USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1309 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 82 GLN : amide:sc= -1.34! K(o=-3.5!,f=-4) USER MOD Set 1.2: A 109 ASN : amide:sc= -1.07 K(o=-3.5,f=-4.1!) USER MOD Set 1.3: A 114 ASN : amide:sc= -1.06 K(o=-3.5,f=-2.9) USER MOD Set 2.1: A 61 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 33 HIS : no HE2:sc= -6.04! C(o=-7.1!,f=-11!) USER MOD Set 3.2: A 70 THR OG1 : rot 45:sc= -1.06! USER MOD Single : A 11 MET CE :methyl -157:sc= -0.212 (180deg=-0.921) USER MOD Single : A 13 SER OG : rot -46:sc= 0.0133 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -2.56! X(o=-2.6!,f=-2.3) USER MOD Single : A 26 LYS NZ :NH3+ -172:sc= 1.96 (180deg=1.84) USER MOD Single : A 28 TYR OH : rot 152:sc= -0.189 USER MOD Single : A 29 ASN : amide:sc= -1.01 K(o=-1,f=-0.5) USER MOD Single : A 32 GLN : amide:sc= -1.01 X(o=-1,f=-1.1) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 143:sc= 0.229 USER MOD Single : A 41 TYR OH : rot 110:sc= -1.14 USER MOD Single : A 42 ASN : amide:sc= -16.9! C(o=-17!,f=-24!) USER MOD Single : A 45 SER OG : rot 180:sc= -0.366 USER MOD Single : A 46 LYS NZ :NH3+ -139:sc= 1.17 (180deg=-0.604!) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot -142:sc= 0.757 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 78:sc= 1.22 USER MOD Single : A 56 THR OG1 : rot 94:sc=-0.00205 USER MOD Single : A 58 THR OG1 : rot 93:sc= 0.327 USER MOD Single : A 59 THR OG1 : rot 97:sc= 1.21 USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot -173:sc= 1.32 USER MOD Single : A 66 SER OG : rot 180:sc= 0.00768 USER MOD Single : A 67 GLN : amide:sc= -1.88! K(o=-1.9!,f=-0.045) USER MOD Single : A 76 SER OG : rot 145:sc= 0.824 USER MOD Single : A 77 ASN : amide:sc= -4.99! C(o=-5!,f=-5.6!) USER MOD Single : A 78 GLN : amide:sc= -2.28 K(o=-2.3,f=-0.33) USER MOD Single : A 86 ASN : amide:sc= -1.96 K(o=-2,f=-6.1!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 CYS SG : rot -60:sc= -4.21! USER MOD Single : A 96 THR OG1 : rot -92:sc= 0.0588 USER MOD Single : A 97 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0279) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 MET CE :methyl -150:sc= -5.01! (180deg=-7.29!) USER MOD Single : A 107 LYS NZ :NH3+ 177:sc= 1.03 (180deg=0.979) USER MOD Single : A 111 ASN : amide:sc= -10.3! C(o=-10!,f=-6!) USER MOD Single : A 116 HIS : no HD1:sc= -5.78! C(o=-5.8!,f=-12!) USER MOD Single : A 119 TYR OH : rot 62:sc= -6.18! USER MOD Single : A 121 TYR OH : rot 38:sc= 0.192 USER MOD Single : A 122 MET CE :methyl -115:sc= -7.27! (180deg=-12.1!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 171:sc=-0.00861 (180deg=-0.122) USER MOD Single : A 125 THR OG1 : rot 86:sc= 1.28 USER MOD Single : A 126 LYS NZ :NH3+ -165:sc=-0.00459 (180deg=-0.128) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0688 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0493) USER MOD Single : A 138 ASN : amide:sc= -0.0905 K(o=-0.091,f=-7.5!) USER MOD Single : A 140 THR OG1 : rot 72:sc= -2.93! USER MOD Single : A 141 SER OG : rot -117:sc= 2.1 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= -0.157 USER MOD Single : A 161 LYS NZ :NH3+ 161:sc= 0.144 (180deg=0.0651) USER MOD Single : A 166 LYS NZ :NH3+ 147:sc= 1.19 (180deg=0.913) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -9.614 17.591 -6.083 1.00 5.22 N ATOM 2 CA GLY A 10 -8.509 18.573 -6.170 1.00 4.42 C ATOM 3 C GLY A 10 -8.095 19.102 -4.812 1.00 3.29 C ATOM 4 O GLY A 10 -7.889 20.306 -4.654 1.00 3.60 O ATOM 0 HA2 GLY A 10 -7.650 18.107 -6.652 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -8.816 19.406 -6.803 1.00 4.42 H new ATOM 10 N MET A 11 -7.974 18.210 -3.829 1.00 2.49 N ATOM 11 CA MET A 11 -7.561 18.600 -2.481 1.00 1.84 C ATOM 12 C MET A 11 -7.297 17.375 -1.608 1.00 1.40 C ATOM 13 O MET A 11 -6.469 17.416 -0.699 1.00 2.20 O ATOM 14 CB MET A 11 -8.609 19.499 -1.811 1.00 2.43 C ATOM 15 CG MET A 11 -9.940 18.812 -1.549 1.00 3.11 C ATOM 16 SD MET A 11 -11.121 19.882 -0.705 1.00 4.02 S ATOM 17 CE MET A 11 -10.224 20.254 0.800 1.00 4.85 C ATOM 0 H MET A 11 -8.156 17.213 -3.941 1.00 2.49 H new ATOM 0 HA MET A 11 -6.634 19.165 -2.582 1.00 1.84 H new ATOM 0 HB2 MET A 11 -8.208 19.863 -0.865 1.00 2.43 H new ATOM 0 HB3 MET A 11 -8.780 20.371 -2.442 1.00 2.43 H new ATOM 0 HG2 MET A 11 -10.367 18.483 -2.496 1.00 3.11 H new ATOM 0 HG3 MET A 11 -9.771 17.919 -0.948 1.00 3.11 H new ATOM 0 HE1 MET A 11 -10.928 20.542 1.581 1.00 4.85 H new ATOM 0 HE2 MET A 11 -9.668 19.372 1.120 1.00 4.85 H new ATOM 0 HE3 MET A 11 -9.530 21.074 0.616 1.00 4.85 H new ATOM 27 N GLY A 12 -7.999 16.285 -1.891 1.00 0.92 N ATOM 28 CA GLY A 12 -7.806 15.069 -1.131 1.00 0.85 C ATOM 29 C GLY A 12 -8.982 14.740 -0.232 1.00 0.79 C ATOM 30 O GLY A 12 -8.916 14.921 0.981 1.00 1.55 O ATOM 0 H GLY A 12 -8.697 16.223 -2.632 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -7.638 14.240 -1.819 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -6.907 15.166 -0.523 1.00 0.85 H new ATOM 34 N SER A 13 -10.061 14.261 -0.825 1.00 0.52 N ATOM 35 CA SER A 13 -11.204 13.782 -0.062 1.00 0.53 C ATOM 36 C SER A 13 -11.297 12.265 -0.215 1.00 0.41 C ATOM 37 O SER A 13 -12.209 11.614 0.300 1.00 0.53 O ATOM 38 CB SER A 13 -12.484 14.461 -0.554 1.00 0.79 C ATOM 39 OG SER A 13 -13.521 14.378 0.408 1.00 1.58 O ATOM 0 H SER A 13 -10.171 14.193 -1.837 1.00 0.52 H new ATOM 0 HA SER A 13 -11.079 14.028 0.993 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.278 15.508 -0.779 1.00 0.79 H new ATOM 0 HB3 SER A 13 -12.810 13.994 -1.483 1.00 0.79 H new ATOM 0 HG SER A 13 -13.570 13.464 0.758 1.00 1.58 H new ATOM 45 N SER A 14 -10.305 11.731 -0.916 1.00 0.32 N ATOM 46 CA SER A 14 -10.185 10.340 -1.240 1.00 0.22 C ATOM 47 C SER A 14 -8.913 10.238 -2.031 1.00 0.21 C ATOM 48 O SER A 14 -8.470 11.209 -2.653 1.00 0.35 O ATOM 49 CB SER A 14 -11.375 9.832 -2.050 1.00 0.25 C ATOM 50 OG SER A 14 -11.429 10.436 -3.332 1.00 1.17 O ATOM 0 H SER A 14 -9.536 12.291 -1.284 1.00 0.32 H new ATOM 0 HA SER A 14 -10.168 9.724 -0.341 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.306 8.750 -2.160 1.00 0.25 H new ATOM 0 HB3 SER A 14 -12.299 10.040 -1.510 1.00 0.25 H new ATOM 0 HG SER A 14 -12.201 10.088 -3.825 1.00 1.17 H new ATOM 56 N ILE A 15 -8.311 9.094 -1.968 1.00 0.18 N ATOM 57 CA ILE A 15 -7.000 8.886 -2.514 1.00 0.18 C ATOM 58 C ILE A 15 -6.991 8.991 -4.045 1.00 0.17 C ATOM 59 O ILE A 15 -5.934 9.114 -4.652 1.00 0.19 O ATOM 60 CB ILE A 15 -6.492 7.523 -2.060 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.468 6.439 -2.508 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.329 7.512 -0.555 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.815 5.125 -2.862 1.00 0.38 C ATOM 0 H ILE A 15 -8.717 8.266 -1.532 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.339 9.671 -2.146 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.520 7.324 -2.512 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.194 6.268 -1.713 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -8.023 6.801 -3.374 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.966 6.535 -0.236 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.613 8.280 -0.261 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.291 7.713 -0.083 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.579 4.410 -3.170 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.110 5.277 -3.679 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.284 4.737 -1.993 1.00 0.38 H new ATOM 75 N PHE A 16 -8.178 8.990 -4.655 1.00 0.18 N ATOM 76 CA PHE A 16 -8.313 9.114 -6.110 1.00 0.19 C ATOM 77 C PHE A 16 -8.093 10.551 -6.562 1.00 0.21 C ATOM 78 O PHE A 16 -8.324 10.894 -7.722 1.00 0.30 O ATOM 79 CB PHE A 16 -9.692 8.667 -6.553 1.00 0.20 C ATOM 80 CG PHE A 16 -9.991 7.257 -6.190 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.237 6.222 -6.697 1.00 0.22 C ATOM 82 CD2 PHE A 16 -11.028 6.971 -5.333 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.509 4.923 -6.341 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.311 5.671 -4.980 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.544 4.628 -5.552 1.00 0.19 C ATOM 0 H PHE A 16 -9.066 8.904 -4.161 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.554 8.477 -6.564 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.441 9.319 -6.103 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.776 8.784 -7.633 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.427 6.433 -7.379 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.627 7.775 -4.932 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.875 4.128 -6.706 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.103 5.451 -4.280 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.795 3.597 -5.351 1.00 0.19 H new ATOM 95 N ASP A 17 -7.686 11.394 -5.629 1.00 0.21 N ATOM 96 CA ASP A 17 -7.323 12.764 -5.936 1.00 0.26 C ATOM 97 C ASP A 17 -5.903 12.746 -6.453 1.00 0.25 C ATOM 98 O ASP A 17 -5.488 13.590 -7.248 1.00 0.32 O ATOM 99 CB ASP A 17 -7.407 13.630 -4.677 1.00 0.32 C ATOM 100 CG ASP A 17 -7.573 15.108 -4.974 1.00 1.13 C ATOM 101 OD1 ASP A 17 -6.657 15.700 -5.587 1.00 1.30 O ATOM 102 OD2 ASP A 17 -8.609 15.693 -4.607 1.00 2.11 O ATOM 0 H ASP A 17 -7.599 11.149 -4.643 1.00 0.21 H new ATOM 0 HA ASP A 17 -8.003 13.183 -6.678 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -8.246 13.293 -4.068 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.504 13.485 -4.084 1.00 0.32 H new ATOM 107 N PHE A 18 -5.174 11.743 -5.988 1.00 0.22 N ATOM 108 CA PHE A 18 -3.794 11.550 -6.360 1.00 0.23 C ATOM 109 C PHE A 18 -3.652 10.412 -7.335 1.00 0.26 C ATOM 110 O PHE A 18 -4.046 9.277 -7.064 1.00 0.29 O ATOM 111 CB PHE A 18 -2.957 11.291 -5.129 1.00 0.21 C ATOM 112 CG PHE A 18 -3.027 12.428 -4.170 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.601 13.689 -4.547 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.548 12.248 -2.910 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.684 14.751 -3.672 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.640 13.304 -2.037 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.205 14.559 -2.413 1.00 0.31 C ATOM 0 H PHE A 18 -5.531 11.041 -5.340 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.441 12.459 -6.847 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.301 10.380 -4.640 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.920 11.124 -5.422 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.199 13.843 -5.538 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.887 11.269 -2.605 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.341 15.730 -3.973 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.055 13.152 -1.051 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.273 15.386 -1.722 1.00 0.31 H new ATOM 127 N GLU A 19 -3.111 10.748 -8.481 1.00 0.35 N ATOM 128 CA GLU A 19 -2.777 9.770 -9.493 1.00 0.43 C ATOM 129 C GLU A 19 -1.767 8.771 -8.934 1.00 0.34 C ATOM 130 O GLU A 19 -0.949 9.104 -8.068 1.00 0.37 O ATOM 131 CB GLU A 19 -2.199 10.472 -10.726 1.00 0.63 C ATOM 132 CG GLU A 19 -2.182 9.607 -11.974 1.00 1.08 C ATOM 133 CD GLU A 19 -3.576 9.304 -12.483 1.00 2.04 C ATOM 134 OE1 GLU A 19 -4.184 8.320 -12.016 1.00 2.86 O ATOM 135 OE2 GLU A 19 -4.074 10.057 -13.346 1.00 2.30 O ATOM 0 H GLU A 19 -2.889 11.709 -8.741 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.680 9.234 -9.785 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -2.782 11.371 -10.927 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.181 10.794 -10.505 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -1.614 10.112 -12.755 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -1.665 8.672 -11.758 1.00 1.08 H new ATOM 142 N VAL A 20 -1.829 7.559 -9.441 1.00 0.29 N ATOM 143 CA VAL A 20 -0.929 6.497 -9.037 1.00 0.26 C ATOM 144 C VAL A 20 -0.034 6.176 -10.219 1.00 0.25 C ATOM 145 O VAL A 20 -0.255 6.703 -11.301 1.00 0.28 O ATOM 146 CB VAL A 20 -1.737 5.254 -8.562 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.872 4.023 -8.341 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.463 5.605 -7.285 1.00 0.49 C ATOM 0 H VAL A 20 -2.508 7.280 -10.149 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.313 6.808 -8.193 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.439 4.998 -9.355 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.497 3.193 -8.011 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.376 3.755 -9.274 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.122 4.237 -7.580 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -3.033 4.742 -6.942 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.739 5.889 -6.521 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.141 6.438 -7.469 1.00 0.49 H new ATOM 158 N LEU A 21 0.991 5.368 -10.027 1.00 0.28 N ATOM 159 CA LEU A 21 1.916 5.086 -11.102 1.00 0.35 C ATOM 160 C LEU A 21 2.183 3.601 -11.226 1.00 0.38 C ATOM 161 O LEU A 21 2.258 2.896 -10.231 1.00 0.58 O ATOM 162 CB LEU A 21 3.231 5.833 -10.876 1.00 0.45 C ATOM 163 CG LEU A 21 3.096 7.351 -10.777 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.430 7.996 -10.490 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.521 7.898 -12.060 1.00 0.68 C ATOM 0 H LEU A 21 1.201 4.901 -9.145 1.00 0.28 H new ATOM 0 HA LEU A 21 1.461 5.428 -12.032 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.690 5.463 -9.959 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.913 5.595 -11.693 1.00 0.45 H new ATOM 0 HG LEU A 21 2.423 7.583 -9.952 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.305 9.077 -10.425 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.821 7.618 -9.545 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.129 7.759 -11.293 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.427 8.981 -11.984 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.182 7.649 -12.890 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.538 7.460 -12.234 1.00 0.68 H new ATOM 177 N ASP A 22 2.284 3.131 -12.458 1.00 0.33 N ATOM 178 CA ASP A 22 2.823 1.809 -12.724 1.00 0.37 C ATOM 179 C ASP A 22 4.327 1.897 -12.523 1.00 0.35 C ATOM 180 O ASP A 22 4.865 2.998 -12.403 1.00 0.40 O ATOM 181 CB ASP A 22 2.482 1.366 -14.153 1.00 0.50 C ATOM 182 CG ASP A 22 2.964 -0.038 -14.466 1.00 1.16 C ATOM 183 OD1 ASP A 22 2.293 -1.006 -14.062 1.00 1.48 O ATOM 184 OD2 ASP A 22 4.023 -0.178 -15.109 1.00 1.87 O ATOM 0 H ASP A 22 1.999 3.647 -13.291 1.00 0.33 H new ATOM 0 HA ASP A 22 2.391 1.068 -12.052 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.402 1.414 -14.295 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.928 2.064 -14.861 1.00 0.50 H new ATOM 189 N ALA A 23 5.004 0.760 -12.495 1.00 0.39 N ATOM 190 CA ALA A 23 6.394 0.688 -12.050 1.00 0.42 C ATOM 191 C ALA A 23 7.368 1.495 -12.913 1.00 0.47 C ATOM 192 O ALA A 23 8.556 1.565 -12.594 1.00 0.59 O ATOM 193 CB ALA A 23 6.839 -0.763 -11.966 1.00 0.52 C ATOM 0 H ALA A 23 4.611 -0.138 -12.778 1.00 0.39 H new ATOM 0 HA ALA A 23 6.421 1.148 -11.062 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.876 -0.807 -11.634 1.00 0.52 H new ATOM 0 HB2 ALA A 23 6.207 -1.297 -11.256 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.753 -1.227 -12.948 1.00 0.52 H new ATOM 199 N ASP A 24 6.885 2.099 -13.992 1.00 0.46 N ATOM 200 CA ASP A 24 7.734 2.951 -14.821 1.00 0.54 C ATOM 201 C ASP A 24 7.320 4.419 -14.717 1.00 0.51 C ATOM 202 O ASP A 24 7.748 5.237 -15.530 1.00 0.62 O ATOM 203 CB ASP A 24 7.698 2.511 -16.288 1.00 0.69 C ATOM 204 CG ASP A 24 8.175 1.087 -16.490 1.00 1.43 C ATOM 205 OD1 ASP A 24 9.298 0.768 -16.041 1.00 1.51 O ATOM 206 OD2 ASP A 24 7.437 0.282 -17.100 1.00 2.34 O ATOM 0 H ASP A 24 5.920 2.017 -14.313 1.00 0.46 H new ATOM 0 HA ASP A 24 8.752 2.847 -14.446 1.00 0.54 H new ATOM 0 HB2 ASP A 24 6.679 2.604 -16.665 1.00 0.69 H new ATOM 0 HB3 ASP A 24 8.319 3.184 -16.879 1.00 0.69 H new ATOM 211 N HIS A 25 6.457 4.740 -13.738 1.00 0.43 N ATOM 212 CA HIS A 25 6.018 6.120 -13.486 1.00 0.44 C ATOM 213 C HIS A 25 4.981 6.525 -14.520 1.00 0.47 C ATOM 214 O HIS A 25 4.589 7.686 -14.612 1.00 0.54 O ATOM 215 CB HIS A 25 7.186 7.128 -13.449 1.00 0.54 C ATOM 216 CG HIS A 25 7.991 7.088 -12.182 1.00 0.64 C ATOM 217 ND1 HIS A 25 7.725 7.871 -11.073 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.053 6.324 -11.847 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.587 7.579 -10.113 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.402 6.647 -10.560 1.00 1.26 N ATOM 0 H HIS A 25 6.047 4.054 -13.104 1.00 0.43 H new ATOM 0 HA HIS A 25 5.570 6.143 -12.492 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.847 6.933 -14.293 1.00 0.54 H new ATOM 0 HB3 HIS A 25 6.788 8.134 -13.582 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.538 5.593 -12.477 1.00 1.47 H new ATOM 0 HE1 HIS A 25 8.617 8.028 -9.131 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.170 6.231 -10.034 1.00 1.26 H new ATOM 229 N LYS A 26 4.550 5.540 -15.294 1.00 0.48 N ATOM 230 CA LYS A 26 3.415 5.693 -16.183 1.00 0.53 C ATOM 231 C LYS A 26 2.161 5.678 -15.330 1.00 0.41 C ATOM 232 O LYS A 26 1.923 4.703 -14.618 1.00 0.38 O ATOM 233 CB LYS A 26 3.369 4.532 -17.173 1.00 0.67 C ATOM 234 CG LYS A 26 4.706 4.231 -17.828 1.00 1.00 C ATOM 235 CD LYS A 26 4.737 2.816 -18.386 1.00 2.12 C ATOM 236 CE LYS A 26 4.417 1.810 -17.291 1.00 3.15 C ATOM 237 NZ LYS A 26 4.709 0.407 -17.681 1.00 4.25 N ATOM 0 H LYS A 26 4.978 4.615 -15.321 1.00 0.48 H new ATOM 0 HA LYS A 26 3.494 6.625 -16.743 1.00 0.53 H new ATOM 0 HB2 LYS A 26 3.020 3.639 -16.655 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.637 4.757 -17.949 1.00 0.67 H new ATOM 0 HG2 LYS A 26 4.890 4.946 -18.630 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.507 4.356 -17.100 1.00 1.00 H new ATOM 0 HD2 LYS A 26 4.016 2.722 -19.198 1.00 2.12 H new ATOM 0 HD3 LYS A 26 5.720 2.605 -18.807 1.00 2.12 H new ATOM 0 HE2 LYS A 26 4.991 2.059 -16.399 1.00 3.15 H new ATOM 0 HE3 LYS A 26 3.363 1.895 -17.026 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 4.346 -0.239 -16.951 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 4.249 0.196 -18.590 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 5.737 0.280 -17.776 1.00 4.25 H new ATOM 251 N PRO A 27 1.377 6.758 -15.348 1.00 0.41 N ATOM 252 CA PRO A 27 0.233 6.912 -14.443 1.00 0.37 C ATOM 253 C PRO A 27 -0.712 5.713 -14.419 1.00 0.32 C ATOM 254 O PRO A 27 -1.357 5.360 -15.410 1.00 0.36 O ATOM 255 CB PRO A 27 -0.458 8.161 -14.987 1.00 0.46 C ATOM 256 CG PRO A 27 0.669 8.953 -15.544 1.00 0.54 C ATOM 257 CD PRO A 27 1.551 7.940 -16.212 1.00 0.50 C ATOM 0 HA PRO A 27 0.550 6.991 -13.403 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.194 7.914 -15.752 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.984 8.705 -14.202 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.315 9.700 -16.254 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.204 9.488 -14.759 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.241 7.743 -17.238 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.590 8.267 -16.250 1.00 0.50 H new ATOM 265 N TYR A 28 -0.749 5.102 -13.251 1.00 0.28 N ATOM 266 CA TYR A 28 -1.721 4.082 -12.887 1.00 0.26 C ATOM 267 C TYR A 28 -3.036 4.739 -12.523 1.00 0.25 C ATOM 268 O TYR A 28 -3.097 5.543 -11.594 1.00 0.37 O ATOM 269 CB TYR A 28 -1.209 3.337 -11.655 1.00 0.30 C ATOM 270 CG TYR A 28 -1.578 1.882 -11.557 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.823 1.461 -11.996 1.00 0.50 C ATOM 272 CD2 TYR A 28 -0.703 0.939 -11.043 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.199 0.141 -11.918 1.00 0.64 C ATOM 274 CE2 TYR A 28 -1.066 -0.391 -10.961 1.00 1.10 C ATOM 275 CZ TYR A 28 -2.201 -0.812 -11.357 1.00 0.92 C ATOM 276 OH TYR A 28 -2.681 -2.111 -11.304 1.00 1.20 O ATOM 0 H TYR A 28 -0.085 5.306 -12.504 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.863 3.400 -13.726 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.122 3.417 -11.634 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.584 3.846 -10.767 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -3.512 2.184 -12.408 1.00 0.50 H new ATOM 0 HD2 TYR A 28 0.274 1.247 -10.702 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -4.173 -0.190 -12.248 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -0.363 -1.099 -10.547 1.00 1.10 H new ATOM 0 HH TYR A 28 -1.932 -2.740 -11.375 1.00 1.20 H new ATOM 286 N ASN A 29 -4.081 4.397 -13.243 1.00 0.34 N ATOM 287 CA ASN A 29 -5.395 4.879 -12.900 1.00 0.42 C ATOM 288 C ASN A 29 -5.875 4.151 -11.648 1.00 0.34 C ATOM 289 O ASN A 29 -6.242 2.976 -11.667 1.00 0.44 O ATOM 290 CB ASN A 29 -6.378 4.728 -14.074 1.00 0.67 C ATOM 291 CG ASN A 29 -6.548 3.302 -14.548 1.00 0.73 C ATOM 292 OD1 ASN A 29 -5.822 2.821 -15.416 1.00 1.18 O ATOM 293 ND2 ASN A 29 -7.513 2.623 -13.973 1.00 1.51 N ATOM 0 H ASN A 29 -4.045 3.792 -14.063 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.346 5.947 -12.688 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -7.350 5.120 -13.774 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.031 5.339 -14.907 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -7.685 1.654 -14.242 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -8.090 3.064 -13.257 1.00 1.51 H new ATOM 300 N LEU A 30 -5.804 4.852 -10.542 1.00 0.25 N ATOM 301 CA LEU A 30 -6.180 4.316 -9.247 1.00 0.20 C ATOM 302 C LEU A 30 -7.683 4.153 -9.161 1.00 0.19 C ATOM 303 O LEU A 30 -8.195 3.232 -8.521 1.00 0.19 O ATOM 304 CB LEU A 30 -5.728 5.304 -8.186 1.00 0.22 C ATOM 305 CG LEU A 30 -6.072 4.971 -6.762 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.381 3.692 -6.323 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.700 6.130 -5.860 1.00 0.28 C ATOM 0 H LEU A 30 -5.481 5.819 -10.511 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.714 3.341 -9.101 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.646 5.409 -8.259 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -6.159 6.277 -8.421 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.147 4.804 -6.689 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.646 3.472 -5.289 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.700 2.869 -6.962 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.301 3.816 -6.403 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.951 5.884 -4.828 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.630 6.322 -5.937 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.251 7.020 -6.165 1.00 0.28 H new ATOM 319 N VAL A 31 -8.370 5.041 -9.858 1.00 0.20 N ATOM 320 CA VAL A 31 -9.802 5.242 -9.705 1.00 0.19 C ATOM 321 C VAL A 31 -10.626 4.039 -10.150 1.00 0.20 C ATOM 322 O VAL A 31 -11.843 4.029 -10.008 1.00 0.23 O ATOM 323 CB VAL A 31 -10.243 6.476 -10.495 1.00 0.22 C ATOM 324 CG1 VAL A 31 -9.289 7.622 -10.245 1.00 1.02 C ATOM 325 CG2 VAL A 31 -10.291 6.156 -11.961 1.00 0.87 C ATOM 0 H VAL A 31 -7.944 5.651 -10.556 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.984 5.383 -8.640 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.239 6.770 -10.164 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -9.612 8.495 -10.812 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -9.280 7.863 -9.182 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -8.286 7.336 -10.560 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -10.606 7.040 -12.516 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -9.301 5.849 -12.299 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -11.001 5.347 -12.134 1.00 0.87 H new ATOM 335 N GLN A 32 -9.971 3.025 -10.684 1.00 0.21 N ATOM 336 CA GLN A 32 -10.665 1.805 -11.055 1.00 0.23 C ATOM 337 C GLN A 32 -11.009 1.003 -9.810 1.00 0.22 C ATOM 338 O GLN A 32 -11.693 -0.015 -9.870 1.00 0.28 O ATOM 339 CB GLN A 32 -9.813 0.966 -12.008 1.00 0.26 C ATOM 340 CG GLN A 32 -8.431 0.640 -11.463 1.00 0.29 C ATOM 341 CD GLN A 32 -7.674 -0.343 -12.332 1.00 0.35 C ATOM 342 OE1 GLN A 32 -8.264 -1.230 -12.944 1.00 1.02 O ATOM 343 NE2 GLN A 32 -6.366 -0.172 -12.413 1.00 0.75 N ATOM 0 H GLN A 32 -8.968 3.020 -10.870 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.588 2.074 -11.569 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.337 0.035 -12.227 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.705 1.501 -12.952 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.854 1.560 -11.376 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.529 0.229 -10.458 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -5.916 0.578 -11.888 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -5.806 -0.790 -13.001 1.00 0.75 H new ATOM 352 N HIS A 33 -10.510 1.472 -8.679 1.00 0.17 N ATOM 353 CA HIS A 33 -10.808 0.865 -7.394 1.00 0.16 C ATOM 354 C HIS A 33 -11.842 1.696 -6.675 1.00 0.16 C ATOM 355 O HIS A 33 -11.936 1.693 -5.455 1.00 0.17 O ATOM 356 CB HIS A 33 -9.515 0.695 -6.585 1.00 0.16 C ATOM 357 CG HIS A 33 -8.568 -0.210 -7.291 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.920 -1.495 -7.622 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.331 -0.001 -7.822 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.962 -2.044 -8.325 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.984 -1.163 -8.469 1.00 0.28 N ATOM 0 H HIS A 33 -9.890 2.280 -8.626 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.229 -0.131 -7.532 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.048 1.667 -6.428 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.747 0.290 -5.600 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.794 -1.952 -7.360 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.740 0.900 -7.749 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.968 -3.049 -8.722 1.00 0.27 H new ATOM 370 N LYS A 34 -12.611 2.417 -7.469 1.00 0.19 N ATOM 371 CA LYS A 34 -13.772 3.114 -6.977 1.00 0.19 C ATOM 372 C LYS A 34 -14.952 2.157 -6.933 1.00 0.21 C ATOM 373 O LYS A 34 -15.300 1.546 -7.944 1.00 0.33 O ATOM 374 CB LYS A 34 -14.118 4.287 -7.884 1.00 0.22 C ATOM 375 CG LYS A 34 -13.227 5.491 -7.703 1.00 0.28 C ATOM 376 CD LYS A 34 -13.641 6.628 -8.613 1.00 0.69 C ATOM 377 CE LYS A 34 -12.694 7.797 -8.464 1.00 1.01 C ATOM 378 NZ LYS A 34 -12.957 8.871 -9.457 1.00 1.56 N ATOM 0 H LYS A 34 -12.445 2.532 -8.469 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.554 3.491 -5.978 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -14.060 3.959 -8.922 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.151 4.582 -7.700 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -13.266 5.821 -6.665 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.193 5.215 -7.911 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -13.649 6.288 -9.649 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -14.657 6.942 -8.373 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -12.783 8.207 -7.458 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -11.668 7.446 -8.576 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -12.282 9.649 -9.314 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -12.847 8.490 -10.418 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -13.927 9.227 -9.335 1.00 1.56 H new ATOM 392 N GLY A 35 -15.552 2.015 -5.774 1.00 0.18 N ATOM 393 CA GLY A 35 -16.698 1.146 -5.647 1.00 0.20 C ATOM 394 C GLY A 35 -16.417 -0.029 -4.741 1.00 0.17 C ATOM 395 O GLY A 35 -17.301 -0.479 -4.010 1.00 0.20 O ATOM 0 H GLY A 35 -15.269 2.485 -4.914 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.542 1.713 -5.254 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.989 0.783 -6.633 1.00 0.20 H new ATOM 399 N SER A 36 -15.195 -0.544 -4.790 1.00 0.16 N ATOM 400 CA SER A 36 -14.766 -1.539 -3.848 1.00 0.16 C ATOM 401 C SER A 36 -13.436 -1.111 -3.282 1.00 0.14 C ATOM 402 O SER A 36 -12.555 -0.688 -4.027 1.00 0.16 O ATOM 403 CB SER A 36 -14.638 -2.896 -4.523 1.00 0.20 C ATOM 404 OG SER A 36 -15.846 -3.256 -5.166 1.00 0.29 O ATOM 0 H SER A 36 -14.490 -0.280 -5.479 1.00 0.16 H new ATOM 0 HA SER A 36 -15.502 -1.632 -3.049 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.828 -2.869 -5.251 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.376 -3.652 -3.782 1.00 0.20 H new ATOM 0 HG SER A 36 -15.644 -3.725 -6.003 1.00 0.29 H new ATOM 410 N PRO A 37 -13.303 -1.169 -1.955 1.00 0.12 N ATOM 411 CA PRO A 37 -12.071 -0.856 -1.249 1.00 0.12 C ATOM 412 C PRO A 37 -10.850 -1.441 -1.916 1.00 0.12 C ATOM 413 O PRO A 37 -10.916 -2.440 -2.623 1.00 0.15 O ATOM 414 CB PRO A 37 -12.283 -1.481 0.141 1.00 0.15 C ATOM 415 CG PRO A 37 -13.544 -2.253 0.024 1.00 0.18 C ATOM 416 CD PRO A 37 -14.344 -1.537 -1.011 1.00 0.15 C ATOM 0 HA PRO A 37 -11.884 0.217 -1.223 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.449 -2.126 0.415 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.359 -0.714 0.912 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.349 -3.284 -0.272 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.074 -2.289 0.976 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.103 -2.176 -1.462 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.860 -0.667 -0.605 1.00 0.15 H new ATOM 424 N LEU A 38 -9.750 -0.784 -1.673 1.00 0.14 N ATOM 425 CA LEU A 38 -8.464 -1.147 -2.202 1.00 0.13 C ATOM 426 C LEU A 38 -7.470 -0.935 -1.084 1.00 0.13 C ATOM 427 O LEU A 38 -7.684 -0.107 -0.222 1.00 0.20 O ATOM 428 CB LEU A 38 -8.098 -0.285 -3.416 1.00 0.16 C ATOM 429 CG LEU A 38 -8.224 1.232 -3.249 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.535 1.937 -4.395 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.680 1.677 -3.195 1.00 0.26 C ATOM 0 H LEU A 38 -9.723 0.047 -1.082 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.466 -2.182 -2.545 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -7.069 -0.512 -3.696 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.730 -0.588 -4.251 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.749 1.496 -2.304 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.629 3.015 -4.268 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.480 1.664 -4.408 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.998 1.640 -5.336 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.725 2.760 -3.076 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.182 1.392 -4.120 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.176 1.198 -2.351 1.00 0.26 H new ATOM 443 N LEU A 39 -6.429 -1.699 -1.046 1.00 0.18 N ATOM 444 CA LEU A 39 -5.415 -1.489 -0.059 1.00 0.19 C ATOM 445 C LEU A 39 -4.137 -1.115 -0.727 1.00 0.18 C ATOM 446 O LEU A 39 -3.707 -1.752 -1.686 1.00 0.21 O ATOM 447 CB LEU A 39 -5.185 -2.707 0.805 1.00 0.23 C ATOM 448 CG LEU A 39 -5.775 -2.622 2.211 1.00 0.35 C ATOM 449 CD1 LEU A 39 -7.272 -2.833 2.182 1.00 1.10 C ATOM 450 CD2 LEU A 39 -5.112 -3.623 3.133 1.00 1.19 C ATOM 0 H LEU A 39 -6.255 -2.475 -1.685 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.760 -0.685 0.590 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.608 -3.576 0.302 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.112 -2.878 0.887 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.581 -1.621 2.597 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -7.668 -2.768 3.195 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -7.736 -2.066 1.561 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -7.493 -3.817 1.769 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -5.548 -3.545 4.129 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -5.267 -4.631 2.747 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -4.043 -3.415 3.187 1.00 1.19 H new ATOM 462 N ILE A 40 -3.548 -0.068 -0.239 1.00 0.19 N ATOM 463 CA ILE A 40 -2.292 0.375 -0.769 1.00 0.20 C ATOM 464 C ILE A 40 -1.200 0.164 0.265 1.00 0.18 C ATOM 465 O ILE A 40 -1.334 0.586 1.416 1.00 0.20 O ATOM 466 CB ILE A 40 -2.386 1.839 -1.181 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.820 2.161 -1.592 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.438 2.132 -2.335 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.933 3.512 -2.230 1.00 0.35 C ATOM 0 H ILE A 40 -3.915 0.498 0.526 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.043 -0.208 -1.656 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.101 2.463 -0.334 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.177 1.401 -2.287 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.466 2.119 -0.715 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.519 3.182 -2.615 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.414 1.916 -2.029 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.700 1.507 -3.189 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.971 3.698 -2.506 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.602 4.276 -1.526 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.308 3.546 -3.123 1.00 0.35 H new ATOM 481 N TYR A 41 -0.142 -0.521 -0.141 1.00 0.18 N ATOM 482 CA TYR A 41 0.892 -0.950 0.783 1.00 0.19 C ATOM 483 C TYR A 41 2.196 -0.208 0.525 1.00 0.20 C ATOM 484 O TYR A 41 2.708 -0.221 -0.590 1.00 0.27 O ATOM 485 CB TYR A 41 1.150 -2.471 0.654 1.00 0.20 C ATOM 486 CG TYR A 41 -0.015 -3.382 1.000 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.305 -3.096 0.597 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.198 -4.557 1.710 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.346 -3.947 0.891 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.844 -5.414 2.012 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.112 -5.101 1.598 1.00 0.33 C ATOM 492 OH TYR A 41 -3.155 -5.949 1.883 1.00 0.42 O ATOM 0 H TYR A 41 0.022 -0.792 -1.111 1.00 0.18 H new ATOM 0 HA TYR A 41 0.540 -0.724 1.790 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.456 -2.681 -0.371 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.991 -2.731 1.297 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.500 -2.190 0.042 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.198 -4.806 2.033 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.347 -3.707 0.566 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.660 -6.321 2.569 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.062 -6.771 1.357 1.00 0.42 H new ATOM 502 N ASN A 42 2.730 0.437 1.549 1.00 0.28 N ATOM 503 CA ASN A 42 4.092 0.937 1.485 1.00 0.34 C ATOM 504 C ASN A 42 5.006 -0.227 1.750 1.00 0.37 C ATOM 505 O ASN A 42 5.303 -0.569 2.882 1.00 0.54 O ATOM 506 CB ASN A 42 4.351 2.063 2.494 1.00 0.46 C ATOM 507 CG ASN A 42 5.824 2.260 2.829 1.00 1.50 C ATOM 508 OD1 ASN A 42 6.166 2.656 3.935 1.00 2.27 O ATOM 509 ND2 ASN A 42 6.708 2.008 1.876 1.00 2.35 N ATOM 0 H ASN A 42 2.246 0.625 2.427 1.00 0.28 H new ATOM 0 HA ASN A 42 4.273 1.368 0.500 1.00 0.34 H new ATOM 0 HB2 ASN A 42 3.951 2.995 2.095 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.804 1.848 3.412 1.00 0.46 H new ATOM 0 HD21 ASN A 42 7.703 2.143 2.055 1.00 2.35 H new ATOM 0 HD22 ASN A 42 6.394 1.679 0.963 1.00 2.35 H new ATOM 516 N VAL A 43 5.452 -0.820 0.690 1.00 0.36 N ATOM 517 CA VAL A 43 6.193 -2.039 0.771 1.00 0.38 C ATOM 518 C VAL A 43 7.655 -1.764 0.502 1.00 0.42 C ATOM 519 O VAL A 43 7.976 -0.859 -0.245 1.00 0.50 O ATOM 520 CB VAL A 43 5.638 -3.032 -0.261 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.600 -2.416 -1.644 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.451 -4.289 -0.287 1.00 0.98 C ATOM 0 H VAL A 43 5.313 -0.473 -0.259 1.00 0.36 H new ATOM 0 HA VAL A 43 6.097 -2.467 1.769 1.00 0.38 H new ATOM 0 HB VAL A 43 4.620 -3.280 0.039 1.00 0.39 H new ATOM 0 HG11 VAL A 43 5.203 -3.141 -2.354 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.961 -1.533 -1.632 1.00 1.03 H new ATOM 0 HG13 VAL A 43 6.609 -2.130 -1.943 1.00 1.03 H new ATOM 0 HG21 VAL A 43 6.037 -4.975 -1.026 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.481 -4.050 -0.551 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.428 -4.758 0.697 1.00 0.98 H new ATOM 532 N ALA A 44 8.552 -2.498 1.125 1.00 0.50 N ATOM 533 CA ALA A 44 9.939 -2.363 0.763 1.00 0.59 C ATOM 534 C ALA A 44 10.384 -3.572 -0.026 1.00 0.58 C ATOM 535 O ALA A 44 10.674 -4.615 0.548 1.00 0.88 O ATOM 536 CB ALA A 44 10.813 -2.169 1.991 1.00 0.83 C ATOM 0 H ALA A 44 8.352 -3.174 1.862 1.00 0.50 H new ATOM 0 HA ALA A 44 10.048 -1.475 0.140 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.854 -2.070 1.685 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.503 -1.267 2.519 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.709 -3.030 2.651 1.00 0.83 H new ATOM 542 N SER A 45 10.332 -3.401 -1.347 1.00 0.57 N ATOM 543 CA SER A 45 10.982 -4.265 -2.351 1.00 0.63 C ATOM 544 C SER A 45 11.390 -5.636 -1.814 1.00 1.01 C ATOM 545 O SER A 45 10.669 -6.609 -2.029 1.00 1.78 O ATOM 546 CB SER A 45 12.182 -3.534 -2.962 1.00 0.73 C ATOM 547 OG SER A 45 12.972 -2.919 -1.959 1.00 1.62 O ATOM 0 H SER A 45 9.818 -2.629 -1.771 1.00 0.57 H new ATOM 0 HA SER A 45 10.239 -4.467 -3.123 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.791 -4.239 -3.527 1.00 0.73 H new ATOM 0 HB3 SER A 45 11.832 -2.779 -3.666 1.00 0.73 H new ATOM 0 HG SER A 45 13.732 -2.461 -2.376 1.00 1.62 H new ATOM 553 N LYS A 46 12.543 -5.682 -1.132 1.00 1.32 N ATOM 554 CA LYS A 46 13.057 -6.870 -0.426 1.00 1.69 C ATOM 555 C LYS A 46 13.298 -8.060 -1.358 1.00 1.14 C ATOM 556 O LYS A 46 12.577 -8.288 -2.328 1.00 1.47 O ATOM 557 CB LYS A 46 12.141 -7.282 0.744 1.00 2.68 C ATOM 558 CG LYS A 46 11.071 -8.304 0.389 1.00 3.45 C ATOM 559 CD LYS A 46 9.675 -7.714 0.480 1.00 4.39 C ATOM 560 CE LYS A 46 8.675 -8.557 -0.292 1.00 5.19 C ATOM 561 NZ LYS A 46 9.139 -8.807 -1.685 1.00 5.84 N ATOM 0 H LYS A 46 13.162 -4.875 -1.052 1.00 1.32 H new ATOM 0 HA LYS A 46 14.025 -6.575 -0.020 1.00 1.69 H new ATOM 0 HB2 LYS A 46 12.759 -7.688 1.545 1.00 2.68 H new ATOM 0 HB3 LYS A 46 11.654 -6.389 1.137 1.00 2.68 H new ATOM 0 HG2 LYS A 46 11.244 -8.675 -0.621 1.00 3.45 H new ATOM 0 HG3 LYS A 46 11.149 -9.159 1.060 1.00 3.45 H new ATOM 0 HD2 LYS A 46 9.371 -7.649 1.525 1.00 4.39 H new ATOM 0 HD3 LYS A 46 9.680 -6.698 0.086 1.00 4.39 H new ATOM 0 HE2 LYS A 46 8.526 -9.508 0.220 1.00 5.19 H new ATOM 0 HE3 LYS A 46 7.710 -8.051 -0.313 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 8.335 -8.723 -2.339 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 9.866 -8.109 -1.939 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 9.540 -9.764 -1.751 1.00 5.84 H new ATOM 575 N CYS A 47 14.318 -8.835 -1.047 1.00 1.21 N ATOM 576 CA CYS A 47 14.631 -10.003 -1.839 1.00 1.53 C ATOM 577 C CYS A 47 14.348 -11.267 -1.043 1.00 1.99 C ATOM 578 O CYS A 47 14.993 -11.530 -0.028 1.00 2.46 O ATOM 579 CB CYS A 47 16.097 -9.958 -2.262 1.00 2.04 C ATOM 580 SG CYS A 47 16.608 -11.324 -3.329 1.00 3.55 S ATOM 0 H CYS A 47 14.941 -8.676 -0.255 1.00 1.21 H new ATOM 0 HA CYS A 47 14.005 -10.010 -2.731 1.00 1.53 H new ATOM 0 HB2 CYS A 47 16.284 -9.018 -2.781 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.721 -9.958 -1.368 1.00 2.04 H new ATOM 0 HG CYS A 47 17.865 -11.191 -3.632 1.00 3.55 H new ATOM 586 N GLY A 48 13.381 -12.048 -1.515 1.00 2.39 N ATOM 587 CA GLY A 48 13.023 -13.294 -0.855 1.00 2.91 C ATOM 588 C GLY A 48 12.484 -13.104 0.556 1.00 2.40 C ATOM 589 O GLY A 48 12.373 -14.065 1.313 1.00 2.46 O ATOM 0 H GLY A 48 12.834 -11.839 -2.350 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.274 -13.811 -1.455 1.00 2.91 H new ATOM 0 HA3 GLY A 48 13.900 -13.940 -0.816 1.00 2.91 H new ATOM 593 N TYR A 49 12.147 -11.871 0.912 1.00 2.15 N ATOM 594 CA TYR A 49 11.669 -11.581 2.258 1.00 1.79 C ATOM 595 C TYR A 49 10.178 -11.264 2.275 1.00 1.42 C ATOM 596 O TYR A 49 9.558 -11.041 1.233 1.00 1.67 O ATOM 597 CB TYR A 49 12.448 -10.417 2.878 1.00 2.10 C ATOM 598 CG TYR A 49 13.852 -10.777 3.303 1.00 2.40 C ATOM 599 CD1 TYR A 49 14.086 -11.787 4.228 1.00 2.66 C ATOM 600 CD2 TYR A 49 14.946 -10.112 2.767 1.00 3.01 C ATOM 601 CE1 TYR A 49 15.373 -12.120 4.608 1.00 3.26 C ATOM 602 CE2 TYR A 49 16.234 -10.440 3.139 1.00 3.74 C ATOM 603 CZ TYR A 49 16.429 -11.436 4.111 1.00 3.76 C ATOM 604 OH TYR A 49 17.727 -11.772 4.431 1.00 4.63 O ATOM 0 H TYR A 49 12.195 -11.061 0.293 1.00 2.15 H new ATOM 0 HA TYR A 49 11.835 -12.480 2.852 1.00 1.79 H new ATOM 0 HB2 TYR A 49 12.495 -9.600 2.158 1.00 2.10 H new ATOM 0 HB3 TYR A 49 11.900 -10.047 3.745 1.00 2.10 H new ATOM 0 HD1 TYR A 49 13.250 -12.320 4.657 1.00 2.66 H new ATOM 0 HD2 TYR A 49 14.787 -9.324 2.046 1.00 3.01 H new ATOM 0 HE1 TYR A 49 15.536 -12.929 5.304 1.00 3.26 H new ATOM 0 HE2 TYR A 49 17.079 -9.939 2.690 1.00 3.74 H new ATOM 0 HH TYR A 49 18.345 -11.164 3.974 1.00 4.63 H new ATOM 614 N THR A 50 9.626 -11.242 3.478 1.00 1.05 N ATOM 615 CA THR A 50 8.223 -10.943 3.712 1.00 0.81 C ATOM 616 C THR A 50 7.973 -10.943 5.219 1.00 0.77 C ATOM 617 O THR A 50 8.582 -11.726 5.948 1.00 1.44 O ATOM 618 CB THR A 50 7.284 -11.974 3.032 1.00 1.09 C ATOM 619 OG1 THR A 50 5.910 -11.688 3.349 1.00 1.93 O ATOM 620 CG2 THR A 50 7.620 -13.396 3.461 1.00 1.87 C ATOM 0 H THR A 50 10.149 -11.435 4.332 1.00 1.05 H new ATOM 0 HA THR A 50 8.003 -9.968 3.278 1.00 0.81 H new ATOM 0 HB THR A 50 7.432 -11.893 1.955 1.00 1.09 H new ATOM 0 HG1 