USER MOD reduce.3.24.130724 H: found=0, std=0, add=1560, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1558 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 LYS NZ :NH3+ 156:sc= 1.28 (180deg=0) USER MOD Set 1.2: A 154 THR OG1 : rot 180:sc= 1.1 USER MOD Set 2.1: A 6 GLN : amide:sc= -0.458 K(o=-0.31,f=-3.2!) USER MOD Set 2.2: A 97 TYR OH : rot 115:sc= 0.145 USER MOD Set 3.1: A 77 SER OG : rot 176:sc= 0.425 USER MOD Set 3.2: A 79 LYS NZ :NH3+ -130:sc= 0.467 (180deg=0) USER MOD Set 4.1: A 48 ASN : amide:sc= -0.103 K(o=-1.3,f=-0.41) USER MOD Set 4.2: A 98 GLN : amide:sc= -1.15 K(o=-1.3,f=-0.17) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0739 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.0054) USER MOD Single : A 13 HIS : no HD1:sc= -0.467 K(o=-0.47,f=0.12) USER MOD Single : A 16 SER OG : rot 12:sc= 0.935 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc=-0.00816 K(o=-0.0082,f=-0.66) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 81:sc= 0.189 USER MOD Single : A 32 LYS NZ :NH3+ 164:sc= -0.0301 (180deg=-0.269) USER MOD Single : A 33 ASN : amide:sc= -1.92! C(o=-1.9!,f=-9.1!) USER MOD Single : A 39 SER OG : rot 180:sc= -0.0196 USER MOD Single : A 45 LYS NZ :NH3+ 160:sc= 1.22 (180deg=1.11) USER MOD Single : A 46 MET CE :methyl 160:sc= -0.0644 (180deg=-0.477) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= -0.262 (180deg=-0.76) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -1.78 K(o=-1.8,f=-2.4) USER MOD Single : A 68 ASN : amide:sc= -0.0958 K(o=-0.096,f=-0.96) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot 180:sc= -2.24! USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 CYS SG : rot 6:sc= 0.0304 USER MOD Single : A 94 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.0115) USER MOD Single : A 95 LYS NZ :NH3+ -167:sc= 0.124 (180deg=0.0869) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.013 USER MOD Single : A 111 TYR OH : rot 130:sc= -1.45! USER MOD Single : A 115 HIS : no HD1:sc= -0.676 X(o=-0.68,f=-0.4) USER MOD Single : A 117 THR OG1 : rot 32:sc= 1.16 USER MOD Single : A 121 SER OG : rot 180:sc= -0.196 USER MOD Single : A 122 TYR OH : rot 179:sc= 0.287 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc= -0.142 K(o=-0.14,f=-1.4!) