USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=46 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 56 THR OG1 : rot 77:sc= 0.0567 USER MOD Set 1.2: A 159 SER OG : rot 180:sc= 0.092 USER MOD Set 2.1: A 61 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 70 THR OG1 : rot 50:sc= 0.173! USER MOD Set 3.1: A 49 TYR OH : rot 110:sc= 0 USER MOD Set 3.2: A 51 LYS NZ :NH3+ 139:sc= 0.824 (180deg=0) USER MOD Set 3.3: A 138 ASN : amide:sc= -1.03 K(o=-0.21,f=-8!) USER MOD Set 4.1: A 46 LYS NZ :NH3+ 152:sc= 1.49 (180deg=-2.36!) USER MOD Set 4.2: A 86 ASN : amide:sc= -1.84! C(o=-0.34!,f=-13!) USER MOD Set 5.1: A 45 SER OG : rot -111:sc= 0.995 USER MOD Set 5.2: A 76 SER OG : rot 180:sc= -0.25 USER MOD Set 5.3: A 78 GLN : amide:sc= -2.13 K(o=-1.4,f=-9!) USER MOD Set 6.1: A 28 TYR OH : rot -51:sc= 1.09 USER MOD Set 6.2: A 32 GLN : amide:sc= -0.213 K(o=-4.1,f=-7!) USER MOD Set 6.3: A 33 HIS : +bothHN:sc= -5! C(o=-4.1!,f=-12!) USER MOD Single : A 11 MET CE :methyl -170:sc=-0.00856 (180deg=-0.191) USER MOD Single : A 13 SER OG : rot -46:sc= 0.478 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -3.54! C(o=-3.5!,f=-5.4!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -2.94! C(o=-2.9!,f=-3.2!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 139:sc= 1.22 USER MOD Single : A 41 TYR OH : rot 80:sc= -2.17! USER MOD Single : A 42 ASN : amide:sc= -10.6! C(o=-11!,f=-13!) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot -164:sc= 0.113 USER MOD Single : A 54 TYR OH : rot 80:sc= 1.21 USER MOD Single : A 58 THR OG1 : rot 74:sc= 1.23 USER MOD Single : A 59 THR OG1 : rot 80:sc= 0.787 USER MOD Single : A 62 ASN : amide:sc= 0.0954 X(o=0.095,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -164:sc= 1.19 (180deg=0.522) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0.0144 USER MOD Single : A 67 GLN : amide:sc= -0.756 X(o=-0.76,f=-0.34) USER MOD Single : A 77 ASN : amide:sc= -0.0416 X(o=-0.042,f=0) USER MOD Single : A 82 GLN : amide:sc= -1.82! X(o=-1.8!,f=-2.1) USER MOD Single : A 91 LYS NZ :NH3+ 178:sc= 1.29 (180deg=1.23) USER MOD Single : A 95 CYS SG : rot -98:sc= 1.35 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.016 USER MOD Single : A 97 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.246) USER MOD Single : A 99 LYS NZ :NH3+ -150:sc=-0.00538 (180deg=-0.0256) USER MOD Single : A 105 MET CE :methyl -148:sc= -5.48! (180deg=-7.55!) USER MOD Single : A 107 LYS NZ :NH3+ 170:sc= 0.912 (180deg=0.79) USER MOD Single : A 109 ASN :FLIP amide:sc= -2.12 F(o=-5.4!,f=-2.1) USER MOD Single : A 111 ASN : amide:sc= 0.857 K(o=0.86,f=-3.3!) USER MOD Single : A 114 ASN : amide:sc= 0.67 K(o=0.67,f=0) 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 176:sc= -2.18! USER MOD Single : A 121 TYR OH : rot 180:sc= -0.218 USER MOD Single : A 122 MET CE :methyl -115:sc= -6.22! (180deg=-10.6!) USER MOD Single : A 123 LYS NZ :NH3+ -162:sc= 1.27 (180deg=1.01) USER MOD Single : A 124 LYS NZ :NH3+ 167:sc=-0.00926 (180deg=-0.157) USER MOD Single : A 125 THR OG1 : rot 82:sc= 1.27 USER MOD Single : A 126 LYS NZ :NH3+ 158:sc= 0.772 (180deg=0.475) USER MOD Single : A 132 THR OG1 : rot -120:sc= -1.38 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -170:sc= -0.0212 (180deg=-0.188) USER MOD Single : A 140 THR OG1 : rot 67:sc= -2.53! USER MOD Single : A 141 SER OG : rot -115:sc= 1.49 USER MOD Single : A 155 SER OG : rot 180:sc=5.45e-05 USER MOD Single : A 161 LYS NZ :NH3+ -163:sc= 0.208 (180deg=-0.116) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 SER OG : rot -89:sc= 0.191! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -8.547 20.890 -6.386 1.00 5.22 N ATOM 2 CA GLY A 10 -8.391 19.474 -5.981 1.00 4.42 C ATOM 3 C GLY A 10 -9.141 19.149 -4.704 1.00 3.29 C ATOM 4 O GLY A 10 -10.368 19.032 -4.715 1.00 3.60 O ATOM 0 HA2 GLY A 10 -8.749 18.829 -6.783 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -7.332 19.254 -5.843 1.00 4.42 H new ATOM 10 N MET A 11 -8.399 19.025 -3.601 1.00 2.49 N ATOM 11 CA MET A 11 -8.954 18.593 -2.317 1.00 1.84 C ATOM 12 C MET A 11 -9.615 17.230 -2.471 1.00 1.40 C ATOM 13 O MET A 11 -10.818 17.117 -2.713 1.00 2.20 O ATOM 14 CB MET A 11 -9.943 19.616 -1.744 1.00 2.43 C ATOM 15 CG MET A 11 -9.299 20.945 -1.389 1.00 3.11 C ATOM 16 SD MET A 11 -10.341 21.973 -0.331 1.00 4.02 S ATOM 17 CE MET A 11 -11.810 22.130 -1.346 1.00 4.85 C ATOM 0 H MET A 11 -7.398 19.221 -3.573 1.00 2.49 H new ATOM 0 HA MET A 11 -8.131 18.514 -1.606 1.00 1.84 H new ATOM 0 HB2 MET A 11 -10.737 19.788 -2.470 1.00 2.43 H new ATOM 0 HB3 MET A 11 -10.411 19.198 -0.853 1.00 2.43 H new ATOM 0 HG2 MET A 11 -8.350 20.760 -0.886 1.00 3.11 H new ATOM 0 HG3 MET A 11 -9.073 21.489 -2.306 1.00 3.11 H new ATOM 0 HE1 MET A 11 -12.474 22.878 -0.912 1.00 4.85 H new ATOM 0 HE2 MET A 11 -11.526 22.437 -2.353 1.00 4.85 H new ATOM 0 HE3 MET A 11 -12.325 21.171 -1.391 1.00 4.85 H new ATOM 27 N GLY A 12 -8.793 16.202 -2.315 1.00 0.92 N ATOM 28 CA GLY A 12 -9.191 14.844 -2.616 1.00 0.85 C ATOM 29 C GLY A 12 -10.371 14.335 -1.821 1.00 0.79 C ATOM 30 O GLY A 12 -11.396 13.980 -2.400 1.00 1.55 O ATOM 0 H GLY A 12 -7.835 16.291 -1.977 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -9.431 14.778 -3.677 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -8.341 14.184 -2.440 1.00 0.85 H new ATOM 34 N SER A 13 -10.221 14.286 -0.498 1.00 0.52 N ATOM 35 CA SER A 13 -11.197 13.632 0.372 1.00 0.53 C ATOM 36 C SER A 13 -11.252 12.133 0.058 1.00 0.41 C ATOM 37 O SER A 13 -12.194 11.433 0.437 1.00 0.53 O ATOM 38 CB SER A 13 -12.586 14.272 0.223 1.00 0.79 C ATOM 39 OG SER A 13 -13.482 13.789 1.214 1.00 1.58 O ATOM 0 H SER A 13 -9.428 14.694 -0.003 1.00 0.52 H new ATOM 0 HA SER A 13 -10.883 13.764 1.407 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.501 15.356 0.303 1.00 0.79 H new ATOM 0 HB3 SER A 13 -12.985 14.056 -0.768 1.00 0.79 H new ATOM 0 HG SER A 13 -13.407 12.814 1.276 1.00 1.58 H new ATOM 45 N SER A 14 -10.216 11.666 -0.636 1.00 0.32 N ATOM 46 CA SER A 14 -10.052 10.297 -1.035 1.00 0.22 C ATOM 47 C SER A 14 -8.765 10.256 -1.805 1.00 0.21 C ATOM 48 O SER A 14 -8.334 11.259 -2.382 1.00 0.35 O ATOM 49 CB SER A 14 -11.214 9.806 -1.896 1.00 0.25 C ATOM 50 OG SER A 14 -11.387 10.613 -3.048 1.00 1.17 O ATOM 0 H SER A 14 -9.448 12.264 -0.940 1.00 0.32 H new ATOM 0 HA SER A 14 -10.033 9.639 -0.166 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.034 8.774 -2.198 1.00 0.25 H new ATOM 0 HB3 SER A 14 -12.131 9.810 -1.307 1.00 0.25 H new ATOM 0 HG SER A 14 -12.137 10.271 -3.578 1.00 1.17 H new ATOM 56 N ILE A 15 -8.144 9.116 -1.778 1.00 0.18 N ATOM 57 CA ILE A 15 -6.819 8.940 -2.306 1.00 0.18 C ATOM 58 C ILE A 15 -6.768 9.150 -3.822 1.00 0.17 C ATOM 59 O ILE A 15 -5.696 9.316 -4.396 1.00 0.19 O ATOM 60 CB ILE A 15 -6.331 7.536 -1.944 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.343 6.495 -2.426 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.129 7.436 -0.451 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.735 5.165 -2.793 1.00 0.38 C ATOM 0 H ILE A 15 -8.547 8.267 -1.383 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.167 9.693 -1.864 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.378 7.343 -2.436 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.086 6.339 -1.644 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.871 6.892 -3.293 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.781 6.435 -0.197 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.387 8.169 -0.134 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.073 7.632 0.058 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.520 4.485 -3.124 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.013 5.305 -3.597 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.232 4.742 -1.923 1.00 0.38 H new ATOM 75 N PHE A 16 -7.933 9.191 -4.459 1.00 0.18 N ATOM 76 CA PHE A 16 -8.012 9.299 -5.912 1.00 0.19 C ATOM 77 C PHE A 16 -7.698 10.702 -6.406 1.00 0.21 C ATOM 78 O PHE A 16 -7.744 10.969 -7.609 1.00 0.30 O ATOM 79 CB PHE A 16 -9.383 8.898 -6.402 1.00 0.20 C ATOM 80 CG PHE A 16 -9.738 7.500 -6.052 1.00 0.19 C ATOM 81 CD1 PHE A 16 -8.955 6.448 -6.464 1.00 0.22 C ATOM 82 CD2 PHE A 16 -10.849 7.248 -5.282 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.272 5.163 -6.095 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.177 5.966 -4.922 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.408 4.890 -5.486 1.00 0.19 C ATOM 0 H PHE A 16 -8.838 9.151 -3.991 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.260 8.621 -6.315 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.126 9.573 -5.978 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.425 9.018 -7.485 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.087 6.632 -7.080 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.471 8.069 -4.957 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.578 4.363 -6.308 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -11.988 5.771 -4.236 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.757 3.871 -5.411 1.00 0.19 H new ATOM 95 N ASP A 17 -7.387 11.597 -5.485 1.00 0.21 N ATOM 96 CA ASP A 17 -6.947 12.929 -5.853 1.00 0.26 C ATOM 97 C ASP A 17 -5.539 12.831 -6.385 1.00 0.25 C ATOM 98 O ASP A 17 -5.050 13.708 -7.100 1.00 0.32 O ATOM 99 CB ASP A 17 -6.974 13.869 -4.652 1.00 0.32 C ATOM 100 CG ASP A 17 -6.578 15.292 -5.012 1.00 1.13 C ATOM 101 OD1 ASP A 17 -7.264 15.909 -5.852 1.00 1.30 O ATOM 102 OD2 ASP A 17 -5.589 15.807 -4.442 1.00 2.11 O ATOM 0 H ASP A 17 -7.431 11.426 -4.480 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.620 13.333 -6.610 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -7.975 13.873 -4.221 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.298 13.491 -3.885 1.00 0.32 H new ATOM 107 N PHE A 18 -4.896 11.728 -6.042 1.00 0.22 N ATOM 108 CA PHE A 18 -3.515 11.538 -6.357 1.00 0.23 C ATOM 109 C PHE A 18 -3.341 10.464 -7.384 1.00 0.26 C ATOM 110 O PHE A 18 -3.541 9.278 -7.115 1.00 0.29 O ATOM 111 CB PHE A 18 -2.759 11.223 -5.094 1.00 0.21 C ATOM 112 CG PHE A 18 -2.976 12.300 -4.090 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.502 13.572 -4.315 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.612 12.023 -2.895 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.668 14.552 -3.370 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.775 13.000 -1.941 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.452 14.327 -2.271 1.00 0.31 C ATOM 0 H PHE A 18 -5.325 10.951 -5.540 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.113 12.455 -6.788 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.091 10.266 -4.691 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.695 11.126 -5.311 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -1.996 13.800 -5.242 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.986 11.027 -2.708 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.178 15.506 -3.494 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.144 12.752 -0.957 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.814 15.150 -1.672 1.00 0.31 H new ATOM 127 N GLU A 19 -3.007 10.914 -8.571 1.00 0.35 N ATOM 128 CA GLU A 19 -2.677 10.028 -9.661 1.00 0.43 C ATOM 129 C GLU A 19 -1.630 9.029 -9.189 1.00 0.34 C ATOM 130 O GLU A 19 -0.705 9.374 -8.447 1.00 0.37 O ATOM 131 CB GLU A 19 -2.149 10.824 -10.858 1.00 0.63 C ATOM 132 CG GLU A 19 -2.038 10.008 -12.136 1.00 1.08 C ATOM 133 CD GLU A 19 -3.390 9.636 -12.714 1.00 2.04 C ATOM 134 OE1 GLU A 19 -4.060 8.740 -12.159 1.00 2.86 O ATOM 135 OE2 GLU A 19 -3.794 10.248 -13.727 1.00 2.30 O ATOM 0 H GLU A 19 -2.957 11.905 -8.808 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.574 9.495 -9.978 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -2.808 11.674 -11.037 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.168 11.228 -10.609 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -1.475 10.576 -12.877 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -1.472 9.099 -11.933 1.00 1.08 H new ATOM 142 N VAL A 20 -1.779 7.809 -9.631 1.00 0.29 N ATOM 143 CA VAL A 20 -0.902 6.736 -9.229 1.00 0.26 C ATOM 144 C VAL A 20 -0.061 6.346 -10.420 1.00 0.25 C ATOM 145 O VAL A 20 -0.321 6.804 -11.521 1.00 0.28 O ATOM 146 CB VAL A 20 -1.728 5.530 -8.695 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.909 4.261 -8.562 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.314 5.891 -7.356 1.00 0.49 C ATOM 0 H VAL A 20 -2.513 7.528 -10.281 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.251 7.061 -8.417 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.512 5.326 -9.424 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.542 3.457 -8.185 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.510 3.982 -9.537 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.086 4.430 -7.868 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.895 5.051 -6.975 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.510 6.123 -6.658 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -2.962 6.760 -7.465 1.00 0.49 H new ATOM 158 N LEU A 21 0.987 5.583 -10.197 1.00 0.28 N ATOM 159 CA LEU A 21 1.839 5.145 -11.275 1.00 0.35 C ATOM 160 C LEU A 21 1.988 3.643 -11.234 1.00 0.38 C ATOM 161 O LEU A 21 2.007 3.060 -10.160 1.00 0.58 O ATOM 162 CB LEU A 21 3.208 5.804 -11.136 1.00 0.45 C ATOM 163 CG LEU A 21 3.162 7.310 -10.908 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.529 7.846 -10.563 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.627 8.004 -12.134 1.00 0.68 C ATOM 0 H LEU A 21 1.268 5.253 -9.274 1.00 0.28 H new ATOM 0 HA LEU A 21 1.393 5.430 -12.228 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.739 5.339 -10.305 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.788 5.603 -12.037 1.00 0.45 H new ATOM 0 HG LEU A 21 2.497 7.507 -10.068 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.468 8.923 -10.405 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.889 7.366 -9.653 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.219 7.637 -11.381 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.598 9.080 -11.960 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.275 7.791 -12.984 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.620 7.644 -12.346 1.00 0.68 H new ATOM 177 N ASP A 22 2.051 3.007 -12.391 1.00 0.33 N ATOM 178 CA ASP A 22 2.503 1.631 -12.441 1.00 0.37 C ATOM 179 C ASP A 22 4.020 1.663 -12.318 1.00 0.35 C ATOM 180 O ASP A 22 4.599 2.751 -12.267 1.00 0.40 O ATOM 181 CB ASP A 22 2.056 0.913 -13.725 1.00 0.50 C ATOM 182 CG ASP A 22 0.551 0.745 -13.822 1.00 1.16 C ATOM 183 OD1 ASP A 22 0.008 -0.194 -13.208 1.00 1.48 O ATOM 184 OD2 ASP A 22 -0.098 1.577 -14.491 1.00 1.87 O ATOM 0 H ASP A 22 1.800 3.413 -13.292 1.00 0.33 H new ATOM 0 HA ASP A 22 2.057 1.061 -11.626 1.00 0.37 H new ATOM 0 HB2 ASP A 22 2.409 1.475 -14.590 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.528 -0.068 -13.768 1.00 0.50 H new ATOM 189 N ALA A 23 4.674 0.517 -12.284 1.00 0.39 N ATOM 190 CA ALA A 23 6.109 0.473 -11.983 1.00 0.42 C ATOM 191 C ALA A 23 6.966 1.175 -13.041 1.00 0.47 C ATOM 192 O ALA A 23 8.178 1.315 -12.875 1.00 0.59 O ATOM 193 CB ALA A 23 6.563 -0.965 -11.800 1.00 0.52 C ATOM 0 H ALA A 23 4.247 -0.393 -12.458 1.00 0.39 H new ATOM 0 HA ALA A 23 6.253 1.023 -11.053 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.630 -0.984 -11.577 1.00 0.52 H new ATOM 0 HB2 ALA A 23 6.012 -1.418 -10.976 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.373 -1.526 -12.715 1.00 0.52 H new ATOM 199 N ASP A 24 6.341 1.625 -14.118 1.00 0.46 N ATOM 200 CA ASP A 24 7.037 2.336 -15.165 1.00 0.54 C ATOM 201 C ASP A 24 6.952 3.847 -14.970 1.00 0.51 C ATOM 202 O ASP A 24 7.596 4.596 -15.701 1.00 0.62 O ATOM 203 CB ASP A 24 6.426 1.964 -16.507 1.00 0.69 C ATOM 204 CG ASP A 24 6.686 0.526 -16.892 1.00 1.43 C ATOM 205 OD1 ASP A 24 7.777 0.238 -17.421 1.00 1.51 O ATOM 206 OD2 ASP A 24 5.799 -0.322 -16.671 1.00 2.34 O ATOM 0 H ASP A 24 5.342 1.506 -14.285 1.00 0.46 H new ATOM 0 HA ASP A 24 8.089 2.052 -15.132 1.00 0.54 H new ATOM 0 HB2 ASP A 24 5.350 2.137 -16.471 1.00 0.69 H new ATOM 0 HB3 ASP A 24 6.829 2.620 -17.279 1.00 0.69 H new ATOM 211 N HIS A 25 6.135 4.284 -13.999 1.00 0.43 N ATOM 212 CA HIS A 25 5.864 5.708 -13.745 1.00 0.44 C ATOM 213 C HIS A 25 4.819 6.216 -14.723 1.00 0.47 C ATOM 214 O HIS A 25 4.442 7.385 -14.696 1.00 0.54 O ATOM 215 CB HIS A 25 7.121 6.598 -13.782 1.00 0.54 C ATOM 216 CG HIS A 25 7.905 6.617 -12.503 1.00 0.64 C ATOM 217 ND1 HIS A 25 7.553 7.366 -11.395 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.024 5.951 -12.156 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.422 7.146 -10.420 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.326 6.293 -10.860 1.00 1.26 N ATOM 0 H HIS A 25 5.641 3.656 -13.365 1.00 0.43 H new ATOM 0 HA HIS A 25 5.485 5.775 -12.725 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.771 6.255 -14.587 1.00 0.54 H new ATOM 0 HB3 HIS A 25 6.822 7.617 -14.026 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.582 5.272 -12.783 1.00 1.47 H new ATOM 0 HE1 HIS A 25 8.395 7.589 -9.435 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.121 5.944 -10.325 1.00 1.26 H new ATOM 229 N LYS A 26 4.371 5.326 -15.599 1.00 0.48 N ATOM 230 CA LYS A 26 3.174 5.571 -16.379 1.00 0.53 C ATOM 231 C LYS A 26 1.985 5.584 -15.431 1.00 0.41 C ATOM 232 O LYS A 26 1.752 4.608 -14.715 1.00 0.38 O ATOM 233 CB LYS A 26 2.989 4.495 -17.451 1.00 0.67 C ATOM 234 CG LYS A 26 3.176 3.094 -16.913 1.00 1.00 C ATOM 235 CD LYS A 26 2.250 2.093 -17.582 1.00 2.12 C ATOM 236 CE LYS A 26 0.795 2.380 -17.254 1.00 3.15 C ATOM 237 NZ LYS A 26 -0.099 1.263 -17.654 1.00 4.25 N ATOM 0 H LYS A 26 4.821 4.430 -15.784 1.00 0.48 H new ATOM 0 HA LYS A 26 3.259 6.530 -16.891 1.00 0.53 H new ATOM 0 HB2 LYS A 26 1.991 4.584 -17.881 1.00 0.67 H new ATOM 0 HB3 LYS A 26 3.700 4.667 -18.259 1.00 0.67 H new ATOM 0 HG2 LYS A 26 4.211 2.785 -17.062 1.00 1.00 H new ATOM 0 HG3 LYS A 26 2.994 3.092 -15.838 1.00 1.00 H new ATOM 0 HD2 LYS A 26 2.395 2.126 -18.662 1.00 2.12 H new ATOM 0 HD3 LYS A 26 2.506 1.085 -17.257 1.00 2.12 H new ATOM 0 HE2 LYS A 26 0.694 2.559 -16.184 1.00 3.15 H new ATOM 0 HE3 LYS A 26 0.483 3.293 -17.761 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 -1.082 1.501 -17.412 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 -0.023 1.108 -18.680 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 0.181 0.397 -17.151 1.00 4.25 H new ATOM 251 N PRO A 27 1.258 6.704 -15.368 1.00 0.41 N ATOM 252 CA PRO A 27 0.154 6.877 -14.421 1.00 0.37 C ATOM 253 C PRO A 27 -0.849 5.726 -14.426 1.00 0.32 C ATOM 254 O PRO A 27 -1.522 5.454 -15.421 1.00 0.36 O ATOM 255 CB PRO A 27 -0.488 8.181 -14.891 1.00 0.46 C ATOM 256 CG PRO A 27 0.660 8.941 -15.449 1.00 0.54 C ATOM 257 CD PRO A 27 1.477 7.915 -16.179 1.00 0.50 C ATOM 0 HA PRO A 27 0.503 6.897 -13.389 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.257 8.003 -15.643 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.963 8.715 -14.069 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.323 9.730 -16.121 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.239 9.420 -14.660 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.139 7.783 -17.207 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.531 8.190 -16.223 1.00 0.50 H new ATOM 265 N TYR A 28 -0.913 5.067 -13.281 1.00 0.28 N ATOM 266 CA TYR A 28 -1.869 4.014 -13.000 1.00 0.26 C ATOM 267 C TYR A 28 -3.226 4.588 -12.630 1.00 0.25 C ATOM 268 O TYR A 28 -3.327 5.611 -11.953 1.00 0.37 O ATOM 269 CB TYR A 28 -1.338 3.166 -11.847 1.00 0.30 C ATOM 270 CG TYR A 28 -2.185 1.982 -11.465 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.762 1.163 -12.421 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.386 1.678 -10.131 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.523 0.075 -12.053 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.139 0.597 -9.752 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.711 -0.205 -10.715 1.00 0.92 C ATOM 276 OH TYR A 28 -4.479 -1.284 -10.339 1.00 1.20 O ATOM 0 H TYR A 28 -0.283 5.256 -12.501 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.996 3.404 -13.895 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.343 2.808 -12.112 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.224 3.806 -10.972 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.614 1.380 -13.469 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -1.941 2.305 -9.373 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.970 -0.555 -12.808 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.283 0.375 -8.705 1.00 1.10 H new ATOM 0 HH TYR A 28 -5.339 -1.253 -10.809 1.00 1.20 H new ATOM 286 N ASN A 29 -4.261 3.900 -13.066 1.00 0.34 N ATOM 287 CA ASN A 29 -5.623 4.287 -12.779 1.00 0.42 C ATOM 288 C ASN A 29 -6.011 3.824 -11.378 1.00 0.34 C ATOM 289 O ASN A 29 -6.620 2.771 -11.210 1.00 0.44 O ATOM 290 CB ASN A 29 -6.564 3.687 -13.830 1.00 0.67 C ATOM 291 CG ASN A 29 -8.015 4.097 -13.644 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.929 3.352 -13.989 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.235 5.288 -13.118 1.00 1.51 N ATOM 0 H ASN A 29 -4.179 3.055 -13.631 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.707 5.373 -12.817 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -6.232 3.994 -14.822 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.493 2.600 -13.792 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.191 5.618 -12.986 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.449 5.878 -12.844 1.00 1.51 H new ATOM 300 N LEU A 30 -5.633 4.609 -10.373 1.00 0.25 N ATOM 301 CA LEU A 30 -5.986 4.302 -8.989 1.00 0.20 C ATOM 302 C LEU A 30 -7.500 4.212 -8.851 1.00 0.19 C ATOM 303 O LEU A 30 -8.031 3.309 -8.203 1.00 0.19 O ATOM 304 CB LEU A 30 -5.471 5.389 -8.031 1.00 0.22 C ATOM 305 CG LEU A 30 -5.835 5.201 -6.563 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.143 3.974 -5.995 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.464 6.442 -5.773 1.00 0.28 C ATOM 0 H LEU A 30 -5.084 5.460 -10.490 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.523 3.350 -8.730 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.385 5.436 -8.114 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.858 6.353 -8.362 1.00 0.22 H new ATOM 0 HG LEU A 30 -6.911 5.048 -6.484 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.415 3.856 -4.946 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.454 3.090 -6.552 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.063 4.094 -6.079 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.728 6.299 -4.725 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.392 6.619 -5.856 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.006 7.301 -6.169 1.00 0.28 H new ATOM 319 N VAL A 31 -8.174 5.143 -9.520 1.00 0.20 N ATOM 320 CA VAL A 31 -9.608 5.367 -9.359 1.00 0.19 C ATOM 321 C VAL A 31 -10.436 4.209 -9.896 1.00 0.20 C ATOM 322 O VAL A 31 -11.657 4.198 -9.776 1.00 0.23 O ATOM 323 CB VAL A 31 -10.037 6.654 -10.072 1.00 0.22 C ATOM 324 CG1 VAL A 31 -11.305 7.236 -9.483 1.00 1.02 C ATOM 325 CG2 VAL A 31 -8.924 7.679 -10.052 1.00 0.87 C ATOM 0 H VAL A 31 -7.736 5.769 -10.196 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.790 5.453 -8.288 1.00 0.19 H new ATOM 0 HB VAL A 31 -10.250 6.389 -11.108 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -11.571 8.147 -10.020 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -12.114 6.512 -9.574 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -11.144 7.469 -8.430 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.253 8.583 -10.564 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.669 7.919 -9.020 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -8.047 7.274 -10.558 1.00 0.87 H new ATOM 335 N GLN A 32 -9.782 3.225 -10.486 1.00 0.21 N ATOM 336 CA GLN A 32 -10.490 2.044 -10.931 1.00 0.23 C ATOM 337 C GLN A 32 -10.938 1.249 -9.713 1.00 0.22 C ATOM 338 O GLN A 32 -11.823 0.401 -9.792 1.00 0.28 O ATOM 339 CB GLN A 32 -9.607 1.178 -11.831 1.00 0.26 C ATOM 340 CG GLN A 32 -8.502 0.458 -11.077 1.00 0.29 C ATOM 341 CD GLN A 32 -7.690 -0.473 -11.950 1.00 0.35 C ATOM 342 OE1 GLN A 32 -7.176 -1.484 -11.479 1.00 1.02 O ATOM 343 NE2 GLN A 32 -7.561 -0.139 -13.220 1.00 0.75 N ATOM 0 H GLN A 32 -8.778 3.221 -10.665 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.358 2.350 -11.515 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.230 0.442 -12.339 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.161 1.805 -12.603 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.837 1.196 -10.628 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.942 -0.113 -10.260 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -8.004 0.710 -13.572 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -7.018 -0.730 -13.850 1.00 0.75 H new ATOM 352 N HIS A 33 -10.321 1.555 -8.576 1.00 0.17 N ATOM 353 CA HIS A 33 -10.672 0.915 -7.318 1.00 0.16 C ATOM 354 C HIS A 33 -11.713 1.746 -6.597 1.00 0.16 C ATOM 355 O HIS A 33 -11.854 1.692 -5.383 1.00 0.17 O ATOM 356 CB HIS A 33 -9.410 0.688 -6.475 1.00 0.16 C ATOM 357 CG HIS A 33 -8.418 -0.145 -7.218 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.698 -1.436 -7.582 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.197 0.148 -7.756 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.717 -1.908 -8.312 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.790 -0.973 -8.441 1.00 0.28 N ATOM 0 H HIS A 33 -9.573 2.245 -8.503 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.111 -0.065 -7.505 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -8.963 1.648 -6.215 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.676 0.196 -5.539 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.540 -1.951 -7.325 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.657 1.078 -7.662 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.673 -2.899 -8.739 1.00 0.27 H new ATOM 0 HE2 HIS A 33 -5.918 -1.068 -8.962 1.00 0.28 H new ATOM 370 N LYS A 34 -12.429 2.534 -7.381 1.00 0.19 N ATOM 371 CA LYS A 34 -13.611 3.210 -6.908 1.00 0.19 C ATOM 372 C LYS A 34 -14.786 2.257 -6.955 1.00 0.21 C ATOM 373 O LYS A 34 -15.113 1.713 -8.009 1.00 0.33 O ATOM 374 CB LYS A 34 -13.911 4.436 -7.763 1.00 0.22 C ATOM 375 CG LYS A 34 -13.123 5.648 -7.358 1.00 0.28 C ATOM 376 CD LYS A 34 -14.011 6.868 -7.184 1.00 0.69 C ATOM 377 CE LYS A 34 -14.602 7.311 -8.503 1.00 1.01 C ATOM 378 NZ LYS A 34 -15.311 8.613 -8.384 1.00 1.56 N ATOM 0 H LYS A 34 -12.203 2.719 -8.358 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.440 3.538 -5.883 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.698 4.204 -8.806 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -14.975 4.664 -7.698 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.598 5.445 -6.425 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.364 5.856 -8.112 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.813 6.639 -6.482 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -13.431 7.683 -6.751 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -13.809 7.396 -9.246 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -15.296 6.551 -8.863 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -15.702 8.881 -9.310 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -16.084 8.525 -7.694 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -14.643 9.344 -8.065 1.00 1.56 H new ATOM 392 N GLY A 35 -15.400 2.041 -5.818 1.00 0.18 N ATOM 393 CA GLY A 35 -16.514 1.137 -5.748 1.00 0.20 C ATOM 394 C GLY A 35 -16.232 -0.024 -4.828 1.00 0.17 C ATOM 395 O GLY A 35 -17.098 -0.423 -4.047 1.00 0.20 O ATOM 0 H GLY A 35 -15.146 2.479 -4.932 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.396 1.673 -5.398 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.743 0.763 -6.746 1.00 0.20 H new ATOM 399 N SER A 36 -15.025 -0.572 -4.904 1.00 0.16 N ATOM 400 CA SER A 36 -14.613 -1.592 -3.982 1.00 0.16 C ATOM 401 C SER A 36 -13.282 -1.195 -3.394 1.00 0.14 C ATOM 402 O SER A 36 -12.355 -0.847 -4.127 1.00 0.16 O ATOM 403 CB SER A 36 -14.501 -2.936 -4.688 1.00 0.20 C ATOM 404 OG SER A 36 -15.704 -3.251 -5.370 1.00 0.29 O ATOM 0 H SER A 36 -14.323 -0.319 -5.599 1.00 0.16 H new ATOM 0 HA SER A 36 -15.354 -1.693 -3.189 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.673 -2.912 -5.396 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.276 -3.716 -3.961 1.00 0.20 H new ATOM 0 HG SER A 36 -15.492 -3.639 -6.245 1.00 0.29 H new ATOM 410 N PRO A 37 -13.199 -1.201 -2.064 1.00 0.12 N ATOM 411 CA PRO A 37 -11.995 -0.877 -1.314 1.00 0.12 C ATOM 412 C PRO A 37 -10.747 -1.489 -1.900 1.00 0.12 C ATOM 413 O PRO A 37 -10.782 -2.527 -2.550 1.00 0.15 O ATOM 414 CB PRO A 37 -12.277 -1.463 0.081 1.00 0.15 C ATOM 415 CG PRO A 37 -13.541 -2.224 -0.073 1.00 0.18 C ATOM 416 CD PRO A 37 -14.285 -1.524 -1.153 1.00 0.15 C ATOM 0 HA PRO A 37 -11.800 0.195 -1.317 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.464 -2.110 0.409 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.379 -0.675 0.827 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.346 -3.263 -0.338 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.111 -2.234 0.856 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.038 -2.161 -1.617 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.800 -0.634 -0.791 1.00 0.15 H new ATOM 424 N LEU A 38 -9.656 -0.818 -1.647 1.00 0.14 N ATOM 425 CA LEU A 38 -8.357 -1.199 -2.136 1.00 0.13 C ATOM 426 C LEU A 38 -7.368 -1.011 -0.993 1.00 0.13 C ATOM 427 O LEU A 38 -7.505 -0.103 -0.197 1.00 0.20 O ATOM 428 CB LEU A 38 -7.957 -0.348 -3.350 1.00 0.16 C ATOM 429 CG LEU A 38 -8.038 1.173 -3.187 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.338 1.859 -4.338 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.482 1.657 -3.122 1.00 0.26 C ATOM 0 H LEU A 38 -9.645 0.030 -1.081 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.365 -2.238 -2.466 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.934 -0.606 -3.623 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.592 -0.634 -4.189 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.547 1.425 -2.247 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.402 2.940 -4.211 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.291 1.558 -4.358 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.816 1.575 -5.276 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.498 2.741 -3.006 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -9.999 1.383 -4.041 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -9.983 1.194 -2.272 1.00 0.26 H new ATOM 443 N LEU A 39 -6.418 -1.890 -0.876 1.00 0.18 N ATOM 444 CA LEU A 39 -5.392 -1.767 0.128 1.00 0.19 C ATOM 445 C LEU A 39 -4.109 -1.386 -0.548 1.00 0.18 C ATOM 446 O LEU A 39 -3.573 -2.143 -1.355 1.00 0.21 O ATOM 447 CB LEU A 39 -5.170 -3.078 0.860 1.00 0.23 C ATOM 448 CG LEU A 39 -5.921 -3.296 2.178 1.00 0.35 C ATOM 449 CD1 LEU A 39 -5.225 -2.581 3.312 1.00 1.10 C ATOM 450 CD2 LEU A 39 -7.365 -2.842 2.078 1.00 1.19 C ATOM 0 H LEU A 39 -6.328 -2.714 -1.471 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.706 -1.013 0.850 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.439 -3.889 0.183 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.103 -3.172 1.063 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.920 -4.367 2.383 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -5.774 -2.748 4.239 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -4.211 -2.966 3.417 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -5.188 -1.512 3.100 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -7.867 -3.012 3.031 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -7.396 -1.780 1.835 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -7.871 -3.408 1.296 1.00 1.19 H new ATOM 462 N ILE A 40 -3.625 -0.216 -0.259 1.00 0.19 N ATOM 463 CA ILE A 40 -2.372 0.200 -0.829 1.00 0.20 C ATOM 464 C ILE A 40 -1.248 -0.095 0.142 1.00 0.18 C ATOM 465 O ILE A 40 -1.332 0.261 1.320 1.00 0.20 O ATOM 466 CB ILE A 40 -2.398 1.682 -1.182 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.820 2.101 -1.541 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.454 1.961 -2.339 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.875 3.480 -2.134 1.00 0.35 C ATOM 0 H ILE A 40 -4.069 0.463 0.360 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.205 -0.358 -1.750 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.067 2.261 -0.320 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.239 1.386 -2.249 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.443 2.067 -0.647 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.481 3.023 -2.583 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.440 1.679 -2.057 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.763 1.381 -3.209 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.908 3.732 -2.373 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.482 4.200 -1.417 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.275 3.509 -3.043 1.00 0.35 H new ATOM 481 N TYR A 41 -0.224 -0.781 -0.340 1.00 0.18 N ATOM 482 CA TYR A 41 0.866 -1.204 0.515 1.00 0.19 C ATOM 483 C TYR A 41 2.147 -0.466 0.148 1.00 0.20 C ATOM 484 O TYR A 41 2.581 -0.502 -0.999 1.00 0.27 O ATOM 485 CB TYR A 41 1.121 -2.727 0.398 1.00 0.20 C ATOM 486 CG TYR A 41 0.013 -3.636 0.906 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.318 -3.353 0.665 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.312 -4.811 1.599 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.314 -4.204 1.090 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.690 -5.663 2.033 1.00 0.35 C ATOM 491 CZ TYR A 41 -1.999 -5.350 1.770 1.00 0.33 C ATOM 492 OH TYR A 41 -2.998 -6.198 2.170 1.00 0.42 O ATOM 0 H TYR A 41 -0.128 -1.055 -1.318 1.00 0.18 H new ATOM 0 HA TYR A 41 0.580 -0.970 1.540 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.304 -2.964 -0.650 1.00 0.20 H new ATOM 0 HB3 TYR A 41 2.035 -2.964 0.943 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.581 -2.450 0.135 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.343 -5.060 1.800 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.348 -3.966 0.886 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.443 -6.565 2.573 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.280 -6.751 1.412 1.00 0.42 H new ATOM 502 N ASN A 42 2.747 0.196 1.119 1.00 0.28 N ATOM 503 CA ASN A 42 4.050 0.831 0.932 1.00 0.34 C ATOM 504 C ASN A 42 5.104 -0.237 1.130 1.00 0.37 C ATOM 505 O ASN A 42 5.580 -0.433 2.237 1.00 0.54 O ATOM 506 CB ASN A 42 4.279 1.924 1.985 1.00 0.46 C ATOM 507 CG ASN A 42 3.063 2.789 2.277 1.00 1.50 C ATOM 508 OD1 ASN A 42 1.921 2.336 2.262 1.00 2.27 O ATOM 509 ND2 ASN A 42 3.303 4.054 2.564 1.00 2.35 N ATOM 0 H ASN A 42 2.355 0.312 2.053 1.00 0.28 H new ATOM 0 HA ASN A 42 4.098 1.280 -0.060 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.604 1.453 2.913 1.00 0.46 H new ATOM 0 HB3 ASN A 42 5.093 2.567 1.651 1.00 0.46 H new ATOM 0 HD21 ASN A 42 2.530 4.683 2.781 1.00 2.35 H new ATOM 0 HD22 ASN A 42 4.261 4.403 2.569 1.00 2.35 H new ATOM 516 N VAL A 43 5.524 -0.882 0.067 1.00 0.36 N ATOM 517 CA VAL A 43 6.202 -2.158 0.196 1.00 0.38 C ATOM 518 C VAL A 43 7.703 -2.011 0.000 1.00 0.42 C ATOM 519 O VAL A 43 8.161 -1.166 -0.761 1.00 0.50 O ATOM 520 CB VAL A 43 5.623 -3.167 -0.819 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.953 -2.750 -2.227 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.125 -4.570 -0.571 1.00 0.98 C ATOM 0 H VAL A 43 5.411 -0.551 -0.891 1.00 0.36 H new ATOM 0 HA VAL A 43 6.035 -2.531 1.207 1.00 0.38 H new ATOM 0 HB VAL A 43 4.541 -3.169 -0.686 1.00 0.39 H new ATOM 0 HG11 VAL A 43 5.537 -3.474 -2.928 1.00 1.03 H new ATOM 0 HG12 VAL A 43 5.527 -1.766 -2.425 1.00 1.03 H new ATOM 0 HG13 VAL A 43 7.035 -2.708 -2.350 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.692 -5.247 -1.308 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.212 -4.588 -0.656 1.00 0.98 H new ATOM 0 HG23 VAL A 43 5.834 -4.889 0.430 1.00 0.98 H new ATOM 532 N ALA A 44 8.461 -2.835 0.709 1.00 0.50 N ATOM 533 CA ALA A 44 9.906 -2.746 0.696 1.00 0.59 C ATOM 534 C ALA A 44 10.504 -3.579 -0.428 1.00 0.58 C ATOM 535 O ALA A 44 10.542 -4.806 -0.349 1.00 0.88 O ATOM 536 CB ALA A 44 10.470 -3.185 2.039 1.00 0.83 C ATOM 0 H ALA A 44 8.091 -3.577 1.304 1.00 0.50 H new ATOM 0 HA ALA A 44 10.178 -1.705 0.519 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.557 -3.114 2.018 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.080 -2.540 2.826 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.178 -4.216 2.237 1.00 0.83 H new ATOM 542 N SER A 45 10.924 -2.892 -1.479 1.00 0.57 N ATOM 543 CA SER A 45 11.701 -3.496 -2.563 1.00 0.63 C ATOM 544 C SER A 45 12.963 -4.152 -2.029 1.00 1.01 C ATOM 545 O SER A 45 14.002 -3.513 -1.891 1.00 1.78 O ATOM 546 CB SER A 45 12.070 -2.438 -3.602 1.00 0.73 C ATOM 547 OG SER A 45 12.146 -1.151 -3.006 1.00 1.62 O ATOM 0 H SER A 45 10.738 -1.898 -1.609 1.00 0.57 H new ATOM 0 HA SER A 45 11.084 -4.263 -3.032 1.00 0.63 H new ATOM 0 HB2 SER A 45 13.027 -2.689 -4.059 1.00 0.73 H new ATOM 0 HB3 SER A 45 11.328 -2.431 -4.400 1.00 0.73 H new ATOM 0 HG SER A 45 11.404 -0.597 -3.327 1.00 1.62 H new ATOM 553 N LYS A 46 12.856 -5.427 -1.715 1.00 1.32 N ATOM 554 CA LYS A 46 13.967 -6.181 -1.183 1.00 1.69 C ATOM 555 C LYS A 46 13.941 -7.587 -1.764 1.00 1.14 C ATOM 556 O LYS A 46 12.953 -7.994 -2.377 1.00 1.47 O ATOM 557 CB LYS A 46 13.887 -6.225 0.350 1.00 2.68 C ATOM 558 CG LYS A 46 15.128 -6.816 1.010 1.00 3.45 C ATOM 559 CD LYS A 46 15.028 -6.846 2.528 1.00 4.39 C ATOM 560 CE LYS A 46 15.098 -5.452 3.133 1.00 5.19 C ATOM 561 NZ LYS A 46 15.306 -5.504 4.604 1.00 5.84 N ATOM 0 H LYS A 46 11.997 -5.967 -1.822 1.00 1.32 H new ATOM 0 HA LYS A 46 14.905 -5.699 -1.460 1.00 1.69 H new ATOM 0 HB2 LYS A 46 13.732 -5.214 0.726 1.00 2.68 H new ATOM 0 HB3 LYS A 46 13.016 -6.811 0.643 1.00 2.68 H new ATOM 0 HG2 LYS A 46 15.283 -7.829 0.640 1.00 3.45 H new ATOM 0 HG3 LYS A 46 16.002 -6.233 0.719 1.00 3.45 H new ATOM 0 HD2 LYS A 46 14.091 -7.321 2.820 1.00 4.39 H new ATOM 0 HD3 LYS A 46 15.835 -7.457 2.932 1.00 4.39 H new ATOM 0 HE2 LYS A 46 15.911 -4.894 2.669 1.00 5.19 H new ATOM 0 HE3 LYS A 46 14.176 -4.913 2.914 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 15.805 -4.646 4.915 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 14.385 -5.561 5.083 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 15.874 -6.341 4.845 1.00 5.84 H new ATOM 575 N CYS A 47 15.003 -8.335 -1.538 1.00 1.21 N ATOM 576 CA CYS A 47 15.134 -9.660 -2.101 1.00 1.53 C ATOM 577 C CYS A 47 14.987 -10.708 -1.008 1.00 1.99 C ATOM 578 O CYS A 47 15.773 -10.749 -0.061 1.00 2.46 O ATOM 579 CB CYS A 47 16.494 -9.778 -2.796 1.00 2.04 C ATOM 580 SG CYS A 47 16.973 -11.465 -3.234 1.00 3.55 S ATOM 0 H CYS A 47 15.793 -8.042 -0.963 1.00 1.21 H new ATOM 0 HA CYS A 47 14.347 -9.829 -2.836 1.00 1.53 H new ATOM 0 HB2 CYS A 47 16.478 -9.172 -3.702 1.00 2.04 H new ATOM 0 HB3 CYS A 47 17.258 -9.355 -2.144 1.00 2.04 H new ATOM 0 HG CYS A 47 18.135 -11.449 -3.816 1.00 3.55 H new ATOM 586 N GLY A 48 13.961 -11.540 -1.146 1.00 2.39 N ATOM 587 CA GLY A 48 13.689 -12.570 -0.164 1.00 2.91 C ATOM 588 C GLY A 48 13.208 -12.003 1.156 1.00 2.40 C ATOM 589 O GLY A 48 13.743 -12.344 2.214 1.00 2.46 O ATOM 0 H GLY A 48 13.308 -11.518 -1.929 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.936 -13.253 -0.558 1.00 2.91 H new ATOM 0 HA3 GLY A 48 14.593 -13.155 0.004 1.00 2.91 H new ATOM 593 N TYR A 49 12.192 -11.145 1.113 1.00 2.15 N ATOM 594 CA TYR A 49 11.698 -10.511 2.325 1.00 1.79 C ATOM 595 C TYR A 49 10.174 -10.376 2.318 1.00 1.42 C ATOM 596 O TYR A 49 9.551 -10.220 1.268 1.00 1.67 O ATOM 597 CB TYR A 49 12.346 -9.137 2.515 1.00 2.10 C ATOM 598 CG TYR A 49 12.016 -8.498 3.846 1.00 2.40 C ATOM 599 CD1 TYR A 49 12.575 -8.979 5.026 1.00 2.66 C ATOM 600 CD2 TYR A 49 11.139 -7.427 3.926 1.00 3.01 C ATOM 601 CE1 TYR A 49 12.272 -8.405 6.245 1.00 3.26 C ATOM 602 CE2 TYR A 49 10.830 -6.848 5.141 1.00 3.74 C ATOM 603 CZ TYR A 49 11.398 -7.340 6.298 1.00 3.76 C ATOM 604 OH TYR A 49 11.095 -6.762 7.513 1.00 4.63 O ATOM 0 H TYR A 49 11.701 -10.877 0.260 1.00 2.15 H new ATOM 0 HA TYR A 49 11.971 -11.155 3.161 1.00 1.79 H new ATOM 0 HB2 TYR A 49 13.428 -9.238 2.427 1.00 2.10 H new ATOM 0 HB3 TYR A 49 12.021 -8.476 1.712 1.00 2.10 H new ATOM 0 HD1 TYR A 49 13.257 -9.815 4.988 1.00 2.66 H new ATOM 0 HD2 TYR A 49 10.690 -7.039 3.023 1.00 3.01 H new ATOM 0 HE1 TYR A 49 12.717 -8.788 7.151 1.00 3.26 H new ATOM 0 HE2 TYR A 49 10.146 -6.013 5.185 1.00 3.74 H new ATOM 0 HH TYR A 49 11.498 -5.870 7.560 1.00 4.63 H new ATOM 614 N THR A 50 9.601 -10.433 3.515 1.00 1.05 N ATOM 615 CA THR A 50 8.165 -10.339 3.734 1.00 0.81 C ATOM 616 C THR A 50 7.920 -10.430 5.244 1.00 0.77 C ATOM 617 O THR A 50 8.829 -10.805 5.988 1.00 1.44 O ATOM 618 CB THR A 50 7.413 -11.484 3.011 1.00 1.09 C ATOM 619 OG1 THR A 50 6.003 -11.401 3.258 1.00 1.93 O ATOM 620 CG2 