THR A 50 5.423 -12.528 3.483 1.00 1.93 H new ATOM 0 HG21 THR A 50 6.944 -14.094 2.967 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.648 -13.627 3.182 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.509 -13.486 4.542 1.00 1.87 H new ATOM 628 N LYS A 51 7.116 -10.052 5.697 1.00 0.61 N ATOM 629 CA LYS A 51 6.759 -10.038 7.103 1.00 0.56 C ATOM 630 C LYS A 51 5.331 -10.533 7.253 1.00 0.76 C ATOM 631 O LYS A 51 4.731 -10.445 8.315 1.00 1.55 O ATOM 632 CB LYS A 51 6.937 -8.621 7.671 1.00 0.59 C ATOM 633 CG LYS A 51 8.359 -8.106 7.508 1.00 1.22 C ATOM 634 CD LYS A 51 8.638 -6.878 8.358 1.00 1.39 C ATOM 635 CE LYS A 51 8.473 -7.177 9.838 1.00 1.46 C ATOM 636 NZ LYS A 51 9.438 -6.411 10.671 1.00 2.01 N ATOM 0 H LYS A 51 6.659 -9.335 5.134 1.00 0.61 H new ATOM 0 HA LYS A 51 7.413 -10.701 7.669 1.00 0.56 H new ATOM 0 HB2 LYS A 51 6.248 -7.942 7.169 1.00 0.59 H new ATOM 0 HB3 LYS A 51 6.672 -8.620 8.728 1.00 0.59 H new ATOM 0 HG2 LYS A 51 9.060 -8.896 7.777 1.00 1.22 H new ATOM 0 HG3 LYS A 51 8.536 -7.865 6.460 1.00 1.22 H new ATOM 0 HD2 LYS A 51 9.652 -6.525 8.168 1.00 1.39 H new ATOM 0 HD3 LYS A 51 7.961 -6.074 8.070 1.00 1.39 H new ATOM 0 HE2 LYS A 51 7.456 -6.935 10.146 1.00 1.46 H new ATOM 0 HE3 LYS A 51 8.612 -8.244 10.010 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 9.292 -6.644 11.674 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 10.409 -6.661 10.395 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 9.289 -5.392 10.527 1.00 2.01 H new ATOM 650 N GLY A 52 4.817 -11.091 6.161 1.00 0.45 N ATOM 651 CA GLY A 52 3.425 -11.487 6.085 1.00 0.51 C ATOM 652 C GLY A 52 2.735 -10.763 4.952 1.00 0.41 C ATOM 653 O GLY A 52 1.803 -11.278 4.334 1.00 0.41 O ATOM 0 H GLY A 52 5.353 -11.278 5.313 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.354 -12.564 5.934 1.00 0.51 H new ATOM 0 HA3 GLY A 52 2.924 -11.263 7.027 1.00 0.51 H new ATOM 657 N GLY A 53 3.241 -9.566 4.676 1.00 0.44 N ATOM 658 CA GLY A 53 2.717 -8.724 3.620 1.00 0.50 C ATOM 659 C GLY A 53 2.558 -9.432 2.290 1.00 0.36 C ATOM 660 O GLY A 53 1.521 -9.310 1.655 1.00 0.32 O ATOM 0 H GLY A 53 4.027 -9.157 5.182 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.748 -8.331 3.929 1.00 0.50 H new ATOM 0 HA3 GLY A 53 3.380 -7.869 3.488 1.00 0.50 H new ATOM 664 N TYR A 54 3.577 -10.174 1.868 1.00 0.37 N ATOM 665 CA TYR A 54 3.593 -10.751 0.527 1.00 0.36 C ATOM 666 C TYR A 54 2.400 -11.675 0.300 1.00 0.26 C ATOM 667 O TYR A 54 1.588 -11.439 -0.594 1.00 0.25 O ATOM 668 CB TYR A 54 4.886 -11.525 0.303 1.00 0.45 C ATOM 669 CG TYR A 54 5.426 -11.443 -1.110 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.556 -11.255 -2.169 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.789 -11.551 -1.387 1.00 0.53 C ATOM 672 CE1 TYR A 54 5.014 -11.175 -3.463 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.263 -11.468 -2.688 1.00 0.65 C ATOM 674 CZ TYR A 54 6.468 -11.305 -3.685 1.00 0.56 C ATOM 675 OH TYR A 54 6.813 -11.183 -5.020 1.00 0.70 O ATOM 0 H TYR A 54 4.399 -10.390 2.432 1.00 0.37 H new ATOM 0 HA TYR A 54 3.529 -9.929 -0.186 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.644 -11.150 0.991 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.717 -12.572 0.554 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.497 -11.169 -1.976 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.486 -11.702 -0.576 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.334 -11.022 -4.288 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.325 -11.542 -2.868 1.00 0.65 H new ATOM 0 HH TYR A 54 6.808 -10.236 -5.274 1.00 0.70 H new ATOM 685 N GLU A 55 2.291 -12.708 1.126 1.00 0.25 N ATOM 686 CA GLU A 55 1.228 -13.704 0.986 1.00 0.27 C ATOM 687 C GLU A 55 -0.130 -13.062 1.187 1.00 0.22 C ATOM 688 O GLU A 55 -1.136 -13.503 0.627 1.00 0.25 O ATOM 689 CB GLU A 55 1.411 -14.812 2.019 1.00 0.36 C ATOM 690 CG GLU A 55 2.856 -15.211 2.198 1.00 1.14 C ATOM 691 CD GLU A 55 3.345 -14.981 3.611 1.00 1.92 C ATOM 692 OE1 GLU A 55 2.970 -15.772 4.509 1.00 2.39 O ATOM 693 OE2 GLU A 55 4.095 -14.005 3.834 1.00 2.61 O ATOM 0 H GLU A 55 2.927 -12.881 1.904 1.00 0.25 H new ATOM 0 HA GLU A 55 1.283 -14.124 -0.019 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.009 -14.480 2.976 1.00 0.36 H new ATOM 0 HB3 GLU A 55 0.833 -15.685 1.716 1.00 0.36 H new ATOM 0 HG2 GLU A 55 2.974 -16.264 1.942 1.00 1.14 H new ATOM 0 HG3 GLU A 55 3.476 -14.643 1.504 1.00 1.14 H new ATOM 700 N THR A 56 -0.136 -12.001 1.967 1.00 0.25 N ATOM 701 CA THR A 56 -1.355 -11.332 2.335 1.00 0.24 C ATOM 702 C THR A 56 -1.864 -10.506 1.173 1.00 0.21 C ATOM 703 O THR A 56 -2.964 -10.724 0.674 1.00 0.22 O ATOM 704 CB THR A 56 -1.118 -10.443 3.571 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.851 -11.268 4.711 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.306 -9.544 3.852 1.00 0.25 C ATOM 0 H THR A 56 0.707 -11.582 2.361 1.00 0.25 H new ATOM 0 HA THR A 56 -2.109 -12.078 2.586 1.00 0.24 H new ATOM 0 HB THR A 56 -0.260 -9.803 3.366 1.00 0.26 H new ATOM 0 HG1 THR A 56 0.117 -11.382 4.813 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.100 -8.933 4.731 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.483 -8.897 2.993 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.190 -10.155 4.034 1.00 0.25 H new ATOM 714 N ALA A 57 -1.028 -9.602 0.722 1.00 0.19 N ATOM 715 CA ALA A 57 -1.357 -8.713 -0.363 1.00 0.20 C ATOM 716 C ALA A 57 -1.668 -9.493 -1.634 1.00 0.19 C ATOM 717 O ALA A 57 -2.616 -9.171 -2.353 1.00 0.22 O ATOM 718 CB ALA A 57 -0.199 -7.769 -0.582 1.00 0.22 C ATOM 0 H ALA A 57 -0.092 -9.463 1.102 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.251 -8.144 -0.107 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.434 -7.089 -1.401 1.00 0.22 H new ATOM 0 HB2 ALA A 57 -0.021 -7.194 0.327 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.695 -8.341 -0.830 1.00 0.22 H new ATOM 724 N THR A 58 -0.871 -10.528 -1.894 1.00 0.17 N ATOM 725 CA THR A 58 -1.050 -11.364 -3.074 1.00 0.17 C ATOM 726 C THR A 58 -2.454 -11.970 -3.092 1.00 0.17 C ATOM 727 O THR A 58 -3.225 -11.785 -4.043 1.00 0.19 O ATOM 728 CB THR A 58 -0.020 -12.508 -3.100 1.00 0.20 C ATOM 729 OG1 THR A 58 1.307 -11.973 -3.134 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.228 -13.424 -4.298 1.00 0.26 C ATOM 0 H THR A 58 -0.092 -10.807 -1.298 1.00 0.17 H new ATOM 0 HA THR A 58 -0.909 -10.730 -3.949 1.00 0.17 H new ATOM 0 HB THR A 58 -0.159 -13.097 -2.193 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.650 -11.890 -2.220 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.518 -14.219 -4.282 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.225 -13.861 -4.253 1.00 0.26 H new ATOM 0 HG23 THR A 58 -0.125 -12.849 -5.218 1.00 0.26 H new ATOM 738 N THR A 59 -2.780 -12.666 -2.006 1.00 0.16 N ATOM 739 CA THR A 59 -4.036 -13.385 -1.893 1.00 0.17 C ATOM 740 C THR A 59 -5.219 -12.429 -1.785 1.00 0.16 C ATOM 741 O THR A 59 -6.280 -12.691 -2.336 1.00 0.19 O ATOM 742 CB THR A 59 -4.022 -14.321 -0.669 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.853 -15.149 -0.704 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.260 -15.203 -0.637 1.00 0.46 C ATOM 0 H THR A 59 -2.180 -12.744 -1.185 1.00 0.16 H new ATOM 0 HA THR A 59 -4.149 -13.978 -2.800 1.00 0.17 H new ATOM 0 HB THR A 59 -4.014 -13.702 0.228 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.158 -14.758 -0.134 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.222 -15.852 0.238 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.151 -14.577 -0.586 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.296 -15.812 -1.540 1.00 0.46 H new ATOM 752 N LEU A 60 -5.022 -11.310 -1.101 1.00 0.13 N ATOM 753 CA LEU A 60 -6.090 -10.361 -0.864 1.00 0.13 C ATOM 754 C LEU A 60 -6.522 -9.723 -2.154 1.00 0.13 C ATOM 755 O LEU A 60 -7.713 -9.633 -2.448 1.00 0.15 O ATOM 756 CB LEU A 60 -5.624 -9.292 0.101 1.00 0.13 C ATOM 757 CG LEU A 60 -5.776 -9.663 1.561 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.194 -8.580 2.443 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.244 -9.877 1.873 1.00 0.35 C ATOM 0 H LEU A 60 -4.124 -11.040 -0.700 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.938 -10.893 -0.433 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.576 -9.071 -0.099 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.185 -8.377 -0.090 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.232 -10.586 1.759 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.311 -8.861 3.490 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.135 -8.456 2.217 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.716 -7.641 2.259 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.357 -10.144 2.924 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.797 -8.960 1.670 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.635 -10.681 1.250 1.00 0.35 H new ATOM 771 N TYR A 61 -5.542 -9.290 -2.922 1.00 0.14 N ATOM 772 CA TYR A 61 -5.808 -8.702 -4.204 1.00 0.15 C ATOM 773 C TYR A 61 -6.626 -9.660 -5.053 1.00 0.17 C ATOM 774 O TYR A 61 -7.703 -9.333 -5.463 1.00 0.22 O ATOM 775 CB TYR A 61 -4.518 -8.370 -4.928 1.00 0.17 C ATOM 776 CG TYR A 61 -4.785 -7.671 -6.232 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.901 -6.887 -6.415 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.910 -7.824 -7.290 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.156 -6.277 -7.628 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.146 -7.215 -8.501 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.282 -6.321 -8.603 1.00 0.23 C ATOM 782 OH TYR A 61 -5.527 -5.861 -9.891 1.00 0.28 O ATOM 0 H TYR A 61 -4.554 -9.338 -2.673 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.367 -7.780 -4.043 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.896 -7.737 -4.295 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.957 -9.286 -5.113 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.590 -6.746 -5.595 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.026 -8.432 -7.164 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -7.090 -5.756 -7.775 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.504 -7.398 -9.350 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.729 -5.997 -10.444 1.00 0.28 H new ATOM 792 N ASN A 62 -6.125 -10.860 -5.247 1.00 0.18 N ATOM 793 CA ASN A 62 -6.732 -11.830 -6.148 1.00 0.22 C ATOM 794 C ASN A 62 -8.042 -12.345 -5.607 1.00 0.20 C ATOM 795 O ASN A 62 -8.893 -12.815 -6.361 1.00 0.24 O ATOM 796 CB ASN A 62 -5.777 -12.986 -6.425 1.00 0.27 C ATOM 797 CG ASN A 62 -4.881 -12.679 -7.599 1.00 0.75 C ATOM 798 OD1 ASN A 62 -5.149 -13.095 -8.726 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.837 -11.914 -7.351 1.00 1.12 N ATOM 0 H ASN A 62 -5.281 -11.197 -4.784 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.938 -11.318 -7.088 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.170 -13.180 -5.541 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.347 -13.893 -6.626 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -3.212 -11.643 -8.110 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.654 -11.593 -6.400 1.00 1.12 H new ATOM 806 N LYS A 63 -8.206 -12.274 -4.300 1.00 0.18 N ATOM 807 CA LYS A 63 -9.419 -12.742 -3.693 1.00 0.20 C ATOM 808 C LYS A 63 -10.501 -11.720 -3.942 1.00 0.18 C ATOM 809 O LYS A 63 -11.674 -12.060 -4.095 1.00 0.22 O ATOM 810 CB LYS A 63 -9.236 -12.935 -2.184 1.00 0.26 C ATOM 811 CG LYS A 63 -10.422 -13.599 -1.506 1.00 0.29 C ATOM 812 CD LYS A 63 -10.427 -15.097 -1.745 1.00 0.64 C ATOM 813 CE LYS A 63 -9.270 -15.777 -1.034 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.245 -17.240 -1.291 1.00 1.54 N ATOM 0 H LYS A 63 -7.516 -11.899 -3.650 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.691 -13.704 -4.128 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.345 -13.537 -2.009 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -9.061 -11.964 -1.721 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -10.389 -13.400 -0.435 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.348 -13.166 -1.883 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.369 -15.519 -1.396 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -10.366 -15.296 -2.815 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.330 -15.334 -1.364 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -9.347 -15.598 0.038 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -8.441 -17.667 -0.788 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.131 -17.667 -0.953 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -9.146 -17.411 -2.312 1.00 1.54 H new ATOM 828 N TYR A 64 -10.101 -10.452 -4.002 1.00 0.16 N ATOM 829 CA TYR A 64 -11.080 -9.398 -3.948 1.00 0.16 C ATOM 830 C TYR A 64 -11.031 -8.393 -5.089 1.00 0.17 C ATOM 831 O TYR A 64 -11.890 -7.514 -5.164 1.00 0.17 O ATOM 832 CB TYR A 64 -11.003 -8.736 -2.589 1.00 0.15 C ATOM 833 CG TYR A 64 -11.406 -9.690 -1.498 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.669 -10.258 -1.514 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.540 -10.032 -0.473 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.067 -11.138 -0.542 1.00 0.23 C ATOM 837 CE2 TYR A 64 -10.931 -10.916 0.516 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.199 -11.467 0.478 1.00 0.24 C ATOM 839 OH TYR A 64 -12.589 -12.359 1.453 1.00 0.31 O ATOM 0 H TYR A 64 -9.132 -10.146 -4.086 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.055 -9.865 -4.089 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.988 -8.382 -2.410 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.653 -7.861 -2.570 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.354 -10.002 -2.309 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.549 -9.604 -0.446 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.056 -11.572 -0.574 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.250 -11.175 1.313 1.00 0.23 H new ATOM 0 HH TYR A 64 -11.903 -12.400 2.152 1.00 0.31 H new ATOM 849 N LYS A 65 -10.081 -8.530 -6.000 1.00 0.20 N ATOM 850 CA LYS A 65 -10.108 -7.734 -7.216 1.00 0.23 C ATOM 851 C LYS A 65 -11.335 -8.118 -7.984 1.00 0.20 C ATOM 852 O LYS A 65 -11.938 -7.301 -8.677 1.00 0.22 O ATOM 853 CB LYS A 65 -8.852 -7.901 -8.085 1.00 0.34 C ATOM 854 CG LYS A 65 -8.325 -9.322 -8.224 1.00 0.29 C ATOM 855 CD LYS A 65 -7.080 -9.348 -9.093 1.00 0.38 C ATOM 856 CE LYS A 65 -7.425 -9.393 -10.573 1.00 0.80 C ATOM 857 NZ LYS A 65 -6.211 -9.340 -11.428 1.00 1.35 N ATOM 0 H LYS A 65 -9.294 -9.174 -5.923 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.127 -6.681 -6.937 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -9.069 -7.515 -9.081 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -8.060 -7.279 -7.668 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.096 -9.729 -7.239 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.094 -9.959 -8.661 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.475 -8.465 -8.888 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.474 -10.217 -8.834 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -7.981 -10.306 -10.788 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -8.079 -8.556 -10.819 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -6.490 -9.373 -12.429 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.693 -8.457 -11.242 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.599 -10.153 -11.212 1.00 1.35 H new ATOM 871 N SER A 66 -11.721 -9.370 -7.785 1.00 0.23 N ATOM 872 CA SER A 66 -12.966 -9.893 -8.322 1.00 0.26 C ATOM 873 C SER A 66 -14.135 -8.938 -8.033 1.00 0.25 C ATOM 874 O SER A 66 -15.032 -8.781 -8.860 1.00 0.31 O ATOM 875 CB SER A 66 -13.241 -11.268 -7.720 1.00 0.32 C ATOM 876 OG SER A 66 -12.103 -12.106 -7.848 1.00 1.28 O ATOM 0 H SER A 66 -11.181 -10.049 -7.248 1.00 0.23 H new ATOM 0 HA SER A 66 -12.870 -9.984 -9.404 1.00 0.26 H new ATOM 0 HB2 SER A 66 -13.506 -11.164 -6.668 1.00 0.32 H new ATOM 0 HB3 SER A 66 -14.095 -11.726 -8.220 1.00 0.32 H new ATOM 0 HG SER A 66 -12.297 -12.983 -7.455 1.00 1.28 H new ATOM 882 N GLN A 67 -14.125 -8.300 -6.860 1.00 0.21 N ATOM 883 CA GLN A 67 -15.116 -7.270 -6.556 1.00 0.20 C ATOM 884 C GLN A 67 -14.650 -5.880 -7.022 1.00 0.20 C ATOM 885 O GLN A 67 -15.440 -5.109 -7.565 1.00 0.27 O ATOM 886 CB GLN A 67 -15.427 -7.255 -5.057 1.00 0.21 C ATOM 887 CG GLN A 67 -16.112 -8.525 -4.576 1.00 0.38 C ATOM 888 CD GLN A 67 -16.439 -8.497 -3.097 1.00 0.52 C ATOM 889 OE1 GLN A 67 -17.513 -8.053 -2.691 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.519 -8.986 -2.284 1.00 0.46 N ATOM 0 H GLN A 67 -13.451 -8.476 -6.115 1.00 0.21 H new ATOM 0 HA GLN A 67 -16.026 -7.514 -7.104 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.500 -7.117 -4.501 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.063 -6.399 -4.833 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.031 -8.673 -5.143 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.468 -9.380 -4.784 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -14.642 -9.344 -2.663 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -15.686 -9.005 -1.278 1.00 0.46 H new ATOM 899 N GLY A 68 -13.364 -5.588 -6.842 1.00 0.17 N ATOM 900 CA GLY A 68 -12.821 -4.279 -7.157 1.00 0.18 C ATOM 901 C GLY A 68 -11.622 -3.948 -6.283 1.00 0.15 C ATOM 902 O GLY A 68 -10.971 -2.917 -6.464 1.00 0.17 O ATOM 0 H GLY A 68 -12.678 -6.249 -6.477 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.527 -4.249 -8.206 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.593 -3.521 -7.020 1.00 0.18 H new ATOM 906 N PHE A 69 -11.327 -4.844 -5.344 1.00 0.14 N ATOM 907 CA PHE A 69 -10.234 -4.657 -4.391 1.00 0.13 C ATOM 908 C PHE A 69 -8.887 -4.794 -5.071 1.00 0.14 C ATOM 909 O PHE A 69 -8.719 -5.606 -5.968 1.00 0.18 O ATOM 910 CB PHE A 69 -10.340 -5.686 -3.260 1.00 0.14 C ATOM 911 CG PHE A 69 -9.298 -5.517 -2.198 1.00 0.12 C ATOM 912 CD1 PHE A 69 -9.019 -4.282 -1.627 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.612 -6.613 -1.760 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.056 -4.167 -0.637 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.668 -6.517 -0.786 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.367 -5.116 -0.254 1.00 0.14 C ATOM 0 H PHE A 69 -11.837 -5.719 -5.222 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.316 -3.651 -3.981 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.327 -5.612 -2.804 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.258 -6.688 -3.682 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.556 -3.405 -1.957 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.824 -7.578 -2.197 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.901 -3.201 -0.179 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.156 -7.389 -0.407 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.562 -4.959 0.448 1.00 0.14 H new ATOM 926 N THR A 70 -7.929 -3.986 -4.662 1.00 0.13 N ATOM 927 CA THR A 70 -6.596 -4.118 -5.141 1.00 0.12 C ATOM 928 C THR A 70 -5.678 -4.044 -3.975 1.00 0.12 C ATOM 929 O THR A 70 -6.022 -3.491 -2.950 1.00 0.19 O ATOM 930 CB THR A 70 -6.256 -3.001 -6.124 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.174 -3.375 -6.975 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.904 -1.727 -5.395 1.00 0.19 C ATOM 0 H THR A 70 -8.066 -3.229 -3.992 1.00 0.13 H new ATOM 0 HA THR A 70 -6.491 -5.070 -5.661 1.00 0.12 H new ATOM 0 HB THR A 70 -7.142 -2.828 -6.735 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.317 -4.287 -7.304 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.666 -0.948 -6.119 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.751 -1.410 -4.786 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.041 -1.902 -4.753 1.00 0.19 H new ATOM 940 N VAL A 71 -4.559 -4.647 -4.103 1.00 0.13 N ATOM 941 CA VAL A 71 -3.476 -4.314 -3.258 1.00 0.13 C ATOM 942 C VAL A 71 -2.406 -3.670 -4.103 1.00 0.13 C ATOM 943 O VAL A 71 -1.658 -4.354 -4.787 1.00 0.15 O ATOM 944 CB VAL A 71 -2.923 -5.550 -2.549 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.557 -5.252 -1.963 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.875 -6.003 -1.461 1.00 0.17 C ATOM 0 H VAL A 71 -4.367 -5.378 -4.788 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.816 -3.626 -2.484 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.822 -6.354 -3.278 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.175 -6.141 -1.461 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.873 -4.964 -2.762 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.639 -4.437 -1.244 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.468 -6.884 -0.965 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -4.002 -5.202 -0.732 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.841 -6.249 -1.902 1.00 0.17 H new ATOM 956 N LEU A 72 -2.341 -2.358 -4.087 1.00 0.17 N ATOM 957 CA LEU A 72 -1.249 -1.713 -4.793 1.00 0.22 C ATOM 958 C LEU A 72 -0.141 -1.483 -3.802 1.00 0.19 C ATOM 959 O LEU A 72 -0.325 -0.795 -2.810 1.00 0.28 O ATOM 960 CB LEU A 72 -1.584 -0.367 -5.475 1.00 0.43 C ATOM 961 CG LEU A 72 -3.034 -0.036 -5.779 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.735 0.493 -4.540 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.093 0.980 -6.900 1.00 1.00 C ATOM 0 H LEU A 72 -2.998 -1.736 -3.616 1.00 0.17 H new ATOM 0 HA LEU A 72 -0.980 -2.384 -5.609 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.191 0.429 -4.843 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.034 -0.329 -6.415 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.549 -0.944 -6.091 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.773 0.724 -4.780 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.704 -0.262 -3.754 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -3.232 1.397 -4.196 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.133 1.219 -7.120 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.568 1.886 -6.598 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -2.620 0.567 -7.791 1.00 1.00 H new ATOM 975 N ALA A 73 1.002 -2.052 -4.065 1.00 0.22 N ATOM 976 CA ALA A 73 2.111 -1.916 -3.166 1.00 0.30 C ATOM 977 C ALA A 73 3.221 -1.088 -3.795 1.00 0.23 C ATOM 978 O ALA A 73 3.791 -1.451 -4.824 1.00 0.32 O ATOM 979 CB ALA A 73 2.603 -3.281 -2.729 1.00 0.51 C ATOM 0 H ALA A 73 1.189 -2.614 -4.895 1.00 0.22 H new ATOM 0 HA ALA A 73 1.778 -1.382 -2.276 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.445 -3.163 -2.047 1.00 0.51 H new ATOM 0 HB2 ALA A 73 1.798 -3.813 -2.223 1.00 0.51 H new ATOM 0 HB3 ALA A 73 2.921 -3.850 -3.603 1.00 0.51 H new ATOM 985 N PHE A 74 3.499 0.042 -3.176 1.00 0.29 N ATOM 986 CA PHE A 74 4.533 0.948 -3.631 1.00 0.33 C ATOM 987 C PHE A 74 5.838 0.631 -2.908 1.00 0.35 C ATOM 988 O PHE A 74 5.938 0.830 -1.696 1.00 0.37 O ATOM 989 CB PHE A 74 4.115 2.393 -3.348 1.00 0.44 C ATOM 990 CG PHE A 74 2.952 2.897 -4.171 1.00 0.36 C ATOM 991 CD1 PHE A 74 2.183 1.993 -4.882 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.614 4.248 -4.228 1.00 0.41 C ATOM 993 CE1 PHE A 74 1.102 2.417 -5.643 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.538 4.672 -4.976 1.00 0.43 C ATOM 995 CZ PHE A 74 0.839 3.886 -5.686 1.00 0.35 C ATOM 0 H PHE A 74 3.011 0.359 -2.338 1.00 0.29 H new ATOM 0 HA PHE A 74 4.678 0.826 -4.704 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.858 2.480 -2.292 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.972 3.043 -3.522 1.00 0.44 H new ATOM 0 HD1 PHE A 74 2.427 0.942 -4.844 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.202 4.970 -3.680 1.00 0.41 H new ATOM 0 HE1 PHE A 74 0.480 1.716 -6.179 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.278 5.720 -4.957 1.00 0.43 H new ATOM 0 HZ PHE A 74 0.057 4.278 -6.319 1.00 0.35 H new ATOM 1005 N PRO A 75 6.855 0.129 -3.630 1.00 0.37 N ATOM 1006 CA PRO A 75 8.080 -0.349 -3.010 1.00 0.46 C ATOM 1007 C PRO A 75 9.055 0.772 -2.699 1.00 0.61 C ATOM 1008 O PRO A 75 9.943 1.075 -3.486 1.00 1.30 O ATOM 1009 CB PRO A 75 8.651 -1.319 -4.039 1.00 0.54 C ATOM 1010 CG PRO A 75 8.091 -0.893 -5.357 1.00 0.44 C ATOM 1011 CD PRO A 75 6.902 0.011 -5.092 1.00 0.38 C ATOM 0 HA PRO A 75 7.892 -0.815 -2.043 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.740 -1.283 -4.047 1.00 0.54 H new ATOM 0 HB3 PRO A 75 8.368 -2.346 -3.808 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.847 -0.367 -5.940 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.786 -1.762 -5.940 1.00 0.44 H new ATOM 0 HD2 PRO A 75 7.029 0.984 -5.566 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.981 -0.418 -5.486 1.00 0.38 H new ATOM 1019 N SER A 76 8.872 1.343 -1.522 1.00 0.41 N ATOM 1020 CA SER A 76 9.653 2.464 -1.039 1.00 0.37 C ATOM 1021 C SER A 76 11.125 2.287 -1.328 1.00 0.50 C ATOM 1022 O SER A 76 11.691 1.194 -1.205 1.00 0.74 O ATOM 1023 CB SER A 76 9.417 2.634 0.464 1.00 0.53 C ATOM 1024 OG SER A 76 9.833 3.911 0.901 1.00 1.44 O ATOM 0 H SER A 76 8.160 1.032 -0.862 1.00 0.41 H new ATOM 0 HA SER A 76 9.329 3.362 -1.565 1.00 0.37 H new ATOM 0 HB2 SER A 76 8.359 2.496 0.687 1.00 0.53 H new ATOM 0 HB3 SER A 76 9.961 1.864 1.010 1.00 0.53 H new ATOM 0 HG SER A 76 9.232 4.227 1.608 1.00 1.44 H new ATOM 1030 N ASN A 77 11.731 3.387 -1.696 1.00 0.52 N ATOM 1031 CA ASN A 77 13.065 3.366 -2.232 1.00 0.72 C ATOM 1032 C ASN A 77 14.020 4.036 -1.285 1.00 0.70 C ATOM 1033 O ASN A 77 13.767 5.138 -0.814 1.00 0.75 O ATOM 1034 CB ASN A 77 13.118 4.035 -3.611 1.00 0.93 C ATOM 1035 CG ASN A 77 12.357 5.348 -3.684 1.00 0.96 C ATOM 1036 OD1 ASN A 77 11.188 5.370 -4.042 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.012 6.447 -3.353 1.00 1.46 N ATOM 0 H ASN A 77 11.315 4.316 -1.633 1.00 0.52 H new ATOM 0 HA ASN A 77 13.364 2.325 -2.353 1.00 0.72 H new ATOM 0 HB2 ASN A 77 14.160 4.214 -3.878 1.00 0.93 H new ATOM 0 HB3 ASN A 77 12.712 3.348 -4.354 1.00 0.93 H new ATOM 0 HD21 ASN A 77 12.543 7.352 -3.392 1.00 1.46 H new ATOM 0 HD22 ASN A 77 13.987 6.391 -3.059 1.00 1.46 H new ATOM 1044 N GLN A 78 15.130 3.355 -1.047 1.00 0.85 N ATOM 1045 CA GLN A 78 16.188 3.791 -0.136 1.00 0.98 C ATOM 1046 C GLN A 78 16.648 5.230 -0.383 1.00 0.98 C ATOM 1047 O GLN A 78 17.412 5.781 0.407 1.00 1.12 O ATOM 1048 CB GLN A 78 17.365 2.812 -0.209 1.00 1.35 C ATOM 1049 CG GLN A 78 17.788 2.434 -1.627 1.00 2.07 C ATOM 1050 CD GLN A 78 18.557 3.521 -2.362 1.00 2.74 C ATOM 1051 OE1 GLN A 78 18.467 3.635 -3.581 1.00 3.34 O ATOM 1052 NE2 GLN A 78 19.329 4.317 -1.634 1.00 3.30 N ATOM 0 H GLN A 78 15.330 2.459 -1.492 1.00 0.85 H new ATOM 0 HA GLN A 78 15.770 3.787 0.871 1.00 0.98 H new ATOM 0 HB2 GLN A 78 18.219 3.251 0.306 1.00 1.35 H new ATOM 0 HB3 GLN A 78 17.099 1.904 0.332 1.00 1.35 H new ATOM 0 HG2 GLN A 78 18.404 1.536 -1.582 1.00 2.07 H new ATOM 0 HG3 GLN A 78 16.898 2.181 -2.204 1.00 2.07 H new ATOM 0 HE21 GLN A 78 19.379 4.193 -0.623 1.00 3.30 H new ATOM 0 HE22 GLN A 78 19.872 5.053 -2.085 1.00 3.30 H new ATOM 1061 N PHE A 79 16.184 5.828 -1.476 1.00 0.98 N ATOM 1062 CA PHE A 79 16.736 7.094 -1.966 1.00 1.19 C ATOM 1063 C PHE A 79 16.494 8.253 -1.001 1.00 1.20 C ATOM 1064 O PHE A 79 17.109 9.312 -1.132 1.00 1.54 O ATOM 1065 CB PHE A 79 16.122 7.445 -3.317 1.00 1.32 C ATOM 1066 CG PHE A 79 16.625 6.618 -4.463 1.00 1.57 C ATOM 1067 CD1 PHE A 79 17.802 6.956 -5.110 1.00 1.82 C ATOM 1068 CD2 PHE A 79 15.915 5.513 -4.904 1.00 2.02 C ATOM 1069 CE1 PHE A 79 18.260 6.208 -6.176 1.00 2.25 C ATOM 1070 CE2 PHE A 79 16.369 4.761 -5.968 1.00 2.64 C ATOM 1071 CZ PHE A 79 17.543 5.109 -6.605 1.00 2.68 C ATOM 0 H PHE A 79 15.423 5.456 -2.044 1.00 0.98 H new ATOM 0 HA PHE A 79 17.813 6.950 -2.058 1.00 1.19 H new ATOM 0 HB2 PHE A 79 15.040 7.331 -3.251 1.00 1.32 H new ATOM 0 HB3 PHE A 79 16.319 8.496 -3.530 1.00 1.32 H new ATOM 0 HD1 PHE A 79 18.367 7.814 -4.777 1.00 1.82 H new ATOM 0 HD2 PHE A 79 14.996 5.237 -4.409 1.00 2.02 H new ATOM 0 HE1 PHE A 79 19.178 6.482 -6.674 1.00 2.25 H new ATOM 0 HE2 PHE A 79 15.807 3.901 -6.302 1.00 2.64 H new ATOM 0 HZ PHE A 79 17.900 4.522 -7.438 1.00 2.68 H new ATOM 1081 N GLY A 80 15.610 8.056 -0.041 1.00 1.10 N ATOM 1082 CA GLY A 80 15.291 9.120 0.889 1.00 1.22 C ATOM 1083 C GLY A 80 16.043 8.996 2.198 1.00 1.24 C ATOM 1084 O GLY A 80 16.232 9.986 2.908 1.00 1.98 O ATOM 0 H GLY A 80 15.107 7.182 0.114 1.00 1.10 H new ATOM 0 HA2 GLY A 80 15.525 10.081 0.430 1.00 1.22 H new ATOM 0 HA3 GLY A 80 14.219 9.114 1.088 1.00 1.22 H new ATOM 1088 N GLY A 81 16.467 7.779 2.520 1.00 1.18 N ATOM 1089 CA GLY A 81 17.131 7.532 3.786 1.00 1.21 C ATOM 1090 C GLY A 81 16.144 7.520 4.935 1.00 1.14 C ATOM 1091 O GLY A 81 16.528 7.553 6.106 1.00 1.49 O ATOM 0 H GLY A 81 16.362 6.957 1.925 1.00 1.18 H new ATOM 0 HA2 GLY A 81 17.654 6.577 3.744 1.00 1.21 H new ATOM 0 HA3 GLY A 81 17.884 8.301 3.959 1.00 1.21 H new ATOM 1095 N GLN A 82 14.868 7.456 4.588 1.00 0.86 N ATOM 1096 CA GLN A 82 13.784 7.521 5.557 1.00 0.82 C ATOM 1097 C GLN A 82 12.904 6.290 5.439 1.00 0.77 C ATOM 1098 O GLN A 82 11.774 6.280 5.901 1.00 0.91 O ATOM 1099 CB GLN A 82 12.947 8.793 5.327 1.00 0.80 C ATOM 1100 CG GLN A 82 12.770 9.173 3.852 1.00 0.75 C ATOM 1101 CD GLN A 82 11.337 9.079 3.376 1.00 1.09 C ATOM 1102 OE1 GLN A 82 10.571 10.042 3.475 1.00 1.74 O ATOM 1103 NE2 GLN A 82 10.977 7.934 2.822 1.00 1.14 N ATOM 0 H GLN A 82 14.553 7.357 3.623 1.00 0.86 H new ATOM 0 HA GLN A 82 14.209 7.554 6.560 1.00 0.82 H new ATOM 0 HB2 GLN A 82 11.963 8.652 5.775 1.00 0.80 H new ATOM 0 HB3 GLN A 82 13.419 9.624 5.850 1.00 0.80 H new ATOM 0 HG2 GLN A 82 13.129 10.191 3.701 1.00 0.75 H new ATOM 0 HG3 GLN A 82 13.392 8.521 3.239 1.00 0.75 H new ATOM 0 HE21 GLN A 82 11.644 7.165 2.762 1.00 1.14 H new ATOM 0 HE22 GLN A 82 10.032 7.820 2.455 1.00 1.14 H new ATOM 1112 N GLU A 83 13.451 5.245 4.847 1.00 0.75 N ATOM 1113 CA GLU A 83 12.644 4.122 4.393 1.00 0.74 C ATOM 1114 C GLU A 83 12.152 3.240 5.542 1.00 0.72 C ATOM 1115 O GLU A 83 12.854 2.997 6.521 1.00 0.88 O ATOM 1116 CB GLU A 83 13.407 3.297 3.354 1.00 0.87 C ATOM 1117 CG GLU A 83 13.749 4.061 2.077 1.00 1.16 C ATOM 1118 CD GLU A 83 13.190 5.468 2.034 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.956 5.622 1.983 1.00 3.07 O ATOM 1120 OE2 GLU A 83 13.993 6.431 2.046 1.00 2.83 O ATOM 0 H GLU A 83 14.450 5.148 4.668 1.00 0.75 H new ATOM 0 HA GLU A 83 11.753 4.541 3.925 1.00 0.74 H new ATOM 0 HB2 GLU A 83 14.330 2.931 3.804 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.812 2.422 3.092 1.00 0.87 H new ATOM 0 HG2 GLU A 83 14.833 4.108 1.973 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.370 3.504 1.220 1.00 1.16 H new ATOM 1127 N PRO A 84 10.916 2.738 5.380 1.00 0.63 N ATOM 1128 CA PRO A 84 10.150 2.019 6.420 1.00 0.75 C ATOM 1129 C PRO A 84 10.587 0.564 6.617 1.00 1.00 C ATOM 1130 O PRO A 84 10.717 0.097 7.746 1.00 1.75 O ATOM 1131 CB PRO A 84 8.745 2.062 5.836 1.00 1.02 C ATOM 1132 CG PRO A 84 8.946 1.997 4.376 1.00 0.72 C ATOM 1133 CD PRO A 84 10.154 2.836 4.115 1.00 0.61 C ATOM 0 HA PRO A 84 10.273 2.467 7.406 1.00 0.75 H new ATOM 0 HB2 PRO A 84 8.143 1.226 6.191 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.224 2.975 6.124 1.00 1.02 H new ATOM 0 HG2 PRO A 84 9.099 0.970 4.044 1.00 0.72 H new ATOM 0 HG3 PRO A 84 8.077 2.379 3.840 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.729 2.461 3.269 1.00 0.61 H new ATOM 0 HD3 PRO A 84 9.886 3.867 3.886 1.00 0.61 H new ATOM 1141 N GLY A 85 10.811 -0.145 5.508 1.00 1.45 N ATOM 1142 CA GLY A 85 11.121 -1.568 5.567 1.00 1.82 C ATOM 1143 C GLY A 85 12.349 -1.870 6.397 1.00 1.61 C ATOM 1144 O GLY A 85 12.501 -2.978 6.915 1.00 2.20 O ATOM 0 H GLY A 85 10.783 0.244 4.565 1.00 1.45 H new ATOM 0 HA2 GLY A 85 10.267 -2.104 5.982 1.00 1.82 H new ATOM 0 HA3 GLY A 85 11.271 -1.944 4.555 1.00 1.82 H new ATOM 1148 N ASN A 86 13.215 -0.874 6.509 1.00 1.49 N ATOM 1149 CA ASN A 86 14.430 -0.955 7.308 1.00 2.04 C ATOM 1150 C ASN A 86 15.196 0.346 7.130 1.00 1.94 C ATOM 1151 O ASN A 86 15.006 1.283 7.901 1.00 2.70 O ATOM 1152 CB ASN A 86 15.293 -2.164 6.893 1.00 2.78 C ATOM 1153 CG ASN A 86 16.535 -2.366 7.753 1.00 3.58 C ATOM 1154 OD1 ASN A 86 17.140 -1.415 8.246 1.00 4.07 O ATOM 1155 ND2 ASN A 86 16.927 -3.618 7.927 1.00 4.20 N ATOM 0 H ASN A 86 13.093 0.025 6.042 1.00 1.49 H new ATOM 0 HA ASN A 86 14.173 -1.098 8.357 1.00 2.04 H new ATOM 0 HB2 ASN A 86 14.682 -3.066 6.938 1.00 2.78 H new ATOM 0 HB3 ASN A 86 15.600 -2.039 5.855 1.00 2.78 H new ATOM 0 HD21 ASN A 86 17.756 -3.820 8.486 1.00 4.20 H new ATOM 0 HD22 ASN A 86 16.400 -4.381 7.503 1.00 4.20 H new ATOM 1162 N GLU A 87 16.019 0.378 6.076 1.00 1.52 N ATOM 1163 CA GLU A 87 16.765 1.563 5.626 1.00 1.46 C ATOM 1164 C GLU A 87 17.995 1.092 4.869 1.00 1.60 C ATOM 1165 O GLU A 87 18.339 1.614 3.811 1.00 2.15 O ATOM 1166 CB GLU A 87 17.195 2.496 6.778 1.00 1.61 C ATOM 1167 CG GLU A 87 18.176 1.879 7.761 1.00 2.19 C ATOM 1168 CD GLU A 87 18.413 2.758 8.969 1.00 2.58 C ATOM 1169 OE1 GLU A 87 19.132 3.768 8.835 1.00 3.02 O ATOM 1170 OE2 GLU A 87 17.883 2.445 10.057 1.00 2.84 O ATOM 0 H GLU A 87 16.191 -0.442 5.495 1.00 1.52 H new ATOM 0 HA GLU A 87 16.100 2.149 4.992 1.00 1.46 H new ATOM 0 HB2 GLU A 87 17.644 3.394 6.352 1.00 1.61 H new ATOM 0 HB3 GLU A 87 16.306 2.812 7.323 1.00 1.61 H new ATOM 0 HG2 GLU A 87 17.797 0.911 8.088 1.00 2.19 H new ATOM 0 HG3 GLU A 87 19.125 1.696 7.257 1.00 2.19 H new ATOM 1177 N GLU A 88 18.623 0.055 5.409 1.00 1.57 N ATOM 1178 CA GLU A 88 19.870 -0.455 4.874 1.00 1.77 C ATOM 1179 C GLU A 88 19.656 -1.774 4.136 1.00 1.62 C ATOM 1180 O GLU A 88 20.404 -2.100 3.222 1.00 1.62 O ATOM 1181 CB GLU A 88 20.860 -0.661 6.021 1.00 2.18 C ATOM 1182 CG GLU A 88 22.309 -0.727 5.580 1.00 2.68 C ATOM 1183 CD GLU A 88 22.790 0.589 5.017 1.00 3.33 C ATOM 1184 OE1 GLU A 88 22.768 1.596 5.754 1.00 3.66 O ATOM 1185 OE2 GLU A 88 23.205 0.624 3.841 1.00 3.92 O ATOM 0 H GLU A 88 18.281 -0.451 6.226 1.00 1.57 H new ATOM 0 HA GLU A 88 20.265 0.270 4.162 1.00 1.77 H new ATOM 0 HB2 GLU A 88 20.745 0.153 6.737 1.00 2.18 H new ATOM 0 HB3 GLU A 88 20.608 -1.583 6.544 1.00 2.18 H new ATOM 0 HG2 GLU A 88 22.933 -1.008 6.428 1.00 2.68 H new ATOM 0 HG3 GLU A 88 22.424 -1.507 4.827 1.00 2.68 H new ATOM 1192 N GLU A 89 18.610 -2.502 4.522 1.00 1.62 N ATOM 1193 CA GLU A 89 18.378 -3.877 4.058 1.00 1.59 C ATOM 1194 C GLU A 89 18.451 -4.013 2.537 1.00 1.49 C ATOM 1195 O GLU A 89 19.099 -4.921 2.023 1.00 1.59 O ATOM 1196 CB GLU A 89 17.022 -4.367 4.563 1.00 1.70 C ATOM 1197 CG GLU A 89 16.775 -5.855 4.360 1.00 1.75 C ATOM 1198 CD GLU A 89 15.556 -6.330 5.123 1.00 2.11 C ATOM 1199 OE1 GLU A 89 14.440 -6.257 4.576 1.00 2.65 O ATOM 1200 OE2 GLU A 89 15.712 -6.755 6.288 1.00 2.45 O ATOM 0 H GLU A 89 17.897 -2.159 5.165 1.00 1.62 H new ATOM 0 HA GLU A 89 19.178 -4.494 4.467 1.00 1.59 H new ATOM 0 HB2 GLU A 89 16.940 -4.139 5.626 1.00 1.70 H new ATOM 0 HB3 GLU A 89 16.236 -3.808 4.056 1.00 1.70 H new ATOM 0 HG2 GLU A 89 16.642 -6.060 3.298 1.00 1.75 H new ATOM 0 HG3 GLU A 89 17.650 -6.417 4.686 1.00 1.75 H new ATOM 1207 N ILE A 90 17.817 -3.100 1.818 1.00 1.43 N ATOM 1208 CA ILE A 90 17.762 -3.188 0.363 1.00 1.39 C ATOM 1209 C ILE A 90 19.026 -2.625 -0.290 1.00 1.49 C ATOM 1210 O ILE A 90 19.080 -2.433 -1.504 1.00 1.57 O ATOM 1211 CB ILE A 90 16.523 -2.467 -0.199 1.00 1.45 C ATOM 1212 CG1 ILE A 90 16.511 -0.993 0.220 1.00 1.74 C ATOM 1213 CG2 ILE A 90 15.258 -3.169 0.272 1.00 1.76 C ATOM 1214 CD1 ILE A 90 15.343 -0.213 -0.348 1.00 2.15 C ATOM 0 H ILE A 90 17.335 -2.293 2.213 1.00 1.43 H new ATOM 0 HA ILE A 90 17.692 -4.248 0.120 1.00 1.39 H new ATOM 0 HB ILE A 90 16.563 -2.504 -1.288 1.00 1.45 H new ATOM 0 HG12 ILE A 90 16.483 -0.933 1.308 1.00 1.74 H new ATOM 0 HG13 ILE A 90 17.441 -0.524 -0.101 1.00 1.74 H new ATOM 0 HG21 ILE A 90 14.385 -2.654 -0.129 1.00 1.76 H new ATOM 0 HG22 ILE A 90 15.263 -4.201 -0.078 1.00 1.76 H new ATOM 0 HG23 ILE A 90 15.218 -3.156 1.361 1.00 1.76 H new ATOM 0 HD11 ILE A 90 15.398 0.822 -0.011 1.00 2.15 H new ATOM 0 HD12 ILE A 90 15.381 -0.242 -1.437 1.00 2.15 H new ATOM 0 HD13 ILE A 90 14.408 -0.657 -0.006 1.00 2.15 H new ATOM 1226 N LYS A 91 20.041 -2.357 0.525 1.00 1.71 N ATOM 1227 CA LYS A 91 21.328 -1.888 0.026 1.00 1.89 C ATOM 1228 C LYS A 91 22.438 -2.809 0.514 1.00 1.98 C ATOM 1229 O LYS A 91 23.346 -3.168 -0.239 1.00 2.17 O ATOM 1230 CB LYS A 91 21.597 -0.455 0.485 1.00 2.00 C ATOM 1231 CG LYS A 91 20.503 0.528 0.100 1.00 2.10 C ATOM 1232 CD LYS A 91 20.855 1.944 0.521 1.00 2.33 C ATOM 1233 CE LYS A 91 21.073 2.049 2.022 1.00 2.39 C ATOM 1234 NZ LYS A 91 21.394 3.439 2.436 1.00 2.79 N ATOM 0 H LYS A 91 19.996 -2.457 1.539 1.00 1.71 H new ATOM 0 HA LYS A 91 21.303 -1.900 -1.064 1.00 1.89 H new ATOM 0 HB2 LYS A 91 21.715 -0.447 1.569 1.00 2.00 H new ATOM 0 HB3 LYS A 91 22.542 -0.118 0.059 1.00 2.00 H new ATOM 0 HG2 LYS A 91 20.346 0.496 -0.978 1.00 2.10 H new ATOM 0 HG3 LYS A 91 19.564 0.231 0.567 1.00 2.10 H new ATOM 0 HD2 LYS A 91 21.757 2.265 -0.001 1.00 2.33 H new ATOM 0 HD3 LYS A 91 20.055 2.622 0.222 1.00 2.33 H new ATOM 0 HE2 LYS A 91 20.178 1.712 2.544 1.00 2.39 H new ATOM 0 HE3 LYS A 91 21.884 1.385 2.319 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 21.536 3.471 3.466 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 22.263 3.752 1.957 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 20.609 4.069 2.175 1.00 2.79 H new ATOM 1248 N GLU A 92 22.353 -3.189 1.786 1.00 2.07 N ATOM 1249 CA GLU A 92 23.278 -4.147 2.380 1.00 2.27 C ATOM 1250 C GLU A 92 23.072 -5.518 1.748 1.00 2.10 C ATOM 1251 O GLU A 92 23.956 -6.377 1.776 1.00 2.26 O ATOM 1252 CB GLU A 92 23.059 -4.225 3.895 1.00 2.54 C ATOM 1253 CG GLU A 92 21.682 -4.744 4.283 1.00 2.47 C ATOM 1254 CD GLU A 92 21.486 -4.875 5.779 1.00 2.96 C ATOM 1255 OE1 GLU A 92 21.165 -3.864 6.435 1.00 3.20 O ATOM 1256 OE2 GLU A 92 21.632 -6.001 6.298 1.00 3.29 O ATOM 0 H GLU A 92 21.643 -2.842 2.431 1.00 2.07 H new ATOM 0 HA GLU A 92 24.300 -3.818 2.194 1.00 2.27 H new ATOM 0 HB2 GLU A 92 23.819 -4.873 4.331 1.00 2.54 H new ATOM 0 HB3 GLU A 92 23.200 -3.234 4.326 1.00 2.54 H new ATOM 0 HG2 GLU A 92 20.923 -4.072 3.882 1.00 2.47 H new ATOM 0 HG3 GLU A 92 21.524 -5.717 3.817 1.00 2.47 H new ATOM 1263 N PHE A 93 21.890 -5.706 1.186 1.00 1.86 N ATOM 1264 CA PHE A 93 21.547 -6.919 0.475 1.00 1.75 C ATOM 1265 C PHE A 93 20.974 -6.537 -0.876 1.00 1.59 C ATOM 1266 O PHE A 93 20.364 -5.476 -1.015 1.00 1.69 O ATOM 1267 CB PHE A 93 20.506 -7.710 1.262 1.00 1.73 C ATOM 1268 CG PHE A 93 20.395 -9.149 0.853 1.00 2.09 C ATOM 1269 CD1 PHE A 93 21.400 -10.051 1.160 1.00 2.34 C ATOM 1270 CD2 PHE A 93 19.289 -9.595 0.151 1.00 2.65 C ATOM 1271 CE1 PHE A 93 21.302 -11.375 0.778 1.00 2.87 C ATOM 1272 CE2 PHE A 93 19.185 -10.916 -0.238 1.00 3.40 C ATOM 1273 CZ PHE A 93 20.184 -11.819 0.116 1.00 3.42 C ATOM 0 H PHE A 93 21.139 -5.016 1.212 1.00 1.86 H new ATOM 0 HA PHE A 93 22.436 -7.537 0.350 1.00 1.75 H new ATOM 0 HB2 PHE A 93 20.754 -7.663 2.322 1.00 1.73 H new ATOM 0 HB3 PHE A 93 19.534 -7.232 1.140 1.00 1.73 H new ATOM 0 HD1 PHE A 93 22.270 -9.716 1.704 1.00 2.34 H new ATOM 0 HD2 PHE A 93 18.498 -8.902 -0.095 1.00 2.65 H new ATOM 0 HE1 PHE A 93 22.106 -12.062 1.000 1.00 2.87 H new ATOM 0 HE2 PHE A 93 18.333 -11.247 -0.814 1.00 3.40 H new ATOM 0 HZ PHE A 93 20.080 -12.866 -0.129 1.00 3.42 H new ATOM 1283 N VAL A 94 21.186 -7.369 -1.874 1.00 1.62 N ATOM 1284 CA VAL A 94 20.615 -7.120 -3.180 1.00 1.68 C ATOM 1285 C VAL A 94 19.144 -7.509 -3.192 1.00 1.54 C ATOM 1286 O VAL A 94 18.785 -8.664 -2.971 1.00 1.74 O ATOM 1287 CB VAL A 94 21.384 -7.863 -4.294 1.00 2.11 C ATOM 1288 CG1 VAL A 94 21.367 -9.369 -4.083 1.00 2.63 C ATOM 1289 CG2 VAL A 94 20.828 -7.503 -5.662 1.00 2.56 C ATOM 0 H VAL A 94 21.746 -8.219 -1.807 1.00 1.62 H new ATOM 0 HA VAL A 94 20.702 -6.053 -3.383 1.00 1.68 H new ATOM 0 HB VAL A 94 22.424 -7.539 -4.247 1.00 2.11 H new ATOM 0 HG11 VAL A 94 21.918 -9.855 -4.888 1.00 2.63 H new ATOM 0 HG12 VAL A 94 21.834 -9.608 -3.127 1.00 2.63 H new ATOM 0 HG13 VAL A 94 20.337 -9.725 -4.083 1.00 2.63 H new ATOM 0 HG21 VAL A 94 21.384 -8.037 -6.433 1.00 2.56 H new ATOM 0 HG22 VAL A 94 19.776 -7.784 -5.713 1.00 2.56 H new ATOM 0 HG23 VAL A 94 20.925 -6.429 -5.823 1.00 2.56 H new ATOM 1299 N CYS A 95 18.290 -6.532 -3.417 1.00 1.47 N ATOM 1300 CA CYS A 95 16.865 -6.773 -3.419 1.00 1.46 C ATOM 1301 C CYS A 95 16.265 -6.443 -4.759 1.00 1.37 C ATOM 1302 O CYS A 95 16.472 -5.358 -5.304 1.00 1.52 O ATOM 1303 CB CYS A 95 16.177 -5.971 -2.315 1.00 1.77 C ATOM 1304 SG CYS A 95 16.834 -6.296 -0.661 1.00 2.83 S ATOM 0 H CYS A 95 18.559 -5.565 -3.600 1.00 1.47 H new ATOM 0 HA CYS A 95 16.705 -7.834 -3.225 1.00 1.46 H new ATOM 0 HB2 CYS A 95 16.278 -4.908 -2.534 1.00 1.77 H new ATOM 0 HB3 CYS A 95 15.111 -6.198 -2.324 1.00 1.77 H new ATOM 0 HG CYS A 95 16.682 -7.555 -0.373 1.00 2.83 H new ATOM 1310 N THR A 96 15.552 -7.413 -5.296 1.00 1.52 N ATOM 1311 CA THR A 96 14.734 -7.195 -6.456 1.00 1.59 C ATOM 1312 C THR A 96 13.631 -6.212 -6.096 1.00 1.08 C ATOM 1313 O THR A 96 13.292 -6.052 -4.918 1.00 1.31 O ATOM 1314 CB THR A 96 14.137 -8.526 -6.949 1.00 2.27 C ATOM 1315 OG1 THR A 96 13.810 -9.358 -5.823 