USER MOD reduce.3.24.130724 H: found=0, std=0, add=1361, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1362 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 109 HIS : no HD1:sc= -1.08 K(o=-1.4,f=-3.3) USER MOD Set 1.2: A 147 SER OG : rot -150:sc= -0.297 USER MOD Set 2.1: A 123 HIS : no HE2:sc= -0.23 X(o=0.5,f=0.14) USER MOD Set 2.2: A 124 SER OG : rot 13:sc= 0.726 USER MOD Set 3.1: A 83 TYR OH : rot 89:sc= -1.23 USER MOD Set 3.2: A 174 LYS NZ :NH3+ -126:sc= -0.566 (180deg=-2.7!) USER MOD Set 4.1: A 73 TYR OH : rot 35:sc= 1.17 USER MOD Set 4.2: A 168 CYS SG : rot 79:sc= 2.07 USER MOD Set 5.1: A 20 SER OG : rot -60:sc= 1.02 USER MOD Set 5.2: A 28 HIS : no HD1:sc= -0.666 K(o=0.36,f=-8.5!) USER MOD Single : A 9 LYS NZ :NH3+ 170:sc= -0.0434 (180deg=-0.215) USER MOD Single : A 15 ASN : amide:sc= 1.29 K(o=1.3,f=-3.8!) USER MOD Single : A 21 HIS : no HE2:sc= -6.6! C(o=-6.6!,f=-4.6!) USER MOD Single : A 25 HIS : no HD1:sc= -0.219 X(o=-0.22,f=0.031) USER MOD Single : A 29 TYR OH : rot 152:sc= 2.21 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot 71:sc= -1.59! USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 53:sc= 0.26 USER MOD Single : A 54 ASN : amide:sc= 0.125 K(o=0.13,f=-2.6!) USER MOD Single : A 58 GLN : amide:sc=-0.00298 K(o=-0.003,f=0.93) USER MOD Single : A 61 TYR OH : rot 67:sc= 0.914 USER MOD Single : A 62 GLN : amide:sc= -0.458 K(o=-0.46,f=-3.1) USER MOD Single : A 63 THR OG1 : rot 82:sc= 0.651 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.0577 X(o=-0.058,f=-0.0062) USER MOD Single : A 70 SER OG : rot 67:sc= 0.944 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 134:sc= 1.04 (180deg=-0.571) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -3.39! K(o=-3.4!,f=-1) USER MOD Single : A 97 SER OG : rot 180:sc= 0.0104 USER MOD Single : A 98 GLN : amide:sc= -0.295 K(o=-0.3,f=-0.91) USER MOD Single : A 99 GLN : amide:sc= -0.323 X(o=-0.32,f=-0.19) USER MOD Single : A 100 LYS NZ :NH3+ -141:sc= 0.554 (180deg=-0.384!) USER MOD Single : A 107 ASN : amide:sc= -0.156 K(o=-0.16,f=-1) USER MOD Single : A 110 THR OG1 : rot 51:sc= 0.0181 USER MOD Single : A 113 LYS NZ :NH3+ -166:sc= 1.32 (180deg=1.18) USER MOD Single : A 125 THR OG1 : rot 11:sc= 1.01 USER MOD Single : A 127 HIS : no HD1:sc= -1.63! C(o=-1.6!,f=-5.1!) USER MOD Single : A 134 SER OG : rot -39:sc= 0.291 USER MOD Single : A 136 LYS NZ :NH3+ -106:sc= -0.0879 (180deg=-1.63) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 17:sc= 0.987 USER MOD Single : A 143 GLN : amide:sc= -0.879 X(o=-0.88,f=-0.41) USER MOD Single : A 148 THR OG1 : rot 20:sc= 0.494 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ -176:sc= 1.25 (180deg=1.09) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 ASN : amide:sc= -5.5! C(o=-5.5!,f=-11!) USER MOD Single : A 166 LYS NZ :NH3+ 174:sc= 2.19 (180deg=1.8) USER MOD Single : A 173 MET CE :methyl -163:sc= -1.43 (180deg=-3.97!) USER MOD Single : A 176 THR OG1 : rot 180:sc= -0.24 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 5 -11.888 14.509 1.480 1.00 1.48 N ATOM 2 CA GLY A 5 -12.178 13.895 2.760 1.00 1.01 C ATOM 3 C GLY A 5 -11.505 12.550 2.920 1.00 0.78 C ATOM 4 O GLY A 5 -12.159 11.549 3.211 1.00 0.75 O ATOM 0 HA2 GLY A 5 -11.852 14.559 3.561 1.00 1.01 H new ATOM 0 HA3 GLY A 5 -13.256 13.774 2.866 1.00 1.01 H new ATOM 8 N LEU A 6 -10.190 12.534 2.744 1.00 0.72 N ATOM 9 CA LEU A 6 -9.408 11.313 2.839 1.00 0.55 C ATOM 10 C LEU A 6 -9.575 10.673 4.216 1.00 0.42 C ATOM 11 O LEU A 6 -9.819 9.471 4.333 1.00 0.36 O ATOM 12 CB LEU A 6 -7.937 11.637 2.589 1.00 0.53 C ATOM 13 CG LEU A 6 -7.036 10.430 2.340 1.00 0.44 C ATOM 14 CD1 LEU A 6 -7.369 9.801 1.004 1.00 0.52 C ATOM 15 CD2 LEU A 6 -5.570 10.823 2.396 1.00 0.47 C ATOM 0 H LEU A 6 -9.639 13.366 2.532 1.00 0.72 H new ATOM 0 HA LEU A 6 -9.761 10.606 2.088 1.00 0.55 H new ATOM 0 HB2 LEU A 6 -7.870 12.303 1.729 1.00 0.53 H new ATOM 0 HB3 LEU A 6 -7.552 12.186 3.448 1.00 0.53 H new ATOM 0 HG LEU A 6 -7.215 9.698 3.128 1.00 0.44 H new ATOM 0 HD11 LEU A 6 -6.721 8.941 0.835 1.00 0.52 H new ATOM 0 HD12 LEU A 6 -8.410 9.477 1.004 1.00 0.52 H new ATOM 0 HD13 LEU A 6 -7.216 10.532 0.210 1.00 0.52 H new ATOM 0 HD21 LEU A 6 -4.951 9.944 2.215 1.00 0.47 H new ATOM 0 HD22 LEU A 6 -5.365 11.574 1.633 1.00 0.47 H new ATOM 0 HD23 LEU A 6 -5.340 11.233 3.380 1.00 0.47 H new ATOM 27 N ALA A 7 -9.461 11.500 5.253 1.00 0.44 N ATOM 28 CA ALA A 7 -9.600 11.049 6.634 1.00 0.41 C ATOM 29 C ALA A 7 -10.997 10.507 6.915 1.00 0.39 C ATOM 30 O ALA A 7 -11.190 9.714 7.836 1.00 0.44 O ATOM 31 CB ALA A 7 -9.296 12.192 7.589 1.00 0.53 C ATOM 0 H ALA A 7 -9.270 12.498 5.159 1.00 0.44 H new ATOM 0 HA ALA A 7 -8.887 10.239 6.788 1.00 0.41 H new ATOM 0 HB1 ALA A 7 -9.402 11.845 8.617 1.00 0.53 H new ATOM 0 HB2 ALA A 7 -8.276 12.540 7.427 1.00 0.53 H new ATOM 0 HB3 ALA A 7 -9.992 13.012 7.409 1.00 0.53 H new ATOM 37 N ASP A 8 -11.966 10.944 6.124 1.00 0.41 N ATOM 38 CA ASP A 8 -13.351 10.540 6.323 1.00 0.48 C ATOM 39 C ASP A 8 -13.626 9.196 5.658 1.00 0.44 C ATOM 40 O ASP A 8 -14.252 8.316 6.251 1.00 0.60 O ATOM 41 CB ASP A 8 -14.302 11.606 5.762 1.00 0.61 C ATOM 42 CG ASP A 8 -15.767 11.253 5.955 1.00 1.30 C ATOM 43 OD1 ASP A 8 -16.315 11.544 7.038 1.00 1.44 O ATOM 44 OD2 ASP A 8 -16.384 10.703 5.019 1.00 2.18 O ATOM 0 H ASP A 8 -11.819 11.578 5.339 1.00 0.41 H new ATOM 0 HA ASP A 8 -13.523 10.437 7.394 1.00 0.48 H new ATOM 0 HB2 ASP A 8 -14.097 12.560 6.247 1.00 0.61 H new ATOM 0 HB3 ASP A 8 -14.103 11.740 4.699 1.00 0.61 H new ATOM 49 N LYS A 9 -13.133 9.032 4.438 1.00 0.33 N ATOM 50 CA LYS A 9 -13.467 7.861 3.636 1.00 0.34 C ATOM 51 C LYS A 9 -12.535 6.686 3.904 1.00 0.29 C ATOM 52 O LYS A 9 -12.788 5.580 3.428 1.00 0.36 O ATOM 53 CB LYS A 9 -13.436 8.204 2.149 1.00 0.44 C ATOM 54 CG LYS A 9 -14.212 9.459 1.791 1.00 0.65 C ATOM 55 CD LYS A 9 -15.707 9.270 1.990 1.00 0.86 C ATOM 56 CE LYS A 9 -16.480 10.546 1.693 1.00 1.24 C ATOM 57 NZ LYS A 9 -16.227 11.054 0.319 1.00 1.79 N ATOM 0 H LYS A 9 -12.503 9.692 3.982 1.00 0.33 H new ATOM 0 HA LYS A 9 -14.474 7.561 3.926 1.00 0.34 H new ATOM 0 HB2 LYS A 9 -12.399 8.328 1.836 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -13.841 7.365 1.584 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -13.865 10.290 2.406 1.00 0.65 H new ATOM 0 HG3 LYS A 9 -14.014 9.726 0.753 1.00 0.65 H new ATOM 0 HD2 LYS A 9 -16.062 8.470 1.341 1.00 0.86 H new ATOM 0 HD3 LYS A 9 -15.901 8.958 3.016 1.00 0.86 H new ATOM 0 HE2 LYS A 9 -17.547 10.359 1.818 1.00 1.24 H new ATOM 0 HE3 LYS A 9 -16.204 11.312 2.417 1.00 1.24 H new ATOM 0 HZ1 LYS A 9 -16.897 11.820 0.103 1.00 1.79 H new ATOM 0 HZ2 LYS A 9 -15.254 11.417 0.257 1.00 1.79 H new ATOM 0 HZ3 LYS A 9 -16.353 10.281 -0.366 1.00 1.79 H new ATOM 71 N VAL A 10 -11.445 6.917 4.626 1.00 0.26 N ATOM 72 CA VAL A 10 -10.551 5.827 4.994 1.00 0.24 C ATOM 73 C VAL A 10 -11.296 4.742 5.766 1.00 0.23 C ATOM 74 O VAL A 10 -12.111 5.027 6.649 1.00 0.30 O ATOM 75 CB VAL A 10 -9.357 6.315 5.834 1.00 0.28 C ATOM 76 CG1 VAL A 10 -9.808 6.903 7.164 1.00 0.33 C ATOM 77 CG2 VAL A 10 -8.360 5.183 6.054 1.00 0.28 C ATOM 0 H VAL A 10 -11.162 7.837 4.964 1.00 0.26 H new ATOM 0 HA VAL A 10 -10.170 5.413 4.060 1.00 0.24 H new ATOM 0 HB VAL A 10 -8.863 7.111 5.276 1.00 0.28 H new ATOM 0 HG11 VAL A 10 -8.937 7.236 7.728 1.00 0.33 H new ATOM 0 HG12 VAL A 10 -10.469 7.751 6.982 1.00 0.33 H new ATOM 0 HG13 VAL A 10 -10.342 6.143 7.735 1.00 0.33 H new ATOM 0 HG21 VAL A 10 -7.523 5.546 6.650 1.00 0.28 H new ATOM 0 HG22 VAL A 10 -8.850 4.363 6.579 1.00 0.28 H new ATOM 0 HG23 VAL A 10 -7.993 4.829 5.091 1.00 0.28 H new ATOM 87 N ILE A 11 -11.034 3.497 5.410 1.00 0.24 N ATOM 88 CA ILE A 11 -11.634 2.377 6.113 1.00 0.29 C ATOM 89 C ILE A 11 -10.566 1.496 6.736 1.00 0.26 C ATOM 90 O ILE A 11 -10.800 0.847 7.755 1.00 0.28 O ATOM 91 CB ILE A 11 -12.503 1.513 5.177 1.00 0.38 C ATOM 92 CG1 ILE A 11 -11.673 1.010 3.996 1.00 0.53 C ATOM 93 CG2 ILE A 11 -13.708 2.300 4.689 1.00 0.92 C ATOM 94 CD1 ILE A 11 -12.378 -0.020 3.148 1.00 0.62 C ATOM 0 H ILE A 11 -10.414 3.237 4.643 1.00 0.24 H new ATOM 0 HA ILE A 11 -12.267 2.800 6.893 1.00 0.29 H new ATOM 0 HB ILE A 11 -12.864 0.651 5.737 1.00 0.38 H new ATOM 0 HG12 ILE A 11 -11.401 1.859 3.368 1.00 0.53 H new ATOM 0 HG13 ILE A 11 -10.744 0.582 4.373 1.00 0.53 H new ATOM 0 HG21 ILE A 11 -14.309 1.674 4.030 1.00 0.92 H new ATOM 0 HG22 ILE A 11 -14.310 2.610 5.543 1.00 0.92 H new ATOM 0 HG23 ILE A 11 -13.370 3.181 4.144 1.00 0.92 H new ATOM 0 HD11 ILE A 11 -11.725 -0.327 2.331 1.00 0.62 H new ATOM 0 HD12 ILE A 11 -12.626 -0.887 3.760 1.00 0.62 H new ATOM 0 HD13 ILE A 11 -13.293 0.409 2.739 1.00 0.62 H new ATOM 106 N TRP A 12 -9.388 1.486 6.123 1.00 0.23 N ATOM 107 CA TRP A 12 -8.353 0.543 6.499 1.00 0.21 C ATOM 108 C TRP A 12 -7.015 0.965 5.885 1.00 0.21 C ATOM 109 O TRP A 12 -6.896 1.092 4.675 1.00 0.25 O ATOM 110 CB TRP A 12 -8.786 -0.842 5.999 1.00 0.23 C ATOM 111 CG TRP A 12 -7.904 -1.987 6.389 1.00 0.25 C ATOM 112 CD1 TRP A 12 -8.102 -2.867 7.414 1.00 0.31 C ATOM 113 CD2 TRP A 12 -6.705 -2.398 5.734 1.00 0.26 C ATOM 114 NE1 TRP A 12 -7.098 -3.805 7.428 1.00 0.33 N ATOM 115 CE2 TRP A 12 -6.226 -3.533 6.408 1.00 0.29 C ATOM 116 CE3 TRP A 12 -5.989 -1.909 4.642 1.00 0.30 C ATOM 117 CZ2 TRP A 12 -5.066 -4.192 6.016 1.00 0.33 C ATOM 118 CZ3 TRP A 12 -4.839 -2.557 4.259 1.00 0.36 C ATOM 119 CH2 TRP A 12 -4.386 -3.684 4.941 1.00 0.36 C ATOM 0 H TRP A 12 -9.131 2.120 5.366 1.00 0.23 H new ATOM 0 HA TRP A 12 -8.219 0.517 7.580 1.00 0.21 H new ATOM 0 HB2 TRP A 12 -9.792 -1.042 6.369 1.00 0.23 H new ATOM 0 HB3 TRP A 12 -8.847 -0.811 4.911 1.00 0.23 H new ATOM 0 HD1 TRP A 12 -8.926 -2.831 8.111 1.00 0.31 H new ATOM 0 HE1 TRP A 12 -7.016 -4.577 8.090 1.00 0.33 H new ATOM 0 HE3 TRP A 12 -6.332 -1.036 4.106 1.00 0.30 H new ATOM 0 HZ2 TRP A 12 -4.715 -5.070 6.538 1.00 0.33 H new ATOM 0 HZ3 TRP A 12 -4.277 -2.186 3.415 1.00 0.36 H new ATOM 0 HH2 TRP A 12 -3.478 -4.168 4.615 1.00 0.36 H new ATOM 130 N ALA A 13 -6.025 1.221 6.721 1.00 0.23 N ATOM 131 CA ALA A 13 -4.691 1.546 6.236 1.00 0.23 C ATOM 132 C ALA A 13 -3.647 0.786 7.032 1.00 0.25 C ATOM 133 O ALA A 13 -3.774 0.639 8.245 1.00 0.26 O ATOM 134 CB ALA A 13 -4.437 3.040 6.318 1.00 0.25 C ATOM 0 H ALA A 13 -6.116 1.211 7.737 1.00 0.23 H new ATOM 0 HA ALA A 13 -4.622 1.247 5.190 1.00 0.23 H new ATOM 0 HB1 ALA A 13 -3.435 3.259 5.951 1.00 0.25 H new ATOM 0 HB2 ALA A 13 -5.170 3.568 5.708 1.00 0.25 H new ATOM 0 HB3 ALA A 13 -4.523 3.367 7.354 1.00 0.25 H new ATOM 140 N VAL A 14 -2.624 0.297 6.359 1.00 0.27 N ATOM 141 CA VAL A 14 -1.597 -0.480 7.015 1.00 0.27 C ATOM 142 C VAL A 14 -0.199 -0.163 6.494 1.00 0.26 C ATOM 143 O VAL A 14 0.179 -0.563 5.394 1.00 0.33 O ATOM 144 CB VAL A 14 -1.861 -1.993 6.884 1.00 0.33 C ATOM 145 CG1 VAL A 14 -0.658 -2.805 7.341 1.00 0.70 C ATOM 146 CG2 VAL A 14 -3.078 -2.375 7.691 1.00 0.79 C ATOM 0 H VAL A 14 -2.484 0.426 5.357 1.00 0.27 H new ATOM 0 HA VAL A 14 -1.638 -0.198 8.067 1.00 0.27 H new ATOM 0 HB VAL A 14 -2.039 -2.216 5.832 1.00 0.33 H new ATOM 0 HG11 VAL A 14 -0.876 -3.868 7.236 1.00 0.70 H new ATOM 0 HG12 VAL A 14 0.207 -2.550 6.729 1.00 0.70 H new ATOM 0 HG13 VAL A 14 -0.443 -2.580 8.386 1.00 0.70 H new ATOM 0 HG21 VAL A 14 -3.258 -3.446 7.593 1.00 0.79 H new ATOM 0 HG22 VAL A 14 -2.911 -2.129 8.740 1.00 0.79 H new ATOM 0 HG23 VAL A 14 -3.945 -1.826 7.324 1.00 0.79 H new ATOM 156 N ASN A 15 0.560 0.560 7.303 1.00 0.26 N ATOM 157 CA ASN A 15 1.986 0.669 7.106 1.00 0.28 C ATOM 158 C ASN A 15 2.639 -0.563 7.702 1.00 0.28 C ATOM 159 O ASN A 15 2.948 -0.606 8.892 1.00 0.34 O ATOM 160 CB ASN A 15 2.563 1.945 7.748 1.00 0.32 C ATOM 161 CG ASN A 15 4.079 1.900 7.836 1.00 0.50 C ATOM 162 OD1 ASN A 15 4.640 1.614 8.892 1.00 1.49 O ATOM 163 ND2 ASN A 15 4.745 2.153 6.728 1.00 0.83 N ATOM 0 H ASN A 15 0.204 1.080 8.105 1.00 0.26 H new ATOM 0 HA ASN A 15 2.192 0.736 6.038 1.00 0.28 H new ATOM 0 HB2 ASN A 15 2.259 2.814 7.165 1.00 0.32 H new ATOM 0 HB3 ASN A 15 2.145 2.070 8.747 1.00 0.32 H new ATOM 0 HD21 ASN A 15 5.764 2.115 6.726 1.00 0.83 H new ATOM 0 HD22 ASN A 15 4.241 2.387 5.872 1.00 0.83 H new ATOM 170 N ALA A 16 2.772 -1.592 6.890 1.00 0.33 N ATOM 171 CA ALA A 16 3.437 -2.799 7.310 1.00 0.39 C ATOM 172 C ALA A 16 4.888 -2.496 7.591 1.00 0.37 C ATOM 173 O ALA A 16 5.703 -2.341 6.658 1.00 0.38 O ATOM 174 CB ALA A 16 3.301 -3.896 6.275 1.00 0.48 C ATOM 0 H ALA A 16 2.425 -1.612 5.931 1.00 0.33 H new ATOM 0 HA ALA A 16 2.963 -3.162 8.222 1.00 0.39 H new ATOM 0 HB1 ALA A 16 3.814 -4.792 6.625 1.00 0.48 H new ATOM 0 HB2 ALA A 16 2.246 -4.120 6.119 1.00 0.48 H new ATOM 0 HB3 ALA A 16 3.745 -3.567 5.335 1.00 0.48 H new ATOM 180 N GLY A 17 5.160 -2.369 8.889 1.00 0.40 N ATOM 181 CA GLY A 17 6.477 -2.067 9.389 1.00 0.45 C ATOM 182 C GLY A 17 6.399 -1.403 10.745 1.00 0.49 C ATOM 183 O GLY A 17 7.083 -1.795 11.686 1.00 0.76 O ATOM 0 H GLY A 17 4.457 -2.476 9.621 1.00 0.40 H new ATOM 0 HA2 GLY A 17 7.062 -2.984 9.461 1.00 0.45 H new ATOM 0 HA3 GLY A 17 6.995 -1.413 8.688 1.00 0.45 H new ATOM 187 N GLY A 18 5.482 -0.460 10.857 1.00 0.57 N ATOM 188 CA GLY A 18 5.401 0.378 12.046 1.00 0.66 C ATOM 189 C GLY A 18 4.283 -0.032 12.983 1.00 0.57 C ATOM 190 O GLY A 18 3.909 -1.198 13.031 1.00 0.74 O ATOM 0 H GLY A 18 4.783 -0.253 10.143 1.00 0.57 H new ATOM 0 HA2 GLY A 18 6.350 0.334 12.580 1.00 0.66 H new ATOM 0 HA3 GLY A 18 5.253 1.415 11.744 1.00 0.66 H new ATOM 194 N GLU A 19 3.736 0.926 13.722 1.00 0.53 N ATOM 195 CA GLU A 19 2.670 0.644 14.673 1.00 0.50 C ATOM 196 C GLU A 19 1.732 1.839 14.823 1.00 0.45 C ATOM 197 O GLU A 19 2.167 2.940 15.144 1.00 0.64 O ATOM 198 CB GLU A 19 3.291 0.208 16.010 1.00 0.69 C ATOM 199 CG GLU A 19 2.391 0.308 17.241 1.00 1.27 C ATOM 200 CD GLU A 19 2.441 1.661 17.923 1.00 1.45 C ATOM 201 OE1 GLU A 19 3.523 2.290 17.930 1.00 1.77 O ATOM 202 OE2 GLU A 19 1.401 2.106 18.450 1.00 1.75 O ATOM 0 H GLU A 19 4.014 1.906 13.680 1.00 0.53 H new ATOM 0 HA GLU A 19 2.054 -0.175 14.301 1.00 0.50 H new ATOM 0 HB2 GLU A 19 3.622 -0.826 15.912 1.00 0.69 H new ATOM 0 HB3 GLU A 19 4.181 0.812 16.187 1.00 0.69 H new ATOM 0 HG2 GLU A 19 1.363 0.097 16.947 1.00 1.27 H new ATOM 0 HG3 GLU A 19 2.682 -0.461 17.957 1.00 1.27 H new ATOM 209 N SER A 20 0.452 1.580 14.518 1.00 0.42 N ATOM 210 CA SER A 20 -0.658 2.531 14.676 1.00 0.42 C ATOM 211 C SER A 20 -0.244 3.976 14.404 1.00 0.38 C ATOM 212 O SER A 20 0.089 4.717 15.329 1.00 0.44 O ATOM 213 CB SER A 20 -1.255 2.408 16.081 1.00 0.59 C ATOM 214 OG SER A 20 -2.553 2.981 16.145 1.00 1.29 O ATOM 0 H SER A 20 0.152 0.679 14.145 1.00 0.42 H new ATOM 0 HA SER A 20 -1.409 2.273 13.930 1.00 0.42 H new ATOM 0 HB2 SER A 20 -1.305 1.357 16.366 1.00 0.59 H new ATOM 0 HB3 SER A 20 -0.602 2.902 16.800 1.00 0.59 H new ATOM 0 HG SER A 20 -2.503 3.932 15.914 1.00 1.29 H new ATOM 220 N HIS A 21 -0.299 4.395 13.145 1.00 0.34 N ATOM 221 CA HIS A 21 0.166 5.738 12.807 1.00 0.33 C ATOM 222 C HIS A 21 -0.864 6.495 11.993 1.00 0.32 C ATOM 223 O HIS A 21 -1.397 5.978 11.016 1.00 0.32 O ATOM 224 CB HIS A 21 1.505 5.704 12.052 1.00 0.35 C ATOM 225 CG HIS A 21 1.909 7.042 11.482 1.00 0.35 C ATOM 226 ND1 HIS A 21 2.589 8.007 12.190 1.00 0.41 N ATOM 227 CD2 HIS A 21 1.688 7.576 10.261 1.00 0.40 C ATOM 228 CE1 HIS A 21 2.758 9.073 11.425 1.00 0.42 C ATOM 229 NE2 HIS A 21 2.219 8.833 10.253 1.00 0.41 N ATOM 0 H HIS A 21 -0.650 3.845 12.361 1.00 0.34 H new ATOM 0 HA HIS A 21 0.317 6.262 13.751 1.00 0.33 H new ATOM 0 HB2 HIS A 21 2.286 5.355 12.728 1.00 0.35 H new ATOM 0 HB3 HIS A 21 1.438 4.978 11.242 1.00 0.35 H new ATOM 0 HD1 HIS A 21 2.912 7.915 13.153 1.00 0.41 H new ATOM 0 HD2 HIS A 21 1.181 7.094 9.438 1.00 0.40 H new ATOM 0 HE1 HIS A 21 3.255 9.986 11.716 1.00 0.42 H new ATOM 238 N VAL A 22 -1.125 7.723 12.403 1.00 0.41 N ATOM 239 CA VAL A 22 -1.999 8.613 11.665 1.00 0.40 C ATOM 240 C VAL A 22 -1.180 9.521 10.746 1.00 0.40 C ATOM 241 O VAL A 22 -0.297 10.251 11.198 1.00 0.48 O ATOM 242 CB VAL A 22 -2.835 9.486 12.615 1.00 0.49 C ATOM 243 CG1 VAL A 22 -3.814 10.354 11.840 1.00 0.84 C ATOM 244 CG2 VAL A 22 -3.561 8.632 13.638 1.00 1.01 C ATOM 0 H VAL A 22 -0.738 8.129 13.255 1.00 0.41 H new ATOM 0 HA VAL A 22 -2.671 7.994 11.070 1.00 0.40 H new ATOM 0 HB VAL A 22 -2.153 10.146 13.150 1.00 0.49 H new ATOM 0 HG11 VAL A 22 -4.392 10.961 12.537 1.00 0.84 H new ATOM 0 HG12 VAL A 22 -3.264 11.006 11.161 1.00 0.84 H new ATOM 0 HG13 VAL A 22 -4.488 9.718 11.266 1.00 0.84 H new ATOM 0 HG21 VAL A 22 -4.145 9.273 14.298 1.00 1.01 H new ATOM 0 HG22 VAL A 22 -4.226 7.937 13.125 1.00 1.01 H new ATOM 0 HG23 VAL A 22 -2.834 8.072 14.226 1.00 1.01 H new ATOM 254 N ASP A 23 -1.457 9.434 9.459 1.00 0.37 N ATOM 255 CA ASP A 23 -0.845 10.294 8.458 1.00 0.42 C ATOM 256 C ASP A 23 -1.515 11.660 8.488 1.00 0.36 C ATOM 257 O ASP A 23 -2.666 11.771 8.899 1.00 0.33 O ATOM 258 CB ASP A 23 -0.982 9.633 7.079 1.00 0.51 C ATOM 259 CG ASP A 23 -1.263 10.607 5.955 1.00 0.55 C ATOM 260 OD1 ASP A 23 -2.441 10.967 5.767 1.00 0.77 O ATOM 261 OD2 ASP A 23 -0.314 11.012 5.260 1.00 0.75 O ATOM 0 H ASP A 23 -2.118 8.760 9.073 1.00 0.37 H new ATOM 0 HA ASP A 23 0.215 10.432 8.670 1.00 0.42 H new ATOM 0 HB2 ASP A 23 -0.064 9.090 6.855 1.00 0.51 H new ATOM 0 HB3 ASP A 23 -1.785 8.898 7.118 1.00 0.51 H new ATOM 266 N VAL A 24 -0.779 12.684 8.055 1.00 0.38 N ATOM 267 CA VAL A 24 -1.204 14.081 8.175 1.00 0.37 C ATOM 268 C VAL A 24 -2.495 14.402 7.421 1.00 0.38 C ATOM 269 O VAL A 24 -3.052 15.488 7.585 1.00 0.49 O ATOM 270 CB VAL A 24 -0.097 15.043 7.691 1.00 0.42 C ATOM 271 CG1 VAL A 24 1.166 14.862 8.515 1.00 0.59 C ATOM 272 CG2 VAL A 24 0.198 14.830 6.214 1.00 0.62 C ATOM 0 H VAL A 24 0.131 12.569 7.610 1.00 0.38 H new ATOM 0 HA VAL A 24 -1.399 14.225 9.238 1.00 0.37 H new ATOM 0 HB VAL A 24 -0.454 16.064 7.824 1.00 0.42 H new ATOM 0 HG11 VAL A 24 1.934 15.548 8.159 1.00 0.59 H new ATOM 0 HG12 VAL A 24 0.950 15.071 9.563 1.00 0.59 H new ATOM 0 HG13 VAL A 24 1.521 13.836 8.416 1.00 0.59 H new ATOM 0 HG21 VAL A 24 0.981 15.519 5.896 1.00 0.62 H new ATOM 0 HG22 VAL A 24 0.530 13.804 6.054 1.00 0.62 H new ATOM 0 HG23 VAL A 24 -0.705 15.014 5.632 1.00 0.62 H new ATOM 282 N HIS A 25 -2.970 13.483 6.592 1.00 0.37 N ATOM 283 CA HIS A 25 -4.240 13.679 5.907 1.00 0.43 C ATOM 284 C HIS A 25 -5.347 12.999 6.700 1.00 0.40 C ATOM 285 O HIS A 25 -6.517 13.033 6.320 1.00 0.51 O ATOM 286 CB HIS A 25 -4.197 13.114 4.484 1.00 0.53 C ATOM 287 CG HIS A 25 -2.986 13.521 3.698 1.00 0.61 C ATOM 288 ND1 HIS A 25 -2.816 14.777 3.161 1.00 0.73 N ATOM 289 CD2 HIS A 25 -1.873 12.823 3.372 1.00 0.72 C ATOM 290 CE1 HIS A 25 -1.653 14.833 2.540 1.00 0.86 C ATOM 291 NE2 HIS A 25 -1.060 13.661 2.653 1.00 0.86 N ATOM 0 H HIS A 25 -2.501 12.603 6.379 1.00 0.37 H new ATOM 0 HA HIS A 25 -4.435 14.749 5.837 1.00 0.43 H new ATOM 0 HB2 HIS A 25 -4.234 12.026 4.536 1.00 0.53 H new ATOM 0 HB3 HIS A 25 -5.090 13.438 3.949 1.00 0.53 H new ATOM 0 HD2 HIS A 25 -1.664 11.795 3.631 1.00 0.72 H new ATOM 0 HE1 HIS A 25 -1.254 15.695 2.025 1.00 0.86 H new ATOM 0 HE2 HIS A 25 -0.147 13.418 2.269 1.00 0.86 H new ATOM 300 N GLY A 26 -4.949 12.374 7.802 1.00 0.32 N ATOM 301 CA GLY A 26 -5.885 11.728 8.698 1.00 0.33 C ATOM 302 C GLY A 26 -6.044 10.247 8.418 1.00 0.30 C ATOM 303 O GLY A 26 -7.107 9.675 8.662 1.00 0.33 O ATOM 0 H GLY A 26 -3.974 12.304 8.093 1.00 0.32 H new ATOM 0 HA2 GLY A 26 -5.549 11.864 9.726 1.00 0.33 H new ATOM 0 HA3 GLY A 26 -6.856 12.215 8.613 1.00 0.33 H new ATOM 307 N ILE A 27 -4.987 9.617 7.922 1.00 0.26 N ATOM 308 CA ILE A 27 -5.054 8.202 7.562 1.00 0.24 C