THR A 50 7.925 -12.849 3.455 1.00 1.87 C ATOM 0 H THR A 50 10.134 -10.548 4.377 1.00 1.05 H new ATOM 0 HA THR A 50 7.793 -9.397 3.332 1.00 0.81 H new ATOM 0 HB THR A 50 7.599 -11.371 1.943 1.00 1.09 H new ATOM 0 HG1 THR A 50 5.578 -12.249 3.013 1.00 1.93 H new ATOM 0 HG21 THR A 50 7.377 -13.631 2.930 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.987 -12.932 3.224 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.777 -12.961 4.529 1.00 1.87 H new ATOM 628 N LYS A 51 6.734 -10.067 5.706 1.00 0.61 N ATOM 629 CA LYS A 51 6.387 -10.217 7.108 1.00 0.56 C ATOM 630 C LYS A 51 4.988 -10.816 7.206 1.00 0.76 C ATOM 631 O LYS A 51 4.315 -10.717 8.231 1.00 1.55 O ATOM 632 CB LYS A 51 6.462 -8.857 7.819 1.00 0.59 C ATOM 633 CG LYS A 51 6.570 -8.961 9.331 1.00 1.22 C ATOM 634 CD LYS A 51 7.031 -7.649 9.942 1.00 1.39 C ATOM 635 CE LYS A 51 8.448 -7.313 9.505 1.00 1.46 C ATOM 636 NZ LYS A 51 8.897 -5.994 10.020 1.00 2.01 N ATOM 0 H LYS A 51 5.995 -9.666 5.128 1.00 0.61 H new ATOM 0 HA LYS A 51 7.094 -10.885 7.600 1.00 0.56 H new ATOM 0 HB2 LYS A 51 7.323 -8.306 7.440 1.00 0.59 H new ATOM 0 HB3 LYS A 51 5.575 -8.276 7.566 1.00 0.59 H new ATOM 0 HG2 LYS A 51 5.602 -9.239 9.749 1.00 1.22 H new ATOM 0 HG3 LYS A 51 7.271 -9.753 9.594 1.00 1.22 H new ATOM 0 HD2 LYS A 51 6.355 -6.848 9.644 1.00 1.39 H new ATOM 0 HD3 LYS A 51 6.988 -7.715 11.029 1.00 1.39 H new ATOM 0 HE2 LYS A 51 9.128 -8.089 9.856 1.00 1.46 H new ATOM 0 HE3 LYS A 51 8.500 -7.313 8.416 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 9.886 -6.062 10.334 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 8.822 -5.283 9.265 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 8.298 -5.712 10.822 1.00 2.01 H new ATOM 650 N GLY A 52 4.564 -11.449 6.116 1.00 0.45 N ATOM 651 CA GLY A 52 3.221 -11.970 6.032 1.00 0.51 C ATOM 652 C GLY A 52 2.371 -11.154 5.083 1.00 0.41 C ATOM 653 O GLY A 52 1.600 -11.704 4.300 1.00 0.41 O ATOM 0 H GLY A 52 5.135 -11.609 5.286 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.252 -13.006 5.696 1.00 0.51 H new ATOM 0 HA3 GLY A 52 2.766 -11.969 7.023 1.00 0.51 H new ATOM 657 N GLY A 53 2.548 -9.839 5.136 1.00 0.44 N ATOM 658 CA GLY A 53 1.758 -8.921 4.326 1.00 0.50 C ATOM 659 C GLY A 53 1.925 -9.105 2.828 1.00 0.36 C ATOM 660 O GLY A 53 1.090 -8.646 2.066 1.00 0.32 O ATOM 0 H GLY A 53 3.236 -9.383 5.735 1.00 0.44 H new ATOM 0 HA2 GLY A 53 0.705 -9.045 4.580 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.031 -7.898 4.587 1.00 0.50 H new ATOM 664 N TYR A 54 2.994 -9.754 2.390 1.00 0.37 N ATOM 665 CA TYR A 54 3.206 -9.986 0.970 1.00 0.36 C ATOM 666 C TYR A 54 2.312 -11.130 0.488 1.00 0.26 C ATOM 667 O TYR A 54 1.514 -10.952 -0.430 1.00 0.25 O ATOM 668 CB TYR A 54 4.685 -10.279 0.728 1.00 0.45 C ATOM 669 CG TYR A 54 5.075 -10.553 -0.708 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.179 -10.276 -1.723 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.315 -11.085 -1.055 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.493 -10.513 -3.037 1.00 0.46 C ATOM 673 CE2 TYR A 54 6.642 -11.322 -2.378 1.00 0.65 C ATOM 674 CZ TYR A 54 5.861 -11.075 -3.321 1.00 0.56 C ATOM 675 OH TYR A 54 6.037 -11.251 -4.687 1.00 0.70 O ATOM 0 H TYR A 54 3.725 -10.128 2.995 1.00 0.37 H new ATOM 0 HA TYR A 54 2.935 -9.099 0.398 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.268 -9.431 1.088 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.969 -11.140 1.333 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.211 -9.864 -1.476 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.031 -11.316 -0.280 1.00 0.53 H new ATOM 0 HE1 TYR A 54 3.791 -10.306 -3.832 1.00 0.46 H new ATOM 0 HE2 TYR A 54 7.613 -11.738 -2.605 1.00 0.65 H new ATOM 0 HH TYR A 54 6.268 -10.393 -5.100 1.00 0.70 H new ATOM 685 N GLU A 55 2.450 -12.292 1.115 1.00 0.25 N ATOM 686 CA GLU A 55 1.566 -13.428 0.848 1.00 0.27 C ATOM 687 C GLU A 55 0.115 -13.012 1.076 1.00 0.22 C ATOM 688 O GLU A 55 -0.792 -13.396 0.332 1.00 0.25 O ATOM 689 CB GLU A 55 1.914 -14.615 1.760 1.00 0.36 C ATOM 690 CG GLU A 55 3.031 -14.346 2.758 1.00 1.14 C ATOM 691 CD GLU A 55 4.412 -14.366 2.138 1.00 1.92 C ATOM 692 OE1 GLU A 55 5.015 -15.457 2.057 1.00 2.39 O ATOM 693 OE2 GLU A 55 4.907 -13.288 1.757 1.00 2.61 O ATOM 0 H GLU A 55 3.168 -12.476 1.816 1.00 0.25 H new ATOM 0 HA GLU A 55 1.701 -13.737 -0.188 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.019 -14.909 2.308 1.00 0.36 H new ATOM 0 HB3 GLU A 55 2.199 -15.463 1.137 1.00 0.36 H new ATOM 0 HG2 GLU A 55 2.865 -13.375 3.224 1.00 1.14 H new ATOM 0 HG3 GLU A 55 2.987 -15.092 3.551 1.00 1.14 H new ATOM 700 N THR A 56 -0.074 -12.216 2.119 1.00 0.25 N ATOM 701 CA THR A 56 -1.350 -11.609 2.444 1.00 0.24 C ATOM 702 C THR A 56 -1.874 -10.780 1.291 1.00 0.21 C ATOM 703 O THR A 56 -2.946 -11.054 0.763 1.00 0.22 O ATOM 704 CB THR A 56 -1.192 -10.735 3.701 1.00 0.26 C ATOM 705 OG1 THR A 56 -1.005 -11.577 4.844 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.386 -9.827 3.913 1.00 0.25 C ATOM 0 H THR A 56 0.670 -11.972 2.772 1.00 0.25 H new ATOM 0 HA THR A 56 -2.074 -12.401 2.636 1.00 0.24 H new ATOM 0 HB THR A 56 -0.320 -10.096 3.562 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.083 -11.909 4.858 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.233 -9.228 4.811 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.499 -9.168 3.052 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.286 -10.431 4.029 1.00 0.25 H new ATOM 714 N ALA A 57 -1.099 -9.789 0.896 1.00 0.19 N ATOM 715 CA ALA A 57 -1.470 -8.899 -0.183 1.00 0.20 C ATOM 716 C ALA A 57 -1.767 -9.676 -1.453 1.00 0.19 C ATOM 717 O ALA A 57 -2.767 -9.425 -2.127 1.00 0.22 O ATOM 718 CB ALA A 57 -0.349 -7.911 -0.423 1.00 0.22 C ATOM 0 H ALA A 57 -0.193 -9.579 1.316 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.376 -8.363 0.099 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.624 -7.238 -1.235 1.00 0.22 H new ATOM 0 HB2 ALA A 57 -0.174 -7.332 0.484 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.560 -8.450 -0.691 1.00 0.22 H new ATOM 724 N THR A 58 -0.893 -10.627 -1.764 1.00 0.17 N ATOM 725 CA THR A 58 -1.017 -11.428 -2.971 1.00 0.17 C ATOM 726 C THR A 58 -2.396 -12.099 -3.027 1.00 0.17 C ATOM 727 O THR A 58 -3.139 -11.973 -4.009 1.00 0.19 O ATOM 728 CB THR A 58 0.083 -12.507 -3.013 1.00 0.20 C ATOM 729 OG1 THR A 58 1.372 -11.881 -2.989 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.046 -13.374 -4.258 1.00 0.26 C ATOM 0 H THR A 58 -0.084 -10.862 -1.189 1.00 0.17 H new ATOM 0 HA THR A 58 -0.905 -10.769 -3.832 1.00 0.17 H new ATOM 0 HB THR A 58 -0.031 -13.148 -2.139 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.553 -11.540 -2.088 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.743 -14.126 -4.261 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.018 -13.867 -4.259 1.00 0.26 H new ATOM 0 HG23 THR A 58 0.045 -12.750 -5.147 1.00 0.26 H new ATOM 738 N THR A 59 -2.736 -12.768 -1.932 1.00 0.16 N ATOM 739 CA THR A 59 -3.977 -13.518 -1.825 1.00 0.17 C ATOM 740 C THR A 59 -5.185 -12.587 -1.691 1.00 0.16 C ATOM 741 O THR A 59 -6.249 -12.853 -2.250 1.00 0.19 O ATOM 742 CB THR A 59 -3.921 -14.468 -0.611 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.730 -15.265 -0.677 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.139 -15.378 -0.566 1.00 0.46 C ATOM 0 H THR A 59 -2.157 -12.805 -1.093 1.00 0.16 H new ATOM 0 HA THR A 59 -4.092 -14.099 -2.740 1.00 0.17 H new ATOM 0 HB THR A 59 -3.913 -13.862 0.295 1.00 0.20 H new ATOM 0 HG1 THR A 59 -1.967 -14.740 -0.356 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.070 -16.035 0.301 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.043 -14.773 -0.492 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.178 -15.979 -1.475 1.00 0.46 H new ATOM 752 N LEU A 60 -5.004 -11.485 -0.973 1.00 0.13 N ATOM 753 CA LEU A 60 -6.069 -10.535 -0.730 1.00 0.13 C ATOM 754 C LEU A 60 -6.513 -9.909 -2.016 1.00 0.13 C ATOM 755 O LEU A 60 -7.697 -9.914 -2.355 1.00 0.15 O ATOM 756 CB LEU A 60 -5.577 -9.456 0.207 1.00 0.13 C ATOM 757 CG LEU A 60 -5.727 -9.798 1.666 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.146 -8.698 2.526 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.194 -9.995 1.976 1.00 0.35 C ATOM 0 H LEU A 60 -4.114 -11.230 -0.546 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.913 -11.060 -0.281 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.526 -9.258 -0.003 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.122 -8.535 0.002 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.184 -10.718 1.884 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.262 -8.959 3.578 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.087 -8.577 2.296 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.670 -7.764 2.324 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.313 -10.243 3.031 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.739 -9.077 1.756 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.589 -10.807 1.365 1.00 0.35 H new ATOM 771 N TYR A 61 -5.537 -9.386 -2.727 1.00 0.14 N ATOM 772 CA TYR A 61 -5.767 -8.780 -4.007 1.00 0.15 C ATOM 773 C TYR A 61 -6.545 -9.727 -4.902 1.00 0.17 C ATOM 774 O TYR A 61 -7.588 -9.382 -5.382 1.00 0.22 O ATOM 775 CB TYR A 61 -4.446 -8.423 -4.660 1.00 0.17 C ATOM 776 CG TYR A 61 -4.631 -7.695 -5.957 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.834 -7.078 -6.249 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.614 -7.615 -6.877 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.015 -6.397 -7.430 1.00 0.18 C ATOM 780 CE2 TYR A 61 -3.784 -6.937 -8.068 1.00 0.31 C ATOM 781 CZ TYR A 61 -4.989 -6.329 -8.339 1.00 0.23 C ATOM 782 OH TYR A 61 -5.167 -5.644 -9.515 1.00 0.28 O ATOM 0 H TYR A 61 -4.562 -9.373 -2.427 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.349 -7.870 -3.863 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.862 -7.804 -3.979 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.872 -9.333 -4.835 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.645 -7.132 -5.538 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -2.667 -8.090 -6.666 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.960 -5.918 -7.641 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -2.976 -6.884 -8.783 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.346 -5.690 -10.048 1.00 0.28 H new ATOM 792 N ASN A 62 -6.059 -10.937 -5.057 1.00 0.18 N ATOM 793 CA ASN A 62 -6.596 -11.869 -6.031 1.00 0.22 C ATOM 794 C ASN A 62 -7.937 -12.413 -5.615 1.00 0.20 C ATOM 795 O ASN A 62 -8.741 -12.802 -6.462 1.00 0.24 O ATOM 796 CB ASN A 62 -5.611 -12.999 -6.289 1.00 0.27 C ATOM 797 CG ASN A 62 -4.679 -12.645 -7.415 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.876 -13.061 -8.555 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.692 -11.828 -7.115 1.00 1.12 N ATOM 0 H ASN A 62 -5.280 -11.306 -4.513 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.748 -11.318 -6.959 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.037 -13.201 -5.385 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.153 -13.912 -6.533 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -3.051 -11.514 -7.843 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.568 -11.509 -6.154 1.00 1.12 H new ATOM 806 N LYS A 63 -8.203 -12.434 -4.321 1.00 0.18 N ATOM 807 CA LYS A 63 -9.460 -12.971 -3.866 1.00 0.20 C ATOM 808 C LYS A 63 -10.513 -11.892 -3.951 1.00 0.18 C ATOM 809 O LYS A 63 -11.707 -12.177 -4.063 1.00 0.22 O ATOM 810 CB LYS A 63 -9.353 -13.521 -2.439 1.00 0.26 C ATOM 811 CG LYS A 63 -10.671 -14.055 -1.891 1.00 0.29 C ATOM 812 CD LYS A 63 -10.463 -14.983 -0.709 1.00 0.64 C ATOM 813 CE LYS A 63 -9.797 -14.274 0.453 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.761 -15.125 1.670 1.00 1.54 N ATOM 0 H LYS A 63 -7.580 -12.094 -3.588 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.741 -13.807 -4.507 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.611 -14.320 -2.421 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.988 -12.732 -1.781 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.303 -13.220 -1.589 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.202 -14.587 -2.680 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.425 -15.383 -0.388 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.851 -15.831 -1.016 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.781 -13.995 0.174 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.333 -13.350 0.671 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -9.555 -14.534 2.501 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.683 -15.590 1.796 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -9.020 -15.847 1.567 1.00 1.54 H new ATOM 828 N TYR A 64 -10.077 -10.641 -3.932 1.00 0.16 N ATOM 829 CA TYR A 64 -11.029 -9.563 -3.837 1.00 0.16 C ATOM 830 C TYR A 64 -10.969 -8.550 -4.974 1.00 0.17 C ATOM 831 O TYR A 64 -11.822 -7.662 -5.050 1.00 0.17 O ATOM 832 CB TYR A 64 -10.909 -8.918 -2.474 1.00 0.15 C ATOM 833 CG TYR A 64 -11.409 -9.840 -1.393 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.687 -10.377 -1.417 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.581 -10.158 -0.329 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.121 -11.210 -0.404 1.00 0.23 C ATOM 837 CE2 TYR A 64 -11.000 -10.986 0.680 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.385 -11.561 0.549 1.00 0.24 C ATOM 839 OH TYR A 64 -12.698 -12.336 1.657 1.00 0.31 O ATOM 0 H TYR A 64 -9.098 -10.360 -3.980 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.021 -10.000 -3.950 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.868 -8.658 -2.282 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.479 -7.989 -2.456 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.350 -10.142 -2.236 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.584 -9.745 -0.294 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.137 -11.574 -0.434 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.369 -11.214 1.526 1.00 0.23 H new ATOM 0 HH TYR A 64 -11.904 -12.434 2.223 1.00 0.31 H new ATOM 849 N LYS A 65 -10.014 -8.692 -5.882 1.00 0.20 N ATOM 850 CA LYS A 65 -10.014 -7.876 -7.088 1.00 0.23 C ATOM 851 C LYS A 65 -11.225 -8.232 -7.895 1.00 0.20 C ATOM 852 O LYS A 65 -11.745 -7.418 -8.655 1.00 0.22 O ATOM 853 CB LYS A 65 -8.740 -8.028 -7.939 1.00 0.34 C ATOM 854 CG LYS A 65 -8.223 -9.449 -8.117 1.00 0.29 C ATOM 855 CD LYS A 65 -6.976 -9.461 -8.981 1.00 0.38 C ATOM 856 CE LYS A 65 -7.326 -9.478 -10.459 1.00 0.80 C ATOM 857 NZ LYS A 65 -6.116 -9.503 -11.320 1.00 1.35 N ATOM 0 H LYS A 65 -9.241 -9.353 -5.810 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.036 -6.830 -6.781 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.933 -7.606 -8.925 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -7.950 -7.429 -7.486 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.001 -9.885 -7.143 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -8.995 -10.068 -8.575 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.369 -8.583 -8.759 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.372 -10.335 -8.739 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -7.942 -10.351 -10.675 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -7.923 -8.599 -10.700 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -6.402 -9.514 -12.320 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.540 -8.657 -11.134 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.558 -10.355 -11.110 1.00 1.35 H new ATOM 871 N SER A 66 -11.682 -9.455 -7.674 1.00 0.23 N ATOM 872 CA SER A 66 -12.937 -9.922 -8.247 1.00 0.26 C ATOM 873 C SER A 66 -14.052 -8.889 -8.029 1.00 0.25 C ATOM 874 O SER A 66 -14.843 -8.619 -8.934 1.00 0.31 O ATOM 875 CB SER A 66 -13.323 -11.258 -7.615 1.00 0.32 C ATOM 876 OG SER A 66 -12.226 -12.156 -7.627 1.00 1.28 O ATOM 0 H SER A 66 -11.200 -10.146 -7.099 1.00 0.23 H new ATOM 0 HA SER A 66 -12.804 -10.056 -9.321 1.00 0.26 H new ATOM 0 HB2 SER A 66 -13.656 -11.098 -6.590 1.00 0.32 H new ATOM 0 HB3 SER A 66 -14.161 -11.694 -8.158 1.00 0.32 H new ATOM 0 HG SER A 66 -12.493 -13.005 -7.216 1.00 1.28 H new ATOM 882 N GLN A 67 -14.103 -8.300 -6.830 1.00 0.21 N ATOM 883 CA GLN A 67 -15.067 -7.235 -6.544 1.00 0.20 C ATOM 884 C GLN A 67 -14.546 -5.853 -6.975 1.00 0.20 C ATOM 885 O GLN A 67 -15.324 -4.997 -7.391 1.00 0.27 O ATOM 886 CB GLN A 67 -15.422 -7.227 -5.057 1.00 0.21 C ATOM 887 CG GLN A 67 -16.289 -8.405 -4.640 1.00 0.38 C ATOM 888 CD GLN A 67 -16.470 -8.499 -3.139 1.00 0.52 C ATOM 889 OE1 GLN A 67 -17.392 -7.917 -2.572 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.595 -9.244 -2.489 1.00 0.46 N ATOM 0 H GLN A 67 -13.493 -8.541 -6.048 1.00 0.21 H new ATOM 0 HA GLN A 67 -15.964 -7.442 -7.127 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.503 -7.236 -4.471 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -15.943 -6.299 -4.820 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.266 -8.317 -5.114 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.840 -9.328 -5.006 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -14.844 -9.710 -2.998 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -15.670 -9.353 -1.478 1.00 0.46 H new ATOM 899 N GLY A 68 -13.238 -5.645 -6.882 1.00 0.17 N ATOM 900 CA GLY A 68 -12.647 -4.362 -7.209 1.00 0.18 C ATOM 901 C GLY A 68 -11.453 -4.059 -6.323 1.00 0.15 C ATOM 902 O GLY A 68 -10.728 -3.084 -6.546 1.00 0.17 O ATOM 0 H GLY A 68 -12.568 -6.353 -6.582 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.336 -4.359 -8.254 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.394 -3.576 -7.096 1.00 0.18 H new ATOM 906 N PHE A 69 -11.248 -4.915 -5.321 1.00 0.14 N ATOM 907 CA PHE A 69 -10.168 -4.752 -4.353 1.00 0.13 C ATOM 908 C PHE A 69 -8.816 -4.869 -5.023 1.00 0.14 C ATOM 909 O PHE A 69 -8.634 -5.681 -5.918 1.00 0.18 O ATOM 910 CB PHE A 69 -10.273 -5.814 -3.251 1.00 0.14 C ATOM 911 CG PHE A 69 -9.216 -5.679 -2.208 1.00 0.12 C ATOM 912 CD1 PHE A 69 -8.957 -4.442 -1.696 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.473 -6.764 -1.754 1.00 0.14 C ATOM 914 CE1 PHE A 69 -7.993 -4.255 -0.763 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.484 -6.586 -0.799 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.243 -5.322 -0.309 1.00 0.14 C ATOM 0 H PHE A 69 -11.827 -5.739 -5.160 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.264 -3.758 -3.916 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.253 -5.744 -2.779 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.207 -6.804 -3.701 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.532 -3.595 -2.041 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.668 -7.751 -2.148 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.810 -3.265 -0.372 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -6.909 -7.429 -0.444 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.470 -5.165 0.428 1.00 0.14 H new ATOM 926 N THR A 70 -7.868 -4.052 -4.615 1.00 0.13 N ATOM 927 CA THR A 70 -6.545 -4.200 -5.089 1.00 0.12 C ATOM 928 C THR A 70 -5.613 -4.101 -3.926 1.00 0.12 C ATOM 929 O THR A 70 -5.933 -3.478 -2.931 1.00 0.19 O ATOM 930 CB THR A 70 -6.199 -3.120 -6.107 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.154 -3.558 -6.968 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.770 -1.845 -5.425 1.00 0.19 C ATOM 0 H THR A 70 -8.007 -3.285 -3.957 1.00 0.13 H new ATOM 0 HA THR A 70 -6.451 -5.169 -5.580 1.00 0.12 H new ATOM 0 HB THR A 70 -7.098 -2.926 -6.692 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.374 -4.444 -7.325 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.530 -1.093 -6.177 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.580 -1.480 -4.793 1.00 0.19 H new ATOM 0 HG23 THR A 70 -4.890 -2.039 -4.812 1.00 0.19 H new ATOM 940 N VAL A 71 -4.507 -4.742 -4.025 1.00 0.13 N ATOM 941 CA VAL A 71 -3.396 -4.391 -3.210 1.00 0.13 C ATOM 942 C VAL A 71 -2.371 -3.751 -4.097 1.00 0.13 C ATOM 943 O VAL A 71 -1.667 -4.440 -4.800 1.00 0.15 O ATOM 944 CB VAL A 71 -2.782 -5.621 -2.547 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.441 -5.280 -1.910 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.733 -6.192 -1.518 1.00 0.17 C ATOM 0 H VAL A 71 -4.343 -5.518 -4.666 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.725 -3.715 -2.421 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.608 -6.375 -3.314 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.022 -6.172 -1.444 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.756 -4.916 -2.676 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.583 -4.508 -1.154 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.282 -7.069 -1.053 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.937 -5.441 -0.755 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.666 -6.478 -2.004 1.00 0.17 H new ATOM 956 N LEU A 72 -2.290 -2.447 -4.104 1.00 0.17 N ATOM 957 CA LEU A 72 -1.259 -1.825 -4.922 1.00 0.22 C ATOM 958 C LEU A 72 -0.017 -1.676 -4.087 1.00 0.19 C ATOM 959 O LEU A 72 -0.032 -1.025 -3.049 1.00 0.28 O ATOM 960 CB LEU A 72 -1.630 -0.459 -5.517 1.00 0.43 C ATOM 961 CG LEU A 72 -3.098 -0.091 -5.593 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.661 0.230 -4.221 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.268 1.080 -6.522 1.00 1.00 C ATOM 0 H LEU A 72 -2.891 -1.810 -3.581 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.113 -2.484 -5.778 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.123 0.309 -4.932 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.221 -0.412 -6.526 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.653 -0.946 -5.979 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.716 0.490 -4.312 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.556 -0.640 -3.572 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -3.116 1.071 -3.792 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.323 1.348 -6.580 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.698 1.929 -6.145 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -2.907 0.812 -7.515 1.00 1.00 H new ATOM 975 N ALA A 73 1.052 -2.276 -4.541 1.00 0.22 N ATOM 976 CA ALA A 73 2.287 -2.240 -3.796 1.00 0.30 C ATOM 977 C ALA A 73 3.212 -1.160 -4.334 1.00 0.23 C ATOM 978 O ALA A 73 3.694 -1.244 -5.447 1.00 0.32 O ATOM 979 CB ALA A 73 2.966 -3.595 -3.836 1.00 0.51 C ATOM 0 H ALA A 73 1.095 -2.794 -5.419 1.00 0.22 H new ATOM 0 HA ALA A 73 2.055 -1.999 -2.759 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.896 -3.553 -3.270 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.308 -4.345 -3.397 1.00 0.51 H new ATOM 0 HB3 ALA A 73 3.183 -3.863 -4.870 1.00 0.51 H new ATOM 985 N PHE A 74 3.448 -0.137 -3.551 1.00 0.29 N ATOM 986 CA PHE A 74 4.378 0.908 -3.931 1.00 0.33 C ATOM 987 C PHE A 74 5.741 0.615 -3.290 1.00 0.35 C ATOM 988 O PHE A 74 5.934 0.851 -2.099 1.00 0.37 O ATOM 989 CB PHE A 74 3.834 2.276 -3.497 1.00 0.44 C ATOM 990 CG PHE A 74 2.688 2.815 -4.344 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.804 1.927 -4.939 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.483 4.180 -4.548 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.744 2.374 -5.721 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.423 4.629 -5.316 1.00 0.43 C ATOM 995 CZ PHE A 74 0.614 3.874 -5.891 1.00 0.35 C ATOM 0 H PHE A 74 3.008 -0.001 -2.641 1.00 0.29 H new ATOM 0 HA PHE A 74 4.499 0.931 -5.014 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.498 2.204 -2.463 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.651 2.997 -3.518 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.942 0.866 -4.792 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.159 4.894 -4.102 1.00 0.41 H new ATOM 0 HE1 PHE A 74 0.050 1.688 -6.183 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.289 5.695 -5.424 1.00 0.43 H new ATOM 0 HZ PHE A 74 -0.173 4.286 -6.505 1.00 0.35 H new ATOM 1005 N PRO A 75 6.701 0.084 -4.081 1.00 0.37 N ATOM 1006 CA PRO A 75 7.937 -0.509 -3.558 1.00 0.46 C ATOM 1007 C PRO A 75 9.008 0.502 -3.190 1.00 0.61 C ATOM 1008 O PRO A 75 10.041 0.572 -3.849 1.00 1.30 O ATOM 1009 CB PRO A 75 8.403 -1.395 -4.707 1.00 0.54 C ATOM 1010 CG PRO A 75 7.932 -0.698 -5.932 1.00 0.44 C ATOM 1011 CD PRO A 75 6.666 0.043 -5.554 1.00 0.38 C ATOM 0 HA PRO A 75 7.755 -1.036 -2.622 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.487 -1.507 -4.707 1.00 0.54 H new ATOM 0 HB3 PRO A 75 7.979 -2.396 -4.633 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.690 -0.006 -6.299 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.738 -1.412 -6.733 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.648 1.046 -5.981 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.778 -0.474 -5.918 1.00 0.38 H new ATOM 1019 N SER A 76 8.726 1.216 -2.102 1.00 0.41 N ATOM 1020 CA SER A 76 9.566 2.262 -1.489 1.00 0.37 C ATOM 1021 C SER A 76 10.852 2.602 -2.198 1.00 0.50 C ATOM 1022 O SER A 76 11.703 1.759 -2.486 1.00 0.74 O ATOM 1023 CB SER A 76 9.857 1.885 -0.034 1.00 0.53 C ATOM 1024 OG SER A 76 10.512 0.629 0.051 1.00 1.44 O ATOM 0 H SER A 76 7.855 1.077 -1.589 1.00 0.41 H new ATOM 0 HA SER A 76 8.974 3.174 -1.569 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.478 2.654 0.426 1.00 0.53 H new ATOM 0 HB3 SER A 76 8.924 1.850 0.529 1.00 0.53 H new ATOM 0 HG SER A 76 10.687 0.414 0.991 1.00 1.44 H new ATOM 1030 N ASN A 77 11.015 3.892 -2.383 1.00 0.52 N ATOM 1031 CA ASN A 77 12.171 4.411 -3.055 1.00 0.72 C ATOM 1032 C ASN A 77 13.304 4.448 -2.054 1.00 0.70 C ATOM 1033 O ASN A 77 13.645 5.506 -1.523 1.00 0.75 O ATOM 1034 CB ASN A 77 11.870 5.794 -3.639 1.00 0.93 C ATOM 1035 CG ASN A 77 13.024 6.369 -4.440 1.00 0.96 C ATOM 1036 OD1 ASN A 77 13.194 6.057 -5.617 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.798 7.245 -3.822 1.00 1.46 N ATOM 0 H ASN A 77 10.352 4.602 -2.072 1.00 0.52 H new ATOM 0 HA ASN A 77 12.455 3.777 -3.895 1.00 0.72 H new ATOM 0 HB2 ASN A 77 10.990 5.727 -4.279 1.00 0.93 H new ATOM 0 HB3 ASN A 77 11.623 6.478 -2.827 1.00 0.93 H new ATOM 0 HD21 ASN A 77 14.568 7.688 -4.323 1.00 1.46 H new ATOM 0 HD22 ASN A 77 13.625 7.478 -2.844 1.00 1.46 H new ATOM 1044 N GLN A 78 13.851 3.244 -1.800 1.00 0.85 N ATOM 1045 CA GLN A 78 14.913 2.977 -0.808 1.00 0.98 C ATOM 1046 C GLN A 78 16.058 3.966 -0.936 1.00 0.98 C ATOM 1047 O GLN A 78 16.937 4.054 -0.085 1.00 1.12 O ATOM 1048 CB GLN A 78 15.454 1.560 -1.012 1.00 1.35 C ATOM 1049 CG GLN A 78 14.389 0.526 -1.345 1.00 2.07 C ATOM 1050 CD GLN A 78 13.573 0.087 -0.147 1.00 2.74 C ATOM 1051 OE1 GLN A 78 13.363 0.837 0.798 1.00 3.34 O ATOM 1052 NE2 GLN A 78 13.096 -1.142 -0.184 1.00 3.30 N ATOM 0 H GLN A 78 13.557 2.402 -2.295 1.00 0.85 H new ATOM 0 HA GLN A 78 14.478 3.082 0.186 1.00 0.98 H new ATOM 0 HB2 GLN A 78 16.191 1.577 -1.815 1.00 1.35 H new ATOM 0 HB3 GLN A 78 15.976 1.249 -0.107 1.00 1.35 H new ATOM 0 HG2 GLN A 78 13.718 0.938 -2.099 1.00 2.07 H new ATOM 0 HG3 GLN A 78 14.868 -0.347 -1.787 1.00 2.07 H new ATOM 0 HE21 GLN A 78 13.290 -1.740 -0.987 1.00 3.30 H new ATOM 0 HE22 GLN A 78 12.533 -1.494 0.590 1.00 3.30 H new ATOM 1061 N PHE A 79 16.034 4.684 -2.026 1.00 0.98 N ATOM 1062 CA PHE A 79 17.092 5.611 -2.378 1.00 1.19 C ATOM 1063 C PHE A 79 16.817 7.002 -1.814 1.00 1.20 C ATOM 1064 O PHE A 79 17.227 8.009 -2.394 1.00 1.54 O ATOM 1065 CB PHE A 79 17.206 5.679 -3.892 1.00 1.32 C ATOM 1066 CG PHE A 79 17.726 4.408 -4.508 1.00 1.57 C ATOM 1067 CD1 PHE A 79 19.090 4.200 -4.652 1.00 1.82 C ATOM 1068 CD2 PHE A 79 16.852 3.420 -4.941 1.00 2.02 C ATOM 1069 CE1 PHE A 79 19.572 3.031 -5.212 1.00 2.25 C ATOM 1070 CE2 PHE A 79 17.330 2.252 -5.503 1.00 2.64 C ATOM 1071 CZ PHE A 79 18.691 2.057 -5.638 1.00 2.68 C ATOM 0 H PHE A 79 15.275 4.646 -2.706 1.00 0.98 H new ATOM 0 HA PHE A 79 18.028 5.256 -1.948 1.00 1.19 H new ATOM 0 HB2 PHE A 79 16.226 5.904 -4.313 1.00 1.32 H new ATOM 0 HB3 PHE A 79 17.867 6.503 -4.163 1.00 1.32 H new ATOM 0 HD1 PHE A 79 19.783 4.960 -4.323 1.00 1.82 H new ATOM 0 HD2 PHE A 79 15.787 3.566 -4.837 1.00 2.02 H new ATOM 0 HE1 PHE A 79 20.636 2.880 -5.316 1.00 2.25 H new ATOM 0 HE2 PHE A 79 16.640 1.491 -5.837 1.00 2.64 H new ATOM 0 HZ PHE A 79 19.065 1.144 -6.076 1.00 2.68 H new ATOM 1081 N GLY A 80 16.119 7.053 -0.692 1.00 1.10 N ATOM 1082 CA GLY A 80 15.763 8.325 -0.102 1.00 1.22 C ATOM 1083 C GLY A 80 16.514 8.608 1.180 1.00 1.24 C ATOM 1084 O GLY A 80 16.982 9.728 1.397 1.00 1.98 O ATOM 0 H GLY A 80 15.792 6.235 -0.178 1.00 1.10 H new ATOM 0 HA2 GLY A 80 15.964 9.121 -0.819 1.00 1.22 H new ATOM 0 HA3 GLY A 80 14.692 8.340 0.099 1.00 1.22 H new ATOM 1088 N GLY A 81 16.649 7.595 2.024 1.00 1.18 N ATOM 1089 CA GLY A 81 17.280 7.785 3.312 1.00 1.21 C ATOM 1090 C GLY A 81 16.327 7.552 4.468 1.00 1.14 C ATOM 1091 O GLY A 81 16.594 7.994 5.587 1.00 1.49 O ATOM 0 H GLY A 81 16.332 6.644 1.838 1.00 1.18 H new ATOM 0 HA2 GLY A 81 18.127 7.105 3.401 1.00 1.21 H new ATOM 0 HA3 GLY A 81 17.677 8.798 3.372 1.00 1.21 H new ATOM 1095 N GLN A 82 15.219 6.851 4.218 1.00 0.86 N ATOM 1096 CA GLN A 82 14.217 6.637 5.262 1.00 0.82 C ATOM 1097 C GLN A 82 13.150 5.622 4.868 1.00 0.77 C ATOM 1098 O GLN A 82 12.063 5.644 5.418 1.00 0.91 O ATOM 1099 CB GLN A 82 13.513 7.959 5.633 1.00 0.80 C ATOM 1100 CG GLN A 82 12.636 8.574 4.531 1.00 0.75 C ATOM 1101 CD GLN A 82 13.367 8.829 3.223 1.00 1.09 C ATOM 1102 OE1 GLN A 82 14.025 9.849 3.056 1.00 1.74 O ATOM 1103 NE2 GLN A 82 13.204 7.932 2.265 1.00 1.14 N ATOM 0 H GLN A 82 14.996 6.428 3.317 1.00 0.86 H new ATOM 0 HA GLN A 82 14.767 6.243 6.117 1.00 0.82 H new ATOM 0 HB2 GLN A 82 12.893 7.786 6.512 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.272 8.687 5.917 1.00 0.80 H new ATOM 0 HG2 GLN A 82 11.793 7.910 4.340 1.00 0.75 H new ATOM 0 HG3 GLN A 82 12.224 9.516 4.893 1.00 0.75 H new ATOM 0 HE21 GLN A 82 12.649 7.094 2.440 1.00 1.14 H new ATOM 0 HE22 GLN A 82 13.633 8.078 1.351 1.00 1.14 H new ATOM 1112 N GLU A 83 13.458 4.722 3.961 1.00 0.75 N ATOM 1113 CA GLU A 83 12.449 3.816 3.429 1.00 0.74 C ATOM 1114 C GLU A 83 12.321 2.534 4.249 1.00 0.72 C ATOM 1115 O GLU A 83 13.257 2.113 4.932 1.00 0.88 O ATOM 1116 CB GLU A 83 12.777 3.473 1.983 1.00 0.87 C ATOM 1117 CG GLU A 83 12.629 4.643 1.036 1.00 1.16 C ATOM 1118 CD GLU A 83 11.304 5.353 1.195 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.185 6.192 2.110 1.00 2.83 O ATOM 1120 OE2 GLU A 83 10.380 5.075 0.405 1.00 3.07 O ATOM 0 H GLU A 83 14.393 4.593 3.574 1.00 0.75 H new ATOM 0 HA GLU A 83 11.490 4.331 3.485 1.00 0.74 H new ATOM 0 HB2 GLU A 83 13.800 3.100 1.930 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.125 2.664 1.653 1.00 0.87 H new ATOM 0 HG2 GLU A 83 13.440 5.351 1.209 1.00 1.16 H new ATOM 0 HG3 GLU A 83 12.727 4.290 0.009 1.00 1.16 H new ATOM 1127 N PRO A 84 11.123 1.916 4.198 1.00 0.63 N ATOM 1128 CA PRO A 84 10.816 0.627 4.848 1.00 0.75 C ATOM 1129 C PRO A 84 11.758 -0.527 4.469 1.00 1.00 C ATOM 1130 O PRO A 84 11.593 -1.648 4.959 1.00 1.75 O ATOM 1131 CB PRO A 84 9.399 0.326 4.350 1.00 1.02 C ATOM 1132 CG PRO A 84 8.808 1.659 4.108 1.00 0.72 C ATOM 1133 CD PRO A 84 9.922 2.477 3.542 1.00 0.61 C ATOM 0 HA PRO A 84 10.927 0.706 5.929 1.00 0.75 H new ATOM 0 HB2 PRO A 84 9.416 -0.273 3.440 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.828 -0.234 5.090 1.00 1.02 H new ATOM 0 HG2 PRO A 84 7.970 1.599 3.414 1.00 0.72 H new ATOM 0 HG3 PRO A 84 8.427 2.096 5.031 1.00 0.72 H new ATOM 0 HD2 PRO A 84 9.977 2.386 2.457 1.00 0.61 H new ATOM 0 HD3 PRO A 84 9.798 3.536 3.767 1.00 0.61 H new ATOM 1141 N GLY A 85 12.730 -0.266 3.601 1.00 1.45 N ATOM 1142 CA GLY A 85 13.714 -1.276 3.249 1.00 1.82 C ATOM 1143 C GLY A 85 15.001 -1.119 4.039 1.00 1.61 C ATOM 1144 O GLY A 85 16.020 -1.723 3.702 1.00 2.20 O ATOM 0 H GLY A 85 12.855 0.631 3.132 1.00 1.45 H new ATOM 0 HA2 GLY A 85 13.297 -2.267 3.430 1.00 1.82 H new ATOM 0 HA3 GLY A 85 13.933 -1.212 2.183 1.00 1.82 H new ATOM 1148 N ASN A 86 14.933 -0.293 5.087 1.00 1.49 N ATOM 1149 CA ASN A 86 16.058 -0.010 5.997 1.00 2.04 C ATOM 1150 C ASN A 86 17.340 0.369 5.246 1.00 1.94 C ATOM 1151 O ASN A 86 18.449 0.015 5.652 1.00 2.70 O ATOM 1152 CB ASN A 86 16.298 -1.145 7.023 1.00 2.78 C ATOM 1153 CG ASN A 86 16.686 -2.491 6.429 1.00 3.58 C ATOM 1154 OD1 ASN A 86 15.823 -3.304 6.087 1.00 4.07 O ATOM 1155 ND2 ASN A 86 17.981 -2.754 6.338 1.00 4.20 N ATOM 0 H ASN A 86 14.081 0.209 5.335 1.00 1.49 H new ATOM 0 HA ASN A 86 15.763 0.867 6.572 1.00 2.04 H new ATOM 0 HB2 ASN A 86 17.083 -0.830 7.710 1.00 2.78 H new ATOM 0 HB3 ASN A 86 15.391 -1.275 7.614 1.00 2.78 H new ATOM 0 HD21 ASN A 86 18.294 -3.654 5.975 1.00 4.20 H new ATOM 0 HD22 ASN A 86 18.665 -2.056 6.631 1.00 4.20 H new ATOM 1162 N GLU A 87 17.148 1.110 4.155 1.00 1.52 N ATOM 1163 CA GLU A 87 18.223 1.765 3.404 1.00 1.46 C ATOM 1164 C GLU A 87 19.290 0.810 2.862 1.00 1.60 C ATOM 1165 O GLU A 87 19.212 0.346 1.721 1.00 2.15 O ATOM 1166 CB GLU A 87 18.896 2.846 4.256 1.00 1.61 C ATOM 1167 CG GLU A 87 17.951 3.950 4.667 1.00 2.19 C ATOM 1168 CD GLU A 87 16.959 4.268 3.579 1.00 2.58 C ATOM 1169 OE1 GLU A 87 17.329 4.993 2.643 1.00 3.02 O ATOM 1170 OE2 GLU A 87 15.815 3.799 3.661 1.00 2.84 O ATOM 0 H GLU A 87 16.223 1.276 3.759 1.00 1.52 H new ATOM 0 HA GLU A 87 17.734 2.208 2.537 1.00 1.46 H new ATOM 0 HB2 GLU A 87 19.318 2.386 5.149 1.00 1.61 H new ATOM 0 HB3 GLU A 87 19.727 3.276 3.697 1.00 1.61 H new ATOM 0 HG2 GLU A 87 17.418 3.655 5.571 1.00 2.19 H new ATOM 0 HG3 GLU A 87 18.522 4.846 4.912 1.00 2.19 H new ATOM 1177 N GLU A 88 20.279 0.522 3.701 1.00 1.57 N ATOM 1178 CA GLU A 88 21.516 -0.127 3.281 1.00 1.77 C ATOM 1179 C GLU A 88 21.267 -1.489 2.642 1.00 1.62 C ATOM 1180 O GLU A 88 21.897 -1.830 1.643 1.00 1.62 O ATOM 1181 CB GLU A 88 22.450 -0.280 4.483 1.00 2.18 C ATOM 1182 CG GLU A 88 22.697 1.020 5.237 1.00 2.68 C ATOM 1183 CD GLU A 88 23.237 2.121 4.350 1.00 3.33 C ATOM 1184 OE1 GLU A 88 24.384 1.997 3.870 1.00 3.92 O ATOM 1185 OE2 GLU A 88 22.513 3.107 4.114 1.00 3.66 O ATOM 0 H GLU A 88 20.245 0.734 4.698 1.00 1.57 H new ATOM 0 HA GLU A 88 21.979 0.507 2.525 1.00 1.77 H new ATOM 0 HB2 GLU A 88 22.027 -1.013 5.170 1.00 2.18 H new ATOM 0 HB3 GLU A 88 23.405 -0.678 4.141 1.00 2.18 H new ATOM 0 HG2 GLU A 88 21.765 1.352 5.693 1.00 2.68 H new ATOM 0 HG3 GLU A 88 23.401 0.836 6.048 1.00 2.68 H new ATOM 1192 N GLU A 89 20.319 -2.234 3.193 1.00 1.62 N ATOM 1193 CA GLU A 89 20.072 -3.617 2.782 1.00 1.59 C ATOM 1194 C GLU A 89 19.559 -3.703 1.341 1.00 1.49 C ATOM 1195 O GLU A 89 19.527 -4.773 0.745 1.00 1.59 O ATOM 1196 CB GLU A 89 19.075 -4.251 3.744 1.00 1.70 C ATOM 1197 CG GLU A 89 19.023 -5.765 3.681 1.00 1.75 C ATOM 1198 CD GLU A 89 18.220 -6.339 4.824 1.00 2.11 C ATOM 1199 OE1 GLU A 89 18.374 -5.854 5.960 1.00 2.45 O ATOM 1200 OE2 GLU A 89 17.407 -7.255 4.592 1.00 2.65 O ATOM 0 H GLU A 89 19.700 -1.903 3.934 1.00 1.62 H new ATOM 0 HA GLU A 89 21.016 -4.161 2.815 1.00 1.59 H new ATOM 0 HB2 GLU A 89 19.327 -3.950 4.761 1.00 1.70 H new ATOM 0 HB3 GLU A 89 18.082 -3.856 3.532 1.00 1.70 H new ATOM 0 HG2 GLU A 89 18.583 -6.076 2.734 1.00 1.75 H new ATOM 0 HG3 GLU A 89 20.036 -6.166 3.709 1.00 1.75 H new ATOM 1207 N ILE A 90 19.145 -2.578 0.796 1.00 1.43 N ATOM 1208 CA ILE A 90 18.674 -2.519 -0.582 1.00 1.39 C ATOM 1209 C ILE A 90 19.799 -2.051 -1.497 1.00 1.49 C ATOM 1210 O ILE A 90 19.862 -2.409 -2.667 1.00 1.57 O ATOM 1211 CB ILE A 90 17.515 -1.528 -0.700 1.00 1.45 C ATOM 1212 CG1 ILE A 90 16.557 -1.709 0.477 1.00 1.74 C ATOM 1213 CG2 ILE A 90 16.793 -1.707 -2.027 1.00 1.76 C ATOM 1214 CD1 ILE A 90 15.866 -3.054 0.506 1.00 2.15 C ATOM 0 H ILE A 90 19.123 -1.684 1.286 1.00 1.43 H new ATOM 0 HA ILE A 90 18.343 -3.516 -0.874 1.00 1.39 H new ATOM 0 HB ILE A 90 17.910 -0.512 -0.671 1.00 1.45 H new ATOM 0 HG12 ILE A 90 17.111 -1.576 1.407 1.00 1.74 H new ATOM 0 HG13 ILE A 90 15.801 -0.924 0.441 1.00 1.74 H new ATOM 0 HG21 ILE A 90 15.972 -0.994 -2.093 1.00 1.76 H new ATOM 0 HG22 ILE A 90 17.490 -1.535 -2.847 1.00 1.76 H new ATOM 0 HG23 ILE A 90 16.399 -2.721 -2.093 1.00 1.76 H new ATOM 0 HD11 ILE A 90 15.204 -3.104 1.370 1.00 2.15 H new ATOM 0 HD12 ILE A 90 15.283 -3.183 -0.406 1.00 2.15 H new ATOM 0 HD13 ILE A 90 16.613 -3.845 0.575 1.00 2.15 H new ATOM 1226 N LYS A 91 20.693 -1.248 -0.940 1.00 1.71 N ATOM 1227 CA LYS A 91 21.754 -0.625 -1.719 1.00 1.89 C ATOM 1228 C LYS A 91 22.960 -1.547 -1.851 1.00 1.98 C ATOM 1229 O LYS A 91 23.554 -1.652 -2.924 1.00 2.17 O ATOM 1230 CB LYS A 91 22.171 0.706 -1.085 1.00 2.00 C ATOM 1231 CG LYS A 91 21.090 1.776 -1.139 1.00 2.10 C ATOM 1232 CD LYS A 91 21.557 3.074 -0.498 1.00 2.33 C ATOM 1233 CE LYS A 91 21.758 2.918 1.000 1.00 2.39 C ATOM 1234 NZ LYS A 91 22.382 4.122 1.610 1.00 2.79 N ATOM 0 H LYS A 91 20.705 -1.011 0.052 1.00 1.71 H new ATOM 0 HA LYS A 91 21.365 -0.435 -2.719 1.00 1.89 H new ATOM 0 HB2 LYS A 91 22.446 0.532 -0.045 1.00 2.00 H new ATOM 0 HB3 LYS A 91 23.062 1.076 -1.592 1.00 2.00 H new ATOM 0 HG2 LYS A 91 20.811 1.961 -2.176 1.00 2.10 H new ATOM 0 HG3 LYS A 91 20.196 1.418 -0.628 1.00 2.10 H new ATOM 0 HD2 LYS A 91 22.492 3.393 -0.960 1.00 2.33 H new ATOM 0 HD3 LYS A 91 20.824 3.858 -0.688 1.00 2.33 H new ATOM 0 HE2 LYS A 91 20.796 2.728 1.476 1.00 2.39 H new ATOM 0 HE3 LYS A 91 22.386 2.048 1.192 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 22.469 3.985 2.637 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 23.326 4.270 1.199 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 21.788 4.954 1.421 1.00 2.79 H new ATOM 1248 N GLU A 92 23.316 -2.217 -0.761 1.00 2.07 N ATOM 1249 CA GLU A 92 24.468 -3.112 -0.758 1.00 2.27 C ATOM 1250 C GLU A 92 24.082 -4.486 -1.278 1.00 2.10 C ATOM 1251 O GLU A 92 24.945 -5.290 -1.638 1.00 2.26 O ATOM 1252 CB GLU A 92 25.047 -3.250 0.651 1.00 2.54 C ATOM 1253 CG GLU A 92 24.118 -3.959 1.625 1.00 2.47 C ATOM 1254 CD GLU A 92 24.783 -4.256 2.949 1.00 2.96 C ATOM 1255 OE1 GLU A 92 24.812 -3.359 3.820 1.00 3.20 O ATOM 1256 OE2 GLU A 92 25.269 -5.388 3.133 1.00 3.29 O ATOM 0 H GLU A 92 22.825 -2.158 0.131 1.00 2.07 H new ATOM 0 HA GLU A 92 25.224 -2.679 -1.413 1.00 2.27 H new ATOM 0 HB2 GLU A 92 25.988 -3.797 0.596 1.00 2.54 H new ATOM 0 HB3 GLU A 92 25.277 -2.258 1.039 1.00 2.54 H new ATOM 0 HG2 GLU A 92 23.236 -3.341 1.796 1.00 2.47 H new ATOM 0 HG3 GLU A 92 23.772 -4.891 1.179 1.00 2.47 H new ATOM 1263 N PHE A 93 22.788 -4.751 -1.310 1.00 1.86 N ATOM 1264 CA PHE A 93 22.294 -6.049 -1.717 1.00 1.75 C ATOM 1265 C PHE A 93 21.531 -5.920 -3.020 1.00 1.59 C ATOM 1266 O PHE A 93 21.093 -4.828 -3.378 1.00 1.69 O ATOM 1267 CB PHE A 93 21.392 -6.611 -0.623 1.00 1.73 C ATOM 1268 CG PHE A 93 21.138 -8.083 -0.744 1.00 2.09 C ATOM 1269 CD1 PHE A 93 22.179 -8.992 -0.683 1.00 2.34 C ATOM 1270 CD2 PHE A 93 19.849 -8.551 -0.929 1.00 2.65 C ATOM 1271 CE1 PHE A 93 21.938 -10.348 -0.803 1.00 2.87 C ATOM 1272 CE2 PHE A 93 19.601 -9.905 -1.051 1.00 3.40 C ATOM 1273 CZ PHE A 93 20.684 -10.815 -0.948 1.00 3.42 C ATOM 0 H PHE A 93 22.061 -4.081 -1.058 1.00 1.86 H new ATOM 0 HA PHE A 93 23.131 -6.730 -1.871 1.00 1.75 H new ATOM 0 HB2 PHE A 93 21.845 -6.409 0.348 1.00 1.73 H new ATOM 0 HB3 PHE A 93 20.438 -6.084 -0.646 1.00 1.73 H new ATOM 0 HD1 PHE A 93 23.190 -8.639 -0.540 1.00 2.34 H new ATOM 0 HD2 PHE A 93 19.028 -7.851 -0.979 1.00 2.65 H new ATOM 0 HE1 PHE A 93 22.766 -11.041 -0.780 1.00 2.87 H new ATOM 0 HE2 PHE A 93 18.597 -10.265 -1.222 1.00 3.40 H new ATOM 0 HZ PHE A 93 20.503 -11.879 -0.986 1.00 3.42 H new ATOM 1283 N VAL A 94 21.393 -7.023 -3.739 1.00 1.62 N ATOM 1284 CA VAL A 94 20.657 -7.017 -4.991 1.00 1.68 C ATOM 1285 C VAL A 94 19.180 -6.725 -4.737 1.00 1.54 C ATOM 1286 O VAL A 94 18.464 -7.519 -4.127 1.00 1.74 O ATOM 1287 CB VAL A 94 20.829 -8.349 -5.763 1.00 2.11 C ATOM 1288 CG1 VAL A 94 20.441 -9.545 -4.906 1.00 2.63 C ATOM 1289 CG2 VAL A 94 20.030 -8.328 -7.058 1.00 2.56 C ATOM 0 H VAL A 94 21.780 -7.930 -3.477 1.00 1.62 H new ATOM 0 HA VAL A 94 21.069 -6.224 -5.616 1.00 1.68 H new ATOM 0 HB VAL A 94 21.885 -8.453 -6.013 1.00 2.11 H new ATOM 0 HG11 VAL A 94 20.574 -10.462 -5.480 1.00 2.63 H new ATOM 0 HG12 VAL A 94 21.073 -9.577 -4.019 1.00 2.63 H new ATOM 0 HG13 VAL A 94 19.397 -9.454 -4.605 1.00 2.63 H new ATOM 0 HG21 VAL A 94 20.165 -9.273 -7.584 1.00 2.56 H new ATOM 0 HG22 VAL A 94 18.973 -8.187 -6.831 1.00 2.56 H new ATOM 0 HG23 VAL A 94 20.379 -7.509 -7.687 1.00 2.56 H new ATOM 1299 N CYS A 95 18.735 -5.565 -5.183 1.00 1.47 N ATOM 1300 CA CYS A 95 17.359 -5.162 -4.982 1.00 1.46 C ATOM 1301 C CYS A 95 16.507 -5.480 -6.182 1.00 1.37 C ATOM 1302 O CYS A 95 16.798 -5.072 -7.307 1.00 1.52 O ATOM 1303 CB CYS A 95 17.260 -3.671 -4.681 1.00 1.77 C ATOM 1304 SG CYS A 95 18.660 -2.703 -5.287 1.00 2.83 S ATOM 0 H CYS A 95 19.307 -4.887 -5.686 1.00 1.47 H new ATOM 0 HA CYS A 95 16.989 -5.728 -4.127 1.00 1.46 H new ATOM 0 HB2 CYS A 95 16.344 -3.282 -5.124 1.00 1.77 H new ATOM 0 HB3 CYS A 95 17.176 -3.533 -3.603 1.00 1.77 H new ATOM 0 HG CYS A 95 19.500 -2.501 -4.316 1.00 2.83 H new ATOM 1310 N THR A 96 15.464 -6.231 -5.933 1.00 1.52 N ATOM 1311 CA THR A 96 14.406 -6.388 -6.886 1.00 1.59 C ATOM 1312 C