25 5.719 -4.353 -5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.911 -4.091 -8.271 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.380 -4.217 -7.427 1.00 0.00 H new ATOM 0 HG LEU A 25 6.408 -1.993 -6.936 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.867 -0.596 -8.243 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.524 -1.925 -9.227 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.864 -2.023 -8.594 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.522 -0.927 -5.779 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.514 -2.359 -6.094 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.937 -2.488 -5.033 1.00 0.00 H new ATOM 390 N LEU A 26 6.547 -6.864 -7.176 1.00 0.00 N ATOM 391 CA LEU A 26 6.271 -8.258 -7.501 1.00 0.00 C ATOM 392 C LEU A 26 6.689 -9.183 -6.365 1.00 0.00 C ATOM 393 O LEU A 26 6.536 -10.401 -6.454 1.00 0.00 O ATOM 394 CB LEU A 26 7.003 -8.657 -8.788 1.00 0.00 C ATOM 395 CG LEU A 26 6.510 -7.977 -10.072 1.00 0.00 C ATOM 396 CD1 LEU A 26 7.445 -8.325 -11.223 1.00 0.00 C ATOM 397 CD2 LEU A 26 5.087 -8.424 -10.369 1.00 0.00 C ATOM 0 H LEU A 26 7.392 -6.490 -7.608 1.00 0.00 H new ATOM 0 HA LEU A 26 5.196 -8.360 -7.649 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.063 -8.435 -8.665 1.00 0.00 H new ATOM 0 HB3 LEU A 26 6.916 -9.736 -8.914 1.00 0.00 H new ATOM 0 HG LEU A 26 6.511 -6.895 -9.944 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.095 -7.842 -12.135 1.00 0.00 H new ATOM 0 HD12 LEU A 26 8.452 -7.977 -10.992 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.459 -9.405 -11.367 1.00 0.00 H new ATOM 0 HD21 LEU A 26 4.737 -7.941 -11.281 1.00 0.00 H new ATOM 0 HD22 LEU A 26 5.065 -9.506 -10.500 1.00 0.00 H new ATOM 0 HD23 LEU A 26 4.438 -8.146 -9.539 1.00 0.00 H new ATOM 409 N LEU A 27 7.218 -8.596 -5.296 1.00 0.00 N ATOM 410 CA LEU A 27 7.541 -9.349 -4.090 1.00 0.00 C ATOM 411 C LEU A 27 6.290 -9.643 -3.273 1.00 0.00 C ATOM 412 O LEU A 27 6.288 -10.530 -2.419 1.00 0.00 O ATOM 413 CB LEU A 27 8.548 -8.571 -3.233 1.00 0.00 C ATOM 414 CG LEU A 27 9.926 -8.343 -3.869 1.00 0.00 C ATOM 415 CD1 LEU A 27 10.771 -7.471 -2.949 1.00 0.00 C ATOM 416 CD2 LEU A 27 10.597 -9.684 -4.121 1.00 0.00 C ATOM 0 H LEU A 27 7.432 -7.600 -5.241 1.00 0.00 H new ATOM 0 HA LEU A 27 7.983 -10.297 -4.396 1.00 0.00 H new ATOM 0 HB2 LEU A 27 8.116 -7.601 -2.988 1.00 0.00 H new ATOM 0 HB3 LEU A 27 8.686 -9.105 -2.293 1.00 0.00 H new ATOM 0 HG LEU A 27 9.816 -7.830 -4.824 1.00 0.00 H new ATOM 0 HD11 LEU A 27 11.750 -7.308 -3.400 1.00 0.00 H new ATOM 0 HD12 LEU A 27 10.276 -6.511 -2.801 1.00 0.00 H new ATOM 0 HD13 LEU A 27 10.893 -7.968 -1.987 1.00 0.00 H new ATOM 0 HD21 LEU A 27 11.576 -9.522 -4.573 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.717 -10.214 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.980 -10.278 -4.795 1.00 0.00 H new ATOM 428 N GLN A 28 5.226 -8.893 -3.538 1.00 0.00 N ATOM 429 CA GLN A 28 3.963 -9.078 -2.834 1.00 0.00 C ATOM 430 C GLN A 28 2.785 -9.055 -3.800 1.00 0.00 C ATOM 431 O GLN A 28 2.083 -8.051 -3.914 1.00 0.00 O ATOM 432 CB GLN A 28 3.782 -7.997 -1.764 1.00 0.00 C ATOM 433 CG GLN A 28 4.802 -8.058 -0.640 1.00 0.00 C ATOM 434 CD GLN A 28 4.504 -7.064 0.466 1.00 0.00 C ATOM 435 OE1 GLN A 28 4.235 -5.888 0.207 1.00 0.00 O ATOM 436 NE2 GLN A 28 4.549 -7.531 1.709 1.00 0.00 N ATOM 0 H GLN A 28 5.213 -8.150 -4.237 1.00 0.00 H new ATOM 0 HA GLN A 28 3.992 -10.055 -2.352 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.839 -7.018 -2.239 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.783 -8.087 -1.338 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.820 -9.065 -0.224 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.795 -7.861 -1.043 1.00 0.00 H new ATOM 0 HE21 GLN A 28 4.776 -8.511 1.878 1.00 0.00 H new ATOM 0 HE22 GLN A 28 4.357 -6.909 2.495 1.00 0.00 H new ATOM 445 N TYR A 29 2.574 -10.168 -4.494 1.00 0.00 N ATOM 446 CA TYR A 29 1.487 -10.275 -5.460 1.00 0.00 C ATOM 447 C TYR A 29 0.134 -10.066 -4.792 1.00 0.00 C ATOM 448 O TYR A 29 -0.830 -9.653 -5.436 1.00 0.00 O ATOM 449 CB TYR A 29 1.528 -11.633 -6.164 1.00 0.00 C ATOM 450 CG TYR A 29 1.056 -12.782 -5.301 1.00 0.00 C ATOM 451 CD1 TYR A 29 -0.279 -13.159 -5.318 1.00 0.00 C ATOM 452 CD2 TYR A 29 1.958 -13.459 -4.493 1.00 0.00 C ATOM 453 CE1 TYR A 29 -0.710 -14.209 -4.529 1.00 0.00 C ATOM 454 CE2 TYR A 29 1.527 -14.508 -3.705 1.00 0.00 C ATOM 455 CZ TYR A 29 0.199 -14.883 -3.722 1.00 0.00 C ATOM 456 OH TYR A 29 -0.231 -15.929 -2.937 1.00 0.00 O ATOM 0 H TYR A 29 3.143 -11.010 -4.405 1.00 0.00 H new ATOM 0 HA TYR A 29 1.622 -9.490 -6.204 1.00 0.00 H new ATOM 0 HB2 TYR A 29 0.910 -11.586 -7.060 1.00 0.00 H new ATOM 0 HB3 TYR A 29 2.549 -11.832 -6.491 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -0.981 -12.632 -5.947 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.997 -13.166 -4.480 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -1.749 -14.504 -4.540 1.00 0.00 H new ATOM 0 HE2 TYR A 29 2.229 -15.035 -3.076 1.00 0.00 H new ATOM 0 HH TYR A 29 0.527 -16.294 -2.434 1.00 0.00 H new ATOM 466 N ARG A 30 0.069 -10.355 -3.497 1.00 0.00 N ATOM 467 CA ARG A 30 -1.187 -10.289 -2.760 1.00 0.00 C ATOM 468 C ARG A 30 -1.655 -8.848 -2.596 1.00 0.00 C ATOM 469 O ARG A 30 -2.816 -8.595 -2.273 1.00 0.00 O ATOM 470 CB ARG A 30 -1.037 -10.928 -1.387 1.00 0.00 C ATOM 471 CG ARG A 30 -0.814 -12.432 -1.404 1.00 0.00 C ATOM 472 CD ARG A 30 -0.648 -12.978 -0.032 1.00 0.00 C ATOM 473 NE ARG A 30 -0.395 -14.410 -0.045 1.00 0.00 N ATOM 474 CZ ARG A 30 -0.143 -15.152 1.051 1.00 0.00 C ATOM 475 NH1 ARG A 30 -0.114 -14.585 2.237 1.00 0.00 N ATOM 476 NH2 ARG A 30 0.075 -16.450 0.934 1.00 0.00 N ATOM 0 H ARG A 30 0.872 -10.637 -2.936 1.00 0.00 H new ATOM 0 HA ARG A 30 -1.933 -10.837 -3.336 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -0.200 -10.457 -0.872 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -1.932 -10.714 -0.803 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -1.659 -12.920 -1.890 1.00 0.00 H new ATOM 0 HG3 ARG A 30 0.071 -12.662 -1.997 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.178 -12.468 0.464 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -1.546 -12.773 0.551 1.00 0.00 H new ATOM 0 HE ARG A 30 -0.409 -14.886 -0.947 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -0.282 -13.583 2.328 1.00 0.00 H new ATOM 0 HH12 ARG A 30 0.077 -15.147 3.066 1.00 0.00 H new ATOM 0 HH21 ARG A 30 0.053 -16.890 0.014 1.00 0.00 H new ATOM 0 HH22 ARG A 30 0.266 -17.012 1.764 1.00 0.00 H new ATOM 490 N ASP A 31 -0.745 -7.907 -2.823 1.00 0.00 N ATOM 491 CA ASP A 31 -1.075 -6.489 -2.749 1.00 0.00 C ATOM 492 C ASP A 31 -1.234 -5.886 -4.139 1.00 0.00 C ATOM 493 O ASP A 31 -1.176 -4.669 -4.309 1.00 0.00 O ATOM 494 CB ASP A 31 0.004 -5.726 -1.976 1.00 0.00 C ATOM 495 CG ASP A 31 0.025 -6.069 -0.493 1.00 0.00 C ATOM 496 OD1 ASP A 31 -1.030 -6.225 0.076 1.00 0.00 O ATOM 497 OD2 ASP A 31 1.095 -6.172 0.058 1.00 0.00 O ATOM 0 H ASP A 31 0.228 -8.101 -3.060 1.00 0.00 H new ATOM 0 HA ASP A 31 -2.025 -6.399 -2.222 1.00 0.00 H new ATOM 0 HB2 ASP A 31 0.979 -5.948 -2.409 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.161 -4.655 -2.094 1.00 0.00 H new ATOM 502 N ALA A 32 -1.436 -6.747 -5.131 1.00 0.00 N ATOM 503 CA ALA A 32 -1.630 -6.300 -6.505 1.00 0.00 C ATOM 504 C ALA A 32 -2.879 -5.437 -6.632 1.00 0.00 C ATOM 505 O ALA A 32 -2.868 -4.407 -7.306 1.00 0.00 O ATOM 506 CB ALA A 32 -1.715 -7.494 -7.444 1.00 0.00 C ATOM 0 H ALA A 32 -1.470 -7.759 -5.009 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.770 -5.692 -6.785 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.860 -7.144 -8.466 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.791 -8.070 -7.385 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.555 -8.125 -7.154 1.00 0.00 H new ATOM 512 N PRO A 33 -3.956 -5.864 -5.981 1.00 0.00 N ATOM 513 CA PRO A 33 -5.188 -5.085 -5.943 1.00 0.00 C ATOM 514 C PRO A 33 -4.923 -3.658 -5.481 1.00 0.00 C ATOM 515 O PRO A 33 -5.483 -2.706 -6.024 1.00 0.00 O ATOM 516 CB PRO A 33 -6.050 -5.853 -4.936 1.00 0.00 C ATOM 517 CG PRO A 33 -5.587 -7.265 -5.060 1.00 0.00 C ATOM 518 CD PRO A 33 -4.093 -7.156 -5.212 1.00 0.00 C ATOM 0 HA PRO A 33 -5.664 -4.982 -6.918 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -5.910 -5.476 -3.923 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.111 -5.760 -5.167 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -5.855 -7.850 -4.180 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.039 -7.758 -5.921 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -3.586 -7.114 -4.248 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -3.674 -8.002 -5.756 1.00 0.00 H new ATOM 526 N LYS A 34 -4.066 -3.516 -4.476 1.00 0.00 N ATOM 527 CA LYS A 34 -3.690 -2.201 -3.969 1.00 0.00 C ATOM 528 C LYS A 34 -2.929 -1.403 -5.020 1.00 0.00 C ATOM 529 O LYS A 34 -3.181 -0.213 -5.211 1.00 0.00 O ATOM 530 CB LYS A 34 -2.848 -2.337 -2.700 1.00 0.00 C ATOM 531 CG LYS A 34 -3.607 -2.882 -1.497 1.00 0.00 C ATOM 532 CD LYS A 34 -2.669 -3.159 -0.331 1.00 0.00 C ATOM 533 CE LYS A 34 -3.403 -3.821 0.826 1.00 0.00 C ATOM 534 NZ LYS A 34 -2.463 -4.376 1.837 1.00 0.00 N ATOM 0 H LYS A 34 -3.618 -4.296 -3.996 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.606 -1.662 -3.729 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -2.002 -2.992 -2.908 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -2.438 -1.360 -2.444 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -4.370 -2.166 -1.191 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.125 -3.800 -1.776 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -1.854 -3.802 -0.663 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -2.221 -2.225 0.007 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -4.060 -3.093 1.303 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -4.037 -4.620 0.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.003 -4.788 2.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.876 -5.113 1.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -1.852 -3.615 2.197 1.00 0.00 H new ATOM 548 N VAL A 35 -1.998 -2.064 -5.698 1.00 0.00 N ATOM 549 CA VAL A 35 -1.213 -1.422 -6.747 1.00 0.00 C ATOM 550 C VAL A 35 -2.110 -0.891 -7.858 1.00 0.00 C ATOM 551 O VAL A 35 -1.928 0.230 -8.332 1.00 0.00 O ATOM 552 CB VAL A 35 -0.200 -2.418 -7.341 1.00 0.00 C ATOM 553 CG1 VAL A 35 0.462 -1.830 -8.578 1.00 0.00 C ATOM 554 CG2 VAL A 35 0.842 -2.783 -6.294 1.00 0.00 C ATOM 0 H VAL A 35 -1.768 -3.045 -5.540 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.681 -0.584 -6.297 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.728 -3.324 -7.639 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.175 -2.547 -8.985 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.298 -1.609 -9.327 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.984 -0.912 -8.309 1.00 0.00 H new ATOM 0 HG21 VAL A 35 1.555 -3.488 -6.721 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.368 -1.883 -5.975 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.350 -3.240 -5.435 1.00 0.00 H new ATOM 564 N ALA A 36 -3.078 -1.703 -8.269 1.00 0.00 N ATOM 565 CA ALA A 36 -3.970 -1.338 -9.364 1.00 0.00 C ATOM 566 C ALA A 36 -4.829 -0.136 -8.996 1.00 0.00 C ATOM 567 O ALA A 36 -4.974 0.800 -9.783 1.00 0.00 O ATOM 568 CB ALA A 36 -4.849 -2.520 -9.746 1.00 0.00 C ATOM 0 H ALA A 36 -3.265 -2.619 -7.860 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.356 -1.063 -10.222 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.509 -2.233 -10.564 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.221 -3.353 -10.062 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.447 -2.822 -8.886 1.00 0.00 H new ATOM 574 N GLU A 37 -5.399 -0.166 -7.796 1.00 0.00 N ATOM 575 CA GLU A 37 -6.295 0.892 -7.346 1.00 0.00 C ATOM 576 C GLU A 37 -5.537 2.193 -7.111 1.00 0.00 C ATOM 577 O GLU A 37 -6.030 3.275 -7.427 1.00 0.00 O ATOM 578 CB GLU A 37 -7.015 0.471 -6.063 1.00 0.00 C ATOM 579 CG GLU A 37 -8.033 -0.644 -6.251 1.00 0.00 C ATOM 580 CD GLU A 37 -8.662 -1.086 -4.959 1.00 0.00 C ATOM 581 OE1 GLU A 37 -8.298 -0.563 -3.933 1.00 0.00 O ATOM 582 OE2 GLU A 37 -9.508 -1.949 -4.997 1.00 0.00 O ATOM 0 H GLU A 37 -5.256 -0.913 -7.117 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.032 1.061 -8.131 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.272 0.149 -5.333 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -7.520 1.340 -5.642 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -8.814 -0.305 -6.932 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.546 -1.498 -6.723 1.00 0.00 H new ATOM 589 N MET A 38 -4.336 2.079 -6.555 1.00 0.00 N ATOM 590 CA MET A 38 -3.461 3.232 -6.379 1.00 0.00 C ATOM 591 C MET A 38 -2.983 3.771 -7.721 1.00 0.00 C ATOM 592 O MET A 38 -2.886 4.983 -7.915 1.00 0.00 O ATOM 593 CB MET A 38 -2.270 2.861 -5.498 1.00 0.00 C ATOM 594 CG MET A 38 -2.623 2.587 -4.043 1.00 0.00 C ATOM 595 SD MET A 38 -1.220 1.972 -3.091 1.00 0.00 S ATOM 596 CE MET A 38 -2.023 1.525 -1.555 1.00 0.00 C ATOM 0 H MET A 38 -3.946 1.199 -6.218 1.00 0.00 H new ATOM 0 HA MET A 38 -4.032 4.019 -5.887 1.00 0.00 H new ATOM 0 HB2 MET A 38 -1.788 1.977 -5.914 1.00 0.00 H new ATOM 0 HB3 MET A 38 -1.540 3.670 -5.536 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.994 3.504 -3.585 1.00 0.00 H new ATOM 0 HG3 MET A 38 -3.433 1.859 -4.001 1.00 0.00 H new ATOM 0 HE1 MET A 38 -1.521 0.661 -1.120 1.00 0.00 H new ATOM 0 HE2 MET A 38 -1.971 2.363 -0.860 1.00 0.00 H new ATOM 0 HE3 MET A 38 -3.067 1.278 -1.749 1.00 0.00 H new ATOM 606 N TRP A 39 -2.685 2.864 -8.645 1.00 0.00 N ATOM 607 CA TRP A 39 -2.315 3.245 -10.002 1.00 0.00 C ATOM 608 C TRP A 39 -3.434 4.024 -10.680 1.00 0.00 C ATOM 609 O TRP A 39 -3.188 5.024 -11.355 1.00 0.00 O ATOM 610 CB TRP A 39 -1.976 2.005 -10.831 1.00 0.00 C ATOM 611 CG TRP A 39 -1.561 2.320 -12.237 1.00 0.00 C ATOM 612 CD1 TRP A 39 -0.372 2.853 -12.636 1.00 0.00 C ATOM 613 CD2 TRP A 39 -2.337 2.120 -13.443 1.00 0.00 C ATOM 614 NE1 TRP A 39 -0.354 3.000 -14.001 1.00 0.00 N ATOM 615 CE2 TRP A 39 -1.547 2.555 -14.511 1.00 0.00 C ATOM 616 CE3 TRP A 39 -3.617 1.614 -13.699 1.00 0.00 C ATOM 617 CZ2 TRP A 39 -1.994 2.504 -15.822 1.00 0.00 C ATOM 618 CZ3 TRP A 39 -4.065 1.562 -15.013 1.00 0.00 C ATOM 619 CH2 TRP A 39 -3.273 1.994 -16.047 1.00 0.00 C ATOM 0 H TRP A 39 -2.693 1.858 -8.478 1.00 0.00 H new ATOM 0 HA TRP A 39 -1.436 3.887 -9.938 1.00 0.00 H new ATOM 0 HB2 TRP A 39 -1.173 1.457 -10.338 1.00 0.00 H new ATOM 0 HB3 TRP A 39 -2.844 1.346 -10.856 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.439 3.121 -11.974 1.00 0.00 H new ATOM 0 HE1 TRP A 39 0.420 3.378 -14.547 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -4.245 1.270 -12.890 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -1.376 2.846 -16.639 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -5.051 1.176 -15.224 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -3.648 1.938 -17.058 1.00 0.00 H new ATOM 630 N LYS A 40 -4.666 3.560 -10.498 1.00 0.00 N ATOM 631 CA LYS A 40 -5.835 4.271 -11.001 1.00 0.00 C ATOM 632 C LYS A 40 -5.855 5.713 -10.512 1.00 0.00 C ATOM 633 O LYS A 40 -5.897 6.649 -11.310 1.00 0.00 O ATOM 634 CB LYS A 40 -7.119 3.555 -10.581 1.00 0.00 C ATOM 635 CG LYS A 40 -8.400 4.298 -10.939 1.00 0.00 C ATOM 636 CD LYS A 40 -9.631 3.475 -10.592 1.00 0.00 C ATOM 637 CE LYS A 40 -10.912 4.234 -10.906 1.00 0.00 C ATOM 638 NZ LYS A 40 -12.126 3.425 -10.610 1.00 0.00 N ATOM 0 H LYS A 40 -4.880 2.693 -10.005 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.776 4.282 -12.089 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.141 2.571 -11.049 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -7.095 3.395 -9.503 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -8.433 5.248 -10.406 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.403 4.530 -12.004 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.614 2.539 -11.151 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.610 3.215 -9.534 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.939 5.155 -10.324 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.915 4.521 -11.