ATOM 309 C ILE A 27 -4.349 7.333 8.611 1.00 0.26 C ATOM 310 O ILE A 27 -3.141 7.418 8.794 1.00 0.28 O ATOM 311 CB ILE A 27 -4.467 7.943 6.151 1.00 0.24 C ATOM 312 CG1 ILE A 27 -5.375 8.533 5.066 1.00 0.26 C ATOM 313 CG2 ILE A 27 -4.284 6.460 5.899 1.00 0.27 C ATOM 314 CD1 ILE A 27 -6.817 8.137 5.218 1.00 0.31 C ATOM 0 H ILE A 27 -4.081 10.056 7.760 1.00 0.26 H new ATOM 0 HA ILE A 27 -6.107 7.923 7.538 1.00 0.24 H new ATOM 0 HB ILE A 27 -3.493 8.432 6.110 1.00 0.24 H new ATOM 0 HG12 ILE A 27 -5.299 9.620 5.090 1.00 0.26 H new ATOM 0 HG13 ILE A 27 -5.018 8.210 4.088 1.00 0.26 H new ATOM 0 HG21 ILE A 27 -3.871 6.309 4.902 1.00 0.27 H new ATOM 0 HG22 ILE A 27 -3.601 6.046 6.641 1.00 0.27 H new ATOM 0 HG23 ILE A 27 -5.248 5.957 5.973 1.00 0.27 H new ATOM 0 HD11 ILE A 27 -7.404 8.588 4.418 1.00 0.31 H new ATOM 0 HD12 ILE A 27 -6.904 7.052 5.164 1.00 0.31 H new ATOM 0 HD13 ILE A 27 -7.190 8.483 6.182 1.00 0.31 H new ATOM 326 N HIS A 28 -5.114 6.485 9.288 1.00 0.31 N ATOM 327 CA HIS A 28 -4.610 5.739 10.444 1.00 0.33 C ATOM 328 C HIS A 28 -4.286 4.282 10.091 1.00 0.33 C ATOM 329 O HIS A 28 -5.154 3.534 9.638 1.00 0.39 O ATOM 330 CB HIS A 28 -5.661 5.795 11.556 1.00 0.40 C ATOM 331 CG HIS A 28 -5.217 5.298 12.904 1.00 0.49 C ATOM 332 ND1 HIS A 28 -5.378 6.033 14.058 1.00 0.60 N ATOM 333 CD2 HIS A 28 -4.633 4.137 13.286 1.00 0.80 C ATOM 334 CE1 HIS A 28 -4.911 5.349 15.083 1.00 0.66 C ATOM 335 NE2 HIS A 28 -4.452 4.196 14.645 1.00 0.78 N ATOM 0 H HIS A 28 -6.089 6.294 9.059 1.00 0.31 H new ATOM 0 HA HIS A 28 -3.679 6.198 10.777 1.00 0.33 H new ATOM 0 HB2 HIS A 28 -5.995 6.827 11.663 1.00 0.40 H new ATOM 0 HB3 HIS A 28 -6.526 5.211 11.242 1.00 0.40 H new ATOM 0 HD2 HIS A 28 -4.360 3.316 12.640 1.00 0.80 H new ATOM 0 HE1 HIS A 28 -4.906 5.680 16.111 1.00 0.66 H new ATOM 0 HE2 HIS A 28 -4.031 3.467 15.221 1.00 0.78 H new ATOM 344 N TYR A 29 -3.033 3.886 10.316 1.00 0.32 N ATOM 345 CA TYR A 29 -2.611 2.497 10.111 1.00 0.35 C ATOM 346 C TYR A 29 -2.874 1.647 11.363 1.00 0.40 C ATOM 347 O TYR A 29 -2.589 2.082 12.480 1.00 0.44 O ATOM 348 CB TYR A 29 -1.139 2.432 9.664 1.00 0.42 C ATOM 349 CG TYR A 29 -0.349 1.257 10.215 1.00 0.65 C ATOM 350 CD1 TYR A 29 -0.719 -0.053 9.940 1.00 0.80 C ATOM 351 CD2 TYR A 29 0.779 1.464 10.993 1.00 0.98 C ATOM 352 CE1 TYR A 29 0.005 -1.118 10.421 1.00 1.17 C ATOM 353 CE2 TYR A 29 1.507 0.399 11.481 1.00 1.30 C ATOM 354 CZ TYR A 29 1.115 -0.890 11.194 1.00 1.39 C ATOM 355 OH TYR A 29 1.842 -1.959 11.664 1.00 1.75 O ATOM 0 H TYR A 29 -2.291 4.506 10.640 1.00 0.32 H new ATOM 0 HA TYR A 29 -3.212 2.072 9.307 1.00 0.35 H new ATOM 0 HB2 TYR A 29 -1.108 2.392 8.575 1.00 0.42 H new ATOM 0 HB3 TYR A 29 -0.643 3.355 9.964 1.00 0.42 H new ATOM 0 HD1 TYR A 29 -1.594 -0.239 9.335 1.00 0.80 H new ATOM 0 HD2 TYR A 29 1.092 2.472 11.220 1.00 0.98 H new ATOM 0 HE1 TYR A 29 -0.299 -2.129 10.192 1.00 1.17 H new ATOM 0 HE2 TYR A 29 2.383 0.575 12.087 1.00 1.30 H new ATOM 0 HH TYR A 29 2.776 -1.690 11.788 1.00 1.75 H new ATOM 365 N ARG A 30 -3.348 0.404 11.127 1.00 0.50 N ATOM 366 CA ARG A 30 -4.035 -0.418 12.142 1.00 0.64 C ATOM 367 C ARG A 30 -3.140 -0.993 13.240 1.00 0.76 C ATOM 368 O ARG A 30 -3.655 -1.575 14.191 1.00 1.46 O ATOM 369 CB ARG A 30 -4.777 -1.607 11.504 1.00 0.83 C ATOM 370 CG ARG A 30 -5.302 -1.397 10.101 1.00 0.73 C ATOM 371 CD ARG A 30 -6.131 -0.150 9.980 1.00 0.93 C ATOM 372 NE ARG A 30 -7.167 -0.060 11.003 1.00 1.52 N ATOM 373 CZ ARG A 30 -7.879 1.038 11.250 1.00 2.17 C ATOM 374 NH1 ARG A 30 -7.611 2.174 10.615 1.00 2.48 N ATOM 375 NH2 ARG A 30 -8.848 1.006 12.152 1.00 2.94 N ATOM 0 H ARG A 30 -3.263 -0.058 10.221 1.00 0.50 H new ATOM 0 HA ARG A 30 -4.720 0.293 12.604 1.00 0.64 H new ATOM 0 HB2 ARG A 30 -4.103 -2.464 11.492 1.00 0.83 H new ATOM 0 HB3 ARG A 30 -5.617 -1.871 12.147 1.00 0.83 H new ATOM 0 HG2 ARG A 30 -4.463 -1.341 9.407 1.00 0.73 H new ATOM 0 HG3 ARG A 30 -5.902 -2.259 9.808 1.00 0.73 H new ATOM 0 HD2 ARG A 30 -5.480 0.722 10.050 1.00 0.93 H new ATOM 0 HD3 ARG A 30 -6.596 -0.122 8.995 1.00 0.93 H new ATOM 0 HE ARG A 30 -7.358 -0.890 11.564 1.00 1.52 H new ATOM 0 HH11 ARG A 30 -6.855 2.210 9.932 1.00 2.48 H new ATOM 0 HH12 ARG A 30 -8.162 3.010 10.811 1.00 2.48 H new ATOM 0 HH21 ARG A 30 -9.048 0.142 12.656 1.00 2.94 H new ATOM 0 HH22 ARG A 30 -9.395 1.846 12.343 1.00 2.94 H new ATOM 389 N LYS A 31 -1.828 -0.846 13.103 1.00 0.59 N ATOM 390 CA LYS A 31 -0.867 -1.428 14.049 1.00 0.67 C ATOM 391 C LYS A 31 -0.799 -2.959 13.948 1.00 0.86 C ATOM 392 O LYS A 31 -1.699 -3.660 14.410 1.00 1.37 O ATOM 393 CB LYS A 31 -1.218 -1.044 15.489 1.00 0.99 C ATOM 394 CG LYS A 31 -0.158 -1.445 16.498 1.00 1.25 C ATOM 395 CD LYS A 31 -0.759 -1.723 17.870 1.00 1.61 C ATOM 396 CE LYS A 31 -1.480 -0.506 18.431 1.00 2.18 C ATOM 397 NZ LYS A 31 -2.154 -0.810 19.719 1.00 2.78 N ATOM 0 H LYS A 31 -1.396 -0.325 12.340 1.00 0.59 H new ATOM 0 HA LYS A 31 0.108 -1.022 13.781 1.00 0.67 H new ATOM 0 HB2 LYS A 31 -1.370 0.034 15.542 1.00 0.99 H new ATOM 0 HB3 LYS A 31 -2.164 -1.513 15.761 1.00 0.99 H new ATOM 0 HG2 LYS A 31 0.364 -2.334 16.143 1.00 1.25 H new ATOM 0 HG3 LYS A 31 0.584 -0.651 16.580 1.00 1.25 H new ATOM 0 HD2 LYS A 31 -1.457 -2.557 17.798 1.00 1.61 H new ATOM 0 HD3 LYS A 31 0.031 -2.026 18.558 1.00 1.61 H new ATOM 0 HE2 LYS A 31 -0.766 0.304 18.577 1.00 2.18 H new ATOM 0 HE3 LYS A 31 -2.217 -0.155 17.709 1.00 2.18 H new ATOM 0 HZ1 LYS A 31 -2.634 0.043 20.070 1.00 2.78 H new ATOM 0 HZ2 LYS A 31 -2.853 -1.566 19.575 1.00 2.78 H new ATOM 0 HZ3 LYS A 31 -1.447 -1.121 20.416 1.00 2.78 H new ATOM 411 N ASP A 32 0.266 -3.454 13.320 1.00 0.75 N ATOM 412 CA ASP A 32 0.654 -4.872 13.398 1.00 1.00 C ATOM 413 C ASP A 32 -0.422 -5.843 12.870 1.00 0.93 C ATOM 414 O ASP A 32 -0.900 -6.706 13.602 1.00 1.29 O ATOM 415 CB ASP A 32 1.007 -5.223 14.852 1.00 1.58 C ATOM 416 CG ASP A 32 2.294 -4.567 15.328 1.00 1.92 C ATOM 417 OD1 ASP A 32 2.296 -3.333 15.528 1.00 2.41 O ATOM 418 OD2 ASP A 32 3.309 -5.275 15.497 1.00 2.36 O ATOM 0 H ASP A 32 0.888 -2.889 12.742 1.00 0.75 H new ATOM 0 HA ASP A 32 1.519 -4.997 12.747 1.00 1.00 H new ATOM 0 HB2 ASP A 32 0.188 -4.917 15.503 1.00 1.58 H new ATOM 0 HB3 ASP A 32 1.101 -6.305 14.946 1.00 1.58 H new ATOM 423 N PRO A 33 -0.843 -5.709 11.600 1.00 0.72 N ATOM 424 CA PRO A 33 -1.796 -6.611 10.966 1.00 0.89 C ATOM 425 C PRO A 33 -1.156 -7.545 9.921 1.00 1.04 C ATOM 426 O PRO A 33 0.025 -7.900 10.024 1.00 1.87 O ATOM 427 CB PRO A 33 -2.723 -5.600 10.276 1.00 0.99 C ATOM 428 CG PRO A 33 -1.919 -4.330 10.148 1.00 0.86 C ATOM 429 CD PRO A 33 -0.544 -4.623 10.689 1.00 0.69 C ATOM 0 HA PRO A 33 -2.270 -7.294 11.671 1.00 0.89 H new ATOM 0 HB2 PRO A 33 -3.040 -5.963 9.298 1.00 0.99 H new ATOM 0 HB3 PRO A 33 -3.627 -5.434 10.862 1.00 0.99 H new ATOM 0 HG2 PRO A 33 -1.864 -4.012 9.107 1.00 0.86 H new ATOM 0 HG3 PRO A 33 -2.388 -3.519 10.705 1.00 0.86 H new ATOM 0 HD2 PRO A 33 0.155 -4.919 9.907 1.00 0.69 H new ATOM 0 HD3 PRO A 33 -0.107 -3.764 11.198 1.00 0.69 H new ATOM 437 N LEU A 34 -1.977 -7.967 8.948 1.00 0.93 N ATOM 438 CA LEU A 34 -1.540 -8.681 7.746 1.00 1.04 C ATOM 439 C LEU A 34 -1.391 -10.180 7.972 1.00 1.44 C ATOM 440 O LEU A 34 -2.220 -10.959 7.504 1.00 1.99 O ATOM 441 CB LEU A 34 -0.277 -8.037 7.155 1.00 0.94 C ATOM 442 CG LEU A 34 0.727 -8.976 6.505 1.00 1.11 C ATOM 443 CD1 LEU A 34 0.437 -9.115 5.025 1.00 1.93 C ATOM 444 CD2 LEU A 34 2.150 -8.487 6.734 1.00 1.40 C ATOM 0 H LEU A 34 -2.985 -7.816 8.979 1.00 0.93 H new ATOM 0 HA LEU A 34 -2.331 -8.583 7.003 1.00 1.04 H new ATOM 0 HB2 LEU A 34 -0.586 -7.301 6.412 1.00 0.94 H new ATOM 0 HB3 LEU A 34 0.232 -7.492 7.951 1.00 0.94 H new ATOM 0 HG LEU A 34 0.631 -9.958 6.968 1.00 1.11 H new ATOM 0 HD11 LEU A 34 1.164 -9.790 4.574 1.00 1.93 H new ATOM 0 HD12 LEU A 34 -0.567 -9.518 4.887 1.00 1.93 H new ATOM 0 HD13 LEU A 34 0.505 -8.137 4.548 1.00 1.93 H new ATOM 0 HD21 LEU A 34 2.851 -9.174 6.260 1.00 1.40 H new ATOM 0 HD22 LEU A 34 2.267 -7.493 6.302 1.00 1.40 H new ATOM 0 HD23 LEU A 34 2.352 -8.443 7.804 1.00 1.40 H new ATOM 456 N GLU A 35 -0.380 -10.591 8.704 1.00 1.59 N ATOM 457 CA GLU A 35 -0.091 -12.018 8.828 1.00 2.32 C ATOM 458 C GLU A 35 -0.020 -12.445 10.280 1.00 2.08 C ATOM 459 O GLU A 35 0.693 -13.383 10.629 1.00 2.59 O ATOM 460 CB GLU A 35 1.222 -12.367 8.117 1.00 3.27 C ATOM 461 CG GLU A 35 1.160 -12.320 6.599 1.00 3.88 C ATOM 462 CD GLU A 35 0.537 -13.561 5.996 1.00 4.71 C ATOM 463 OE1 GLU A 35 1.251 -14.578 5.857 1.00 5.31 O ATOM 464 OE2 GLU A 35 -0.661 -13.529 5.654 1.00 5.06 O ATOM 0 H GLU A 35 0.251 -9.976 9.218 1.00 1.59 H new ATOM 0 HA GLU A 35 -0.909 -12.560 8.353 1.00 2.32 H new ATOM 0 HB2 GLU A 35 1.996 -11.678 8.456 1.00 3.27 H new ATOM 0 HB3 GLU A 35 1.529 -13.367 8.423 1.00 3.27 H new ATOM 0 HG2 GLU A 35 0.587 -11.446 6.291 1.00 3.88 H new ATOM 0 HG3 GLU A 35 2.168 -12.196 6.203 1.00 3.88 H new ATOM 471 N GLY A 36 -0.753 -11.751 11.129 1.00 1.92 N ATOM 472 CA GLY A 36 -0.724 -12.077 12.541 1.00 2.13 C ATOM 473 C GLY A 36 0.457 -11.438 13.233 1.00 2.00 C ATOM 474 O GLY A 36 0.688 -11.659 14.423 1.00 2.64 O ATOM 0 H GLY A 36 -1.363 -10.975 10.874 1.00 1.92 H new ATOM 0 HA2 GLY A 36 -1.648 -11.742 13.012 1.00 2.13 H new ATOM 0 HA3 GLY A 36 -0.678 -13.159 12.665 1.00 2.13 H new ATOM 478 N ARG A 37 1.222 -10.675 12.454 1.00 1.78 N ATOM 479 CA ARG A 37 2.428 -10.001 12.920 1.00 2.68 C ATOM 480 C ARG A 37 2.099 -8.906 13.923 1.00 2.85 C ATOM 481 O ARG A 37 2.296 -7.726 13.650 1.00 3.72 O ATOM 482 CB ARG A 37 3.183 -9.385 11.736 1.00 3.59 C ATOM 483 CG ARG A 37 4.113 -10.341 11.006 1.00 3.76 C ATOM 484 CD ARG A 37 3.381 -11.532 10.413 1.00 3.79 C ATOM 485 NE ARG A 37 4.294 -12.386 9.652 1.00 4.42 N ATOM 486 CZ ARG A 37 4.197 -13.717 9.558 1.00 4.86 C ATOM 487 NH1 ARG A 37 3.232 -14.373 10.189 1.00 4.81 N ATOM 488 NH2 ARG A 37 5.085 -14.392 8.838 1.00 5.64 N ATOM 0 H ARG A 37 1.017 -10.507 11.469 1.00 1.78 H new ATOM 0 HA ARG A 37 3.052 -10.748 13.410 1.00 2.68 H new ATOM 0 HB2 ARG A 37 2.456 -8.993 11.024 1.00 3.59 H new ATOM 0 HB3 ARG A 37 3.766 -8.537 12.096 1.00 3.59 H new ATOM 0 HG2 ARG A 37 4.628 -9.803 10.210 1.00 3.76 H new ATOM 0 HG3 ARG A 37 4.877 -10.697 11.697 1.00 3.76 H new ATOM 0 HD2 ARG A 37 2.916 -12.111 11.211 1.00 3.79 H new ATOM 0 HD3 ARG A 37 2.578 -11.183 9.764 1.00 3.79 H new ATOM 0 HE ARG A 37 5.062 -11.933 9.156 1.00 4.42 H new ATOM 0 HH11 ARG A 37 2.553 -13.862 10.754 1.00 4.81 H new ATOM 0 HH12 ARG A 37 3.169 -15.388 10.109 1.00 4.81 H new ATOM 0 HH21 ARG A 37 5.837 -13.896 8.360 1.00 5.64 H new ATOM 0 HH22 ARG A 37 5.015 -15.407 8.763 1.00 5.64 H new ATOM 502 N VAL A 38 1.599 -9.310 15.072 1.00 2.35 N ATOM 503 CA VAL A 38 1.273 -8.383 16.138 1.00 2.65 C ATOM 504 C VAL A 38 2.319 -8.477 17.236 1.00 2.33 C ATOM 505 O VAL A 38 2.499 -9.538 17.840 1.00 2.45 O ATOM 506 CB VAL A 38 -0.110 -8.685 16.757 1.00 3.31 C ATOM 507 CG1 VAL A 38 -0.532 -7.566 17.697 1.00 3.96 C ATOM 508 CG2 VAL A 38 -1.157 -8.909 15.680 1.00 3.90 C ATOM 0 H VAL A 38 1.407 -10.287 15.294 1.00 2.35 H new ATOM 0 HA VAL A 38 1.253 -7.383 15.705 1.00 2.65 H new ATOM 0 HB VAL A 38 -0.026 -9.605 17.335 1.00 3.31 H new ATOM 0 HG11 VAL A 38 -1.508 -7.797 18.123 1.00 3.96 H new ATOM 0 HG12 VAL A 38 0.200 -7.469 18.499 1.00 3.96 H new ATOM 0 HG13 VAL A 38 -0.590 -6.629 17.144 1.00 3.96 H new ATOM 0 HG21 VAL A 38 -2.119 -9.119 16.146 1.00 3.90 H new ATOM 0 HG22 VAL A 38 -1.241 -8.015 15.062 1.00 3.90 H new ATOM 0 HG23 VAL A 38 -0.863 -9.754 15.057 1.00 3.90 H new ATOM 518 N GLY A 39 3.028 -7.387 17.473 1.00 2.49 N ATOM 519 CA GLY A 39 3.987 -7.364 18.553 1.00 2.46 C ATOM 520 C GLY A 39 4.930 -6.184 18.482 1.00 2.14 C ATOM 521 O GLY A 39 4.757 -5.198 19.199 1.00 2.56 O ATOM 0 H GLY A 39 2.957 -6.521 16.939 1.00 2.49 H new ATOM 0 HA2 GLY A 39 3.454 -7.340 19.504 1.00 2.46 H new ATOM 0 HA3 GLY A 39 4.567 -8.287 18.536 1.00 2.46 H new ATOM 525 N ARG A 40 5.918 -6.270 17.604 1.00 2.03 N ATOM 526 CA ARG A 40 6.973 -5.270 17.555 1.00 2.30 C ATOM 527 C ARG A 40 7.034 -4.570 16.206 1.00 2.00 C ATOM 528 O ARG A 40 6.960 -5.205 15.154 1.00 2.54 O ATOM 529 CB ARG A 40 8.329 -5.905 17.866 1.00 3.17 C ATOM 530 CG ARG A 40 8.481 -6.348 19.309 1.00 3.67 C ATOM 531 CD ARG A 40 9.887 -6.849 19.585 1.00 4.46 C ATOM 532 NE ARG A 40 10.897 -5.826 19.309 1.00 4.84 N ATOM 533 CZ ARG A 40 12.179 -6.097 19.059 1.00 5.53 C ATOM 534 NH1 ARG A 40 12.607 -7.355 19.050 1.00 5.88 N ATOM 535 NH2 ARG A 40 13.034 -5.110 18.820 1.00 6.20 N ATOM 0 H ARG A 40 6.011 -7.019 16.918 1.00 2.03 H new ATOM 0 HA ARG A 40 6.738 -4.522 18.312 1.00 2.30 H new ATOM 0 HB2 ARG A 40 8.474 -6.766 17.214 1.00 3.17 H new ATOM 0 HB3 ARG A 40 9.117 -5.190 17.630 1.00 3.17 H new ATOM 0 HG2 ARG A 40 8.252 -5.515 19.974 1.00 3.67 H new ATOM 0 HG3 ARG A 40 7.762 -7.137 19.527 1.00 3.67 H new ATOM 0 HD2 ARG A 40 9.963 -7.162 20.626 1.00 4.46 H new ATOM 0 HD3 ARG A 40 10.085 -7.729 18.973 1.00 4.46 H new ATOM 0 HE ARG A 40 10.603 -4.849 19.308 1.00 4.84 H new ATOM 0 HH11 ARG A 40 11.955 -8.117 19.235 1.00 5.88 H new ATOM 0 HH12 ARG A 40 13.588 -7.559 18.858 1.00 5.88 H new ATOM 0 HH21 ARG A 40 12.711 -4.143 18.827 1.00 6.20 H new ATOM 0 HH22 ARG A 40 14.014 -5.319 18.629 1.00 6.20 H new ATOM 549 N ALA A 41 7.176 -3.253 16.258 1.00 1.69 N ATOM 550 CA ALA A 41 7.340 -2.445 15.067 1.00 1.44 C ATOM 551 C ALA A 41 8.792 -2.474 14.618 1.00 1.34 C ATOM 552 O ALA A 41 9.637 -1.770 15.175 1.00 2.00 O ATOM 553 CB ALA A 41 6.892 -1.015 15.331 1.00 1.63 C ATOM 0 H ALA A 41 7.180 -2.719 17.127 1.00 1.69 H new ATOM 0 HA ALA A 41 6.718 -2.857 14.272 1.00 1.44 H new ATOM 0 HB1 ALA A 41 7.021 -0.420 14.427 1.00 1.63 H new ATOM 0 HB2 ALA A 41 5.841 -1.011 15.621 1.00 1.63 H new ATOM 0 HB3 ALA A 41 7.492 -0.588 16.135 1.00 1.63 H new ATOM 559 N SER A 42 9.083 -3.322 13.646 1.00 1.46 N ATOM 560 CA SER A 42 10.423 -3.426 13.097 1.00 1.66 C ATOM 561 C SER A 42 10.809 -2.135 12.387 1.00 1.61 C ATOM 562 O SER A 42 10.042 -1.607 11.588 1.00 1.90 O ATOM 563 CB SER A 42 10.498 -4.612 12.134 1.00 1.97 C ATOM 564 OG SER A 42 9.426 -4.580 11.208 1.00 2.52 O ATOM 0 H SER A 42 8.404 -3.952 13.219 1.00 1.46 H new ATOM 0 HA SER A 42 11.128 -3.589 13.912 1.00 1.66 H new ATOM 0 HB2 SER A 42 11.447 -4.591 11.598 1.00 1.97 H new ATOM 0 HB3 SER A 42 10.470 -5.545 12.697 1.00 1.97 H new ATOM 0 HG SER A 42 9.565 -3.847 10.572 1.00 2.52 H new ATOM 570 N ASP A 43 11.986 -1.623 12.696 1.00 1.58 N ATOM 571 CA ASP A 43 12.465 -0.393 12.085 1.00 1.62 C ATOM 572 C ASP A 43 13.950 -0.522 11.772 1.00 2.03 C ATOM 573 O ASP A 43 14.722 0.435 11.868 1.00 2.27 O ATOM 574 CB ASP A 43 12.188 0.806 13.002 1.00 1.71 C ATOM 575 CG ASP A 43 13.022 0.799 14.273 1.00 2.08 C ATOM 576 OD1 ASP A 43 12.840 -0.112 15.106 1.00 2.17 O ATOM 577 OD2 ASP A 43 13.886 1.684 14.434 1.00 2.52 O ATOM 0 H ASP A 43 12.631 -2.040 13.368 1.00 1.58 H new ATOM 0 HA ASP A 43 11.930 -0.222 11.151 1.00 1.62 H new ATOM 0 HB2 ASP A 43 12.384 1.727 12.453 1.00 1.71 H new ATOM 0 HB3 ASP A 43 11.131 0.813 13.270 1.00 1.71 H new ATOM 582 N TYR A 44 14.332 -1.725 11.362 1.00 2.47 N ATOM 583 CA TYR A 44 15.718 -2.048 11.057 1.00 2.99 C ATOM 584 C TYR A 44 16.175 -1.300 9.812 1.00 2.89 C ATOM 585 O TYR A 44 17.365 -1.036 9.629 1.00 3.07 O ATOM 586 CB TYR A 44 15.875 -3.553 10.840 1.00 3.71 C ATOM 587 CG TYR A 44 15.470 -4.389 12.033 1.00 4.28 C ATOM 588 CD1 TYR A 44 16.337 -4.571 13.103 1.00 4.67 C ATOM 589 CD2 TYR A 44 14.220 -4.993 12.091 1.00 4.82 C ATOM 590 CE1 TYR A 44 15.970 -5.330 14.196 1.00 5.49 C ATOM 591 CE2 TYR A 44 13.845 -5.752 13.181 1.00 5.71 C ATOM 592 CZ TYR A 44 14.727 -5.936 14.220 1.00 6.00 C ATOM 593 OH TYR A 44 14.352 -6.671 15.322 1.00 7.02 O ATOM 0 H TYR A 44 13.687 -2.505 11.232 1.00 2.47 H new ATOM 0 HA TYR A 44 16.336 -1.743 11.901 1.00 2.99 H new ATOM 0 HB2 TYR A 44 15.276 -3.851 9.980 1.00 3.71 H new ATOM 0 HB3 TYR A 44 16.915 -3.768 10.594 1.00 3.71 H new ATOM 0 HD1 TYR A 44 17.314 -4.111 13.079 1.00 4.67 H new ATOM 0 HD2 TYR A 44 13.530 -4.866 11.269 1.00 4.82 H new ATOM 0 HE1 TYR A 44 16.649 -5.450 15.027 1.00 5.49 H new ATOM 0 HE2 TYR A 44 12.863 -6.200 13.218 1.00 5.71 H new ATOM 0 HH TYR A 44 13.451 -7.031 15.184 1.00 7.02 H new ATOM 603 N GLY A 45 15.220 -0.967 8.961 1.00 2.99 N ATOM 604 CA GLY A 45 15.512 -0.202 7.772 1.00 3.06 C ATOM 605 C GLY A 45 14.826 1.144 7.794 1.00 2.42 C ATOM 606 O GLY A 45 14.410 1.654 6.757 1.00 2.68 O ATOM 0 H GLY A 45 14.238 -1.217 9.075 1.00 2.99 H new ATOM 0 HA2 GLY A 45 16.589 -0.061 7.685 1.00 3.06 H new ATOM 0 HA3 GLY A 45 15.192 -0.760 6.892 1.00 3.06 H new ATOM 610 N MET A 46 14.705 1.721 8.989 1.00 1.93 N ATOM 611 CA MET A 46 14.054 3.015 9.153 1.00 1.65 C ATOM 612 C MET A 46 14.937 4.135 8.600 1.00 1.66 C ATOM 613 O MET A 46 14.485 5.267 8.413 1.00 2.25 O ATOM 614 CB MET A 46 13.726 3.274 10.628 1.00 1.79 C ATOM 615 CG MET A 46 12.817 4.475 10.845 1.00 1.56 C ATOM 616 SD MET A 46 12.474 4.794 12.585 1.00 2.17 S ATOM 617 CE MET A 46 11.352 6.184 12.455 1.00 2.35 C ATOM 0 H MET A 46 15.050 1.311 9.857 1.00 1.93 H new ATOM 0 HA MET A 46 13.121 2.999 8.590 1.00 1.65 H new ATOM 0 HB2 MET A 46 13.250 2.388 11.047 1.00 1.79 H new ATOM 0 HB3 MET A 46 14.655 3.427 11.177 1.00 1.79 H new ATOM 0 HG2 MET A 46 13.279 5.358 10.404 1.00 1.56 H new ATOM 0 HG3 MET A 46 11.876 4.311 10.319 1.00 1.56 H new ATOM 0 HE1 MET A 46 11.047 6.500 13.453 1.00 2.35 H new ATOM 0 HE2 MET A 46 11.853 7.010 11.950 1.00 2.35 H new ATOM 0 HE3 MET A 46 10.472 5.889 11.883 1.00 2.35 H new ATOM 627 N LYS A 47 16.196 3.817 8.334 1.00 1.57 N ATOM 628 CA LYS A 47 17.109 4.768 7.717 1.00 1.68 C ATOM 629 C LYS A 47 16.923 4.749 6.200 1.00 1.61 C ATOM 630 O LYS A 47 17.856 4.475 5.441 1.00 2.34 O ATOM 631 CB LYS A 47 18.557 4.433 8.080 1.00 2.02 C ATOM 632 CG LYS A 47 19.555 5.511 7.677 1.00 2.44 C ATOM 633 CD LYS A 47 20.984 5.000 7.753 1.00 3.01 C ATOM 634 CE LYS A 47 21.207 3.838 6.797 1.00 3.44 C ATOM 635 NZ LYS A 47 22.618 3.376 6.798 1.00 4.25 N ATOM 0 H LYS A 47 16.609 2.906 8.536 1.00 1.57 H new ATOM 0 HA LYS A 47 16.886 5.767 8.091 1.00 1.68 H new ATOM 0 HB2 LYS A 47 18.624 4.272 9.156 1.00 2.02 H new ATOM 0 HB3 LYS A 47 18.835 3.495 7.599 1.00 2.02 H new ATOM 0 HG2 LYS A 47 19.340 5.847 6.662 1.00 2.44 H new ATOM 0 HG3 LYS A 47 19.441 6.377 8.330 1.00 2.44 H new ATOM 0 HD2 LYS A 47 21.675 5.808 7.514 1.00 3.01 H new ATOM 0 HD3 LYS A 47 21.205 4.683 8.772 1.00 3.01 H new ATOM 0 HE2 LYS A 47 20.555 3.010 7.075 1.00 3.44 H new ATOM 0 HE3 LYS A 47 20.926 4.140 5.788 1.00 3.44 H new ATOM 0 HZ1 LYS A 47 22.724 2.584 6.133 1.00 4.25 H new ATOM 0 HZ2 LYS A 47 23.239 4.158 6.507 1.00 4.25 H new ATOM 0 HZ3 LYS A 47 22.880 3.063 7.754 1.00 4.25 H new ATOM 649 N LEU A 48 15.701 5.015 5.774 1.00 1.41 N ATOM 650 CA LEU A 48 15.369 5.078 4.360 1.00 1.31 C ATOM 651 C LEU A 48 14.362 6.194 4.141 1.00 1.01 C ATOM 652 O LEU A 48 13.176 5.942 3.936 1.00 1.02 O ATOM 653 CB LEU A 48 14.783 3.742 3.893 1.00 1.59 C ATOM 654 CG LEU A 48 15.132 3.320 2.458 1.00 2.10 C ATOM 655 CD1 LEU A 48 14.596 4.319 1.444 1.00 2.56 C ATOM 656 CD2 LEU A 48 16.638 3.160 2.300 1.00 2.55 C ATOM 0 H LEU A 48 14.912 5.193 6.396 1.00 1.41 H new ATOM 0 HA LEU A 48 16.271 5.278 3.782 1.00 1.31 H new ATOM 0 HB2 LEU A 48 15.123 2.961 4.573 1.00 1.59 H new ATOM 0 HB3 LEU A 48 13.698 3.793 3.982 1.00 1.59 H new ATOM 0 HG LEU A 48 14.656 2.358 2.267 1.00 2.10 H new ATOM 0 HD11 LEU A 48 14.859 3.993 0.438 1.00 2.56 H new ATOM 0 HD12 LEU A 48 13.511 4.382 1.533 1.00 2.56 H new ATOM 0 HD13 LEU A 48 15.033 5.300 1.633 1.00 2.56 H new ATOM 0 HD21 LEU A 48 16.867 2.861 