1.00 2.76 O ATOM 1316 CG2 THR A 96 15.118 -9.254 -7.859 1.00 2.98 C ATOM 0 H THR A 96 15.528 -8.368 -4.937 1.00 1.52 H new ATOM 0 HA THR A 96 15.340 -6.783 -7.263 1.00 1.59 H new ATOM 0 HB THR A 96 13.233 -8.310 -7.518 1.00 2.27 H new ATOM 0 HG1 THR A 96 14.570 -9.941 -5.615 1.00 2.76 H new ATOM 0 HG21 THR A 96 14.675 -10.192 -8.195 1.00 2.98 H new ATOM 0 HG22 THR A 96 15.345 -8.629 -8.723 1.00 2.98 H new ATOM 0 HG23 THR A 96 16.037 -9.463 -7.311 1.00 2.98 H new ATOM 1324 N LYS A 97 13.081 -5.546 -7.093 1.00 1.14 N ATOM 1325 CA LYS A 97 12.092 -4.495 -6.856 1.00 1.11 C ATOM 1326 C LYS A 97 10.725 -5.073 -6.484 1.00 1.04 C ATOM 1327 O LYS A 97 9.691 -4.602 -6.964 1.00 1.76 O ATOM 1328 CB LYS A 97 11.967 -3.566 -8.072 1.00 1.47 C ATOM 1329 CG LYS A 97 11.587 -4.265 -9.371 1.00 1.47 C ATOM 1330 CD LYS A 97 11.344 -3.255 -10.484 1.00 1.89 C ATOM 1331 CE LYS A 97 11.125 -3.927 -11.831 1.00 2.34 C ATOM 1332 NZ LYS A 97 9.935 -4.820 -11.833 1.00 2.72 N ATOM 0 H LYS A 97 13.297 -5.709 -8.076 1.00 1.14 H new ATOM 0 HA LYS A 97 12.448 -3.909 -6.008 1.00 1.11 H new ATOM 0 HB2 LYS A 97 11.220 -2.803 -7.854 1.00 1.47 H new ATOM 0 HB3 LYS A 97 12.916 -3.050 -8.217 1.00 1.47 H new ATOM 0 HG2 LYS A 97 12.382 -4.951 -9.665 1.00 1.47 H new ATOM 0 HG3 LYS A 97 10.690 -4.864 -9.217 1.00 1.47 H new ATOM 0 HD2 LYS A 97 10.474 -2.647 -10.237 1.00 1.89 H new ATOM 0 HD3 LYS A 97 12.196 -2.579 -10.551 1.00 1.89 H new ATOM 0 HE2 LYS A 97 11.004 -3.163 -12.599 1.00 2.34 H new ATOM 0 HE3 LYS A 97 12.011 -4.506 -12.093 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 9.789 -5.201 -12.790 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 10.088 -5.604 -11.168 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 9.095 -4.280 -11.543 1.00 2.72 H new ATOM 1346 N PHE A 98 10.740 -6.077 -5.606 1.00 0.89 N ATOM 1347 CA PHE A 98 9.531 -6.711 -5.107 1.00 0.92 C ATOM 1348 C PHE A 98 8.797 -7.441 -6.235 1.00 1.11 C ATOM 1349 O PHE A 98 9.108 -8.597 -6.518 1.00 2.12 O ATOM 1350 CB PHE A 98 8.652 -5.659 -4.409 1.00 1.15 C ATOM 1351 CG PHE A 98 7.291 -6.109 -3.948 1.00 0.75 C ATOM 1352 CD1 PHE A 98 7.013 -7.457 -3.925 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.310 -5.219 -3.523 1.00 0.96 C ATOM 1354 CE1 PHE A 98 5.793 -7.918 -3.495 1.00 0.94 C ATOM 1355 CE2 PHE A 98 5.084 -5.684 -3.082 1.00 0.87 C ATOM 1356 CZ PHE A 98 4.749 -6.837 -3.131 1.00 0.45 C ATOM 0 H PHE A 98 11.599 -6.471 -5.222 1.00 0.89 H new ATOM 0 HA PHE A 98 9.789 -7.470 -4.368 1.00 0.92 H new ATOM 0 HB2 PHE A 98 9.196 -5.282 -3.543 1.00 1.15 H new ATOM 0 HB3 PHE A 98 8.519 -4.820 -5.092 1.00 1.15 H new ATOM 0 HD1 PHE A 98 7.764 -8.162 -4.250 1.00 1.02 H new ATOM 0 HD2 PHE A 98 6.507 -4.157 -3.537 1.00 0.96 H new ATOM 0 HE1 PHE A 98 5.576 -8.973 -3.416 1.00 0.94 H new ATOM 0 HE2 PHE A 98 4.387 -4.969 -2.670 1.00 0.87 H new ATOM 0 HZ PHE A 98 3.727 -7.116 -2.922 1.00 0.45 H new ATOM 1366 N LYS A 99 7.855 -6.747 -6.884 1.00 0.80 N ATOM 1367 CA LYS A 99 6.997 -7.339 -7.914 1.00 0.78 C ATOM 1368 C LYS A 99 6.106 -8.436 -7.326 1.00 0.79 C ATOM 1369 O LYS A 99 6.536 -9.225 -6.489 1.00 1.43 O ATOM 1370 CB LYS A 99 7.841 -7.882 -9.069 1.00 1.02 C ATOM 1371 CG LYS A 99 7.037 -8.577 -10.156 1.00 1.34 C ATOM 1372 CD LYS A 99 7.947 -9.239 -11.176 1.00 1.63 C ATOM 1373 CE LYS A 99 8.902 -10.218 -10.510 1.00 2.05 C ATOM 1374 NZ LYS A 99 9.782 -10.897 -11.493 1.00 2.69 N ATOM 0 H LYS A 99 7.667 -5.760 -6.709 1.00 0.80 H new ATOM 0 HA LYS A 99 6.346 -6.556 -8.303 1.00 0.78 H new ATOM 0 HB2 LYS A 99 8.398 -7.058 -9.515 1.00 1.02 H new ATOM 0 HB3 LYS A 99 8.574 -8.583 -8.670 1.00 1.02 H new ATOM 0 HG2 LYS A 99 6.385 -9.326 -9.707 1.00 1.34 H new ATOM 0 HG3 LYS A 99 6.394 -7.852 -10.655 1.00 1.34 H new ATOM 0 HD2 LYS A 99 7.345 -9.763 -11.918 1.00 1.63 H new ATOM 0 HD3 LYS A 99 8.516 -8.477 -11.708 1.00 1.63 H new ATOM 0 HE2 LYS A 99 9.515 -9.687 -9.782 1.00 2.05 H new ATOM 0 HE3 LYS A 99 8.329 -10.965 -9.960 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 10.416 -11.555 -10.995 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 9.200 -11.426 -12.173 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 10.348 -10.187 -12.000 1.00 2.69 H new ATOM 1388 N ALA A 100 4.858 -8.482 -7.755 1.00 0.51 N ATOM 1389 CA ALA A 100 3.915 -9.436 -7.201 1.00 0.43 C ATOM 1390 C ALA A 100 2.687 -9.569 -8.076 1.00 0.40 C ATOM 1391 O ALA A 100 2.614 -8.990 -9.160 1.00 0.55 O ATOM 1392 CB ALA A 100 3.503 -9.006 -5.808 1.00 0.43 C ATOM 0 H ALA A 100 4.476 -7.875 -8.480 1.00 0.51 H new ATOM 0 HA ALA A 100 4.408 -10.407 -7.155 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.795 -9.727 -5.399 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.383 -8.958 -5.167 1.00 0.43 H new ATOM 0 HB3 ALA A 100 3.034 -8.023 -5.854 1.00 0.43 H new ATOM 1398 N GLU A 101 1.711 -10.314 -7.574 1.00 0.34 N ATOM 1399 CA GLU A 101 0.489 -10.577 -8.310 1.00 0.40 C ATOM 1400 C GLU A 101 -0.525 -9.452 -8.090 1.00 0.43 C ATOM 1401 O GLU A 101 -1.732 -9.644 -8.256 1.00 0.67 O ATOM 1402 CB GLU A 101 -0.116 -11.914 -7.877 1.00 0.50 C ATOM 1403 CG GLU A 101 0.892 -13.055 -7.810 1.00 0.67 C ATOM 1404 CD GLU A 101 1.551 -13.341 -9.142 1.00 1.24 C ATOM 1405 OE1 GLU A 101 0.964 -14.082 -9.957 1.00 1.57 O ATOM 1406 OE2 GLU A 101 2.656 -12.820 -9.386 1.00 1.99 O ATOM 0 H GLU A 101 1.746 -10.749 -6.652 1.00 0.34 H new ATOM 0 HA GLU A 101 0.734 -10.625 -9.371 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.578 -11.792 -6.897 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -0.910 -12.184 -8.573 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.660 -12.811 -7.076 1.00 0.67 H new ATOM 0 HG3 GLU A 101 0.390 -13.956 -7.459 1.00 0.67 H new ATOM 1413 N PHE A 102 -0.017 -8.284 -7.710 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.830 -7.119 -7.436 1.00 0.40 C ATOM 1415 C PHE A 102 -0.053 -5.857 -7.822 1.00 0.45 C ATOM 1416 O PHE A 102 1.161 -5.912 -8.019 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.271 -7.092 -5.967 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.200 -7.366 -4.986 1.00 0.45 C ATOM 1419 CD1 PHE A 102 0.555 -6.334 -4.488 1.00 0.62 C ATOM 1420 CD2 PHE A 102 0.053 -8.649 -4.574 1.00 0.52 C ATOM 1421 CE1 PHE A 102 1.559 -6.576 -3.583 1.00 0.58 C ATOM 1422 CE2 PHE A 102 1.057 -8.907 -3.669 1.00 0.59 C ATOM 1423 CZ PHE A 102 1.781 -7.892 -3.144 1.00 0.44 C ATOM 0 H PHE A 102 0.983 -8.125 -7.584 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.739 -7.161 -8.036 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.699 -6.113 -5.750 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.065 -7.825 -5.829 1.00 0.84 H new ATOM 0 HD1 PHE A 102 0.358 -5.322 -4.811 1.00 0.62 H new ATOM 0 HD2 PHE A 102 -0.540 -9.463 -4.963 1.00 0.52 H new ATOM 0 HE1 PHE A 102 2.170 -5.766 -3.214 1.00 0.58 H new ATOM 0 HE2 PHE A 102 1.268 -9.925 -3.376 1.00 0.59 H new ATOM 0 HZ PHE A 102 2.527 -8.093 -2.390 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.759 -4.721 -7.955 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.213 -3.449 -8.474 1.00 0.39 C ATOM 1435 C PRO A 103 0.993 -2.899 -7.722 1.00 0.41 C ATOM 1436 O PRO A 103 0.844 -2.103 -6.806 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.396 -2.490 -8.333 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.582 -3.379 -8.393 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.183 -4.585 -7.622 1.00 0.27 C ATOM 0 HA PRO A 103 0.167 -3.587 -9.486 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.355 -1.940 -7.393 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.409 -1.751 -9.134 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.459 -2.901 -7.956 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -2.836 -3.632 -9.422 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.338 -4.451 -6.551 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.755 -5.464 -7.920 1.00 0.27 H new ATOM 1447 N ILE A 104 2.190 -3.293 -8.133 1.00 0.35 N ATOM 1448 CA ILE A 104 3.396 -2.677 -7.603 1.00 0.35 C ATOM 1449 C ILE A 104 3.746 -1.483 -8.479 1.00 0.33 C ATOM 1450 O ILE A 104 3.822 -1.609 -9.706 1.00 0.44 O ATOM 1451 CB ILE A 104 4.603 -3.642 -7.540 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.263 -4.907 -6.741 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.808 -2.931 -6.929 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.275 -4.677 -5.629 1.00 1.34 C ATOM 0 H ILE A 104 2.351 -4.027 -8.823 1.00 0.35 H new ATOM 0 HA ILE A 104 3.189 -2.377 -6.576 1.00 0.35 H new ATOM 0 HB ILE A 104 4.849 -3.948 -8.557 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.862 -5.658 -7.421 1.00 0.52 H new ATOM 0 HG13 ILE A 104 5.181 -5.317 -6.320 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.654 -3.618 -6.888 1.00 0.45 H new ATOM 0 HG22 ILE A 104 6.070 -2.068 -7.541 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.562 -2.599 -5.921 1.00 0.45 H new ATOM 0 HD11 ILE A 104 3.085 -5.617 -5.111 1.00 1.34 H new ATOM 0 HD12 ILE A 104 3.682 -3.950 -4.926 1.00 1.34 H new ATOM 0 HD13 ILE A 104 2.342 -4.297 -6.044 1.00 1.34 H new ATOM 1466 N MET A 105 3.934 -0.328 -7.861 1.00 0.29 N ATOM 1467 CA MET A 105 4.106 0.906 -8.615 1.00 0.30 C ATOM 1468 C MET A 105 5.569 1.153 -8.958 1.00 0.27 C ATOM 1469 O MET A 105 6.423 0.296 -8.731 1.00 0.35 O ATOM 1470 CB MET A 105 3.519 2.096 -7.839 1.00 0.43 C ATOM 1471 CG MET A 105 4.491 2.807 -6.906 1.00 1.50 C ATOM 1472 SD MET A 105 5.037 4.413 -7.535 1.00 2.49 S ATOM 1473 CE MET A 105 3.503 5.333 -7.566 1.00 3.03 C ATOM 0 H MET A 105 3.971 -0.218 -6.848 1.00 0.29 H new ATOM 0 HA MET A 105 3.563 0.801 -9.554 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.133 2.821 -8.555 1.00 0.43 H new ATOM 0 HB3 MET A 105 2.670 1.743 -7.253 1.00 0.43 H new ATOM 0 HG2 MET A 105 4.016 2.947 -5.935 1.00 1.50 H new ATOM 0 HG3 MET A 105 5.362 2.171 -6.746 1.00 1.50 H new ATOM 0 HE1 MET A 105 3.538 6.072 -8.366 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.672 4.649 -7.740 1.00 3.03 H new ATOM 0 HE3 MET A 105 3.363 5.839 -6.611 1.00 3.03 H new ATOM 1483 N ALA A 106 5.846 2.337 -9.487 1.00 0.33 N ATOM 1484 CA ALA A 106 7.202 2.733 -9.882 1.00 0.52 C ATOM 1485 C ALA A 106 8.155 2.741 -8.698 1.00 0.66 C ATOM 1486 O ALA A 106 9.372 2.682 -8.864 1.00 1.46 O ATOM 1487 CB ALA A 106 7.155 4.107 -10.507 1.00 0.70 C ATOM 0 H ALA A 106 5.141 3.054 -9.657 1.00 0.33 H new ATOM 0 HA ALA A 106 7.574 2.003 -10.600 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.160 4.407 -10.803 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.510 4.085 -11.385 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.761 4.822 -9.785 1.00 0.70 H new ATOM 1493 N LYS A 107 7.538 2.746 -7.525 1.00 0.40 N ATOM 1494 CA LYS A 107 8.152 3.028 -6.238 1.00 0.36 C ATOM 1495 C LYS A 107 8.332 4.502 -6.074 1.00 0.38 C ATOM 1496 O LYS A 107 8.838 5.211 -6.948 1.00 0.59 O ATOM 1497 CB LYS A 107 9.482 2.312 -5.964 1.00 0.49 C ATOM 1498 CG LYS A 107 10.739 3.045 -6.424 1.00 0.84 C ATOM 1499 CD LYS A 107 11.979 2.193 -6.231 1.00 0.83 C ATOM 1500 CE LYS A 107 11.853 0.876 -6.969 1.00 0.95 C ATOM 1501 NZ LYS A 107 11.692 1.081 -8.434 1.00 1.76 N ATOM 0 H LYS A 107 6.542 2.542 -7.443 1.00 0.40 H new ATOM 0 HA LYS A 107 7.456 2.626 -5.502 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.561 2.132 -4.892 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.455 1.337 -6.450 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.641 3.314 -7.476 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.844 3.975 -5.866 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.855 2.733 -6.590 1.00 0.83 H new ATOM 0 HD3 LYS A 107 12.134 2.005 -5.169 1.00 0.83 H new ATOM 0 HE2 LYS A 107 12.738 0.267 -6.781 1.00 0.95 H new ATOM 0 HE3 LYS A 107 10.997 0.322 -6.583 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 11.660 0.158 -8.912 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 10.808 1.597 -8.617 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 12.496 1.632 -8.798 1.00 1.76 H new ATOM 1515 N ILE A 108 7.846 4.949 -4.968 1.00 0.31 N ATOM 1516 CA ILE A 108 8.057 6.278 -4.528 1.00 0.35 C ATOM 1517 C ILE A 108 8.561 6.199 -3.110 1.00 0.36 C ATOM 1518 O ILE A 108 8.491 5.138 -2.492 1.00 0.42 O ATOM 1519 CB ILE A 108 6.777 7.129 -4.682 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.533 6.374 -4.199 1.00 0.82 C ATOM 1521 CG2 ILE A 108 6.600 7.486 -6.158 1.00 0.68 C ATOM 1522 CD1 ILE A 108 5.366 6.333 -2.705 1.00 0.64 C ATOM 0 H ILE A 108 7.279 4.386 -4.333 1.00 0.31 H new ATOM 0 HA ILE A 108 8.801 6.787 -5.141 1.00 0.35 H new ATOM 0 HB ILE A 108 6.886 8.026 -4.072 1.00 0.48 H new ATOM 0 HG12 ILE A 108 4.650 6.838 -4.638 1.00 0.82 H new ATOM 0 HG13 ILE A 108 5.576 5.352 -4.575 1.00 0.82 H new ATOM 0 HG21 ILE A 108 5.699 8.087 -6.281 1.00 0.68 H new ATOM 0 HG22 ILE A 108 7.465 8.053 -6.501 1.00 0.68 H new ATOM 0 HG23 ILE A 108 6.509 6.572 -6.745 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.461 5.779 -2.455 1.00 0.64 H new ATOM 0 HD12 ILE A 108 6.228 5.840 -2.256 1.00 0.64 H new ATOM 0 HD13 ILE A 108 5.288 7.350 -2.320 1.00 0.64 H new ATOM 1534 N ASN A 109 9.123 7.278 -2.641 1.00 0.38 N ATOM 1535 CA ASN A 109 9.802 7.320 -1.348 1.00 0.44 C ATOM 1536 C ASN A 109 8.814 7.211 -0.193 1.00 0.47 C ATOM 1537 O ASN A 109 8.774 8.093 0.663 1.00 0.76 O ATOM 1538 CB ASN A 109 10.560 8.641 -1.259 1.00 0.53 C ATOM 1539 CG ASN A 109 11.979 8.512 -0.755 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.862 9.258 -1.182 1.00 1.73 O ATOM 1541 ND2 ASN A 109 12.213 7.592 0.154 1.00 1.16 N ATOM 0 H ASN A 109 9.130 8.168 -3.139 1.00 0.38 H new ATOM 0 HA ASN A 109 10.484 6.473 -1.272 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.578 9.103 -2.246 1.00 0.53 H new ATOM 0 HB3 ASN A 109 10.013 9.316 -0.601 1.00 0.53 H new ATOM 0 HD21 ASN A 109 13.153 7.476 0.532 1.00 1.16 H new ATOM 0 HD22 ASN A 109 11.454 6.994 0.482 1.00 1.16 H new ATOM 1548 N VAL A 110 8.036 6.123 -0.158 1.00 0.41 N ATOM 1549 CA VAL A 110 6.945 6.001 0.798 1.00 0.42 C ATOM 1550 C VAL A 110 7.466 5.977 2.218 1.00 0.44 C ATOM 1551 O VAL A 110 7.873 4.930 2.724 1.00 0.48 O ATOM 1552 CB VAL A 110 6.124 4.704 0.601 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.654 5.018 0.510 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.567 3.904 -0.611 1.00 0.77 C ATOM 0 H VAL A 110 8.146 5.322 -0.780 1.00 0.41 H new ATOM 0 HA VAL A 110 6.310 6.869 0.624 1.00 0.42 H new ATOM 0 HB VAL A 110 6.308 4.082 1.477 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.092 4.094 0.372 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.329 5.506 1.429 1.00 0.60 H new ATOM 0 HG13 VAL A 110 4.475 5.681 -0.336 1.00 0.60 H new ATOM 0 HG21 VAL A 110 5.955 3.006 -0.698 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.451 4.510 -1.509 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.613 3.621 -0.497 1.00 0.77 H new ATOM 1564 N ASN A 111 7.443 7.142 2.845 1.00 0.48 N ATOM 1565 CA ASN A 111 7.646 7.284 4.269 1.00 0.56 C ATOM 1566 C ASN A 111 7.634 8.764 4.608 1.00 0.62 C ATOM 1567 O ASN A 111 7.499 9.591 3.705 1.00 0.67 O ATOM 1568 CB ASN A 111 8.956 6.653 4.730 1.00 0.65 C ATOM 1569 CG ASN A 111 8.878 6.223 6.186 1.00 1.20 C ATOM 1570 OD1 ASN A 111 9.176 6.992 7.100 1.00 1.90 O ATOM 1571 ND2 ASN A 111 8.445 5.000 6.412 1.00 1.72 N ATOM 0 H ASN A 111 7.280 8.028 2.366 1.00 0.48 H new ATOM 0 HA ASN A 111 6.843 6.761 4.789 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.186 5.790 4.105 1.00 0.65 H new ATOM 0 HB3 ASN A 111 9.771 7.366 4.602 1.00 0.65 H new ATOM 0 HD21 ASN A 111 8.347 4.662 7.370 1.00 1.72 H new ATOM 0 HD22 ASN A 111 8.207 4.390 5.630 1.00 1.72 H new ATOM 1578 N GLY A 112 7.763 9.065 5.898 1.00 0.73 N ATOM 1579 CA GLY A 112 8.035 10.411 6.383 1.00 0.85 C ATOM 1580 C GLY A 112 7.514 11.543 5.517 1.00 0.93 C ATOM 1581 O GLY A 112 6.316 11.842 5.507 1.00 1.47 O ATOM 0 H GLY A 112 7.680 8.372 6.642 1.00 0.73 H new ATOM 0 HA2 GLY A 112 7.603 10.512 7.379 1.00 0.85 H new ATOM 0 HA3 GLY A 112 9.113 10.527 6.490 1.00 0.85 H new ATOM 1585 N GLU A 113 8.436 12.167 4.793 1.00 0.88 N ATOM 1586 CA GLU A 113 8.156 13.405 4.082 1.00 1.23 C ATOM 1587 C GLU A 113 8.061 13.228 2.569 1.00 1.10 C ATOM 1588 O GLU A 113 7.294 13.929 1.915 1.00 1.39 O ATOM 1589 CB GLU A 113 9.224 14.441 4.427 1.00 1.61 C ATOM 1590 CG GLU A 113 10.644 13.916 4.303 1.00 1.83 C ATOM 1591 CD GLU A 113 11.681 14.924 4.742 1.00 2.29 C ATOM 1592 OE1 GLU A 113 11.769 15.198 5.957 1.00 2.81 O ATOM 1593 OE2 GLU A 113 12.417 15.442 3.878 1.00 2.65 O ATOM 0 H GLU A 113 9.393 11.830 4.684 1.00 0.88 H new ATOM 0 HA GLU A 113 7.174 13.747 4.410 1.00 1.23 H new ATOM 0 HB2 GLU A 113 9.106 15.304 3.772 1.00 1.61 H new ATOM 0 HB3 GLU A 113 9.063 14.791 5.447 1.00 1.61 H new ATOM 0 HG2 GLU A 113 10.746 13.012 4.903 1.00 1.83 H new ATOM 0 HG3 GLU A 113 10.833 13.634 3.267 1.00 1.83 H new ATOM 1600 N ASN A 114 8.822 12.296 2.006 1.00 0.79 N ATOM 1601 CA ASN A 114 8.954 12.227 0.551 1.00 0.79 C ATOM 1602 C ASN A 114 7.973 11.248 -0.041 1.00 0.79 C ATOM 1603 O ASN A 114 7.970 11.071 -1.257 1.00 1.22 O ATOM 1604 CB ASN A 114 10.346 11.768 0.119 1.00 0.87 C ATOM 1605 CG ASN A 114 11.480 12.533 0.774 1.00 1.45 C ATOM 1606 OD1 ASN A 114 11.933 13.553 0.254 1.00 2.06 O ATOM 1607 ND2 ASN A 114 11.960 12.040 1.905 1.00 2.16 N ATOM 0 H ASN A 114 9.348 11.590 2.520 1.00 0.79 H new ATOM 0 HA ASN A 114 8.764 13.239 0.193 1.00 0.79 H new ATOM 0 HB2 ASN A 114 10.456 10.708 0.350 1.00 0.87 H new ATOM 0 HB3 ASN A 114 10.431 11.869 -0.963 1.00 0.87 H new ATOM 0 HD21 ASN A 114 12.733 12.508 2.378 1.00 2.16 H new ATOM 0 HD22 ASN A 114 11.557 11.192 2.304 1.00 2.16 H new ATOM 1614 N ALA A 115 7.152 10.636 0.818 1.00 0.59 N ATOM 1615 CA ALA A 115 6.294 9.514 0.439 1.00 0.61 C ATOM 1616 C ALA A 115 5.735 9.649 -0.969 1.00 0.68 C ATOM 1617 O ALA A 115 6.352 9.197 -1.933 1.00 1.26 O ATOM 1618 CB ALA A 115 5.170 9.322 1.448 1.00 0.86 C ATOM 0 H ALA A 115 7.065 10.907 1.798 1.00 0.59 H new ATOM 0 HA ALA A 115 6.926 8.626 0.444 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.547 8.482 1.143 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.594 9.121 2.432 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.563 10.226 1.493 1.00 0.86 H new ATOM 1624 N HIS A 116 4.563 10.250 -1.077 1.00 0.42 N ATOM 1625 CA HIS A 116 3.966 10.571 -2.336 1.00 0.35 C ATOM 1626 C HIS A 116 2.620 11.168 -2.024 1.00 0.29 C ATOM 1627 O HIS A 116 1.962 10.672 -1.128 1.00 0.29 O ATOM 1628 CB HIS A 116 3.863 9.294 -3.193 1.00 0.35 C ATOM 1629 CG HIS A 116 2.910 9.386 -4.315 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.591 9.544 -4.084 1.00 0.33 N ATOM 1631 CD2 HIS A 116 3.073 9.426 -5.653 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.962 9.703 -5.203 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.828 9.632 -6.193 1.00 0.32 N ATOM 0 H HIS A 116 4.001 10.528 -0.273 1.00 0.42 H new ATOM 0 HA HIS A 116 4.556 11.283 -2.913 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.850 9.057 -3.590 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.570 8.463 -2.551 1.00 0.35 H new ATOM 0 HD2 HIS A 116 4.001 9.317 -6.194 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.100 9.867 -5.308 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.611 9.715 -7.186 1.00 0.32 H new ATOM 1642 N PRO A 117 2.212 12.240 -2.725 1.00 0.31 N ATOM 1643 CA PRO A 117 0.938 12.929 -2.512 1.00 0.31 C ATOM 1644 C PRO A 117 -0.183 12.008 -2.009 1.00 0.26 C ATOM 1645 O PRO A 117 -0.869 12.334 -1.058 1.00 0.27 O ATOM 1646 CB PRO A 117 0.611 13.473 -3.907 1.00 0.37 C ATOM 1647 CG PRO A 117 1.890 13.428 -4.698 1.00 0.40 C ATOM 1648 CD PRO A 117 2.972 12.909 -3.786 1.00 0.38 C ATOM 0 HA PRO A 117 1.016 13.691 -1.737 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.162 12.872 -4.386 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.229 14.492 -3.846 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.780 12.781 -5.568 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.146 14.420 -5.069 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.639 12.219 -4.302 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.591 13.716 -3.393 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.324 10.845 -2.640 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.322 9.848 -2.264 1.00 0.23 C ATOM 1658 C LEU A 118 -1.093 9.317 -0.841 1.00 0.27 C ATOM 1659 O LEU A 118 -2.004 9.309 -0.022 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.280 8.722 -3.287 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.135 7.503 -2.991 