THR A 96 13.365 -5.315 -6.617 1.00 1.08 C ATOM 1313 O THR A 96 13.206 -4.873 -5.477 1.00 1.31 O ATOM 1314 CB THR A 96 13.767 -7.783 -6.772 1.00 2.27 C ATOM 1315 OG1 THR A 96 13.525 -8.097 -5.396 1.00 2.76 O ATOM 1316 CG2 THR A 96 14.662 -8.847 -7.392 1.00 2.98 C ATOM 0 H THR A 96 15.329 -6.748 -5.064 1.00 1.52 H new ATOM 0 HA THR A 96 14.805 -6.288 -7.895 1.00 1.59 H new ATOM 0 HB THR A 96 12.822 -7.770 -7.315 1.00 2.27 H new ATOM 0 HG1 THR A 96 13.117 -8.985 -5.330 1.00 2.76 H new ATOM 0 HG21 THR A 96 14.186 -9.823 -7.297 1.00 2.98 H new ATOM 0 HG22 THR A 96 14.819 -8.621 -8.447 1.00 2.98 H new ATOM 0 HG23 THR A 96 15.622 -8.860 -6.877 1.00 2.98 H new ATOM 1324 N LYS A 97 12.676 -4.879 -7.656 1.00 1.14 N ATOM 1325 CA LYS A 97 11.597 -3.904 -7.512 1.00 1.11 C ATOM 1326 C LYS A 97 10.364 -4.556 -6.884 1.00 1.04 C ATOM 1327 O LYS A 97 9.233 -4.299 -7.297 1.00 1.76 O ATOM 1328 CB LYS A 97 11.258 -3.306 -8.880 1.00 1.47 C ATOM 1329 CG LYS A 97 11.134 -4.352 -9.975 1.00 1.47 C ATOM 1330 CD LYS A 97 10.965 -3.730 -11.352 1.00 1.89 C ATOM 1331 CE LYS A 97 9.573 -3.152 -11.546 1.00 2.34 C ATOM 1332 NZ LYS A 97 9.388 -2.616 -12.918 1.00 2.72 N ATOM 0 H LYS A 97 12.842 -5.183 -8.615 1.00 1.14 H new ATOM 0 HA LYS A 97 11.926 -3.103 -6.850 1.00 1.11 H new ATOM 0 HB2 LYS A 97 10.321 -2.754 -8.806 1.00 1.47 H new ATOM 0 HB3 LYS A 97 12.030 -2.588 -9.157 1.00 1.47 H new ATOM 0 HG2 LYS A 97 12.021 -4.985 -9.971 1.00 1.47 H new ATOM 0 HG3 LYS A 97 10.281 -4.997 -9.763 1.00 1.47 H new ATOM 0 HD2 LYS A 97 11.707 -2.943 -11.488 1.00 1.89 H new ATOM 0 HD3 LYS A 97 11.155 -4.483 -12.116 1.00 1.89 H new ATOM 0 HE2 LYS A 97 8.828 -3.924 -11.353 1.00 2.34 H new ATOM 0 HE3 LYS A 97 9.404 -2.358 -10.819 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 8.374 -2.482 -13.104 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 9.879 -1.703 -13.003 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 9.781 -3.287 -13.609 1.00 2.72 H new ATOM 1346 N PHE A 98 10.616 -5.392 -5.871 1.00 0.89 N ATOM 1347 CA PHE A 98 9.589 -6.179 -5.202 1.00 0.92 C ATOM 1348 C PHE A 98 8.923 -7.150 -6.184 1.00 1.11 C ATOM 1349 O PHE A 98 9.349 -8.299 -6.309 1.00 2.12 O ATOM 1350 CB PHE A 98 8.562 -5.257 -4.526 1.00 1.15 C ATOM 1351 CG PHE A 98 7.358 -5.969 -3.984 1.00 0.75 C ATOM 1352 CD1 PHE A 98 7.455 -6.804 -2.883 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.125 -5.808 -4.593 1.00 0.96 C ATOM 1354 CE1 PHE A 98 6.338 -7.459 -2.404 1.00 0.94 C ATOM 1355 CE2 PHE A 98 5.015 -6.460 -4.114 1.00 0.87 C ATOM 1356 CZ PHE A 98 5.122 -7.278 -3.026 1.00 0.45 C ATOM 0 H PHE A 98 11.552 -5.539 -5.492 1.00 0.89 H new ATOM 0 HA PHE A 98 10.059 -6.778 -4.422 1.00 0.92 H new ATOM 0 HB2 PHE A 98 9.051 -4.723 -3.712 1.00 1.15 H new ATOM 0 HB3 PHE A 98 8.233 -4.508 -5.247 1.00 1.15 H new ATOM 0 HD1 PHE A 98 8.409 -6.943 -2.397 1.00 1.02 H new ATOM 0 HD2 PHE A 98 6.035 -5.163 -5.454 1.00 0.96 H new ATOM 0 HE1 PHE A 98 6.417 -8.110 -1.546 1.00 0.94 H new ATOM 0 HE2 PHE A 98 4.059 -6.326 -4.597 1.00 0.87 H new ATOM 0 HZ PHE A 98 4.247 -7.787 -2.650 1.00 0.45 H new ATOM 1366 N LYS A 99 7.907 -6.660 -6.889 1.00 0.80 N ATOM 1367 CA LYS A 99 7.151 -7.425 -7.880 1.00 0.78 C ATOM 1368 C LYS A 99 6.304 -8.500 -7.234 1.00 0.79 C ATOM 1369 O LYS A 99 6.696 -9.118 -6.245 1.00 1.43 O ATOM 1370 CB LYS A 99 8.053 -8.049 -8.950 1.00 1.02 C ATOM 1371 CG LYS A 99 8.965 -7.060 -9.650 1.00 1.34 C ATOM 1372 CD LYS A 99 9.699 -7.704 -10.818 1.00 1.63 C ATOM 1373 CE LYS A 99 10.379 -9.008 -10.422 1.00 2.05 C ATOM 1374 NZ LYS A 99 11.326 -8.831 -9.291 1.00 2.69 N ATOM 0 H LYS A 99 7.578 -5.700 -6.786 1.00 0.80 H new ATOM 0 HA LYS A 99 6.492 -6.708 -8.370 1.00 0.78 H new ATOM 0 HB2 LYS A 99 8.664 -8.824 -8.487 1.00 1.02 H new ATOM 0 HB3 LYS A 99 7.427 -8.539 -9.696 1.00 1.02 H new ATOM 0 HG2 LYS A 99 8.378 -6.215 -10.010 1.00 1.34 H new ATOM 0 HG3 LYS A 99 9.689 -6.665 -8.938 1.00 1.34 H new ATOM 0 HD2 LYS A 99 8.994 -7.895 -11.627 1.00 1.63 H new ATOM 0 HD3 LYS A 99 10.445 -7.009 -11.203 1.00 1.63 H new ATOM 0 HE2 LYS A 99 9.621 -9.741 -10.146 1.00 2.05 H new ATOM 0 HE3 LYS A 99 10.915 -9.411 -11.281 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 12.096 -9.525 -9.371 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 11.722 -7.870 -9.317 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 10.824 -8.974 -8.392 1.00 2.69 H new ATOM 1388 N ALA A 100 5.142 -8.724 -7.823 1.00 0.51 N ATOM 1389 CA ALA A 100 4.160 -9.635 -7.274 1.00 0.43 C ATOM 1390 C ALA A 100 2.979 -9.754 -8.207 1.00 0.40 C ATOM 1391 O ALA A 100 3.104 -9.541 -9.413 1.00 0.55 O ATOM 1392 CB ALA A 100 3.679 -9.126 -5.941 1.00 0.43 C ATOM 0 H ALA A 100 4.855 -8.278 -8.695 1.00 0.51 H new ATOM 0 HA ALA A 100 4.626 -10.613 -7.151 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.940 -9.816 -5.533 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.522 -9.050 -5.255 1.00 0.43 H new ATOM 0 HB3 ALA A 100 3.226 -8.143 -6.069 1.00 0.43 H new ATOM 1398 N GLU A 101 1.828 -10.067 -7.636 1.00 0.34 N ATOM 1399 CA GLU A 101 0.614 -10.182 -8.410 1.00 0.40 C ATOM 1400 C GLU A 101 -0.290 -8.967 -8.196 1.00 0.43 C ATOM 1401 O GLU A 101 -1.509 -9.078 -8.299 1.00 0.67 O ATOM 1402 CB GLU A 101 -0.139 -11.463 -8.040 1.00 0.50 C ATOM 1403 CG GLU A 101 0.689 -12.733 -8.179 1.00 0.67 C ATOM 1404 CD GLU A 101 1.234 -12.935 -9.579 1.00 1.24 C ATOM 1405 OE1 GLU A 101 0.430 -13.179 -10.501 1.00 1.57 O ATOM 1406 OE2 GLU A 101 2.468 -12.826 -9.765 1.00 1.99 O ATOM 0 H GLU A 101 1.714 -10.245 -6.638 1.00 0.34 H new ATOM 0 HA GLU A 101 0.892 -10.225 -9.463 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.489 -11.381 -7.011 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -1.023 -11.547 -8.672 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.519 -12.698 -7.474 1.00 0.67 H new ATOM 0 HG3 GLU A 101 0.075 -13.592 -7.907 1.00 0.67 H new ATOM 1413 N PHE A 102 0.310 -7.815 -7.890 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.443 -6.603 -7.616 1.00 0.40 C ATOM 1415 C PHE A 102 -0.213 -5.556 -8.684 1.00 0.45 C ATOM 1416 O PHE A 102 0.501 -5.773 -9.664 1.00 0.80 O ATOM 1417 CB PHE A 102 0.007 -5.927 -6.340 1.00 0.84 C ATOM 1418 CG PHE A 102 0.437 -6.819 -5.274 1.00 0.45 C ATOM 1419 CD1 PHE A 102 -0.417 -7.749 -4.749 1.00 0.52 C ATOM 1420 CD2 PHE A 102 1.701 -6.701 -4.782 1.00 0.62 C ATOM 1421 CE1 PHE A 102 0.002 -8.563 -3.744 1.00 0.59 C ATOM 1422 CE2 PHE A 102 2.128 -7.505 -3.782 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.277 -8.446 -3.257 1.00 0.44 C ATOM 0 H PHE A 102 1.322 -7.702 -7.827 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.481 -6.930 -7.562 1.00 0.40 H new ATOM 0 HB2 PHE A 102 0.829 -5.252 -6.578 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -0.812 -5.313 -5.967 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -1.423 -7.837 -5.132 1.00 0.52 H new ATOM 0 HD2 PHE A 102 2.369 -5.959 -5.194 1.00 0.62 H new ATOM 0 HE1 PHE A 102 -0.669 -9.301 -3.330 1.00 0.59 H new ATOM 0 HE2 PHE A 102 3.133 -7.407 -3.398 1.00 0.58 H new ATOM 0 HZ PHE A 102 1.613 -9.094 -2.461 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.822 -4.390 -8.475 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.385 -3.130 -9.047 1.00 0.39 C ATOM 1435 C PRO A 103 0.782 -2.560 -8.250 1.00 0.41 C ATOM 1436 O PRO A 103 0.621 -1.612 -7.484 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.635 -2.242 -8.923 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.725 -3.190 -8.558 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.051 -4.202 -7.715 1.00 0.27 C ATOM 0 HA PRO A 103 -0.027 -3.215 -10.073 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.504 -1.474 -8.160 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.852 -1.728 -9.859 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.526 -2.688 -8.015 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.174 -3.642 -9.442 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -1.864 -3.843 -6.703 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.630 -5.121 -7.625 1.00 0.27 H new ATOM 1447 N ILE A 104 1.949 -3.187 -8.377 1.00 0.35 N ATOM 1448 CA ILE A 104 3.153 -2.636 -7.778 1.00 0.35 C ATOM 1449 C ILE A 104 3.586 -1.436 -8.604 1.00 0.33 C ATOM 1450 O ILE A 104 3.839 -1.556 -9.805 1.00 0.44 O ATOM 1451 CB ILE A 104 4.325 -3.642 -7.673 1.00 0.41 C ATOM 1452 CG1 ILE A 104 3.914 -4.882 -6.882 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.544 -2.967 -7.036 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.288 -5.956 -7.741 1.00 1.34 C ATOM 0 H ILE A 104 2.082 -4.063 -8.882 1.00 0.35 H new ATOM 0 HA ILE A 104 2.906 -2.360 -6.753 1.00 0.35 H new ATOM 0 HB ILE A 104 4.593 -3.965 -8.679 1.00 0.41 H new ATOM 0 HG12 ILE A 104 4.791 -5.292 -6.380 1.00 0.52 H new ATOM 0 HG13 ILE A 104 3.208 -4.591 -6.104 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.362 -3.684 -6.967 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.853 -2.121 -7.650 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.285 -2.615 -6.037 1.00 0.45 H new ATOM 0 HD11 ILE A 104 3.019 -6.809 -7.118 1.00 1.34 H new ATOM 0 HD12 ILE A 104 2.393 -5.561 -8.222 1.00 1.34 H new ATOM 0 HD13 ILE A 104 4.000 -6.273 -8.503 1.00 1.34 H new ATOM 1466 N MET A 105 3.637 -0.281 -7.967 1.00 0.29 N ATOM 1467 CA MET A 105 3.896 0.963 -8.666 1.00 0.30 C ATOM 1468 C MET A 105 5.384 1.133 -8.931 1.00 0.27 C ATOM 1469 O MET A 105 6.188 0.256 -8.624 1.00 0.35 O ATOM 1470 CB MET A 105 3.332 2.146 -7.858 1.00 0.43 C ATOM 1471 CG MET A 105 4.335 2.887 -6.987 1.00 1.50 C ATOM 1472 SD MET A 105 4.903 4.437 -7.722 1.00 2.49 S ATOM 1473 CE MET A 105 3.387 5.381 -7.792 1.00 3.03 C ATOM 0 H MET A 105 3.502 -0.179 -6.961 1.00 0.29 H new ATOM 0 HA MET A 105 3.393 0.937 -9.633 1.00 0.30 H new ATOM 0 HB2 MET A 105 2.887 2.858 -8.553 1.00 0.43 H new ATOM 0 HB3 MET A 105 2.528 1.777 -7.221 1.00 0.43 H new ATOM 0 HG2 MET A 105 3.881 3.096 -6.018 1.00 1.50 H new ATOM 0 HG3 MET A 105 5.195 2.242 -6.804 1.00 1.50 H new ATOM 0 HE1 MET A 105 3.410 6.043 -8.658 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.539 4.702 -7.877 1.00 3.03 H new ATOM 0 HE3 MET A 105 3.286 5.975 -6.884 1.00 3.03 H new ATOM 1483 N ALA A 106 5.738 2.280 -9.483 1.00 0.33 N ATOM 1484 CA ALA A 106 7.117 2.577 -9.868 1.00 0.52 C ATOM 1485 C ALA A 106 8.011 2.800 -8.656 1.00 0.66 C ATOM 1486 O ALA A 106 9.210 3.022 -8.803 1.00 1.46 O ATOM 1487 CB ALA A 106 7.134 3.801 -10.750 1.00 0.70 C ATOM 0 H ALA A 106 5.082 3.036 -9.679 1.00 0.33 H new ATOM 0 HA ALA A 106 7.510 1.716 -10.409 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.160 4.026 -11.040 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.538 3.614 -11.643 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.716 4.648 -10.205 1.00 0.70 H new ATOM 1493 N LYS A 107 7.397 2.689 -7.479 1.00 0.40 N ATOM 1494 CA LYS A 107 7.980 3.043 -6.187 1.00 0.36 C ATOM 1495 C LYS A 107 8.122 4.530 -6.062 1.00 0.38 C ATOM 1496 O LYS A 107 8.497 5.242 -6.998 1.00 0.59 O ATOM 1497 CB LYS A 107 9.344 2.392 -5.915 1.00 0.49 C ATOM 1498 CG LYS A 107 10.548 3.220 -6.342 1.00 0.84 C ATOM 1499 CD LYS A 107 11.845 2.446 -6.182 1.00 0.83 C ATOM 1500 CE LYS A 107 11.816 1.177 -7.009 1.00 0.95 C ATOM 1501 NZ LYS A 107 11.555 1.471 -8.445 1.00 1.76 N ATOM 0 H LYS A 107 6.443 2.336 -7.397 1.00 0.40 H new ATOM 0 HA LYS A 107 7.284 2.655 -5.443 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.425 2.185 -4.848 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.381 1.432 -6.430 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.431 3.523 -7.382 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.592 4.132 -5.747 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.686 3.068 -6.490 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.999 2.198 -5.132 1.00 0.83 H new ATOM 0 HE2 LYS A 107 12.767 0.654 -6.910 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.044 0.509 -6.627 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 11.708 0.611 -9.009 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 10.572 1.791 -8.561 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 12.202 2.217 -8.770 1.00 1.76 H new ATOM 1515 N ILE A 108 7.780 4.979 -4.901 1.00 0.31 N ATOM 1516 CA ILE A 108 8.062 6.308 -4.486 1.00 0.35 C ATOM 1517 C ILE A 108 8.461 6.224 -3.036 1.00 0.36 C ATOM 1518 O ILE A 108 8.319 5.166 -2.418 1.00 0.42 O ATOM 1519 CB ILE A 108 6.865 7.281 -4.665 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.839 7.144 -3.533 1.00 0.82 C ATOM 1521 CG2 ILE A 108 6.196 7.075 -6.025 1.00 0.68 C ATOM 1522 CD1 ILE A 108 5.237 5.773 -3.367 1.00 0.64 C ATOM 0 H ILE A 108 7.288 4.421 -4.203 1.00 0.31 H new ATOM 0 HA ILE A 108 8.855 6.719 -5.111 1.00 0.35 H new ATOM 0 HB ILE A 108 7.265 8.294 -4.622 1.00 0.48 H new ATOM 0 HG12 ILE A 108 6.318 7.428 -2.596 1.00 0.82 H new ATOM 0 HG13 ILE A 108 5.033 7.857 -3.708 1.00 0.82 H new ATOM 0 HG21 ILE A 108 5.360 7.767 -6.128 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.920 7.260 -6.818 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.830 6.051 -6.099 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.526 5.785 -2.541 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.722 5.488 -4.285 1.00 0.64 H new ATOM 0 HD13 ILE A 108 6.027 5.052 -3.155 1.00 0.64 H new ATOM 1534 N ASN A 109 9.002 7.287 -2.524 1.00 0.38 N ATOM 1535 CA ASN A 109 9.202 7.418 -1.097 1.00 0.44 C ATOM 1536 C ASN A 109 7.906 7.081 -0.390 1.00 0.47 C ATOM 1537 O ASN A 109 6.881 7.691 -0.644 1.00 0.76 O ATOM 1538 CB ASN A 109 9.619 8.848 -0.804 1.00 0.53 C ATOM 1539 CG ASN A 109 10.121 9.090 0.619 1.00 0.98 C ATOM 1540 OD1 ASN A 109 9.634 8.329 1.581 1.00 1.73 O flip ATOM 1541 ND2 ASN A 109 10.947 9.972 0.849 1.00 1.16 N flip ATOM 0 H ASN A 109 9.318 8.088 -3.071 1.00 0.38 H new ATOM 0 HA ASN A 109 9.979 6.739 -0.745 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.404 9.134 -1.505 1.00 0.53 H new ATOM 0 HB3 ASN A 109 8.770 9.505 -0.991 1.00 0.53 H new ATOM 0 HD21 ASN A 109 11.307 10.545 0.086 1.00 1.16 H new ATOM 0 HD22 ASN A 109 11.272 10.130 1.803 1.00 1.16 H new ATOM 1548 N VAL A 110 7.920 6.070 0.440 1.00 0.41 N ATOM 1549 CA VAL A 110 6.817 5.882 1.344 1.00 0.42 C ATOM 1550 C VAL A 110 7.355 5.735 2.733 1.00 0.44 C ATOM 1551 O VAL A 110 7.566 4.631 3.222 1.00 0.48 O ATOM 1552 CB VAL A 110 6.003 4.625 0.988 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.875 4.974 0.046 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.891 3.564 0.364 1.00 0.77 C ATOM 0 H VAL A 110 8.666 5.378 0.509 1.00 0.41 H new ATOM 0 HA VAL A 110 6.158 6.747 1.269 1.00 0.42 H new ATOM 0 HB VAL A 110 5.582 4.225 1.910 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.310 4.073 -0.195 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.215 5.700 0.522 1.00 0.60 H new ATOM 0 HG13 VAL A 110 5.284 5.401 -0.869 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.293 2.686 0.121 1.00 0.77 H new ATOM 0 HG22 VAL A 110 7.344 3.958 -0.546 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.675 3.286 1.068 1.00 0.77 H new ATOM 1564 N ASN A 111 7.514 6.877 3.369 1.00 0.48 N ATOM 1565 CA ASN A 111 7.952 6.952 4.737 1.00 0.56 C ATOM 1566 C ASN A 111 8.221 8.399 5.087 1.00 0.62 C ATOM 1567 O ASN A 111 8.055 9.280 4.240 1.00 0.67 O ATOM 1568 CB ASN A 111 9.193 6.092 4.989 1.00 0.65 C ATOM 1569 CG ASN A 111 8.974 5.138 6.157 1.00 1.20 C ATOM 1570 OD1 ASN A 111 7.837 4.800 6.493 1.00 1.90 O ATOM 1571 ND2 ASN A 111 10.050 4.694 6.781 1.00 1.72 N ATOM 0 H ASN A 111 7.339 7.786 2.941 1.00 0.48 H new ATOM 0 HA ASN A 111 7.163 6.557 5.377 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.433 5.523 4.091 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.048 6.735 5.197 1.00 0.65 H new ATOM 0 HD21 ASN A 111 9.955 4.051 7.567 1.00 1.72 H new ATOM 0 HD22 ASN A 111 10.976 4.994 6.477 1.00 1.72 H new ATOM 1578 N GLY A 112 8.625 8.601 6.331 1.00 0.73 N ATOM 1579 CA GLY A 112 9.180 9.854 6.836 1.00 0.85 C ATOM 1580 C GLY A 112 9.232 11.061 5.900 1.00 0.93 C ATOM 1581 O GLY A 112 8.454 12.000 6.063 1.00 1.47 O ATOM 0 H GLY A 112 8.575 7.874 7.044 1.00 0.73 H new ATOM 0 HA2 GLY A 112 8.603 10.141 7.715 1.00 0.85 H new ATOM 0 HA3 GLY A 112 10.197 9.653 7.174 1.00 0.85 H new ATOM 1585 N GLU A 113 10.129 11.045 4.910 1.00 0.88 N ATOM 1586 CA GLU A 113 10.662 12.308 4.401 1.00 1.23 C ATOM 1587 C GLU A 113 9.817 12.956 3.313 1.00 1.10 C ATOM 1588 O GLU A 113 9.547 14.157 3.377 1.00 1.39 O ATOM 1589 CB GLU A 113 12.084 12.102 3.884 1.00 1.61 C ATOM 1590 CG GLU A 113 12.760 13.386 3.436 1.00 1.83 C ATOM 1591 CD GLU A 113 14.194 13.168 3.010 1.00 2.29 C ATOM 1592 OE1 GLU A 113 15.080 13.125 3.888 1.00 2.81 O ATOM 1593 OE2 GLU A 113 14.438 13.033 1.793 1.00 2.65 O ATOM 0 H GLU A 113 10.490 10.204 4.460 1.00 0.88 H new ATOM 0 HA GLU A 113 10.648 12.995 5.247 1.00 1.23 H new ATOM 0 HB2 GLU A 113 12.684 11.640 4.668 1.00 1.61 H new ATOM 0 HB3 GLU A 113 12.060 11.403 3.048 1.00 1.61 H new ATOM 0 HG2 GLU A 113 12.200 13.817 2.606 1.00 1.83 H new ATOM 0 HG3 GLU A 113 12.732 14.110 4.250 1.00 1.83 H new ATOM 1600 N ASN A 114 9.385 12.197 2.323 1.00 0.79 N ATOM 1601 CA ASN A 114 8.681 12.809 1.210 1.00 0.79 C ATOM 1602 C ASN A 114 7.382 12.101 0.937 1.00 0.79 C ATOM 1603 O ASN A 114 6.388 12.740 0.592 1.00 1.22 O ATOM 1604 CB ASN A 114 9.551 12.793 -0.053 1.00 0.87 C ATOM 1605 CG ASN A 114 8.917 13.538 -1.215 1.00 1.45 C ATOM 1606 OD1 ASN A 114 9.104 14.744 -1.367 1.00 2.06 O ATOM 1607 ND2 ASN A 114 8.169 12.830 -2.048 1.00 2.16 N ATOM 0 H ASN A 114 9.503 11.186 2.264 1.00 0.79 H new ATOM 0 HA ASN A 114 8.465 13.842 1.483 1.00 0.79 H new ATOM 0 HB2 ASN A 114 10.520 13.239 0.173 1.00 0.87 H new ATOM 0 HB3 ASN A 114 9.736 11.760 -0.348 1.00 0.87 H new ATOM 0 HD21 ASN A 114 7.726 13.284 -2.847 1.00 2.16 H new ATOM 0 HD22 ASN A 114 8.036 11.831 -1.891 1.00 2.16 H new ATOM 1614 N ALA A 115 7.385 10.783 1.140 1.00 0.59 N ATOM 1615 CA ALA A 115 6.267 9.961 0.760 1.00 0.61 C ATOM 1616 C ALA A 115 5.835 10.340 -0.651 1.00 0.68 C ATOM 1617 O ALA A 115 6.671 10.487 -1.545 1.00 1.26 O ATOM 1618 CB ALA A 115 5.132 10.095 1.762 1.00 0.86 C ATOM 0 H ALA A 115 8.158 10.273 1.568 1.00 0.59 H new ATOM 0 HA ALA A 115 6.560 8.911 0.763 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.298 9.464 1.454 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.478 9.783 2.747 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.805 11.134 1.805 1.00 0.86 H new ATOM 1624 N HIS A 116 4.553 10.497 -0.844 1.00 0.42 N ATOM 1625 CA HIS A 116 4.009 10.879 -2.110 1.00 0.35 C ATOM 1626 C HIS A 116 2.620 11.398 -1.855 1.00 0.29 C ATOM 1627 O HIS A 116 1.936 10.827 -1.036 1.00 0.29 O ATOM 1628 CB HIS A 116 4.025 9.641 -3.022 1.00 0.35 C ATOM 1629 CG HIS A 116 3.092 9.688 -4.179 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.762 9.833 -3.986 1.00 0.33 N ATOM 1631 CD2 HIS A 116 3.275 9.639 -5.523 1.00 0.31 C ATOM 1632 CE1 HIS A 116 1.148 9.893 -5.124 1.00 0.32 C ATOM 1633 NE2 HIS A 116 2.033 9.775 -6.093 1.00 0.32 N ATOM 0 H HIS A 116 3.853 10.361 -0.115 1.00 0.42 H new ATOM 0 HA HIS A 116 4.582 11.662 -2.607 1.00 0.35 H new ATOM 0 HB2 HIS A 116 5.038 9.502 -3.400 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.786 8.764 -2.420 1.00 0.35 H new ATOM 0 HD2 HIS A 116 4.214 9.517 -6.043 1.00 0.31 H new ATOM 0 HE1 HIS A 116 0.084 10.019 -5.257 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.831 9.783 -7.093 1.00 0.32 H new ATOM 1642 N PRO A 117 2.199 12.477 -2.538 1.00 0.31 N ATOM 1643 CA PRO A 117 0.876 13.090 -2.396 1.00 0.31 C ATOM 1644 C PRO A 117 -0.220 12.109 -1.949 1.00 0.26 C ATOM 1645 O PRO A 117 -0.943 12.375 -1.001 1.00 0.27 O ATOM 1646 CB PRO A 117 0.609 13.600 -3.815 1.00 0.37 C ATOM 1647 CG PRO A 117 1.953 13.760 -4.467 1.00 0.40 C ATOM 1648 CD PRO A 117 2.994 13.224 -3.516 1.00 0.38 C ATOM 0 HA PRO A 117 0.859 13.856 -1.620 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.011 12.896 -4.371 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.073 14.549 -3.792 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.985 13.219 -5.413 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.146 14.809 -4.693 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.713 12.582 -4.025 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.561 14.027 -3.045 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.320 10.971 -2.637 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.256 9.904 -2.278 1.00 0.23 C ATOM 1658 C LEU A 118 -1.046 9.405 -0.840 1.00 0.27 C ATOM 1659 O LEU A 118 -1.974 9.383 -0.037 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.091 8.756 -3.263 1.00 0.24 C ATOM 1661 CG LEU A 118 -1.953 7.532 -3.009 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.417 7.890 -3.165 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.568 6.405 -3.953 1.00 0.27 C ATOM 0 H LEU A 118 0.246 10.763 -3.460 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.268 10.305 -2.328 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.309 9.128 -4.264 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.046 8.447 -3.259 1.00 0.24 H new ATOM 0 HG LEU A 118 -1.787 7.188 -1.988 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.029 7.007 -2.981 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.679 8.669 -2.449 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.597 8.252 -4.177 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.196 5.536 -3.757 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.709 6.730 -4.984 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.522 6.140 -3.796 1.00 0.27 H new ATOM 1675 N TYR A 119 0.182 9.025 -0.517 1.00 0.32 N ATOM 1676 CA TYR A 119 0.507 8.535 0.817 1.00 0.42 C ATOM 1677 C TYR A 119 0.633 9.649 1.819 1.00 0.40 C ATOM 1678 O TYR A 119 0.286 9.471 2.975 1.00 0.41 O ATOM 1679 CB TYR A 119 1.786 7.736 0.811 1.00 0.57 C ATOM 1680 CG TYR A 119 1.620 6.420 0.142 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.093 5.353 0.828 1.00 1.09 C ATOM 1682 CD2 TYR A 119 1.988 6.245 -1.180 1.00 0.92 C ATOM 1683 CE1 TYR A 119 0.930 4.145 0.218 1.00 1.88 C ATOM 1684 CE2 TYR A 119 1.821 5.032 -1.803 1.00 1.74 C ATOM 1685 CZ TYR A 119 1.336 3.978 -1.095 1.00 2.20 C ATOM 1686 OH TYR A 119 1.097 2.782 -1.718 1.00 3.04 O ATOM 0 H TYR A 119 0.972 9.046 -1.162 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.323 7.894 1.113 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.566 8.304 0.304 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.121 7.581 1.837 1.00 0.57 H new ATOM 0 HD1 TYR A 119 0.805 5.473 1.862 1.00 1.09 H new ATOM 0 HD2 TYR A 119 2.412 7.073 -1.729 1.00 0.92 H new ATOM 0 HE1 TYR A 119 0.486 3.321 0.757 1.00 1.88 H new ATOM 0 HE2 TYR A 119 2.073 4.917 -2.847 1.00 1.74 H new ATOM 0 HH TYR A 119 1.380 2.839 -2.654 1.00 3.04 H new ATOM 1696 N GLU A 120 1.149 10.786 1.389 1.00 0.40 N ATOM 1697 CA GLU A 120 1.163 11.951 2.239 1.00 0.42 C ATOM 1698 C GLU A 120 -0.249 12.232 2.626 1.00 0.37 C ATOM 1699 O GLU A 120 -0.520 12.637 3.741 1.00 0.43 O ATOM 1700 CB GLU A 120 1.770 13.170 1.540 1.00 0.50 C ATOM 1701 CG GLU A 120 3.287 13.184 1.525 1.00 0.76 C ATOM 1702 CD GLU A 120 3.881 13.315 2.916 1.00 1.58 C ATOM 1703 OE1 GLU A 120 3.872 12.317 3.668 1.00 2.44 O ATOM 1704 OE2 GLU A 120 4.349 14.419 3.268 1.00 1.93 O ATOM 0 H GLU A 120 1.559 10.922 0.465 1.00 0.40 H new ATOM 0 HA GLU A 120 1.785 11.754 3.112 1.00 0.42 H new ATOM 0 HB2 GLU A 120 1.407 13.205 0.513 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.414 14.074 2.035 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.651 12.266 1.063 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.633 14.012 0.906 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.159 11.953 1.709 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.569 12.069 2.048 1.00 0.28 C ATOM 1713 C TYR A 121 -3.000 10.950 2.999 1.00 0.27 C ATOM 1714 O TYR A 121 -3.833 11.154 3.882 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.449 12.059 0.805 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.914 11.977 1.137 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.579 13.065 1.671 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.635 10.822 0.884 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.923 13.005 1.951 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.982 10.755 1.153 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.595 11.803 1.806 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.971 11.789 1.952 1.00 0.56 O ATOM 0 H TYR A 121 -0.959 11.654 0.754 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.698 13.028 2.550 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.261 12.962 0.224 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.174 11.212 0.176 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -5.034 13.976 1.871 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.132 9.961 0.469 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.451 13.888 2.281 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.555 9.889 0.855 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.305 10.877 1.822 1.00 0.56 H new ATOM 1732 N MET A 122 -2.400 9.784 2.840 1.00 0.27 N ATOM 1733 CA MET A 122 -2.853 8.596 3.549 1.00 0.29 C ATOM 1734 C MET A 122 -2.442 8.660 5.008 1.00 0.33 C ATOM 1735 O MET A 122 -3.280 8.558 5.897 1.00 0.35 O ATOM 1736 CB MET A 122 -2.323 7.313 2.906 1.00 0.33 C ATOM 1737 CG MET A 122 -3.434 6.346 2.554 1.00 0.71 C ATOM 1738 SD MET A 122 -2.961 5.182 1.274 1.00 0.56 S ATOM 1739 CE MET A 122 -2.971 6.275 -0.134 1.00 0.55 C ATOM 0 H MET A 122 -1.599 9.632 2.227 1.00 0.27 H new ATOM 0 HA MET A 122 -3.941 8.573 3.485 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.764 7.565 2.005 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.625 6.828 3.589 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.728 5.796 3.448 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.308 6.908 2.223 1.00 0.71 H new ATOM 0 HE1 MET A 122 -3.754 5.968 -0.828 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.161 7.295 0.199 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.004 6.231 -0.635 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.146 8.842 5.253 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.648 8.961 6.616 1.00 0.45 C ATOM 1751 C LYS A 123 -1.072 10.276 7.249 1.00 0.47 C ATOM 1752 O LYS A 123 -1.172 10.366 8.471 1.00 0.54 O ATOM 1753 CB LYS A 123 0.876 8.790 6.720 1.00 0.53 C ATOM 1754 CG LYS A 123 1.649 9.146 5.469 1.00 0.48 C ATOM 1755 CD LYS A 123 3.074 9.566 5.784 1.00 1.00 C ATOM 1756 CE LYS A 123 3.118 10.819 6.650 1.00 1.05 C ATOM 1757 NZ LYS A 123 2.581 12.011 5.942 1.00 1.46 N ATOM 0 H LYS A 123 -0.429 8.909 4.530 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.101 8.138 7.169 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.240 9.407 7.541 1.00 0.53 H new ATOM 0 HB3 LYS A 123 1.093 7.754 6.980 1.00 0.53 H new ATOM 0 HG2 LYS A 123 1.664 8.289 4.795 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.139 9.955 4.945 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.588 8.752 6.296 1.00 1.00 H new ATOM 0 HD3 LYS A 123 3.613 9.748 4.854 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.543 10.650 7.560 1.00 1.05 H new ATOM 0 HE3 LYS A 123 4.147 11.012 6.954 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 2.900 12.875 6.426 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 2.926 12.016 4.961 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 1.542 11.977 5.944 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.326 11.306 6.439 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.789 12.564 7.004 1.00 0.50 C ATOM 1773 C LYS A 124 -3.195 12.385 7.557 1.00 0.49 C ATOM 1774 O LYS A 124 -3.611 13.083 8.483 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.744 13.723 6.002 1.00 0.56 C ATOM 1776 CG LYS A 124 -3.042 13.971 5.250 1.00 0.59 C ATOM 1777 CD LYS A 124 -2.871 15.073 4.221 1.00 0.97 C ATOM 1778 CE LYS A 124 -4.201 15.505 3.632 1.00 1.41 C ATOM 1779 NZ LYS A 124 -5.035 16.241 4.616 1.00 1.99 N ATOM 0 H LYS A 124 -1.222 11.293 5.424 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.105 12.832 7.809 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.470 14.634 6.534 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -0.953 13.527 5.278 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -3.361 13.053 4.756 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.828 14.244 5.954 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -2.383 15.930 4.684 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -2.215 14.726 3.422 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -4.023 16.138 2.763 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -4.744 14.627 3.282 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -5.825 16.704 4.124 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -5.410 15.574 5.321 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -4.455 16.960 5.094 1.00 1.99 H new ATOM 1793 N THR A 125 -3.917 11.437 6.972 1.00 0.42 N ATOM 1794 CA THR A 125 -5.253 11.093 7.438 1.00 0.44 C ATOM 1795 C THR A 125 -5.188 9.996 8.512 1.00 0.44 C ATOM 1796 O THR A 125 -6.045 9.917 9.396 1.00 0.56 O ATOM 1797 CB THR A 125 -6.142 10.628 6.260 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.107 11.611 5.215 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.583 10.420 6.703 1.00 0.59 C ATOM 0 H THR A 125 -3.598 10.892 6.171 1.00 0.42 H new ATOM 0 HA THR A 125 -5.696 11.987 7.877 1.00 0.44 H new ATOM 0 HB THR A 125 -5.752 9.677 5.897 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.298 11.487 4.677 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.182 10.094 5.853 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.618 9.660 7.484 1.00 0.59 H new ATOM 0 HG23 THR A 125 -7.983 11.357 7.090 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.153 9.170 8.440 1.00 0.44 N ATOM 1808 CA LYS A 126 -3.987 8.039 9.351 1.00 0.54 C ATOM 1809 C LYS A 126 -2.552 7.971 9.884 1.00 0.57 C ATOM 1810 O LYS A 126 -1.699 7.303 9.296 1.00 0.68 O ATOM 1811 CB LYS A 126 -4.342 6.736 8.625 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.825 6.586 8.341 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.574 6.145 9.582 1.00 0.92 C ATOM 1814 CE LYS A 126 -8.032 6.567 9.535 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.799 6.036 10.694 1.00 1.85 N ATOM 0 H LYS A 126 -3.406 9.262 7.752 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.657 8.176 10.200 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -3.794 6.693 7.684 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -4.008 5.891 9.227 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -6.229 7.534 7.986 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -5.974 5.858 7.544 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.511 5.061 9.679 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.099 6.572 10.465 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -8.095 7.655 9.525 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.483 6.213 8.608 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -9.649 6.616 10.843 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -9.080 5.053 10.503 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -8.205 6.067 11.547 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.284 8.642 11.021 1.00 0.77 N ATOM 1830 CA PRO A 127 -0.932 8.752 11.598 1.00 1.04 C ATOM 1831 C PRO A 127 -0.314 7.406 11.989 1.00 1.27 C ATOM 1832 O PRO A 127 0.878 7.182 11.791 1.00 1.69 O ATOM 1833 CB PRO A 127 -1.136 9.623 12.845 1.00 1.28 C ATOM 1834 CG PRO A 127 -2.436 10.318 12.622 1.00 1.22 C ATOM 1835 CD PRO A 127 -3.278 9.362 11.830 1.00 0.95 C ATOM 0 HA PRO A 127 -0.236 9.167 10.870 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -1.163 9.016 13.750 1.00 1.28 H new ATOM 0 HB3 PRO A 127 -0.322 10.338 12.965 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -2.914 10.568 13.569 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -2.292 11.253 12.081 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.839 8.687 12.476 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -4.005 9.884 11.207 1.00 0.95 H new ATOM 1843 N GLY A 128 -1.108 6.513 12.560 1.00 1.55 N ATOM 1844 CA GLY A 128 -0.582 5.214 12.928 1.00 1.96 C ATOM 1845 C GLY A 128 -1.263 4.616 14.137 1.00 2.13 C ATOM 1846 O GLY A 128 -1.649 5.333 15.060 1.00 2.59 O ATOM 0 H GLY A 128 -2.094 6.660 12.773 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -0.691 4.533 12.084 1.00 1.96 H new ATOM 0 HA3 GLY A 128 0.486 5.305 13.129 1.00 1.96 H new ATOM 1850 N ILE A 129 -1.392 3.294 14.140 1.00 2.17 N ATOM 1851 CA ILE A 129 -1.995 2.576 15.262 1.00 2.46 C ATOM 1852 C ILE A 129 -1.099 2.644 16.494 1.00 2.36 C ATOM 1853 O ILE A 129 -1.547 2.437 17.620 1.00 2.70 O ATOM 1854 CB ILE A 129 -2.260 1.094 14.913 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -0.976 0.425 14.403 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -3.374 0.978 13.884 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -1.135 -1.046 14.084 1.00 3.58 C ATOM 0 H ILE A 129 -1.086 2.693 13.375 1.00 2.17 H new ATOM 0 HA ILE A 129 -2.947 3.062 15.475 1.00 2.46 H new ATOM 0 HB ILE A 129 -2.579 0.577 15.818 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -0.638 0.946 13.508 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -0.195 0.541 15.154 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -3.546 -0.073 13.651 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -4.288 1.415 14.286 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -3.087 1.509 12.976 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -0.185 -1.446 13.730 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -1.442 -1.582 14.982 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -1.892 -1.171 13.310 1.00 3.58 H new ATOM 1869 N LEU A 130 0.173 2.941 16.266 1.00 2.12 N ATOM 1870 CA LEU A 130 1.143 3.061 17.342 1.00 2.29 C ATOM 1871 C LEU A 130 1.445 4.524 17.608 1.00 2.20 C ATOM 1872 O LEU A 130 2.356 4.867 18.360 1.00 2.44 O ATOM 1873 CB LEU A 130 2.424 2.303 16.992 1.00 2.58 C ATOM 1874 CG LEU A 130 3.316 2.913 15.902 1.00 2.89 C ATOM 1875 CD1 LEU A 130 4.658 2.196 15.872 1.00 3.36 C ATOM 1876 CD2 LEU A 130 2.656 2.829 14.531 1.00 3.47 C ATOM 0 H LEU A 130 0.558 3.104 15.336 1.00 2.12 H new ATOM 0 HA LEU A 130 0.722 2.621 18.246 1.00 2.29 H new ATOM 0 HB2 LEU A 130 3.018 2.204 17.900 1.00 2.58 H new ATOM 0 HB3 LEU A 130 2.148 1.296 16.680 1.00 2.58 H new ATOM 0 HG LEU A 130 3.467 3.966 16.140 1.00 2.89 H new ATOM 0 HD11 LEU A 130 5.287 2.633 15.096 1.00 3.36 H new ATOM 0 HD12 LEU A 130 5.149 2.302 16.840 1.00 3.36 H new ATOM 0 HD13 LEU A 130 4.501 1.139 15.658 1.00 3.36 H new ATOM 0 HD21 LEU A 130 3.314 3.270 13.783 1.00 3.47 H new ATOM 0 HD22 LEU A 130 2.470 1.785 14.280 1.00 3.47 H new ATOM 0 HD23 LEU A 130 1.711 3.372 14.548 1.00 3.47 H new ATOM 1888 N ALA A 131 0.655 5.368 16.957 1.00 2.45 N ATOM 1889 CA ALA A 131 0.730 6.811 17.097 1.00 2.67 C ATOM 1890 C ALA A 131 2.095 7.366 16.697 1.00 2.55 C ATOM 1891 O ALA A 131 2.758 8.042 17.484 1.00 3.21 O ATOM 1892 CB ALA A 131 0.364 7.235 18.515 1.00 3.28 C ATOM 0 H ALA A 131 -0.068 5.060 16.306 1.00 2.45 H new ATOM 0 HA ALA A 131 0.002 7.237 16.406 1.00 2.67 H new ATOM 0 HB1 ALA A 131 0.427 8.320 18.598 1.00 3.28 H new ATOM 0 HB2 ALA A 131 -0.652 6.912 18.740 1.00 3.28 H new ATOM 0 HB3 ALA A 131 1.056 6.777 19.222 1.00 3.28 H new ATOM 1898 N THR A 132 2.515 7.091 15.471 1.00 2.02 N ATOM 1899 CA THR A 132 3.792 7.592 14.990 1.00 2.10 C ATOM 1900 C THR A 132 3.605 8.749 14.010 1.00 1.56 C ATOM 1901 O THR A 132 3.685 9.912 14.409 1.00 2.12 O ATOM 1902 CB THR A 132 4.629 6.473 14.343 1.00 2.73 C ATOM 1903 OG1 THR A 132 4.834 5.423 15.291 1.00 3.34 O ATOM 1904 CG2 THR A 132 5.979 6.996 13.869 1.00 3.56 C ATOM 0 H THR A 132 1.995 6.529 14.797 1.00 2.02 H new ATOM 0 HA THR A 132 4.335 7.965 15.858 1.00 2.10 H new ATOM 0 HB THR A 132 4.084 6.097 13.477 1.00 2.73 H new ATOM 0 HG1 THR A 132 5.795 5.302 15.443 1.00 3.34 H new ATOM 0 HG21 THR A 132 6.546 6.182 13.417 1.00 3.56 H new ATOM 0 HG22 THR A 132 5.825 7.784 13.132 1.00 3.56 H new ATOM 0 HG23 THR A 132 6.533 7.396 14.718 1.00 3.56 H new ATOM 1912 N LYS A 133 3.319 8.438 12.746 1.00 1.29 N ATOM 1913 CA LYS A 133 3.227 9.466 11.710 1.00 1.47 C ATOM 1914 C LYS A 133 2.875 8.859 10.359 1.00 1.14 C ATOM 1915 O LYS A 133 2.124 9.444 9.581 1.00 1.58 O ATOM 1916 CB LYS A 133 4.555 10.221 11.593 1.00 2.24 C ATOM 1917 CG LYS A 133 4.475 11.472 10.733 1.00 3.04 C ATOM 1918 CD LYS A 133 5.655 12.395 10.987 1.00 3.81 C ATOM 1919 CE LYS A 133 5.540 13.689 10.195 1.00 4.63 C ATOM 1920 NZ LYS A 133 6.517 14.709 10.665 1.00 5.17 N ATOM 0 H LYS A 133 3.148 7.488 12.416 1.00 1.29 H new ATOM 0 HA LYS A 133 2.435 10.157 12.000 1.00 1.47 H new ATOM 0 HB2 LYS A 133 4.894 10.498 12.591 1.00 2.24 H new ATOM 0 HB3 LYS A 133 5.307 9.552 11.176 1.00 2.24 H new ATOM 0 HG2 LYS A 133 4.451 11.191 9.680 1.00 3.04 H new ATOM 0 HG3 LYS A 133 3.545 12.001 10.943 1.00 3.04 H new ATOM 0 HD2 LYS A 133 5.715 12.624 12.051 1.00 3.81 H new ATOM 0 HD3 LYS A 133 6.580 11.885 10.718 1.00 3.81 H new ATOM 0 HE2 LYS A 133 5.707 13.485 9.137 1.00 4.63 H new ATOM 0 HE3 LYS A 133 4.528 14.084 10.287 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 6.410 15.577 10.103 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 6.341 14.922 11.668 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 7.483 14.341 10.553 1.00 5.17 H new ATOM 1934 N ALA A 134 3.417 7.682 10.088 1.00 0.92 N ATOM 1935 CA ALA A 134 3.246 7.051 8.793 1.00 0.77 C ATOM 1936 C ALA A 134 3.088 5.544 8.930 1.00 0.81 C ATOM 1937 O ALA A 134 2.876 5.033 10.029 1.00 1.59 O ATOM 1938 CB ALA A 134 4.444 7.369 7.912 1.00 1.02 C ATOM 0 H ALA A 134 3.979 7.146 10.749 1.00 0.92 H new ATOM 0 HA ALA A 134 2.338 7.443 8.336 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.316 6.895 6.939 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.524 8.448 7.782 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.352 6.992 8.383 1.00 1.02 H new ATOM 1944 N ILE A 135 3.176 4.851 7.796 1.00 0.69 N ATOM 1945 CA ILE A 135 3.227 3.392 7.765 1.00 0.74 C ATOM 1946 C ILE A 135 4.320 2.881 8.710 1.00 1.09 C ATOM 1947 O ILE A 135 4.115 1.920 9.450 1.00 2.00 O ATOM 1948 CB ILE A 135 3.482 2.841 6.334 1.00 0.86 C ATOM 1949 CG1 ILE A 135 4.718 3.466 5.652 1.00 0.88 C ATOM 1950 CG2 ILE A 135 2.247 3.034 5.484 1.00 1.54 C ATOM 1951 CD1 ILE A 135 4.570 4.925 5.251 1.00 0.89 C ATOM 0 H ILE A 135 3.214 5.286 6.874 1.00 0.69 H new ATOM 0 HA ILE A 135 2.252 3.032 8.092 1.00 0.74 H new ATOM 0 HB ILE A 135 3.698 1.777 6.434 1.00 0.86 H new ATOM 0 HG12 ILE A 135 5.569 3.376 6.327 1.00 0.88 H new ATOM 0 HG13 ILE A 135 4.955 2.884 4.761 1.00 0.88 H new ATOM 0 HG21 ILE A 135 2.431 2.646 4.482 1.00 1.54 H new ATOM 0 HG22 ILE A 135 1.410 2.499 5.932 1.00 1.54 H new ATOM 0 HG23 ILE A 135 2.009 4.096 5.424 1.00 1.54 H new ATOM 0 HD11 ILE A 135 5.492 5.268 4.781 1.00 0.89 H new ATOM 0 HD12 ILE A 135 3.744 5.027 4.547 1.00 0.89 H new ATOM 0 HD13 ILE A 135 4.368 5.527 6.137 1.00 0.89 H new ATOM 1963 N LYS A 136 5.473 3.572 8.676 1.00 0.85 N ATOM 1964 CA LYS A 136 6.641 3.292 9.528 1.00 1.14 C ATOM 1965 C LYS A 136 7.318 1.957 9.189 1.00 0.75 C ATOM 1966 O LYS A 136 8.547 1.841 9.241 1.00 0.78 O ATOM 1967 CB LYS A 136 6.267 3.334 11.016 1.00 1.71 C ATOM 1968 CG LYS A 136 7.483 3.348 11.930 1.00 2.72 C ATOM 1969 CD LYS A 136 7.098 3.402 13.396 1.00 3.21 C ATOM 1970 CE LYS A 136 8.330 3.513 14.281 1.00 4.09 C ATOM 1971 NZ LYS A 136 9.236 2.344 14.125 1.00 4.81 N ATOM 0 H LYS A 136 5.621 4.357 8.042 1.00 0.85 H new ATOM 0 HA LYS A 136 7.363 4.082 9.322 1.00 1.14 H new ATOM 0 HB2 LYS A 136 5.663 4.221 11.209 1.00 1.71 H new ATOM 0 HB3 LYS A 136 5.649 2.469 11.255 1.00 1.71 H new ATOM 0 HG2 LYS A 136 8.083 2.457 11.747 1.00 2.72 H new ATOM 0 HG3 LYS A 136 8.107 4.208 11.688 1.00 2.72 H new ATOM 0 HD2 LYS A 136 6.442 4.254 13.572 1.00 3.21 H new ATOM 0 HD3 LYS A 136 6.535 2.507 13.661 1.00 3.21 H new ATOM 0 HE2 LYS A 136 8.872 4.427 14.035 1.00 4.09 H new ATOM 0 HE3 LYS A 136 8.021 3.596 15.323 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 9.970 2.373 14.861 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 8.688 1.465 14.218 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 9.684 2.375 13.187 1.00 4.81 H new ATOM 1985 N TRP A 137 6.520 0.958 8.867 1.00 0.69 N ATOM 1986 CA TRP A 137 7.011 -0.361 8.511 1.00 0.45 C ATOM 1987 C TRP A 137 7.056 -0.554 6.999 1.00 0.43 C ATOM 1988 O TRP A 137 6.744 0.356 6.239 1.00 0.55 O ATOM 1989 CB TRP A 137 6.146 -1.469 9.122 1.00 0.42 C ATOM 1990 CG TRP A 137 6.375 -1.746 10.559 1.00 0.62 C ATOM 1991 CD1 TRP A 137 5.421 -2.017 11.497 1.00 0.93 C ATOM 1992 CD2 TRP A 137 7.624 -1.798 11.221 1.00 1.00 C ATOM 1993 NE1 TRP A 137 6.012 -2.212 12.712 1.00 1.11 N ATOM 1994 CE2 TRP A 137 7.363 -2.084 12.564 1.00 1.16 C ATOM 1995 CE3 TRP A 137 8.935 -1.627 10.805 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 