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.663 3.271 -11.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.843 2.507 -10.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.721 3.931 -9.923 1.00 0.00 H new ATOM 652 N GLU A 41 -5.826 5.887 -9.195 1.00 0.00 N ATOM 653 CA GLU A 41 -5.902 7.213 -8.595 1.00 0.00 C ATOM 654 C GLU A 41 -4.803 8.123 -9.129 1.00 0.00 C ATOM 655 O GLU A 41 -5.060 9.267 -9.506 1.00 0.00 O ATOM 656 CB GLU A 41 -5.800 7.116 -7.071 1.00 0.00 C ATOM 657 CG GLU A 41 -5.869 8.454 -6.349 1.00 0.00 C ATOM 658 CD GLU A 41 -5.835 8.314 -4.853 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.086 7.236 -4.370 1.00 0.00 O ATOM 660 OE2 GLU A 41 -5.557 9.287 -4.191 1.00 0.00 O ATOM 0 H GLU A 41 -5.750 5.124 -8.522 1.00 0.00 H new ATOM 0 HA GLU A 41 -6.866 7.644 -8.863 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.604 6.478 -6.705 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.862 6.626 -6.812 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.034 9.077 -6.670 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.783 8.971 -6.640 1.00 0.00 H new ATOM 667 N TYR A 42 -3.579 7.609 -9.160 1.00 0.00 N ATOM 668 CA TYR A 42 -2.438 8.376 -9.646 1.00 0.00 C ATOM 669 C TYR A 42 -2.649 8.823 -11.087 1.00 0.00 C ATOM 670 O TYR A 42 -2.503 10.002 -11.409 1.00 0.00 O ATOM 671 CB TYR A 42 -1.152 7.555 -9.529 1.00 0.00 C ATOM 672 CG TYR A 42 0.064 8.237 -10.117 1.00 0.00 C ATOM 673 CD1 TYR A 42 0.765 9.171 -9.369 1.00 0.00 C ATOM 674 CD2 TYR A 42 0.477 7.928 -11.404 1.00 0.00 C ATOM 675 CE1 TYR A 42 1.875 9.794 -9.906 1.00 0.00 C ATOM 676 CE2 TYR A 42 1.587 8.551 -11.941 1.00 0.00 C ATOM 677 CZ TYR A 42 2.284 9.480 -11.197 1.00 0.00 C ATOM 678 OH TYR A 42 3.390 10.100 -11.732 1.00 0.00 O ATOM 0 H TYR A 42 -3.351 6.663 -8.854 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.345 9.267 -9.025 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.963 7.341 -8.477 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.297 6.597 -10.029 1.00 0.00 H new ATOM 0 HD1 TYR A 42 0.443 9.411 -8.367 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.069 7.201 -11.986 1.00 0.00 H new ATOM 0 HE1 TYR A 42 2.423 10.522 -9.325 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.909 8.311 -12.943 1.00 0.00 H new ATOM 0 HH TYR A 42 3.662 9.635 -12.551 1.00 0.00 H new ATOM 688 N MET A 43 -2.994 7.875 -11.951 1.00 0.00 N ATOM 689 CA MET A 43 -3.163 8.157 -13.372 1.00 0.00 C ATOM 690 C MET A 43 -4.325 9.112 -13.609 1.00 0.00 C ATOM 691 O MET A 43 -4.343 9.853 -14.592 1.00 0.00 O ATOM 692 CB MET A 43 -3.374 6.858 -14.146 1.00 0.00 C ATOM 693 CG MET A 43 -2.147 5.959 -14.213 1.00 0.00 C ATOM 694 SD MET A 43 -0.745 6.754 -15.022 1.00 0.00 S ATOM 695 CE MET A 43 -1.312 6.795 -16.720 1.00 0.00 C ATOM 0 H MET A 43 -3.162 6.903 -11.692 1.00 0.00 H new ATOM 0 HA MET A 43 -2.254 8.639 -13.733 1.00 0.00 H new ATOM 0 HB2 MET A 43 -4.191 6.303 -13.685 1.00 0.00 H new ATOM 0 HB3 MET A 43 -3.687 7.101 -15.161 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.860 5.667 -13.203 1.00 0.00 H new ATOM 0 HG3 MET A 43 -2.400 5.045 -14.750 1.00 0.00 H new ATOM 0 HE1 MET A 43 -0.470 7.006 -17.380 1.00 0.00 H new ATOM 0 HE2 MET A 43 -1.745 5.830 -16.982 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.066 7.574 -16.833 1.00 0.00 H new ATOM 705 N LEU A 44 -5.297 9.091 -12.702 1.00 0.00 N ATOM 706 CA LEU A 44 -6.481 9.932 -12.828 1.00 0.00 C ATOM 707 C LEU A 44 -6.423 11.112 -11.866 1.00 0.00 C ATOM 708 O LEU A 44 -7.445 11.726 -11.560 1.00 0.00 O ATOM 709 CB LEU A 44 -7.747 9.108 -12.560 1.00 0.00 C ATOM 710 CG LEU A 44 -7.953 7.891 -13.471 1.00 0.00 C ATOM 711 CD1 LEU A 44 -9.255 7.193 -13.100 1.00 0.00 C ATOM 712 CD2 LEU A 44 -7.969 8.341 -14.924 1.00 0.00 C ATOM 0 H LEU A 44 -5.287 8.500 -11.871 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.510 10.319 -13.846 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.723 8.765 -11.526 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.613 9.763 -12.658 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.134 7.184 -13.339 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.402 6.328 -13.747 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.209 6.865 -12.061 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -10.088 7.885 -13.225 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.115 7.476 -15.571 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.783 9.050 -15.076 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.020 8.820 -15.167 1.00 0.00 H new ATOM 724 N ARG A 45 -5.222 11.424 -11.392 1.00 0.00 N ATOM 725 CA ARG A 45 -5.017 12.576 -10.523 1.00 0.00 C ATOM 726 C ARG A 45 -4.654 13.817 -11.329 1.00 0.00 C ATOM 727 O ARG A 45 -3.713 13.801 -12.122 1.00 0.00 O ATOM 728 CB ARG A 45 -3.917 12.294 -9.510 1.00 0.00 C ATOM 729 CG ARG A 45 -3.639 13.428 -8.536 1.00 0.00 C ATOM 730 CD ARG A 45 -2.673 13.022 -7.483 1.00 0.00 C ATOM 731 NE ARG A 45 -3.263 12.088 -6.537 1.00 0.00 N ATOM 732 CZ ARG A 45 -2.584 11.459 -5.558 1.00 0.00 C ATOM 733 NH1 ARG A 45 -1.295 11.673 -5.410 1.00 0.00 N ATOM 734 NH2 ARG A 45 -3.213 10.626 -4.747 1.00 0.00 N ATOM 0 H ARG A 45 -4.375 10.894 -11.596 1.00 0.00 H new ATOM 0 HA ARG A 45 -5.954 12.760 -9.998 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -4.186 11.404 -8.942 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.998 12.063 -10.048 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.245 14.287 -9.080 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -4.572 13.746 -8.071 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -1.800 12.565 -7.948 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -2.324 13.906 -6.950 1.00 0.00 H new ATOM 0 HE ARG A 45 -4.261 11.896 -6.621 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -0.809 12.315 -6.036 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -0.781 11.197 -4.669 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -4.213 10.459 -4.862 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -2.699 10.150 -4.006 1.00 0.00 H new ATOM 748 N PRO A 46 -5.407 14.892 -11.122 1.00 0.00 N ATOM 749 CA PRO A 46 -5.263 16.096 -11.931 1.00 0.00 C ATOM 750 C PRO A 46 -4.017 16.879 -11.536 1.00 0.00 C ATOM 751 O PRO A 46 -3.589 17.786 -12.251 1.00 0.00 O ATOM 752 CB PRO A 46 -6.543 16.877 -11.618 1.00 0.00 C ATOM 753 CG PRO A 46 -6.923 16.423 -10.250 1.00 0.00 C ATOM 754 CD PRO A 46 -6.579 14.958 -10.233 1.00 0.00 C ATOM 0 HA PRO A 46 -5.141 15.890 -12.994 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -6.370 17.953 -11.647 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -7.329 16.661 -12.342 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -6.374 16.969 -9.483 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -7.984 16.584 -10.058 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.345 14.608 -9.227 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -7.401 14.344 -10.601 1.00 0.00 H new ATOM 762 N SER A 47 -3.438 16.523 -10.395 1.00 0.00 N ATOM 763 CA SER A 47 -2.226 17.176 -9.914 1.00 0.00 C ATOM 764 C SER A 47 -0.979 16.517 -10.491 1.00 0.00 C ATOM 765 O SER A 47 0.144 16.926 -10.196 1.00 0.00 O ATOM 766 CB SER A 47 -2.176 17.133 -8.399 1.00 0.00 C ATOM 767 OG SER A 47 -3.233 17.863 -7.841 1.00 0.00 O ATOM 0 H SER A 47 -3.789 15.785 -9.785 1.00 0.00 H new ATOM 0 HA SER A 47 -2.249 18.214 -10.246 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.225 16.098 -8.059 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.226 17.538 -8.051 1.00 0.00 H new ATOM 0 HG SER A 47 -3.181 17.819 -6.863 1.00 0.00 H new ATOM 773 N VAL A 48 -1.184 15.496 -11.316 1.00 0.00 N ATOM 774 CA VAL A 48 -0.077 14.788 -11.948 1.00 0.00 C ATOM 775 C VAL A 48 0.060 15.177 -13.414 1.00 0.00 C ATOM 776 O VAL A 48 -0.927 15.225 -14.148 1.00 0.00 O ATOM 777 CB VAL A 48 -0.285 13.266 -11.841 1.00 0.00 C ATOM 778 CG1 VAL A 48 0.836 12.523 -12.553 1.00 0.00 C ATOM 779 CG2 VAL A 48 -0.360 12.855 -10.378 1.00 0.00 C ATOM 0 H VAL A 48 -2.107 15.140 -11.563 1.00 0.00 H new ATOM 0 HA VAL A 48 0.837 15.069 -11.425 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.225 13.003 -12.326 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.673 11.449 -12.467 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.848 12.805 -13.606 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.791 12.782 -12.097 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.507 11.777 -10.310 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.568 13.127 -9.876 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.195 13.366 -9.899 1.00 0.00 H new ATOM 789 N ASN A 49 1.289 15.454 -13.835 1.00 0.00 N ATOM 790 CA ASN A 49 1.557 15.845 -15.214 1.00 0.00 C ATOM 791 C ASN A 49 1.466 14.650 -16.154 1.00 0.00 C ATOM 792 O ASN A 49 1.589 13.502 -15.727 1.00 0.00 O ATOM 793 CB ASN A 49 2.916 16.511 -15.326 1.00 0.00 C ATOM 794 CG ASN A 49 2.965 17.845 -14.635 1.00 0.00 C ATOM 795 OD1 ASN A 49 1.995 18.611 -14.668 1.00 0.00 O ATOM 796 ND2 ASN A 49 4.077 18.139 -14.010 1.00 0.00 N ATOM 0 H ASN A 49 2.117 15.415 -13.240 1.00 0.00 H new ATOM 0 HA ASN A 49 0.794 16.564 -15.512 1.00 0.00 H new ATOM 0 HB2 ASN A 49 3.674 15.856 -14.897 1.00 0.00 H new ATOM 0 HB3 ASN A 49 3.167 16.642 -16.379 1.00 0.00 H new ATOM 0 HD21 ASN A 49 4.168 19.031 -13.524 1.00 0.00 H new ATOM 0 HD22 ASN A 49 4.852 17.476 -14.009 1.00 0.00 H new ATOM 803 N THR A 50 1.250 14.926 -17.435 1.00 0.00 N ATOM 804 CA THR A 50 1.033 13.873 -18.420 1.00 0.00 C ATOM 805 C THR A 50 2.293 13.043 -18.626 1.00 0.00 C ATOM 806 O THR A 50 2.221 11.856 -18.947 1.00 0.00 O ATOM 807 CB THR A 50 0.575 14.460 -19.768 1.00 0.00 C ATOM 808 OG1 THR A 50 1.563 15.378 -20.253 1.00 0.00 O ATOM 809 CG2 THR A 50 -0.753 15.186 -19.610 1.00 0.00 C ATOM 0 H THR A 50 1.220 15.872 -17.816 1.00 0.00 H new ATOM 0 HA THR A 50 0.246 13.226 -18.032 1.00 0.00 H new ATOM 0 HB THR A 50 0.448 13.643 -20.479 1.00 0.00 H new ATOM 0 HG1 THR A 50 1.271 15.749 -21.112 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.061 15.594 -20.572 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.510 14.487 -19.253 1.00 0.00 H new ATOM 0 HG23 THR A 50 -0.641 15.997 -18.891 1.00 0.00 H new ATOM 817 N ARG A 51 3.448 13.673 -18.439 1.00 0.00 N ATOM 818 CA ARG A 51 4.721 12.963 -18.468 1.00 0.00 C ATOM 819 C ARG A 51 4.885 12.076 -17.240 1.00 0.00 C ATOM 820 O ARG A 51 5.411 10.967 -17.330 1.00 0.00 O ATOM 821 CB ARG A 51 5.881 13.946 -18.537 1.00 0.00 C ATOM 822 CG ARG A 51 7.256 13.307 -18.648 1.00 0.00 C ATOM 823 CD ARG A 51 8.335 14.327 -18.680 1.00 0.00 C ATOM 824 NE ARG A 51 9.655 13.719 -18.706 1.00 0.00 N ATOM 825 CZ ARG A 51 10.302 13.342 -19.826 1.00 0.00 C ATOM 826 NH1 ARG A 51 9.739 13.517 -21.001 1.00 0.00 N ATOM 827 NH2 ARG A 51 11.503 12.797 -19.743 1.00 0.00 N ATOM 0 H ARG A 51 3.528 14.675 -18.266 1.00 0.00 H new ATOM 0 HA ARG A 51 4.725 12.335 -19.359 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.731 14.603 -19.394 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.859 14.574 -17.647 1.00 0.00 H new ATOM 0 HG2 ARG A 51 7.415 12.636 -17.804 1.00 0.00 H new ATOM 0 HG3 ARG A 51 7.303 12.699 -19.552 1.00 0.00 H new ATOM 0 HD2 ARG A 51 8.210 14.961 -19.558 1.00 0.00 H new ATOM 0 HD3 ARG A 51 8.250 14.973 -17.806 1.00 0.00 H new ATOM 0 HE ARG A 51 10.125 13.567 -17.813 1.00 0.00 H new ATOM 0 HH11 ARG A 51 8.812 13.938 -21.065 1.00 0.00 H new ATOM 0 HH12 ARG A 51 10.229 13.232 -21.849 1.00 0.00 H new ATOM 0 HH21 ARG A 51 11.940 12.662 -18.831 1.00 0.00 H new ATOM 0 HH22 ARG A 51 11.993 12.511 -20.591 1.00 0.00 H new ATOM 841 N ARG A 52 4.432 12.572 -16.094 1.00 0.00 N ATOM 842 CA ARG A 52 4.459 11.796 -14.860 1.00 0.00 C ATOM 843 C ARG A 52 3.477 10.633 -14.918 1.00 0.00 C ATOM 844 O ARG A 52 3.721 9.572 -14.343 1.00 0.00 O ATOM 845 CB ARG A 52 4.126 12.677 -13.665 1.00 0.00 C ATOM 846 CG ARG A 52 5.194 13.698 -13.305 1.00 0.00 C ATOM 847 CD ARG A 52 4.784 14.540 -12.153 1.00 0.00 C ATOM 848 NE ARG A 52 5.803 15.516 -11.804 1.00 0.00 N ATOM 849 CZ ARG A 52 5.650 16.486 -10.881 1.00 0.00 C ATOM 850 NH1 ARG A 52 4.516 16.595 -10.225 1.00 0.00 N ATOM 851 NH2 ARG A 52 6.639 17.327 -10.636 1.00 0.00 N ATOM 0 H ARG A 52 4.041 13.509 -15.994 1.00 0.00 H new ATOM 0 HA ARG A 52 5.468 11.398 -14.747 1.00 0.00 H new ATOM 0 HB2 ARG A 52 3.194 13.204 -13.869 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.948 12.039 -12.800 1.00 0.00 H new ATOM 0 HG2 ARG A 52 6.124 13.182 -13.066 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.395 14.334 -14.167 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.854 15.056 -12.393 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.582 13.903 -11.292 1.00 0.00 H new ATOM 0 HE ARG A 52 6.697 15.463 -12.292 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.753 15.946 -10.415 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.400 17.329 -9.526 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.519 17.242 -11.145 1.00 0.00 H new ATOM 0 HH22 ARG A 52 6.523 18.061 -9.937 1.00 0.00 H new ATOM 865 N LYS A 53 2.365 10.839 -15.616 1.00 0.00 N ATOM 866 CA LYS A 53 1.428 9.759 -15.900 1.00 0.00 C ATOM 867 C LYS A 53 2.046 8.724 -16.831 1.00 0.00 C ATOM 868 O LYS A 53 1.850 7.521 -16.656 1.00 0.00 O ATOM 869 CB LYS A 53 0.140 10.314 -16.511 1.00 0.00 C ATOM 870 CG LYS A 53 -0.727 11.103 -15.540 1.00 0.00 C ATOM 871 CD LYS A 53 -1.953 11.678 -16.235 1.00 0.00 C ATOM 872 CE LYS A 53 -2.771 12.545 -15.290 1.00 0.00 C ATOM 873 NZ LYS A 53 -3.910 13.203 -15.984 1.00 0.00 N ATOM 0 H LYS A 53 2.091 11.745 -15.996 1.00 0.00 H new ATOM 0 HA LYS A 53 1.189 9.268 -14.956 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.399 10.956 -17.353 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -0.445 9.485 -16.911 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -1.041 10.456 -14.721 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -0.142 11.912 -15.101 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -1.641 12.269 -17.096 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -2.573 10.865 -16.614 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.150 11.932 -14.472 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.128 13.306 -14.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.461 13.757 -15.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.546 13.834 -16.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.520 12.479 -16.414 1.00 0.00 H new ATOM 887 N LEU A 54 2.793 9.198 -17.823 1.00 0.00 N ATOM 888 CA LEU A 54 3.529 8.313 -18.718 1.00 0.00 C ATOM 889 C LEU A 54 4.482 7.413 -17.942 1.00 0.00 C ATOM 890 O LEU A 54 4.602 6.223 -18.233 1.00 0.00 O ATOM 891 CB LEU A 54 4.315 9.136 -19.746 1.00 0.00 C ATOM 892 CG LEU A 54 5.084 8.326 -20.798 1.00 0.00 C ATOM 893 CD1 LEU A 54 4.099 7.546 -21.659 1.00 0.00 C ATOM 894 CD2 LEU A 54 5.927 9.266 -21.647 1.00 0.00 C ATOM 0 H LEU A 54 2.904 10.191 -18.027 1.00 0.00 H new ATOM 0 HA LEU A 54 2.806 7.682 -19.235 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.620 9.799 -20.261 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.024 9.769 -19.212 1.00 0.00 H new ATOM 0 HG LEU A 54 5.750 7.616 -20.307 1.00 0.00 H new ATOM 0 HD11 LEU A 54 4.645 6.971 -22.406 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.523 6.868 -21.029 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.423 8.240 -22.158 1.00 0.00 H new ATOM 0 HD21 LEU A 54 6.473 8.690 -22.394 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.278 9.986 -22.146 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.634 9.796 -21.009 1.00 0.00 H new ATOM 906 N LEU A 55 5.158 7.988 -16.954 1.00 0.00 N ATOM 907 CA LEU A 55 6.046 7.223 -16.086 1.00 0.00 C ATOM 908 C LEU A 55 5.286 6.128 -15.349 1.00 0.00 C ATOM 909 O LEU A 55 5.768 5.002 -15.224 1.00 0.00 O ATOM 910 CB LEU A 55 6.727 8.152 -15.074 1.00 0.00 C ATOM 911 CG LEU A 55 7.772 9.115 -15.653 1.00 0.00 C ATOM 912 CD1 LEU A 55 8.212 10.096 -14.574 1.00 0.00 C ATOM 913 CD2 LEU A 55 8.955 8.321 -16.186 1.00 0.00 C ATOM 0 H LEU A 55 5.108 8.983 -16.734 1.00 0.00 H new ATOM 0 HA LEU A 55 6.804 6.753 -16.713 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.958 8.739 -14.572 1.00 0.00 H new ATOM 0 HB3 LEU A 55 7.208 7.539 -14.312 1.00 0.00 H new ATOM 0 HG LEU A 55 7.340 9.682 -16.478 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.954 10.780 -14.985 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.349 10.664 -14.225 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.647 9.547 -13.739 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.697 9.005 -16.597 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.402 7.746 -15.375 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.615 7.642 -16.968 1.00 0.00 H new ATOM 925 N GLY A 56 4.097 6.465 -14.862 1.00 0.00 N ATOM 926 CA GLY A 56 3.229 5.488 -14.215 1.00 0.00 C ATOM 927 C GLY A 56 2.811 4.393 -15.188 1.00 0.00 C ATOM 928 O GLY A 56 2.768 3.216 -14.831 1.00 0.00 O ATOM 0 H GLY A 56 3.712 7.409 -14.903 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.747 5.044 -13.365 1.00 0.00 H new ATOM 0 HA3 GLY A 56 2.343 5.988 -13.823 1.00 0.00 H new ATOM 932 N LEU A 57 2.503 4.789 -16.419 1.00 0.00 N ATOM 933 CA LEU A 57 2.194 3.833 -17.475 1.00 0.00 C ATOM 934 C LEU A 57 3.345 2.859 -17.692 1.00 0.00 C ATOM 935 O LEU A 57 3.135 1.651 -17.808 1.00 0.00 O ATOM 936 CB LEU A 57 1.887 4.571 -18.784 1.00 0.00 C ATOM 937 CG LEU A 57 1.513 3.682 -19.977 1.00 0.00 C ATOM 938 CD1 LEU A 57 0.202 2.965 -19.685 1.00 0.00 C ATOM 939 CD2 LEU A 57 1.401 4.536 -21.232 1.00 0.00 C ATOM 0 H LEU A 57 2.461 5.766 -16.709 1.00 0.00 H new ATOM 0 HA LEU A 57 1.317 3.264 -17.165 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.069 5.268 -18.603 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.758 5.166 -19.057 1.00 0.00 H new ATOM 0 HG LEU A 57 2.287 2.932 -20.139 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.064 2.333 -20.533 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.316 2.348 -18.794 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.586 3.700 -19.519 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.135 3.904 -22.080 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.631 5.294 -21.089 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.357 5.022 -21.428 1.00 0.00 H new ATOM 951 N TYR A 58 4.561 3.391 -17.745 1.00 0.00 N ATOM 952 CA TYR A 58 5.746 2.572 -17.974 1.00 0.00 C ATOM 953 C TYR A 58 5.974 1.600 -16.824 1.00 0.00 C ATOM 954 O TYR A 58 6.341 0.445 -17.039 1.00 0.00 O ATOM 955 CB TYR A 58 6.978 3.458 -18.172 1.00 0.00 C ATOM 956 CG TYR A 58 7.014 4.163 -19.510 1.00 0.00 C ATOM 957 CD1 TYR A 58 6.246 3.691 -20.564 1.00 0.00 C ATOM 958 CD2 TYR A 58 7.815 5.282 -19.683 1.00 0.00 C ATOM 959 CE1 TYR A 58 6.279 4.335 -21.786 1.00 0.00 C ATOM 960 CE2 TYR A 58 7.848 5.926 -20.904 1.00 0.00 C ATOM 961 CZ TYR A 58 7.084 5.456 -21.953 1.00 0.00 C ATOM 962 OH TYR A 58 7.116 6.097 -23.170 1.00 0.00 O ATOM 0 H TYR A 58 4.752 4.387 -17.632 1.00 0.00 H new ATOM 0 HA TYR A 58 5.581 1.990 -18.881 1.00 0.00 H new ATOM 0 HB2 TYR A 58 7.009 4.204 -17.378 1.00 0.00 H new ATOM 0 HB3 TYR A 58 7.874 2.846 -18.070 1.00 0.00 H new ATOM 0 HD1 TYR A 58 5.622 2.820 -20.430 1.00 0.00 H new ATOM 0 HD2 TYR A 58 8.413 5.650 -18.862 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.682 3.969 -22.608 1.00 0.00 H new ATOM 0 HE2 TYR A 58 8.472 6.797 -21.038 1.00 0.00 H new ATOM 0 HH TYR A 58 7.726 6.862 -23.121 1.00 0.00 H new ATOM 972 N LEU A 59 5.754 2.074 -15.602 1.00 0.00 N ATOM 973 CA LEU A 59 5.894 1.234 -14.418 1.00 0.00 C ATOM 974 C LEU A 59 4.911 0.071 -14.449 1.00 0.00 C ATOM 975 O LEU A 59 5.292 -1.082 -14.245 1.00 0.00 O ATOM 976 CB LEU A 59 5.670 2.067 -13.149 1.00 0.00 C ATOM 977 CG LEU A 59 5.724 1.291 -11.827 1.00 0.00 C ATOM 978 CD1 LEU A 59 7.084 0.620 -11.687 1.00 0.00 C ATOM 979 CD2 LEU A 59 5.463 2.242 -10.669 1.00 0.00 C ATOM 0 H LEU A 59 5.478 3.036 -15.406 1.00 0.00 H new ATOM 0 HA LEU A 59 6.906 0.829 -14.412 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.421 2.856 -13.117 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.698 2.555 -13.223 1.00 0.00 H new ATOM 0 HG LEU A 59 4.956 0.518 -11.817 1.00 0.00 H new ATOM 0 HD11 LEU A 59 7.123 0.069 -10.748 1.00 0.00 H new ATOM 0 HD12 LEU A 59 7.238 -0.068 -12.518 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.867 1.379 -11.695 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.501 1.691 -9.730 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.222 3.024 -10.662 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.478 2.694 -10.784 1.00 0.00 H new ATOM 991 N MET A 60 3.645 0.379 -14.707 1.00 0.00 N ATOM 992 CA MET A 60 2.621 -0.648 -14.854 1.00 0.00 C ATOM 993 C MET A 60 3.044 -1.707 -15.864 1.00 0.00 C ATOM 994 O MET A 60 2.954 -2.905 -15.596 1.00 0.00 O ATOM 995 CB MET A 60 1.294 -0.015 -15.270 1.00 0.00 C ATOM 996 CG MET A 60 0.155 -1.007 -15.458 1.00 0.00 C ATOM 997 SD MET A 60 0.187 -1.807 -17.074 1.00 0.00 S ATOM 998 CE MET A 60 -0.220 -0.429 -18.142 1.00 0.00 C ATOM 0 H MET A 60 3.303 1.333 -14.819 1.00 0.00 H new ATOM 0 HA MET A 60 2.492 -1.138 -13.889 1.00 0.00 H new ATOM 0 HB2 MET A 60 1.002 0.716 -14.516 1.00 0.00 H new ATOM 0 HB3 MET A 60 1.442 0.530 -16.202 1.00 0.00 H new ATOM 0 HG2 MET A 60 0.209 -1.768 -14.679 1.00 0.00 H new ATOM 0 HG3 MET A 60 -0.796 -0.490 -15.332 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.084 -0.686 -18.754 1.00 0.00 H new ATOM 0 HE2 MET A 60 -0.453 0.446 -17.535 1.00 0.00 H new ATOM 0 HE3 MET A 60 0.629 -0.206 -18.788 1.00 0.00 H new ATOM 1008 N ASN A 61 3.507 -1.258 -17.026 1.00 0.00 N ATOM 1009 CA ASN A 61 3.959 -2.166 -18.073 1.00 0.00 C ATOM 1010 C ASN A 61 5.034 -3.113 -17.555 1.00 0.00 C ATOM 1011 O ASN A 61 4.980 -4.319 -17.795 1.00 0.00 O ATOM 1012 CB ASN A 61 4.467 -1.388 -19.273 1.00 0.00 C ATOM 1013 CG ASN A 61 4.924 -2.282 -20.391 1.00 0.00 C ATOM 1014 OD1 ASN A 61 4.163 -3.126 -20.879 1.00 0.00 O ATOM 1015 ND2 ASN A 61 6.154 -2.116 -20.806 1.00 0.00 N ATOM 0 H ASN A 61 3.579 -0.269 -17.266 1.00 0.00 H new ATOM 0 HA ASN A 61 3.105 -2.767 -18.386 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.676 -0.732 -19.637 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.294 -0.749 -18.963 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.520 -2.696 -21.561 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.747 -1.407 -20.374 1.00 0.00 H new ATOM 1022 N HIS A 62 6.009 -2.560 -16.842 1.00 0.00 N ATOM 1023 CA HIS A 62 7.122 -3.347 -16.325 1.00 0.00 C ATOM 1024 C HIS A 62 6.641 -4.383 -15.316 1.00 0.00 C ATOM 1025 O HIS A 62 7.120 -5.516 -15.299 1.00 0.00 O ATOM 1026 CB HIS A 62 8.171 -2.440 -15.674 1.00 0.00 C ATOM 1027 CG HIS A 62 8.952 -1.624 -16.656 1.00 0.00 C ATOM 1028 ND1 HIS A 62 9.943 -0.745 -16.270 1.00 0.00 N ATOM 1029 CD2 HIS A 62 8.889 -1.552 -18.006 1.00 0.00 C ATOM 1030 CE1 HIS A 62 10.456 -0.167 -17.343 1.00 0.00 C ATOM 1031 NE2 HIS A 62 9.834 -0.639 -18.407 1.00 0.00 N ATOM 0 H HIS A 62 6.051 -1.568 -16.609 1.00 0.00 H new ATOM 0 HA HIS A 62 7.576 -3.868 -17.168 1.00 0.00 H new ATOM 0 HB2 HIS A 62 7.674 -1.770 -14.972 1.00 0.00 H new ATOM 0 HB3 HIS A 62 8.861 -3.054 -15.095 1.00 0.00 H new ATOM 0 HD2 HIS A 62 8.221 -2.108 -18.648 1.00 0.00 H new ATOM 0 HE1 HIS A 62 11.249 0.566 -17.348 1.00 0.00 H new ATOM 0 HE2 HIS A 62 10.024 -0.369 -19.372 1.00 0.00 H new ATOM 1039 N VAL A 63 5.692 -3.986 -14.475 1.00 0.00 N ATOM 1040 CA VAL A 63 5.146 -4.878 -13.459 1.00 0.00 C ATOM 1041 C VAL A 63 4.459 -6.080 -14.094 1.00 0.00 C ATOM 1042 O VAL A 63 4.748 -7.226 -13.749 1.00 0.00 O ATOM 1043 CB VAL A 63 4.139 -4.124 -12.571 1.00 0.00 C ATOM 1044 CG1 VAL A 63 3.385 -5.097 -11.677 1.00 0.00 C ATOM 1045 CG2 VAL A 63 4.864 -3.078 -11.739 1.00 0.00 C ATOM 0 H VAL A 63 5.285 -3.051 -14.477 1.00 0.00 H new ATOM 0 HA VAL A 63 5.976 -5.233 -12.849 1.00 0.00 H new ATOM 0 HB VAL A 63 3.413 -3.620 -13.209 1.00 0.00 H new ATOM 0 HG11 VAL A 63 2.678 -4.547 -11.056 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.845 -5.814 -12.294 1.00 0.00 H new ATOM 0 HG13 VAL A 63 4.092 -5.627 -11.039 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.145 -2.549 -11.113 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.605 -3.566 -11.106 1.00 0.00 H new ATOM 0 HG23 VAL A 63 5.362 -2.368 -12.400 1.00 0.00 H new ATOM 1055 N VAL A 64 3.547 -5.812 -15.023 1.00 0.00 N ATOM 1056 CA VAL A 64 2.686 -6.852 -15.574 1.00 0.00 C ATOM 1057 C VAL A 64 3.436 -7.711 -16.583 1.00 0.00 C ATOM 1058 O VAL A 64 3.110 -8.882 -16.779 1.00 0.00 O ATOM 1059 CB VAL A 64 1.456 -6.222 -16.254 1.00 0.00 C ATOM 1060 CG1 VAL A 64 0.662 -5.392 -15.256 1.00 0.00 C ATOM 1061 CG2 VAL A 64 1.897 -5.370 -17.434 1.00 0.00 C ATOM 0 H VAL A 64 3.385 -4.882 -15.410 1.00 0.00 H new ATOM 0 HA VAL A 64 2.363 -7.486 -14.749 1.00 0.00 H new ATOM 0 HB VAL A 64 0.808 -7.018 -16.621 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.203 -4.954 -15.754 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.326 -6.030 -14.438 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.294 -4.597 -14.860 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.022 -4.927 -17.910 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.559 -4.578 -17.084 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.426 -5.993 -18.155 1.00 0.00 H new ATOM 1071 N GLN A 65 4.443 -7.124 -17.220 1.00 0.00 N ATOM 1072 CA GLN A 65 5.294 -7.857 -18.149 1.00 0.00 C ATOM 1073 C GLN A 65 6.200 -8.835 -17.411 1.00 0.00 C ATOM 1074 O GLN A 65 6.341 -9.990 -17.812 1.00 0.00 O ATOM 1075 CB GLN A 65 6.139 -6.889 -18.981 1.00 0.00 C ATOM 1076 CG GLN A 65 7.013 -7.564 -20.025 1.00 0.00 C ATOM 1077 CD GLN A 65 7.775 -6.565 -20.875 1.00 0.00 C ATOM 1078 OE1 GLN A 65 7.795 -5.367 -20.582 1.00 0.00 O ATOM 1079 NE2 GLN A 65 8.407 -7.054 -21.936 1.00 0.00 N ATOM 0 H GLN A 65 4.690 -6.141 -17.109 1.00 0.00 H new ATOM 0 HA GLN A 65 4.645 -8.426 -18.815 1.00 0.00 H new ATOM 0 HB2 GLN A 65 5.476 -6.183 -19.480 1.00 0.00 H new ATOM 0 HB3 GLN A 65 6.774 -6.310 -18.310 1.00 0.00 H new ATOM 0 HG2 GLN A 65 7.720 -8.228 -19.528 1.00 0.00 H new ATOM 0 HG3 GLN A 65 6.391 -8.185 -20.669 1.00 0.00 H new ATOM 0 HE21 GLN A 65 8.363 -8.052 -22.140 1.00 0.00 H new ATOM 0 HE22 GLN A 65 8.936 -6.431 -22.546 1.00 0.00 H new ATOM 1088 N GLN A 66 6.812 -8.366 -16.329 1.00 0.00 N ATOM 1089 CA GLN A 66 7.629 -9.223 -15.478 1.00 0.00 C ATOM 1090 C GLN A 66 6.771 -10.231 -14.726 1.00 0.00 C ATOM 1091 O GLN A 66 7.192 -11.363 -14.486 1.00 0.00 O ATOM 1092 CB GLN A 66 8.437 -8.380 -14.487 1.00 0.00 C ATOM 1093 CG GLN A 66 9.547 -7.562 -15.125 1.00 0.00 C ATOM 1094 CD GLN A 66 10.188 -6.596 -14.147 1.00 0.00 C ATOM 1095 OE1 GLN A 66 9.550 -6.139 -13.195 1.00 0.00 O ATOM 1096 NE2 GLN A 66 11.457 -6.279 -14.377 1.00 0.00 N ATOM 0 H GLN A 66 6.757 -7.395 -16.020 1.00 0.00 H new ATOM 0 HA GLN A 66 8.317 -9.772 -16.121 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.759 -7.706 -13.964 1.00 0.00 H new ATOM 0 HB3 GLN A 66 8.873 -9.040 -13.737 1.00 0.00 H new ATOM 0 HG2 GLN A 66 10.309 -8.234 -15.520 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.144 -7.005 -15.971 1.00 0.00 H new ATOM 0 HE21 GLN A 66 11.946 -6.681 -15.177 1.00 0.00 H new ATOM 0 HE22 GLN A 66 11.942 -5.634 -13.754 1.00 0.00 H new ATOM 1105 N ALA A 67 5.565 -9.814 -14.355 1.00 0.00 N ATOM 1106 CA ALA A 67 4.613 -10.705 -13.702 1.00 0.00 C ATOM 1107 C ALA A 67 4.299 -11.912 -14.577 1.00 0.00 C ATOM 1108 O ALA A 67 4.212 -13.039 -14.089 1.00 0.00 O ATOM 1109 CB ALA A 67 3.336 -9.955 -13.357 1.00 0.00 C ATOM 0 H ALA A 67 5.223 -8.863 -14.496 1.00 0.00 H new ATOM 0 HA ALA A 67 5.069 -11.067 -12.780 1.00 0.00 H new ATOM 0 HB1 ALA A 67 2.636 -10.634 -12.870 1.00 0.00 H new ATOM 0 HB2 ALA A 67 3.569 -9.130 -12.684 1.00 0.00 H new ATOM 0 HB3 ALA A 67 2.887 -9.563 -14.269 1.00 0.00 H new ATOM 1115 N LYS A 68 4.128 -11.668 -15.872 1.00 0.00 N ATOM 1116 CA LYS A 68 3.955 -12.747 -16.838 1.00 0.00 C ATOM 1117 C LYS A 68 5.112 -13.736 -16.773 1.00 0.00 C ATOM 1118 O LYS A 68 4.904 -14.948 -16.726 1.00 0.00 O ATOM 1119 CB LYS A 68 3.825 -12.183 -18.253 1.00 0.00 C ATOM 1120 CG LYS A 68 3.647 -13.238 -19.337 1.00 0.00 C ATOM 1121 CD LYS A 68 3.553 -12.602 -20.717 1.00 0.00 C ATOM 1122 CE LYS A 68 3.573 -13.656 -21.814 1.00 0.00 C ATOM 1123 NZ LYS A 68 2.327 -14.470 -21.827 1.00 0.00 N ATOM 0 H LYS A 68 4.105 -10.732 -16.277 1.00 0.00 H new ATOM 0 HA LYS A 68 3.038 -13.278 -16.583 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.975 -11.502 -18.283 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.714 -11.594 -18.479 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.485 -13.934 -19.311 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.745 -13.818 -19.139 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.636 -12.017 -20.788 1.00 0.00 H new ATOM 0 HD3 LYS A 68 4.384 -11.911 -20.859 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.699 -13.170 -22.782 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.433 -14.311 -21.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 2.389 -15.187 -22.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 2.210 -14.941 -20.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 1.510 -13.851 -22.005 1.00 0.00 H new ATOM 1137 N GLY A 69 6.333 -13.211 -16.770 1.00 0.00 N ATOM 1138 CA GLY A 69 7.526 -14.045 -16.693 1.00 0.00 C ATOM 1139 C GLY A 69 7.572 -14.819 -15.381 1.00 0.00 C ATOM 1140 O GLY A 69 8.096 -15.931 -15.324 1.00 0.00 O ATOM 0 H GLY A 69 6.522 -12.210 -16.820 1.00 0.00 H new ATOM 0 HA2 GLY A 69 7.540 -14.742 -17.531 1.00 0.00 H new ATOM 0 HA3 GLY A 69 8.416 -13.421 -16.782 1.00 0.00 H new ATOM 1144 N GLN A 70 7.021 -14.223 -14.329 1.00 0.00 N ATOM 1145 CA GLN A 70 7.003 -14.853 -13.014 1.00 0.00 C ATOM 1146 C GLN A 70 5.737 -15.677 -12.816 1.00 0.00 C ATOM 1147 O GLN A 70 5.497 -16.214 -11.734 1.00 0.00 O ATOM 1148 CB GLN A 70 7.117 -13.797 -11.912 1.00 0.00 C ATOM 1149 CG GLN A 70 8.448 -13.064 -11.888 1.00 0.00 C ATOM 1150 CD GLN A 70 8.525 -12.041 -10.770 1.00 0.00 C ATOM 1151 OE1 GLN A 70 7.649 -11.982 -9.903 1.00 0.00 O ATOM 1152 NE2 GLN A 70 9.576 -11.230 -10.784 1.00 0.00 N ATOM 0 H GLN A 70 6.581 -13.304 -14.362 1.00 0.00 H new ATOM 0 HA GLN A 70 7.861 -15.523 -12.954 1.00 0.00 H new ATOM 0 HB2 GLN A 70 6.316 -13.069 -12.038 1.00 0.00 H new ATOM 0 HB3 GLN A 70 6.962 -14.278 -10.946 1.00 0.00 H new ATOM 0 HG2 GLN A 70 9.256 -13.787 -11.772 1.00 0.00 H new ATOM 0 HG3 GLN A 70 8.602 -12.565 -12.845 1.00 0.00 H new ATOM 0 HE21 GLN A 70 10.276 -11.315 -11.521 1.00 0.00 H new ATOM 0 HE22 GLN A 70 9.683 -10.522 -10.058 1.00 0.00 H new ATOM 1161 N LYS A 71 4.929 -15.773 -13.866 1.00 0.00 N ATOM 1162 CA LYS A 71 3.706 -16.565 -13.822 1.00 0.00 C ATOM 1163 C LYS A 71 2.778 -16.085 -12.713 1.00 0.00 C ATOM 1164 O LYS A 71 2.237 -16.887 -11.953 1.00 0.00 O ATOM 1165 CB LYS A 71 4.033 -18.046 -13.629 1.00 0.00 C ATOM 1166 CG LYS A 71 4.893 -18.650 -14.732 1.00 0.00 C ATOM 1167 CD LYS A 71 5.122 -20.136 -14.503 1.00 0.00 C ATOM 1168 CE LYS A 71 6.013 -20.732 -15.583 1.00 0.00 C ATOM 1169 NZ LYS A 71 6.273 -22.180 -15.354 1.00 0.00 N ATOM 0 H LYS A 71 5.100 -15.311 -14.759 1.00 0.00 H new ATOM 0 HA LYS A 71 3.193 -16.437 -14.775 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.546 -18.171 -12.676 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.100 -18.606 -13.565 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.409 -18.499 -15.697 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.852 -18.134 -14.772 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.580 -20.289 -13.526 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.164 -20.656 -14.491 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.542 -20.598 -16.557 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.960 -20.193 -15.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.884 -22.547 -16.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.746 -22.307 -14.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.372 -22.699 -15.354 1.00 0.00 H new ATOM 1183 N ILE A 72 2.600 -14.771 -12.626 1.00 0.00 N ATOM 1184 CA ILE A 72 1.669 -14.186 -11.668 1.00 0.00 C ATOM 1185 C ILE A 72 0.423 -13.654 -12.365 1.00 0.00 C ATOM 1186 O ILE A 72 0.506 -12.763 -13.210 1.00 0.00 O ATOM 1187 CB ILE A 72 2.339 -13.049 -10.874 1.00 0.00 C ATOM 1188 CG1 ILE A 72 3.569 -13.572 -10.129 1.00 0.00 C ATOM 1189 CG2 ILE A 72 1.349 -12.424 -9.903 1.00 0.00 C ATOM 1190 CD1 ILE A 72 4.416 -12.484 -9.509 1.00 0.00 C ATOM 0 H ILE A 72 3.089 -14.091 -13.208 1.00 0.00 H new ATOM 0 HA ILE A 72 1.374 -14.977 -10.978 1.00 0.00 H new ATOM 0 HB ILE A 72 2.663 -12.280 -11.575 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.244 -14.257 -9.346 1.00 0.00 H new ATOM 0 HG13 ILE A 72 4.184 -14.148 -10.821 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.839 -11.622 -9.350 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.503 -12.018 -10.457 1.00 0.00 H new ATOM 0 HG23 ILE A 72 0.995 -13.183 -9.205 1.00 0.00 H new ATOM 0 HD11 ILE A 72 5.268 -12.933 -8.999 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.773 -11.812 -10.289 1.00 0.00 H new ATOM 0 HD13 ILE A 72 3.818 -11.922 -8.791 1.00 0.00 H new ATOM 1202 N ILE A 73 -0.731 -14.206 -12.006 1.00 0.00 N ATOM 1203 CA ILE A 73 -1.988 -13.842 -12.649 1.00 0.00 C ATOM 1204 C ILE A 73 -2.777 -12.857 -11.796 1.00 0.00 C ATOM 1205 O ILE A 73 -3.820 -12.354 -12.216 1.00 0.00 O ATOM 1206 CB ILE A 73 -2.847 -15.089 -12.922 1.00 0.00 C ATOM 1207 CG1 ILE A 73 -3.271 -15.744 -11.604 1.00 0.00 C ATOM 1208 CG2 ILE A 73 -2.088 -16.079 -13.792 1.00 0.00 C ATOM 1209 CD1 ILE A 73 -4.299 -16.840 -11.770 1.00 0.00 C ATOM 0 H ILE A 73 -0.822 -14.908 -11.272 1.00 0.00 H new ATOM 0 HA ILE A 73 -1.741 -13.366 -13.598 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.745 -14.781 -13.458 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.389 -16.157 -11.114 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -3.674 -14.978 -10.942 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -2.711 -16.955 -13.975 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.835 -15.609 -14.742 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.174 -16.384 -13.283 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.549 -17.255 -10.794 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.198 -16.429 -12.230 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.893 -17.627 -12.406 1.00 0.00 H new ATOM 1221 N GLN A 74 -2.274 -12.584 -10.597 1.00 0.00 N ATOM 1222 CA GLN A 74 -2.952 -11.689 -9.667 1.00 0.00 C ATOM 1223 C GLN A 74 -2.961 -10.257 -10.188 1.00 0.00 C ATOM 1224 O GLN A 74 -3.933 -9.525 -10.002 1.00 0.00 O ATOM 1225 CB GLN A 74 -2.285 -11.740 -8.290 1.00 0.00 C ATOM 1226 CG GLN A 74 -3.070 -11.045 -7.192 1.00 0.00 C ATOM 1227 CD GLN A 74 -4.397 -11.723 -6.911 1.00 0.00 C ATOM 1228 OE1 GLN A 74 -4.464 -12.944 -6.745 1.00 0.00 O ATOM 1229 NE2 GLN A 74 -5.464 -10.933 -6.855 1.00 0.00 N ATOM 0 H GLN A 74 -1.398 -12.970 -10.246 1.00 0.00 H new ATOM 0 HA GLN A 74 -3.984 -12.026 -9.574 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -2.135 -12.783 -8.010 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -1.298 -11.284 -8.360 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -2.474 -11.027 -6.279 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -3.248 -10.008 -7.477 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -5.363 -9.928 -6.998 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -6.384 -11.331 -6.669 1.00 0.00 H new ATOM 1238 N PHE A 75 -1.873 -9.864 -10.841 1.00 0.00 N ATOM 1239 CA PHE A 75 -1.752 -8.518 -11.388 1.00 0.00 C ATOM 1240 C PHE A 75 -2.578 -8.365 -12.659 1.00 0.00 C ATOM 1241 O PHE A 75 -3.017 -7.265 -12.997 1.00 0.00 O ATOM 1242 CB PHE A 75 -0.287 -8.190 -11.683 1.00 0.00 C ATOM 1243 CG PHE A 75 0.501 -7.791 -10.468 1.00 0.00 C ATOM 1244 CD1 PHE A 75 1.243 -8.730 -9.766 1.00 0.00 C ATOM 1245 CD2 PHE A 75 0.502 -6.478 -10.024 1.00 0.00 C ATOM 1246 CE1 PHE A 75 1.968 -8.364 -8.648 1.00 0.00 C ATOM 1247 CE2 PHE A 75 1.227 -6.109 -8.908 1.00 0.00 C ATOM 1248 CZ PHE A 75 1.961 -7.054 -8.219 1.00 0.00 C ATOM 0 H PHE A 75 -1.061 -10.459 -11.005 1.00 0.00 H new ATOM 0 HA PHE A 75 -2.133 -7.821 -10.641 1.00 0.00 H new ATOM 0 HB2 PHE A 75 0.185 -9.059 -12.142 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -0.245 -7.382 -12.413 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.254 -9.758 -10.097 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.071 -5.734 -10.557 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.541 -9.105 -8.110 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.220 -5.082 -8.574 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.528 -6.767 -7.346 1.00 0.00 H new ATOM 1258 N GLN A 76 -2.786 -9.473 -13.361 1.00 0.00 N ATOM 1259 CA GLN A 76 -3.618 -9.478 -14.558 1.00 0.00 C ATOM 1260 C GLN A 76 -5.053 -9.082 -14.233 1.00 0.00 C ATOM 1261 O GLN A 76 -5.625 -8.201 -14.875 1.00 0.00 O ATOM 1262 CB GLN A 76 -3.594 -10.856 -15.223 1.00 0.00 C ATOM 1263 CG GLN A 76 -2.271 -11.206 -15.884 1.00 0.00 C ATOM 1264 CD GLN A 76 -2.280 -12.592 -16.499 1.00 0.00 C ATOM 1265 OE1 GLN A 76 -2.785 -13.548 -15.903 1.00 0.00 O ATOM 1266 NE2 GLN A 76 -1.719 -12.711 -17.697 1.00 0.00 N ATOM 0 H GLN A 76 -2.389 -10.381 -13.121 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.208 -8.743 -15.250 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.824 -11.613 -14.473 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -4.384 -10.899 -15.972 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.048 -10.470 -16.657 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -1.472 -11.144 -15.146 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -1.313 -11.894 -18.154 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -1.694 -13.619 -18.160 1.00 0.00 H new ATOM 1275 N ASP A 77 -5.630 -9.739 -13.233 1.00 0.00 N ATOM 1276 CA ASP A 77 -6.997 -9.452 -12.816 1.00 0.00 C ATOM 1277 C ASP A 77 -7.091 -8.095 -12.130 1.00 0.00 C ATOM 1278 O ASP A 77 -8.026 -7.331 -12.369 1.00 0.00 O ATOM 1279 CB ASP A 77 -7.511 -10.543 -11.873 1.00 0.00 C ATOM 1280 CG ASP A 77 -7.775 -11.864 -12.583 1.00 0.00 C ATOM 1281 OD1 ASP A 77 -7.841 -11.865 -13.789 1.00 0.00 O ATOM 1282 OD2 ASP A 77 -7.908 -12.860 -11.912 1.00 0.00 O ATOM 0 H ASP A 77 -5.171 -10.475 -12.696 1.00 0.00 H new ATOM 0 HA ASP A 77 -7.617 -9.430 -13.712 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.782 -10.703 -11.079 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.431 -10.202 -11.398 1.00 0.00 H new ATOM 1287 N SER A 78 -6.116 -7.801 -11.277 1.00 0.00 N ATOM 1288 CA SER A 78 -6.083 -6.532 -10.559 1.00 0.00 C ATOM 1289 C SER A 78 -5.992 -5.356 -11.522 1.00 0.00 C ATOM 1290 O SER A 78 -6.682 -4.350 -11.356 1.00 0.00 O ATOM 1291 CB SER A 78 -4.909 -6.505 -9.600 1.00 0.00 C ATOM 1292 OG SER A 78 -5.049 -7.482 -8.606 1.00 0.00 O ATOM 0 H SER A 78 -5.337 -8.425 -11.066 1.00 0.00 H new ATOM 0 HA SER A 78 -7.012 -6.440 -9.996 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.982 -6.671 -10.150 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.834 -5.520 -9.139 1.00 0.00 H new ATOM 0 HG SER A 78 -4.605 -8.307 -8.893 1.00 0.00 H new ATOM 1298 N PHE A 79 -5.136 -5.489 -12.530 1.00 0.00 N ATOM 1299 CA PHE A 79 -5.004 -4.468 -13.562 1.00 0.00 C ATOM 1300 C PHE A 79 -6.307 -4.288 -14.330 1.00 0.00 C ATOM 1301 O PHE A 79 -6.793 -3.169 -14.495 1.00 0.00 O ATOM 1302 CB PHE A 79 -3.880 -4.832 -14.534 1.00 0.00 C ATOM 1303 CG PHE A 79 -3.738 -3.876 -15.683 1.00 0.00 C ATOM 1304 CD1 PHE A 79 -3.291 -2.579 -15.475 1.00 0.00 C ATOM 1305 CD2 PHE A 79 -4.053 -4.269 -16.975 1.00 0.00 C ATOM 1306 CE1 PHE A 79 -3.161 -1.698 -16.531 1.00 0.00 C ATOM 1307 CE2 PHE A 79 -3.922 -3.391 -18.034 1.00 0.00 C ATOM 1308 CZ PHE A 79 -3.476 -2.104 -17.811 1.00 0.00 C ATOM 0 H PHE A 79 -4.523 -6.295 -12.654 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.762 -3.528 -13.067 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -2.938 -4.870 -13.987 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -4.062 -5.833 -14.926 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.042 -2.254 -14.476 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.405 -5.274 -17.156 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.813 -0.691 -16.354 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.168 -3.712 -19.035 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.374 -1.416 -18.637 1.00 0.00 H new ATOM 1318 N GLY A 80 -6.870 -5.397 -14.797 1.00 0.00 N ATOM 1319 CA GLY A 80 -8.079 -5.359 -15.611 1.00 0.00 C ATOM 1320 C GLY A 80 -9.201 -4.615 -14.897 1.00 0.00 C ATOM 1321 O GLY A 80 -10.029 -3.963 -15.532 1.00 0.00 O ATOM 0 H GLY A 80 -6.508 -6.335 -14.625 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.865 -4.873 -16.563 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.400 -6.376 -15.838 1.00 0.00 H new ATOM 1325 N LYS A 81 -9.221 -4.716 -13.572 1.00 0.00 N ATOM 1326 CA LYS A 81 -10.225 -4.032 -12.766 1.00 0.00 C ATOM 1327 C LYS A 81 -10.296 -2.551 -13.117 1.00 0.00 C ATOM 1328 O LYS A 81 -11.381 -1.977 -13.209 1.00 0.00 O ATOM 1329 CB LYS A 81 -9.926 -4.205 -11.276 1.00 0.00 C ATOM 1330 CG LYS A 81 -10.943 -3.552 -10.350 1.00 0.00 C ATOM 1331 CD LYS A 81 -10.587 -3.780 -8.889 1.00 0.00 C ATOM 1332 CE LYS A 81 -11.601 -3.126 -7.962 1.00 0.00 C ATOM 1333 NZ LYS A 81 -11.268 -3.347 -6.529 1.00 0.00 N ATOM 0 H LYS A 81 -8.552 -5.266 -13.033 1.00 0.00 H new ATOM 0 HA LYS A 81 -11.193 -4.482 -12.987 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.877 -5.270 -11.049 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.941 -3.789 -11.065 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -10.988 -2.482 -10.553 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.935 -3.957 -10.552 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.544 -4.850 -8.686 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -9.595 -3.377 -8.688 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.640 -2.056 -8.164 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.593 -3.526 -8.