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.590 7.823 -3.243 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.690 6.322 -3.833 1.00 0.27 C ATOM 0 H LEU A 118 0.255 10.566 -3.432 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.309 10.310 -2.260 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.586 9.127 -4.252 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.245 8.395 -3.392 1.00 0.24 H new ATOM 0 HG LEU A 118 -2.013 7.233 -1.942 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.198 6.944 -3.029 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.899 8.645 -2.597 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.724 8.111 -4.286 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.315 5.458 -3.607 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.785 6.572 -4.890 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.650 6.086 -3.608 1.00 0.27 H new ATOM 1675 N TYR A 119 0.128 8.881 -0.550 1.00 0.32 N ATOM 1676 CA TYR A 119 0.463 8.365 0.777 1.00 0.42 C ATOM 1677 C TYR A 119 0.641 9.464 1.788 1.00 0.40 C ATOM 1678 O TYR A 119 0.301 9.292 2.952 1.00 0.41 O ATOM 1679 CB TYR A 119 1.731 7.552 0.751 1.00 0.57 C ATOM 1680 CG TYR A 119 1.528 6.157 0.280 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.443 5.870 -1.073 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.382 5.136 1.187 1.00 1.09 C ATOM 1683 CE1 TYR A 119 1.202 4.587 -1.506 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.158 3.855 0.771 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.244 3.562 -0.605 1.00 2.20 C ATOM 1686 OH TYR A 119 0.793 2.304 -1.000 1.00 3.04 O ATOM 0 H TYR A 119 0.903 8.874 -1.213 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.380 7.738 1.068 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.456 8.044 0.103 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.161 7.531 1.752 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.567 6.663 -1.796 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.445 5.349 2.244 1.00 1.09 H new ATOM 0 HE1 TYR A 119 0.982 4.393 -2.545 1.00 1.74 H new ATOM 0 HE2 TYR A 119 0.919 3.080 1.484 1.00 1.88 H new ATOM 0 HH TYR A 119 1.347 1.975 -1.739 1.00 3.04 H new ATOM 1696 N GLU A 120 1.206 10.578 1.360 1.00 0.40 N ATOM 1697 CA GLU A 120 1.309 11.729 2.224 1.00 0.42 C ATOM 1698 C GLU A 120 -0.079 12.149 2.578 1.00 0.37 C ATOM 1699 O GLU A 120 -0.327 12.631 3.670 1.00 0.43 O ATOM 1700 CB GLU A 120 2.060 12.876 1.556 1.00 0.50 C ATOM 1701 CG GLU A 120 3.531 12.597 1.313 1.00 0.76 C ATOM 1702 CD GLU A 120 4.228 13.781 0.684 1.00 1.58 C ATOM 1703 OE1 GLU A 120 4.376 14.817 1.364 1.00 1.93 O ATOM 1704 OE2 GLU A 120 4.665 13.663 -0.482 1.00 2.44 O ATOM 0 H GLU A 120 1.596 10.706 0.426 1.00 0.40 H new ATOM 0 HA GLU A 120 1.877 11.466 3.116 1.00 0.42 H new ATOM 0 HB2 GLU A 120 1.582 13.102 0.603 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.968 13.767 2.178 1.00 0.50 H new ATOM 0 HG2 GLU A 120 4.015 12.349 2.258 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.634 11.727 0.664 1.00 0.76 H new ATOM 1711 N TYR A 121 -0.998 11.909 1.656 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.401 12.100 1.969 1.00 0.28 C ATOM 1713 C TYR A 121 -2.893 11.015 2.917 1.00 0.27 C ATOM 1714 O TYR A 121 -3.741 11.261 3.774 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.254 12.088 0.711 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.725 12.069 1.006 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.343 13.176 1.556 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.488 10.938 0.759 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.683 13.162 1.852 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.831 10.912 1.055 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.427 12.030 1.602 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.770 12.019 1.905 1.00 0.56 O ATOM 0 H TYR A 121 -0.803 11.589 0.707 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.496 13.074 2.450 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.020 12.967 0.110 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -2.997 11.215 0.112 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -4.763 14.065 1.756 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.021 10.065 0.328 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.153 14.036 2.280 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.414 10.024 0.861 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.158 12.896 1.704 1.00 0.56 H new ATOM 1732 N MET A 122 -2.336 9.827 2.781 1.00 0.27 N ATOM 1733 CA MET A 122 -2.868 8.661 3.463 1.00 0.29 C ATOM 1734 C MET A 122 -2.538 8.719 4.946 1.00 0.33 C ATOM 1735 O MET A 122 -3.422 8.604 5.796 1.00 0.35 O ATOM 1736 CB MET A 122 -2.353 7.367 2.841 1.00 0.33 C ATOM 1737 CG MET A 122 -3.473 6.398 2.535 1.00 0.71 C ATOM 1738 SD MET A 122 -3.036 5.200 1.269 1.00 0.56 S ATOM 1739 CE MET A 122 -3.174 6.236 -0.174 1.00 0.55 C ATOM 0 H MET A 122 -1.515 9.643 2.204 1.00 0.27 H new ATOM 0 HA MET A 122 -3.952 8.669 3.348 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.812 7.597 1.923 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.642 6.896 3.520 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.749 5.870 3.448 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.351 6.956 2.212 1.00 0.71 H new ATOM 0 HE1 MET A 122 -3.986 5.875 -0.805 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.381 7.261 0.133 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.239 6.207 -0.734 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.258 8.911 5.256 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.834 9.082 6.639 1.00 0.45 C ATOM 1751 C LYS A 123 -1.285 10.431 7.188 1.00 0.47 C ATOM 1752 O LYS A 123 -1.432 10.588 8.397 1.00 0.54 O ATOM 1753 CB LYS A 123 0.680 8.859 6.822 1.00 0.53 C ATOM 1754 CG LYS A 123 1.550 9.248 5.638 1.00 0.48 C ATOM 1755 CD LYS A 123 1.781 10.754 5.533 1.00 1.00 C ATOM 1756 CE LYS A 123 2.774 11.266 6.570 1.00 1.05 C ATOM 1757 NZ LYS A 123 3.092 12.710 6.366 1.00 1.46 N ATOM 0 H LYS A 123 -0.503 8.952 4.572 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.327 8.306 7.225 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.010 9.425 7.693 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.850 7.805 7.044 1.00 0.53 H new ATOM 0 HG2 LYS A 123 2.513 8.744 5.721 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.083 8.893 4.719 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.147 10.993 4.535 1.00 1.00 H new ATOM 0 HD3 LYS A 123 0.831 11.274 5.657 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.363 11.122 7.569 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.692 10.680 6.515 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 3.770 13.022 7.090 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 3.507 12.844 5.422 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 2.220 13.272 6.443 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.500 11.408 6.303 1.00 0.43 N ATOM 1772 CA LYS A 124 -2.092 12.674 6.722 1.00 0.50 C ATOM 1773 C LYS A 124 -3.518 12.441 7.202 1.00 0.49 C ATOM 1774 O LYS A 124 -4.023 13.141 8.081 1.00 0.57 O ATOM 1775 CB LYS A 124 -2.063 13.712 5.588 1.00 0.56 C ATOM 1776 CG LYS A 124 -3.413 14.323 5.231 1.00 0.59 C ATOM 1777 CD LYS A 124 -3.271 15.371 4.139 1.00 0.97 C ATOM 1778 CE LYS A 124 -4.620 15.927 3.709 1.00 1.41 C ATOM 1779 NZ LYS A 124 -5.359 16.555 4.837 1.00 1.99 N ATOM 0 H LYS A 124 -1.277 11.347 5.310 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.499 13.075 7.544 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.382 14.515 5.870 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -1.649 13.241 4.697 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -4.094 13.539 4.900 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.856 14.776 6.118 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -2.640 16.185 4.496 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -2.768 14.932 3.278 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -4.471 16.664 2.920 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -5.223 15.124 3.285 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -6.196 17.051 4.470 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -5.659 15.819 5.508 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -4.739 17.235 5.322 1.00 1.99 H new ATOM 1793 N THR A 125 -4.155 11.442 6.614 1.00 0.42 N ATOM 1794 CA THR A 125 -5.513 11.085 6.985 1.00 0.44 C ATOM 1795 C THR A 125 -5.531 10.255 8.268 1.00 0.44 C ATOM 1796 O THR A 125 -6.302 10.535 9.187 1.00 0.56 O ATOM 1797 CB THR A 125 -6.216 10.312 5.850 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.236 11.118 4.661 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.641 9.936 6.236 1.00 0.59 C ATOM 0 H THR A 125 -3.752 10.863 5.877 1.00 0.42 H new ATOM 0 HA THR A 125 -6.057 12.013 7.161 1.00 0.44 H new ATOM 0 HB THR A 125 -5.659 9.393 5.668 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.400 10.991 4.165 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.109 9.393 5.415 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.623 9.306 7.125 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.212 10.841 6.444 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.675 9.245 8.339 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.646 8.375 9.503 1.00 0.54 C ATOM 1809 C LYS A 126 -3.224 7.997 9.897 1.00 0.57 C ATOM 1810 O LYS A 126 -2.477 7.414 9.105 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.483 7.120 9.252 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.466 6.135 10.412 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.575 5.109 10.279 1.00 0.92 C ATOM 1814 CE LYS A 126 -7.923 5.689 10.679 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.028 5.890 12.148 1.00 1.85 N ATOM 0 H LYS A 126 -3.999 9.011 7.612 1.00 0.44 H new ATOM 0 HA LYS A 126 -5.078 8.930 10.336 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.513 7.414 9.051 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -5.114 6.620 8.356 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -4.501 5.629 10.448 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -5.578 6.675 11.352 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.622 4.754 9.250 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.350 4.245 10.904 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -8.073 6.642 10.171 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.718 5.022 10.346 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -9.024 6.040 12.408 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -7.665 5.049 12.640 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -7.469 6.722 12.425 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.840 8.321 11.145 1.00 0.77 N ATOM 1830 CA PRO A 127 -1.546 7.953 11.717 1.00 1.04 C ATOM 1831 C PRO A 127 -1.521 6.498 12.186 1.00 1.27 C ATOM 1832 O PRO A 127 -0.853 6.155 13.159 1.00 1.69 O ATOM 1833 CB PRO A 127 -1.377 8.908 12.911 1.00 1.28 C ATOM 1834 CG PRO A 127 -2.570 9.812 12.891 1.00 1.22 C ATOM 1835 CD PRO A 127 -3.630 9.100 12.100 1.00 0.95 C ATOM 0 HA PRO A 127 -0.743 8.037 10.985 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -1.323 8.354 13.848 1.00 1.28 H new ATOM 0 HB3 PRO A 127 -0.453 9.480 12.825 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -2.916 10.021 13.903 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -2.323 10.770 12.434 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -4.248 8.462 12.732 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -4.300 9.798 11.599 1.00 0.95 H new ATOM 1843 N GLY A 128 -2.269 5.655 11.481 1.00 1.55 N ATOM 1844 CA GLY A 128 -2.207 4.227 11.706 1.00 1.96 C ATOM 1845 C GLY A 128 -3.121 3.758 12.812 1.00 2.13 C ATOM 1846 O GLY A 128 -3.643 4.562 13.583 1.00 2.59 O ATOM 0 H GLY A 128 -2.922 5.942 10.752 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -2.469 3.709 10.783 1.00 1.96 H new ATOM 0 HA3 GLY A 128 -1.182 3.948 11.948 1.00 1.96 H new ATOM 1850 N ILE A 129 -3.332 2.451 12.867 1.00 2.17 N ATOM 1851 CA ILE A 129 -4.072 1.842 13.959 1.00 2.46 C ATOM 1852 C ILE A 129 -3.185 1.840 15.197 1.00 2.36 C ATOM 1853 O ILE A 129 -3.643 2.029 16.326 1.00 2.70 O ATOM 1854 CB ILE A 129 -4.490 0.400 13.614 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -5.056 0.340 12.192 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -5.514 -0.106 14.616 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -5.500 -1.046 11.768 1.00 3.58 C ATOM 0 H ILE A 129 -2.999 1.791 12.164 1.00 2.17 H new ATOM 0 HA ILE A 129 -4.981 2.416 14.139 1.00 2.46 H new ATOM 0 HB ILE A 129 -3.611 -0.242 13.665 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -5.904 1.021 12.120 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -4.299 0.698 11.494 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -5.800 -1.126 14.360 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -5.082 -0.091 15.617 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -6.395 0.535 14.591 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -5.889 -1.008 10.750 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -4.651 -1.728 11.807 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -6.280 -1.400 12.442 1.00 3.58 H new ATOM 1869 N LEU A 130 -1.900 1.625 14.953 1.00 2.12 N ATOM 1870 CA LEU A 130 -0.875 1.808 15.962 1.00 2.29 C ATOM 1871 C LEU A 130 -0.382 3.246 15.884 1.00 2.20 C ATOM 1872 O LEU A 130 -0.360 3.832 14.802 1.00 2.44 O ATOM 1873 CB LEU A 130 0.296 0.830 15.751 1.00 2.58 C ATOM 1874 CG LEU A 130 1.118 1.017 14.463 1.00 2.89 C ATOM 1875 CD1 LEU A 130 2.443 0.279 14.568 1.00 3.36 C ATOM 1876 CD2 LEU A 130 0.352 0.522 13.243 1.00 3.47 C ATOM 0 H LEU A 130 -1.542 1.319 14.048 1.00 2.12 H new ATOM 0 HA LEU A 130 -1.295 1.604 16.947 1.00 2.29 H new ATOM 0 HB2 LEU A 130 0.971 0.916 16.603 1.00 2.58 H new ATOM 0 HB3 LEU A 130 -0.101 -0.185 15.759 1.00 2.58 H new ATOM 0 HG LEU A 130 1.307 2.084 14.343 1.00 2.89 H new ATOM 0 HD11 LEU A 130 3.012 0.421 13.649 1.00 3.36 H new ATOM 0 HD12 LEU A 130 3.012 0.670 15.412 1.00 3.36 H new ATOM 0 HD13 LEU A 130 2.256 -0.784 14.718 1.00 3.36 H new ATOM 0 HD21 LEU A 130 0.958 0.667 12.349 1.00 3.47 H new ATOM 0 HD22 LEU A 130 0.127 -0.538 13.360 1.00 3.47 H new ATOM 0 HD23 LEU A 130 -0.578 1.082 13.146 1.00 3.47 H new ATOM 1888 N ALA A 131 -0.002 3.811 17.019 1.00 2.45 N ATOM 1889 CA ALA A 131 0.425 5.202 17.074 1.00 2.67 C ATOM 1890 C ALA A 131 1.779 5.377 16.401 1.00 2.55 C ATOM 1891 O ALA A 131 2.823 5.274 17.043 1.00 3.21 O ATOM 1892 CB ALA A 131 0.473 5.681 18.518 1.00 3.28 C ATOM 0 H ALA A 131 0.020 3.327 17.917 1.00 2.45 H new ATOM 0 HA ALA A 131 -0.300 5.809 16.532 1.00 2.67 H new ATOM 0 HB1 ALA A 131 0.794 6.722 18.545 1.00 3.28 H new ATOM 0 HB2 ALA A 131 -0.518 5.595 18.963 1.00 3.28 H new ATOM 0 HB3 ALA A 131 1.178 5.069 19.081 1.00 3.28 H new ATOM 1898 N THR A 132 1.754 5.601 15.098 1.00 2.02 N ATOM 1899 CA THR A 132 2.967 5.798 14.329 1.00 2.10 C ATOM 1900 C THR A 132 2.702 6.735 13.154 1.00 1.56 C ATOM 1901 O THR A 132 1.771 6.510 12.374 1.00 2.12 O ATOM 1902 CB THR A 132 3.517 4.452 13.816 1.00 2.73 C ATOM 1903 OG1 THR A 132 3.640 3.535 14.912 1.00 3.34 O ATOM 1904 CG2 THR A 132 4.873 4.634 13.159 1.00 3.56 C ATOM 0 H THR A 132 0.897 5.651 14.548 1.00 2.02 H new ATOM 0 HA THR A 132 3.714 6.249 14.983 1.00 2.10 H new ATOM 0 HB THR A 132 2.822 4.057 13.075 1.00 2.73 H new ATOM 0 HG1 THR A 132 3.988 2.679 14.585 1.00 3.34 H new ATOM 0 HG21 THR A 132 5.239 3.670 12.806 1.00 3.56 H new ATOM 0 HG22 THR A 132 4.780 5.318 12.315 1.00 3.56 H new ATOM 0 HG23 THR A 132 5.576 5.045 13.883 1.00 3.56 H new ATOM 1912 N LYS A 133 3.528 7.776 13.046 1.00 1.29 N ATOM 1913 CA LYS A 133 3.354 8.852 12.060 1.00 1.47 C ATOM 1914 C LYS A 133 2.938 8.318 10.697 1.00 1.14 C ATOM 1915 O LYS A 133 1.814 8.543 10.240 1.00 1.58 O ATOM 1916 CB LYS A 133 4.658 9.632 11.908 1.00 2.24 C ATOM 1917 CG LYS A 133 5.190 10.178 13.226 1.00 3.04 C ATOM 1918 CD LYS A 133 6.476 10.975 13.051 1.00 3.81 C ATOM 1919 CE LYS A 133 6.252 12.229 12.223 1.00 4.63 C ATOM 1920 NZ LYS A 133 7.449 13.111 12.218 1.00 5.17 N ATOM 0 H LYS A 133 4.345 7.901 13.644 1.00 1.29 H new ATOM 0 HA LYS A 133 2.560 9.502 12.428 1.00 1.47 H new ATOM 0 HB2 LYS A 133 5.411 8.983 11.461 1.00 2.24 H new ATOM 0 HB3 LYS A 133 4.500 10.460 11.217 1.00 2.24 H new ATOM 0 HG2 LYS A 133 4.432 10.813 13.685 1.00 3.04 H new ATOM 0 HG3 LYS A 133 5.370 9.350 13.912 1.00 3.04 H new ATOM 0 HD2 LYS A 133 6.869 11.251 14.030 1.00 3.81 H new ATOM 0 HD3 LYS A 133 7.228 10.351 12.569 1.00 3.81 H new ATOM 0 HE2 LYS A 133 6.003 11.949 11.199 1.00 4.63 H new ATOM 0 HE3 LYS A 133 5.398 12.778 12.619 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 7.256 13.955 11.642 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 7.672 13.400 13.192 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 8.258 12.596 11.816 1.00 5.17 H new ATOM 1934 N ALA A 134 3.844 7.607 10.058 1.00 0.92 N ATOM 1935 CA ALA A 134 3.582 7.060 8.747 1.00 0.77 C ATOM 1936 C ALA A 134 3.657 5.545 8.784 1.00 0.81 C ATOM 1937 O ALA A 134 3.920 4.965 9.836 1.00 1.59 O ATOM 1938 CB ALA A 134 4.570 7.619 7.734 1.00 1.02 C ATOM 0 H ALA A 134 4.770 7.395 10.428 1.00 0.92 H new ATOM 0 HA ALA A 134 2.576 7.349 8.443 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.360 7.198 6.751 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.474 8.704 7.692 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.585 7.356 8.032 1.00 1.02 H new ATOM 1944 N ILE A 135 3.392 4.933 7.634 1.00 0.69 N ATOM 1945 CA ILE A 135 3.546 3.491 7.417 1.00 0.74 C ATOM 1946 C ILE A 135 4.741 2.916 8.210 1.00 1.09 C ATOM 1947 O ILE A 135 4.583 1.964 8.965 1.00 2.00 O ATOM 1948 CB ILE A 135 3.746 3.200 5.911 1.00 0.86 C ATOM 1949 CG1 ILE A 135 4.311 4.430 5.163 1.00 0.88 C ATOM 1950 CG2 ILE A 135 2.434 2.753 5.286 1.00 1.54 C ATOM 1951 CD1 ILE A 135 3.274 5.449 4.726 1.00 0.89 C ATOM 0 H ILE A 135 3.058 5.431 6.809 1.00 0.69 H new ATOM 0 HA ILE A 135 2.636 3.008 7.773 1.00 0.74 H new ATOM 0 HB ILE A 135 4.477 2.396 5.819 1.00 0.86 H new ATOM 0 HG12 ILE A 135 5.037 4.926 5.807 1.00 0.88 H new ATOM 0 HG13 ILE A 135 4.851 4.084 4.282 1.00 0.88 H new ATOM 0 HG21 ILE A 135 2.586 2.551 4.226 1.00 1.54 H new ATOM 0 HG22 ILE A 135 2.085 1.847 5.782 1.00 1.54 H new ATOM 0 HG23 ILE A 135 1.689 3.540 5.402 1.00 1.54 H new ATOM 0 HD11 ILE A 135 3.768 6.273 4.211 1.00 0.89 H new ATOM 0 HD12 ILE A 135 2.560 4.976 4.052 1.00 0.89 H new ATOM 0 HD13 ILE A 135 2.748 5.831 5.601 1.00 0.89 H new ATOM 1963 N LYS A 136 5.910 3.562 8.044 1.00 0.85 N ATOM 1964 CA LYS A 136 7.167 3.268 8.785 1.00 1.14 C ATOM 1965 C LYS A 136 7.681 1.808 8.704 1.00 0.75 C ATOM 1966 O LYS A 136 8.826 1.550 9.061 1.00 0.78 O ATOM 1967 CB LYS A 136 7.034 3.694 10.249 1.00 1.71 C ATOM 1968 CG LYS A 136 8.241 4.455 10.790 1.00 2.72 C ATOM 1969 CD LYS A 136 9.455 3.558 10.974 1.00 3.21 C ATOM 1970 CE LYS A 136 10.699 4.358 11.323 1.00 4.09 C ATOM 1971 NZ LYS A 136 10.547 5.113 12.594 1.00 4.81 N ATOM 0 H LYS A 136 6.017 4.324 7.375 1.00 0.85 H new ATOM 0 HA LYS A 136 7.926 3.858 8.271 1.00 1.14 H new ATOM 0 HB2 LYS A 136 6.147 4.319 10.355 1.00 1.71 H new ATOM 0 HB3 LYS A 136 6.874 2.806 10.861 1.00 1.71 H new ATOM 0 HG2 LYS A 136 8.492 5.266 10.107 1.00 2.72 H new ATOM 0 HG3 LYS A 136 7.981 4.911 11.745 1.00 2.72 H new ATOM 0 HD2 LYS A 136 9.255 2.833 11.763 1.00 3.21 H new ATOM 0 HD3 LYS A 136 9.631 2.992 10.059 1.00 3.21 H new ATOM 0 HE2 LYS A 136 11.551 3.683 11.404 1.00 4.09 H new ATOM 0 HE3 LYS A 136 10.919 5.054 10.514 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 11.448 5.574 12.834 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 9.807 5.835 12.482 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 10.280 4.458 13.357 1.00 4.81 H new ATOM 1985 N TRP A 137 6.878 0.866 8.250 1.00 0.69 N ATOM 1986 CA TRP A 137 7.336 -0.518 8.090 1.00 0.45 C ATOM 1987 C TRP A 137 7.320 -0.908 6.631 1.00 0.43 C ATOM 1988 O TRP A 137 6.956 -0.108 5.774 1.00 0.55 O ATOM 1989 CB TRP A 137 6.478 -1.532 8.876 1.00 0.42 C ATOM 1990 CG TRP A 137 6.792 -1.613 10.330 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.280 -2.679 11.031 1.00 0.93 C ATOM 1992 CD2 TRP A 137 6.629 -0.566 11.259 1.00 1.00 C ATOM 1993 NE1 TRP A 137 7.452 -2.319 12.348 1.00 1.11 N ATOM 1994 CE2 TRP A 137 7.055 -1.024 12.506 1.00 1.16 C ATOM 1995 CE3 TRP A 137 6.164 0.721 11.138 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 