1.277 1.00 2.55 H new ATOM 0 HD22 LEU A 48 17.130 4.108 2.519 1.00 2.55 H new ATOM 0 HD23 LEU A 48 16.997 2.397 2.990 1.00 2.55 H new ATOM 668 N PRO A 49 14.816 7.448 4.214 1.00 1.03 N ATOM 669 CA PRO A 49 13.927 8.600 4.136 1.00 1.05 C ATOM 670 C PRO A 49 13.202 8.691 2.797 1.00 0.81 C ATOM 671 O PRO A 49 13.807 8.958 1.760 1.00 0.91 O ATOM 672 CB PRO A 49 14.855 9.802 4.340 1.00 1.47 C ATOM 673 CG PRO A 49 16.222 9.301 4.016 1.00 1.69 C ATOM 674 CD PRO A 49 16.227 7.844 4.375 1.00 1.37 C ATOM 0 HA PRO A 49 13.131 8.542 4.879 1.00 1.05 H new ATOM 0 HB2 PRO A 49 14.575 10.630 3.689 1.00 1.47 H new ATOM 0 HB3 PRO A 49 14.803 10.170 5.365 1.00 1.47 H new ATOM 0 HG2 PRO A 49 16.449 9.443 2.959 1.00 1.69 H new ATOM 0 HG3 PRO A 49 16.980 9.844 4.580 1.00 1.69 H new ATOM 0 HD2 PRO A 49 16.883 7.271 3.719 1.00 1.37 H new ATOM 0 HD3 PRO A 49 16.576 7.683 5.395 1.00 1.37 H new ATOM 682 N ILE A 50 11.901 8.439 2.830 1.00 0.66 N ATOM 683 CA ILE A 50 11.073 8.546 1.645 1.00 0.48 C ATOM 684 C ILE A 50 10.953 10.014 1.217 1.00 0.70 C ATOM 685 O ILE A 50 10.365 10.841 1.912 1.00 1.59 O ATOM 686 CB ILE A 50 9.685 7.874 1.875 1.00 0.38 C ATOM 687 CG1 ILE A 50 9.697 6.456 1.316 1.00 0.42 C ATOM 688 CG2 ILE A 50 8.552 8.660 1.232 1.00 0.42 C ATOM 689 CD1 ILE A 50 10.693 5.536 1.984 1.00 0.51 C ATOM 0 H ILE A 50 11.397 8.158 3.671 1.00 0.66 H new ATOM 0 HA ILE A 50 11.547 8.006 0.826 1.00 0.48 H new ATOM 0 HB ILE A 50 9.509 7.854 2.950 1.00 0.38 H new ATOM 0 HG12 ILE A 50 8.699 6.029 1.418 1.00 0.42 H new ATOM 0 HG13 ILE A 50 9.918 6.500 0.249 1.00 0.42 H new ATOM 0 HG21 ILE A 50 7.605 8.153 1.419 1.00 0.42 H new ATOM 0 HG22 ILE A 50 8.517 9.663 1.658 1.00 0.42 H new ATOM 0 HG23 ILE A 50 8.721 8.728 0.157 1.00 0.42 H new ATOM 0 HD11 ILE A 50 10.638 4.547 1.528 1.00 0.51 H new ATOM 0 HD12 ILE A 50 11.699 5.937 1.860 1.00 0.51 H new ATOM 0 HD13 ILE A 50 10.462 5.459 3.046 1.00 0.51 H new ATOM 701 N LEU A 51 11.552 10.325 0.072 1.00 0.60 N ATOM 702 CA LEU A 51 11.685 11.706 -0.393 1.00 0.60 C ATOM 703 C LEU A 51 10.343 12.326 -0.776 1.00 0.62 C ATOM 704 O LEU A 51 10.195 13.544 -0.771 1.00 0.90 O ATOM 705 CB LEU A 51 12.643 11.789 -1.591 1.00 0.66 C ATOM 706 CG LEU A 51 14.098 11.378 -1.321 1.00 0.92 C ATOM 707 CD1 LEU A 51 14.243 9.864 -1.276 1.00 1.51 C ATOM 708 CD2 LEU A 51 15.020 11.965 -2.378 1.00 1.91 C ATOM 0 H LEU A 51 11.958 9.633 -0.558 1.00 0.60 H new ATOM 0 HA LEU A 51 12.091 12.274 0.444 1.00 0.60 H new ATOM 0 HB2 LEU A 51 12.251 11.158 -2.389 1.00 0.66 H new ATOM 0 HB3 LEU A 51 12.639 12.813 -1.963 1.00 0.66 H new ATOM 0 HG LEU A 51 14.383 11.774 -0.346 1.00 0.92 H new ATOM 0 HD11 LEU A 51 15.284 9.604 -1.083 1.00 1.51 H new ATOM 0 HD12 LEU A 51 13.615 9.462 -0.481 1.00 1.51 H new ATOM 0 HD13 LEU A 51 13.934 9.440 -2.232 1.00 1.51 H new ATOM 0 HD21 LEU A 51 16.047 11.664 -2.172 1.00 1.91 H new ATOM 0 HD22 LEU A 51 14.725 11.600 -3.362 1.00 1.91 H new ATOM 0 HD23 LEU A 51 14.949 13.053 -2.359 1.00 1.91 H new ATOM 720 N ARG A 52 9.365 11.496 -1.104 1.00 0.56 N ATOM 721 CA ARG A 52 8.069 12.000 -1.554 1.00 0.60 C ATOM 722 C ARG A 52 7.037 11.960 -0.430 1.00 0.59 C ATOM 723 O ARG A 52 5.863 11.671 -0.663 1.00 0.83 O ATOM 724 CB ARG A 52 7.571 11.197 -2.760 1.00 0.70 C ATOM 725 CG ARG A 52 7.532 11.993 -4.055 1.00 0.93 C ATOM 726 CD ARG A 52 8.909 12.507 -4.443 1.00 1.14 C ATOM 727 NE ARG A 52 8.890 13.204 -5.727 1.00 1.80 N ATOM 728 CZ ARG A 52 9.892 13.955 -6.181 1.00 2.47 C ATOM 729 NH1 ARG A 52 10.981 14.141 -5.440 1.00 2.72 N ATOM 730 NH2 ARG A 52 9.805 14.526 -7.373 1.00 3.17 N ATOM 0 H ARG A 52 9.438 10.479 -1.069 1.00 0.56 H new ATOM 0 HA ARG A 52 8.202 13.040 -1.853 1.00 0.60 H new ATOM 0 HB2 ARG A 52 8.216 10.329 -2.898 1.00 0.70 H new ATOM 0 HB3 ARG A 52 6.571 10.821 -2.546 1.00 0.70 H new ATOM 0 HG2 ARG A 52 7.139 11.366 -4.855 1.00 0.93 H new ATOM 0 HG3 ARG A 52 6.848 12.834 -3.944 1.00 0.93 H new ATOM 0 HD2 ARG A 52 9.276 13.182 -3.669 1.00 1.14 H new ATOM 0 HD3 ARG A 52 9.607 11.671 -4.494 1.00 1.14 H new ATOM 0 HE ARG A 52 8.059 13.110 -6.311 1.00 1.80 H new ATOM 0 HH11 ARG A 52 11.052 13.708 -4.519 1.00 2.72 H new ATOM 0 HH12 ARG A 52 11.745 14.717 -5.792 1.00 2.72 H new ATOM 0 HH21 ARG A 52 8.970 14.391 -7.944 1.00 3.17 H new ATOM 0 HH22 ARG A 52 10.573 15.101 -7.720 1.00 3.17 H new ATOM 744 N SER A 53 7.486 12.231 0.784 1.00 0.49 N ATOM 745 CA SER A 53 6.594 12.289 1.933 1.00 0.47 C ATOM 746 C SER A 53 7.165 13.193 3.031 1.00 0.46 C ATOM 747 O SER A 53 8.380 13.387 3.125 1.00 0.54 O ATOM 748 CB SER A 53 6.375 10.874 2.469 1.00 0.47 C ATOM 749 OG SER A 53 5.559 10.867 3.617 1.00 0.97 O ATOM 0 H SER A 53 8.465 12.415 1.001 1.00 0.49 H new ATOM 0 HA SER A 53 5.641 12.714 1.619 1.00 0.47 H new ATOM 0 HB2 SER A 53 5.917 10.259 1.694 1.00 0.47 H new ATOM 0 HB3 SER A 53 7.338 10.422 2.706 1.00 0.47 H new ATOM 0 HG SER A 53 4.729 11.354 3.432 1.00 0.97 H new ATOM 755 N ASN A 54 6.273 13.757 3.843 1.00 0.46 N ATOM 756 CA ASN A 54 6.659 14.552 5.007 1.00 0.48 C ATOM 757 C ASN A 54 7.002 13.612 6.163 1.00 0.44 C ATOM 758 O ASN A 54 6.313 12.625 6.358 1.00 0.42 O ATOM 759 CB ASN A 54 5.513 15.516 5.374 1.00 0.60 C ATOM 760 CG ASN A 54 5.411 15.817 6.863 1.00 0.92 C ATOM 761 OD1 ASN A 54 6.075 16.714 7.381 1.00 1.92 O ATOM 762 ND2 ASN A 54 4.549 15.081 7.551 1.00 0.75 N ATOM 0 H ASN A 54 5.265 13.676 3.713 1.00 0.46 H new ATOM 0 HA ASN A 54 7.541 15.153 4.784 1.00 0.48 H new ATOM 0 HB2 ASN A 54 5.652 16.452 4.833 1.00 0.60 H new ATOM 0 HB3 ASN A 54 4.569 15.089 5.035 1.00 0.60 H new ATOM 0 HD21 ASN A 54 4.417 15.249 8.548 1.00 0.75 H new ATOM 0 HD22 ASN A 54 4.018 14.347 7.083 1.00 0.75 H new ATOM 769 N PRO A 55 8.046 13.930 6.957 1.00 0.47 N ATOM 770 CA PRO A 55 8.664 13.013 7.933 1.00 0.49 C ATOM 771 C PRO A 55 7.696 12.111 8.717 1.00 0.45 C ATOM 772 O PRO A 55 7.994 10.934 8.930 1.00 0.46 O ATOM 773 CB PRO A 55 9.390 13.963 8.903 1.00 0.57 C ATOM 774 CG PRO A 55 9.165 15.351 8.387 1.00 0.70 C ATOM 775 CD PRO A 55 8.746 15.213 6.953 1.00 0.53 C ATOM 0 HA PRO A 55 9.297 12.297 7.408 1.00 0.49 H new ATOM 0 HB2 PRO A 55 8.999 13.857 9.915 1.00 0.57 H new ATOM 0 HB3 PRO A 55 10.455 13.733 8.947 1.00 0.57 H new ATOM 0 HG2 PRO A 55 8.396 15.860 8.968 1.00 0.70 H new ATOM 0 HG3 PRO A 55 10.074 15.947 8.469 1.00 0.70 H new ATOM 0 HD2 PRO A 55 8.097 16.030 6.638 1.00 0.53 H new ATOM 0 HD3 PRO A 55 9.602 15.208 6.278 1.00 0.53 H new ATOM 783 N GLU A 56 6.545 12.630 9.125 1.00 0.47 N ATOM 784 CA GLU A 56 5.620 11.859 9.949 1.00 0.49 C ATOM 785 C GLU A 56 4.931 10.797 9.106 1.00 0.40 C ATOM 786 O GLU A 56 4.987 9.587 9.381 1.00 0.39 O ATOM 787 CB GLU A 56 4.567 12.794 10.530 1.00 0.62 C ATOM 788 CG GLU A 56 5.147 14.018 11.205 1.00 0.78 C ATOM 789 CD GLU A 56 5.798 13.700 12.535 1.00 1.73 C ATOM 790 OE1 GLU A 56 6.984 13.316 12.534 1.00 2.71 O ATOM 791 OE2 GLU A 56 5.131 13.831 13.585 1.00 2.02 O ATOM 0 H GLU A 56 6.230 13.574 8.902 1.00 0.47 H new ATOM 0 HA GLU A 56 6.176 11.375 10.752 1.00 0.49 H new ATOM 0 HB2 GLU A 56 3.897 13.113 9.732 1.00 0.62 H new ATOM 0 HB3 GLU A 56 3.963 12.244 11.252 1.00 0.62 H new ATOM 0 HG2 GLU A 56 5.884 14.477 10.545 1.00 0.78 H new ATOM 0 HG3 GLU A 56 4.356 14.752 11.359 1.00 0.78 H new ATOM 798 N ASP A 57 4.312 11.249 8.039 1.00 0.40 N ATOM 799 CA ASP A 57 3.620 10.351 7.156 1.00 0.38 C ATOM 800 C ASP A 57 4.626 9.593 6.307 1.00 0.35 C ATOM 801 O ASP A 57 4.308 8.568 5.719 1.00 0.38 O ATOM 802 CB ASP A 57 2.592 11.102 6.311 1.00 0.47 C ATOM 803 CG ASP A 57 3.170 12.230 5.476 1.00 0.92 C ATOM 804 OD1 ASP A 57 3.422 13.309 6.044 1.00 1.36 O ATOM 805 OD2 ASP A 57 3.347 12.056 4.252 1.00 1.63 O ATOM 0 H ASP A 57 4.276 12.231 7.766 1.00 0.40 H new ATOM 0 HA ASP A 57 3.063 9.621 7.744 1.00 0.38 H new ATOM 0 HB2 ASP A 57 2.097 10.393 5.648 1.00 0.47 H new ATOM 0 HB3 ASP A 57 1.826 11.510 6.970 1.00 0.47 H new ATOM 810 N GLN A 58 5.855 10.094 6.295 1.00 0.34 N ATOM 811 CA GLN A 58 6.980 9.384 5.709 1.00 0.36 C ATOM 812 C GLN A 58 7.175 8.072 6.434 1.00 0.34 C ATOM 813 O GLN A 58 7.391 7.047 5.812 1.00 0.35 O ATOM 814 CB GLN A 58 8.255 10.229 5.794 1.00 0.42 C ATOM 815 CG GLN A 58 9.503 9.526 5.286 1.00 0.51 C ATOM 816 CD GLN A 58 10.753 10.365 5.455 1.00 0.89 C ATOM 817 OE1 GLN A 58 11.120 11.142 4.577 1.00 1.52 O ATOM 818 NE2 GLN A 58 11.427 10.204 6.582 1.00 1.58 N ATOM 0 H GLN A 58 6.097 11.002 6.691 1.00 0.34 H new ATOM 0 HA GLN A 58 6.770 9.191 4.657 1.00 0.36 H new ATOM 0 HB2 GLN A 58 8.109 11.145 5.222 1.00 0.42 H new ATOM 0 HB3 GLN A 58 8.414 10.523 6.831 1.00 0.42 H new ATOM 0 HG2 GLN A 58 9.627 8.584 5.819 1.00 0.51 H new ATOM 0 HG3 GLN A 58 9.374 9.281 4.232 1.00 0.51 H new ATOM 0 HE21 GLN A 58 11.091 9.549 7.288 1.00 1.58 H new ATOM 0 HE22 GLN A 58 12.283 10.735 6.745 1.00 1.58 H new ATOM 827 N VAL A 59 7.080 8.115 7.757 1.00 0.35 N ATOM 828 CA VAL A 59 7.134 6.907 8.564 1.00 0.37 C ATOM 829 C VAL A 59 6.021 5.958 8.148 1.00 0.32 C ATOM 830 O VAL A 59 6.229 4.752 8.044 1.00 0.37 O ATOM 831 CB VAL A 59 6.991 7.210 10.068 1.00 0.45 C ATOM 832 CG1 VAL A 59 7.095 5.937 10.888 1.00 1.08 C ATOM 833 CG2 VAL A 59 8.026 8.222 10.523 1.00 1.27 C ATOM 0 H VAL A 59 6.965 8.975 8.293 1.00 0.35 H new ATOM 0 HA VAL A 59 8.110 6.450 8.397 1.00 0.37 H new ATOM 0 HB VAL A 59 6.003 7.642 10.227 1.00 0.45 H new ATOM 0 HG11 VAL A 59 6.991 6.176 11.946 1.00 1.08 H new ATOM 0 HG12 VAL A 59 6.304 5.248 10.592 1.00 1.08 H new ATOM 0 HG13 VAL A 59 8.065 5.471 10.715 1.00 1.08 H new ATOM 0 HG21 VAL A 59 7.901 8.416 11.588 1.00 1.27 H new ATOM 0 HG22 VAL A 59 9.026 7.827 10.341 1.00 1.27 H new ATOM 0 HG23 VAL A 59 7.896 9.150 9.967 1.00 1.27 H new ATOM 843 N LEU A 60 4.838 6.515 7.889 1.00 0.30 N ATOM 844 CA LEU A 60 3.707 5.693 7.449 1.00 0.31 C ATOM 845 C LEU A 60 3.928 5.141 6.048 1.00 0.33 C ATOM 846 O LEU A 60 3.320 4.154 5.667 1.00 0.41 O ATOM 847 CB LEU A 60 2.398 6.474 7.447 1.00 0.34 C ATOM 848 CG LEU A 60 1.163 5.620 7.145 1.00 0.56 C ATOM 849 CD1 LEU A 60 0.821 4.736 8.327 1.00 1.12 C ATOM 850 CD2 LEU A 60 -0.023 6.481 6.764 1.00 1.18 C ATOM 0 H LEU A 60 4.638 7.512 7.973 1.00 0.30 H new ATOM 0 HA LEU A 60 3.640 4.874 8.165 1.00 0.31 H new ATOM 0 HB2 LEU A 60 2.269 6.950 8.419 1.00 0.34 H new ATOM 0 HB3 LEU A 60 2.464 7.272 6.708 1.00 0.34 H new ATOM 0 HG LEU A 60 1.401 4.983 6.293 1.00 0.56 H new ATOM 0 HD11 LEU A 60 -0.059 4.138 8.091 1.00 1.12 H new ATOM 0 HD12 LEU A 60 1.661 4.076 8.543 1.00 1.12 H new ATOM 0 HD13 LEU A 60 0.615 5.357 9.198 1.00 1.12 H new ATOM 0 HD21 LEU A 60 -0.883 5.844 6.556 1.00 1.18 H new ATOM 0 HD22 LEU A 60 -0.262 7.156 7.586 1.00 1.18 H new ATOM 0 HD23 LEU A 60 0.221 7.063 5.875 1.00 1.18 H new ATOM 862 N TYR A 61 4.776 5.797 5.288 1.00 0.35 N ATOM 863 CA TYR A 61 5.064 5.382 3.917 1.00 0.40 C ATOM 864 C TYR A 61 6.391 4.631 3.876 1.00 0.45 C ATOM 865 O TYR A 61 6.862 4.224 2.815 1.00 0.56 O ATOM 866 CB TYR A 61 5.121 6.589 2.967 1.00 0.42 C ATOM 867 CG TYR A 61 3.858 7.439 2.914 1.00 0.47 C ATOM 868 CD1 TYR A 61 2.678 7.051 3.543 1.00 0.59 C ATOM 869 CD2 TYR A 61 3.860 8.652 2.238 1.00 0.82 C ATOM 870 CE1 TYR A 61 1.546 7.850 3.502 1.00 0.64 C ATOM 871 CE2 TYR A 61 2.734 9.452 2.188 1.00 0.99 C ATOM 872 CZ TYR A 61 1.582 9.051 2.824 1.00 0.78 C ATOM 873 OH TYR A 61 0.463 9.860 2.781 1.00 0.96 O ATOM 0 H TYR A 61 5.286 6.627 5.591 1.00 0.35 H new ATOM 0 HA TYR A 61 4.259 4.727 3.584 1.00 0.40 H new ATOM 0 HB2 TYR A 61 5.954 7.225 3.265 1.00 0.42 H new ATOM 0 HB3 TYR A 61 5.338 6.229 1.962 1.00 0.42 H new ATOM 0 HD1 TYR A 61 2.644 6.110 4.073 1.00 0.59 H new ATOM 0 HD2 TYR A 61 4.761 8.978 1.740 1.00 0.82 H new ATOM 0 HE1 TYR A 61 0.640 7.534 3.998 1.00 0.64 H new ATOM 0 HE2 TYR A 61 2.759 10.389 1.651 1.00 0.99 H new ATOM 0 HH TYR A 61 0.275 10.207 3.678 1.00 0.96 H new ATOM 883 N GLN A 62 6.981 4.471 5.051 1.00 0.43 N ATOM 884 CA GLN A 62 8.273 3.827 5.208 1.00 0.58 C ATOM 885 C GLN A 62 8.143 2.666 6.199 1.00 0.73 C ATOM 886 O GLN A 62 7.271 1.828 6.034 1.00 1.49 O ATOM 887 CB GLN A 62 9.289 4.865 5.709 1.00 0.63 C ATOM 888 CG GLN A 62 10.737 4.406 5.731 1.00 0.99 C ATOM 889 CD GLN A 62 11.526 5.137 6.794 1.00 1.18 C ATOM 890 OE1 GLN A 62 11.608 4.690 7.933 1.00 1.97 O ATOM 891 NE2 GLN A 62 12.090 6.271 6.433 1.00 1.13 N ATOM 0 H GLN A 62 6.571 4.788 5.930 1.00 0.43 H new ATOM 0 HA GLN A 62 8.619 3.429 4.254 1.00 0.58 H new ATOM 0 HB2 GLN A 62 9.217 5.752 5.079 1.00 0.63 H new ATOM 0 HB3 GLN A 62 9.006 5.167 6.718 1.00 0.63 H new ATOM 0 HG2 GLN A 62 10.778 3.333 5.917 1.00 0.99 H new ATOM 0 HG3 GLN A 62 11.191 4.578 4.755 1.00 0.99 H new ATOM 0 HE21 GLN A 62 11.996 6.605 5.474 1.00 1.13 H new ATOM 0 HE22 GLN A 62 12.621 6.815 7.113 1.00 1.13 H new ATOM 900 N THR A 63 8.967 2.692 7.247 1.00 0.44 N ATOM 901 CA THR A 63 9.100 1.604 8.244 1.00 0.48 C ATOM 902 C THR A 63 8.798 0.195 7.686 1.00 0.61 C ATOM 903 O THR A 63 7.641 -0.182 7.517 1.00 1.27 O ATOM 904 CB THR A 63 8.199 1.879 9.457 1.00 0.50 C ATOM 905 OG1 THR A 63 8.078 3.292 9.650 1.00 0.89 O ATOM 906 CG2 THR A 63 8.777 1.251 10.715 1.00 0.89 C ATOM 0 H THR A 63 9.579 3.485 7.440 1.00 0.44 H new ATOM 0 HA THR A 63 10.150 1.602 8.538 1.00 0.48 H new ATOM 0 HB THR A 63 7.220 1.440 9.265 1.00 0.50 H new ATOM 0 HG1 THR A 63 7.399 3.648 9.040 1.00 0.89 H new ATOM 0 HG21 THR A 63 8.121 1.460 11.560 1.00 0.89 H new ATOM 0 HG22 THR A 63 8.861 0.173 10.578 1.00 0.89 H new ATOM 0 HG23 THR A 63 9.764 1.670 10.910 1.00 0.89 H new ATOM 914 N GLU A 64 9.842 -0.594 7.443 1.00 0.53 N ATOM 915 CA GLU A 64 9.676 -1.934 6.873 1.00 0.53 C ATOM 916 C GLU A 64 9.306 -2.969 7.938 1.00 0.58 C ATOM 917 O GLU A 64 9.701 -2.857 9.095 1.00 0.99 O ATOM 918 CB GLU A 64 10.951 -2.357 6.128 1.00 0.67 C ATOM 919 CG GLU A 64 12.259 -1.940 6.799 1.00 1.00 C ATOM 920 CD GLU A 64 12.571 -2.700 8.076 1.00 1.42 C ATOM 921 OE1 GLU A 64 12.659 -3.942 8.028 1.00 1.78 O ATOM 922 OE2 GLU A 64 12.756 -2.050 9.123 1.00 1.96 O ATOM 0 H GLU A 64 10.810 -0.332 7.630 1.00 0.53 H new ATOM 0 HA GLU A 64 8.848 -1.890 6.165 1.00 0.53 H new ATOM 0 HB2 GLU A 64 10.946 -3.441 6.017 1.00 0.67 H new ATOM 0 HB3 GLU A 64 10.924 -1.934 5.124 1.00 0.67 H new ATOM 0 HG2 GLU A 64 13.078 -2.083 6.094 1.00 1.00 H new ATOM 0 HG3 GLU A 64 12.215 -0.874 7.025 1.00 1.00 H new ATOM 929 N ARG A 65 8.529 -3.974 7.545 1.00 0.85 N ATOM 930 CA ARG A 65 8.126 -5.027 8.469 1.00 0.96 C ATOM 931 C ARG A 65 8.806 -6.351 8.136 1.00 1.17 C ATOM 932 O ARG A 65 8.299 -7.133 7.332 1.00 2.02 O ATOM 933 CB ARG A 65 6.604 -5.199 8.461 1.00 0.96 C ATOM 934 CG ARG A 65 6.093 -6.226 9.461 1.00 1.17 C ATOM 935 CD ARG A 65 4.888 -5.709 10.233 1.00 1.09 C ATOM 936 NE ARG A 65 5.247 -4.634 11.155 1.00 1.70 N ATOM 937 CZ ARG A 65 4.864 -4.597 12.436 1.00 2.50 C ATOM 938 NH1 ARG A 65 4.140 -5.582 12.953 1.00 2.93 N ATOM 939 NH2 ARG A 65 5.216 -3.581 13.203 1.00 3.35 N ATOM 0 H ARG A 65 8.168 -4.081 6.597 1.00 0.85 H new ATOM 0 HA ARG A 65 8.442 -4.726 9.468 1.00 0.96 H new ATOM 0 HB2 ARG A 65 6.139 -4.237 8.674 1.00 0.96 H new ATOM 0 HB3 ARG A 65 6.287 -5.492 7.460 1.00 0.96 H new ATOM 0 HG2 ARG A 65 5.823 -7.142 8.936 1.00 1.17 H new ATOM 0 HG3 ARG A 65 6.890 -6.482 10.159 1.00 1.17 H new ATOM 0 HD2 ARG A 65 4.136 -5.348 9.531 1.00 1.09 H new ATOM 0 HD3 ARG A 65 4.436 -6.529 10.791 1.00 1.09 H new ATOM 0 HE ARG A 65 5.822 -3.869 10.802 1.00 1.70 H new ATOM 0 HH11 ARG A 65 3.871 -6.376 12.372 1.00 2.93 H new ATOM 0 HH12 ARG A 65 3.853 -5.545 13.931 1.00 2.93 H new ATOM 0 HH21 ARG A 65 5.781 -2.823 12.819 1.00 3.35 H new ATOM 0 HH22 ARG A 65 4.923 -3.554 14.180 1.00 3.35 H new ATOM 953 N TYR A 66 9.964 -6.579 8.756 1.00 1.04 N ATOM 954 CA TYR A 66 10.677 -7.856 8.656 1.00 1.21 C ATOM 955 C TYR A 66 10.997 -8.219 7.205 1.00 1.23 C ATOM 956 O TYR A 66 11.041 -7.361 6.320 1.00 1.84 O ATOM 957 CB TYR A 66 9.846 -8.978 9.298 1.00 1.67 C ATOM 958 CG TYR A 66 9.530 -8.761 10.762 1.00 2.01 C ATOM 959 CD1 TYR A 66 10.516 -8.889 11.733 1.00 2.29 C ATOM 960 CD2 TYR A 66 8.243 -8.432 11.175 1.00 2.73 C ATOM 961 CE1 TYR A 66 10.227 -8.697 13.071 1.00 3.11 C ATOM 962 CE2 TYR A 66 7.949 -8.240 12.511 1.00 3.58 C ATOM 963 CZ TYR A 66 8.945 -8.373 13.455 1.00 3.72 C ATOM 964 OH TYR A 66 8.655 -8.191 14.788 1.00 4.71 O ATOM 0 H TYR A 66 10.434 -5.887 9.340 1.00 1.04 H new ATOM 0 HA TYR A 66 11.621 -7.745 9.190 1.00 1.21 H new ATOM 0 HB2 TYR A 66 8.911 -9.081 8.748 1.00 1.67 H new ATOM 0 HB3 TYR A 66 10.384 -9.920 9.191 1.00 1.67 H new ATOM 0 HD1 TYR A 66 11.523 -9.142 11.438 1.00 2.29 H new ATOM 0 HD2 TYR A 66 7.460 -8.325 10.439 1.00 2.73 H new ATOM 0 HE1 TYR A 66 11.005 -8.801 13.813 1.00 3.11 H new ATOM 0 HE2 TYR A 66 6.944 -7.987 12.815 1.00 3.58 H new ATOM 0 HH TYR A 66 7.706 -7.966 14.889 1.00 4.71 H new ATOM 974 N ASN A 67 11.269 -9.494 6.985 1.00 1.36 N ATOM 975 CA ASN A 67 11.518 -10.021 5.651 1.00 1.73 C ATOM 976 C ASN A 67 10.537 -11.151 5.362 1.00 1.33 C ATOM 977 O ASN A 67 10.889 -12.333 5.384 1.00 1.73 O ATOM 978 CB ASN A 67 12.975 -10.490 5.509 1.00 2.80 C ATOM 979 CG ASN A 67 13.485 -11.254 6.721 1.00 3.74 C ATOM 980 OD1 ASN A 67 14.011 -10.661 7.664 1.00 4.33 O ATOM 981 ND2 ASN A 67 13.341 -12.566 6.703 1.00 4.38 N ATOM 0 H ASN A 67 11.324 -10.194 7.725 1.00 1.36 H new ATOM 0 HA ASN A 67 11.364 -9.230 4.918 1.00 1.73 H new ATOM 0 HB2 ASN A 67 13.060 -11.124 4.627 1.00 2.80 H new ATOM 0 HB3 ASN A 67 13.613 -9.623 5.341 1.00 2.80 H new ATOM 0 HD21 ASN A 67 13.671 -13.126 7.489 1.00 4.38 H new ATOM 0 HD22 ASN A 67 12.900 -13.020 5.903 1.00 4.38 H new ATOM 988 N GLU A 68 9.298 -10.760 5.094 1.00 1.25 N ATOM 989 CA GLU A 68 8.195 -11.694 4.953 1.00 1.47 C ATOM 990 C GLU A 68 8.198 -12.380 3.583 1.00 1.24 C ATOM 991 O GLU A 68 9.177 -12.331 2.839 1.00 1.43 O ATOM 992 CB GLU A 68 6.876 -10.940 5.159 1.00 2.17 C ATOM 993 CG GLU A 68 5.881 -11.661 6.056 1.00 2.67 C ATOM 994 CD GLU A 68 6.411 -11.878 7.455 1.00 3.24 C ATOM 995 OE1 GLU A 68 7.029 -12.932 7.706 1.00 3.64 O ATOM 996 OE2 GLU A 68 6.185 -11.013 8.323 1.00 3.70 O ATOM 0 H GLU A 68 9.032 -9.783 4.968 1.00 1.25 H new ATOM 0 HA GLU A 68 8.307 -12.474 5.706 1.00 1.47 H new ATOM 0 HB2 GLU A 68 7.093 -9.962 5.588 1.00 2.17 H new ATOM 0 HB3 GLU A 68 6.413 -10.767 4.187 1.00 2.17 H new ATOM 0 HG2 GLU A 68 4.958 -11.083 6.107 1.00 2.67 H new ATOM 0 HG3 GLU A 68 5.630 -12.625 5.613 1.00 2.67 H new ATOM 1003 N ASP A 69 7.067 -12.983 3.262 1.00 1.13 N ATOM 1004 CA ASP A 69 6.899 -13.806 2.070 1.00 0.98 C ATOM 1005 C ASP A 69 5.433 -14.086 1.842 1.00 0.97 C ATOM 1006 O ASP A 69 4.738 -14.500 2.770 1.00 1.66 O ATOM 1007 CB ASP A 69 7.642 -15.140 2.213 1.00 1.44 C ATOM 1008 CG ASP A 69 6.975 -16.302 1.494 1.00 1.51 C ATOM 1009 OD1 ASP A 69 7.133 -16.421 0.264 1.00 1.63 O ATOM 1010 OD2 ASP A 69 6.301 -17.109 2.158 1.00 2.20 O ATOM 0 H ASP A 69 6.223 -12.915 3.830 1.00 1.13 H new ATOM 0 HA ASP A 69 7.313 -13.259 1.223 1.00 0.98 H new ATOM 0 HB2 ASP A 69 8.655 -15.022 1.829 1.00 1.44 H new ATOM 0 HB3 ASP A 69 7.729 -15.384 3.272 1.00 1.44 H new ATOM 1015 N SER A 70 4.968 -13.826 0.622 1.00 0.78 N ATOM 1016 CA SER A 70 3.651 -14.267 0.206 1.00 0.76 C ATOM 1017 C SER A 70 2.594 -13.827 1.216 1.00 0.82 C ATOM 1018 O SER A 70 1.824 -14.632 1.742 1.00 1.01 O ATOM 1019 CB SER A 70 3.715 -15.782 0.064 1.00 0.96 C ATOM 1020 OG SER A 70 4.735 -16.151 -0.854 1.00 1.41 O ATOM 0 H SER A 70 5.487 -13.313 -0.090 1.00 0.78 H new ATOM 0 HA SER A 70 3.364 -13.819 -0.745 1.00 0.76 H new ATOM 0 HB2 SER A 70 3.909 -16.237 1.035 1.00 0.96 H new ATOM 0 HB3 SER A 70 2.753 -16.162 -0.279 1.00 0.96 H new ATOM 0 HG SER A 70 5.611 -15.927 -0.477 1.00 1.41 H new ATOM 1026 N