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -12.125 -3.231 -5.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.894 -4.309 -6.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -10.552 -2.655 -6.228 1.00 0.00 H new ATOM 1347 N VAL A 82 -9.134 -1.938 -13.312 1.00 0.00 N ATOM 1348 CA VAL A 82 -9.052 -0.495 -13.506 1.00 0.00 C ATOM 1349 C VAL A 82 -8.573 -0.154 -14.911 1.00 0.00 C ATOM 1350 O VAL A 82 -8.670 0.993 -15.349 1.00 0.00 O ATOM 1351 CB VAL A 82 -8.093 0.129 -12.474 1.00 0.00 C ATOM 1352 CG1 VAL A 82 -8.587 -0.137 -11.060 1.00 0.00 C ATOM 1353 CG2 VAL A 82 -6.691 -0.425 -12.670 1.00 0.00 C ATOM 0 H VAL A 82 -8.235 -2.418 -13.340 1.00 0.00 H new ATOM 0 HA VAL A 82 -10.053 -0.085 -13.370 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.065 1.208 -12.623 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.898 0.311 -10.344 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.577 0.300 -10.932 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.640 -1.212 -10.889 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.018 0.020 -11.937 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -6.706 -1.507 -12.539 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -6.343 -0.186 -13.675 1.00 0.00 H new ATOM 1363 N ALA A 83 -8.056 -1.156 -15.614 1.00 0.00 N ATOM 1364 CA ALA A 83 -7.413 -0.935 -16.904 1.00 0.00 C ATOM 1365 C ALA A 83 -8.339 -0.194 -17.861 1.00 0.00 C ATOM 1366 O ALA A 83 -7.989 0.864 -18.383 1.00 0.00 O ATOM 1367 CB ALA A 83 -6.976 -2.260 -17.511 1.00 0.00 C ATOM 0 H ALA A 83 -8.070 -2.130 -15.312 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.532 -0.315 -16.739 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -6.498 -2.079 -18.474 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -6.270 -2.752 -16.842 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -7.847 -2.900 -17.653 1.00 0.00 H new ATOM 1373 N ALA A 84 -9.521 -0.757 -18.087 1.00 0.00 N ATOM 1374 CA ALA A 84 -10.444 -0.226 -19.083 1.00 0.00 C ATOM 1375 C ALA A 84 -10.743 1.245 -18.829 1.00 0.00 C ATOM 1376 O ALA A 84 -10.630 2.076 -19.730 1.00 0.00 O ATOM 1377 CB ALA A 84 -11.734 -1.034 -19.094 1.00 0.00 C ATOM 0 H ALA A 84 -9.863 -1.582 -17.593 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.968 -0.309 -20.060 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -12.413 -0.625 -19.843 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.510 -2.073 -19.336 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -12.204 -0.983 -18.112 1.00 0.00 H new ATOM 1383 N GLU A 85 -11.125 1.562 -17.596 1.00 0.00 N ATOM 1384 CA GLU A 85 -11.526 2.918 -17.243 1.00 0.00 C ATOM 1385 C GLU A 85 -10.355 3.886 -17.357 1.00 0.00 C ATOM 1386 O GLU A 85 -10.449 4.911 -18.033 1.00 0.00 O ATOM 1387 CB GLU A 85 -12.093 2.954 -15.822 1.00 0.00 C ATOM 1388 CG GLU A 85 -12.585 4.323 -15.376 1.00 0.00 C ATOM 1389 CD GLU A 85 -13.185 4.308 -13.997 1.00 0.00 C ATOM 1390 OE1 GLU A 85 -13.133 3.285 -13.358 1.00 0.00 O ATOM 1391 OE2 GLU A 85 -13.696 5.322 -13.582 1.00 0.00 O ATOM 0 H GLU A 85 -11.165 0.897 -16.824 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.299 3.230 -17.945 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.918 2.245 -15.755 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.324 2.614 -15.128 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.753 5.027 -15.397 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.328 4.686 -16.086 1.00 0.00 H new ATOM 1398 N VAL A 86 -9.253 3.556 -16.693 1.00 0.00 N ATOM 1399 CA VAL A 86 -8.106 4.452 -16.618 1.00 0.00 C ATOM 1400 C VAL A 86 -7.549 4.752 -18.003 1.00 0.00 C ATOM 1401 O VAL A 86 -7.356 5.912 -18.368 1.00 0.00 O ATOM 1402 CB VAL A 86 -6.999 3.831 -15.746 1.00 0.00 C ATOM 1403 CG1 VAL A 86 -5.724 4.656 -15.836 1.00 0.00 C ATOM 1404 CG2 VAL A 86 -7.472 3.725 -14.304 1.00 0.00 C ATOM 0 H VAL A 86 -9.130 2.673 -16.198 1.00 0.00 H new ATOM 0 HA VAL A 86 -8.445 5.386 -16.169 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.780 2.829 -16.115 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.953 4.203 -15.214 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.383 4.687 -16.871 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.921 5.670 -15.488 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.683 3.285 -13.694 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.712 4.719 -13.926 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -8.361 3.095 -14.258 1.00 0.00 H new ATOM 1414 N LEU A 87 -7.293 3.699 -18.773 1.00 0.00 N ATOM 1415 CA LEU A 87 -6.663 3.841 -20.080 1.00 0.00 C ATOM 1416 C LEU A 87 -7.516 4.690 -21.014 1.00 0.00 C ATOM 1417 O LEU A 87 -6.994 5.474 -21.806 1.00 0.00 O ATOM 1418 CB LEU A 87 -6.427 2.461 -20.707 1.00 0.00 C ATOM 1419 CG LEU A 87 -5.382 1.583 -20.007 1.00 0.00 C ATOM 1420 CD1 LEU A 87 -5.368 0.201 -20.647 1.00 0.00 C ATOM 1421 CD2 LEU A 87 -4.015 2.244 -20.103 1.00 0.00 C ATOM 0 H LEU A 87 -7.513 2.737 -18.514 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.706 4.343 -19.937 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.375 1.923 -20.724 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.122 2.601 -21.744 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.636 1.471 -18.953 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.625 -0.423 -20.150 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.352 -0.256 -20.547 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.116 0.292 -21.704 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.273 1.619 -19.605 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.742 2.366 -21.151 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.049 3.221 -19.621 1.00 0.00 H new ATOM 1433 N GLY A 88 -8.831 4.530 -20.915 1.00 0.00 N ATOM 1434 CA GLY A 88 -9.762 5.336 -21.696 1.00 0.00 C ATOM 1435 C GLY A 88 -9.679 6.806 -21.307 1.00 0.00 C ATOM 1436 O GLY A 88 -9.611 7.683 -22.168 1.00 0.00 O ATOM 0 H GLY A 88 -9.277 3.849 -20.301 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -9.541 5.225 -22.758 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.778 4.973 -21.542 1.00 0.00 H new ATOM 1440 N ARG A 89 -9.684 7.069 -20.005 1.00 0.00 N ATOM 1441 CA ARG A 89 -9.702 8.437 -19.500 1.00 0.00 C ATOM 1442 C ARG A 89 -8.423 9.177 -19.870 1.00 0.00 C ATOM 1443 O ARG A 89 -8.466 10.315 -20.337 1.00 0.00 O ATOM 1444 CB ARG A 89 -9.871 8.448 -17.988 1.00 0.00 C ATOM 1445 CG ARG A 89 -11.259 8.071 -17.497 1.00 0.00 C ATOM 1446 CD ARG A 89 -11.391 8.253 -16.028 1.00 0.00 C ATOM 1447 NE ARG A 89 -12.663 7.755 -15.532 1.00 0.00 N ATOM 1448 CZ ARG A 89 -13.836 8.410 -15.640 1.00 0.00 C ATOM 1449 NH1 ARG A 89 -13.881 9.585 -16.227 1.00 0.00 N ATOM 1450 NH2 ARG A 89 -14.941 7.871 -15.155 1.00 0.00 N ATOM 0 H ARG A 89 -9.676 6.352 -19.279 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.548 8.945 -19.962 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -9.147 7.760 -17.551 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.628 9.444 -17.617 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.004 8.681 -18.008 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -11.467 7.033 -17.755 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -10.576 7.734 -15.523 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -11.295 9.311 -15.783 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.668 6.846 -15.070 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.028 10.001 -16.601 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -14.769 10.081 -16.309 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -14.906 6.959 -14.699 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -15.829 8.367 -15.237 1.00 0.00 H new ATOM 1464 N ILE A 90 -7.285 8.524 -19.658 1.00 0.00 N ATOM 1465 CA ILE A 90 -5.988 9.149 -19.891 1.00 0.00 C ATOM 1466 C ILE A 90 -5.697 9.274 -21.381 1.00 0.00 C ATOM 1467 O ILE A 90 -4.906 10.120 -21.800 1.00 0.00 O ATOM 1468 CB ILE A 90 -4.863 8.347 -19.213 1.00 0.00 C ATOM 1469 CG1 ILE A 90 -4.712 6.975 -19.873 1.00 0.00 C ATOM 1470 CG2 ILE A 90 -5.138 8.198 -17.724 1.00 0.00 C ATOM 1471 CD1 ILE A 90 -3.529 6.181 -19.369 1.00 0.00 C ATOM 0 H ILE A 90 -7.235 7.561 -19.325 1.00 0.00 H new ATOM 0 HA ILE A 90 -6.026 10.148 -19.456 1.00 0.00 H new ATOM 0 HB ILE A 90 -3.927 8.892 -19.336 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.622 6.399 -19.704 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.615 7.109 -20.950 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.333 7.628 -17.260 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.196 9.185 -17.264 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -6.083 7.674 -17.579 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.489 5.221 -19.884 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.610 6.735 -19.562 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.633 6.014 -18.297 1.00 0.00 H new ATOM 1483 N ASN A 91 -6.340 8.428 -22.178 1.00 0.00 N ATOM 1484 CA ASN A 91 -6.286 8.551 -23.630 1.00 0.00 C ATOM 1485 C ASN A 91 -6.815 9.904 -24.088 1.00 0.00 C ATOM 1486 O ASN A 91 -6.249 10.531 -24.984 1.00 0.00 O ATOM 1487 CB ASN A 91 -7.059 7.424 -24.290 1.00 0.00 C ATOM 1488 CG ASN A 91 -6.882 7.400 -25.783 1.00 0.00 C ATOM 1489 OD1 ASN A 91 -5.779 7.157 -26.286 1.00 0.00 O ATOM 1490 ND2 ASN A 91 -7.948 7.647 -26.502 1.00 0.00 N ATOM 0 H ASN A 91 -6.906 7.648 -21.842 1.00 0.00 H new ATOM 0 HA ASN A 91 -5.242 8.479 -23.934 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -6.732 6.471 -23.873 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -8.118 7.528 -24.055 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.888 7.644 -27.520 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -8.838 7.843 -26.044 1.00 0.00 H new ATOM 1497 N GLN A 92 -7.902 10.349 -23.469 1.00 0.00 N ATOM 1498 CA GLN A 92 -8.467 11.661 -23.761 1.00 0.00 C ATOM 1499 C GLN A 92 -7.615 12.774 -23.163 1.00 0.00 C ATOM 1500 O GLN A 92 -7.428 13.824 -23.778 1.00 0.00 O ATOM 1501 CB GLN A 92 -9.900 11.758 -23.230 1.00 0.00 C ATOM 1502 CG GLN A 92 -10.894 10.865 -23.953 1.00 0.00 C ATOM 1503 CD GLN A 92 -12.293 10.969 -23.377 1.00 0.00 C ATOM 1504 OE1 GLN A 92 -12.475 11.362 -22.221 1.00 0.00 O ATOM 1505 NE2 GLN A 92 -13.290 10.618 -24.180 1.00 0.00 N ATOM 0 H GLN A 92 -8.410 9.820 -22.761 1.00 0.00 H new ATOM 0 HA GLN A 92 -8.479 11.783 -24.844 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -9.901 11.501 -22.171 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.235 12.792 -23.307 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.918 11.134 -25.009 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.557 9.830 -23.895 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.093 10.299 -25.129 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.253 10.667 -23.849 1.00 0.00 H new ATOM 1514 N GLU A 93 -7.101 12.537 -21.961 1.00 0.00 N ATOM 1515 CA GLU A 93 -6.300 13.534 -21.261 1.00 0.00 C ATOM 1516 C GLU A 93 -4.978 13.780 -21.976 1.00 0.00 C ATOM 1517 O GLU A 93 -4.497 14.911 -22.041 1.00 0.00 O ATOM 1518 CB GLU A 93 -6.036 13.090 -19.820 1.00 0.00 C ATOM 1519 CG GLU A 93 -7.268 13.094 -18.926 1.00 0.00 C ATOM 1520 CD GLU A 93 -6.987 12.581 -17.541 1.00 0.00 C ATOM 1521 OE1 GLU A 93 -5.970 11.958 -17.354 1.00 0.00 O ATOM 1522 OE2 GLU A 93 -7.791 12.812 -16.669 1.00 0.00 O ATOM 0 H GLU A 93 -7.225 11.662 -21.451 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.864 14.467 -21.252 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.615 12.085 -19.834 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.283 13.745 -19.383 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.659 14.109 -18.860 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.045 12.482 -19.384 1.00 0.00 H new ATOM 1529 N PHE A 94 -4.394 12.714 -22.513 1.00 0.00 N ATOM 1530 CA PHE A 94 -3.097 12.801 -23.174 1.00 0.00 C ATOM 1531 C PHE A 94 -3.193 13.592 -24.472 1.00 0.00 C ATOM 1532 O PHE A 94 -4.195 13.517 -25.183 1.00 0.00 O ATOM 1533 CB PHE A 94 -2.549 11.403 -23.461 1.00 0.00 C ATOM 1534 CG PHE A 94 -1.975 10.716 -22.254 1.00 0.00 C ATOM 1535 CD1 PHE A 94 -1.675 11.436 -21.107 1.00 0.00 C ATOM 1536 CD2 PHE A 94 -1.735 9.351 -22.263 1.00 0.00 C ATOM 1537 CE1 PHE A 94 -1.148 10.805 -19.996 1.00 