7.041 -0.216 13.633 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 6.149 1.530 12.239 1.00 1.97 C ATOM 1998 CH2 TRP A 137 6.587 1.064 13.483 1.00 1.97 C ATOM 0 H TRP A 137 5.906 1.024 7.983 1.00 0.69 H new ATOM 0 HA TRP A 137 8.349 -0.551 8.491 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.427 -1.267 8.759 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.609 -2.519 8.434 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.497 -3.652 10.616 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.817 -2.922 13.085 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.815 1.089 10.185 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 7.376 -0.584 14.592 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 5.793 2.546 12.147 1.00 1.97 H new ATOM 0 HH2 TRP A 137 6.566 1.725 14.337 1.00 1.97 H new ATOM 2009 N ASN A 138 7.808 -2.110 6.363 1.00 0.37 N ATOM 2010 CA ASN A 138 7.511 -2.864 5.135 1.00 0.38 C ATOM 2011 C ASN A 138 6.015 -2.749 4.778 1.00 0.31 C ATOM 2012 O ASN A 138 5.353 -1.833 5.197 1.00 0.30 O ATOM 2013 CB ASN A 138 7.891 -4.334 5.315 1.00 0.41 C ATOM 2014 CG ASN A 138 8.313 -4.997 4.011 1.00 1.06 C ATOM 2015 OD1 ASN A 138 7.829 -4.648 2.935 1.00 2.04 O ATOM 2016 ND2 ASN A 138 9.223 -5.953 4.095 1.00 1.40 N ATOM 0 H ASN A 138 8.434 -2.605 6.999 1.00 0.37 H new ATOM 0 HA ASN A 138 8.098 -2.441 4.320 1.00 0.38 H new ATOM 0 HB2 ASN A 138 8.705 -4.409 6.036 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.043 -4.875 5.735 1.00 0.41 H new ATOM 0 HD21 ASN A 138 9.545 -6.426 3.251 1.00 1.40 H new ATOM 0 HD22 ASN A 138 9.603 -6.217 5.004 1.00 1.40 H new ATOM 2023 N PHE A 139 5.489 -3.714 4.037 1.00 0.34 N ATOM 2024 CA PHE A 139 4.201 -3.608 3.328 1.00 0.36 C ATOM 2025 C PHE A 139 3.172 -2.614 3.930 1.00 0.32 C ATOM 2026 O PHE A 139 2.604 -1.863 3.159 1.00 0.57 O ATOM 2027 CB PHE A 139 3.580 -4.997 3.330 1.00 0.55 C ATOM 2028 CG PHE A 139 3.869 -5.830 2.117 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.153 -6.276 1.820 1.00 0.61 C ATOM 2030 CD2 PHE A 139 2.832 -6.201 1.289 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.376 -7.076 0.717 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.049 -7.001 0.194 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.322 -7.442 -0.093 1.00 1.89 C ATOM 0 H PHE A 139 5.948 -4.615 3.903 1.00 0.34 H new ATOM 0 HA PHE A 139 4.426 -3.215 2.336 1.00 0.36 H new ATOM 0 HB2 PHE A 139 3.932 -5.533 4.211 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.500 -4.894 3.431 1.00 0.55 H new ATOM 0 HD1 PHE A 139 5.980 -5.995 2.456 1.00 0.61 H new ATOM 0 HD2 PHE A 139 1.831 -5.857 1.505 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.376 -7.415 0.489 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.223 -7.284 -0.441 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.494 -8.074 -0.952 1.00 1.89 H new ATOM 2043 N THR A 140 2.931 -2.624 5.260 1.00 0.25 N ATOM 2044 CA THR A 140 2.106 -1.612 5.955 1.00 0.25 C ATOM 2045 C THR A 140 1.024 -0.987 5.069 1.00 0.22 C ATOM 2046 O THR A 140 1.255 -0.014 4.347 1.00 0.29 O ATOM 2047 CB THR A 140 2.959 -0.495 6.574 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.093 -1.063 7.222 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.151 0.282 7.597 1.00 0.60 C ATOM 0 H THR A 140 3.306 -3.338 5.884 1.00 0.25 H new ATOM 0 HA THR A 140 1.606 -2.167 6.749 1.00 0.25 H new ATOM 0 HB THR A 140 3.279 0.178 5.778 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.722 -1.396 6.548 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.769 1.070 8.027 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.282 0.727 7.112 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.821 -0.392 8.388 1.00 0.60 H new ATOM 2057 N SER A 141 -0.159 -1.530 5.175 1.00 0.19 N ATOM 2058 CA SER A 141 -1.243 -1.201 4.266 1.00 0.20 C ATOM 2059 C SER A 141 -1.990 0.043 4.710 1.00 0.22 C ATOM 2060 O SER A 141 -1.766 0.545 5.801 1.00 0.39 O ATOM 2061 CB SER A 141 -2.219 -2.354 4.238 1.00 0.26 C ATOM 2062 OG SER A 141 -1.547 -3.599 4.278 1.00 0.62 O ATOM 0 H SER A 141 -0.406 -2.213 5.891 1.00 0.19 H new ATOM 0 HA SER A 141 -0.814 -1.015 3.281 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.899 -2.278 5.087 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.828 -2.296 3.336 1.00 0.26 H new ATOM 0 HG SER A 141 -1.725 -4.093 3.451 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.871 0.533 3.850 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.911 1.450 4.246 1.00 0.18 C ATOM 2070 C PHE A 142 -5.181 0.898 3.680 1.00 0.18 C ATOM 2071 O PHE A 142 -5.292 0.725 2.479 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.693 2.860 3.697 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.572 3.636 4.327 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -1.287 3.585 3.806 1.00 0.42 C ATOM 2075 CD2 PHE A 142 -2.814 4.451 5.422 1.00 0.35 C ATOM 2076 CE1 PHE A 142 -0.270 4.326 4.371 1.00 0.55 C ATOM 2077 CE2 PHE A 142 -1.800 5.198 5.986 1.00 0.50 C ATOM 2078 CZ PHE A 142 -0.525 5.135 5.460 1.00 0.57 C ATOM 0 H PHE A 142 -2.878 0.301 2.857 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.927 1.539 5.332 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.504 2.788 2.626 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.617 3.425 3.821 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -1.081 2.959 2.950 1.00 0.42 H new ATOM 0 HD2 PHE A 142 -3.809 4.502 5.839 1.00 0.35 H new ATOM 0 HE1 PHE A 142 0.728 4.273 3.961 1.00 0.55 H new ATOM 0 HE2 PHE A 142 -2.003 5.831 6.837 1.00 0.50 H new ATOM 0 HZ PHE A 142 0.271 5.717 5.900 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.137 0.595 4.505 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.349 0.066 3.964 1.00 0.16 C ATOM 2090 C LEU A 143 -8.149 1.206 3.416 1.00 0.15 C ATOM 2091 O LEU A 143 -8.753 1.978 4.138 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.140 -0.712 4.997 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.647 -0.752 4.739 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -9.993 -1.685 3.589 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.399 -1.140 5.993 1.00 0.43 C ATOM 0 H LEU A 143 -6.106 0.700 5.519 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.111 -0.642 3.170 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.762 -1.734 5.032 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.963 -0.273 5.979 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.957 0.253 4.452 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.072 -1.688 3.435 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.498 -1.342 2.681 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.658 -2.695 3.826 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.469 -1.161 5.784 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.074 -2.127 6.322 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.197 -0.411 6.778 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.111 1.289 2.122 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.757 2.326 1.392 1.00 0.14 C ATOM 2109 C ILE A 144 -10.166 1.867 1.098 1.00 0.15 C ATOM 2110 O ILE A 144 -10.377 0.693 0.808 1.00 0.19 O ATOM 2111 CB ILE A 144 -8.005 2.567 0.081 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.530 2.868 0.331 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.662 3.675 -0.703 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.281 4.104 1.137 1.00 0.19 C ATOM 0 H ILE A 144 -7.616 0.619 1.533 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.770 3.254 1.963 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.052 1.652 -0.510 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.080 2.018 0.843 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -6.024 2.967 -0.629 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.117 3.836 -1.633 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.692 3.399 -0.929 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.653 4.592 -0.114 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.208 4.243 1.268 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.698 4.967 0.618 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.755 4.003 2.113 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.125 2.759 1.171 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.510 2.322 1.070 1.00 0.15 C ATOM 2128 C ASP A 145 -12.987 2.386 -0.371 1.00 0.14 C ATOM 2129 O ASP A 145 -12.204 2.684 -1.269 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.421 3.128 2.009 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.244 4.194 1.305 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.655 5.207 0.871 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.473 4.043 1.208 1.00 0.75 O ATOM 0 H ASP A 145 -10.987 3.762 1.296 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.563 1.282 1.392 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -14.095 2.442 2.522 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.808 3.603 2.774 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.258 2.090 -0.583 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.833 2.035 -1.917 1.00 0.17 C ATOM 2140 C ARG A 146 -14.591 3.335 -2.670 1.00 0.18 C ATOM 2141 O ARG A 146 -14.269 3.332 -3.854 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.331 1.809 -1.819 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.745 0.881 -0.694 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.249 0.768 -0.640 1.00 0.29 C ATOM 2145 NE ARG A 146 -18.877 2.078 -0.814 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.072 2.258 -1.361 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -20.818 1.209 -1.680 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -20.524 3.483 -1.576 1.00 2.22 N ATOM 0 H ARG A 146 -14.920 1.881 0.164 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.356 1.215 -2.455 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.824 2.771 -1.682 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.688 1.399 -2.764 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.304 -0.104 -0.844 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.367 1.258 0.256 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.595 0.088 -1.419 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.552 0.339 0.315 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.366 2.901 -0.496 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.473 0.265 -1.505 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -21.737 1.346 -2.101 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -19.953 4.289 -1.321 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.443 3.621 -1.997 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.732 4.446 -1.969 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.616 5.750 -2.590 1.00 0.21 C ATOM 2164 C ASP A 147 -13.201 6.264 -2.429 1.00 0.18 C ATOM 2165 O ASP A 147 -12.936 7.451 -2.597 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.613 6.735 -1.971 1.00 0.28 C ATOM 2167 CG ASP A 147 -17.061 6.389 -2.272 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.634 5.514 -1.588 1.00 2.00 O ATOM 2169 OD2 ASP A 147 -17.649 7.014 -3.181 1.00 1.19 O ATOM 0 H ASP A 147 -14.927 4.469 -0.968 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.846 5.657 -3.651 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.469 6.758 -0.891 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.401 7.738 -2.342 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.288 5.350 -2.127 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.900 5.701 -1.974 1.00 0.16 C ATOM 2176 C GLY A 148 -10.591 6.460 -0.704 1.00 0.15 C ATOM 2177 O GLY A 148 -9.712 7.312 -0.698 1.00 0.17 O ATOM 0 H GLY A 148 -12.494 4.361 -1.985 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.302 4.790 -1.995 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.593 6.304 -2.829 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.286 6.178 0.375 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.963 6.822 1.631 1.00 0.18 C ATOM 2183 C VAL A 149 -10.290 5.847 2.598 1.00 0.17 C ATOM 2184 O VAL A 149 -10.920 4.924 3.100 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.202 7.455 2.301 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.817 8.154 3.600 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.883 8.429 1.349 1.00 1.12 C ATOM 0 H VAL A 149 -12.064 5.520 0.411 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.264 7.624 1.394 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.906 6.658 2.541 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.705 8.592 4.054 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.378 7.430 4.286 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -11.092 8.940 3.389 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.754 8.866 1.837 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.185 9.220 1.077 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.199 7.899 0.450 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.973 6.019 2.797 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.192 5.301 3.812 1.00 0.20 C ATOM 2199 C PRO A 150 -8.893 5.286 5.174 1.00 0.23 C ATOM 2200 O PRO A 150 -9.197 6.335 5.747 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.892 6.111 3.919 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.991 7.221 2.916 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.136 6.911 2.009 1.00 0.41 C ATOM 0 HA PRO A 150 -8.044 4.257 3.535 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.766 6.509 4.926 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -6.026 5.481 3.715 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.147 8.176 3.417 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.065 7.307 2.348 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.674 7.814 1.722 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.799 6.434 1.089 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.128 4.097 5.690 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.842 3.913 6.939 1.00 0.29 C ATOM 2213 C VAL A 151 -8.927 3.242 7.948 1.00 0.32 C ATOM 2214 O VAL A 151 -9.040 3.454 9.151 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.103 3.036 6.739 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -11.893 2.910 8.028 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.985 3.590 5.632 1.00 1.13 C ATOM 0 H VAL A 151 -8.828 3.226 5.253 1.00 0.22 H new ATOM 0 HA VAL A 151 -10.154 4.893 7.301 1.00 0.29 H new ATOM 0 HB VAL A 151 -10.766 2.042 6.445 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -12.772 2.289 7.857 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -11.268 2.451 8.794 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -12.207 3.899 8.361 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.863 2.954 5.514 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -12.301 4.601 5.890 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -11.425 3.613 4.697 1.00 1.13 H new ATOM 2227 N GLU A 152 -8.006 2.437 7.438 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.091 1.679 8.285 1.00 0.20 C ATOM 2229 C GLU A 152 -5.681 1.729 7.735 1.00 0.20 C ATOM 2230 O GLU A 152 -5.458 2.175 6.619 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.502 0.211 8.367 1.00 0.21 C ATOM 2232 CG GLU A 152 -8.954 -0.006 8.712 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.290 0.327 10.151 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.685 -0.274 11.062 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -10.181 1.168 10.381 1.00 1.17 O ATOM 0 H GLU A 152 -7.871 2.290 6.438 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.130 2.134 9.275 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.292 -0.267 7.410 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.884 -0.286 9.115 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.571 0.605 8.053 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.214 -1.047 8.518 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.740 1.309 8.552 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.408 0.960 8.091 1.00 0.24 C ATOM 2244 C ARG A 153 -2.879 -0.221 8.895 1.00 0.25 C ATOM 2245 O ARG A 153 -2.923 -0.218 10.123 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.449 2.153 8.140 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.049 1.797 8.616 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.035 2.872 8.280 1.00 0.47 C ATOM 2249 NE ARG A 153 -0.427 4.231 8.681 1.00 0.65 N ATOM 2250 CZ ARG A 153 0.293 4.982 9.513 1.00 1.51 C ATOM 2251 NH1 ARG A 153 1.239 4.428 10.261 1.00 2.16 N ATOM 2252 NH2 ARG A 153 0.036 6.277 9.636 1.00 1.85 N ATOM 0 H ARG A 153 -4.874 1.199 9.557 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.475 0.668 7.043 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.383 2.595 7.146 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.864 2.914 8.800 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.064 1.639 9.694 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.741 0.856 8.160 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.911 2.624 8.762 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.143 2.862 7.205 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.292 4.618 8.304 1.00 0.65 H new ATOM 0 HH11 ARG A 153 1.416 3.425 10.199 1.00 2.16 H new ATOM 0 HH12 ARG A 153 1.789 5.005 10.897 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -0.715 6.702 9.092 1.00 1.85 H new ATOM 0 HH22 ARG A 153 0.590 6.848 10.274 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.363 -1.216 8.189 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.012 -2.495 8.786 1.00 0.22 C ATOM 2268 C PHE A 154 -0.507 -2.657 8.793 1.00 0.24 C ATOM 2269 O PHE A 154 0.174 -2.093 7.952 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.641 -3.640 7.983 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.145 -3.638 7.971 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.838 -2.912 7.016 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.867 -4.372 8.902 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.218 -2.916 6.989 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.250 -4.380 8.877 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.922 -3.650 7.919 1.00 0.22 C ATOM 0 H PHE A 154 -2.176 -1.159 7.188 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.389 -2.523 9.808 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.282 -3.587 6.955 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.294 -4.588 8.393 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.292 -2.336 6.284 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.343 -4.943 9.654 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.746 -2.344 6.240 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.802 -4.956 9.605 1.00 0.22 H new ATOM 0 HZ PHE A 154 -8.002 -3.654 7.898 1.00 0.22 H new ATOM 2286 N SER A 155 0.006 -3.418 9.741 1.00 0.22 N ATOM 2287 CA SER A 155 1.427 -3.707 9.795 1.00 0.25 C ATOM 2288 C SER A 155 1.782 -4.722 8.709 1.00 0.22 C ATOM 2289 O SER A 155 0.918 -5.459 8.247 1.00 0.26 O ATOM 2290 CB SER A 155 1.776 -4.259 11.181 1.00 0.35 C ATOM 2291 OG SER A 155 1.240 -3.429 12.201 1.00 1.11 O ATOM 0 H SER A 155 -0.542 -3.848 10.486 1.00 0.22 H new ATOM 0 HA SER A 155 2.000 -2.796 9.622 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.383 -5.271 11.285 1.00 0.35 H new ATOM 0 HB3 SER A 155 2.859 -4.325 11.290 1.00 0.35 H new ATOM 0 HG SER A 155 1.472 -3.798 13.079 1.00 1.11 H new ATOM 2297 N PRO A 156 3.050 -4.777 8.273 1.00 0.25 N ATOM 2298 CA PRO A 156 3.491 -5.757 7.275 1.00 0.29 C ATOM 2299 C PRO A 156 3.384 -7.172 7.816 1.00 0.39 C ATOM 2300 O PRO A 156 3.296 -8.135 7.064 1.00 0.78 O ATOM 2301 CB PRO A 156 4.953 -5.392 7.027 1.00 0.34 C ATOM 2302 CG PRO A 156 5.370 -4.643 8.243 1.00 0.36 C ATOM 2303 CD PRO A 156 4.147 -3.905 8.710 1.00 0.33 C ATOM 0 HA PRO A 156 2.884 -5.732 6.370 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.564 -6.283 6.882 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.062 -4.782 6.130 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.735 -5.322 9.014 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.181 -3.951 8.017 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.147 -3.767 9.791 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.078 -2.914 8.262 1.00 0.33 H new ATOM 2311 N GLY A 157 3.437 -7.265 9.135 1.00 0.36 N ATOM 2312 CA GLY A 157 3.216 -8.514 9.831 1.00 0.46 C ATOM 2313 C GLY A 157 1.747 -8.864 9.993 1.00 0.41 C