8.364 -2.195 13.498 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 9.946 -1.741 11.737 1.00 1.97 C ATOM 1998 CH2 TRP A 137 9.654 -2.026 13.077 1.00 1.97 C ATOM 0 H TRP A 137 5.503 1.039 8.845 1.00 0.69 H new ATOM 0 HA TRP A 137 8.022 -0.429 8.913 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.098 -1.203 8.985 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.317 -2.388 8.562 1.00 0.42 H new ATOM 0 HD1 TRP A 137 4.359 -2.069 11.307 1.00 0.93 H new ATOM 0 HE1 TRP A 137 5.526 -2.419 13.584 1.00 1.11 H new ATOM 0 HE3 TRP A 137 9.161 -1.409 9.772 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 8.139 -2.409 14.532 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 10.973 -1.609 11.430 1.00 1.97 H new ATOM 0 HH2 TRP A 137 10.461 -2.114 13.789 1.00 1.97 H new ATOM 2009 N ASN A 138 7.560 -1.729 6.625 1.00 0.37 N ATOM 2010 CA ASN A 138 7.466 -2.343 5.279 1.00 0.38 C ATOM 2011 C ASN A 138 6.104 -2.148 4.593 1.00 0.31 C ATOM 2012 O ASN A 138 5.415 -1.178 4.847 1.00 0.30 O ATOM 2013 CB ASN A 138 7.774 -3.840 5.383 1.00 0.41 C ATOM 2014 CG ASN A 138 8.829 -4.144 6.430 1.00 1.06 C ATOM 2015 OD1 ASN A 138 8.508 -4.478 7.573 1.00 2.04 O ATOM 2016 ND2 ASN A 138 10.089 -3.997 6.064 1.00 1.40 N ATOM 0 H ASN A 138 8.074 -2.319 7.279 1.00 0.37 H new ATOM 0 HA ASN A 138 8.198 -1.829 4.655 1.00 0.38 H new ATOM 0 HB2 ASN A 138 6.859 -4.380 5.626 1.00 0.41 H new ATOM 0 HB3 ASN A 138 8.112 -4.206 4.414 1.00 0.41 H new ATOM 0 HD21 ASN A 138 10.838 -4.161 6.737 1.00 1.40 H new ATOM 0 HD22 ASN A 138 10.313 -3.719 5.109 1.00 1.40 H new ATOM 2023 N PHE A 139 5.769 -3.045 3.666 1.00 0.34 N ATOM 2024 CA PHE A 139 4.528 -2.986 2.857 1.00 0.36 C ATOM 2025 C PHE A 139 3.276 -2.409 3.570 1.00 0.32 C ATOM 2026 O PHE A 139 2.360 -2.037 2.871 1.00 0.57 O ATOM 2027 CB PHE A 139 4.225 -4.357 2.242 1.00 0.55 C ATOM 2028 CG PHE A 139 4.821 -5.508 2.965 1.00 0.55 C ATOM 2029 CD1 PHE A 139 6.145 -5.836 2.781 1.00 0.61 C ATOM 2030 CD2 PHE A 139 4.049 -6.245 3.855 1.00 1.23 C ATOM 2031 CE1 PHE A 139 6.696 -6.894 3.470 1.00 1.22 C ATOM 2032 CE2 PHE A 139 4.598 -7.299 4.544 1.00 1.93 C ATOM 2033 CZ PHE A 139 5.936 -7.670 4.264 1.00 1.89 C ATOM 0 H PHE A 139 6.354 -3.850 3.444 1.00 0.34 H new ATOM 0 HA PHE A 139 4.745 -2.258 2.075 1.00 0.36 H new ATOM 0 HB2 PHE A 139 3.144 -4.491 2.202 1.00 0.55 H new ATOM 0 HB3 PHE A 139 4.585 -4.366 1.213 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.752 -5.263 2.096 1.00 0.61 H new ATOM 0 HD2 PHE A 139 3.011 -5.988 4.006 1.00 1.23 H new ATOM 0 HE1 PHE A 139 7.751 -7.103 3.372 1.00 1.22 H new ATOM 0 HE2 PHE A 139 4.021 -7.834 5.284 1.00 1.93 H new ATOM 0 HZ PHE A 139 6.346 -8.575 4.688 1.00 1.89 H new ATOM 2043 N THR A 140 3.205 -2.415 4.920 1.00 0.25 N ATOM 2044 CA THR A 140 2.207 -1.642 5.699 1.00 0.25 C ATOM 2045 C THR A 140 1.099 -1.030 4.849 1.00 0.22 C ATOM 2046 O THR A 140 1.292 -0.047 4.123 1.00 0.29 O ATOM 2047 CB THR A 140 2.882 -0.525 6.502 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.092 -1.017 7.069 1.00 0.48 O ATOM 2049 CG2 THR A 140 1.974 -0.025 7.614 1.00 0.60 C ATOM 0 H THR A 140 3.841 -2.958 5.504 1.00 0.25 H new ATOM 0 HA THR A 140 1.745 -2.370 6.366 1.00 0.25 H new ATOM 0 HB THR A 140 3.091 0.305 5.828 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.732 -1.213 6.354 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.479 0.767 8.167 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.052 0.364 7.183 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.740 -0.847 8.290 1.00 0.60 H new ATOM 2057 N SER A 141 -0.059 -1.607 4.991 1.00 0.19 N ATOM 2058 CA SER A 141 -1.173 -1.371 4.101 1.00 0.20 C ATOM 2059 C SER A 141 -2.027 -0.222 4.611 1.00 0.22 C ATOM 2060 O SER A 141 -1.936 0.113 5.772 1.00 0.39 O ATOM 2061 CB SER A 141 -1.984 -2.645 4.081 1.00 0.26 C ATOM 2062 OG SER A 141 -1.186 -3.748 4.473 1.00 0.62 O ATOM 0 H SER A 141 -0.265 -2.268 5.740 1.00 0.19 H new ATOM 0 HA SER A 141 -0.824 -1.104 3.103 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.838 -2.550 4.752 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.382 -2.814 3.080 1.00 0.26 H new ATOM 0 HG SER A 141 -1.097 -4.371 3.722 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.847 0.377 3.755 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.878 1.302 4.195 1.00 0.18 C ATOM 2070 C PHE A 142 -5.169 0.784 3.651 1.00 0.18 C ATOM 2071 O PHE A 142 -5.302 0.600 2.455 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.656 2.714 3.661 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.662 3.548 4.413 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -3.063 4.281 5.517 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.343 3.638 3.997 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -2.170 5.086 6.194 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.448 4.438 4.673 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.860 5.164 5.771 1.00 0.57 C ATOM 0 H PHE A 142 -2.815 0.235 2.745 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.868 1.364 5.283 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.330 2.643 2.623 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.613 3.236 3.660 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -4.088 4.222 5.853 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.014 3.076 3.135 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -2.496 5.654 7.053 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.578 4.497 4.342 1.00 0.55 H new ATOM 0 HZ PHE A 142 -0.158 5.792 6.298 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.122 0.527 4.492 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.364 0.050 3.982 1.00 0.16 C ATOM 2090 C LEU A 143 -8.141 1.218 3.461 1.00 0.15 C ATOM 2091 O LEU A 143 -8.663 2.044 4.203 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.136 -0.730 5.018 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.646 -0.772 4.794 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -10.006 -1.566 3.550 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.351 -1.335 6.006 1.00 0.43 C ATOM 0 H LEU A 143 -6.067 0.636 5.505 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.178 -0.650 3.168 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.757 -1.752 5.040 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.940 -0.297 5.999 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.983 0.253 4.641 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.089 -1.573 3.424 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.542 -1.106 2.678 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.646 -2.589 3.655 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.426 -1.356 5.825 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -9.995 -2.348 6.196 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.141 -0.708 6.873 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.148 1.278 2.163 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.785 2.319 1.428 1.00 0.14 C ATOM 2109 C ILE A 144 -10.195 1.865 1.120 1.00 0.15 C ATOM 2110 O ILE A 144 -10.407 0.691 0.836 1.00 0.19 O ATOM 2111 CB ILE A 144 -8.015 2.549 0.121 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.526 2.769 0.374 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.610 3.703 -0.642 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.212 3.963 1.214 1.00 0.19 C ATOM 0 H ILE A 144 -7.696 0.580 1.572 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.803 3.248 1.997 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.108 1.648 -0.485 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.117 1.882 0.858 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -6.018 2.871 -0.585 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.053 3.854 -1.567 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.652 3.485 -0.877 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.557 4.607 -0.035 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.133 4.043 1.343 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.587 4.862 0.724 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.687 3.857 2.189 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.157 2.763 1.169 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.550 2.320 1.091 1.00 0.15 C ATOM 2128 C ASP A 145 -13.070 2.377 -0.340 1.00 0.14 C ATOM 2129 O ASP A 145 -12.310 2.662 -1.262 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.447 3.123 2.048 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.268 4.202 1.363 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.697 5.261 1.034 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.479 4.013 1.175 1.00 0.75 O ATOM 0 H ASP A 145 -11.019 3.770 1.259 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.583 1.278 1.410 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -14.122 2.437 2.559 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.823 3.586 2.813 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.359 2.082 -0.518 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.980 2.071 -1.839 1.00 0.17 C ATOM 2140 C ARG A 146 -14.717 3.376 -2.573 1.00 0.18 C ATOM 2141 O ARG A 146 -14.452 3.387 -3.771 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.493 1.875 -1.729 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.917 0.694 -0.876 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.408 0.429 -1.010 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.202 1.642 -0.824 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.484 1.658 -0.458 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -21.124 0.524 -0.187 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -21.118 2.817 -0.353 1.00 2.22 N ATOM 0 H ARG A 146 -14.995 1.846 0.244 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.541 1.242 -2.394 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.934 2.782 -1.316 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.903 1.749 -2.731 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.359 -0.193 -1.175 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.672 0.889 0.168 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.614 0.009 -1.995 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.710 -0.318 -0.276 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.743 2.539 -0.985 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.634 -0.368 -0.258 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -22.105 0.546 0.092 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.625 3.688 -0.552 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -22.099 2.838 -0.074 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.770 4.480 -1.848 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.623 5.783 -2.467 1.00 0.21 C ATOM 2164 C ASP A 147 -13.183 6.261 -2.323 1.00 0.18 C ATOM 2165 O ASP A 147 -12.891 7.447 -2.431 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.598 6.782 -1.833 1.00 0.28 C ATOM 2167 CG ASP A 147 -15.694 8.084 -2.605 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -15.834 8.033 -3.844 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -15.667 9.166 -1.976 1.00 2.00 O ATOM 0 H ASP A 147 -14.913 4.500 -0.838 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.859 5.707 -3.529 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -16.587 6.328 -1.772 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.281 6.993 -0.812 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.279 5.314 -2.096 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.880 5.635 -1.947 1.00 0.16 C ATOM 2176 C GLY A 148 -10.551 6.401 -0.685 1.00 0.15 C ATOM 2177 O GLY A 148 -9.676 7.257 -0.700 1.00 0.17 O ATOM 0 H GLY A 148 -12.498 4.321 -2.013 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.303 4.710 -1.958 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.559 6.221 -2.808 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.227 6.121 0.413 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.868 6.767 1.662 1.00 0.18 C ATOM 2183 C VAL A 149 -10.150 5.807 2.607 1.00 0.17 C ATOM 2184 O VAL A 149 -10.749 4.873 3.139 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.089 7.382 2.376 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.679 8.045 3.684 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.785 8.382 1.471 1.00 1.12 C ATOM 0 H VAL A 149 -12.008 5.468 0.468 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.187 7.576 1.397 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.786 6.577 2.608 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.558 8.471 4.167 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.227 7.303 4.342 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -10.958 8.837 3.480 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.644 8.806 1.990 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.090 9.179 1.208 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.121 7.879 0.564 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.839 6.019 2.782 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.025 5.322 3.782 1.00 0.20 C ATOM 2199 C PRO A 150 -8.653 5.417 5.171 1.00 0.23 C ATOM 2200 O PRO A 150 -8.760 6.505 5.743 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.693 6.081 3.769 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.908 7.278 2.901 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.046 6.955 1.998 1.00 0.41 C ATOM 0 HA PRO A 150 -7.925 4.260 3.557 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.403 6.377 4.777 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.891 5.455 3.378 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.131 8.158 3.504 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.010 7.505 2.326 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.617 7.846 1.736 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.705 6.509 1.064 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.067 4.292 5.710 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.726 4.268 6.998 1.00 0.29 C ATOM 2213 C VAL A 151 -8.882 3.477 7.985 1.00 0.32 C ATOM 2214 O VAL A 151 -8.975 3.657 9.200 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.149 3.667 6.883 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -11.107 2.219 6.429 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.907 3.801 8.188 1.00 1.13 C ATOM 0 H VAL A 151 -8.958 3.376 5.274 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.831 5.291 7.360 1.00 0.29 H new ATOM 0 HB VAL A 151 -11.682 4.237 6.122 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -12.123 1.830 6.359 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -10.627 2.158 5.452 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -10.541 1.628 7.149 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.902 3.370 8.077 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -11.370 3.274 8.977 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -11.995 4.855 8.451 1.00 1.13 H new ATOM 2227 N GLU A 152 -8.028 2.625 7.444 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.156 1.791 8.259 1.00 0.20 C ATOM 2229 C GLU A 152 -5.774 1.737 7.662 1.00 0.20 C ATOM 2230 O GLU A 152 -5.548 2.190 6.548 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.675 0.359 8.351 1.00 0.21 C ATOM 2232 CG GLU A 152 -9.158 0.262 8.586 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.565 0.621 10.003 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.708 0.526 10.907 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -10.738 1.009 10.216 1.00 1.17 O ATOM 0 H GLU A 152 -7.918 2.491 6.439 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.132 2.237 9.253 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.428 -0.167 7.429 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -7.155 -0.154 9.159 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.673 0.923 7.889 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.488 -0.753 8.367 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.853 1.231 8.439 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.595 0.746 7.918 1.00 0.24 C ATOM 2244 C ARG A 153 -3.141 -0.458 8.724 1.00 0.25 C ATOM 2245 O ARG A 153 -3.388 -0.543 9.930 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.530 1.842 7.880 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.189 1.450 8.489 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.322 2.675 8.728 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.084 3.831 9.241 1.00 0.65 N ATOM 2250 CZ ARG A 153 -1.953 3.805 10.265 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.147 2.702 10.981 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -2.618 4.904 10.582 1.00 1.85 N ATOM 0 H ARG A 153 -4.950 1.142 9.450 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.745 0.436 6.884 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.370 2.138 6.843 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.910 2.717 8.406 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.352 0.926 9.431 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.672 0.758 7.824 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.466 2.423 9.438 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.167 2.955 7.795 1.00 0.47 H new ATOM 0 HE ARG A 153 -0.938 4.728 8.777 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -1.631 1.851 10.757 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -2.812 2.706 11.754 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.469 5.762 10.050 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.280 4.894 11.358 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.487 -1.385 8.054 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.125 -2.656 8.646 1.00 0.22 C ATOM 2268 C PHE A 154 -0.623 -2.836 8.575 1.00 0.24 C ATOM 2269 O PHE A 154 -0.003 -2.475 7.585 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.814 -3.801 7.897 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.318 -3.771 7.952 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -5.041 -3.020 7.039 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -5.010 -4.518 8.896 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.421 -3.009 7.067 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.394 -4.511 8.926 1.00 0.22 C ATOM 2276 CZ PHE A 154 -7.097 -3.755 8.010 1.00 0.22 C ATOM 0 H PHE A 154 -2.192 -1.278 7.084 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.447 -2.669 9.687 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.501 -3.775 6.853 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.467 -4.748 8.310 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.518 -2.436 6.296 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.463 -5.111 9.614 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.971 -2.417 6.351 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.922 -5.096 9.664 1.00 0.22 H new ATOM 0 HZ PHE A 154 -8.177 -3.747 8.032 1.00 0.22 H new ATOM 2286 N SER A 155 -0.047 -3.381 9.624 1.00 0.22 N ATOM 2287 CA SER A 155 1.385 -3.628 9.666 1.00 0.25 C ATOM 2288 C SER A 155 1.752 -4.723 8.666 1.00 0.22 C ATOM 2289 O SER A 155 0.893 -5.496 8.256 1.00 0.26 O ATOM 2290 CB SER A 155 1.778 -4.042 11.083 1.00 0.35 C ATOM 2291 OG SER A 155 1.188 -3.172 12.036 1.00 1.11 O ATOM 0 H SER A 155 -0.548 -3.664 10.466 1.00 0.22 H new ATOM 0 HA SER A 155 1.926 -2.721 9.395 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.458 -5.067 11.271 1.00 0.35 H new ATOM 0 HB3 SER A 155 2.863 -4.022 11.186 1.00 0.35 H new ATOM 0 HG SER A 155 1.448 -3.451 12.939 1.00 1.11 H new ATOM 2297 N PRO A 156 3.017 -4.798 8.236 1.00 0.25 N ATOM 2298 CA PRO A 156 3.484 -5.887 7.377 1.00 0.29 C ATOM 2299 C PRO A 156 3.291 -7.231 8.063 1.00 0.39 C ATOM 2300 O PRO A 156 3.063 -8.250 7.420 1.00 0.78 O ATOM 2301 CB PRO A 156 4.975 -5.588 7.182 1.00 0.34 C ATOM 2302 CG PRO A 156 5.328 -4.627 8.261 1.00 0.36 C ATOM 2303 CD PRO A 156 4.081 -3.840 8.538 1.00 0.33 C ATOM 0 HA PRO A 156 2.939 -5.945 6.435 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.571 -6.498 7.255 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.165 -5.161 6.197 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.665 -5.151 9.155 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.142 -3.972 7.949 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.038 -3.502 9.573 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.016 -2.952 7.909 1.00 0.33 H new ATOM 2311 N GLY A 157 3.415 -7.198 9.381 1.00 0.36 N ATOM 2312 CA GLY A 157 3.130 -8.343 10.215 1.00 0.46 C ATOM 2313 C GLY A 157 