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc=-0.00881 X(o=-0.0088,f=-0.013) USER MOD Single : A 139 GLN : amide:sc= 0.762 K(o=0.76,f=-0.0048) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 160:sc= -0.0144 (180deg=-0.153) USER MOD Single : A 145 ASN : amide:sc= -0.0907 X(o=-0.091,f=-0.54) USER MOD Single : A 146 GLN : amide:sc= -0.694 K(o=-0.69,f=-0.096) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ -171:sc= 0.597 (180deg=0.275) USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 161:sc= 1.25 (180deg=1.04) USER MOD Single : A 166 THR OG1 : rot 180:sc= 0 USER MOD Single : A 167 TYR OH : rot 13:sc= 1.12 USER MOD Single : A 171 LYS NZ :NH3+ 172:sc= 1.08 (180deg=0.875) USER MOD Single : A 172 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0105) USER MOD ----------------------------------------------------------------- ATOM 20 N LEU A 2 -10.390 -14.079 4.101 1.00 0.61 N ATOM 21 CA LEU A 2 -10.698 -14.038 2.681 1.00 0.57 C ATOM 22 C LEU A 2 -9.631 -14.786 1.896 1.00 0.52 C ATOM 23 O LEU A 2 -8.512 -14.971 2.379 1.00 0.60 O ATOM 24 CB LEU A 2 -10.824 -12.594 2.178 1.00 0.59 C ATOM 25 CG LEU A 2 -9.655 -11.664 2.517 1.00 0.64 C ATOM 26 CD1 LEU A 2 -9.371 -10.729 1.355 1.00 1.05 C ATOM 27 CD2 LEU A 2 -9.955 -10.860 3.773 1.00 0.96 C ATOM 0 HA LEU A 2 -11.660 -14.526 2.527 1.00 0.57 H new ATOM 0 HB2 LEU A 2 -10.943 -12.616 1.095 1.00 0.59 H new ATOM 0 HB3 LEU A 2 -11.737 -12.164 2.591 1.00 0.59 H new ATOM 0 HG LEU A 2 -8.773 -12.277 2.701 1.00 0.64 H new ATOM 0 HD11 LEU A 2 -8.538 -10.074 1.610 1.00 1.05 H new ATOM 0 HD12 LEU A 2 -9.115 -11.314 0.471 1.00 1.05 H new ATOM 0 HD13 LEU A 2 -10.256 -10.127 1.148 1.00 1.05 H new ATOM 0 HD21 LEU A 2 -9.112 -10.206 3.996 1.00 0.96 H new ATOM 0 HD22 LEU A 2 -10.850 -10.258 3.614 1.00 0.96 H new ATOM 0 HD23 LEU A 2 -10.119 -11.539 4.610 1.00 0.96 H new ATOM 39 N THR A 3 -9.965 -15.200 0.688 1.00 0.46 N ATOM 40 CA THR A 3 -9.038 -15.942 -0.146 1.00 0.42 C ATOM 41 C THR A 3 -8.497 -15.052 -1.258 1.00 0.39 C ATOM 42 O THR A 3 -8.979 -13.931 -1.443 1.00 0.40 O ATOM 43 CB THR A 3 -9.736 -17.167 -0.764 1.00 0.44 C ATOM 44 OG1 THR A 3 -11.090 -16.834 -1.097 1.00 0.51 O ATOM 45 CG2 THR A 3 -9.718 -18.346 0.199 1.00 0.52 C ATOM 0 H THR A 3 -10.876 -15.034 0.261 1.00 0.46 H new ATOM 0 HA THR A 3 -8.211 -16.278 0.479 1.00 0.42 H new ATOM 0 HB THR A 3 -9.196 -17.453 -1.667 1.00 0.44 H new ATOM 0 HG1 THR A 3 -11.531 -17.615 -1.492 1.00 0.51 H new ATOM 0 HG21 THR A 3 -10.217 -19.199 -0.261 1.00 0.52 H new ATOM 0 HG22 THR A 3 -8.686 -18.611 0.431 1.00 0.52 H new ATOM 0 