ATOM 2314 O GLY A 157 1.410 -9.844 10.662 1.00 0.50 O ATOM 0 H GLY A 157 3.635 -6.475 9.749 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.715 -9.317 9.288 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.679 -8.459 10.816 1.00 0.46 H new ATOM 2318 N ALA A 158 0.865 -8.070 9.394 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.548 -8.408 9.367 1.00 0.31 C ATOM 2320 C ALA A 158 -0.797 -9.449 8.289 1.00 0.34 C ATOM 2321 O ALA A 158 -0.070 -9.513 7.298 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.405 -7.171 9.128 1.00 0.37 C ATOM 0 H ALA A 158 1.104 -7.196 8.925 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.829 -8.819 10.337 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.457 -7.455 9.113 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.235 -6.450 9.928 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.137 -6.722 8.172 1.00 0.37 H new ATOM 2328 N SER A 159 -1.808 -10.266 8.490 1.00 0.26 N ATOM 2329 CA SER A 159 -2.114 -11.320 7.564 1.00 0.30 C ATOM 2330 C SER A 159 -3.385 -10.977 6.808 1.00 0.23 C ATOM 2331 O SER A 159 -4.090 -10.026 7.160 1.00 0.22 O ATOM 2332 CB SER A 159 -2.266 -12.651 8.313 1.00 0.41 C ATOM 2333 OG SER A 159 -2.493 -13.733 7.421 1.00 1.42 O ATOM 0 H SER A 159 -2.433 -10.215 9.295 1.00 0.26 H new ATOM 0 HA SER A 159 -1.299 -11.425 6.848 1.00 0.30 H new ATOM 0 HB2 SER A 159 -1.367 -12.844 8.898 1.00 0.41 H new ATOM 0 HB3 SER A 159 -3.095 -12.580 9.017 1.00 0.41 H new ATOM 0 HG SER A 159 -2.583 -14.565 7.932 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.649 -11.759 5.777 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.828 -11.626 4.932 1.00 0.20 C ATOM 2341 C VAL A 160 -6.074 -11.302 5.750 1.00 0.21 C ATOM 2342 O VAL A 160 -6.684 -10.251 5.567 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.052 -12.953 4.195 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.317 -12.921 3.355 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.849 -13.296 3.331 1.00 0.26 C ATOM 0 H VAL A 160 -3.036 -12.524 5.495 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.659 -10.808 4.232 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.175 -13.730 4.949 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.442 -13.878 2.848 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.177 -12.737 3.999 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.242 -12.125 2.614 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -4.028 -14.240 2.817 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.692 -12.507 2.596 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.963 -13.387 3.960 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.415 -12.189 6.681 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.657 -12.073 7.436 1.00 0.31 C ATOM 2357 C LYS A 161 -7.667 -10.835 8.336 1.00 0.26 C ATOM 2358 O LYS A 161 -8.725 -10.261 8.583 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.902 -13.333 8.276 1.00 0.45 C ATOM 2360 CG LYS A 161 -6.866 -13.559 9.366 1.00 1.12 C ATOM 2361 CD LYS A 161 -7.526 -13.782 10.717 1.00 1.80 C ATOM 2362 CE LYS A 161 -8.351 -12.574 11.135 1.00 2.67 C ATOM 2363 NZ LYS A 161 -9.031 -12.780 12.437 1.00 3.46 N ATOM 0 H LYS A 161 -5.846 -12.998 6.930 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.463 -11.965 6.710 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -8.889 -13.266 8.735 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -7.916 -14.200 7.616 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -6.251 -14.422 9.113 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -6.200 -12.698 9.422 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -8.166 -14.663 10.671 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -6.762 -13.981 11.469 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -7.704 -11.700 11.200 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -9.096 -12.363 10.368 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -9.306 -11.859 12.835 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -9.880 -13.364 12.297 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.385 -13.262 13.094 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.491 -10.418 8.808 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.390 -9.266 9.709 1.00 0.27 C ATOM 2379 C ASP A 162 -6.819 -8.028 8.963 1.00 0.22 C ATOM 2380 O ASP A 162 -7.440 -7.116 9.507 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.952 -9.084 10.182 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.862 -8.472 11.565 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.960 -7.228 11.671 1.00 1.40 O ATOM 2384 OD2 ASP A 162 -4.706 -9.217 12.550 1.00 0.86 O ATOM 0 H ASP A 162 -5.598 -10.858 8.583 1.00 0.26 H new ATOM 0 HA ASP A 162 -7.029 -9.434 10.576 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.450 -10.051 10.184 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.419 -8.450 9.474 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.468 -8.026 7.698 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.855 -6.979 6.792 1.00 0.15 C ATOM 2391 C ILE A 163 -8.301 -7.164 6.350 1.00 0.14 C ATOM 2392 O ILE A 163 -9.076 -6.207 6.323 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.930 -6.976 5.563 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.545 -6.423 5.939 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.557 -6.186 4.425 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.538 -6.491 4.811 1.00 0.21 C ATOM 0 H ILE A 163 -5.902 -8.758 7.269 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.766 -6.024 7.309 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.798 -8.001 5.218 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.651 -5.386 6.258 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.160 -6.981 6.793 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.888 -6.195 3.564 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.509 -6.639 4.149 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.723 -5.157 4.745 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.585 -6.084 5.149 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.402 -7.529 4.507 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.901 -5.909 3.964 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.657 -8.403 6.019 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.993 -8.714 5.527 1.00 0.13 C ATOM 2410 C GLU A 164 -11.068 -8.237 6.493 1.00 0.15 C ATOM 2411 O GLU A 164 -12.075 -7.693 6.074 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.191 -10.214 5.324 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.406 -10.820 4.185 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.741 -12.282 3.990 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -9.172 -13.129 4.711 1.00 0.67 O ATOM 2416 OE2 GLU A 164 -10.593 -12.592 3.131 1.00 0.60 O ATOM 0 H GLU A 164 -8.035 -9.209 6.084 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.085 -8.196 4.573 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.918 -10.728 6.246 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.251 -10.404 5.155 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.617 -10.273 3.266 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.339 -10.714 4.382 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.864 -8.453 7.785 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.877 -8.091 8.773 1.00 0.21 C ATOM 2425 C GLU A 165 -12.177 -6.594 8.771 1.00 0.21 C ATOM 2426 O GLU A 165 -13.198 -6.159 9.304 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.494 -8.555 10.185 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.058 -8.286 10.591 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.771 -8.773 11.998 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -10.224 -8.128 12.967 1.00 0.87 O ATOM 2431 OE2 GLU A 165 -9.063 -9.791 12.143 1.00 0.83 O ATOM 0 H GLU A 165 -10.018 -8.872 8.173 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.786 -8.615 8.478 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.154 -8.066 10.901 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.680 -9.626 10.260 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.384 -8.779 9.891 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -9.857 -7.217 10.528 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.295 -5.813 8.175 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.549 -4.397 7.975 1.00 0.20 C ATOM 2440 C LYS A 166 -11.995 -4.150 6.536 1.00 0.19 C ATOM 2441 O LYS A 166 -12.768 -3.234 6.246 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.292 -3.591 8.292 1.00 0.25 C ATOM 2443 CG LYS A 166 -9.863 -3.678 9.747 1.00 0.38 C ATOM 2444 CD LYS A 166 -10.864 -3.001 10.666 1.00 0.58 C ATOM 2445 CE LYS A 166 -10.438 -3.097 12.121 1.00 1.09 C ATOM 2446 NZ LYS A 166 -9.069 -2.557 12.340 1.00 1.71 N ATOM 0 H LYS A 166 -10.395 -6.135 7.820 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.344 -4.076 8.648 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.476 -3.943 7.660 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.466 -2.546 8.035 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.755 -4.724 10.033 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -8.885 -3.212 9.867 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -10.967 -1.953 10.384 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.844 -3.462 10.541 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -11.147 -2.550 12.743 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -10.472 -4.139 12.440 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -9.013 -2.124 13.284 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -8.376 -3.330 12.272 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -8.859 -1.839 11.617 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.521 -5.009 5.653 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.745 -4.894 4.223 1.00 0.15 C ATOM 2462 C LEU A 167 -13.133 -5.378 3.801 1.00 0.15 C ATOM 2463 O LEU A 167 -13.852 -4.684 3.086 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.689 -5.723 3.501 1.00 0.13 C ATOM 2465 CG LEU A 167 -11.030 -6.060 2.061 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.863 -4.839 1.179 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.186 -7.214 1.566 1.00 0.16 C ATOM 0 H LEU A 167 -10.960 -5.820 5.913 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.677 -3.839 3.959 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.744 -5.180 3.520 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.535 -6.651 4.051 1.00 0.13 H new ATOM 0 HG LEU A 167 -12.074 -6.370 2.015 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.111 -5.097 0.150 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.527 -4.047 1.525 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.830 -4.494 1.227 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.447 -7.438 0.532 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.131 -6.944 1.624 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.370 -8.092 2.185 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.483 -6.582 4.236 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.721 -7.243 3.832 1.00 0.19 C ATOM 2481 C ILE A 168 -15.958 -6.384 4.109 1.00 0.22 C ATOM 2482 O ILE A 168 -16.820 -6.272 3.246 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.871 -8.623 4.515 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.645 -9.499 4.223 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.147 -9.317 4.051 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.667 -10.836 4.938 1.00 0.24 C ATOM 0 H ILE A 168 -12.915 -7.131 4.881 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.653 -7.389 2.754 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.939 -8.469 5.592 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.581 -9.672 3.149 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.745 -8.957 4.513 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.234 -10.286 4.543 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -17.010 -8.702 4.307 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.111 -9.460 2.971 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.769 -11.400 4.683 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.699 -10.672 6.015 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.548 -11.399 4.630 1.00 0.24 H new ATOM 2498 N PRO A 169 -16.082 -5.763 5.305 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.186 -4.832 5.592 1.00 0.29 C ATOM 2500 C PRO A 169 -17.273 -3.676 4.592 1.00 0.29 C ATOM 2501 O PRO A 169 -18.298 -2.997 4.507 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.850 -4.298 6.982 1.00 0.34 C ATOM 2503 CG PRO A 169 -16.024 -5.367 7.603 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.211 -5.947 6.487 1.00 0.24 C ATOM 0 HA PRO A 169 -18.152 -5.332 5.526 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.303 -3.357 6.924 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.753 -4.106 7.562 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.383 -4.962 8.386 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.652 -6.128 8.067 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.259 -5.429 6.371 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -14.983 -6.999 6.659 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.195 -3.446 3.848 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.187 -2.424 2.811 1.00 0.22 C ATOM 2514 C LEU A 170 -16.450 -3.035 1.435 1.00 0.20 C ATOM 2515 O LEU A 170 -17.196 -2.466 0.641 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.867 -1.650 2.806 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.638 -0.715 3.988 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.257 -0.086 3.891 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.718 0.359 4.028 1.00 0.69 C ATOM 0 H LEU A 170 -15.316 -3.955 3.945 1.00 0.22 H new ATOM 0 HA LEU A 170 -16.992 -1.724 3.036 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.048 -2.368 2.772 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.816 -1.064 1.889 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.694 -1.290 4.913 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.101 0.581 4.739 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.499 -0.869 3.901 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.180 0.482 2.964 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.543 1.020 4.877 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.689 0.938 3.105 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.696 -0.112 4.131 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.826 -4.180 1.147 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.080 -4.892 -0.115 1.00 0.20 C ATOM 2533 C LEU A 171 -17.530 -5.286 -0.189 1.00 0.27 C ATOM 2534 O LEU A 171 -18.237 -5.004 -1.156 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.255 -6.169 -0.217 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.764 -5.962 -0.307 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -13.049 -7.298 -0.330 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.420 -5.151 -1.543 1.00 0.31 C ATOM 0 H LEU A 171 -15.148 -4.632 1.760 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.807 -4.218 -0.927 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.468 -6.791 0.652 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.583 -6.726 -1.095 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.433 -5.409 0.572 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.973 -7.134 -0.395 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.277 -7.849 0.582 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.381 -7.874 -1.194 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.341 -5.009 -1.596 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.760 -5.681 -2.432 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.912 -4.180 -1.489 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.952 -5.938 0.871 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.298 -6.426 0.982 1.00 0.39 C ATOM 2552 C GLY A 172 -20.296 -5.335 1.325 1.00 0.66 C ATOM 2553 O GLY A 172 -21.337 -5.598 1.932 1.00 1.12 O ATOM 0 H GLY A 172 -17.365 -6.143 1.680 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.588 -6.894 0.041 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.336 -7.200 1.748 1.00 0.39 H new ATOM 2557 N SER A 173 -19.972 -4.111 0.944 1.00 0.85 N ATOM 2558 CA SER A 173 -20.851 -2.978 1.155 1.00 1.33 C ATOM 2559 C SER A 173 -21.115 -2.268 -0.171 1.00 1.84 C ATOM 2560 O SER A 173 -20.314 -1.453 -0.628 1.00 2.43 O ATOM 2561 CB SER A 173 -20.234 -2.005 2.164 1.00 2.03 C ATOM 2562 OG SER A 173 -21.125 -0.945 2.477 1.00 2.64 O ATOM 0 H SER A 173 -19.094 -3.877 0.481 1.00 0.85 H new ATOM 0 HA SER A 173 -21.798 -3.339 1.557 1.00 1.33 H new ATOM 0 HB2 SER A 173 -19.972 -2.542 3.075 1.00 2.03 H new ATOM 0 HB3 SER A 173 -19.309 -1.596 1.758 1.00 2.03 H new ATOM 0 HG SER A 173 -20.702 -0.343 3.124 1.00 2.64 H new ATOM 2568 N ALA A 174 -22.237 -2.591 -0.794 1.00 2.40 N ATOM 2569 CA ALA A 174 -22.636 -1.930 -2.023 1.00 3.35 C ATOM 2570 C ALA A 174 -23.378 -0.646 -1.692 1.00 3.69 C ATOM 2571 O ALA A 174 -23.481 0.264 -2.520 1.00 4.35 O ATOM 2572 CB ALA A 174 -23.501 -2.845 -2.877 1.00 4.30 C ATOM 0 H ALA A 174 -22.886 -3.307 -0.468 1.00 2.40 H new ATOM 0 HA ALA A 174 -21.742 -1.688 -2.598 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -23.787 -2.326 -3.792 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -22.940 -3.744 -3.130 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -24.397 -3.121 -2.322 1.00 4.30 H new ATOM 2578 N ARG A 175 -23.886 -0.594 -0.456 1.00 3.66 N ATOM 2579 CA ARG A 175 -24.561 0.584 0.090 1.00 4.44 C ATOM 2580 C ARG A 175 -25.851 0.870 -0.678 1.00 4.81 C ATOM 2581 O ARG A 175 -26.377 1.982 -0.669 1.00 5.15 O ATOM 2582 CB ARG A 175 -23.619 1.791 0.074 1.00 5.16 C ATOM 2583 CG ARG A 175 -24.146 3.001 0.823 1.00 5.82 C ATOM 2584 CD ARG A 175 -23.172 4.153 0.741 1.00 6.62 C ATOM 2585 NE ARG A 175 -21.970 3.917 1.537 1.00 7.03 N ATOM 2586 CZ ARG A 175 -21.254 4.885 2.105 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -21.590 6.159 1.925 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -20.200 4.575 2.846 1.00 8.45 N ATOM 0 H ARG A 175 -23.839 -1.376 0.197 1.00 3.66 H new ATOM 0 HA ARG A 175 -24.833 0.385 1.127 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -22.663 1.497 0.507 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -23.426 2.074 -0.961 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -25.107 3.302 0.406 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -24.320 2.740 1.867 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -22.891 4.315 -0.299 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -23.660 5.065 1.085 1.00 6.62 H new ATOM 0 HE ARG A 175 -21.661 2.953 1.665 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -22.398 6.397 1.350 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -21.039 6.898 2.362 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -19.940 3.598 2.979 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -19.649 5.314 3.283 1.00 8.45 H new ATOM 2602 N LEU A 176 -26.350 -0.153 -1.338 1.00 5.22 N ATOM 2603 CA LEU A 176 -27.610 -0.068 -2.052 1.00 6.05 C ATOM 2604 C LEU A 176 -28.752 -0.459 -1.125 1.00 6.72 C ATOM 2605 O LEU A 176 -29.047 -1.668 -1.008 1.00 7.14 O ATOM 2606 CB LEU A 176 -27.583 -0.972 -3.289 1.00 6.60 C ATOM 2607 CG LEU A 176 -28.848 -0.947 -4.149 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -29.105 0.450 -4.692 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -28.729 -1.944 -5.289 1.00 7.60 C ATOM 2610 OXT LEU A 176 -29.330 0.440 -0.484 1.00 7.13 O ATOM 0 H LEU A 176 -25.897 -1.065 -1.396 1.00 5.22 H new ATOM 0 HA LEU A 176 -27.764 0.958 -2.385 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -26.736 -0.683 -3.911 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -27.405 -1.997 -2.965 1.00 6.60 H new ATOM 0 HG LEU A 176 -29.694 -1.230 -3.522 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -30.009 0.443 -5.300 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -29.231 1.145 -3.862 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -28.259 0.764 -5.303 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -29.636 -1.916 -5.893 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -27.871 -1.686 -5.910 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -28.594 -2.947 -4.883 1.00 7.60 H new TER 2622 LEU A 176