1.646 -8.649 10.348 1.00 0.41 C ATOM 2314 O GLY A 157 1.272 -9.592 11.047 1.00 0.50 O ATOM 0 H GLY A 157 3.717 -6.372 9.898 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.636 -9.216 9.803 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.547 -8.171 11.207 1.00 0.46 H new ATOM 2318 N ALA A 158 0.795 -7.858 9.705 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.626 -8.166 9.660 1.00 0.31 C ATOM 2320 C ALA A 158 -0.886 -9.110 8.501 1.00 0.34 C ATOM 2321 O ALA A 158 -0.221 -9.031 7.467 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.464 -6.901 9.524 1.00 0.37 C ATOM 0 H ALA A 158 1.063 -7.006 9.212 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.917 -8.644 10.596 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.521 -7.166 9.493 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.278 -6.248 10.377 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.193 -6.382 8.604 1.00 0.37 H new ATOM 2328 N SER A 159 -1.840 -10.002 8.668 1.00 0.26 N ATOM 2329 CA SER A 159 -2.069 -11.028 7.692 1.00 0.30 C ATOM 2330 C SER A 159 -3.383 -10.784 6.971 1.00 0.23 C ATOM 2331 O SER A 159 -4.081 -9.801 7.234 1.00 0.22 O ATOM 2332 CB SER A 159 -2.072 -12.401 8.370 1.00 0.41 C ATOM 2333 OG SER A 159 -1.806 -13.440 7.441 1.00 1.42 O ATOM 0 H SER A 159 -2.466 -10.031 9.473 1.00 0.26 H new ATOM 0 HA SER A 159 -1.266 -11.004 6.956 1.00 0.30 H new ATOM 0 HB2 SER A 159 -1.323 -12.419 9.162 1.00 0.41 H new ATOM 0 HB3 SER A 159 -3.039 -12.573 8.842 1.00 0.41 H new ATOM 0 HG SER A 159 -1.813 -14.303 7.905 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.691 -11.694 6.068 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.889 -11.648 5.244 1.00 0.20 C ATOM 2341 C VAL A 160 -6.133 -11.316 6.069 1.00 0.21 C ATOM 2342 O VAL A 160 -6.789 -10.314 5.812 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.079 -13.020 4.582 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.297 -13.043 3.679 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.835 -13.418 3.806 1.00 0.26 C ATOM 0 H VAL A 160 -3.103 -12.506 5.880 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.763 -10.864 4.497 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.243 -13.747 5.378 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.398 -14.031 3.229 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.188 -12.819 4.265 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.182 -12.296 2.893 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.990 -14.393 3.345 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.637 -12.677 3.031 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.984 -13.469 4.485 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.414 -12.127 7.092 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.659 -12.008 7.851 1.00 0.31 C ATOM 2357 C LYS A 161 -7.737 -10.672 8.562 1.00 0.26 C ATOM 2358 O LYS A 161 -8.804 -10.056 8.627 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.789 -13.132 8.885 1.00 0.45 C ATOM 2360 CG LYS A 161 -8.956 -12.923 9.837 1.00 1.12 C ATOM 2361 CD LYS A 161 -8.949 -13.914 10.986 1.00 1.80 C ATOM 2362 CE LYS A 161 -9.954 -13.514 12.056 1.00 2.67 C ATOM 2363 NZ LYS A 161 -9.596 -12.217 12.702 1.00 3.46 N ATOM 0 H LYS A 161 -5.796 -12.872 7.413 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.478 -12.085 7.135 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.914 -14.083 8.368 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.865 -13.200 9.459 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -8.920 -11.909 10.235 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -9.892 -13.016 9.286 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -9.186 -14.910 10.613 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -7.951 -13.966 11.421 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -10.946 -13.436 11.611 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -10.006 -14.295 12.815 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -10.118 -12.119 13.596 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -8.574 -12.195 12.893 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -9.847 -11.432 12.067 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.599 -10.224 9.075 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.534 -8.982 9.825 1.00 0.27 C ATOM 2379 C ASP A 162 -7.048 -7.857 8.963 1.00 0.22 C ATOM 2380 O ASP A 162 -7.820 -7.007 9.400 1.00 0.26 O ATOM 2381 CB ASP A 162 -5.095 -8.677 10.237 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.528 -9.684 11.209 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -5.124 -9.870 12.293 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.492 -10.304 10.891 1.00 1.40 O ATOM 0 H ASP A 162 -5.705 -10.707 8.983 1.00 0.26 H new ATOM 0 HA ASP A 162 -7.144 -9.081 10.723 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.467 -8.648 9.346 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -5.055 -7.685 10.687 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.616 -7.888 7.722 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.997 -6.903 6.745 1.00 0.15 C ATOM 2391 C ILE A 163 -8.419 -7.136 6.262 1.00 0.14 C ATOM 2392 O ILE A 163 -9.217 -6.203 6.221 1.00 0.15 O ATOM 2393 CB ILE A 163 -6.025 -6.940 5.558 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.639 -6.464 6.015 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.553 -6.096 4.403 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.540 -6.774 5.034 1.00 0.21 C ATOM 0 H ILE A 163 -5.985 -8.605 7.364 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.954 -5.920 7.215 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.936 -7.964 5.196 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.671 -5.388 6.183 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.402 -6.929 6.972 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.849 -6.136 3.572 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.519 -6.485 4.080 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.669 -5.063 4.731 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.590 -6.408 5.424 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.480 -7.852 4.884 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.753 -6.286 4.083 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.734 -8.383 5.924 1.00 0.13 N ATOM 2409 CA GLU A 164 -10.043 -8.723 5.383 1.00 0.13 C ATOM 2410 C GLU A 164 -11.150 -8.273 6.313 1.00 0.15 C ATOM 2411 O GLU A 164 -12.158 -7.745 5.881 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.216 -10.228 5.204 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.256 -10.880 4.247 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.461 -12.374 4.176 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -9.417 -13.033 5.227 1.00 0.67 O ATOM 2416 OE2 GLU A 164 -9.665 -12.905 3.067 1.00 0.60 O ATOM 0 H GLU A 164 -8.098 -9.175 6.016 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.103 -8.217 4.419 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -10.113 -10.707 6.178 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.232 -10.421 4.860 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.383 -10.448 3.254 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.233 -10.668 4.558 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.964 -8.504 7.593 1.00 0.18 N ATOM 2424 CA GLU A 165 -12.007 -8.237 8.569 1.00 0.21 C ATOM 2425 C GLU A 165 -12.350 -6.750 8.636 1.00 0.21 C ATOM 2426 O GLU A 165 -13.394 -6.369 9.166 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.602 -8.777 9.939 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.570 -7.951 10.685 1.00 0.47 C ATOM 2429 CD GLU A 165 -10.223 -8.573 12.022 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -9.295 -9.411 12.069 1.00 0.83 O ATOM 2431 OE2 GLU A 165 -10.855 -8.214 13.038 1.00 0.87 O ATOM 0 H GLU A 165 -10.100 -8.877 7.987 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.910 -8.756 8.248 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.496 -8.856 10.558 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.212 -9.787 9.812 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.668 -7.860 10.080 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -10.953 -6.942 10.840 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.475 -5.916 8.093 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.764 -4.500 7.960 1.00 0.20 C ATOM 2440 C LYS A 166 -12.103 -4.171 6.507 1.00 0.19 C ATOM 2441 O LYS A 166 -12.773 -3.183 6.212 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.579 -3.662 8.450 1.00 0.25 C ATOM 2443 CG LYS A 166 -10.145 -3.992 9.874 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.246 -3.698 10.883 1.00 0.58 C ATOM 2445 CE LYS A 166 -11.467 -2.202 11.058 1.00 1.09 C ATOM 2446 NZ LYS A 166 -12.584 -1.911 11.995 1.00 1.71 N ATOM 0 H LYS A 166 -10.561 -6.197 7.739 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.627 -4.255 8.580 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.735 -3.814 7.777 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.844 -2.606 8.395 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.868 -5.044 9.935 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.257 -3.413 10.127 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -12.174 -4.167 10.555 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -10.986 -4.142 11.844 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -10.552 -1.741 11.430 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -11.680 -1.751 10.089 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -12.701 -0.882 12.086 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -13.463 -2.328 11.628 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -12.370 -2.319 12.927 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.659 -5.044 5.618 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.808 -4.875 4.178 1.00 0.15 C ATOM 2462 C LEU A 167 -13.161 -5.377 3.672 1.00 0.15 C ATOM 2463 O LEU A 167 -13.853 -4.691 2.922 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.700 -5.655 3.478 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.953 -5.946 2.006 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.782 -4.685 1.181 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.041 -7.054 1.511 1.00 0.16 C ATOM 0 H LEU A 167 -11.177 -5.904 5.878 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.746 -3.809 3.957 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.769 -5.095 3.568 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.555 -6.601 4.001 1.00 0.13 H new ATOM 0 HG LEU A 167 -11.982 -6.288 1.892 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -10.966 -4.910 0.130 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.491 -3.929 1.520 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.766 -4.308 1.299 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.240 -7.245 0.456 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.001 -6.752 1.636 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.227 -7.962 2.085 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.508 -6.592 4.071 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.710 -7.272 3.603 1.00 0.19 C ATOM 2481 C ILE A 168 -15.980 -6.470 3.885 1.00 0.22 C ATOM 2482 O ILE A 168 -16.839 -6.387 3.022 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.833 -8.684 4.213 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.578 -9.510 3.905 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.075 -9.386 3.680 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.586 -10.882 4.546 1.00 0.24 C ATOM 0 H ILE A 168 -12.959 -7.139 4.734 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.606 -7.363 2.522 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.927 -8.587 5.295 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.483 -9.623 2.825 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.699 -8.963 4.247 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.148 -10.381 4.120 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.961 -8.808 3.943 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.007 -9.473 2.596 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.669 -11.410 4.286 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.650 -10.777 5.629 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.445 -11.447 4.185 1.00 0.24 H new ATOM 2498 N PRO A 169 -16.144 -5.875 5.084 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.263 -4.965 5.351 1.00 0.29 C ATOM 2500 C PRO A 169 -17.365 -3.828 4.329 1.00 0.29 C ATOM 2501 O PRO A 169 -18.418 -3.211 4.181 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.963 -4.395 6.738 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.572 -4.821 7.068 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.319 -6.072 6.285 1.00 0.24 C ATOM 0 HA PRO A 169 -18.215 -5.492 5.289 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -17.049 -3.308 6.740 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.671 -4.772 7.476 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -14.854 -4.045 6.803 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -15.464 -5.003 8.137 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.264 -6.188 6.037 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.616 -6.963 6.838 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.269 -3.544 3.633 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.270 -2.523 2.598 1.00 0.22 C ATOM 2514 C LEU A 170 -16.474 -3.138 1.216 1.00 0.20 C ATOM 2515 O LEU A 170 -17.225 -2.593 0.404 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.982 -1.699 2.631 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.781 -0.814 3.852 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.388 -0.209 3.817 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.839 0.277 3.887 1.00 0.69 C ATOM 0 H LEU A 170 -15.371 -4.008 3.769 1.00 0.22 H new ATOM 0 HA LEU A 170 -17.107 -1.855 2.801 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.136 -2.383 2.561 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.956 -1.068 1.743 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.881 -1.415 4.756 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.245 0.425 4.692 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.645 -1.006 3.821 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.274 0.389 2.913 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.686 0.904 4.765 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.762 0.887 2.987 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.829 -0.177 3.934 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.798 -4.253 0.937 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.029 -4.985 -0.310 1.00 0.20 C ATOM 2533 C LEU A 171 -17.466 -5.416 -0.357 1.00 0.27 C ATOM 2534 O LEU A 171 -18.221 -5.068 -1.264 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.163 -6.231 -0.400 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.682 -5.964 -0.430 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -12.915 -7.266 -0.401 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.312 -5.159 -1.663 1.00 0.31 C ATOM 0 H LEU A 171 -15.094 -4.666 1.549 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.778 -4.324 -1.139 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.386 -6.875 0.451 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.437 -6.784 -1.298 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.416 -5.383 0.453 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.845 -7.059 -0.423 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.160 -7.812 0.510 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.186 -7.867 -1.269 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.238 -4.975 -1.669 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.589 -5.716 -2.558 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.843 -4.207 -1.649 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.836 -6.149 0.670 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.176 -6.616 0.785 1.00 0.39 C ATOM 2552 C GLY A 172 -19.976 -5.711 1.685 1.00 0.66 C ATOM 2553 O GLY A 172 -20.568 -6.151 2.674 1.00 1.12 O ATOM 0 H GLY A 172 -17.218 -6.428 1.432 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.638 -6.658 -0.201 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.181 -7.631 1.183 1.00 0.39 H new ATOM 2557 N SER A 173 -19.949 -4.434 1.347 1.00 0.85 N ATOM 2558 CA SER A 173 -20.618 -3.398 2.114 1.00 1.33 C ATOM 2559 C SER A 173 -22.138 -3.454 1.966 1.00 1.84 C ATOM 2560 O SER A 173 -22.752 -2.576 1.356 1.00 2.43 O ATOM 2561 CB SER A 173 -20.089 -2.027 1.692 1.00 2.03 C ATOM 2562 OG SER A 173 -19.912 -1.966 0.283 1.00 2.64 O ATOM 0 H SER A 173 -19.458 -4.084 0.525 1.00 0.85 H new ATOM 0 HA SER A 173 -20.398 -3.570 3.168 1.00 1.33 H new ATOM 0 HB2 SER A 173 -20.785 -1.250 2.010 1.00 2.03 H new ATOM 0 HB3 SER A 173 -19.140 -1.829 2.191 1.00 2.03 H new ATOM 0 HG SER A 173 -19.010 -2.271 0.053 1.00 2.64 H new ATOM 2568 N ALA A 174 -22.734 -4.500 2.519 1.00 2.40 N ATOM 2569 CA ALA A 174 -24.175 -4.562 2.669 1.00 3.35 C ATOM 2570 C ALA A 174 -24.575 -3.677 3.843 1.00 3.69 C ATOM 2571 O ALA A 174 -25.712 -3.221 3.933 1.00 4.35 O ATOM 2572 CB ALA A 174 -24.629 -6.000 2.877 1.00 4.30 C ATOM 0 H ALA A 174 -22.238 -5.318 2.871 1.00 2.40 H new ATOM 0 HA ALA A 174 -24.663 -4.200 1.764 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -25.713 -6.027 2.988 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -24.337 -6.602 2.016 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -24.162 -6.402 3.776 1.00 4.30 H new ATOM 2578 N ARG A 175 -23.605 -3.452 4.734 1.00 3.66 N ATOM 2579 CA ARG A 175 -23.689 -2.431 5.778 1.00 4.44 C ATOM 2580 C ARG A 175 -24.959 -2.559 6.618 1.00 4.81 C ATOM 2581 O ARG A 175 -25.790 -1.646 6.650 1.00 5.15 O ATOM 2582 CB ARG A 175 -23.611 -1.039 5.141 1.00 5.16 C ATOM 2583 CG ARG A 175 -22.882 -0.008 5.991 1.00 5.82 C ATOM 2584 CD ARG A 175 -21.435 -0.414 6.224 1.00 6.62 C ATOM 2585 NE ARG A 175 -20.627 0.679 6.767 1.00 7.03 N ATOM 2586 CZ ARG A 175 -19.349 0.550 7.119 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -18.754 -0.638 7.084 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -18.669 1.609 7.534 1.00 8.45 N ATOM 0 H ARG A 175 -22.732 -3.979 4.750 1.00 3.66 H new ATOM 0 HA ARG A 175 -22.846 -2.578 6.454 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -23.109 -1.120 4.177 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -24.623 -0.683 4.945 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -22.915 0.963 5.498 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -23.390 0.103 6.949 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -21.404 -1.260 6.911 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -21.000 -0.751 5.283 1.00 6.62 H new ATOM 0 HE ARG A 175 -21.068 1.592 6.882 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -19.277 -1.462 6.786 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -17.775 -0.726 7.356 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -19.124 2.520 7.583 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -17.690 1.513 7.804 1.00 8.45 H new ATOM 2602 N LEU A 176 -25.104 -3.689 7.297 1.00 5.22 N ATOM 2603 CA LEU A 176 -26.233 -3.892 8.195 1.00 6.05 C ATOM 2604 C LEU A 176 -25.911 -3.301 9.561 1.00 6.72 C ATOM 2605 O LEU A 176 -26.156 -2.093 9.761 1.00 7.14 O ATOM 2606 CB LEU A 176 -26.583 -5.383 8.340 1.00 6.60 C ATOM 2607 CG LEU A 176 -27.228 -6.045 7.116 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -26.218 -6.236 5.996 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -27.846 -7.380 7.505 1.00 7.60 C ATOM 2610 OXT LEU A 176 -25.392 -4.039 10.425 1.00 7.13 O ATOM 0 H LEU A 176 -24.457 -4.476 7.244 1.00 5.22 H new ATOM 0 HA LEU A 176 -27.099 -3.388 7.767 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -25.671 -5.928 8.584 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -27.259 -5.496 9.188 1.00 6.60 H new ATOM 0 HG LEU A 176 -28.013 -5.384 6.749 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -26.706 -6.707 5.143 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -25.819 -5.267 5.696 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -25.404 -6.871 6.345 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -28.301 -7.840 6.628 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -27.072 -8.038 7.900 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -28.609 -7.220 8.267 1.00 7.60 H new TER 2622 LEU A 176