HG23 THR A 3 -10.238 -18.073 1.118 1.00 0.52 H new ATOM 53 N LEU A 4 -7.490 -15.547 -1.977 1.00 0.39 N ATOM 54 CA LEU A 4 -6.882 -14.814 -3.087 1.00 0.40 C ATOM 55 C LEU A 4 -7.939 -14.278 -4.050 1.00 0.39 C ATOM 56 O LEU A 4 -7.929 -13.101 -4.400 1.00 0.41 O ATOM 57 CB LEU A 4 -5.910 -15.728 -3.843 1.00 0.43 C ATOM 58 CG LEU A 4 -5.259 -15.117 -5.090 1.00 0.63 C ATOM 59 CD1 LEU A 4 -4.360 -13.953 -4.712 1.00 1.14 C ATOM 60 CD2 LEU A 4 -4.470 -16.172 -5.852 1.00 1.69 C ATOM 0 H LEU A 4 -7.074 -16.463 -1.808 1.00 0.39 H new ATOM 0 HA LEU A 4 -6.342 -13.963 -2.671 1.00 0.40 H new ATOM 0 HB2 LEU A 4 -5.121 -16.036 -3.157 1.00 0.43 H new ATOM 0 HB3 LEU A 4 -6.444 -16.631 -4.139 1.00 0.43 H new ATOM 0 HG LEU A 4 -6.051 -14.742 -5.738 1.00 0.63 H new ATOM 0 HD11 LEU A 4 -3.909 -13.535 -5.612 1.00 1.14 H new ATOM 0 HD12 LEU A 4 -4.950 -13.185 -4.211 1.00 1.14 H new ATOM 0 HD13 LEU A 4 -3.575 -14.302 -4.041 1.00 1.14 H new ATOM 0 HD21 LEU A 4 -4.015 -15.720 -6.734 1.00 1.69 H new ATOM 0 HD22 LEU A 4 -3.689 -16.578 -5.209 1.00 1.69 H new ATOM 0 HD23 LEU A 4 -5.140 -16.975 -6.160 1.00 1.69 H new ATOM 72 N ILE A 5 -8.859 -15.146 -4.455 1.00 0.40 N ATOM 73 CA ILE A 5 -9.906 -14.759 -5.384 1.00 0.42 C ATOM 74 C ILE A 5 -10.884 -13.768 -4.759 1.00 0.40 C ATOM 75 O ILE A 5 -11.200 -12.748 -5.366 1.00 0.40 O ATOM 76 CB ILE A 5 -10.682 -15.990 -5.901 1.00 0.48 C ATOM 77 CG1 ILE A 5 -11.900 -15.548 -6.717 1.00 1.32 C ATOM 78 CG2 ILE A 5 -11.100 -16.879 -4.743 1.00 1.22 C ATOM 79 CD1 ILE A 5 -12.793 -16.690 -7.154 1.00 1.94 C ATOM 0 H ILE A 5 -8.899 -16.120 -4.154 1.00 0.40 H new ATOM 0 HA ILE A 5 -9.410 -14.272 -6.224 1.00 0.42 H new ATOM 0 HB ILE A 5 -10.026 -16.568 -6.553 1.00 0.48 H new ATOM 0 HG12 ILE A 5 -12.487 -14.847 -6.124 1.00 1.32 H new ATOM 0 HG13 ILE A 5 -11.557 -15.009 -7.600 1.00 1.32 H new ATOM 0 HG21 ILE A 5 -11.646 -17.742 -5.125 1.00 1.22 H new ATOM 0 HG22 ILE A 5 -10.214 -17.219 -4.207 1.00 1.22 H new ATOM 0 HG23 ILE A 5 -11.741 -16.316 -4.065 1.00 1.22 H new ATOM 0 HD11 ILE A 5 -13.633 -16.297 -7.726 1.00 1.94 H new ATOM 0 HD12 ILE A 5 -12.223 -17.381 -7.775 1.00 1.94 H new ATOM 0 HD13 ILE A 5 -13.167 -17.216 -6.276 1.00 1.94 H new ATOM 91 N GLN A 6 -11.347 -14.058 -3.545 1.00 0.38 N ATOM 92 CA GLN A 6 -12.288 -13.178 -2.858 1.00 0.38 C ATOM 93 C GLN A 6 -11.733 -11.763 -2.757 1.00 0.36 C ATOM 94 O GLN A 6 -12.368 -10.813 -3.203 1.00 0.37 O ATOM 95 CB GLN