PHE A 71 2.568 -12.529 1.465 1.00 0.78 N ATOM 1027 CA PHE A 71 1.822 -11.976 2.578 1.00 0.94 C ATOM 1028 C PHE A 71 0.626 -11.164 2.094 1.00 0.58 C ATOM 1029 O PHE A 71 0.725 -10.419 1.119 1.00 0.79 O ATOM 1030 CB PHE A 71 2.755 -11.137 3.474 1.00 1.57 C ATOM 1031 CG PHE A 71 3.709 -10.230 2.747 1.00 1.10 C ATOM 1032 CD1 PHE A 71 4.796 -10.764 2.082 1.00 1.38 C ATOM 1033 CD2 PHE A 71 3.555 -8.853 2.769 1.00 1.10 C ATOM 1034 CE1 PHE A 71 5.708 -9.958 1.452 1.00 1.18 C ATOM 1035 CE2 PHE A 71 4.469 -8.033 2.128 1.00 1.29 C ATOM 1036 CZ PHE A 71 5.551 -8.591 1.471 1.00 1.02 C ATOM 0 H PHE A 71 3.061 -11.834 0.904 1.00 0.78 H new ATOM 0 HA PHE A 71 1.426 -12.798 3.174 1.00 0.94 H new ATOM 0 HB2 PHE A 71 2.141 -10.531 4.140 1.00 1.57 H new ATOM 0 HB3 PHE A 71 3.333 -11.815 4.102 1.00 1.57 H new ATOM 0 HD1 PHE A 71 4.929 -11.835 2.058 1.00 1.38 H new ATOM 0 HD2 PHE A 71 2.716 -8.416 3.290 1.00 1.10 H new ATOM 0 HE1 PHE A 71 6.552 -10.397 0.940 1.00 1.18 H new ATOM 0 HE2 PHE A 71 4.337 -6.961 2.141 1.00 1.29 H new ATOM 0 HZ PHE A 71 6.270 -7.956 0.975 1.00 1.02 H new ATOM 1046 N GLY A 72 -0.504 -11.323 2.774 1.00 0.46 N ATOM 1047 CA GLY A 72 -1.723 -10.681 2.338 1.00 0.78 C ATOM 1048 C GLY A 72 -2.426 -9.915 3.428 1.00 0.58 C ATOM 1049 O GLY A 72 -2.412 -10.309 4.593 1.00 0.74 O ATOM 0 H GLY A 72 -0.594 -11.886 3.620 1.00 0.46 H new ATOM 0 HA2 GLY A 72 -1.492 -10.000 1.519 1.00 0.78 H new ATOM 0 HA3 GLY A 72 -2.401 -11.438 1.943 1.00 0.78 H new ATOM 1053 N TYR A 73 -3.057 -8.829 3.038 1.00 0.39 N ATOM 1054 CA TYR A 73 -3.755 -7.969 3.971 1.00 0.36 C ATOM 1055 C TYR A 73 -5.257 -8.187 3.885 1.00 0.34 C ATOM 1056 O TYR A 73 -5.816 -8.299 2.793 1.00 0.43 O ATOM 1057 CB TYR A 73 -3.428 -6.511 3.675 1.00 0.51 C ATOM 1058 CG TYR A 73 -1.947 -6.209 3.689 1.00 0.58 C ATOM 1059 CD1 TYR A 73 -1.156 -6.475 2.579 1.00 0.78 C ATOM 1060 CD2 TYR A 73 -1.337 -5.674 4.813 1.00 0.72 C ATOM 1061 CE1 TYR A 73 0.197 -6.214 2.587 1.00 0.97 C ATOM 1062 CE2 TYR A 73 0.019 -5.411 4.830 1.00 0.89 C ATOM 1063 CZ TYR A 73 0.780 -5.685 3.714 1.00 0.99 C ATOM 1064 OH TYR A 73 2.126 -5.434 3.726 1.00 1.21 O ATOM 0 H TYR A 73 -3.101 -8.517 2.068 1.00 0.39 H new ATOM 0 HA TYR A 73 -3.426 -8.217 4.980 1.00 0.36 H new ATOM 0 HB2 TYR A 73 -3.835 -6.247 2.699 1.00 0.51 H new ATOM 0 HB3 TYR A 73 -3.926 -5.879 4.410 1.00 0.51 H new ATOM 0 HD1 TYR A 73 -1.610 -6.894 1.693 1.00 0.78 H new ATOM 0 HD2 TYR A 73 -1.931 -5.459 5.689 1.00 0.72 H new ATOM 0 HE1 TYR A 73 0.796 -6.424 1.713 1.00 0.97 H new ATOM 0 HE2 TYR A 73 0.480 -4.993 5.713 1.00 0.89 H new ATOM 0 HH TYR A 73 2.412 -5.142 2.835 1.00 1.21 H new ATOM 1074 N ASP A 74 -5.900 -8.258 5.038 1.00 0.35 N ATOM 1075 CA ASP A 74 -7.344 -8.438 5.100 1.00 0.39 C ATOM 1076 C ASP A 74 -8.049 -7.108 5.347 1.00 0.34 C ATOM 1077 O ASP A 74 -7.862 -6.471 6.380 1.00 0.44 O ATOM 1078 CB ASP A 74 -7.722 -9.455 6.188 1.00 0.57 C ATOM 1079 CG ASP A 74 -7.140 -9.123 7.551 1.00 1.58 C ATOM 1080 OD1 ASP A 74 -5.951 -9.429 7.783 1.00 1.92 O ATOM 1081 OD2 ASP A 74 -7.866 -8.561 8.397 1.00 2.47 O ATOM 0 H ASP A 74 -5.444 -8.194 5.948 1.00 0.35 H new ATOM 0 HA ASP A 74 -7.674 -8.826 4.136 1.00 0.39 H new ATOM 0 HB2 ASP A 74 -8.808 -9.505 6.267 1.00 0.57 H new ATOM 0 HB3 ASP A 74 -7.379 -10.444 5.886 1.00 0.57 H new ATOM 1086 N ILE A 75 -8.837 -6.687 4.368 1.00 0.28 N ATOM 1087 CA ILE A 75 -9.642 -5.478 4.477 1.00 0.27 C ATOM 1088 C ILE A 75 -11.117 -5.859 4.570 1.00 0.27 C ATOM 1089 O ILE A 75 -11.792 -5.981 3.551 1.00 0.26 O ATOM 1090 CB ILE A 75 -9.491 -4.534 3.252 1.00 0.25 C ATOM 1091 CG1 ILE A 75 -8.046 -4.147 2.950 1.00 0.28 C ATOM 1092 CG2 ILE A 75 -10.282 -3.260 3.477 1.00 0.29 C ATOM 1093 CD1 ILE A 75 -7.210 -5.218 2.304 1.00 0.38 C ATOM 0 H ILE A 75 -8.937 -7.173 3.477 1.00 0.28 H new ATOM 0 HA ILE A 75 -9.291 -4.955 5.366 1.00 0.27 H new ATOM 0 HB ILE A 75 -9.870 -5.096 2.398 1.00 0.25 H new ATOM 0 HG12 ILE A 75 -8.051 -3.272 2.299 1.00 0.28 H new ATOM 0 HG13 ILE A 75 -7.566 -3.848 3.882 1.00 0.28 H new ATOM 0 HG21 ILE A 75 -10.170 -2.605 2.613 1.00 0.29 H new ATOM 0 HG22 ILE A 75 -11.335 -3.505 3.612 1.00 0.29 H new ATOM 0 HG23 ILE A 75 -9.910 -2.753 4.367 1.00 0.29 H new ATOM 0 HD11 ILE A 75 -6.202 -4.839 2.133 1.00 0.38 H new ATOM 0 HD12 ILE A 75 -7.164 -6.088 2.959 1.00 0.38 H new ATOM 0 HD13 ILE A 75 -7.657 -5.503 1.352 1.00 0.38 H new ATOM 1105 N PRO A 76 -11.643 -6.068 5.775 1.00 0.32 N ATOM 1106 CA PRO A 76 -13.053 -6.411 5.956 1.00 0.35 C ATOM 1107 C PRO A 76 -13.975 -5.282 5.490 1.00 0.34 C ATOM 1108 O PRO A 76 -13.896 -4.159 5.992 1.00 0.41 O ATOM 1109 CB PRO A 76 -13.194 -6.621 7.465 1.00 0.45 C ATOM 1110 CG PRO A 76 -11.802 -6.770 7.984 1.00 0.59 C ATOM 1111 CD PRO A 76 -10.918 -5.997 7.049 1.00 0.41 C ATOM 0 HA PRO A 76 -13.336 -7.286 5.371 1.00 0.35 H new ATOM 0 HB2 PRO A 76 -13.698 -5.775 7.933 1.00 0.45 H new ATOM 0 HB3 PRO A 76 -13.790 -7.507 7.683 1.00 0.45 H new ATOM 0 HG2 PRO A 76 -11.723 -6.385 9.001 1.00 0.59 H new ATOM 0 HG3 PRO A 76 -11.510 -7.820 8.017 1.00 0.59 H new ATOM 0 HD2 PRO A 76 -10.783 -4.967 7.380 1.00 0.41 H new ATOM 0 HD3 PRO A 76 -9.925 -6.440 6.974 1.00 0.41 H new ATOM 1119 N ILE A 77 -14.846 -5.579 4.534 1.00 0.31 N ATOM 1120 CA ILE A 77 -15.702 -4.561 3.932 1.00 0.30 C ATOM 1121 C ILE A 77 -17.175 -4.912 4.107 1.00 0.36 C ATOM 1122 O ILE A 77 -17.552 -6.082 4.060 1.00 0.40 O ATOM 1123 CB ILE A 77 -15.400 -4.405 2.422 1.00 0.26 C ATOM 1124 CG1 ILE A 77 -13.938 -4.013 2.200 1.00 0.28 C ATOM 1125 CG2 ILE A 77 -16.329 -3.378 1.782 1.00 0.30 C ATOM 1126 CD1 ILE A 77 -13.560 -3.867 0.741 1.00 0.49 C ATOM 0 H ILE A 77 -14.979 -6.517 4.157 1.00 0.31 H new ATOM 0 HA ILE A 77 -15.492 -3.621 4.442 1.00 0.30 H new ATOM 0 HB ILE A 77 -15.576 -5.369 1.944 1.00 0.26 H new ATOM 0 HG12 ILE A 77 -13.742 -3.071 2.713 1.00 0.28 H new ATOM 0 HG13 ILE A 77 -13.296 -4.765 2.659 1.00 0.28 H new ATOM 0 HG21 ILE A 77 -16.096 -3.288 0.721 1.00 0.30 H new ATOM 0 HG22 ILE A 77 -17.364 -3.700 1.900 1.00 0.30 H new ATOM 0 HG23 ILE A 77 -16.192 -2.412 2.267 1.00 0.30 H new ATOM 0 HD11 ILE A 77 -12.509 -3.588 0.664 1.00 0.49 H new ATOM 0 HD12 ILE A 77 -13.723 -4.814 0.226 1.00 0.49 H new ATOM 0 HD13 ILE A 77 -14.176 -3.094 0.281 1.00 0.49 H new ATOM 1138 N LYS A 78 -17.997 -3.897 4.332 1.00 0.44 N ATOM 1139 CA LYS A 78 -19.441 -4.077 4.381 1.00 0.54 C ATOM 1140 C LYS A 78 -20.155 -3.114 3.439 1.00 0.55 C ATOM 1141 O LYS A 78 -21.343 -3.279 3.165 1.00 0.71 O ATOM 1142 CB LYS A 78 -19.972 -3.858 5.799 1.00 0.71 C ATOM 1143 CG LYS A 78 -19.752 -5.028 6.739 1.00 1.23 C ATOM 1144 CD LYS A 78 -20.426 -4.769 8.075 1.00 1.82 C ATOM 1145 CE LYS A 78 -20.454 -6.009 8.946 1.00 2.66 C ATOM 1146 NZ LYS A 78 -21.198 -5.768 10.211 1.00 3.32 N ATOM 0 H LYS A 78 -17.687 -2.937 4.484 1.00 0.44 H new ATOM 0 HA LYS A 78 -19.642 -5.101 4.067 1.00 0.54 H new ATOM 0 HB2 LYS A 78 -19.493 -2.974 6.221 1.00 0.71 H new ATOM 0 HB3 LYS A 78 -21.040 -3.647 5.745 1.00 0.71 H new ATOM 0 HG2 LYS A 78 -20.151 -5.940 6.294 1.00 1.23 H new ATOM 0 HG3 LYS A 78 -18.684 -5.187 6.888 1.00 1.23 H new ATOM 0 HD2 LYS A 78 -19.900 -3.970 8.598 1.00 1.82 H new ATOM 0 HD3 LYS A 78 -21.445 -4.422 7.906 1.00 1.82 H new ATOM 0 HE2 LYS A 78 -20.920 -6.829 8.399 1.00 2.66 H new ATOM 0 HE3 LYS A 78 -19.434 -6.317 9.175 1.00 2.66 H new ATOM 0 HZ1 LYS A 78 -21.199 -6.636 10.784 1.00 3.32 H new ATOM 0 HZ2 LYS A 78 -20.739 -5.002 10.743 1.00 3.32 H new ATOM 0 HZ3 LYS A 78 -22.178 -5.498 9.991 1.00 3.32 H new ATOM 1160 N GLU A 79 -19.436 -2.121 2.926 1.00 0.46 N ATOM 1161 CA GLU A 79 -20.079 -1.027 2.218 1.00 0.47 C ATOM 1162 C GLU A 79 -19.738 -1.049 0.736 1.00 0.36 C ATOM 1163 O GLU A 79 -18.835 -1.767 0.303 1.00 0.39 O ATOM 1164 CB GLU A 79 -19.644 0.304 2.827 1.00 0.60 C ATOM 1165 CG GLU A 79 -20.073 0.491 4.273 1.00 1.02 C ATOM 1166 CD GLU A 79 -21.563 0.708 4.406 1.00 1.41 C ATOM 1167 OE1 GLU A 79 -22.023 1.837 4.131 1.00 1.87 O ATOM 1168 OE2 GLU A 79 -22.281 -0.239 4.777 1.00 2.16 O ATOM 0 H GLU A 79 -18.420 -2.053 2.987 1.00 0.46 H new ATOM 0 HA GLU A 79 -21.158 -1.145 2.318 1.00 0.47 H new ATOM 0 HB2 GLU A 79 -18.558 0.382 2.768 1.00 0.60 H new ATOM 0 HB3 GLU A 79 -20.055 1.117 2.229 1.00 0.60 H new ATOM 0 HG2 GLU A 79 -19.783 -0.386 4.852 1.00 1.02 H new ATOM 0 HG3 GLU A 79 -19.544 1.344 4.699 1.00 1.02 H new ATOM 1175 N GLU A 80 -20.459 -0.251 -0.032 1.00 0.38 N ATOM 1176 CA GLU A 80 -20.192 -0.104 -1.450 1.00 0.34 C ATOM 1177 C GLU A 80 -19.547 1.238 -1.735 1.00 0.35 C ATOM 1178 O GLU A 80 -19.277 2.021 -0.822 1.00 0.52 O ATOM 1179 CB GLU A 80 -21.481 -0.236 -2.256 1.00 0.42 C ATOM 1180 CG GLU A 80 -21.966 -1.660 -2.407 1.00 0.71 C ATOM 1181 CD GLU A 80 -23.475 -1.740 -2.389 1.00 0.84 C ATOM 1182 OE1 GLU A 80 -24.100 -1.450 -3.428 1.00 0.90 O ATOM 1183 OE2 GLU A 80 -24.045 -2.076 -1.336 1.00 1.20 O ATOM 0 H GLU A 80 -21.241 0.309 0.308 1.00 0.38 H new ATOM 0 HA GLU A 80 -19.506 -0.897 -1.747 1.00 0.34 H new ATOM 0 HB2 GLU A 80 -22.261 0.354 -1.775 1.00 0.42 H new ATOM 0 HB3 GLU A 80 -21.324 0.191 -3.247 1.00 0.42 H new ATOM 0 HG2 GLU A 80 -21.590 -2.075 -3.342 1.00 0.71 H new ATOM 0 HG3 GLU A 80 -21.559 -2.271 -1.601 1.00 0.71 H new ATOM 1190 N GLY A 81 -19.291 1.491 -3.002 1.00 0.30 N ATOM 1191 CA GLY A 81 -18.695 2.740 -3.407 1.00 0.28 C ATOM 1192 C GLY A 81 -17.421 2.510 -4.174 1.00 0.24 C ATOM 1193 O GLY A 81 -17.107 1.370 -4.526 1.00 0.28 O ATOM 0 H GLY A 81 -19.488 0.846 -3.767 1.00 0.30 H new ATOM 0 HA2 GLY A 81 -19.399 3.299 -4.024 1.00 0.28 H new ATOM 0 HA3 GLY A 81 -18.488 3.350 -2.527 1.00 0.28 H new ATOM 1197 N GLU A 82 -16.669 3.569 -4.418 1.00 0.22 N ATOM 1198 CA GLU A 82 -15.457 3.443 -5.201 1.00 0.23 C ATOM 1199 C GLU A 82 -14.266 3.365 -4.263 1.00 0.22 C ATOM 1200 O GLU A 82 -13.818 4.378 -3.742 1.00 0.26 O ATOM 1201 CB GLU A 82 -15.305 4.638 -6.146 1.00 0.29 C ATOM 1202 CG GLU A 82 -16.581 5.000 -6.891 1.00 0.42 C ATOM 1203 CD GLU A 82 -17.053 3.912 -7.832 1.00 1.11 C ATOM 1204 OE1 GLU A 82 -17.800 3.010 -7.392 1.00 1.96 O ATOM 1205 OE2 GLU A 82 -16.692 3.968 -9.026 1.00 1.30 O ATOM 0 H GLU A 82 -16.874 4.513 -4.090 1.00 0.22 H new ATOM 0 HA GLU A 82 -15.509 2.536 -5.803 1.00 0.23 H new ATOM 0 HB2 GLU A 82 -14.973 5.503 -5.572 1.00 0.29 H new ATOM 0 HB3 GLU A 82 -14.522 4.418 -6.872 1.00 0.29 H new ATOM 0 HG2 GLU A 82 -17.368 5.212 -6.168 1.00 0.42 H new ATOM 0 HG3 GLU A 82 -16.415 5.915 -7.459 1.00 0.42 H new ATOM 1212 N TYR A 83 -13.717 2.184 -4.063 1.00 0.21 N ATOM 1213 CA TYR A 83 -12.670 2.049 -3.068 1.00 0.22 C ATOM 1214 C TYR A 83 -11.343 2.233 -3.736 1.00 0.22 C ATOM 1215 O TYR A 83 -11.004 1.536 -4.679 1.00 0.22 O ATOM 1216 CB TYR A 83 -12.691 0.679 -2.388 1.00 0.25 C ATOM 1217 CG TYR A 83 -13.829 0.471 -1.423 1.00 0.27 C ATOM 1218 CD1 TYR A 83 -15.121 0.806 -1.783 1.00 0.59 C ATOM 1219 CD2 TYR A 83 -13.619 -0.050 -0.157 1.00 0.67 C ATOM 1220 CE1 TYR A 83 -16.166 0.628 -0.919 1.00 0.60 C ATOM 1221 CE2 TYR A 83 -14.664 -0.233 0.716 1.00 0.71 C ATOM 1222 CZ TYR A 83 -15.899 0.070 0.368 1.00 0.39 C ATOM 1223 OH TYR A 83 -16.989 -0.066 1.190 1.00 0.44 O ATOM 0 H TYR A 83 -13.967 1.328 -4.558 1.00 0.21 H new ATOM 0 HA TYR A 83 -12.838 2.806 -2.302 1.00 0.22 H new ATOM 0 HB2 TYR A 83 -12.739 -0.092 -3.157 1.00 0.25 H new ATOM 0 HB3 TYR A 83 -11.751 0.539 -1.855 1.00 0.25 H new ATOM 0 HD1 TYR A 83 -15.309 1.216 -2.764 1.00 0.59 H new ATOM 0 HD2 TYR A 83 -12.618 -0.317 0.149 1.00 0.67 H new ATOM 0 HE1 TYR A 83 -17.171 0.903 -1.204 1.00 0.60 H new ATOM 0 HE2 TYR A 83 -14.471 -0.631 1.701 1.00 0.71 H new ATOM 0 HH TYR A 83 -17.406 -0.940 1.038 1.00 0.44 H new ATOM 1233 N VAL A 84 -10.589 3.163 -3.225 1.00 0.22 N ATOM 1234 CA VAL A 84 -9.346 3.521 -3.847 1.00 0.22 C ATOM 1235 C VAL A 84 -8.189 3.006 -3.021 1.00 0.23 C ATOM 1236 O VAL A 84 -7.888 3.510 -1.938 1.00 0.24 O ATOM 1237 CB VAL A 84 -9.262 5.043 -4.101 1.00 0.22 C ATOM 1238 CG1 VAL A 84 -7.856 5.468 -4.493 1.00 0.26 C ATOM 1239 CG2 VAL A 84 -10.243 5.416 -5.194 1.00 0.25 C ATOM 0 H VAL A 84 -10.813 3.688 -2.379 1.00 0.22 H new ATOM 0 HA VAL A 84 -9.290 3.046 -4.827 1.00 0.22 H new ATOM 0 HB VAL A 84 -9.515 5.564 -3.177 1.00 0.22 H new ATOM 0 HG11 VAL A 84 -7.836 6.544 -4.664 1.00 0.26 H new ATOM 0 HG12 VAL A 84 -7.162 5.214 -3.691 1.00 0.26 H new ATOM 0 HG13 VAL A 84 -7.561 4.950 -5.406 1.00 0.26 H new ATOM 0 HG21 VAL A 84 -10.190 6.489 -5.380 1.00 0.25 H new ATOM 0 HG22 VAL A 84 -9.992 4.877 -6.108 1.00 0.25 H new ATOM 0 HG23 VAL A 84 -11.253 5.151 -4.882 1.00 0.25 H new ATOM 1249 N LEU A 85 -7.580 1.956 -3.536 1.00 0.25 N ATOM 1250 CA LEU A 85 -6.495 1.292 -2.858 1.00 0.30 C ATOM 1251 C LEU A 85 -5.174 1.911 -3.275 1.00 0.29 C ATOM 1252 O LEU A 85 -4.692 1.676 -4.376 1.00 0.31 O ATOM 1253 CB LEU A 85 -6.509 -0.197 -3.207 1.00 0.40 C ATOM 1254 CG LEU A 85 -5.555 -1.061 -2.392 1.00 0.92 C ATOM 1255 CD1 LEU A 85 -6.106 -1.293 -0.999 1.00 1.56 C ATOM 1256 CD2 LEU A 85 -5.291 -2.381 -3.099 1.00 1.13 C ATOM 0 H LEU A 85 -7.826 1.543 -4.435 1.00 0.25 H new ATOM 0 HA LEU A 85 -6.615 1.408 -1.781 1.00 0.30 H new ATOM 0 HB2 LEU A 85 -7.522 -0.576 -3.073 1.00 0.40 H new ATOM 0 HB3 LEU A 85 -6.264 -0.309 -4.263 1.00 0.40 H new ATOM 0 HG LEU A 85 -4.606 -0.533 -2.298 1.00 0.92 H new ATOM 0 HD11 LEU A 85 -5.411 -1.912 -0.431 1.00 1.56 H new ATOM 0 HD12 LEU A 85 -6.234 -0.335 -0.494 1.00 1.56 H new ATOM 0 HD13 LEU A 85 -7.069 -1.799 -1.068 1.00 1.56 H new ATOM 0 HD21 LEU A 85 -4.607 -2.984 -2.501 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -6.230 -2.919 -3.229 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -4.846 -2.188 -4.075 1.00 1.13 H new ATOM 1268 N VAL A 86 -4.601 2.707 -2.399 1.00 0.31 N ATOM 1269 CA VAL A 86 -3.321 3.338 -2.656 1.00 0.34 C ATOM 1270 C VAL A 86 -2.292 2.778 -1.682 1.00 0.32 C ATOM 1271 O VAL A 86 -2.307 3.105 -0.500 1.00 0.32 O ATOM 1272 CB VAL A 86 -3.390 4.872 -2.480 1.00 0.41 C ATOM 1273 CG1 VAL A 86 -2.059 5.517 -2.846 1.00 1.05 C ATOM 1274 CG2 VAL A 86 -4.517 5.463 -3.311 1.00 1.14 C ATOM 0 H VAL A 86 -5.006 2.936 -1.491 1.00 0.31 H new ATOM 0 HA VAL A 86 -3.041 3.127 -3.688 1.00 0.34 H new ATOM 0 HB VAL A 86 -3.596 5.082 -1.430 1.00 0.41 H new ATOM 0 HG11 VAL A 86 -2.130 6.597 -2.715 1.00 1.05 H new ATOM 0 HG12 VAL A 86 -1.274 5.124 -2.200 1.00 1.05 H new ATOM 0 HG13 VAL A 86 -1.820 5.293 -3.885 1.00 1.05 H new ATOM 0 HG21 VAL A 86 -4.545 6.543 -3.170 1.00 1.14 H new ATOM 0 HG22 VAL A 86 -4.349 5.239 -4.364 1.00 1.14 H new ATOM 0 HG23 VAL A 86 -5.467 5.031 -2.995 1.00 1.14 H new ATOM 1284 N LEU A 87 -1.426 1.907 -2.152 1.00 0.33 N ATOM 1285 CA LEU A 87 -0.405 1.356 -1.279 1.00 0.32 C ATOM 1286 C LEU A 87 0.953 1.973 -1.586 1.00 0.28 C ATOM 1287 O LEU A 87 1.312 2.166 -2.749 1.00 0.29 O ATOM 1288 CB LEU A 87 -0.359 -0.197 -1.303 1.00 0.42 C ATOM 1289 CG LEU A 87 -0.566 -0.934 -2.648 1.00 0.57 C ATOM 1290 CD1 LEU A 87 -1.994 -0.795 -3.152 1.00 1.37 C ATOM 1291 CD2 LEU A 87 0.418 -0.469 -3.704 1.00 1.44 C ATOM 0 H LEU A 87 -1.404 1.568 -3.114 1.00 0.33 H new ATOM 0 HA LEU A 87 -0.677 1.624 -0.258 1.00 0.32 H new ATOM 0 HB2 LEU A 87 0.609 -0.504 -0.906 1.00 0.42 H new ATOM 0 HB3 LEU A 87 -1.118 -0.559 -0.609 1.00 0.42 H new ATOM 0 HG LEU A 87 -0.377 -1.990 -2.456 1.00 0.57 H new ATOM 0 HD11 LEU A 87 -2.099 -1.326 -4.098 1.00 1.37 H new ATOM 0 HD12 LEU A 87 -2.681 -1.219 -2.420 1.00 1.37 H new ATOM 0 HD13 LEU A 87 -2.227 0.260 -3.300 1.00 1.37 H new ATOM 0 HD21 LEU A 87 0.239 -1.011 -4.632 1.00 1.44 H new ATOM 0 HD22 LEU A 87 0.288 0.599 -3.877 1.00 1.44 H new ATOM 0 HD23 LEU A 87 1.435 -0.661 -3.363 1.00 1.44 H new ATOM 1303 N LYS A 88 1.682 2.338 -0.541 1.00 0.28 N ATOM 1304 CA LYS A 88 2.990 2.954 -0.723 1.00 0.28 C ATOM 1305 C LYS A 88 4.097 1.918 -0.551 1.00 0.28 C ATOM 1306 O LYS A 88 4.215 1.298 0.498 1.00 0.39 O ATOM 1307 CB LYS A 88 3.187 4.092 0.279 1.00 0.35 C ATOM 1308 CG LYS A 88 3.803 5.354 -0.300 1.00 0.67 C ATOM 1309 CD LYS A 88 2.798 6.123 -1.141 1.00 1.91 C ATOM 1310 CE LYS A 88 3.320 7.502 -1.507 1.00 2.70 C ATOM 1311 NZ LYS A 88 2.361 8.264 -2.353 1.00 3.73 N ATOM 0 H LYS A 88 1.395 2.221 0.431 1.00 0.28 H new ATOM 0 HA LYS A 88 3.039 3.359 -1.734 1.00 0.28 H new ATOM 0 HB2 LYS A 88 2.220 4.344 0.715 1.00 0.35 H new ATOM 0 HB3 LYS A 88 3.820 3.736 1.092 1.00 0.35 H new ATOM 0 HG2 LYS A 88 4.165 5.989 0.509 1.00 0.67 H new ATOM 0 HG3 LYS A 88 4.667 5.092 -0.911 1.00 0.67 H new ATOM 0 HD2 LYS A 88 2.578 5.563 -2.050 1.00 1.91 H new ATOM 0 HD3 LYS A 88 1.861 6.221 -0.592 1.00 1.91 H new ATOM 0 HE2 LYS A 88 3.523 8.064 -0.596 1.00 2.70 H new ATOM 0 HE3 LYS A 88 4.267 7.400 -2.037 1.00 2.70 H new ATOM 0 HZ1 LYS A 88 2.271 9.234 -1.989 1.00 3.73 H new ATOM 0 HZ2 LYS A 88 2.709 8.293 -3.333 1.00 3.73 H new ATOM 0 HZ3 LYS A 88 1.431 7.798 -2.330 1.00 3.73 H new ATOM 1325 N PHE A 89 4.899 1.730 -1.578 1.00 0.27 N ATOM 1326 CA PHE A 89 6.007 0.795 -1.506 1.00 0.28 C ATOM 1327 C PHE A 89 7.332 1.520 -1.429 1.00 0.28 C ATOM 1328 O PHE A 89 7.527 2.554 -2.073 1.00 0.29 O ATOM 1329 CB PHE A 89 6.011 -0.159 -2.699 1.00 0.32 C ATOM 1330 CG PHE A 89 5.061 -1.301 -2.531 1.00 0.32 C ATOM 1331 CD1 PHE A 89 5.244 -2.195 -1.491 1.00 0.37 C ATOM 1332 CD2 PHE A 89 3.992 -1.486 -3.391 1.00 0.37 C ATOM 1333 CE1 PHE A 89 4.387 -3.254 -1.309 1.00 0.44 C ATOM 1334 CE2 PHE A 89 3.130 -2.547 -3.215 1.00 0.42 C ATOM 1335 CZ PHE A 89 3.325 -3.432 -2.177 1.00 0.45 C ATOM 0 H PHE A 89 4.806 2.211 -2.473 1.00 0.27 H new ATOM 0 HA PHE A 89 5.872 0.212 -0.595 1.00 0.28 H new ATOM 0 HB2 PHE A 89 5.751 0.394 -3.602 1.00 0.32 H new ATOM 0 HB3 PHE A 89 7.019 -0.549 -2.843 1.00 0.32 H new ATOM 0 HD1 PHE A 89 6.073 -2.059 -0.812 1.00 0.37 H new ATOM 0 HD2 PHE A 89 3.832 -0.794 -4.205 1.00 0.37 H new ATOM 0 HE1 PHE A 89 4.542 -3.944 -0.492 1.00 0.44 H new ATOM 0 HE2 PHE A 89 2.300 -2.685 -3.892 1.00 0.42 H new ATOM 0 HZ PHE A 89 2.649 -4.264 -2.041 1.00 0.45 H new ATOM 1345 N ALA A 90 8.235 0.969 -0.637 1.00 0.32 N ATOM 1346 CA ALA A 90 9.571 1.530 -0.495 1.00 0.36 C ATOM 1347 C ALA A 90 10.609 0.421 -0.452 1.00 0.42 C ATOM 1348 O ALA A 90 10.415 -0.588 0.233 1.00 0.51 O ATOM 1349 CB ALA A 90 9.661 2.398 0.748 1.00 0.44 C ATOM 0 H ALA A 90 8.068 0.131 -0.080 1.00 0.32 H new ATOM 0 HA ALA A 90 9.774 2.159 -1.362 1.00 0.36 H new ATOM 0 HB1 ALA A 90 10.668 2.807 0.834 1.00 0.44 H new ATOM 0 HB2 ALA A 90 8.943 3.215 0.674 1.00 0.44 H new ATOM 0 HB3 ALA A 90 9.437 1.796 1.629 1.00 0.44 H new ATOM 1355 N GLU A 91 11.692 0.618 -1.198 1.00 0.59 N ATOM 1356 CA GLU A 91 12.752 -0.375 -1.333 1.00 0.75 C ATOM 1357 C GLU A 91 13.871 -0.115 -0.333 1.00 1.10 C ATOM 1358 O GLU A 91 13.983 0.981 0.219 1.00 1.80 O ATOM 1359 CB GLU A 91 13.346 -0.323 -2.743 1.00 1.45 C ATOM 1360 CG GLU A 91 14.019 1.009 -3.044 1.00 1.95 C ATOM 1361 CD GLU A 91 14.929 0.975 -4.255 1.00 2.17 C ATOM 1362 OE1 GLU A 91 16.096 0.560 -4.112 1.00 2.62 O ATOM 1363 OE2 GLU A 91 14.460 1.318 -5.361 1.00 2.51 O ATOM 0 H GLU A 91 11.859 1.474 -1.727 1.00 0.59 H new ATOM 0 HA GLU A 91 12.314 -1.355 -1.143 1.00 0.75 H new ATOM 0 HB2 GLU A 91 14.073 -1.127 -2.857 1.00 1.45 H new ATOM 0 HB3 GLU A 91 12.556 -0.500 -3.473 1.00 1.45 H new ATOM 0 HG2 GLU A 91 13.251 1.766 -3.200 1.00 1.95 H new ATOM 0 HG3 GLU A 91 14.599 1.317 -2.174 1.00 1.95 H new ATOM 1370 N VAL A 92 14.700 -1.129 -0.121 1.00 1.37 N ATOM 1371 CA VAL A 92 15.903 -0.990 0.696 1.00 2.09 C ATOM 1372 C VAL A 92 17.078 -1.744 0.067 1.00 1.99 C ATOM 1373 O VAL A 92 18.239 -1.496 0.399 1.00 2.61 O ATOM 1374 CB VAL A 92 15.696 -1.511 2.140 1.00 2.95 C ATOM 1375 CG1 VAL A 92 14.695 -0.652 2.901 1.00 3.64 C ATOM 1376 CG2 VAL A 92 15.249 -2.965 2.125 1.00 3.77 C ATOM 0 H VAL A 92 14.561 -2.064 -0.506 1.00 1.37 H new ATOM 0 HA VAL A 92 16.122 0.077 0.740 1.00 2.09 H new ATOM 0 HB VAL A 92 16.653 -1.446 2.658 1.00 2.95 H new ATOM 0 HG11 VAL A 92 14.572 -1.044 3.911 1.00 3.64 H new ATOM 0 HG12 VAL A 92 15.061 0.374 2.952 1.00 3.64 H new ATOM 0 HG13 VAL A 92 13.735 -0.670 2.386 1.00 3.64 H new ATOM 0 HG21 VAL A 92 15.109 -3.313 3.148 1.00 3.77 H new ATOM 0 HG22 VAL A 92 14.309 -3.051 1.580 1.00 3.77 H new ATOM 0 HG23 VAL A 92 16.009 -3.574 1.635 1.00 3.77 H new ATOM 1386 N TYR A 93 16.768 -2.658 -0.848 1.00 1.71 N ATOM 1387 CA TYR A 93 17.775 -3.513 -1.469 1.00 1.99 C ATOM 1388 C TYR A 93 17.403 -3.823 -2.915 1.00 1.66 C ATOM 1389 O TYR A 93 16.250 -3.651 -3.310 1.00 1.98 O ATOM 1390 CB TYR A 93 17.907 -4.833 -0.703 1.00 2.71 C ATOM 1391 CG TYR A 93 18.944 -4.830 0.400 1.00 3.21 C ATOM 1392 CD1 TYR A 93 20.272 -5.149 0.144 1.00 3.71 C ATOM 1393 CD2 TYR A 93 18.593 -4.482 1.697 1.00 3.58 C ATOM 1394 CE1 TYR A 93 21.218 -5.123 1.152 1.00 4.48 C ATOM 1395 CE2 TYR A 93 19.532 -4.450 2.705 1.00 4.35 C ATOM 1396 CZ TYR A 93 20.852 -4.879 2.421 1.00 4.77 C ATOM 1397 OH TYR A 93 21.779 -4.734 3.438 1.00 5.68 O ATOM 0 H TYR A 93 15.818 -2.826 -1.178 1.00 1.71 H new ATOM 0 HA TYR A 93 18.724 -2.977 -1.444 1.00 1.99 H new ATOM 0 HB2 TYR A 93 16.938 -5.083 -0.270 1.00 2.71 H new ATOM 0 HB3 TYR A 93 18.154 -5.624 -1.411 1.00 2.71 H new ATOM 0 HD1 TYR A 93 20.570 -5.421 -0.858 1.00 3.71 H new ATOM 0 HD2 TYR A 93 17.566 -4.232 1.920 1.00 3.58 H new ATOM 0 HE1 TYR A 93 22.257 -5.300 0.918 1.00 4.48 H new ATOM 0 HE2 TYR A 93 19.267 -4.104 3.693 1.00 4.35 H new ATOM 0 HH TYR A 93 21.313 -4.561 4.283 1.00 5.68 H new ATOM 1407 N PHE A 94 18.392 -4.285 -3.685 1.00 1.60 N ATOM 1408 CA PHE A 94 18.179 -4.771 -5.048 1.00 1.62 C ATOM 1409 C PHE A 94 17.690 -3.655 -5.962 1.00 1.50 C ATOM 1410 O PHE A 94 16.641 -3.764 -6.598 1.00 1.99 O ATOM 1411 CB PHE A 94 17.199 -5.948 -5.060 1.00 2.15 C ATOM 1412 CG PHE A 94 17.702 -7.160 -4.323 1.00 2.79 C ATOM 1413 CD1 PHE A 94 18.628 -8.007 -4.910 1.00 3.42 C ATOM 1414 CD2 PHE A 94 17.253 -7.447 -3.043 1.00 3.28 C ATOM 1415 CE1 PHE A 94 19.095 -9.120 -4.235 1.00 4.37 C ATOM 1416 CE2 PHE A 94 17.717 -8.557 -2.363 1.00 4.15 C ATOM 1417 CZ PHE A 94 18.640 -9.394 -2.960 1.00 4.65 C ATOM 0 H PHE A 94 19.364 -4.332 -3.379 1.00 1.60 H new ATOM 0 HA PHE A 94 19.139 -5.120 -5.429 1.00 1.62 H new ATOM 0 HB2 PHE A 94 16.256 -5.629 -4.616 1.00 2.15 H new ATOM 0 HB3 PHE A 94 16.988 -6.223 -6.093 1.00 2.15 H new ATOM 0 HD1 PHE A 94 18.989 -7.796 -5.906 1.00 3.42 H new ATOM 0 HD2 PHE A 94 16.532 -6.795 -2.572 1.00 3.28 H new ATOM 0 HE1 PHE A 94 19.815 -9.774 -4.704 1.00 4.37 H new ATOM 0 HE2 PHE A 94 17.359 -8.770 -1.367 1.00 4.15 H new ATOM 0 HZ PHE A 94 19.005 -10.261 -2.430 1.00 4.65 H new ATOM 1427 N ALA A 95 18.471 -2.586 -6.022 1.00 1.26 N ATOM 1428 CA ALA A 95 18.147 -1.436 -6.847 1.00 1.24 C ATOM 1429 C ALA A 95 18.431 -1.718 -8.317 1.00 1.19 C ATOM 1430 O ALA A 95 19.523 -1.440 -8.822 1.00 1.37 O ATOM 1431 CB ALA A 95 18.934 -0.225 -6.375 1.00 1.39 C ATOM 0 H ALA A 95 19.343 -2.493 -5.502 1.00 1.26 H new ATOM 0 HA ALA A 95 17.081 -1.229 -6.748 1.00 1.24 H new ATOM 0 HB1 ALA A 95 18.687 0.635 -6.998 1.00 1.39 H new ATOM 0 HB2 ALA A 95 18.679 -0.007 -5.338 1.00 1.39 H new ATOM 0 HB3 ALA A 95 20.001 -0.433 -6.450 1.00 1.39 H new ATOM 1437 N GLN A 96 17.446 -2.287 -8.989 1.00 1.05 N ATOM 1438 CA GLN A 96 17.543 -2.590 -10.412 1.00 1.05 C ATOM 1439 C GLN A 96 16.145 -2.674 -11.021 1.00 0.91 C ATOM 1440 O GLN A 96 15.224 -3.198 -10.399 1.00 0.88 O ATOM 1441 CB GLN A 96 18.321 -3.893 -10.631 1.00 1.21 C ATOM 1442 CG GLN A 96 17.739 -5.096 -9.907 1.00 1.54 C ATOM 1443 CD GLN A 96 18.689 -6.276 -9.896 1.00 2.09 C ATOM 1444 OE1 GLN A 96 19.484 -6.437 -8.969 1.00 2.63 O ATOM 1445 NE2 GLN A 96 18.622 -7.102 -10.926 1.00 2.75 N ATOM 0 H GLN A 96 16.556 -2.553 -8.567 1.00 1.05 H new ATOM 0 HA GLN A 96 18.088 -1.789 -10.911 1.00 1.05 H new ATOM 0 HB2 GLN A 96 18.355 -4.107 -11.699 1.00 1.21 H new ATOM 0 HB3 GLN A 96 19.350 -3.748 -10.302 1.00 1.21 H new ATOM 0 HG2 GLN A 96 17.497 -4.818 -8.881 1.00 1.54 H new ATOM 0 HG3 GLN A 96 16.805 -5.389 -10.387 1.00 1.54 H new ATOM 0 HE21 GLN A 96 17.949 -6.932 -11.673 1.00 2.75 H new ATOM 0 HE22 GLN A 96 19.244 -7.909 -10.974 1.00 2.75 H new ATOM 1454 N SER A 97 15.992 -2.155 -12.233 1.00 0.94 N ATOM 1455 CA SER A 97 14.671 -2.011 -12.836 1.00 0.92 C ATOM 1456 C SER A 97 14.356 -3.113 -13.844 1.00 0.95 C ATOM 1457 O SER A 97 15.250 -3.621 -14.532 1.00 1.17 O ATOM 1458 CB SER A 97 14.553 -0.638 -13.500 1.00 1.04 C ATOM 1459 OG SER A 97 15.722 -0.316 -14.239 1.00 1.40 O ATOM 0 H SER A 97 16.762 -1.828 -12.816 1.00 0.94 H new ATOM 0 HA SER A 97 13.939 -2.102 -12.034 1.00 0.92 H new ATOM 0 HB2 SER A 97 13.688 -0.626 -14.162 1.00 1.04 H new ATOM 0 HB3 SER A 97 14.382 0.122 -12.738 1.00 1.04 H new ATOM 0 HG SER A 97 15.615 0.566 -14.652 1.00 1.40 H new ATOM 1465 N GLN A 98 13.073 -3.471 -13.907 1.00 0.89 N ATOM 1466 CA GLN A 98 12.557 -4.454 -14.857 1.00 0.97 C ATOM 1467 C GLN A 98 13.300 -5.775 -14.699 1.00 1.04 C ATOM 1468 O GLN A 98 13.851 -6.323 -15.659 1.00 1.44 O ATOM 1469 CB GLN A 98 12.675 -3.932 -16.296 1.00 1.14 C ATOM 1470 CG GLN A 98 11.834 -4.710 -17.297 1.00 1.77 C ATOM 1471 CD GLN A 98 10.357 -4.668 -16.960 1.00 1.94 C ATOM 1472 OE1 GLN A 98 9.866 -3.699 -16.387 1.00 2.33 O ATOM 1473 NE2 GLN A 98 9.635 -5.715 -17.316 1.00 2.38 N ATOM 0 H GLN A 98 12.357 -3.082 -13.294 1.00 0.89 H new ATOM 0 HA GLN A 98 11.501 -4.622 -14.646 1.00 0.97 H new ATOM 0 HB2 GLN A 98 12.376 -2.884 -16.319 1.00 1.14 H new ATOM 0 HB3 GLN A 98 13.720 -3.972 -16.603 1.00 1.14 H new ATOM 0 HG2 GLN A 98 11.989 -4.300 -18.295 1.00 1.77 H new ATOM 0 HG3 GLN A 98 12.170 -5.747 -17.323 1.00 1.77 H new ATOM 0 HE21 GLN A 98 10.077 -6.502 -17.791 1.00 2.38 H new ATOM 0 HE22 GLN A 98 8.635 -5.737 -17.116 1.00 2.38 H new ATOM 1482 N GLN A 99 13.323 -6.276 -13.477 1.00 1.05 N ATOM 1483 CA GLN A 99 14.024 -7.511 -13.180 1.00 1.16 C ATOM 1484 C GLN A 99 13.324 -8.246 -12.054 1.00 1.02 C ATOM 1485 O GLN A 99 13.031 -9.438 -12.157 1.00 1.16 O ATOM 1486 CB GLN A 99 15.476 -7.215 -12.798 1.00 1.35 C ATOM 1487 CG GLN A 99 16.351 -8.454 -12.704 1.00 1.82 C ATOM 1488 CD GLN A 99 16.400 -9.229 -14.004 1.00 2.26 C ATOM 1489 OE1 GLN A 99 17.215 -8.942 -14.881 1.00 2.73 O ATOM 1490 NE2 GLN A 99 15.540 -10.226 -14.130 1.00 2.89 N ATOM 0 H GLN A 99 12.864 -5.846 -12.674 1.00 1.05 H new ATOM 0 HA GLN A 99 14.020 -8.142 -14.068 1.00 1.16 H new ATOM 0 HB2 GLN A 99 15.904 -6.535 -13.534 1.00 1.35 H new ATOM 0 HB3 GLN A 99 15.491 -6.697 -11.839 1.00 1.35 H new ATOM 0 HG2 GLN A 99 17.362 -8.160 -12.421 1.00 1.82 H new ATOM 0 HG3 GLN A 99 15.974 -9.102 -11.912 1.00 1.82 H new ATOM 0 HE21 GLN A 99 14.881 -10.429 -13.378 1.00 2.89 H new ATOM 0 HE22 GLN A 99 15.535 -10.791 -14.979 1.00 2.89 H new ATOM 1499 N LYS A 100 13.046 -7.523 -10.984 1.00 0.87 N ATOM 1500 CA LYS A 100 12.376 -8.094 -9.835 1.00 0.84 C ATOM 1501 C LYS A 100 10.952 -7.570 -9.769 1.00 0.66 C ATOM 1502 O LYS A 100 10.673 -6.556 -9.130 1.00 0.63 O ATOM 1503 CB LYS A 100 13.150 -7.771 -8.552 1.00 1.00 C ATOM 1504 CG LYS A 100 14.564 -8.338 -8.555 1.00 1.33 C ATOM 1505 CD LYS A 100 15.365 -7.944 -7.320 1.00 1.75 C ATOM 1506 CE LYS A 100 14.863 -8.623 -6.050 1.00 2.23 C ATOM 1507 NZ LYS A 100 13.778 -7.856 -5.379 1.00 2.79 N ATOM 0 H LYS A 100 13.276 -6.534 -10.889 1.00 0.87 H new ATOM 0 HA LYS A 100 12.341 -9.179 -9.934 1.00 0.84 H new ATOM 0 HB2 LYS A 100 13.198 -6.689 -8.425 1.00 1.00 H new ATOM 0 HB3 LYS A 100 12.606 -8.169 -7.695 1.00 1.00 H new ATOM 0 HG2 LYS A 100 14.514 -9.425 -8.617 1.00 1.33 H new ATOM 0 HG3 LYS A 100 15.087 -7.991 -9.446 1.00 1.33 H new ATOM 0 HD2 LYS A 100 16.413 -8.201 -7.475 1.00 1.75 H new ATOM 0 HD3 LYS A 100 15.318 -6.863 -7.192 1.00 1.75 H new ATOM 0 HE2 LYS A 100 14.499 -9.620 -6.296 1.00 2.23 H new ATOM 0 HE3 LYS A 100 15.695 -8.749 -5.357 1.00 2.23 H new ATOM 0 HZ1 LYS A 100 13.907 -7.902 -4.348 1.00 2.79 H new ATOM 0 HZ2 LYS A 100 13.812 -6.864 -5.688 1.00 2.79 H new ATOM 0 HZ3 LYS A 100 12.856 -8.266 -5.632 1.00 2.79 H new ATOM 1521 N VAL A 101 10.048 -8.284 -10.421 1.00 0.62 N ATOM 1522 CA VAL A 101 8.676 -7.836 -10.553 1.00 0.51 C ATOM 1523 C VAL A 101 7.768 -8.664 -9.656 1.00 0.49 C ATOM 1524 O VAL A 101 7.767 -9.894 -9.707 1.00 0.64 O ATOM 1525 CB VAL A 101 8.193 -7.916 -12.023 1.00 0.60 C ATOM 1526 CG1 VAL A 101 8.946 -6.922 -12.893 1.00 1.22 C ATOM 1527 CG2 VAL A 101 8.353 -9.323 -12.583 1.00 1.20 C ATOM 0 H VAL A 101 10.244 -9.180 -10.868 1.00 0.62 H new ATOM 0 HA VAL A 101 8.632 -6.792 -10.244 1.00 0.51 H new ATOM 0 HB VAL A 101 7.133 -7.662 -12.033 1.00 0.60 H new ATOM 0 HG11 VAL A 101 8.591 -6.996 -13.921 1.00 1.22 H new ATOM 0 HG12 VAL A 101 8.776 -5.911 -12.522 1.00 1.22 H new ATOM 0 HG13 VAL A 101 10.012 -7.145 -12.861 1.00 1.22 H new ATOM 0 HG21 VAL A 101 8.005 -9.345 -13.616 1.00 1.20 H new ATOM 0 HG22 VAL A 101 9.404 -9.611 -12.548 1.00 1.20 H new ATOM 0 HG23 VAL A 101 7.765 -10.021 -11.987 1.00 1.20 H new ATOM 1537 N PHE A 102 7.034 -7.978 -8.803 1.00 0.43 N ATOM 1538 CA PHE A 102 6.223 -8.632 -7.793 1.00 0.43 C ATOM 1539 C PHE A 102 4.745 -8.620 -8.162 1.00 0.35 C ATOM 1540 O PHE A 102 4.320 -7.849 -9.012 1.00 0.34 O ATOM 1541 CB PHE A 102 6.429 -7.922 -6.467 1.00 0.47 C ATOM 1542 CG PHE A 102 7.849 -7.975 -5.976 1.00 0.63 C ATOM 1543 CD1 PHE A 102 8.437 -9.185 -5.651 1.00 0.80 C ATOM 1544 CD2 PHE A 102 8.591 -6.816 -5.838 1.00 0.76 C ATOM 1545 CE1 PHE A 102 9.739 -9.238 -5.195 1.00 0.97 C ATOM 1546 CE2 PHE A 102 9.893 -6.861 -5.382 1.00 0.91 C ATOM 1547 CZ PHE A 102 10.474 -8.071 -5.075 1.00 0.99 C ATOM 0 H PHE A 102 6.982 -6.959 -8.789 1.00 0.43 H new ATOM 0 HA PHE A 102 6.533 -9.674 -7.720 1.00 0.43 H new ATOM 0 HB2 PHE A 102 6.127 -6.880 -6.570 1.00 0.47 H new ATOM 0 HB3 PHE A 102 5.776 -8.370 -5.718 1.00 0.47 H new ATOM 0 HD1 PHE A 102 7.871 -10.099 -5.755 1.00 0.80 H new ATOM 0 HD2 PHE A 102 8.146 -5.865 -6.090 1.00 0.76 H new ATOM 0 HE1 PHE A 102 10.183 -10.187 -4.933 1.00 0.97 H new ATOM 0 HE2 PHE A 102 10.456 -5.947 -5.266 1.00 0.91 H new ATOM 0 HZ PHE A 102 11.500 -8.110 -4.741 1.00 0.99 H new ATOM 1557 N ASP A 103 3.965 -9.461 -7.506 1.00 0.35 N ATOM 1558 CA ASP A 103 2.540 -9.574 -7.804 1.00 0.34 C ATOM 1559 C ASP A 103 1.711 -8.996 -6.667 1.00 0.33 C ATOM 1560 O ASP A 103 2.048 -9.176 -5.499 1.00 0.40 O ATOM 1561 CB ASP A 103 2.155 -11.039 -8.021 1.00 0.45 C ATOM 1562 CG ASP A 103 2.914 -11.696 -9.157 1.00 0.86 C ATOM 1563 OD1 ASP A 103 2.573 -11.440 -10.334 1.00 1.53 O ATOM 1564 OD2 ASP A 103 3.870 -12.450 -8.884 1.00 1.46 O ATOM 0 H ASP A 103 4.291 -10.078 -6.762 1.00 0.35 H new ATOM 0 HA ASP A 103 2.338 -9.011 -8.715 1.00 0.34 H new ATOM 0 HB2 ASP A 103 2.337 -11.595 -7.102 1.00 0.45 H new ATOM 0 HB3 ASP A 103 1.086 -11.100 -8.224 1.00 0.45 H new ATOM 1569 N VAL A 104 0.634 -8.300 -7.005 1.00 0.30 N ATOM 1570 CA VAL A 104 -0.231 -7.704 -5.999 1.00 0.31 C ATOM 1571 C VAL A 104 -1.690 -7.778 -6.430 1.00 0.28 C ATOM 1572 O VAL A 104 -2.045 -7.391 -7.551 1.00 0.30 O ATOM 1573 CB VAL A 104 0.204 -6.246 -5.702 1.00 0.36 C ATOM 1574 CG1 VAL A 104 -0.710 -5.202 -6.331 1.00 0.45 C ATOM 1575 CG2 VAL A 104 0.317 -6.021 -4.204 1.00 0.63 C ATOM 0 H VAL A 104 0.340 -8.135 -7.968 1.00 0.30 H new ATOM 0 HA VAL A 104 -0.134 -8.273 -5.075 1.00 0.31 H new ATOM 0 HB VAL A 104 1.182 -6.116 -6.165 1.00 0.36 H new ATOM 0 HG11 VAL A 104 -0.347 -4.204 -6.083 1.00 0.45 H new ATOM 0 HG12 VAL A 104 -0.715 -5.328 -7.414 1.00 0.45 H new ATOM 0 HG13 VAL A 104 -1.722 -5.326 -5.947 1.00 0.45 H new ATOM 0 HG21 VAL A 104 0.623 -4.993 -4.013 1.00 0.63 H new ATOM 0 HG22 VAL A 104 -0.649 -6.205 -3.734 1.00 0.63 H new ATOM 0 HG23 VAL A 104 1.058 -6.704 -3.788 1.00 0.63 H new ATOM 1585 N ARG A 105 -2.526 -8.310 -5.544 1.00 0.28 N ATOM 1586 CA ARG A 105 -3.930 -8.537 -5.856 1.00 0.26 C ATOM 1587 C ARG A 105 -4.857 -7.802 -4.900 1.00 0.28 C ATOM 1588 O ARG A 105 -4.562 -7.670 -3.719 1.00 0.39 O ATOM 1589 CB ARG A 105 -4.278 -10.032 -5.822 1.00 0.37 C ATOM 1590 CG ARG A 105 -3.137 -10.965 -5.459 1.00 0.64 C ATOM 1591 CD ARG A 105 -3.560 -12.414 -5.632 1.00 0.57 C ATOM 1592 NE ARG A 105 -2.544 -13.351 -5.161 1.00 1.11 N ATOM 1593 CZ ARG A 105 -2.128 -14.412 -5.850 1.00 1.36 C ATOM 1594 NH1 ARG A 105 -2.598 -14.650 -7.069 1.00 1.37 N ATOM 1595 NH2 ARG A 105 -1.251 -15.237 -5.304 1.00 1.95 N ATOM 0 H ARG A 105 -2.253 -8.592 -4.602 1.00 0.28 H new ATOM 0 HA ARG A 105 -4.079 -8.147 -6.863 1.00 0.26 H new ATOM 0 HB2 ARG A 105 -5.087 -10.182 -5.107 1.00 0.37 H new ATOM 0 HB3 ARG A 105 -4.661 -10.320 -6.801 1.00 0.37 H new ATOM 0 HG2 ARG A 105 -2.273 -10.754 -6.089 1.00 0.64 H new ATOM 0 HG3 ARG A 105 -2.830 -10.790 -4.428 1.00 0.64 H new ATOM 0 HD2 ARG A 105 -4.489 -12.586 -5.088 1.00 0.57 H new ATOM 0 HD3 ARG A 105 -3.767 -12.606 -6.685 1.00 0.57 H new ATOM 0 HE ARG A 105 -2.126 -13.182 -4.246 1.00 1.11 H new ATOM 0 HH11 ARG A 105 -3.283 -14.018 -7.484 1.00 1.37 H new ATOM 0 HH12 ARG A 105 -2.274 -15.465 -7.590 1.00 1.37 H new ATOM 0 HH21 ARG A 105 -0.899 -15.058 -4.363 1.00 1.95 H new ATOM 0 HH22 ARG A 105 -0.926 -16.053 -5.823 1.00 1.95 H new ATOM 1609 N VAL A 106 -5.980 -7.334 -5.433 1.00 0.28 N ATOM 1610 CA VAL A 106 -7.054 -6.772 -4.633 1.00 0.31 C ATOM 1611 C VAL A 106 -8.239 -7.733 -4.614 1.00 0.28 C ATOM 1612 O VAL A 106 -8.946 -7.896 -5.610 1.00 0.34 O ATOM 1613 CB VAL A 106 -7.486 -5.378 -5.147 1.00 0.39 C ATOM 1614 CG1 VAL A 106 -7.769 -5.404 -6.638 1.00 1.44 C ATOM 1615 CG2 VAL A 106 -8.701 -4.867 -4.390 1.00 1.41 C ATOM 0 H VAL A 106 -6.169 -7.335 -6.435 1.00 0.28 H new ATOM 0 HA VAL A 106 -6.685 -6.637 -3.616 1.00 0.31 H new ATOM 0 HB VAL A 106 -6.656 -4.694 -4.968 1.00 0.39 H new ATOM 0 HG11 VAL A 106 -8.070 -4.410 -6.969 1.00 1.44 H new ATOM 0 HG12 VAL A 106 -6.870 -5.708 -7.174 1.00 1.44 H new ATOM 0 HG13 VAL A 106 -8.571 -6.113 -6.844 1.00 1.44 H new ATOM 0 HG21 VAL A 106 -8.982 -3.886 -4.773 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -9.531 -5.560 -4.524 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -8.462 -4.788 -3.329 1.00 1.41 H new ATOM 1625 N ASN A 107 -8.412 -8.405 -3.481 1.00 0.28 N ATOM 1626 CA ASN A 107 -9.420 -9.449 -3.330 1.00 0.28 C ATOM 1627 C ASN A 107 -9.181 -10.531 -4.379 1.00 0.29 C ATOM 1628 O ASN A 107 -10.095 -10.984 -5.064 1.00 0.38 O ATOM 1629 CB ASN A 107 -10.836 -8.876 -3.449 1.00 0.30 C ATOM 1630 CG ASN A 107 -11.903 -9.881 -3.058 1.00 0.96 C ATOM 1631 OD1 ASN A 107 -11.703 -10.701 -2.166 1.00 1.57 O ATOM 1632 ND2 ASN A 107 -13.039 -9.829 -3.733 1.00 1.65 N ATOM 0 H ASN A 107 -7.857 -8.241 -2.641 1.00 0.28 H new ATOM 0 HA ASN A 107 -9.332 -9.885 -2.335 1.00 0.28 H new ATOM 0 HB2 ASN A 107 -10.922 -7.994 -2.815 1.00 0.30 H new ATOM 0 HB3 ASN A 107 -11.007 -8.549 -4.475 1.00 0.30 H new ATOM 0 HD21 ASN A 107 -13.790 -10.486 -3.520 1.00 1.65 H new ATOM 0 HD22 ASN A 107 -13.165 -9.132 -4.467 1.00 1.65 H new ATOM 1639 N GLY A 108 -7.915 -10.895 -4.530 1.00 0.29 N ATOM 1640 CA GLY A 108 -7.542 -11.930 -5.475 1.00 0.35 C ATOM 1641 C GLY A 108 -7.162 -11.381 -6.836 1.00 0.32 C ATOM 1642 O GLY A 108 -6.542 -12.074 -7.643 1.00 0.42 O ATOM 0 H GLY A 108 -7.135 -10.490 -4.012 1.00 0.29 H new ATOM 0 HA2 GLY A 108 -6.704 -12.498 -5.071 1.00 0.35 H new ATOM 0 HA3 GLY A 108 -8.373 -12.626 -5.589 1.00 0.35 H new ATOM 1646 N HIS A 109 -7.518 -10.132 -7.089 1.00 0.26 N ATOM 1647 CA HIS A 109 -7.336 -9.532 -8.398 1.00 0.27 C ATOM 1648 C HIS A 109 -5.974 -8.860 -8.550 1.00 0.23 C ATOM 1649 O HIS A 109 -5.796 -7.728 -8.111 1.00 0.24 O ATOM 1650 CB HIS A 109 -8.450 -8.518 -8.600 1.00 0.33 C ATOM 1651 CG HIS A 109 -9.791 -9.162 -8.739 1.00 0.44 C ATOM 1652 ND1 HIS A 109 -10.174 -9.828 -9.874 1.00 0.57 N ATOM 1653 CD2 HIS A 109 -10.824 -9.282 -7.864 1.00 0.53 C ATOM 1654 CE1 HIS A 109 -11.377 -10.332 -9.706 1.00 0.68 C ATOM 1655 NE2 HIS A 109 -11.797 -10.019 -8.494 1.00 0.65 N ATOM 0 H HIS A 109 -7.938 -9.511 -6.398 1.00 0.26 H new ATOM 0 HA HIS A 109 -7.374 -10.316 -9.154 1.00 0.27 H new ATOM 0 HB2 HIS A 109 -8.467 -7.829 -7.756 1.00 0.33 H new ATOM 0 HB3 HIS A 109 -8.241 -7.926 -9.491 1.00 0.33 H new ATOM 0 HD2 HIS A 109 -10.871 -8.876 -6.864 1.00 0.53 H new ATOM 0 HE1 HIS A 109 -11.929 -10.905 -10.436 1.00 0.68 H new ATOM 0 HE2 HIS A 109 -12.697 -10.281 -8.091 1.00 0.65 H new ATOM 1664 N THR A 110 -5.017 -9.542 -9.178 1.00 0.27 N ATOM 1665 CA THR A 110 -3.680 -8.977 -9.348 1.00 0.30 C ATOM 1666 C THR A 110 -3.693 -7.768 -10.274 1.00 0.30 C ATOM 1667 O THR A 110 -3.700 -7.902 -11.499 1.00 0.48 O ATOM 1668 CB THR A 110 -2.663 -10.005 -9.880 1.00 0.40 C ATOM 1669 OG1 THR A 110 -3.281 -10.851 -10.860 1.00 0.77 O ATOM 1670 CG2 THR A 110 -2.089 -10.850 -8.757 1.00 0.61 C ATOM 0 H THR A 110 -5.140 -10.474 -9.573 1.00 0.27 H new ATOM 0 HA THR A 110 -3.366 -8.667 -8.351 1.00 0.30 H new ATOM 0 HB THR A 110 -1.844 -9.454 -10.342 1.00 0.40 H new ATOM 0 HG1 THR A 110 -3.731 -10.298 -11.532 1.00 0.77 H new ATOM 0 HG21 THR A 110 -1.375 -11.564 -9.167 1.00 0.61 H new ATOM 0 HG22 THR A 110 -1.584 -10.205 -8.038 1.00 0.61 H new ATOM 0 HG23 THR A 110 -2.895 -11.388 -8.258 1.00 0.61 H new ATOM 1678 N VAL A 111 -3.695 -6.590 -9.676 1.00 0.26 N ATOM 1679 CA VAL A 111 -3.652 -5.353 -10.430 1.00 0.29 C ATOM 1680 C VAL A 111 -2.226 -5.065 -10.849 1.00 0.29 C ATOM 1681 O VAL A 111 -1.953 -4.773 -12.014 1.00 0.38 O ATOM 1682 CB VAL A 111 -4.170 -4.161 -9.609 1.00 0.32 C ATOM 1683 CG1 VAL A 111 -4.432 -2.962 -10.510 1.00 0.93 C ATOM 1684 CG2 VAL A 111 -5.411 -4.552 -8.835 1.00 0.94 C ATOM 0 H VAL A 111 -3.726 -6.465 -8.664 1.00 0.26 H new ATOM 0 HA VAL A 111 -4.296 -5.479 -11.300 1.00 0.29 H new ATOM 0 HB VAL A 111 -3.403 -3.873 -8.890 1.00 0.32 H new ATOM 0 HG11 VAL A 111 -4.798 -2.129 -9.910 1.00 0.93 H new ATOM 0 HG12 VAL A 111 -3.507 -2.672 -11.008 1.00 0.93 H new ATOM 0 HG13 VAL A 111 -5.179 -3.226 -11.259 1.00 0.93 H new ATOM 0 HG21 VAL A 111 -5.765 -3.697 -8.259 1.00 0.94 H new ATOM 0 HG22 VAL A 111 -6.189 -4.868 -9.530 1.00 0.94 H new ATOM 0 HG23 VAL A 111 -5.174 -5.373 -8.158 1.00 0.94 H new ATOM 1694 N VAL A 112 -1.306 -5.174 -9.899 1.00 0.27 N ATOM 1695 CA VAL A 112 0.085 -4.899 -10.191 1.00 0.28 C ATOM 1696 C VAL A 112 0.883 -6.177 -10.077 1.00 0.28 C ATOM 1697 O VAL A 112 1.389 -6.526 -9.014 1.00 0.27 O ATOM 1698 CB VAL A 112 0.685 -3.822 -9.259 1.00 0.29 C ATOM 1699 CG1 VAL A 112 2.031 -3.353 -9.787 1.00 0.35 C ATOM 1700 CG2 VAL A 112 -0.269 -2.649 -9.110 1.00 0.33 C ATOM 0 H VAL A 112 -1.498 -5.447 -8.935 1.00 0.27 H new ATOM 0 HA VAL A 112 0.136 -4.508 -11.207 1.00 0.28 H new ATOM 0 HB VAL A 112 0.836 -4.265 -8.275 1.00 0.29 H new ATOM 0 HG11 VAL A 112 2.440 -2.595 -9.119 1.00 0.35 H new ATOM 0 HG12 VAL A 112 2.716 -4.199 -9.838 1.00 0.35 H new ATOM 0 HG13 VAL A 112 1.903 -2.929 -10.783 1.00 0.35 H new ATOM 0 HG21 VAL A 112 0.173 -1.902 -8.450 1.00 0.33 H new ATOM 0 HG22 VAL A 112 -0.455 -2.205 -10.088 1.00 0.33 H new ATOM 0 HG23 VAL A 112 -1.210 -2.997 -8.685 1.00 0.33 H new ATOM 1710 N LYS A 113 0.981 -6.874 -11.186 1.00 0.33 N ATOM 1711 CA LYS A 113 1.729 -8.109 -11.244 1.00 0.37 C ATOM 1712 C LYS A 113 2.942 -7.908 -12.140 1.00 0.41 C ATOM 1713 O LYS A 113 3.055 -8.468 -13.231 1.00 0.68 O ATOM 1714 CB LYS A 113 0.820 -9.234 -11.763 1.00 0.44 C ATOM 1715 CG LYS A 113 -0.318 -8.748 -12.668 1.00 1.24 C ATOM 1716 CD LYS A 113 0.200 -8.029 -13.906 1.00 2.09 C ATOM 1717 CE LYS A 113 -0.697 -6.869 -14.304 1.00 3.07 C ATOM 