0.00 C ATOM 1538 CE2 PHE A 94 -1.208 8.718 -21.154 1.00 0.00 C ATOM 1539 CZ PHE A 94 -0.915 9.447 -20.019 1.00 0.00 C ATOM 0 H PHE A 94 -4.799 11.778 -22.503 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.416 13.322 -22.501 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -3.349 10.787 -23.872 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -1.777 11.476 -24.227 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -1.855 12.501 -21.082 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.963 8.775 -23.148 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -0.919 11.377 -19.109 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -1.025 7.654 -21.175 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.504 8.954 -19.151 1.00 0.00 H new ATOM 1549 N PRO A 95 -2.145 14.349 -24.776 1.00 0.00 N ATOM 1550 CA PRO A 95 -2.032 15.018 -26.067 1.00 0.00 C ATOM 1551 C PRO A 95 -1.833 14.012 -27.193 1.00 0.00 C ATOM 1552 O PRO A 95 -1.708 12.812 -26.951 1.00 0.00 O ATOM 1553 CB PRO A 95 -0.802 15.913 -25.885 1.00 0.00 C ATOM 1554 CG PRO A 95 0.045 15.175 -24.904 1.00 0.00 C ATOM 1555 CD PRO A 95 -0.940 14.568 -23.942 1.00 0.00 C ATOM 0 HA PRO A 95 -2.926 15.577 -26.343 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -0.278 16.066 -26.828 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.078 16.899 -25.510 1.00 0.00 H new ATOM 0 HG2 PRO A 95 0.645 14.409 -25.395 1.00 0.00 H new ATOM 0 HG3 PRO A 95 0.738 15.845 -24.394 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -0.567 13.634 -23.521 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.147 15.235 -23.105 1.00 0.00 H new ATOM 1563 N ARG A 96 -1.804 14.509 -28.425 1.00 0.00 N ATOM 1564 CA ARG A 96 -1.733 13.646 -29.598 1.00 0.00 C ATOM 1565 C ARG A 96 -0.534 12.709 -29.521 1.00 0.00 C ATOM 1566 O ARG A 96 -0.626 11.536 -29.881 1.00 0.00 O ATOM 1567 CB ARG A 96 -1.642 14.476 -30.870 1.00 0.00 C ATOM 1568 CG ARG A 96 -2.917 15.216 -31.242 1.00 0.00 C ATOM 1569 CD ARG A 96 -2.733 16.049 -32.459 1.00 0.00 C ATOM 1570 NE ARG A 96 -3.950 16.759 -32.819 1.00 0.00 N ATOM 1571 CZ ARG A 96 -4.033 17.694 -33.785 1.00 0.00 C ATOM 1572 NH1 ARG A 96 -2.964 18.020 -34.478 1.00 0.00 N ATOM 1573 NH2 ARG A 96 -5.188 18.284 -34.037 1.00 0.00 N ATOM 0 H ARG A 96 -1.829 15.506 -28.637 1.00 0.00 H new ATOM 0 HA ARG A 96 -2.645 13.049 -29.620 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -0.837 15.202 -30.756 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -1.365 13.820 -31.696 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -3.719 14.497 -31.411 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -3.226 15.849 -30.411 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -1.930 16.767 -32.290 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -2.423 15.415 -33.290 1.00 0.00 H new ATOM 0 HE ARG A 96 -4.801 16.533 -32.304 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -2.072 17.565 -34.284 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -3.027 18.728 -35.210 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.018 18.032 -33.500 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -5.250 18.992 -34.769 1.00 0.00 H new ATOM 1587 N ASP A 97 0.591 13.235 -29.048 1.00 0.00 N ATOM 1588 CA ASP A 97 1.826 12.463 -28.975 1.00 0.00 C ATOM 1589 C ASP A 97 1.687 11.289 -28.015 1.00 0.00 C ATOM 1590 O ASP A 97 1.964 10.145 -28.374 1.00 0.00 O ATOM 1591 CB ASP A 97 2.991 13.354 -28.536 1.00 0.00 C ATOM 1592 CG ASP A 97 3.414 14.348 -29.609 1.00 0.00 C ATOM 1593 OD1 ASP A 97 3.035 14.167 -30.742 1.00 0.00 O ATOM 1594 OD2 ASP A 97 4.112 15.279 -29.286 1.00 0.00 O ATOM 0 H ASP A 97 0.673 14.194 -28.709 1.00 0.00 H new ATOM 0 HA ASP A 97 2.030 12.072 -29.972 1.00 0.00 H new ATOM 0 HB2 ASP A 97 2.706 13.898 -27.636 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.843 12.727 -28.273 1.00 0.00 H new ATOM 1599 N LEU A 98 1.256 11.580 -26.792 1.00 0.00 N ATOM 1600 CA LEU A 98 1.144 10.559 -25.757 1.00 0.00 C ATOM 1601 C LEU A 98 -0.075 9.676 -25.984 1.00 0.00 C ATOM 1602 O LEU A 98 -0.097 8.514 -25.577 1.00 0.00 O ATOM 1603 CB LEU A 98 1.057 11.216 -24.373 1.00 0.00 C ATOM 1604 CG LEU A 98 2.315 11.962 -23.910 1.00 0.00 C ATOM 1605 CD1 LEU A 98 2.076 12.551 -22.527 1.00 0.00 C ATOM 1606 CD2 LEU A 98 3.498 11.005 -23.900 1.00 0.00 C ATOM 0 H LEU A 98 0.978 12.515 -26.493 1.00 0.00 H new ATOM 0 HA LEU A 98 2.035 9.933 -25.806 1.00 0.00 H new ATOM 0 HB2 LEU A 98 0.222 11.917 -24.376 1.00 0.00 H new ATOM 0 HB3 LEU A 98 0.824 10.445 -23.639 1.00 0.00 H new ATOM 0 HG LEU A 98 2.539 12.778 -24.597 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.970 13.081 -22.198 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.237 13.245 -22.567 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.850 11.749 -21.824 1.00 0.00 H new ATOM 0 HD21 LEU A 98 4.392 11.535 -23.571 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.293 10.180 -23.217 1.00 0.00 H new ATOM 0 HD23 LEU A 98 3.658 10.613 -24.905 1.00 0.00 H new ATOM 1618 N LYS A 99 -1.090 10.233 -26.637 1.00 0.00 N ATOM 1619 CA LYS A 99 -2.257 9.459 -27.044 1.00 0.00 C ATOM 1620 C LYS A 99 -1.862 8.307 -27.959 1.00 0.00 C ATOM 1621 O LYS A 99 -2.288 7.170 -27.762 1.00 0.00 O ATOM 1622 CB LYS A 99 -3.279 10.357 -27.740 1.00 0.00 C ATOM 1623 CG LYS A 99 -4.541 9.638 -28.197 1.00 0.00 C ATOM 1624 CD LYS A 99 -5.515 10.598 -28.864 1.00 0.00 C ATOM 1625 CE LYS A 99 -6.744 9.869 -29.384 1.00 0.00 C ATOM 1626 NZ LYS A 99 -7.692 10.792 -30.067 1.00 0.00 N ATOM 0 H LYS A 99 -1.128 11.219 -26.896 1.00 0.00 H new ATOM 0 HA LYS A 99 -2.709 9.040 -26.145 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.560 11.162 -27.060 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -2.807 10.821 -28.606 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.277 8.843 -28.894 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.022 9.165 -27.341 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.819 11.364 -28.151 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.017 11.109 -29.688 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.435 9.087 -30.078 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -7.252 9.376 -28.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -8.516 10.255 -30.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -8.007 11.523 -29.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -7.216 11.243 -30.874 1.00 0.00 H new ATOM 1640 N LYS A 100 -1.044 8.609 -28.962 1.00 0.00 N ATOM 1641 CA LYS A 100 -0.542 7.589 -29.875 1.00 0.00 C ATOM 1642 C LYS A 100 0.352 6.592 -29.149 1.00 0.00 C ATOM 1643 O LYS A 100 0.227 5.382 -29.334 1.00 0.00 O ATOM 1644 CB LYS A 100 0.222 8.235 -31.032 1.00 0.00 C ATOM 1645 CG LYS A 100 -0.655 8.996 -32.018 1.00 0.00 C ATOM 1646 CD LYS A 100 0.180 9.655 -33.106 1.00 0.00 C ATOM 1647 CE LYS A 100 -0.692 10.437 -34.077 1.00 0.00 C ATOM 1648 NZ LYS A 100 0.114 11.114 -35.128 1.00 0.00 N ATOM 0 H LYS A 100 -0.714 9.553 -29.163 1.00 0.00 H new ATOM 0 HA LYS A 100 -1.400 7.049 -30.275 1.00 0.00 H new ATOM 0 HB2 LYS A 100 0.966 8.919 -30.623 1.00 0.00 H new ATOM 0 HB3 LYS A 100 0.765 7.459 -31.571 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -1.373 8.313 -32.471 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -1.229 9.755 -31.487 1.00 0.00 H new ATOM 0 HD2 LYS A 100 0.911 10.324 -32.651 1.00 0.00 H new ATOM 0 HD3 LYS A 100 0.739 8.893 -33.649 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.407 9.762 -34.547 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -1.270 11.181 -33.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -0.518 11.635 -35.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 0.779 11.778 -34.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 0.646 10.403 -35.670 1.00 0.00 H new ATOM 1662 N LYS A 101 1.256 7.108 -28.322 1.00 0.00 N ATOM 1663 CA LYS A 101 2.185 6.265 -27.580 1.00 0.00 C ATOM 1664 C LYS A 101 1.445 5.334 -26.629 1.00 0.00 C ATOM 1665 O LYS A 101 1.833 4.180 -26.447 1.00 0.00 O ATOM 1666 CB LYS A 101 3.185 7.124 -26.804 1.00 0.00 C ATOM 1667 CG LYS A 101 4.214 7.833 -27.674 1.00 0.00 C ATOM 1668 CD LYS A 101 5.158 8.679 -26.834 1.00 0.00 C ATOM 1669 CE LYS A 101 6.187 9.389 -27.701 1.00 0.00 C ATOM 1670 NZ LYS A 101 7.116 10.225 -26.893 1.00 0.00 N ATOM 0 H LYS A 101 1.364 8.107 -28.149 1.00 0.00 H new ATOM 0 HA LYS A 101 2.728 5.654 -28.300 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.636 7.871 -26.231 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.708 6.492 -26.086 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.786 7.096 -28.238 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.705 8.465 -28.401 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.585 9.415 -26.270 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.667 8.046 -26.107 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.759 8.651 -28.262 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.675 10.017 -28.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.800 10.691 -27.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.574 10.947 -26.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.624 9.623 -26.214 1.00 0.00 H new ATOM 1684 N LEU A 102 0.376 5.841 -26.024 1.00 0.00 N ATOM 1685 CA LEU A 102 -0.466 5.033 -25.151 1.00 0.00 C ATOM 1686 C LEU A 102 -1.049 3.840 -25.897 1.00 0.00 C ATOM 1687 O LEU A 102 -0.976 2.705 -25.427 1.00 0.00 O ATOM 1688 CB LEU A 102 -1.602 5.886 -24.572 1.00 0.00 C ATOM 1689 CG LEU A 102 -2.631 5.133 -23.719 1.00 0.00 C ATOM 1690 CD1 LEU A 102 -1.944 4.543 -22.496 1.00 0.00 C ATOM 1691 CD2 LEU A 102 -3.748 6.084 -23.314 1.00 0.00 C ATOM 0 H LEU A 102 0.072 6.810 -26.123 1.00 0.00 H new ATOM 0 HA LEU A 102 0.157 4.659 -24.338 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.164 6.678 -23.965 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -2.125 6.370 -25.397 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.066 4.317 -24.295 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.676 4.008 -21.890 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.163 3.853 -22.815 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.501 5.345 -21.905 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.479 5.549 -22.708 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.332 6.909 -22.736 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.234 6.476 -24.207 1.00 0.00 H new ATOM 1703 N SER A 103 -1.628 4.104 -27.064 1.00 0.00 N ATOM 1704 CA SER A 103 -2.243 3.055 -27.868 1.00 0.00 C ATOM 1705 C SER A 103 -1.210 2.034 -28.325 1.00 0.00 C ATOM 1706 O SER A 103 -1.525 0.858 -28.512 1.00 0.00 O ATOM 1707 CB SER A 103 -2.936 3.661 -29.074 1.00 0.00 C ATOM 1708 OG SER A 103 -2.003 4.182 -29.980 1.00 0.00 O ATOM 0 H SER A 103 -1.684 5.036 -27.474 1.00 0.00 H new ATOM 0 HA SER A 103 -2.978 2.543 -27.247 1.00 0.00 H new ATOM 0 HB2 SER A 103 -3.544 2.903 -29.568 1.00 0.00 H new ATOM 0 HB3 SER A 103 -3.614 4.451 -28.750 1.00 0.00 H new ATOM 0 HG SER A 103 -1.248 4.567 -29.487 1.00 0.00 H new ATOM 1714 N ARG A 104 0.026 2.488 -28.504 1.00 0.00 N ATOM 1715 CA ARG A 104 1.129 1.597 -28.843 1.00 0.00 C ATOM 1716 C ARG A 104 1.452 0.657 -27.689 1.00 0.00 C ATOM 1717 O ARG A 104 1.686 -0.535 -27.893 1.00 0.00 O ATOM 1718 CB ARG A 104 2.371 2.397 -29.205 1.00 0.00 C ATOM 1719 CG ARG A 104 2.304 3.114 -30.544 1.00 0.00 C ATOM 1720 CD ARG A 104 3.523 3.923 -30.796 1.00 0.00 C ATOM 1721 NE ARG A 104 3.470 4.597 -32.083 1.00 0.00 N ATOM 1722 CZ ARG A 104 4.403 5.458 -32.535 1.00 0.00 C ATOM 1723 NH1 ARG A 104 5.452 5.738 -31.794 1.00 0.00 N ATOM 1724 NH2 ARG A 104 4.263 6.020 -33.723 1.00 0.00 N ATOM 0 H ARG A 104 0.289 3.470 -28.420 1.00 0.00 H new ATOM 0 HA ARG A 104 0.818 1.003 -29.702 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.551 3.135 -28.423 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.229 1.725 -29.212 1.00 0.00 H new ATOM 0 HG2 ARG A 104 2.181 2.382 -31.343 1.00 0.00 H new ATOM 0 HG3 ARG A 104 1.427 3.761 -30.567 1.00 0.00 H new ATOM 0 HD2 ARG A 104 3.638 4.662 -30.003 1.00 0.00 H new ATOM 0 HD3 ARG A 104 4.401 3.278 -30.760 1.00 0.00 H new ATOM 0 HE ARG A 104 2.670 4.405 -32.686 1.00 0.00 H new ATOM 0 HH11 ARG A 104 5.560 5.304 -30.877 1.00 0.00 H new ATOM 0 HH12 ARG A 104 6.158 6.390 -32.136 1.00 0.00 H new ATOM 0 HH21 ARG A 104 3.449 5.802 -34.298 1.00 0.00 H new ATOM 0 HH22 ARG A 104 4.969 6.672 -34.065 1.00 0.00 H new ATOM 1738 N VAL A 105 1.463 1.199 -26.476 1.00 0.00 N ATOM 1739 CA VAL A 105 1.665 0.392 -25.278 1.00 0.00 C ATOM 1740 C VAL A 105 0.580 -0.668 -25.139 1.00 0.00 C ATOM 1741 O VAL A 105 0.866 -1.828 -24.842 1.00 0.00 O ATOM 1742 CB VAL A 105 1.668 1.288 -24.025 1.00 0.00 C ATOM 1743 CG1 VAL A 105 1.622 0.439 -22.764 1.00 0.00 C ATOM 1744 CG2 VAL A 105 2.899 2.181 -24.030 1.00 0.00 C ATOM 0 H VAL A 105 1.334 2.195 -26.296 1.00 0.00 H new ATOM 0 HA VAL A 105 2.630 -0.107 -25.373 1.00 0.00 H new ATOM 0 HB VAL A 105 0.780 1.920 -24.039 1.00 0.00 H new ATOM 0 HG11 VAL A 105 1.625 1.088 -21.888 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.715 -0.165 -22.765 1.00 0.00 H new ATOM 0 HG13 VAL A 105 2.493 -0.215 -22.734 1.00 0.00 H new ATOM 0 HG21 VAL A 105 2.894 2.812 -23.141 1.00 0.00 H new ATOM 0 HG22 VAL A 105 3.797 1.563 -24.032 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.889 2.809 -24.921 1.00 0.00 H new ATOM 1754 N VAL A 106 -0.667 -0.263 -25.355 1.00 0.00 N ATOM 1755 CA VAL A 106 -1.793 -1.188 -25.304 1.00 0.00 C ATOM 1756 C VAL A 106 -1.643 -2.296 -26.338 1.00 0.00 C ATOM 1757 O VAL A 106 -1.887 -3.467 -26.048 1.00 0.00 O ATOM 1758 CB VAL A 106 -3.114 -0.436 -25.550 1.00 0.00 C ATOM 1759 CG1 VAL A 106 -4.263 -1.419 -25.719 1.00 0.00 C ATOM 1760 CG2 VAL A 106 -3.387 0.521 -24.400 1.00 0.00 C ATOM 0 H VAL A 106 -0.923 0.701 -25.567 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.808 -1.637 -24.311 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.026 0.142 -26.470 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -5.189 -0.870 -25.892 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.063 -2.070 -26.570 