A 6 -12.586 -13.714 -1.455 1.00 0.40 C ATOM 96 CG GLN A 6 -13.989 -14.279 -1.290 1.00 0.77 C ATOM 97 CD GLN A 6 -15.052 -13.199 -1.224 1.00 0.81 C ATOM 98 OE1 GLN A 6 -15.305 -12.625 -0.168 1.00 1.38 O ATOM 99 NE2 GLN A 6 -15.699 -12.931 -2.347 1.00 0.99 N ATOM 0 H GLN A 6 -11.087 -14.892 -3.019 1.00 0.38 H new ATOM 0 HA GLN A 6 -13.210 -13.151 -3.438 1.00 0.38 H new ATOM 0 HB2 GLN A 6 -11.862 -14.492 -1.214 1.00 0.40 H new ATOM 0 HB3 GLN A 6 -12.442 -12.910 -0.733 1.00 0.40 H new ATOM 0 HG2 GLN A 6 -14.207 -14.947 -2.123 1.00 0.77 H new ATOM 0 HG3 GLN A 6 -14.030 -14.879 -0.381 1.00 0.77 H new ATOM 0 HE21 GLN A 6 -15.460 -13.429 -3.204 1.00 0.99 H new ATOM 0 HE22 GLN A 6 -16.436 -12.226 -2.355 1.00 0.99 H new ATOM 108 N GLY A 7 -10.533 -11.646 -2.210 1.00 0.35 N ATOM 109 CA GLY A 7 -9.894 -10.347 -2.073 1.00 0.34 C ATOM 110 C GLY A 7 -9.725 -9.644 -3.403 1.00 0.33 C ATOM 111 O GLY A 7 -10.010 -8.448 -3.531 1.00 0.33 O ATOM 0 H GLY A 7 -9.985 -12.430 -1.856 1.00 0.35 H new ATOM 0 HA2 GLY A 7 -10.488 -9.721 -1.407 1.00 0.34 H new ATOM 0 HA3 GLY A 7 -8.918 -10.473 -1.605 1.00 0.34 H new ATOM 115 N LYS A 8 -9.297 -10.403 -4.399 1.00 0.35 N ATOM 116 CA LYS A 8 -9.073 -9.879 -5.736 1.00 0.38 C ATOM 117 C LYS A 8 -10.376 -9.351 -6.327 1.00 0.38 C ATOM 118 O LYS A 8 -10.422 -8.260 -6.894 1.00 0.38 O ATOM 119 CB LYS A 8 -8.495 -10.989 -6.625 1.00 0.44 C ATOM 120 CG LYS A 8 -7.857 -10.499 -7.923 1.00 0.76 C ATOM 121 CD LYS A 8 -8.887 -10.141 -8.988 1.00 0.74 C ATOM 122 CE LYS A 8 -9.774 -11.327 -9.333 1.00 1.24 C ATOM 123 NZ LYS A 8 -10.476 -11.131 -10.625 1.00 1.81 N ATOM 0 H LYS A 8 -9.095 -11.398 -4.303 1.00 0.35 H new ATOM 0 HA LYS A 8 -8.365 -9.052 -5.684 1.00 0.38 H new ATOM 0 HB2 LYS A 8 -7.748 -11.541 -6.054 1.00 0.44 H new ATOM 0 HB3 LYS A 8 -9.292 -11.691 -6.870 1.00 0.44 H new ATOM 0 HG2 LYS A 8 -7.240 -9.625 -7.712 1.00 0.76 H new ATOM 0 HG3 LYS A 8 -7.193 -11.272 -8.311 1.00 0.76 H new ATOM 0 HD2 LYS A 8 -9.504 -9.315 -8.634 1.00 0.74 H new ATOM 0 HD3 LYS A 8 -8.376 -9.795 -9.887 1.00 0.74 H new ATOM 0 HE2 LYS A 8 -9.168 -12.232 -9.382 1.00 1.24 H new ATOM 0 HE3 LYS A 8 -10.507 -11.476 -8.540 1.00 1.24 H new ATOM 0 HZ1 LYS A 8 -11.071 -11.960 -10.826 1.00 1.81 H new ATOM 0 HZ2 LYS A 8 -11.073 -10.281 -10.570 1.00 1.81 H new ATOM 0 HZ3 LYS A 8 -9.777 -11.014 -11.386 1.00 1.81 H new ATOM 137 N LYS A 9 -11.434 -10.127 -6.163 1.00 0.41 N ATOM 138 CA LYS A 9 -12.743 -9.783 -6.692 1.00 0.46 C ATOM 139 C LYS A 9 -13.347 -8.584 -5.969 1.00 0.43 C ATOM 140 O LYS A 9 -13.768 -7.612 -6.600 1.00 0.44 O ATOM 141 CB LYS A 9 -13.665 -10.999 -6.574 1.00 0.53 C ATOM 142 CG LYS A 9 -15.142 -10.690 -6.746 1.00 0.74 C ATOM 143 CD LYS A 9 -15.996 -11.861 -6.296 1.00 0.87 C ATOM 144 CE LYS A 9 -17.474 -11.589 -6.502 1.00 1.29 C ATOM 145 NZ LYS A 9 -18.280 -12.831 -6.397 1.00 1.69 N ATOM 0 H LYS A 9 -11.410 -11.014 -5.659 1.00 0.41 H new ATOM 0 HA LYS A 9 -12.631 -9.503 -7.739 1.00 0.46 H new ATOM 0 HB2 LYS A 9 -13.372 -11.735 -7.322 1.00 0.53 H new ATOM 0 HB3 LYS A 9 -13.515 -11.459 -5.598 1.00 0.53 H new ATOM 0 HG2 LYS A 9 -15.402 -9.802 -6.169 1.00 0.74 H new ATOM 0 HG3 LYS A 9 -15.351 -10.463 -7.791 1.00 0.74 H new ATOM 0 HD2 LYS A 9 -15.710 -12.755 -6.851 1.00 0.87 H new ATOM 0 HD3 LYS A 9 -15.807 -12.066 -5.242 1.00 0.87 H new ATOM 0 HE2 LYS A 9 -17.818 -10.868 -5.761 1.00 1.29 H new ATOM 0 HE3 LYS A 9 -17.628 -11.137 -7.482 1.00 1.29 H new ATOM 0 HZ1 LYS A 9 -19.285 -12.606 -6.543 1.00 1.69 H new ATOM 0 HZ2 LYS A 9 -17.968 -13.510 -7.121 1.00 1.69 H new ATOM 0 HZ3 LYS A 9 -18.153 -13.249 -5.453 1.00 1.69 H new ATOM 159 N ILE A 10 -13.362 -8.646 -4.645 1.00 0.41 N ATOM 160 CA ILE A 10 -13.940 -7.578 -3.842 1.00 0.42 C ATOM 161 C ILE A 10 -13.175 -6.272 -4.017 1.00 0.35 C ATOM 162 O ILE A 10 -13.782 -5.223 -4.211 1.00 0.38 O ATOM 163 CB ILE A 10 -14.032 -7.959 -2.344 1.00 0.46 C ATOM 164 CG1 ILE A 10 -12.644 -8.089 -1.705 1.00 0.45 C ATOM 165 CG2 ILE A 10 -14.808 -9.254 -2.203 1.00 0.57 C ATOM 166 CD1 ILE A 10 -12.667 -8.547 -0.260 1.00 0.58 C ATOM 0 H ILE A 10 -12.981 -9.423 -4.105 1.00 0.41 H new ATOM 0 HA ILE A 10 -14.957 -7.430 -4.206 1.00 0.42 H new ATOM 0 HB ILE A 10 -14.554 -7.161 -1.816 1.00 0.46 H new ATOM 0 HG12 ILE A 10 -12.052 -8.794 -2.289 1.00 0.45 H new ATOM 0 HG13 ILE A 10 -12.138 -7.125 -1.761 1.00 0.45 H new ATOM 0 HG21 ILE A 10 -14.875 -9.525 -1.149 1.00 0.57 H new ATOM 0 HG22 ILE A 10 -15.811 -9.123 -2.608 1.00 0.57 H new ATOM 0 HG23 ILE A 10 -14.297 -10.046 -2.750 1.00 0.57 H new ATOM 0 HD11 ILE A 10 -11.646 -8.613 0.117 1.00 0.58 H new ATOM 0 HD12 ILE A 10 -13.230 -7.831 0.340 1.00 0.58 H new ATOM 0 HD13 ILE A 10 -13.142 -9.526 -0.196 1.00 0.58 H new ATOM 178 N VAL A 11 -11.848 -6.336 -3.981 1.00 0.31 N ATOM 179 CA VAL A 11 -11.040 -5.137 -4.145 1.00 0.30 C ATOM 180 C VAL A 11 -11.247 -4.538 -5.530 1.00 