1718 NZ LYS A 113 -0.045 -5.994 -15.316 1.00 4.01 N ATOM 0 H LYS A 113 0.547 -6.603 -12.068 1.00 0.33 H new ATOM 0 HA LYS A 113 2.078 -8.394 -10.252 1.00 0.37 H new ATOM 0 HB2 LYS A 113 1.427 -9.953 -12.314 1.00 0.44 H new ATOM 0 HB3 LYS A 113 0.393 -9.764 -10.912 1.00 0.44 H new ATOM 0 HG2 LYS A 113 -0.927 -9.599 -12.972 1.00 1.24 H new ATOM 0 HG3 LYS A 113 -0.967 -8.077 -12.105 1.00 1.24 H new ATOM 0 HD2 LYS A 113 1.208 -7.660 -13.716 1.00 2.09 H new ATOM 0 HD3 LYS A 113 0.269 -8.735 -14.734 1.00 2.09 H new ATOM 0 HE2 LYS A 113 -1.634 -7.254 -14.705 1.00 3.07 H new ATOM 0 HE3 LYS A 113 -0.946 -6.281 -13.420 1.00 3.07 H new ATOM 0 HZ1 LYS A 113 -0.569 -5.099 -15.390 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 0.935 -5.799 -15.027 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 -0.045 -6.472 -16.240 1.00 4.01 H new ATOM 1732 N ASP A 114 3.867 -7.150 -11.596 1.00 0.39 N ATOM 1733 CA ASP A 114 5.027 -6.620 -12.303 1.00 0.45 C ATOM 1734 C ASP A 114 5.581 -5.482 -11.467 1.00 0.38 C ATOM 1735 O ASP A 114 6.157 -4.524 -11.980 1.00 0.45 O ATOM 1736 CB ASP A 114 4.674 -6.107 -13.718 1.00 0.63 C ATOM 1737 CG ASP A 114 3.490 -5.143 -13.744 1.00 1.33 C ATOM 1738 OD1 ASP A 114 3.664 -3.958 -13.394 1.00 1.96 O ATOM 1739 OD2 ASP A 114 2.380 -5.570 -14.141 1.00 1.52 O ATOM 0 H ASP A 114 3.838 -6.872 -10.615 1.00 0.39 H new ATOM 0 HA ASP A 114 5.758 -7.417 -12.437 1.00 0.45 H new ATOM 0 HB2 ASP A 114 5.546 -5.609 -14.142 1.00 0.63 H new ATOM 0 HB3 ASP A 114 4.451 -6.960 -14.359 1.00 0.63 H new ATOM 1744 N LEU A 115 5.393 -5.608 -10.156 1.00 0.33 N ATOM 1745 CA LEU A 115 5.709 -4.546 -9.224 1.00 0.34 C ATOM 1746 C LEU A 115 7.210 -4.415 -9.033 1.00 0.37 C ATOM 1747 O LEU A 115 7.777 -4.900 -8.056 1.00 0.47 O ATOM 1748 CB LEU A 115 5.009 -4.781 -7.887 1.00 0.38 C ATOM 1749 CG LEU A 115 4.330 -3.545 -7.295 1.00 0.45 C ATOM 1750 CD1 LEU A 115 3.594 -3.893 -6.025 1.00 1.18 C ATOM 1751 CD2 LEU A 115 5.340 -2.439 -7.038 1.00 1.07 C ATOM 0 H LEU A 115 5.018 -6.449 -9.718 1.00 0.33 H new ATOM 0 HA LEU A 115 5.344 -3.608 -9.642 1.00 0.34 H new ATOM 0 HB2 LEU A 115 4.261 -5.563 -8.017 1.00 0.38 H new ATOM 0 HB3 LEU A 115 5.740 -5.155 -7.170 1.00 0.38 H new ATOM 0 HG LEU A 115 3.605 -3.182 -8.024 1.00 0.45 H new ATOM 0 HD11 LEU A 115 3.119 -2.998 -5.623 1.00 1.18 H new ATOM 0 HD12 LEU A 115 2.832 -4.642 -6.240 1.00 1.18 H new ATOM 0 HD13 LEU A 115 4.298 -4.290 -5.294 1.00 1.18 H new ATOM 0 HD21 LEU A 115 4.831 -1.572 -6.617 1.00 1.07 H new ATOM 0 HD22 LEU A 115 6.096 -2.792 -6.336 1.00 1.07 H new ATOM 0 HD23 LEU A 115 5.819 -2.159 -7.976 1.00 1.07 H new ATOM 1763 N ASP A 116 7.833 -3.780 -10.002 1.00 0.39 N ATOM 1764 CA ASP A 116 9.230 -3.407 -9.926 1.00 0.44 C ATOM 1765 C ASP A 116 9.296 -1.924 -9.595 1.00 0.43 C ATOM 1766 O ASP A 116 9.021 -1.076 -10.446 1.00 0.48 O ATOM 1767 CB ASP A 116 9.908 -3.699 -11.270 1.00 0.53 C ATOM 1768 CG ASP A 116 11.404 -3.464 -11.254 1.00 1.28 C ATOM 1769 OD1 ASP A 116 11.820 -2.283 -11.211 1.00 1.93 O ATOM 1770 OD2 ASP A 116 12.165 -4.456 -11.233 1.00 1.83 O ATOM 0 H ASP A 116 7.380 -3.505 -10.874 1.00 0.39 H new ATOM 0 HA ASP A 116 9.749 -3.978 -9.156 1.00 0.44 H new ATOM 0 HB2 ASP A 116 9.714 -4.735 -11.549 1.00 0.53 H new ATOM 0 HB3 ASP A 116 9.458 -3.072 -12.039 1.00 0.53 H new ATOM 1775 N ILE A 117 9.612 -1.622 -8.335 1.00 0.44 N ATOM 1776 CA ILE A 117 9.592 -0.249 -7.832 1.00 0.46 C ATOM 1777 C ILE A 117 10.462 0.662 -8.686 1.00 0.48 C ATOM 1778 O ILE A 117 10.071 1.787 -9.008 1.00 0.51 O ATOM 1779 CB ILE A 117 10.076 -0.170 -6.364 1.00 0.52 C ATOM 1780 CG1 ILE A 117 9.199 -1.035 -5.453 1.00 0.56 C ATOM 1781 CG2 ILE A 117 10.088 1.276 -5.875 1.00 0.58 C ATOM 1782 CD1 ILE A 117 9.654 -1.029 -4.008 1.00 0.82 C ATOM 0 H ILE A 117 9.887 -2.316 -7.640 1.00 0.44 H new ATOM 0 HA ILE A 117 8.556 0.085 -7.882 1.00 0.46 H new ATOM 0 HB ILE A 117 11.095 -0.555 -6.325 1.00 0.52 H new ATOM 0 HG12 ILE A 117 8.170 -0.679 -5.505 1.00 0.56 H new ATOM 0 HG13 ILE A 117 9.201 -2.060 -5.824 1.00 0.56 H new ATOM 0 HG21 ILE A 117 10.431 1.308 -4.841 1.00 0.58 H new ATOM 0 HG22 ILE A 117 10.760 1.865 -6.499 1.00 0.58 H new ATOM 0 HG23 ILE A 117 9.081 1.689 -5.936 1.00 0.58 H new ATOM 0 HD11 ILE A 117 8.992 -1.660 -3.415 1.00 0.82 H new ATOM 0 HD12 ILE A 117 10.672 -1.412 -3.946 1.00 0.82 H new ATOM 0 HD13 ILE A 117 9.626 -0.010 -3.622 1.00 0.82 H new ATOM 1794 N PHE A 118 11.616 0.149 -9.080 1.00 0.54 N ATOM 1795 CA PHE A 118 12.590 0.927 -9.823 1.00 0.62 C ATOM 1796 C PHE A 118 12.026 1.335 -11.183 1.00 0.65 C ATOM 1797 O PHE A 118 12.139 2.489 -11.596 1.00 0.74 O ATOM 1798 CB PHE A 118 13.866 0.107 -10.000 1.00 0.70 C ATOM 1799 CG PHE A 118 15.116 0.930 -10.117 1.00 0.81 C ATOM 1800 CD1 PHE A 118 15.334 1.705 -11.240 1.00 0.92 C ATOM 1801 CD2 PHE A 118 16.059 0.943 -9.103 1.00 0.89 C ATOM 1802 CE1 PHE A 118 16.471 2.478 -11.354 1.00 1.06 C ATOM 1803 CE2 PHE A 118 17.197 1.715 -9.210 1.00 1.02 C ATOM 1804 CZ PHE A 118 17.450 2.413 -10.325 1.00 1.08 C ATOM 0 H PHE A 118 11.902 -0.812 -8.895 1.00 0.54 H new ATOM 0 HA PHE A 118 12.821 1.835 -9.266 1.00 0.62 H new ATOM 0 HB2 PHE A 118 13.969 -0.571 -9.153 1.00 0.70 H new ATOM 0 HB3 PHE A 118 13.766 -0.511 -10.892 1.00 0.70 H new ATOM 0 HD1 PHE A 118 14.606 1.706 -12.038 1.00 0.92 H new ATOM 0 HD2 PHE A 118 15.902 0.342 -8.219 1.00 0.89 H new ATOM 0 HE1 PHE A 118 16.615 3.121 -12.210 1.00 1.06 H new ATOM 0 HE2 PHE A 118 17.893 1.757 -8.385 1.00 1.02 H new ATOM 0 HZ PHE A 118 18.394 2.924 -10.442 1.00 1.08 H new ATOM 1814 N ASP A 119 11.407 0.386 -11.871 1.00 0.61 N ATOM 1815 CA ASP A 119 10.803 0.654 -13.173 1.00 0.68 C ATOM 1816 C ASP A 119 9.537 1.501 -13.039 1.00 0.69 C ATOM 1817 O ASP A 119 9.238 2.334 -13.899 1.00 0.81 O ATOM 1818 CB ASP A 119 10.480 -0.661 -13.888 1.00 0.68 C ATOM 1819 CG ASP A 119 9.696 -0.455 -15.167 1.00 0.82 C ATOM 1820 OD1 ASP A 119 10.290 0.005 -16.164 1.00 0.96 O ATOM 1821 OD2 ASP A 119 8.483 -0.753 -15.187 1.00 0.89 O ATOM 0 H ASP A 119 11.309 -0.577 -11.551 1.00 0.61 H new ATOM 0 HA ASP A 119 11.525 1.218 -13.764 1.00 0.68 H new ATOM 0 HB2 ASP A 119 11.409 -1.183 -14.117 1.00 0.68 H new ATOM 0 HB3 ASP A 119 9.910 -1.304 -13.217 1.00 0.68 H new ATOM 1826 N ARG A 120 8.817 1.310 -11.944 1.00 0.61 N ATOM 1827 CA ARG A 120 7.524 1.954 -11.758 1.00 0.66 C ATOM 1828 C ARG A 120 7.673 3.423 -11.372 1.00 0.75 C ATOM 1829 O ARG A 120 7.036 4.290 -11.970 1.00 0.97 O ATOM 1830 CB ARG A 120 6.705 1.208 -10.703 1.00 0.63 C ATOM 1831 CG ARG A 120 6.006 -0.041 -11.224 1.00 0.59 C ATOM 1832 CD ARG A 120 4.904 0.312 -12.211 1.00 0.72 C ATOM 1833 NE ARG A 120 4.079 -0.845 -12.558 1.00 1.02 N ATOM 1834 CZ ARG A 120 2.760 -0.782 -12.749 1.00 1.31 C ATOM 1835 NH1 ARG A 120 2.126 0.380 -12.662 1.00 1.69 N ATOM 1836 NH2 ARG A 120 2.079 -1.880 -13.054 1.00 1.65 N ATOM 0 H ARG A 120 9.106 0.713 -11.169 1.00 0.61 H new ATOM 0 HA ARG A 120 6.997 1.916 -12.712 1.00 0.66 H new ATOM 0 HB2 ARG A 120 7.363 0.926 -9.881 1.00 0.63 H new ATOM 0 HB3 ARG A 120 5.956 1.886 -10.294 1.00 0.63 H new ATOM 0 HG2 ARG A 120 6.734 -0.693 -11.707 1.00 0.59 H new ATOM 0 HG3 ARG A 120 5.583 -0.599 -10.388 1.00 0.59 H new ATOM 0 HD2 ARG A 120 4.272 1.091 -11.784 1.00 0.72 H new ATOM 0 HD3 ARG A 120 5.349 0.723 -13.117 1.00 0.72 H new ATOM 0 HE ARG A 120 4.538 -1.750 -12.660 1.00 1.02 H new ATOM 0 HH11 ARG A 120 2.647 1.230 -12.448 1.00 1.69 H new ATOM 0 HH12 ARG A 120 1.118 0.423 -12.809 1.00 1.69 H new ATOM 0 HH21 ARG A 120 2.564 -2.773 -13.143 1.00 1.65 H new ATOM 0 HH22 ARG A 120 1.071 -1.831 -13.200 1.00 1.65 H new ATOM 1850 N VAL A 121 8.496 3.708 -10.371 1.00 0.65 N ATOM 1851 CA VAL A 121 8.687 5.093 -9.938 1.00 0.75 C ATOM 1852 C VAL A 121 10.138 5.555 -10.093 1.00 0.80 C ATOM 1853 O VAL A 121 10.402 6.741 -10.306 1.00 0.95 O ATOM 1854 CB VAL A 121 8.233 5.294 -8.469 1.00 0.79 C ATOM 1855 CG1 VAL A 121 9.098 4.494 -7.508 1.00 1.42 C ATOM 1856 CG2 VAL A 121 8.237 6.770 -8.096 1.00 1.49 C ATOM 0 H VAL A 121 9.034 3.016 -9.850 1.00 0.65 H new ATOM 0 HA VAL A 121 8.064 5.704 -10.591 1.00 0.75 H new ATOM 0 HB VAL A 121 7.211 4.923 -8.386 1.00 0.79 H new ATOM 0 HG11 VAL A 121 8.754 4.657 -6.487 1.00 1.42 H new ATOM 0 HG12 VAL A 121 9.026 3.434 -7.750 1.00 1.42 H new ATOM 0 HG13 VAL A 121 10.135 4.817 -7.597 1.00 1.42 H new ATOM 0 HG21 VAL A 121 7.915 6.885 -7.061 1.00 1.49 H new ATOM 0 HG22 VAL A 121 9.244 7.171 -8.209 1.00 1.49 H new ATOM 0 HG23 VAL A 121 7.555 7.313 -8.750 1.00 1.49 H new ATOM 1866 N GLY A 122 11.071 4.624 -10.025 1.00 0.76 N ATOM 1867 CA GLY A 122 12.470 4.981 -9.976 1.00 0.89 C ATOM 1868 C GLY A 122 13.119 4.388 -8.751 1.00 1.00 C ATOM 1869 O GLY A 122 12.573 3.464 -8.154 1.00 1.40 O ATOM 0 H GLY A 122 10.884 3.622 -10.003 1.00 0.76 H new ATOM 0 HA2 GLY A 122 12.975 4.623 -10.873 1.00 0.89 H new ATOM 0 HA3 GLY A 122 12.575 6.066 -9.963 1.00 0.89 H new ATOM 1873 N HIS A 123 14.266 4.908 -8.356 1.00 1.10 N ATOM 1874 CA HIS A 123 14.941 4.379 -7.186 1.00 1.36 C ATOM 1875 C HIS A 123 14.304 4.901 -5.905 1.00 1.08 C ATOM 1876 O HIS A 123 14.243 6.113 -5.677 1.00 1.41 O ATOM 1877 CB HIS A 123 16.432 4.714 -7.197 1.00 2.01 C ATOM 1878 CG HIS A 123 17.170 4.049 -6.080 1.00 2.61 C ATOM 1879 ND1 HIS A 123 17.737 4.730 -5.027 1.00 3.35 N ATOM 1880 CD2 HIS A 123 17.388 2.742 -5.839 1.00 3.26 C ATOM 1881 CE1 HIS A 123 18.269 3.861 -4.185 1.00 4.11 C ATOM 1882 NE2 HIS A 123 18.068 2.644 -4.652 1.00 4.08 N ATOM 0 H HIS A 123 14.743 5.682 -8.818 1.00 1.10 H new ATOM 0 HA HIS A 123 14.833 3.295 -7.218 1.00 1.36 H new ATOM 0 HB2 HIS A 123 16.864 4.407 -8.149 1.00 2.01 H new ATOM 0 HB3 HIS A 123 16.560 5.794 -7.122 1.00 2.01 H new ATOM 0 HD1 HIS A 123 17.745 5.744 -4.914 1.00 3.35 H new ATOM 0 HD2 HIS A 123 17.082 1.919 -6.468 1.00 3.26 H new ATOM 0 HE1 HIS A 123 18.783 4.107 -3.267 1.00 4.11 H new ATOM 1891 N SER A 124 13.855 3.965 -5.075 1.00 1.19 N ATOM 1892 CA SER A 124 13.269 4.248 -3.764 1.00 1.00 C ATOM 1893 C SER A 124 12.149 5.288 -3.835 1.00 1.02 C ATOM 1894 O SER A 124 11.166 5.092 -4.549 1.00 1.97 O ATOM 1895 CB SER A 124 14.354 4.663 -2.753 1.00 1.06 C ATOM 1896 OG SER A 124 15.062 5.817 -3.181 1.00 1.72 O ATOM 0 H SER A 124 13.888 2.970 -5.296 1.00 1.19 H new ATOM 0 HA SER A 124 12.812 3.322 -3.414 1.00 1.00 H new ATOM 0 HB2 SER A 124 13.893 4.858 -1.785 1.00 1.06 H new ATOM 0 HB3 SER A 124 15.054 3.839 -2.612 1.00 1.06 H new ATOM 0 HG SER A 124 14.588 6.232 -3.932 1.00 1.72 H new ATOM 1902 N THR A 125 12.316 6.393 -3.095 1.00 0.66 N ATOM 1903 CA THR A 125 11.291 7.425 -2.944 1.00 0.53 C ATOM 1904 C THR A 125 9.960 6.809 -2.503 1.00 0.48 C ATOM 1905 O THR A 125 9.934 5.704 -1.963 1.00 0.60 O ATOM 1906 CB THR A 125 11.107 8.282 -4.229 1.00 0.60 C ATOM 1907 OG1 THR A 125 10.726 7.481 -5.351 1.00 0.81 O ATOM 1908 CG2 THR A 125 12.387 9.037 -4.557 1.00 0.85 C ATOM 0 H THR A 125 13.174 6.593 -2.582 1.00 0.66 H new ATOM 0 HA THR A 125 11.639 8.102 -2.164 1.00 0.53 H new ATOM 0 HB THR A 125 10.306 8.993 -4.028 1.00 0.60 H new ATOM 0 HG1 THR A 125 10.492 6.580 -5.045 1.00 0.81 H new ATOM 0 HG21 THR A 125 12.238 9.631 -5.459 1.00 0.85 H new ATOM 0 HG22 THR A 125 12.644 9.696 -3.727 1.00 0.85 H new ATOM 0 HG23 THR A 125 13.197 8.326 -4.720 1.00 0.85 H new ATOM 1916 N ALA A 126 8.867 7.529 -2.685 1.00 0.44 N ATOM 1917 CA ALA A 126 7.566 7.005 -2.316 1.00 0.45 C ATOM 1918 C ALA A 126 6.854 6.457 -3.537 1.00 0.40 C ATOM 1919 O ALA A 126 6.434 7.213 -4.412 1.00 0.50 O ATOM 1920 CB ALA A 126 6.727 8.081 -1.647 1.00 0.57 C ATOM 0 H ALA A 126 8.854 8.468 -3.082 1.00 0.44 H new ATOM 0 HA ALA A 126 7.709 6.192 -1.604 1.00 0.45 H new ATOM 0 HB1 ALA A 126 5.755 7.669 -1.377 1.00 0.57 H new ATOM 0 HB2 ALA A 126 7.234 8.432 -0.748 1.00 0.57 H new ATOM 0 HB3 ALA A 126 6.589 8.915 -2.335 1.00 0.57 H new ATOM 1926 N HIS A 127 6.734 5.142 -3.602 1.00 0.33 N ATOM 1927 CA HIS A 127 6.025 4.510 -4.696 1.00 0.32 C ATOM 1928 C HIS A 127 4.582 4.280 -4.290 1.00 0.34 C ATOM 1929 O HIS A 127 4.320 3.802 -3.199 1.00 0.55 O ATOM 1930 CB HIS A 127 6.679 3.177 -5.095 1.00 0.34 C ATOM 1931 CG HIS A 127 5.989 2.507 -6.244 1.00 0.38 C ATOM 1932 ND1 HIS A 127 5.532 3.191 -7.350 1.00 0.44 N ATOM 1933 CD2 HIS A 127 5.637 1.215 -6.436 1.00 0.48 C ATOM 1934 CE1 HIS A 127 4.929 2.351 -8.163 1.00 0.50 C ATOM 1935 NE2 HIS A 127 4.978 1.145 -7.638 1.00 0.51 N ATOM 0 H HIS A 127 7.117 4.496 -2.912 1.00 0.33 H new ATOM 0 HA HIS A 127 6.067 5.171 -5.562 1.00 0.32 H new ATOM 0 HB2 HIS A 127 7.722 3.355 -5.358 1.00 0.34 H new ATOM 0 HB3 HIS A 127 6.677 2.506 -4.236 1.00 0.34 H new ATOM 0 HD2 HIS A 127 5.837 0.391 -5.767 1.00 0.48 H new ATOM 0 HE1 HIS A 127 4.469 2.608 -9.106 1.00 0.50 H new ATOM 0 HE2 HIS A 127 4.591 0.299 -8.055 1.00 0.51 H new ATOM 1944 N ASP A 128 3.650 4.630 -5.148 1.00 0.38 N ATOM 1945 CA ASP A 128 2.249 4.397 -4.858 1.00 0.47 C ATOM 1946 C ASP A 128 1.544 3.777 -6.042 1.00 0.46 C ATOM 1947 O ASP A 128 1.763 4.166 -7.187 1.00 0.61 O ATOM 1948 CB ASP A 128 1.532 5.687 -4.436 1.00 0.66 C ATOM 1949 CG ASP A 128 1.777 6.856 -5.374 1.00 0.99 C ATOM 1950 OD1 ASP A 128 1.277 6.805 -6.516 1.00 1.36 O ATOM 1951 OD2 ASP A 128 2.485 7.809 -4.990 1.00 1.64 O ATOM 0 H ASP A 128 3.833 5.075 -6.048 1.00 0.38 H new ATOM 0 HA ASP A 128 2.210 3.699 -4.021 1.00 0.47 H new ATOM 0 HB2 ASP A 128 0.460 5.495 -4.381 1.00 0.66 H new ATOM 0 HB3 ASP A 128 1.859 5.962 -3.433 1.00 0.66 H new ATOM 1956 N GLU A 129 0.736 2.777 -5.759 1.00 0.40 N ATOM 1957 CA GLU A 129 -0.143 2.206 -6.758 1.00 0.41 C ATOM 1958 C GLU A 129 -1.573 2.532 -6.373 1.00 0.33 C ATOM 1959 O GLU A 129 -2.068 2.062 -5.347 1.00 0.39 O ATOM 1960 CB GLU A 129 0.050 0.690 -6.866 1.00 0.53 C ATOM 1961 CG GLU A 129 1.485 0.262 -7.141 1.00 0.97 C ATOM 1962 CD GLU A 129 1.987 0.648 -8.522 1.00 0.72 C ATOM 1963 OE1 GLU A 129 1.365 1.537 -9.141 1.00 1.12 O ATOM 1964 OE2 GLU A 129 2.978 0.058 -9.003 1.00 0.75 O ATOM 0 H GLU A 129 0.670 2.340 -4.840 1.00 0.40 H new ATOM 0 HA GLU A 129 0.092 2.631 -7.734 1.00 0.41 H new ATOM 0 HB2 GLU A 129 -0.285 0.225 -5.938 1.00 0.53 H new ATOM 0 HB3 GLU A 129 -0.590 0.309 -7.662 1.00 0.53 H new ATOM 0 HG2 GLU A 129 2.137 0.708 -6.390 1.00 0.97 H new ATOM 0 HG3 GLU A 129 1.560 -0.819 -7.027 1.00 0.97 H new ATOM 1971 N ILE A 130 -2.207 3.377 -7.167 1.00 0.28 N ATOM 1972 CA ILE A 130 -3.566 3.813 -6.894 1.00 0.24 C ATOM 1973 C ILE A 130 -4.548 2.957 -7.685 1.00 0.25 C ATOM 1974 O ILE A 130 -4.575 3.006 -8.914 1.00 0.31 O ATOM 1975 CB ILE A 130 -3.759 5.300 -7.268 1.00 0.29 C ATOM 1976 CG1 ILE A 130 -2.751 6.175 -6.513 1.00 0.39 C ATOM 1977 CG2 ILE A 130 -5.185 5.746 -6.973 1.00 0.31 C ATOM 1978 CD1 ILE A 130 -2.824 7.645 -6.874 1.00 0.74 C ATOM 0 H ILE A 130 -1.799 3.777 -8.012 1.00 0.28 H new ATOM 0 HA ILE A 130 -3.753 3.700 -5.826 1.00 0.24 H new ATOM 0 HB ILE A 130 -3.581 5.414 -8.337 1.00 0.29 H new ATOM 0 HG12 ILE A 130 -2.920 6.065 -5.442 1.00 0.39 H new ATOM 0 HG13 ILE A 130 -1.744 5.810 -6.716 1.00 0.39 H new ATOM 0 HG21 ILE A 130 -5.301 6.796 -7.243 1.00 0.31 H new ATOM 0 HG22 ILE A 130 -5.882 5.143 -7.554 1.00 0.31 H new ATOM 0 HG23 ILE A 130 -5.393 5.619 -5.911 1.00 0.31 H new ATOM 0 HD11 ILE A 130 -2.081 8.198 -6.299 1.00 0.74 H new ATOM 0 HD12 ILE A 130 -2.625 7.769 -7.939 1.00 0.74 H new ATOM 0 HD13 ILE A 130 -3.819 8.027 -6.644 1.00 0.74 H new ATOM 1990 N ILE A 131 -5.344 2.173 -6.979 1.00 0.24 N ATOM 1991 CA ILE A 131 -6.218 1.206 -7.616 1.00 0.28 C ATOM 1992 C ILE A 131 -7.673 1.420 -7.207 1.00 0.25 C ATOM 1993 O ILE A 131 -8.107 0.934 -6.162 1.00 0.26 O ATOM 1994 CB ILE A 131 -5.803 -0.234 -7.241 1.00 0.35 C ATOM 1995 CG1 ILE A 131 -4.309 -0.447 -7.501 1.00 0.40 C ATOM 1996 CG2 ILE A 131 -6.632 -1.239 -8.027 1.00 0.40 C ATOM 1997 CD1 ILE A 131 -3.773 -1.746 -6.938 1.00 1.25 C ATOM 0 H ILE A 131 -5.402 2.188 -5.961 1.00 0.24 H new ATOM 0 HA ILE A 131 -6.125 1.348 -8.693 1.00 0.28 H new ATOM 0 HB ILE A 131 -5.989 -0.386 -6.178 1.00 0.35 H new ATOM 0 HG12 ILE A 131 -4.130 -0.426 -8.576 1.00 0.40 H new ATOM 0 HG13 ILE A 131 -3.752 0.384 -7.068 1.00 0.40 H new ATOM 0 HG21 ILE A 131 -6.331 -2.251 -7.755 1.00 0.40 H new ATOM 0 HG22 ILE A 131 -7.688 -1.100 -7.796 1.00 0.40 H new ATOM 0 HG23 ILE A 131 -6.471 -1.087 -9.094 1.00 0.40 H new ATOM 0 HD11 ILE A 131 -2.709 -1.828 -7.161 1.00 1.25 H new ATOM 0 HD12 ILE A 131 -3.920 -1.763 -5.858 1.00 1.25 H new ATOM 0 HD13 ILE A 131 -4.304 -2.584 -7.389 1.00 1.25 H new ATOM 2009 N PRO A 132 -8.438 2.188 -7.993 1.00 0.24 N ATOM 2010 CA PRO A 132 -9.875 2.342 -7.775 1.00 0.23 C ATOM 2011 C PRO A 132 -10.666 1.088 -8.153 1.00 0.23 C ATOM 2012 O PRO A 132 -10.612 0.610 -9.293 1.00 0.25 O ATOM 2013 CB PRO A 132 -10.263 3.513 -8.688 1.00 0.26 C ATOM 2014 CG PRO A 132 -8.969 4.149 -9.071 1.00 0.29 C ATOM 2015 CD PRO A 132 -7.974 3.024 -9.106 1.00 0.28 C ATOM 0 HA PRO A 132 -10.102 2.514 -6.723 1.00 0.23 H new ATOM 0 HB2 PRO A 132 -10.807 3.165 -9.566 1.00 0.26 H new ATOM 0 HB3 PRO A 132 -10.912 4.219 -8.170 1.00 0.26 H new ATOM 0 HG2 PRO A 132 -9.043 4.640 -10.041 1.00 0.29 H new ATOM 0 HG3 PRO A 132 -8.676 4.912 -8.350 1.00 0.29 H new ATOM 0 HD2 PRO A 132 -7.992 2.490 -10.056 1.00 0.28 H new ATOM 0 HD3 PRO A 132 -6.953 3.375 -8.957 1.00 0.28 H new ATOM 2023 N ILE A 133 -11.389 0.567 -7.180 1.00 0.21 N ATOM 2024 CA ILE A 133 -12.297 -0.550 -7.370 1.00 0.21 C ATOM 2025 C ILE A 133 -13.712 0.000 -7.238 1.00 0.19 C ATOM 2026 O ILE A 133 -13.903 1.078 -6.675 1.00 0.26 O ATOM 2027 CB ILE A 133 -12.083 -1.664 -6.302 1.00 0.23 C ATOM 2028 CG1 ILE A 133 -13.047 -1.493 -5.122 1.00 0.25 C ATOM 2029 CG2 ILE A 133 -10.653 -1.652 -5.785 1.00 0.26 C ATOM 2030 CD1 ILE A 133 -12.812 -2.465 -3.985 1.00 0.27 C ATOM 0 H ILE A 133 -11.362 0.913 -6.221 1.00 0.21 H new ATOM 0 HA ILE A 133 -12.118 -0.999 -8.347 1.00 0.21 H new ATOM 0 HB ILE A 133 -12.283 -2.619 -6.788 1.00 0.23 H new ATOM 0 HG12 ILE A 133 -12.960 -0.476 -4.740 1.00 0.25 H new ATOM 0 HG13 ILE A 133 -14.069 -1.612 -5.482 1.00 0.25 H new ATOM 0 HG21 ILE A 133 -10.529 -2.439 -5.041 1.00 0.26 H new ATOM 0 HG22 ILE A 133 -9.965 -1.824 -6.613 1.00 0.26 H new ATOM 0 HG23 ILE A 133 -10.439 -0.685 -5.330 1.00 0.26 H new ATOM 0 HD11 ILE A 133 -13.535 -2.278 -3.191 1.00 0.27 H new ATOM 0 HD12 ILE A 133 -12.929 -3.486 -4.349 1.00 0.27 H new ATOM 0 HD13 ILE A 133 -11.803 -2.332 -3.596 1.00 0.27 H new ATOM 2042 N SER A 134 -14.693 -0.709 -7.742 1.00 0.19 N ATOM 2043 CA SER A 134 -16.067 -0.273 -7.603 1.00 0.21 C ATOM 2044 C SER A 134 -16.920 -1.388 -7.013 1.00 0.22 C ATOM 2045 O SER A 134 -17.119 -2.432 -7.635 1.00 0.25 O ATOM 2046 CB SER A 134 -16.615 0.195 -8.956 1.00 0.26 C ATOM 2047 OG SER A 134 -16.440 -0.794 -9.959 1.00 1.24 O ATOM 0 H SER A 134 -14.570 -1.585 -8.249 1.00 0.19 H new ATOM 0 HA SER A 134 -16.103 0.573 -6.916 1.00 0.21 H new ATOM 0 HB2 SER A 134 -17.674 0.432 -8.858 1.00 0.26 H new ATOM 0 HB3 SER A 134 -16.110 1.113 -9.257 1.00 0.26 H new ATOM 0 HG SER A 134 -15.568 -1.226 -9.844 1.00 1.24 H new ATOM 2053 N ILE A 135 -17.384 -1.181 -5.791 1.00 0.23 N ATOM 2054 CA ILE A 135 -18.269 -2.135 -5.147 1.00 0.25 C ATOM 2055 C ILE A 135 -19.700 -1.646 -5.265 1.00 0.29 C ATOM 2056 O ILE A 135 -20.010 -0.534 -4.843 1.00 0.34 O ATOM 2057 CB ILE A 135 -17.942 -2.325 -3.650 1.00 0.26 C ATOM 2058 CG1 ILE A 135 -16.463 -2.643 -3.456 1.00 0.28 C ATOM 2059 CG2 ILE A 135 -18.810 -3.426 -3.051 1.00 0.30 C ATOM 2060 CD1 ILE A 135 -16.076 -2.854 -2.009 1.00 0.32 C ATOM 0 H ILE A 135 -17.162 -0.361 -5.226 1.00 0.23 H new ATOM 0 HA ILE A 135 -18.132 -3.093 -5.648 1.00 0.25 H new ATOM 0 HB ILE A 135 -18.160 -1.392 -3.131 1.00 