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -4.362 -2.022 -24.816 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -4.323 1.050 -24.581 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -3.462 -0.041 -23.469 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.572 1.241 -24.325 1.00 0.00 H new ATOM 1770 N ASN A 107 -1.239 -1.919 -27.547 1.00 0.00 N ATOM 1771 CA ASN A 107 -1.014 -2.886 -28.615 1.00 0.00 C ATOM 1772 C ASN A 107 0.082 -3.875 -28.242 1.00 0.00 C ATOM 1773 O ASN A 107 -0.027 -5.070 -28.516 1.00 0.00 O ATOM 1774 CB ASN A 107 -0.674 -2.177 -29.914 1.00 0.00 C ATOM 1775 CG ASN A 107 -1.871 -1.522 -30.544 1.00 0.00 C ATOM 1776 OD1 ASN A 107 -3.018 -1.880 -30.250 1.00 0.00 O ATOM 1777 ND2 ASN A 107 -1.628 -0.568 -31.407 1.00 0.00 N ATOM 0 H ASN A 107 -1.061 -0.950 -27.811 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.937 -3.448 -28.758 1.00 0.00 H new ATOM 0 HB2 ASN A 107 0.090 -1.423 -29.723 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.246 -2.894 -30.614 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.401 -0.087 -31.867 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -0.666 -0.305 -31.619 1.00 0.00 H new ATOM 1784 N ILE A 108 1.139 -3.370 -27.614 1.00 0.00 N ATOM 1785 CA ILE A 108 2.224 -4.218 -27.137 1.00 0.00 C ATOM 1786 C ILE A 108 1.729 -5.211 -26.093 1.00 0.00 C ATOM 1787 O ILE A 108 2.058 -6.396 -26.144 1.00 0.00 O ATOM 1788 CB ILE A 108 3.362 -3.371 -26.540 1.00 0.00 C ATOM 1789 CG1 ILE A 108 4.073 -2.579 -27.641 1.00 0.00 C ATOM 1790 CG2 ILE A 108 4.350 -4.255 -25.794 1.00 0.00 C ATOM 1791 CD1 ILE A 108 4.988 -1.494 -27.120 1.00 0.00 C ATOM 0 H ILE A 108 1.267 -2.376 -27.424 1.00 0.00 H new ATOM 0 HA ILE A 108 2.604 -4.771 -27.996 1.00 0.00 H new ATOM 0 HB ILE A 108 2.931 -2.664 -25.831 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.654 -3.268 -28.253 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.324 -2.128 -28.292 1.00 0.00 H new ATOM 0 HG21 ILE A 108 5.148 -3.639 -25.379 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.835 -4.775 -24.986 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.776 -4.985 -26.482 1.00 0.00 H new ATOM 0 HD11 ILE A 108 5.455 -0.978 -27.959 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.409 -0.781 -26.532 1.00 0.00 H new ATOM 0 HD13 ILE A 108 5.760 -1.939 -26.493 1.00 0.00 H new ATOM 1803 N LEU A 109 0.935 -4.720 -25.147 1.00 0.00 N ATOM 1804 CA LEU A 109 0.376 -5.568 -24.100 1.00 0.00 C ATOM 1805 C LEU A 109 -0.482 -6.679 -24.690 1.00 0.00 C ATOM 1806 O LEU A 109 -0.492 -7.802 -24.187 1.00 0.00 O ATOM 1807 CB LEU A 109 -0.462 -4.727 -23.129 1.00 0.00 C ATOM 1808 CG LEU A 109 0.319 -3.713 -22.283 1.00 0.00 C ATOM 1809 CD1 LEU A 109 -0.658 -2.790 -21.567 1.00 0.00 C ATOM 1810 CD2 LEU A 109 1.201 -4.453 -21.289 1.00 0.00 C ATOM 0 H LEU A 109 0.664 -3.739 -25.084 1.00 0.00 H new ATOM 0 HA LEU A 109 1.206 -6.025 -23.561 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.218 -4.189 -23.702 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -0.992 -5.402 -22.457 1.00 0.00 H new ATOM 0 HG LEU A 109 0.959 -3.106 -22.924 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -0.104 -2.069 -20.966 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.263 -2.260 -22.302 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.307 -3.379 -20.920 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.756 -3.732 -20.688 1.00 0.00 H new ATOM 0 HD22 LEU A 109 0.579 -5.067 -20.637 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.901 -5.091 -21.828 1.00 0.00 H new ATOM 1822 N LYS A 110 -1.202 -6.359 -25.761 1.00 0.00 N ATOM 1823 CA LYS A 110 -2.008 -7.348 -26.466 1.00 0.00 C ATOM 1824 C LYS A 110 -1.129 -8.344 -27.212 1.00 0.00 C ATOM 1825 O LYS A 110 -1.268 -9.555 -27.045 1.00 0.00 O ATOM 1826 CB LYS A 110 -2.967 -6.662 -27.439 1.00 0.00 C ATOM 1827 CG LYS A 110 -3.871 -7.615 -28.209 1.00 0.00 C ATOM 1828 CD LYS A 110 -4.824 -6.858 -29.122 1.00 0.00 C ATOM 1829 CE LYS A 110 -5.777 -7.805 -29.837 1.00 0.00 C ATOM 1830 NZ LYS A 110 -6.720 -7.077 -30.729 1.00 0.00 N ATOM 0 H LYS A 110 -1.243 -5.421 -26.159 1.00 0.00 H new ATOM 0 HA LYS A 110 -2.589 -7.895 -25.723 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -3.589 -5.960 -26.883 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -2.385 -6.077 -28.152 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.262 -8.298 -28.801 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -4.442 -8.224 -27.508 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -5.395 -6.137 -28.537 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -4.253 -6.291 -29.857 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.203 -8.522 -30.424 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.342 -8.376 -29.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.520 -7.697 -30.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -7.073 -6.229 -30.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -6.227 -6.796 -31.600 1.00 0.00 H new ATOM 1844 N GLU A 111 -0.224 -7.826 -28.035 1.00 0.00 N ATOM 1845 CA GLU A 111 0.566 -8.663 -28.930 1.00 0.00 C ATOM 1846 C GLU A 111 1.490 -9.587 -28.147 1.00 0.00 C ATOM 1847 O GLU A 111 1.792 -10.696 -28.587 1.00 0.00 O ATOM 1848 CB GLU A 111 1.387 -7.795 -29.887 1.00 0.00 C ATOM 1849 CG GLU A 111 0.564 -7.070 -30.941 1.00 0.00 C ATOM 1850 CD GLU A 111 1.394 -6.176 -31.819 1.00 0.00 C ATOM 1851 OE1 GLU A 111 2.574 -6.073 -31.583 1.00 0.00 O ATOM 1852 OE2 GLU A 111 0.848 -5.595 -32.727 1.00 0.00 O ATOM 0 H GLU A 111 -0.019 -6.829 -28.101 1.00 0.00 H new ATOM 0 HA GLU A 111 -0.125 -9.277 -29.508 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.940 -7.058 -29.305 1.00 0.00 H new ATOM 0 HB3 GLU A 111 2.123 -8.424 -30.388 1.00 0.00 H new ATOM 0 HG2 GLU A 111 0.050 -7.804 -31.561 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -0.205 -6.475 -30.448 1.00 0.00 H new ATOM 1859 N ARG A 112 1.937 -9.122 -26.985 1.00 0.00 N ATOM 1860 CA ARG A 112 2.851 -9.895 -26.152 1.00 0.00 C ATOM 1861 C ARG A 112 2.090 -10.841 -25.232 1.00 0.00 C ATOM 1862 O ARG A 112 2.686 -11.527 -24.402 1.00 0.00 O ATOM 1863 CB ARG A 112 3.723 -8.971 -25.315 1.00 0.00 C ATOM 1864 CG ARG A 112 4.677 -8.096 -26.112 1.00 0.00 C ATOM 1865 CD ARG A 112 5.753 -8.896 -26.750 1.00 0.00 C ATOM 1866 NE ARG A 112 6.703 -8.058 -27.464 1.00 0.00 N ATOM 1867 CZ ARG A 112 7.725 -8.522 -28.208 1.00 0.00 C ATOM 1868 NH1 ARG A 112 7.916 -9.818 -28.327 1.00 0.00 N ATOM 1869 NH2 ARG A 112 8.535 -7.676 -28.819 1.00 0.00 N ATOM 0 H ARG A 112 1.681 -8.213 -26.599 1.00 0.00 H new ATOM 0 HA ARG A 112 3.482 -10.484 -26.817 1.00 0.00 H new ATOM 0 HB2 ARG A 112 3.077 -8.328 -24.717 1.00 0.00 H new ATOM 0 HB3 ARG A 112 4.304 -9.576 -24.618 1.00 0.00 H new ATOM 0 HG2 ARG A 112 4.121 -7.556 -26.879 1.00 0.00 H new ATOM 0 HG3 ARG A 112 5.121 -7.348 -25.454 1.00 0.00 H new ATOM 0 HD2 ARG A 112 6.278 -9.471 -25.987 1.00 0.00 H new ATOM 0 HD3 ARG A 112 5.310 -9.613 -27.442 1.00 0.00 H new ATOM 0 HE ARG A 112 6.587 -7.047 -27.396 1.00 0.00 H new ATOM 0 HH11 ARG A 112 7.290 -10.471 -27.856 1.00 0.00 H new ATOM 0 HH12 ARG A 112 8.690 -10.170 -28.890 1.00 0.00 H new ATOM 0 HH21 ARG A 112 8.386 -6.671 -28.727 1.00 0.00 H new ATOM 0 HH22 ARG A 112 9.309 -8.028 -29.382 1.00 0.00 H new ATOM 1883 N ASN A 113 0.771 -10.874 -25.385 1.00 0.00 N ATOM 1884 CA ASN A 113 -0.069 -11.776 -24.605 1.00 0.00 C ATOM 1885 C ASN A 113 0.150 -11.577 -23.111 1.00 0.00 C ATOM 1886 O ASN A 113 0.317 -12.541 -22.364 1.00 0.00 O ATOM 1887 CB ASN A 113 0.191 -13.219 -24.995 1.00 0.00 C ATOM 1888 CG ASN A 113 -0.176 -13.506 -26.425 1.00 0.00 C ATOM 1889 OD1 ASN A 113 -1.215 -13.050 -26.915 1.00 0.00 O ATOM 1890 ND2 ASN A 113 0.657 -14.254 -27.103 1.00 0.00 N ATOM 0 H ASN A 113 0.260 -10.286 -26.043 1.00 0.00 H new ATOM 0 HA ASN A 113 -1.110 -11.540 -24.826 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.245 -13.449 -24.841 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -0.378 -13.877 -24.338 1.00 0.00 H new ATOM 0 HD21 ASN A 113 0.460 -14.482 -28.077 1.00 0.00 H new ATOM 0 HD22 ASN A 113 1.503 -14.608 -26.657 1.00 0.00 H new ATOM 1897 N ILE A 114 0.147 -10.320 -22.680 1.00 0.00 N ATOM 1898 CA ILE A 114 0.389 -9.989 -21.280 1.00 0.00 C ATOM 1899 C ILE A 114 -0.829 -10.304 -20.422 1.00 0.00 C ATOM 1900 O ILE A 114 -0.698 -10.734 -19.276 1.00 0.00 O ATOM 1901 CB ILE A 114 0.759 -8.503 -21.123 1.00 0.00 C ATOM 1902 CG1 ILE A 114 2.029 -8.182 -21.914 1.00 0.00 C ATOM 1903 CG2 ILE A 114 0.940 -8.153 -19.654 1.00 0.00 C ATOM 1904 CD1 ILE A 114 3.227 -9.011 -21.508 1.00 0.00 C ATOM 0 H ILE A 114 -0.021 -9.513 -23.281 1.00 0.00 H new ATOM 0 HA ILE A 114 1.225 -10.601 -20.941 1.00 0.00 H new ATOM 0 HB ILE A 114 -0.056 -7.899 -21.522 1.00 0.00 H new ATOM 0 HG12 ILE A 114 1.834 -8.338 -22.975 1.00 0.00 H new ATOM 0 HG13 ILE A 114 2.269 -7.127 -21.785 1.00 0.00 H new ATOM 0 HG21 ILE A 114 1.201 -7.099 -19.561 1.00 0.00 H new ATOM 0 HG22 ILE A 114 0.011 -8.346 -19.117 1.00 0.00 H new ATOM 0 HG23 ILE A 114 1.737 -8.763 -19.230 1.00 0.00 H new ATOM 0 HD11 ILE A 114 4.088 -8.726 -22.113 1.00 0.00 H new ATOM 0 HD12 ILE A 114 3.450 -8.838 -20.455 1.00 0.00 H new ATOM 0 HD13 ILE A 114 3.008 -10.067 -21.663 1.00 0.00 H new ATOM 1916 N PHE A 115 -2.014 -10.088 -20.983 1.00 0.00 N ATOM 1917 CA PHE A 115 -3.258 -10.291 -20.249 1.00 0.00 C ATOM 1918 C PHE A 115 -4.177 -11.260 -20.980 1.00 0.00 C ATOM 1919 O PHE A 115 -3.901 -11.659 -22.112 1.00 0.00 O ATOM 1920 CB PHE A 115 -3.978 -8.957 -20.039 1.00 0.00 C ATOM 1921 CG PHE A 115 -3.141 -7.918 -19.349 1.00 0.00 C ATOM 1922 CD1 PHE A 115 -2.578 -6.873 -20.066 1.00 0.00 C ATOM 1923 CD2 PHE A 115 -2.913 -7.984 -17.983 1.00 0.00 C ATOM 1924 CE1 PHE A 115 -1.807 -5.916 -19.432 1.00 0.00 C ATOM 1925 CE2 PHE A 115 -2.145 -7.029 -17.347 1.00 0.00 C ATOM 1926 CZ PHE A 115 -1.591 -5.994 -18.073 1.00 0.00 C ATOM 0 H PHE A 115 -2.139 -9.772 -21.945 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.005 -10.720 -19.280 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.296 -8.570 -21.007 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -4.881 -9.130 -19.453 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.743 -6.806 -21.131 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.341 -8.792 -17.409 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.374 -5.107 -20.002 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.978 -7.092 -16.282 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.989 -5.247 -17.577 1.00 0.00 H new ATOM 1936 N SER A 116 -5.271 -11.637 -20.328 1.00 0.00 N ATOM 1937 CA SER A 116 -6.278 -12.489 -20.948 1.00 0.00 C ATOM 1938 C SER A 116 -7.037 -11.742 -22.037 1.00 0.00 C ATOM 1939 O SER A 116 -6.992 -10.514 -22.108 1.00 0.00 O ATOM 1940 CB SER A 116 -7.250 -12.997 -19.900 1.00 0.00 C ATOM 1941 OG SER A 116 -8.062 -11.959 -19.424 1.00 0.00 O ATOM 0 H SER A 116 -5.483 -11.365 -19.368 1.00 0.00 H new ATOM 0 HA SER A 116 -5.766 -13.335 -21.407 1.00 0.00 H new ATOM 0 HB2 SER A 116 -7.872 -13.784 -20.327 1.00 0.00 H new ATOM 0 HB3 SER A 116 -6.698 -13.441 -19.072 1.00 0.00 H new ATOM 0 HG SER A 116 -8.681 -12.311 -18.751 1.00 0.00 H new ATOM 1947 N LYS A 117 -7.733 -12.491 -22.886 1.00 0.00 N ATOM 1948 CA LYS A 117 -8.492 -11.901 -23.982 1.00 0.00 C ATOM 1949 C LYS A 117 -9.590 -10.983 -23.461 1.00 0.00 C ATOM 1950 O LYS A 117 -9.916 -9.973 -24.084 1.00 0.00 O ATOM 1951 CB LYS A 117 -9.097 -12.995 -24.864 1.00 0.00 C ATOM 1952 CG LYS A 117 -8.079 -13.769 -25.692 1.00 0.00 C ATOM 1953 CD LYS A 117 -8.753 -14.847 -26.528 1.00 0.00 C ATOM 1954 CE LYS A 117 -7.737 -15.626 -27.351 1.00 0.00 C ATOM 1955 NZ LYS A 117 -8.377 -16.709 -28.145 1.00 0.00 N ATOM 0 H LYS A 117 -7.787 -13.508 -22.836 1.00 0.00 H new ATOM 0 HA LYS A 117 -7.804 -11.304 -24.580 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.641 -13.696 -24.231 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.825 -12.542 -25.537 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.541 -13.082 -26.345 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.341 -14.225 -25.032 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -9.295 -15.530 -25.875 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.487 -14.390 -27.191 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -7.215 -14.944 -28.022 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -6.987 -16.057 -26.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -7.651 -17.215 -28.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -8.854 -17.374 -27.