0.26 H new ATOM 0 HG12 ILE A 135 -16.215 -3.539 -4.025 1.00 0.28 H new ATOM 0 HG13 ILE A 135 -15.867 -1.829 -3.868 1.00 0.28 H new ATOM 0 HG21 ILE A 135 -18.567 -3.547 -1.995 1.00 0.30 H new ATOM 0 HG22 ILE A 135 -19.861 -3.156 -3.153 1.00 0.30 H new ATOM 0 HG23 ILE A 135 -18.623 -4.363 -3.576 1.00 0.30 H new ATOM 0 HD11 ILE A 135 -15.011 -3.076 -1.946 1.00 0.32 H new ATOM 0 HD12 ILE A 135 -16.293 -1.951 -1.439 1.00 0.32 H new ATOM 0 HD13 ILE A 135 -16.645 -3.688 -1.598 1.00 0.32 H new ATOM 2072 N LYS A 136 -20.553 -2.461 -5.859 1.00 0.31 N ATOM 2073 CA LYS A 136 -21.967 -2.141 -6.005 1.00 0.37 C ATOM 2074 C LYS A 136 -22.790 -3.418 -5.987 1.00 0.40 C ATOM 2075 O LYS A 136 -22.414 -4.410 -6.611 1.00 0.42 O ATOM 2076 CB LYS A 136 -22.231 -1.369 -7.302 1.00 0.46 C ATOM 2077 CG LYS A 136 -21.593 0.009 -7.330 1.00 0.66 C ATOM 2078 CD LYS A 136 -21.846 0.718 -8.650 1.00 1.28 C ATOM 2079 CE LYS A 136 -21.078 2.028 -8.754 1.00 1.51 C ATOM 2080 NZ LYS A 136 -19.622 1.806 -8.952 1.00 1.95 N ATOM 0 H LYS A 136 -20.288 -3.363 -6.254 1.00 0.31 H new ATOM 0 HA LYS A 136 -22.259 -1.507 -5.168 1.00 0.37 H new ATOM 0 HB2 LYS A 136 -21.856 -1.951 -8.144 1.00 0.46 H new ATOM 0 HB3 LYS A 136 -23.307 -1.265 -7.440 1.00 0.46 H new ATOM 0 HG2 LYS A 136 -21.989 0.610 -6.512 1.00 0.66 H new ATOM 0 HG3 LYS A 136 -20.519 -0.084 -7.166 1.00 0.66 H new ATOM 0 HD2 LYS A 136 -21.559 0.064 -9.473 1.00 1.28 H new ATOM 0 HD3 LYS A 136 -22.913 0.915 -8.757 1.00 1.28 H new ATOM 0 HE2 LYS A 136 -21.472 2.614 -9.585 1.00 1.51 H new ATOM 0 HE3 LYS A 136 -21.236 2.613 -7.848 1.00 1.51 H new ATOM 0 HZ1 LYS A 136 -19.115 2.021 -8.070 1.00 1.95 H new ATOM 0 HZ2 LYS A 136 -19.455 0.814 -9.215 1.00 1.95 H new ATOM 0 HZ3 LYS A 136 -19.276 2.428 -9.710 1.00 1.95 H new ATOM 2094 N LYS A 137 -23.889 -3.392 -5.239 1.00 0.46 N ATOM 2095 CA LYS A 137 -24.789 -4.537 -5.106 1.00 0.54 C ATOM 2096 C LYS A 137 -24.057 -5.726 -4.493 1.00 0.48 C ATOM 2097 O LYS A 137 -24.430 -6.881 -4.702 1.00 0.54 O ATOM 2098 CB LYS A 137 -25.407 -4.929 -6.458 1.00 0.65 C ATOM 2099 CG LYS A 137 -26.049 -3.768 -7.210 1.00 0.81 C ATOM 2100 CD LYS A 137 -26.974 -2.953 -6.321 1.00 1.53 C ATOM 2101 CE LYS A 137 -28.130 -3.779 -5.792 1.00 2.40 C ATOM 2102 NZ LYS A 137 -28.895 -3.041 -4.754 1.00 3.13 N ATOM 0 H LYS A 137 -24.183 -2.574 -4.705 1.00 0.46 H new ATOM 0 HA LYS A 137 -25.601 -4.242 -4.441 1.00 0.54 H new ATOM 0 HB2 LYS A 137 -24.632 -5.370 -7.085 1.00 0.65 H new ATOM 0 HB3 LYS A 137 -26.159 -5.700 -6.291 1.00 0.65 H new ATOM 0 HG2 LYS A 137 -25.269 -3.121 -7.611 1.00 0.81 H new ATOM 0 HG3 LYS A 137 -26.611 -4.154 -8.060 1.00 0.81 H new ATOM 0 HD2 LYS A 137 -26.406 -2.547 -5.484 1.00 1.53 H new ATOM 0 HD3 LYS A 137 -27.363 -2.105 -6.884 1.00 1.53 H new ATOM 0 HE2 LYS A 137 -28.794 -4.046 -6.614 1.00 2.40 H new ATOM 0 HE3 LYS A 137 -27.751 -4.711 -5.373 1.00 2.40 H new ATOM 0 HZ1 LYS A 137 -29.679 -3.634 -4.413 1.00 3.13 H new ATOM 0 HZ2 LYS A 137 -28.266 -2.808 -3.959 1.00 3.13 H new ATOM 0 HZ3 LYS A 137 -29.277 -2.164 -5.162 1.00 3.13 H new ATOM 2116 N GLY A 138 -23.004 -5.429 -3.740 1.00 0.41 N ATOM 2117 CA GLY A 138 -22.223 -6.473 -3.106 1.00 0.40 C ATOM 2118 C GLY A 138 -21.259 -7.136 -4.071 1.00 0.37 C ATOM 2119 O GLY A 138 -20.726 -8.209 -3.797 1.00 0.39 O ATOM 0 H GLY A 138 -22.677 -4.480 -3.557 1.00 0.41 H new ATOM 0 HA2 GLY A 138 -21.665 -6.050 -2.271 1.00 0.40 H new ATOM 0 HA3 GLY A 138 -22.894 -7.225 -2.692 1.00 0.40 H new ATOM 2123 N LYS A 139 -21.047 -6.507 -5.215 1.00 0.37 N ATOM 2124 CA LYS A 139 -20.095 -6.999 -6.194 1.00 0.36 C ATOM 2125 C LYS A 139 -18.917 -6.042 -6.285 1.00 0.32 C ATOM 2126 O LYS A 139 -19.068 -4.847 -6.057 1.00 0.40 O ATOM 2127 CB LYS A 139 -20.764 -7.159 -7.558 1.00 0.44 C ATOM 2128 CG LYS A 139 -21.964 -8.096 -7.542 1.00 0.87 C ATOM 2129 CD LYS A 139 -22.651 -8.160 -8.897 1.00 1.14 C ATOM 2130 CE LYS A 139 -21.736 -8.736 -9.965 1.00 1.64 C ATOM 2131 NZ LYS A 139 -22.414 -8.824 -11.284 1.00 2.23 N ATOM 0 H LYS A 139 -21.526 -5.649 -5.489 1.00 0.37 H new ATOM 0 HA LYS A 139 -19.733 -7.978 -5.879 1.00 0.36 H new ATOM 0 HB2 LYS A 139 -21.083 -6.179 -7.914 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -20.030 -7.534 -8.272 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -21.640 -9.095 -7.251 1.00 0.87 H new ATOM 0 HG3 LYS A 139 -22.677 -7.760 -6.789 1.00 0.87 H new ATOM 0 HD2 LYS A 139 -23.550 -8.771 -8.820 1.00 1.14 H new ATOM 0 HD3 LYS A 139 -22.969 -7.160 -9.191 1.00 1.14 H new ATOM 0 HE2 LYS A 139 -20.846 -8.114 -10.055 1.00 1.64 H new ATOM 0 HE3 LYS A 139 -21.402 -9.728 -9.661 1.00 1.64 H new ATOM 0 HZ1 LYS A 139 -21.758 -9.222 -11.986 1.00 2.23 H new ATOM 0 HZ2 LYS A 139 -23.250 -9.438 -11.205 1.00 2.23 H new ATOM 0 HZ3 LYS A 139 -22.710 -7.874 -11.586 1.00 2.23 H new ATOM 2145 N LEU A 140 -17.753 -6.569 -6.618 1.00 0.33 N ATOM 2146 CA LEU A 140 -16.534 -5.780 -6.647 1.00 0.30 C ATOM 2147 C LEU A 140 -15.927 -5.822 -8.047 1.00 0.31 C ATOM 2148 O LEU A 140 -15.525 -6.884 -8.527 1.00 0.41 O ATOM 2149 CB LEU A 140 -15.534 -6.336 -5.620 1.00 0.32 C ATOM 2150 CG LEU A 140 -14.376 -5.410 -5.220 1.00 0.32 C ATOM 2151 CD1 LEU A 140 -13.715 -5.922 -3.952 1.00 0.39 C ATOM 2152 CD2 LEU A 140 -13.337 -5.306 -6.327 1.00 0.37 C ATOM 0 H LEU A 140 -17.625 -7.548 -6.874 1.00 0.33 H new ATOM 0 HA LEU A 140 -16.766 -4.746 -6.393 1.00 0.30 H new ATOM 0 HB2 LEU A 140 -16.084 -6.603 -4.718 1.00 0.32 H new ATOM 0 HB3 LEU A 140 -15.111 -7.258 -6.020 1.00 0.32 H new ATOM 0 HG LEU A 140 -14.791 -4.417 -5.046 1.00 0.32 H new ATOM 0 HD11 LEU A 140 -12.895 -5.259 -3.676 1.00 0.39 H new ATOM 0 HD12 LEU A 140 -14.447 -5.949 -3.145 1.00 0.39 H new ATOM 0 HD13 LEU A 140 -13.328 -6.926 -4.124 1.00 0.39 H new ATOM 0 HD21 LEU A 140 -12.532 -4.643 -6.010 1.00 0.37 H new ATOM 0 HD22 LEU A 140 -12.930 -6.295 -6.538 1.00 0.37 H new ATOM 0 HD23 LEU A 140 -13.803 -4.906 -7.227 1.00 0.37 H new ATOM 2164 N SER A 141 -15.861 -4.676 -8.696 1.00 0.28 N ATOM 2165 CA SER A 141 -15.246 -4.583 -10.008 1.00 0.31 C ATOM 2166 C SER A 141 -14.022 -3.672 -9.937 1.00 0.28 C ATOM 2167 O SER A 141 -14.148 -2.465 -9.743 1.00 0.36 O ATOM 2168 CB SER A 141 -16.260 -4.060 -11.035 1.00 0.39 C ATOM 2169 OG SER A 141 -15.756 -4.150 -12.358 1.00 1.19 O ATOM 0 H SER A 141 -16.226 -3.794 -8.336 1.00 0.28 H new ATOM 0 HA SER A 141 -14.925 -5.575 -10.327 1.00 0.31 H new ATOM 0 HB2 SER A 141 -17.185 -4.631 -10.958 1.00 0.39 H new ATOM 0 HB3 SER A 141 -16.506 -3.023 -10.808 1.00 0.39 H new ATOM 0 HG SER A 141 -14.994 -4.766 -12.377 1.00 1.19 H new ATOM 2175 N VAL A 142 -12.842 -4.252 -10.088 1.00 0.33 N ATOM 2176 CA VAL A 142 -11.603 -3.499 -9.958 1.00 0.35 C ATOM 2177 C VAL A 142 -11.047 -3.157 -11.339 1.00 0.43 C ATOM 2178 O VAL A 142 -10.672 -4.046 -12.101 1.00 0.48 O ATOM 2179 CB VAL A 142 -10.538 -4.273 -9.133 1.00 0.35 C ATOM 2180 CG1 VAL A 142 -10.296 -5.652 -9.713 1.00 0.92 C ATOM 2181 CG2 VAL A 142 -9.242 -3.479 -9.070 1.00 0.83 C ATOM 0 H VAL A 142 -12.715 -5.241 -10.301 1.00 0.33 H new ATOM 0 HA VAL A 142 -11.833 -2.579 -9.421 1.00 0.35 H new ATOM 0 HB VAL A 142 -10.917 -4.401 -8.119 1.00 0.35 H new ATOM 0 HG11 VAL A 142 -9.546 -6.171 -9.116 1.00 0.92 H new ATOM 0 HG12 VAL A 142 -11.226 -6.220 -9.701 1.00 0.92 H new ATOM 0 HG13 VAL A 142 -9.941 -5.558 -10.739 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -8.504 -4.032 -8.489 1.00 0.83 H new ATOM 0 HG22 VAL A 142 -8.864 -3.320 -10.080 1.00 0.83 H new ATOM 0 HG23 VAL A 142 -9.428 -2.515 -8.596 1.00 0.83 H new ATOM 2191 N GLN A 143 -11.027 -1.863 -11.657 1.00 0.56 N ATOM 2192 CA GLN A 143 -10.529 -1.371 -12.943 1.00 0.70 C ATOM 2193 C GLN A 143 -11.300 -1.966 -14.122 1.00 0.82 C ATOM 2194 O GLN A 143 -12.267 -1.371 -14.602 1.00 1.45 O ATOM 2195 CB GLN A 143 -9.029 -1.649 -13.096 1.00 0.74 C ATOM 2196 CG GLN A 143 -8.151 -0.770 -12.221 1.00 0.83 C ATOM 2197 CD GLN A 143 -8.321 0.703 -12.535 1.00 1.15 C ATOM 2198 OE1 GLN A 143 -7.648 1.243 -13.412 1.00 1.88 O ATOM 2199 NE2 GLN A 143 -9.207 1.370 -11.812 1.00 1.11 N ATOM 0 H GLN A 143 -11.355 -1.127 -11.032 1.00 0.56 H new ATOM 0 HA GLN A 143 -10.688 -0.293 -12.952 1.00 0.70 H new ATOM 0 HB2 GLN A 143 -8.836 -2.694 -12.855 1.00 0.74 H new ATOM 0 HB3 GLN A 143 -8.747 -1.505 -14.139 1.00 0.74 H new ATOM 0 HG2 GLN A 143 -8.393 -0.947 -11.173 1.00 0.83 H new ATOM 0 HG3 GLN A 143 -7.107 -1.051 -12.359 1.00 0.83 H new ATOM 0 HE21 GLN A 143 -9.746 0.887 -11.093 1.00 1.11 H new ATOM 0 HE22 GLN A 143 -9.350 2.367 -11.973 1.00 1.11 H new ATOM 2208 N GLY A 144 -10.880 -3.140 -14.574 1.00 0.86 N ATOM 2209 CA GLY A 144 -11.518 -3.772 -15.709 1.00 0.96 C ATOM 2210 C GLY A 144 -11.970 -5.187 -15.412 1.00 0.85 C ATOM 2211 O GLY A 144 -12.509 -5.865 -16.285 1.00 1.02 O ATOM 0 H GLY A 144 -10.105 -3.667 -14.172 1.00 0.86 H new ATOM 0 HA2 GLY A 144 -12.378 -3.177 -16.015 1.00 0.96 H new ATOM 0 HA3 GLY A 144 -10.824 -3.785 -16.550 1.00 0.96 H new ATOM 2215 N GLU A 145 -11.768 -5.636 -14.180 1.00 0.66 N ATOM 2216 CA GLU A 145 -12.155 -6.982 -13.797 1.00 0.65 C ATOM 2217 C GLU A 145 -13.398 -6.923 -12.921 1.00 0.52 C ATOM 2218 O GLU A 145 -13.591 -5.962 -12.177 1.00 0.55 O ATOM 2219 CB GLU A 145 -11.005 -7.680 -13.068 1.00 0.74 C ATOM 2220 CG GLU A 145 -11.253 -9.153 -12.803 1.00 1.06 C ATOM 2221 CD GLU A 145 -11.627 -9.920 -14.053 1.00 1.35 C ATOM 2222 OE1 GLU A 145 -10.735 -10.185 -14.883 1.00 1.95 O ATOM 2223 OE2 GLU A 145 -12.817 -10.269 -14.203 1.00 1.84 O ATOM 0 H GLU A 145 -11.340 -5.088 -13.434 1.00 0.66 H new ATOM 0 HA GLU A 145 -12.384 -7.561 -14.692 1.00 0.65 H new ATOM 0 HB2 GLU A 145 -10.095 -7.575 -13.659 1.00 0.74 H new ATOM 0 HB3 GLU A 145 -10.829 -7.174 -12.119 1.00 0.74 H new ATOM 0 HG2 GLU A 145 -10.357 -9.594 -12.366 1.00 1.06 H new ATOM 0 HG3 GLU A 145 -12.051 -9.256 -12.067 1.00 1.06 H new ATOM 2230 N VAL A 146 -14.237 -7.944 -13.002 1.00 0.59 N ATOM 2231 CA VAL A 146 -15.520 -7.917 -12.319 1.00 0.54 C ATOM 2232 C VAL A 146 -15.770 -9.206 -11.541 1.00 0.53 C ATOM 2233 O VAL A 146 -15.546 -10.306 -12.041 1.00 0.67 O ATOM 2234 CB VAL A 146 -16.671 -7.675 -13.321 1.00 0.64 C ATOM 2235 CG1 VAL A 146 -16.657 -8.718 -14.427 1.00 0.92 C ATOM 2236 CG2 VAL A 146 -18.015 -7.657 -12.609 1.00 0.92 C ATOM 0 H VAL A 146 -14.054 -8.797 -13.531 1.00 0.59 H new ATOM 0 HA VAL A 146 -15.489 -7.091 -11.608 1.00 0.54 H new ATOM 0 HB VAL A 146 -16.519 -6.698 -13.779 1.00 0.64 H new ATOM 0 HG11 VAL A 146 -17.477 -8.526 -15.119 1.00 0.92 H new ATOM 0 HG12 VAL A 146 -15.710 -8.667 -14.964 1.00 0.92 H new ATOM 0 HG13 VAL A 146 -16.775 -9.711 -13.992 1.00 0.92 H new ATOM 0 HG21 VAL A 146 -18.809 -7.485 -13.335 1.00 0.92 H new ATOM 0 HG22 VAL A 146 -18.177 -8.614 -12.114 1.00 0.92 H new ATOM 0 HG23 VAL A 146 -18.023 -6.859 -11.867 1.00 0.92 H new ATOM 2246 N SER A 147 -16.214 -9.054 -10.303 1.00 0.47 N ATOM 2247 CA SER A 147 -16.569 -10.176 -9.456 1.00 0.47 C ATOM 2248 C SER A 147 -17.610 -9.723 -8.452 1.00 0.48 C ATOM 2249 O SER A 147 -18.018 -8.565 -8.459 1.00 0.79 O ATOM 2250 CB SER A 147 -15.336 -10.688 -8.706 1.00 0.54 C ATOM 2251 OG SER A 147 -14.272 -10.966 -9.593 1.00 1.27 O ATOM 0 H SER A 147 -16.338 -8.144 -9.858 1.00 0.47 H new ATOM 0 HA SER A 147 -16.965 -10.981 -10.075 1.00 0.47 H new ATOM 0 HB2 SER A 147 -15.018 -9.944 -7.975 1.00 0.54 H new ATOM 0 HB3 SER A 147 -15.594 -11.590 -8.151 1.00 0.54 H new ATOM 0 HG SER A 147 -13.721 -11.689 -9.226 1.00 1.27 H new ATOM 2257 N THR A 148 -18.057 -10.631 -7.615 1.00 0.41 N ATOM 2258 CA THR A 148 -18.855 -10.262 -6.468 1.00 0.40 C ATOM 2259 C THR A 148 -17.959 -10.226 -5.236 1.00 0.39 C ATOM 2260 O THR A 148 -17.029 -11.022 -5.110 1.00 0.46 O ATOM 2261 CB THR A 148 -20.043 -11.229 -6.251 1.00 0.46 C ATOM 2262 OG1 THR A 148 -20.806 -10.846 -5.093 1.00 1.45 O ATOM 2263 CG2 THR A 148 -19.567 -12.662 -6.095 1.00 1.28 C ATOM 0 H THR A 148 -17.881 -11.632 -7.707 1.00 0.41 H new ATOM 0 HA THR A 148 -19.284 -9.276 -6.647 1.00 0.40 H new ATOM 0 HB THR A 148 -20.678 -11.168 -7.135 1.00 0.46 H new ATOM 0 HG1 THR A 148 -20.623 -9.908 -4.877 1.00 1.45 H new ATOM 0 HG21 THR A 148 -20.426 -13.316 -5.944 1.00 1.28 H new ATOM 0 HG22 THR A 148 -19.032 -12.967 -6.994 1.00 1.28 H new ATOM 0 HG23 THR A 148 -18.901 -12.733 -5.235 1.00 1.28 H new ATOM 2271 N PHE A 149 -18.216 -9.279 -4.355 1.00 0.35 N ATOM 2272 CA PHE A 149 -17.419 -9.118 -3.152 1.00 0.32 C ATOM 2273 C PHE A 149 -17.841 -10.132 -2.093 1.00 0.35 C ATOM 2274 O PHE A 149 -19.004 -10.176 -1.691 1.00 0.43 O ATOM 2275 CB PHE A 149 -17.564 -7.687 -2.622 1.00 0.30 C ATOM 2276 CG PHE A 149 -17.045 -7.511 -1.230 1.00 0.30 C ATOM 2277 CD1 PHE A 149 -15.686 -7.385 -1.002 1.00 0.34 C ATOM 2278 CD2 PHE A 149 -17.913 -7.454 -0.152 1.00 0.38 C ATOM 2279 CE1 PHE A 149 -15.200 -7.205 0.274 1.00 0.42 C ATOM 2280 CE2 PHE A 149 -17.433 -7.273 1.126 1.00 0.46 C ATOM 2281 CZ PHE A 149 -16.095 -7.223 1.354 1.00 0.47 C ATOM 0 H PHE A 149 -18.975 -8.605 -4.450 1.00 0.35 H new ATOM 0 HA PHE A 149 -16.371 -9.298 -3.393 1.00 0.32 H new ATOM 0 HB2 PHE A 149 -17.034 -7.006 -3.288 1.00 0.30 H new ATOM 0 HB3 PHE A 149 -18.616 -7.403 -2.648 1.00 0.30 H new ATOM 0 HD1 PHE A 149 -14.999 -7.428 -1.834 1.00 0.34 H new ATOM 0 HD2 PHE A 149 -18.976 -7.552 -0.315 1.00 0.38 H new ATOM 0 HE1 PHE A 149 -14.144 -7.052 0.441 1.00 0.42 H new ATOM 0 HE2 PHE A 149 -18.123 -7.170 1.950 1.00 0.46 H new ATOM 0 HZ PHE A 149 -15.720 -7.197 2.367 1.00 0.47 H new ATOM 2291 N THR A 150 -16.896 -10.948 -1.651 1.00 0.37 N ATOM 2292 CA THR A 150 -17.183 -11.992 -0.685 1.00 0.48 C ATOM 2293 C THR A 150 -16.401 -11.808 0.619 1.00 0.43 C ATOM 2294 O THR A 150 -15.241 -12.215 0.733 1.00 0.82 O ATOM 2295 CB THR A 150 -16.873 -13.374 -1.285 1.00 0.78 C ATOM 2296 OG1 THR A 150 -15.680 -13.299 -2.080 1.00 1.79 O ATOM 2297 CG2 THR A 150 -18.032 -13.870 -2.138 1.00 1.25 C ATOM 0 H THR A 150 -15.921 -10.905 -1.948 1.00 0.37 H new ATOM 0 HA THR A 150 -18.244 -11.923 -0.447 1.00 0.48 H new ATOM 0 HB THR A 150 -16.724 -14.079 -0.468 1.00 0.78 H new ATOM 0 HG1 THR A 150 -15.484 -14.181 -2.460 1.00 1.79 H new ATOM 0 HG21 THR A 150 -17.787 -14.849 -2.550 1.00 1.25 H new ATOM 0 HG22 THR A 150 -18.929 -13.949 -1.523 1.00 1.25 H new ATOM 0 HG23 THR A 150 -18.211 -13.168 -2.952 1.00 1.25 H new ATOM 2305 N GLY A 151 -17.044 -11.182 1.596 1.00 0.42 N ATOM 2306 CA GLY A 151 -16.491 -11.112 2.937 1.00 0.37 C ATOM 2307 C GLY A 151 -15.525 -9.966 3.150 1.00 0.32 C ATOM 2308 O GLY A 151 -15.846 -9.005 3.851 1.00 0.34 O ATOM 0 H GLY A 151 -17.945 -10.718 1.483 1.00 0.42 H new ATOM 0 HA2 GLY A 151 -17.309 -11.020 3.651 1.00 0.37 H new ATOM 0 HA3 GLY A 151 -15.980 -12.049 3.157 1.00 0.37 H new ATOM 2312 N LYS A 152 -14.340 -10.054 2.569 1.00 0.29 N ATOM 2313 CA LYS A 152 -13.333 -9.033 2.797 1.00 0.28 C ATOM 2314 C LYS A 152 -12.399 -8.910 1.600 1.00 0.27 C ATOM 2315 O LYS A 152 -12.262 -9.838 0.804 1.00 0.33 O ATOM 2316 CB LYS A 152 -12.557 -9.330 4.097 1.00 0.36 C ATOM 2317 CG LYS A 152 -11.225 -10.045 3.936 1.00 0.44 C ATOM 2318 CD LYS A 152 -11.362 -11.432 3.332 1.00 0.62 C ATOM 2319 CE LYS A 152 -9.994 -12.003 3.040 1.00 0.77 C ATOM 2320 NZ LYS A 152 -10.053 -13.218 2.181 1.00 1.23 N ATOM 0 H LYS A 152 -14.055 -10.809 1.946 1.00 0.29 H new ATOM 0 HA LYS A 152 -13.832 -8.071 2.915 1.00 0.28 H new ATOM 0 HB2 LYS A 152 -12.379 -8.386 4.613 1.00 0.36 H new ATOM 0 HB3 LYS A 152 -13.193 -9.933 4.745 1.00 0.36 H new ATOM 0 HG2 LYS A 152 -10.571 -9.444 3.305 1.00 0.44 H new ATOM 0 HG3 LYS A 152 -10.743 -10.126 4.910 1.00 0.44 H new ATOM 0 HD2 LYS A 152 -11.900 -12.086 4.019 1.00 0.62 H new ATOM 0 HD3 LYS A 152 -11.948 -11.382 2.415 1.00 0.62 H new ATOM 0 HE2 LYS A 152 -9.385 -11.244 2.549 1.00 0.77 H new ATOM 0 HE3 LYS A 152 -9.499 -12.250 3.979 1.00 0.77 H new ATOM 0 HZ1 LYS A 152 -9.089 -13.570 2.011 1.00 1.23 H new ATOM 0 HZ2 LYS A 152 -10.611 -13.954 2.659 1.00 1.23 H new ATOM 0 HZ3 LYS A 152 -10.500 -12.980 1.273 1.00 1.23 H new ATOM 2334 N LEU A 153 -11.782 -7.750 1.482 1.00 0.23 N ATOM 2335 CA LEU A 153 -10.830 -7.480 0.419 1.00 0.24 C ATOM 2336 C LEU A 153 -9.479 -8.051 0.819 1.00 0.26 C ATOM 2337 O LEU A 153 -9.103 -7.980 1.982 1.00 0.44 O ATOM 2338 CB LEU A 153 -10.751 -5.966 0.182 1.00 0.26 C ATOM 2339 CG LEU A 153 -10.091 -5.526 -1.124 1.00 0.35 C ATOM 2340 CD1 LEU A 153 -10.559 -4.132 -1.500 1.00 1.17 C ATOM 2341 CD2 LEU A 153 -8.578 -5.540 -0.997 1.00 1.16 C ATOM 0 H LEU A 153 -11.926 -6.967 2.120 1.00 0.23 H new ATOM 0 HA LEU A 153 -11.145 -7.951 -0.512 1.00 0.24 H new ATOM 0 HB2 LEU A 153 -11.762 -5.561 0.209 1.00 0.26 H new ATOM 0 HB3 LEU A 153 -10.205 -5.516 1.011 1.00 0.26 H new ATOM 0 HG LEU A 153 -10.381 -6.229 -1.905 1.00 0.35 H new ATOM 0 HD11 LEU A 153 -10.083 -3.827 -2.432 1.00 1.17 H new ATOM 0 HD12 LEU A 153 -11.641 -4.134 -1.629 1.00 1.17 H new ATOM 0 HD13 LEU A 153 -10.289 -3.432 -0.709 1.00 1.17 H new ATOM 0 HD21 LEU A 153 -8.131 -5.223 -1.939 1.00 1.16 H new ATOM 0 HD22 LEU A 153 -8.273 -4.858 -0.203 1.00 1.16 H new ATOM 0 HD23 LEU A 153 -8.242 -6.549 -0.757 1.00 1.16 H new ATOM 2353 N SER A 154 -8.754 -8.639 -0.117 1.00 0.24 N ATOM 2354 CA SER A 154 -7.466 -9.216 0.222 1.00 0.27 C ATOM 2355 C SER A 154 -6.381 -8.628 -0.656 1.00 0.30 C ATOM 2356 O SER A 154 -6.319 -8.918 -1.848 1.00 0.50 O ATOM 2357 CB SER A 154 -7.491 -10.738 0.062 1.00 0.38 C ATOM 2358 OG SER A 154 -6.430 -11.352 0.777 1.00 1.35 O ATOM 0 H SER A 154 -9.027 -8.729 -1.096 1.00 0.24 H new ATOM 0 HA SER A 154 -7.253 -8.979 1.264 1.00 0.27 H new ATOM 0 HB2 SER A 154 -8.445 -11.127 0.418 1.00 0.38 H new ATOM 0 HB3 SER A 154 -7.416 -10.995 -0.995 1.00 0.38 H new ATOM 0 HG SER A 154 -6.474 -12.324 0.657 1.00 1.35 H new ATOM 2364 N VAL A 155 -5.525 -7.808 -0.077 1.00 0.26 N ATOM 2365 CA VAL A 155 -4.399 -7.296 -0.824 1.00 0.28 C ATOM 2366 C VAL A 155 -3.235 -8.232 -0.614 1.00 0.29 C ATOM 2367 O VAL A 155 -2.527 -8.157 0.388 1.00 0.38 O ATOM 2368 CB VAL A 155 -3.992 -5.868 -0.407 1.00 0.34 C ATOM 2369 CG1 VAL A 155 -2.844 -5.372 -1.275 1.00 0.42 C ATOM 2370 CG2 VAL A 155 -5.175 -4.923 -0.502 1.00 0.39 C ATOM 0 H VAL A 155 -5.587 -7.489 0.890 1.00 0.26 H new ATOM 0 HA VAL A 155 -4.689 -7.241 -1.873 1.00 0.28 H new ATOM 0 HB VAL A 155 -3.659 -5.894 0.631 1.00 0.34 H new ATOM 0 HG11 VAL A 155 -2.567 -4.363 -0.970 1.00 0.42 H new ATOM 0 HG12 VAL A 155 -1.987 -6.035 -1.158 1.00 0.42 H new ATOM 0 HG13 VAL A 155 -3.155 -5.363 -2.320 1.00 0.42 H new ATOM 0 HG21 VAL A 155 -4.866 -3.921 -0.203 1.00 0.39 H new ATOM 0 HG22 VAL A 155 -5.540 -4.899 -1.529 1.00 0.39 H new ATOM 0 HG23 VAL A 155 -5.971 -5.269 0.158 1.00 0.39 H new ATOM 2380 N GLU A 156 -3.072 -9.138 -1.553 1.00 0.32 N ATOM 2381 CA GLU A 156 -2.061 -10.161 -1.443 1.00 0.40 C ATOM 2382 C GLU A 156 -0.851 -9.774 -2.262 1.00 0.36 C ATOM 2383 O GLU A 156 -0.950 -9.567 -3.474 1.00 0.42 O ATOM 2384 CB GLU A 156 -2.604 -11.502 -1.925 1.00 0.61 C ATOM 2385 CG GLU A 156 -2.042 -12.680 -1.159 1.00 0.73 C ATOM 2386 CD GLU A 156 -2.256 -13.992 -1.873 1.00 1.41 C ATOM 2387 OE1 GLU A 156 -1.430 -14.346 -2.737 1.00 1.92 O ATOM 2388 OE2 GLU A 156 -3.248 -14.680 -1.566 1.00 1.98 O ATOM 0 H GLU A 156 -3.631 -9.185 -2.405 1.00 0.32 H new ATOM 0 HA GLU A 156 -1.774 -10.257 -0.396 1.00 0.40 H new ATOM 0 HB2 GLU A 156 -3.690 -11.502 -1.833 1.00 0.61 H new ATOM 0 HB3 GLU A 156 -2.373 -11.621 -2.984 1.00 0.61 H new ATOM 0 HG2 GLU A 156 -0.975 -12.528 -0.998 1.00 0.73 H new ATOM 0 HG3 GLU A 156 -2.509 -12.725 -0.175 1.00 0.73 H new ATOM 2395 N PHE A 157 0.281 -9.657 -1.600 1.00 0.41 N ATOM 2396 CA PHE A 157 1.512 -9.322 -2.278 1.00 0.43 C ATOM 2397 C PHE A 157 2.425 -10.537 -2.325 1.00 0.43 C ATOM 2398 O PHE A 157 2.868 -11.049 -1.290 1.00 0.51 O ATOM 2399 CB PHE A 157 2.201 -8.144 -1.589 1.00 0.55 C ATOM 2400 CG PHE A 157 3.474 -7.723 -2.255 1.00 0.88 C ATOM 2401 CD1 PHE A 157 4.677 -8.297 -1.893 1.00 1.19 C ATOM 2402 CD2 PHE A 157 3.466 -6.752 -3.240 1.00 1.46 C ATOM 2403 CE1 PHE A 157 5.850 -7.909 -2.498 1.00 1.85 C ATOM 2404 CE2 PHE A 157 4.636 -6.361 -3.848 1.00 2.17 C ATOM 2405 CZ PHE A 157 5.823 -6.948 -3.491 1.00 2.32 C ATOM 0 H PHE A 157 0.373 -9.789 -0.593 1.00 0.41 H new ATOM 0 HA PHE A 157 1.283 -9.022 -3.301 1.00 0.43 H new ATOM 0 HB2 PHE A 157 1.516 -7.297 -1.564 1.00 0.55 H new ATOM 0 HB3 PHE A 157 2.413 -8.412 -0.554 1.00 0.55 H new ATOM 0 HD1 PHE A 157 4.697 -9.058 -1.127 1.00 1.19 H new ATOM 0 HD2 PHE A 157 2.532 -6.297 -3.534 1.00 1.46 H new ATOM 0 HE1 PHE A 157 6.788 -8.353 -2.198 1.00 1.85 H new ATOM 0 HE2 PHE A 157 4.620 -5.592 -4.606 1.00 2.17 H new ATOM 0 HZ PHE A 157 6.738 -6.659 -3.987 1.00 2.32 H new ATOM 2415 N VAL A 158 2.693 -10.992 -3.532 1.00 0.44 N ATOM 2416 CA VAL A 158 3.491 -12.179 -3.743 1.00 0.48 C ATOM 2417 C VAL A 158 4.869 -11.808 -4.266 1.00 0.48 C ATOM 2418 O VAL A 158 5.011 -11.291 -5.374 1.00 0.47 O ATOM 2419 CB VAL A 158 2.815 -13.147 -4.737 1.00 0.52 C ATOM 2420 CG1 VAL A 158 3.618 -14.434 -4.879 1.00 0.62 C ATOM 2421 CG2 VAL A 158 1.390 -13.445 -4.299 1.00 0.59 C ATOM 0 H VAL A 158 2.364 -10.550 -4.391 1.00 0.44 H new ATOM 0 HA VAL A 158 3.586 -12.680 -2.780 1.00 0.48 H new ATOM 0 HB VAL A 158 2.783 -12.665 -5.714 1.00 0.52 H new ATOM 0 HG11 VAL A 158 3.119 -15.098 -5.585 1.00 0.62 H new ATOM 0 HG12 VAL A 158 4.618 -14.200 -5.245 1.00 0.62 H new ATOM 0 HG13 VAL A 158 3.692 -14.926 -3.909 1.00 0.62 H new ATOM 0 HG21 VAL A 158 0.926 -14.129 -5.010 1.00 0.59 H new ATOM 0 HG22 VAL A 158 1.402 -13.903 -3.310 1.00 0.59 H new ATOM 0 HG23 VAL A 158 0.819 -12.517 -4.263 1.00 0.59 H new ATOM 2431 N LYS A 159 5.874 -12.049 -3.445 1.00 0.58 N ATOM 2432 CA LYS A 159 7.262 -11.895 -3.859 1.00 0.66 C ATOM 2433 C LYS A 159 7.683 -13.076 -4.729 1.00 0.63 C ATOM 2434 O LYS A 159 7.189 -14.190 -4.555 1.00 0.77 O ATOM 2435 CB LYS A 159 8.189 -11.783 -2.637 1.00 0.93 C ATOM 2436 CG LYS A 159 7.668 -12.450 -1.362 1.00 1.36 C ATOM 2437 CD LYS A 159 7.356 -13.932 -1.545 1.00 1.66 C ATOM 2438 CE LYS A 159 8.586 -14.757 -1.888 1.00 1.99 C ATOM 2439 NZ LYS A 159 8.234 -16.188 -2.094 1.00 2.26 N ATOM 0 H LYS A 159 5.756 -12.355 -2.479 1.00 0.58 H new ATOM 0 HA LYS A 159 7.347 -10.976 -4.439 1.00 0.66 H new ATOM 0 HB2 LYS A 159 9.153 -12.223 -2.891 1.00 0.93 H new ATOM 0 HB3 LYS A 159 8.365 -10.727 -2.430 1.00 0.93 H new ATOM 0 HG2 LYS A 159 8.409 -12.336 -0.571 1.00 1.36 H new ATOM 0 HG3 LYS A 159 6.767 -11.933 -1.031 1.00 1.36 H new ATOM 0 HD2 LYS A 159 6.908 -14.320 -0.630 1.00 1.66 H new ATOM 0 HD3 LYS A 159 6.615 -14.047 -2.336 1.00 1.66 H new ATOM 0 HE2 LYS A 159 9.053 -14.361 -2.790 1.00 1.99 H new ATOM 0 HE3 LYS A 159 9.319 -14.672 -1.086 1.00 1.99 H new ATOM 0 HZ1 LYS A 159 9.101 -16.738 -2.260 1.00 2.26 H new ATOM 0 HZ2 LYS A 159 7.749 -16.551 -1.249 1.00 2.26 H new ATOM 0 HZ3 LYS A 159 7.606 -16.276 -2.918 1.00 2.26 H new ATOM 2453 N GLY A 160 8.579 -12.826 -5.670 1.00 0.75 N ATOM 2454 CA GLY A 160 9.089 -13.894 -6.504 1.00 0.91 C ATOM 2455 C GLY A 160 10.313 -14.552 -5.899 1.00 0.98 C ATOM 2456 O GLY A 160 10.327 -15.759 -5.666 1.00 1.45 O ATOM 0 H GLY A 160 8.963 -11.903 -5.872 1.00 0.75 H new ATOM 0 HA2 GLY A 160 8.310 -14.643 -6.651 1.00 0.91 H new ATOM 0 HA3 GLY A 160 9.340 -13.497 -7.488 1.00 0.91 H new ATOM 2460 N TYR A 161 11.338 -13.750 -5.636 1.00 1.01 N ATOM 2461 CA TYR A 161 12.574 -14.253 -5.044 1.00 1.21 C ATOM 2462 C TYR A 161 12.317 -14.692 -3.601 1.00 1.36 C ATOM 2463 O TYR A 161 12.289 -15.885 -3.296 1.00 2.24 O ATOM 2464 CB TYR A 161 13.653 -13.163 -5.088 1.00 1.55 C ATOM 2465 CG TYR A 161 15.067 -13.683 -4.943 1.00 1.94 C ATOM 2466 CD1 TYR A 161 15.634 -13.898 -3.692 1.00 2.65 C ATOM 2467 CD2 TYR A 161 15.841 -13.946 -6.066 1.00 2.07 C ATOM 2468 CE1 TYR A 161 16.929 -14.362 -3.567 1.00 3.41 C ATOM 2469 CE2 TYR A 161 17.136 -14.412 -5.949 1.00 2.73 C ATOM 2470 CZ TYR A 161 17.675 -14.618 -4.699 1.00 3.40 C ATOM 2471 OH TYR A 161 18.969 -15.078 -4.581 1.00 4.24 O ATOM 0 H TYR A 161 11.339 -12.747 -5.823 1.00 1.01 H new ATOM 0 HA TYR A 161 12.923 -15.114 -5.614 1.00 1.21 H new ATOM 0 HB2 TYR A 161 13.571 -12.624 -6.032 1.00 1.55 H new ATOM 0 HB3 TYR A 161 13.459 -12.443 -4.293 1.00 1.55 H new ATOM 0 HD1 TYR A 161 15.053 -13.699 -2.804 1.00 2.65 H new ATOM 0 HD2 TYR A 161 15.423 -13.783 -7.048 1.00 2.07 H new ATOM 0 HE1 TYR A 161 17.355 -14.524 -2.588 1.00 3.41 H new ATOM 0 HE2 TYR A 161 17.722 -14.614 -6.833 1.00 2.73 H new ATOM 0 HH TYR A 161 19.352 -15.208 -5.473 1.00 4.24 H new ATOM 2481 N TYR A 162 12.125 -13.710 -2.730 1.00 1.19 N ATOM 2482 CA TYR A 162 11.751 -13.938 -1.338 1.00 1.26 C ATOM 2483 C TYR A 162 11.512 -12.593 -0.684 1.00 1.24 C ATOM 2484 O TYR A 162 10.499 -12.369 -0.023 1.00 2.08 O ATOM 2485 CB TYR A 162 12.836 -14.704 -0.573 1.00 1.59 C ATOM 2486 CG TYR A 162 12.459 -14.988 0.864 1.00 2.17 C ATOM 2487 CD1 TYR A 162 11.627 -16.052 1.190 1.00 2.54 C ATOM 2488 CD2 TYR A 162 12.945 -14.194 1.893 1.00 2.97 C ATOM 2489 CE1 TYR A 162 11.291 -16.315 2.502 1.00 3.35 C ATOM 2490 CE2 TYR A 162 12.615 -14.453 3.207 1.00 3.90 C ATOM 2491 CZ TYR A 162 11.747 -15.507 3.497 1.00 3.99 C ATOM 2492 OH TYR A 162 11.461 -15.773 4.819 1.00 4.98 O ATOM 0 H TYR A 162 12.225 -12.724 -2.971 1.00 1.19 H new ATOM 0 HA TYR A 162 10.848 -14.548 -1.312 1.00 1.26 H new ATOM 0 HB2 TYR A 162 13.036 -15.646 -1.083 1.00 1.59 H new ATOM 0 HB3 TYR A 162 13.761 -14.128 -0.593 1.00 1.59 H new ATOM 0 HD1 TYR A 162 11.237 -16.683 0.405 1.00 2.54 H new ATOM 0 HD2 TYR A 162 13.592 -13.360 1.662 1.00 2.97 H new ATOM 0 HE1 TYR A 162 10.666 -17.163 2.739 1.00 3.35 H new ATOM 0 HE2 TYR A 162 13.024 -13.847 4.002 1.00 3.90 H new ATOM 0 HH TYR A 162 11.872 -15.088 5.387 1.00 4.98 H new ATOM 2502 N ASP A 163 12.465 -11.707 -0.898 1.00 1.09 N ATOM 2503 CA ASP A 163 12.355 -10.316 -0.495 1.00 1.04 C ATOM 2504 C ASP A 163 11.280 -9.626 -1.286 1.00 1.04 C ATOM 2505 O ASP A 163 11.002 -9.947 -2.443 1.00 1.79 O ATOM 2506 CB ASP A 163 13.688 -9.603 -0.729 1.00 1.31 C ATOM 2507 CG ASP A 163 14.116 -9.669 -2.185 1.00 2.02 C ATOM 2508 OD1 ASP A 163 14.651 -10.716 -2.614 1.00 2.55 O ATOM 2509 OD2 ASP A 163 13.939 -8.660 -2.902 1.00 2.64 O ATOM 0 H ASP A 163 13.346 -11.933 -1.360 1.00 1.09 H new ATOM 0 HA ASP A 163 12.099 -10.280 0.564 1.00 1.04 H new ATOM 0 HB2 ASP A 163 13.601 -8.561 -0.423 1.00 1.31 H new ATOM 0 HB3 ASP A 163 14.457 -10.056 -0.103 1.00 1.31 H new ATOM 2514 N ASN A 164 10.666 -8.706 -0.608 1.00 0.87 N ATOM 2515 CA ASN A 164 9.687 -7.830 -1.172 1.00 0.88 C ATOM 2516 C ASN A 164 10.280 -6.427 -1.128 1.00 1.12 C ATOM 2517 O ASN A 164 11.450 -6.291 -0.770 1.00 1.48 O ATOM 2518 CB ASN A 164 8.391 -7.948 -0.353 1.00 1.20 C ATOM 2519 CG ASN A 164 8.645 -8.135 1.140 1.00 1.19 C ATOM 2520 OD1 ASN A 164 8.828 -7.172 1.870 1.00 2.06 O ATOM 2521 ND2 ASN A 164 8.608 -9.381 1.616 1.00 1.23 N ATOM 0 H ASN A 164 10.838 -8.539 0.383 1.00 0.87 H new ATOM 0 HA ASN A 164 9.438 -8.079 -2.203 1.00 0.88 H new ATOM 0 HB2 ASN A 164 7.789 -7.052 -0.504 1.00 1.20 H new ATOM 0 HB3 ASN A 164 7.808 -8.790 -0.725 1.00 1.20 H new ATOM 0 HD21 ASN A 164 8.734 -9.550 2.614 1.00 1.23 H new ATOM 0 HD22 ASN A 164 8.453 -10.165 0.982 1.00 1.23 H new ATOM 2528 N PRO A 165 9.543 -5.367 -1.504 1.00 1.68 N ATOM 2529 CA PRO A 165 10.005 -3.994 -1.275 1.00 2.10 C ATOM 2530 C PRO A 165 10.456 -3.809 0.168 1.00 1.62 C ATOM 2531 O PRO A 165 11.319 -2.987 0.469 1.00 2.28 O ATOM 2532 CB PRO A 165 8.760 -3.161 -1.560 1.00 2.94 C ATOM 2533 CG PRO A 165 8.004 -3.963 -2.559 1.00 3.16 C ATOM 2534 CD PRO A 165 8.249 -5.401 -2.201 1.00 2.35 C ATOM 0 HA PRO A 165 10.860 -3.719 -1.893 1.00 2.10 H new ATOM 0 HB2 PRO A 165 8.175 -2.998 -0.655 1.00 2.94 H new ATOM 0 HB3 PRO A 165 9.020 -2.178 -1.953 1.00 2.94 H new ATOM 0 HG2 PRO A 165 6.940 -3.728 -2.525 1.00 3.16 H new ATOM 0 HG3 PRO A 165 8.346 -3.749 -3.572 1.00 3.16 H new ATOM 0 HD2 PRO A 165 7.459 -5.795 -1.562 1.00 2.35 H new ATOM 0 HD3 PRO A 165 8.287 -6.034 -3.087 1.00 2.35 H new ATOM 2542 N LYS A 166 9.855 -4.629 1.029 1.00 0.98 N ATOM 2543 CA LYS A 166 10.130 -4.696 2.456 1.00 0.66 C ATOM 2544 C LYS A 166 9.243 -3.696 3.199 1.00 0.59 C ATOM 2545 O LYS A 166 8.726 -3.994 4.278 1.00 0.75 O ATOM 2546 CB LYS A 166 11.612 -4.465 2.780 1.00 1.09 C ATOM 2547 CG LYS A 166 12.072 -5.152 4.059 1.00 1.74 C ATOM 2548 CD LYS A 166 13.507 -4.793 4.406 1.00 2.26 C ATOM 2549 CE LYS A 166 14.121 -5.787 5.381 1.00 2.74 C ATOM 2550 NZ LYS A 166 13.304 -5.956 6.609 1.00 3.18 N ATOM 0 H LYS A 166 9.135 -5.289 0.736 1.00 0.98 H new ATOM 0 HA LYS A 166 9.896 -5.706 2.793 1.00 0.66 H new ATOM 0 HB2 LYS A 166 12.217 -4.823 1.947 1.00 1.09 H new ATOM 0 HB3 LYS A 166 11.793 -3.394 2.868 1.00 1.09 H new ATOM 0 HG2 LYS A 166 11.416 -4.866 4.882 1.00 1.74 H new ATOM 0 HG3 LYS A 166 11.985 -6.232 3.943 1.00 1.74 H new ATOM 0 HD2 LYS A 166 14.104 -4.762 3.495 1.00 2.26 H new ATOM 0 HD3 LYS A 166 13.536 -3.794 4.840 1.00 2.26 H new ATOM 0 HE2 LYS A 166 14.234 -6.752 4.888 1.00 2.74 H new ATOM 0 HE3 LYS A 166 15.121 -5.451 5.657 1.00 2.74 H new ATOM 0 HZ1 LYS A 166 13.709 -6.715 7.194 1.00 3.18 H new ATOM 0 HZ2 LYS A 166 13.301 -5.067 7.149 1.00 3.18 H new ATOM 0 HZ3 LYS A 166 12.329 -6.204 6.346 1.00 3.18 H new ATOM 2564 N VAL A 167 9.063 -2.509 2.611 1.00 0.49 N ATOM 2565 CA VAL A 167 8.136 -1.521 3.160 1.00 0.44 C ATOM 2566 C VAL A 167 6.800 -1.573 2.437 1.00 0.38 C ATOM 2567 O VAL A 167 6.770 -1.519 1.197 1.00 0.39 O ATOM 2568 CB VAL A 167 8.713 -0.095 3.015 1.00 0.53 C ATOM 2569 CG1 VAL A 167 7.643 0.955 3.258 1.00 1.15 C ATOM 2570 CG2 VAL A 167 9.889 0.114 3.953 1.00 1.19 C ATOM 0 H VAL A 167 9.544 -2.213 1.762 1.00 0.49 H new ATOM 0 HA VAL A 167 7.993 -1.758 4.214 1.00 0.44 H new ATOM 0 HB VAL A 167 9.070 0.015 1.991 1.00 0.53 H new ATOM 0 HG11 VAL A 167 8.077 1.949 3.149 1.00 1.15 H new ATOM 0 HG12 VAL A 167 6.839 0.829 2.533 1.00 1.15 H new ATOM 0 HG13 VAL A 167 7.244 0.841 4.266 1.00 1.15 H new ATOM 0 HG21 VAL A 167 10.276 1.125 3.831 1.00 1.19 H new ATOM 0 HG22 VAL A 167 9.562 -0.028 4.983 1.00 1.19 H new ATOM 0 HG23 VAL A 167 10.673 -0.606 3.719 1.00 1.19 H new ATOM 2580 N CYS A 168 5.692 -1.602 3.201 1.00 0.38 N ATOM 2581 CA CYS A 168 4.372 -1.679 2.575 1.00 0.40 C ATOM 2582 C CYS A 168 3.329 -0.826 3.308 1.00 0.47 C ATOM 2583 O CYS A 168 2.677 -1.277 4.237 1.00 0.94 O ATOM 2584 CB CYS A 168 3.921 -3.133 2.506 1.00 0.48 C ATOM 2585 SG CYS A 168 2.443 -3.405 1.504 1.00 1.36 S ATOM 0 H CYS A 168 5.688 -1.574 4.221 1.00 0.38 H new ATOM 0 HA CYS A 168 4.458 -1.274 1.567 1.00 0.40 H new ATOM 0 HB2 CYS A 168 4.735 -3.735 2.103 1.00 0.48 H new ATOM 0 HB3 CYS A 168 3.731 -3.491 3.518 1.00 0.48 H new ATOM 0 HG CYS A 168 2.768 -3.418 0.245 1.00 1.36 H new ATOM 2591 N ALA A 169 3.157 0.390 2.822 1.00 0.29 N ATOM 2592 CA ALA A 169 2.286 1.411 3.410 1.00 0.28 C ATOM 2593 C ALA A 169 0.841 1.336 2.917 1.00 0.27 C ATOM 2594 O ALA A 169 0.275 2.361 2.542 1.00 0.28 O ATOM 2595 CB ALA A 169 2.842 2.797 3.200 1.00 0.31 C ATOM 0 H ALA A 169 3.632 0.712 1.979 1.00 0.29 H new ATOM 0 HA ALA A 169 2.264 1.197 4.478 1.00 0.28 H new ATOM 0 HB1 ALA A 169 2.171 3.530 3.648 1.00 0.31 H new ATOM 0 HB2 ALA A 169 3.824 2.870 3.668 1.00 0.31 H new ATOM 0 HB3 ALA A 169 2.933 2.994 2.132 1.00 0.31 H new ATOM 2601 N LEU A 170 0.338 0.115 2.746 1.00 0.28 N ATOM 2602 CA LEU A 170 -1.051 -0.143 2.326 1.00 0.32 C ATOM 2603 C LEU A 170 -2.018 0.946 2.821 1.00 0.32 C ATOM 2604 O LEU A 170 -1.991 1.324 3.983 1.00 0.52 O ATOM 2605 CB LEU A 170 -1.501 -1.483 2.924 1.00 0.48 C ATOM 2606 CG LEU A 170 -2.438 -2.350 2.075 1.00 0.39 C ATOM 2607 CD1 LEU A 170 -3.464 -1.520 1.322 1.00 0.66 C ATOM 2608 CD2 LEU A 170 -1.634 -3.211 1.116 1.00 0.69 C ATOM 0 H LEU A 170 0.882 -0.735 2.895 1.00 0.28 H new ATOM 0 HA LEU A 170 -1.073 -0.154 1.236 1.00 0.32 H new ATOM 0 HB2 LEU A 170 -0.610 -2.069 3.149 1.00 0.48 H new ATOM 0 HB3 LEU A 170 -1.997 -1.280 3.873 1.00 0.48 H new ATOM 0 HG LEU A 170 -2.991 -2.997 2.756 1.00 0.39 H new ATOM 0 HD11 LEU A 170 -4.105 -2.178 0.735 1.00 0.66 H new ATOM 0 HD12 LEU A 170 -4.072 -0.961 2.033 1.00 0.66 H new ATOM 0 HD13 LEU A 170 -2.952 -0.824 0.657 1.00 0.66 H new ATOM 0 HD21 LEU A 170 -2.312 -3.821 0.519 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -1.047 -2.571 0.457 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -0.965 -3.859 1.682 1.00 0.69 H new ATOM 2620 N PHE A 171 -2.858 1.453 1.933 1.00 0.27 N ATOM 2621 CA PHE A 171 -3.929 2.358 2.322 1.00 0.27 C ATOM 2622 C PHE A 171 -5.165 2.126 1.455 1.00 0.27 C ATOM 2623 O PHE A 171 -5.123 2.331 0.247 1.00 0.34 O ATOM 2624 CB PHE A 171 -3.445 3.808 2.205 1.00 0.32 C ATOM 2625 CG PHE A 171 -4.549 4.817 2.099 1.00 0.29 C ATOM 2626 CD1 PHE A 171 -5.548 4.863 3.059 1.00 0.33 C ATOM 2627 CD2 PHE A 171 -4.589 5.722 1.052 1.00 0.38 C ATOM 2628 CE1 PHE A 171 -6.563 5.791 2.976 1.00 0.41 C ATOM 2629 CE2 PHE A 171 -5.600 6.654 0.967 1.00 0.48 C ATOM 2630 CZ PHE A 171 -6.592 6.677 1.880 1.00 0.47 C ATOM 0 H PHE A 171 -2.819 1.252 0.934 1.00 0.27 H new ATOM 0 HA PHE A 171 -4.205 2.162 3.358 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -2.832 4.046 3.075 1.00 0.32 H new ATOM 0 HB3 PHE A 171 -2.803 3.895 1.329 1.00 0.32 H new ATOM 0 HD1 PHE A 171 -5.530 4.163 3.882 1.00 0.33 H new ATOM 0 HD2 PHE A 171 -3.820 5.697 0.294 1.00 0.38 H new ATOM 0 HE1 PHE A 171 -7.325 5.839 3.740 1.00 0.41 H new ATOM 0 HE2 PHE A 171 -5.598 7.373 0.161 1.00 0.48 H new ATOM 0 HZ PHE A 171 -7.409 7.375 1.771 1.00 0.47 H new ATOM 2640 N ILE A 172 -6.265 1.681 2.055 1.00 0.23 N ATOM 2641 CA ILE A 172 -7.511 1.588 1.314 1.00 0.23 C ATOM 2642 C ILE A 172 -8.547 2.570 1.859 1.00 0.23 C ATOM 2643 O ILE A 172 -8.855 2.610 3.064 1.00 0.24 O ATOM 2644 CB ILE A 172 -8.121 0.167 1.258 1.00 0.23 C ATOM 2645 CG1 ILE A 172 -9.315 0.179 0.294 1.00 0.26 C ATOM 2646 CG2 ILE A 172 -8.543 -0.327 2.628 1.00 0.21 C ATOM 2647 CD1 ILE A 172 -10.080 -1.126 0.247 1.00 0.30 C ATOM 0 H ILE A 172 -6.317 1.386 3.030 1.00 0.23 H new ATOM 0 HA ILE A 172 -7.246 1.849 0.289 1.00 0.23 H new ATOM 0 HB ILE A 172 -7.358 -0.524 0.899 1.00 0.23 H new ATOM 0 HG12 ILE A 172 -9.997 0.978 0.586 1.00 0.26 H new ATOM 0 HG13 ILE A 172 -8.958 0.415 -0.708 1.00 0.26 H new ATOM 0 HG21 ILE A 172 -8.965 -1.328 2.540 1.00 0.21 H new ATOM 0 HG22 ILE A 172 -7.676 -0.356 3.287 1.00 0.21 H new ATOM 0 HG23 ILE A 172 -9.292 0.347 3.043 1.00 0.21 H new ATOM 0 HD11 ILE A 172 -10.908 -1.037 -0.456 1.00 0.30 H new ATOM 0 HD12 ILE A 172 -9.414 -1.927 -0.075 1.00 0.30 H new ATOM 0 HD13 ILE A 172 -10.470 -1.355 1.239 1.00 0.30 H new ATOM 2659 N MET A 173 -9.059 3.377 0.961 1.00 0.24 N ATOM 2660 CA MET A 173 -10.106 4.326 1.288 1.00 0.25 C ATOM 2661 C MET A 173 -11.355 3.987 0.484 1.00 0.27 C ATOM 2662 O MET A 173 -11.273 3.245 -0.493 1.00 0.31 O ATOM 2663 CB MET A 173 -9.645 5.743 0.973 1.00 0.28 C ATOM 2664 CG MET A 173 -9.258 5.932 -0.480 1.00 0.33 C ATOM 2665 SD MET A 173 -9.075 7.663 -0.905 1.00 0.99 S ATOM 2666 CE MET A 173 -10.570 8.276 -0.153 1.00 0.50 C ATOM 0 H MET A 173 -8.765 3.398 -0.016 1.00 0.24 H new ATOM 0 HA MET A 173 -10.333 4.267 2.352 1.00 0.25 H new ATOM 0 HB2 MET A 173 -10.442 6.443 1.225 1.00 0.28 H new ATOM 0 HB3 MET A 173 -8.792 5.990 1.605 1.00 0.28 H new ATOM 0 HG2 MET A 173 -8.322 5.409 -0.677 1.00 0.33 H new ATOM 0 HG3 MET A 173 -10.016 5.480 -1.119 1.00 0.33 H new ATOM 0 HE1 MET A 173 -10.800 9.263 -0.553 1.00 0.50 H new ATOM 0 HE2 MET A 173 -11.393 7.595 -0.371 1.00 0.50 H new ATOM 0 HE3 MET A 173 -10.433 8.345 0.926 1.00 0.50 H new ATOM 2676 N LYS A 174 -12.504 4.516 0.877 1.00 0.30 N ATOM 2677 CA LYS A 174 -13.744 4.137 0.218 1.00 0.34 C ATOM 2678 C LYS A 174 -14.464 5.325 -0.403 1.00 0.30 C ATOM 2679 O LYS A 174 -14.361 6.457 0.049 1.00 0.33 O ATOM 2680 CB LYS A 174 -14.701 3.445 1.194 1.00 0.50 C ATOM 2681 CG LYS A 174 -15.449 4.413 2.101 1.00 0.69 C ATOM 2682 CD LYS A 174 -16.956 4.198 2.060 1.00 0.77 C ATOM 2683 CE LYS A 174 -17.330 2.752 2.315 1.00 0.74 C ATOM 2684 NZ LYS A 174 -16.831 2.264 3.628 1.00 1.22 N ATOM 0 H LYS A 174 -12.604 5.194 1.632 1.00 0.30 H new ATOM 0 HA LYS A 174 -13.458 3.449 -0.578 1.00 0.34 H new ATOM 0 HB2 LYS A 174 -15.424 2.858 0.627 1.00 0.50 H new ATOM 0 HB3 LYS A 174 -14.136 2.745 1.810 1.00 0.50 H new ATOM 0 HG2 LYS A 174 -15.095 4.294 3.125 1.00 0.69 H new ATOM 0 HG3 LYS A 174 -15.222 5.436 1.802 1.00 0.69 H new ATOM 0 HD2 LYS A 174 -17.433 4.833 2.806 1.00 0.77 H new ATOM 0 HD3 LYS A 174 -17.340 4.506 1.087 1.00 0.77 H new ATOM 0 HE2 LYS A 174 -18.414 2.648 2.279 1.00 0.74 H new ATOM 0 HE3 LYS A 174 -16.923 2.128 1.519 1.00 0.74 H new ATOM 0 HZ1 LYS A 174 -16.272 1.398 3.487 1.00 1.22 H new ATOM 0 HZ2 LYS A 174 -16.233 2.994 4.065 1.00 1.22 H new ATOM 0 HZ3 LYS A 174 -17.638 2.058 4.251 1.00 1.22 H new ATOM 2698 N GLY A 175 -15.163 5.029 -1.466 1.00 0.28 N ATOM 2699 CA GLY A 175 -16.199 5.890 -1.983 1.00 0.28 C ATOM 2700 C GLY A 175 -15.797 6.684 -3.207 1.00 0.28 C ATOM 2701 O GLY A 175 -16.647 6.906 -4.067 1.00 0.31 O ATOM 0 H GLY A 175 -15.029 4.174 -2.005 1.00 0.28 H new ATOM 0 HA2 GLY A 175 -17.070 5.283 -2.228 1.00 0.28 H new ATOM 0 HA3 GLY A 175 -16.504 6.583 -1.199 1.00 0.28 H new ATOM 2705 N THR A 176 -14.509 7.021 -3.349 1.00 0.27 N ATOM 2706 CA THR A 176 -14.041 7.771 -4.513 1.00 0.32 C ATOM 2707 C THR A 176 -12.530 7.961 -4.503 1.00 0.38 C ATOM 2708 O THR A 176 -11.883 7.847 -3.463 1.00 0.44 O ATOM 2709 CB THR A 176 -14.652 9.178 -4.575 1.00 0.43 C ATOM 2710 OG1 THR A 176 -15.282 9.519 -3.328 1.00 0.57 O ATOM 2711 CG2 THR A 176 -15.651 9.309 -5.717 1.00 0.68 C ATOM 0 H THR A 176 -13.780 6.787 -2.676 1.00 0.27 H new ATOM 0 HA THR A 176 -14.350 7.176 -5.372 1.00 0.32 H new ATOM 0 HB THR A 176 -13.835 9.875 -4.760 1.00 0.43 H new ATOM 0 HG1 THR A 176 -15.663 10.420 -3.390 1.00 0.57 H new ATOM 0 HG21 THR A 176 -16.061 10.319 -5.727 1.00 0.68 H new ATOM 0 HG22 THR A 176 -15.149 9.112 -6.664 1.00 0.68 H new ATOM 0 HG23 THR A 176 -16.459 8.591 -5.578 1.00 0.68 H new ATOM 2719 N ALA A 177 -11.980 8.251 -5.683 1.00 0.50 N ATOM 2720 CA ALA A 177 -10.600 8.704 -5.812 1.00 0.65 C ATOM 2721 C ALA A 177 -10.525 10.214 -5.615 1.00 0.68 C ATOM 2722 O ALA A 177 -9.449 10.789 -5.526 1.00 0.86 O ATOM 2723 CB ALA A 177 -10.037 8.320 -7.172 1.00 0.82 C ATOM 0 H ALA A 177 -12.478 8.178 -6.570 1.00 0.50 H new ATOM 0 HA ALA A 177 -10.000 8.218 -5.042 1.00 0.65 H new ATOM 0 HB1 ALA A 177 -9.006 8.666 -7.250 1.00 0.82 H new ATOM 0 HB2 ALA A 177 -10.065 7.236 -7.285 1.00 0.82 H new ATOM 0 HB3 ALA A 177 -10.635 8.782 -7.957 1.00 0.82 H new ATOM 2729 N ASP A 178 -11.686 10.850 -5.570 1.00 0.61 N ATOM 2730 CA ASP A 178 -11.776 12.303 -5.447 1.00 0.68 C ATOM 2731 C ASP A 178 -11.397 12.773 -4.046 1.00 0.67 C ATOM 2732 O ASP A 178 -11.097 13.948 -3.840 1.00 0.79 O ATOM 2733 CB ASP A 178 -13.195 12.776 -5.780 1.00 0.82 C ATOM 2734 CG ASP A 178 -13.557 12.584 -7.241 1.00 1.38 C ATOM 2735 OD1 ASP A 178 -13.726 11.423 -7.667 1.00 2.16 O ATOM 2736 OD2 ASP A 178 -13.656 13.593 -7.975 1.00 1.60 O ATOM 0 H ASP A 178 -12.590 10.379 -5.617 1.00 0.61 H new ATOM 0 HA ASP A 178 -11.069 12.736 -6.155 1.00 0.68 H new ATOM 0 HB2 ASP A 178 -13.908 12.232 -5.160 1.00 0.82 H new ATOM 0 HB3 ASP A 178 -13.290 13.831 -5.524 1.00 0.82 H new TER 2741 ASP A 178