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -9.075 -16.296 -28.797 1.00 0.00 H new ATOM 1969 N GLN A 118 -10.157 -11.339 -22.313 1.00 0.00 N ATOM 1970 CA GLN A 118 -11.224 -10.551 -21.708 1.00 0.00 C ATOM 1971 C GLN A 118 -10.719 -9.179 -21.278 1.00 0.00 C ATOM 1972 O GLN A 118 -11.378 -8.165 -21.505 1.00 0.00 O ATOM 1973 CB GLN A 118 -11.820 -11.288 -20.506 1.00 0.00 C ATOM 1974 CG GLN A 118 -13.021 -10.596 -19.885 1.00 0.00 C ATOM 1975 CD GLN A 118 -14.219 -10.569 -20.815 1.00 0.00 C ATOM 1976 OE1 GLN A 118 -14.663 -11.610 -21.309 1.00 0.00 O ATOM 1977 NE2 GLN A 118 -14.750 -9.377 -21.060 1.00 0.00 N ATOM 0 H GLN A 118 -9.895 -12.170 -21.782 1.00 0.00 H new ATOM 0 HA GLN A 118 -12.001 -10.411 -22.460 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -12.113 -12.291 -20.818 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -11.048 -11.404 -19.745 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -13.293 -11.107 -18.961 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -12.750 -9.575 -19.617 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -14.351 -8.543 -20.630 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -15.557 -9.296 -21.678 1.00 0.00 H new ATOM 1986 N VAL A 119 -9.545 -9.155 -20.656 1.00 0.00 N ATOM 1987 CA VAL A 119 -8.927 -7.903 -20.235 1.00 0.00 C ATOM 1988 C VAL A 119 -8.642 -7.001 -21.428 1.00 0.00 C ATOM 1989 O VAL A 119 -8.920 -5.802 -21.392 1.00 0.00 O ATOM 1990 CB VAL A 119 -7.613 -8.183 -19.481 1.00 0.00 C ATOM 1991 CG1 VAL A 119 -6.853 -6.888 -19.237 1.00 0.00 C ATOM 1992 CG2 VAL A 119 -7.911 -8.890 -18.167 1.00 0.00 C ATOM 0 H VAL A 119 -9.002 -9.989 -20.432 1.00 0.00 H new ATOM 0 HA VAL A 119 -9.627 -7.394 -19.573 1.00 0.00 H new ATOM 0 HB VAL A 119 -6.986 -8.832 -20.092 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.927 -7.104 -18.703 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.620 -6.418 -20.192 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -7.467 -6.213 -18.640 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -6.978 -9.085 -17.639 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -8.551 -8.258 -17.551 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -8.418 -9.834 -18.368 1.00 0.00 H new ATOM 2002 N VAL A 120 -8.085 -7.583 -22.485 1.00 0.00 N ATOM 2003 CA VAL A 120 -7.793 -6.839 -23.704 1.00 0.00 C ATOM 2004 C VAL A 120 -9.065 -6.278 -24.326 1.00 0.00 C ATOM 2005 O VAL A 120 -9.110 -5.115 -24.728 1.00 0.00 O ATOM 2006 CB VAL A 120 -7.082 -7.746 -24.726 1.00 0.00 C ATOM 2007 CG1 VAL A 120 -6.976 -7.049 -26.074 1.00 0.00 C ATOM 2008 CG2 VAL A 120 -5.705 -8.131 -24.208 1.00 0.00 C ATOM 0 H VAL A 120 -7.827 -8.569 -22.521 1.00 0.00 H new ATOM 0 HA VAL A 120 -7.140 -6.008 -23.436 1.00 0.00 H new ATOM 0 HB VAL A 120 -7.670 -8.654 -24.861 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -6.471 -7.704 -26.784 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -7.975 -6.816 -26.443 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -6.406 -6.127 -25.963 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -5.209 -8.772 -24.936 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.110 -7.231 -24.052 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -5.808 -8.666 -23.264 1.00 0.00 H new ATOM 2018 N ASN A 121 -10.098 -7.111 -24.401 1.00 0.00 N ATOM 2019 CA ASN A 121 -11.369 -6.704 -24.988 1.00 0.00 C ATOM 2020 C ASN A 121 -12.003 -5.568 -24.195 1.00 0.00 C ATOM 2021 O ASN A 121 -12.564 -4.635 -24.769 1.00 0.00 O ATOM 2022 CB ASN A 121 -12.317 -7.885 -25.081 1.00 0.00 C ATOM 2023 CG ASN A 121 -11.934 -8.849 -26.170 1.00 0.00 C ATOM 2024 OD1 ASN A 121 -11.192 -8.497 -27.094 1.00 0.00 O ATOM 2025 ND2 ASN A 121 -12.426 -10.058 -26.079 1.00 0.00 N ATOM 0 H ASN A 121 -10.079 -8.073 -24.062 1.00 0.00 H new ATOM 0 HA ASN A 121 -11.171 -6.339 -25.996 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -12.333 -8.409 -24.126 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -13.328 -7.521 -25.262 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -12.201 -10.755 -26.789 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -13.035 -10.304 -25.298 1.00 0.00 H new ATOM 2032 N ASP A 122 -11.911 -5.654 -22.873 1.00 0.00 N ATOM 2033 CA ASP A 122 -12.424 -4.605 -22.000 1.00 0.00 C ATOM 2034 C ASP A 122 -11.714 -3.281 -22.252 1.00 0.00 C ATOM 2035 O ASP A 122 -12.345 -2.226 -22.303 1.00 0.00 O ATOM 2036 CB ASP A 122 -12.265 -5.004 -20.530 1.00 0.00 C ATOM 2037 CG ASP A 122 -13.217 -6.117 -20.112 1.00 0.00 C ATOM 2038 OD1 ASP A 122 -14.169 -6.353 -20.817 1.00 0.00 O ATOM 2039 OD2 ASP A 122 -12.982 -6.719 -19.092 1.00 0.00 O ATOM 0 H ASP A 122 -11.485 -6.440 -22.382 1.00 0.00 H new ATOM 0 HA ASP A 122 -13.483 -4.478 -22.225 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -11.238 -5.326 -20.355 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -12.437 -4.131 -19.901 1.00 0.00 H new ATOM 2044 N ILE A 123 -10.396 -3.344 -22.411 1.00 0.00 N ATOM 2045 CA ILE A 123 -9.600 -2.155 -22.690 1.00 0.00 C ATOM 2046 C ILE A 123 -9.975 -1.544 -24.034 1.00 0.00 C ATOM 2047 O ILE A 123 -10.201 -0.339 -24.138 1.00 0.00 O ATOM 2048 CB ILE A 123 -8.096 -2.484 -22.677 1.00 0.00 C ATOM 2049 CG1 ILE A 123 -7.641 -2.842 -21.260 1.00 0.00 C ATOM 2050 CG2 ILE A 123 -7.291 -1.314 -23.219 1.00 0.00 C ATOM 2051 CD1 ILE A 123 -6.264 -3.464 -21.199 1.00 0.00 C ATOM 0 H ILE A 123 -9.856 -4.207 -22.351 1.00 0.00 H new ATOM 0 HA ILE A 123 -9.813 -1.431 -21.903 1.00 0.00 H new ATOM 0 HB ILE A 123 -7.923 -3.346 -23.322 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.650 -1.941 -20.647 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -8.361 -3.533 -20.821 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.230 -1.564 -23.203 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.599 -1.104 -24.243 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.466 -0.434 -22.600 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.012 -3.690 -20.163 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.254 -4.384 -21.783 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.532 -2.767 -21.607 1.00 0.00 H new ATOM 2063 N GLU A 124 -10.040 -2.384 -25.062 1.00 0.00 N ATOM 2064 CA GLU A 124 -10.337 -1.921 -26.412 1.00 0.00 C ATOM 2065 C GLU A 124 -11.721 -1.289 -26.485 1.00 0.00 C ATOM 2066 O GLU A 124 -11.917 -0.275 -27.155 1.00 0.00 O ATOM 2067 CB GLU A 124 -10.241 -3.080 -27.407 1.00 0.00 C ATOM 2068 CG GLU A 124 -8.824 -3.567 -27.670 1.00 0.00 C ATOM 2069 CD GLU A 124 -8.770 -4.716 -28.638 1.00 0.00 C ATOM 2070 OE1 GLU A 124 -9.803 -5.264 -28.937 1.00 0.00 O ATOM 2071 OE2 GLU A 124 -7.694 -5.045 -29.079 1.00 0.00 O ATOM 0 H GLU A 124 -9.891 -3.390 -24.985 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.599 -1.163 -26.674 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.835 -3.914 -27.033 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.687 -2.769 -28.352 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -8.228 -2.742 -28.060 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -8.369 -3.871 -26.727 1.00 0.00 H new ATOM 2078 N ARG A 125 -12.680 -1.895 -25.792 1.00 0.00 N ATOM 2079 CA ARG A 125 -14.044 -1.380 -25.760 1.00 0.00 C ATOM 2080 C ARG A 125 -14.092 0.012 -25.143 1.00 0.00 C ATOM 2081 O ARG A 125 -14.743 0.914 -25.671 1.00 0.00 O ATOM 2082 CB ARG A 125 -14.949 -2.313 -24.970 1.00 0.00 C ATOM 2083 CG ARG A 125 -16.420 -1.926 -24.967 1.00 0.00 C ATOM 2084 CD ARG A 125 -17.258 -2.960 -24.308 1.00 0.00 C ATOM 2085 NE ARG A 125 -16.967 -3.070 -22.888 1.00 0.00 N ATOM 2086 CZ ARG A 125 -16.279 -4.082 -22.324 1.00 0.00 C ATOM 2087 NH1 ARG A 125 -15.820 -5.061 -23.072 1.00 0.00 N ATOM 2088 NH2 ARG A 125 -16.066 -4.091 -21.020 1.00 0.00 N ATOM 0 H ARG A 125 -12.537 -2.744 -25.245 1.00 0.00 H new ATOM 0 HA ARG A 125 -14.396 -1.320 -26.790 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -14.854 -3.319 -25.378 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -14.596 -2.352 -23.939 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -16.545 -0.974 -24.452 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -16.760 -1.781 -25.992 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -18.311 -2.715 -24.445 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -17.090 -3.924 -24.789 1.00 0.00 H new ATOM 0 HE ARG A 125 -17.308 -2.329 -22.275 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -15.985 -5.054 -24.079 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -15.299 -5.827 -22.646 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -16.422 -3.332 -20.440 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -15.545 -4.857 -20.594 1.00 0.00 H new ATOM 2102 N SER A 126 -13.400 0.181 -24.021 1.00 0.00 N ATOM 2103 CA SER A 126 -13.337 1.472 -23.347 1.00 0.00 C ATOM 2104 C SER A 126 -12.665 2.520 -24.225 1.00 0.00 C ATOM 2105 O SER A 126 -13.138 3.651 -24.330 1.00 0.00 O ATOM 2106 CB SER A 126 -12.585 1.341 -22.036 1.00 0.00 C ATOM 2107 OG SER A 126 -12.508 2.574 -21.376 1.00 0.00 O ATOM 0 H SER A 126 -12.874 -0.561 -23.559 1.00 0.00 H new ATOM 0 HA SER A 126 -14.358 1.797 -23.148 1.00 0.00 H new ATOM 0 HB2 SER A 126 -13.085 0.613 -21.397 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.581 0.962 -22.225 1.00 0.00 H new ATOM 0 HG SER A 126 -11.808 2.535 -20.691 1.00 0.00 H new ATOM 2113 N LEU A 127 -11.560 2.136 -24.855 1.00 0.00 N ATOM 2114 CA LEU A 127 -10.828 3.037 -25.736 1.00 0.00 C ATOM 2115 C LEU A 127 -11.688 3.474 -26.915 1.00 0.00 C ATOM 2116 O LEU A 127 -11.656 4.635 -27.323 1.00 0.00 O ATOM 2117 CB LEU A 127 -9.553 2.357 -26.251 1.00 0.00 C ATOM 2118 CG LEU A 127 -8.448 2.141 -25.209 1.00 0.00 C ATOM 2119 CD1 LEU A 127 -7.339 1.290 -25.813 1.00 0.00 C ATOM 2120 CD2 LEU A 127 -7.913 3.489 -24.749 1.00 0.00 C ATOM 0 H LEU A 127 -11.152 1.205 -24.771 1.00 0.00 H new ATOM 0 HA LEU A 127 -10.559 3.922 -25.159 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -9.824 1.389 -26.672 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -9.147 2.957 -27.066 1.00 0.00 H new ATOM 0 HG LEU A 127 -8.851 1.617 -24.342 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -6.554 1.137 -25.073 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -7.745 0.325 -26.117 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -6.923 1.798 -26.683 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -7.128 3.335 -24.009 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.505 4.029 -25.603 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -8.722 4.069 -24.305 1.00 0.00 H new ATOM 2132 N ALA A 128 -12.458 2.538 -27.459 1.00 0.00 N ATOM 2133 CA ALA A 128 -13.392 2.843 -28.535 1.00 0.00 C ATOM 2134 C ALA A 128 -14.447 3.844 -28.082 1.00 0.00 C ATOM 2135 O ALA A 128 -14.769 4.790 -28.801 1.00 0.00 O ATOM 2136 CB ALA A 128 -14.054 1.570 -29.040 1.00 0.00 C ATOM 0 H ALA A 128 -12.453 1.559 -27.171 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.828 3.294 -29.351 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -14.749 1.815 -29.843 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.291 0.888 -29.415 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -14.597 1.094 -28.224 1.00 0.00 H new ATOM 2142 N ALA A 129 -14.982 3.630 -26.884 1.00 0.00 N ATOM 2143 CA ALA A 129 -15.960 4.545 -26.308 1.00 0.00 C ATOM 2144 C ALA A 129 -15.358 5.927 -26.087 1.00 0.00 C ATOM 2145 O ALA A 129 -16.025 6.943 -26.281 1.00 0.00 O ATOM 2146 CB ALA A 129 -16.499 3.987 -24.998 1.00 0.00 C ATOM 0 H ALA A 129 -14.754 2.830 -26.293 1.00 0.00 H new ATOM 0 HA ALA A 129 -16.784 4.646 -27.014 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -17.228 4.681 -24.580 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -16.977 3.025 -25.182 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -15.678 3.855 -24.293 1.00 0.00 H new ATOM 2152 N ALA A 130 -14.094 5.958 -25.679 1.00 0.00 N ATOM 2153 CA ALA A 130 -13.381 7.215 -25.490 1.00 0.00 C ATOM 2154 C ALA A 130 -13.235 7.969 -26.805 1.00 0.00 C ATOM 2155 O ALA A 130 -13.285 9.199 -26.836 1.00 0.00 O ATOM 2156 CB ALA A 130 -12.014 6.961 -24.871 1.00 0.00 C ATOM 0 H ALA A 130 -13.542 5.126 -25.473 1.00 0.00 H new ATOM 0 HA ALA A 130 -13.966 7.834 -24.810 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -11.494 7.909 -24.736 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -12.137 6.474 -23.904 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -11.430 6.317 -25.529 1.00 0.00 H new ATOM 2162 N LEU A 131 -13.054 7.225 -27.891 1.00 0.00 N ATOM 2163 CA LEU A 131 -12.975 7.817 -29.221 1.00 0.00 C ATOM 2164 C LEU A 131 -14.340 8.306 -29.688 1.00 0.00 C ATOM 2165 O LEU A 131 -14.444 9.327 -30.368 1.00 0.00 O ATOM 2166 CB LEU A 131 -12.420 6.796 -30.223 1.00 0.00 C ATOM 2167 CG LEU A 131 -10.951 6.402 -30.027 1.00 0.00 C ATOM 2168 CD1 LEU A 131 -10.603 5.255 -30.965 1.00 0.00 C ATOM 2169 CD2 LEU A 131 -10.062 7.610 -30.286 1.00 0.00 C ATOM 0 H LEU A 131 -12.959 6.210 -27.876 1.00 0.00 H new ATOM 0 HA LEU A 131 -12.303 8.674 -29.167 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -13.029 5.894 -30.169 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -12.537 7.200 -31.228 1.00 0.00 H new ATOM 0 HG LEU A 131 -10.788 6.069 -29.002 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -9.559 4.975 -30.826 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -11.241 4.399 -30.745 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -10.760 5.569 -31.997 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -9.018 7.330 -30.147 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -10.211 7.959 -31.308 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -10.320 8.408 -29.589 1.00 0.00 H new ATOM 2181 N GLU A 132 -15.384 7.572 -29.319 1.00 0.00 N ATOM 2182 CA GLU A 132 -16.745 7.930 -29.701 1.00 0.00 C ATOM 2183 C GLU A 132 -17.214 9.178 -28.965 1.00 0.00 C ATOM 2184 O GLU A 132 -17.799 10.080 -29.564 1.00 0.00 O ATOM 2185 CB GLU A 132 -17.701 6.769 -29.417 1.00 0.00 C ATOM 2186 CG GLU A 132 -17.532 5.574 -30.344 1.00 0.00 C ATOM 2187 CD GLU A 132 -18.379 4.398 -29.944 1.00 0.00 C ATOM 2188 OE1 GLU A 132 -18.893 4.405 -28.851 1.00 0.00 O ATOM 2189 OE2 GLU A 132 -18.513 3.492 -30.732 1.00 0.00 O ATOM 0 H GLU A 132 -15.314 6.725 -28.755 1.00 0.00 H new ATOM 0 HA GLU A 132 -16.746 8.142 -30.770 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -17.556 6.439 -28.388 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -18.726 7.131 -29.494 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -17.788 5.871 -31.361 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -16.484 5.274 -30.354 1.00 0.00 H new ATOM 2196 N HIS A 133 -16.953 9.224 -27.663 1.00 0.00 N ATOM 2197 CA HIS A 133 -17.386 10.342 -26.834 1.00 0.00 C ATOM 2198 C HIS A 133 -16.270 10.806 -25.907 1.00 0.00 C ATOM 2199 O HIS A 133 -15.400 11.518 -26.326 1.00 0.00 O ATOM 2200 CB HIS A 133 -18.617 9.957 -26.007 1.00 0.00 C ATOM 2201 CG HIS A 133 -19.801 9.565 -26.836 1.00 0.00 C ATOM 2202 ND1 HIS A 133 -20.624 10.492 -27.442 1.00 0.00 N ATOM 2203 CD2 HIS A 133 -20.300 8.349 -27.160 1.00 0.00 C ATOM 2204 CE1 HIS A 133 -21.579 9.861 -28.103 1.00 0.00 C ATOM 2205 NE2 HIS A 133 -21.404 8.561 -27.948 1.00 0.00 N ATOM 0 H HIS A 133 -16.443 8.499 -27.159 1.00 0.00 H new ATOM 0 HA HIS A 133 -17.647 11.164 -27.501 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -18.356 9.129 -25.348 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -18.893 10.797 -25.370 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -19.904 7.392 -26.856 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -22.368 10.329 -28.673 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -21.994 7.832 -28.349 1.00 0.00 H new TER 2213 HIS A 133