0.29 C ATOM 181 O VAL A 11 -11.371 -3.318 -5.664 1.00 0.30 O ATOM 182 CB VAL A 11 -9.542 -5.414 -3.882 1.00 0.35 C ATOM 183 CG1 VAL A 11 -8.648 -4.427 -4.620 1.00 0.39 C ATOM 184 CG2 VAL A 11 -9.268 -5.360 -2.391 1.00 0.41 C ATOM 0 H VAL A 11 -11.316 -7.195 -3.841 1.00 0.31 H new ATOM 0 HA VAL A 11 -11.370 -4.412 -3.401 1.00 0.30 H new ATOM 0 HB VAL A 11 -9.310 -6.410 -4.260 1.00 0.35 H new ATOM 0 HG11 VAL A 11 -7.603 -4.655 -4.410 1.00 0.39 H new ATOM 0 HG12 VAL A 11 -8.828 -4.505 -5.692 1.00 0.39 H new ATOM 0 HG13 VAL A 11 -8.872 -3.414 -4.287 1.00 0.39 H new ATOM 0 HG21 VAL A 11 -8.211 -5.556 -2.208 1.00 0.41 H new ATOM 0 HG22 VAL A 11 -9.526 -4.372 -2.009 1.00 0.41 H new ATOM 0 HG23 VAL A 11 -9.870 -6.114 -1.883 1.00 0.41 H new ATOM 194 N ASN A 12 -11.291 -5.392 -6.550 1.00 0.32 N ATOM 195 CA ASN A 12 -11.514 -4.941 -7.921 1.00 0.37 C ATOM 196 C ASN A 12 -12.791 -4.103 -8.010 1.00 0.36 C ATOM 197 O ASN A 12 -12.776 -2.961 -8.491 1.00 0.38 O ATOM 198 CB ASN A 12 -11.600 -6.144 -8.871 1.00 0.44 C ATOM 199 CG ASN A 12 -11.808 -5.730 -10.317 1.00 0.59 C ATOM 200 OD1 ASN A 12 -12.938 -5.674 -10.807 1.00 1.02 O ATOM 201 ND2 ASN A 12 -10.719 -5.437 -11.011 1.00 1.32 N ATOM 0 H ASN A 12 -11.175 -6.401 -6.453 1.00 0.32 H new ATOM 0 HA ASN A 12 -10.671 -4.319 -8.220 1.00 0.37 H new ATOM 0 HB2 ASN A 12 -10.685 -6.731 -8.793 1.00 0.44 H new ATOM 0 HB3 ASN A 12 -12.421 -6.790 -8.560 1.00 0.44 H new ATOM 0 HD21 ASN A 12 -10.798 -5.153 -11.987 1.00 1.32 H new ATOM 0 HD22 ASN A 12 -9.802 -5.496 -10.569 1.00 1.32 H new ATOM 208 N HIS A 13 -13.882 -4.659 -7.494 1.00 0.35 N ATOM 209 CA HIS A 13 -15.169 -3.977 -7.508 1.00 0.38 C ATOM 210 C HIS A 13 -15.111 -2.735 -6.631 1.00 0.33 C ATOM 211 O HIS A 13 -15.557 -1.653 -7.025 1.00 0.35 O ATOM 212 CB HIS A 13 -16.281 -4.908 -7.017 1.00 0.44 C ATOM 213 CG HIS A 13 -16.752 -5.893 -8.045 1.00 0.64 C ATOM 214 ND1 HIS A 13 -17.706 -5.558 -8.977 1.00 1.05 N ATOM 215 CD2 HIS A 13 -16.378 -7.182 -8.237 1.00 1.07 C ATOM 216 CE1 HIS A 13 -17.895 -6.644 -9.708 1.00 1.21 C ATOM 217 NE2 HIS A 13 -17.111 -7.649 -9.297 1.00 1.22 N ATOM 0 H HIS A 13 -13.899 -5.582 -7.060 1.00 0.35 H new ATOM 0 HA HIS A 13 -15.390 -3.683 -8.534 1.00 0.38 H new ATOM 0 HB2 HIS A 13 -15.924 -5.453 -6.143 1.00 0.44 H new ATOM 0 HB3 HIS A 13 -17.129 -4.305 -6.692 1.00 0.44 H new ATOM 0 HD2 HIS A 13 -15.645 -7.733 -7.666 1.00 1.07 H new ATOM 0 HE1 HIS A 13 -18.592 -6.712 -10.530 1.00 1.21 H new ATOM 0 HE2 HIS A 13 -17.067 -8.586 -9.698 1.00 1.22 H new ATOM 225 N LEU A 14 -14.517 -2.896 -5.458 1.00 0.30 N ATOM 226 CA LEU A 14 -14.386 -1.812 -4.499 1.00 0.31 C ATOM 227 C LEU A 14 -13.623 -0.643 -5.097 1.00 0.31 C ATOM 228 O LEU A 14 -13.926 0.510 -4.820 1.00 0.34 O ATOM 229 CB LEU A 14 -13.668 -2.303 -3.242 1.00 0.35 C ATOM 230 CG LEU A 14 -14.524 -3.111 -2.266 1.00 0.49 C ATOM 231 CD1 LEU A 14 -13.917 -3.070 -0.877 1.00 0.89 C ATOM 232 CD2 LEU A 14 -15.954 -2.595 -2.244 1.00 0.54 C ATOM 0 H LEU A 14 -14.114 -3.779 -5.146 1.00 0.30 H new ATOM 0 HA LEU A 14 -15.388 -1.474 -4.236 1.00 0.31 H new ATOM 0 HB2 LEU A 14 -12.819 -2.915 -3.546 1.00 0.35 H new ATOM 0 HB3 LEU A 14 -13.265 -1.439 -2.714 1.00 0.35 H new ATOM 0 HG LEU A 14 -14.547 -4.147 -2.604 1.00 0.49 H new ATOM 0 HD11 LEU A 14 -14.536 -3.649 -0.192 1.00 0.89 H new ATOM 0 HD12 LEU A 14 -12.913 -3.494 -0.906 1.00 0.89 H new ATOM 0 HD13 LEU A 14 -13.864 -2.037 -0.533 1.00 0.89 H new ATOM 0 HD21 LEU A 14 -16.543 -3.186 -1.543 1.00 0.54 H new ATOM 0 HD22 LEU A 14 -15.959 -1.550 -1.933 1.00 0.54 H new ATOM 0 HD23 LEU A 14 -16.386 -2.678 -3.241 1.00 0.54 H new ATOM 244 N ARG A 15 -12.641 -0.952 -5.925 1.00 0.32 N ATOM 245 CA ARG A 15 -11.835 0.072 -6.560 1.00 0.37 C ATOM 246 C ARG A 15 -12.647 0.853 -7.578 1.00 0.38 C ATOM 247 O ARG A 15 -12.619 2.075 -7.602 1.00 0.45 O ATOM 248 CB ARG A 15 -10.621 -0.543 -7.203 1.00 0.43 C ATOM 249 CG ARG A 15 -9.310 -0.053 -6.615 1.00 1.21 C ATOM 250 CD ARG A 15 -8.893 -0.852 -5.388 1.00 1.96 C ATOM 251 NE ARG A 15 -9.923 -0.868 -4.344 1.00 2.47 N ATOM 252 CZ ARG A 15 -10.241 0.184 -3.580 1.00 3.14 C ATOM 253 NH1 ARG A 15 -9.641 1.356 -3.762 1.00 3.59 N ATOM 254 NH2 ARG A 15 -11.170 0.059 -2.637 1.00 3.77 N ATOM 0 H ARG A 15 -12.383 -1.907 -6.173 1.00 0.32 H new ATOM 0 HA ARG A 15 -11.504 0.771 -5.792 1.00 0.37 H new ATOM 0 HB2 ARG A 15 -10.674 -1.627 -7.099 1.00 0.43 H new ATOM 0 HB3 ARG A 15 -10.635 -0.324 -8.271 1.00 0.43 H new ATOM 0 HG2 ARG A 15 -8.528 -0.118 -7.372 1.00 1.21 H new ATOM 0 HG3 ARG A 15 -9.406 0.999 -6.346 1.00 1.21 H new ATOM 0 HD2 ARG A 15 -8.668 -1.876 -5.686 1.00 1.96 H new ATOM 0 HD3 ARG A 15 -7.975 -0.430 -4.980 1.00 1.96 H new ATOM 0 HE ARG A 15 -10.431 -1.739 -4.190 1.00 2.47 H new ATOM 0 HH11 ARG A 15 -8.932 1.459 -4.488 1.00 3.59 H new ATOM 0 HH12 ARG A 15 -9.889 2.153 -3.175 1.00 3.59 H new ATOM 0 HH21 ARG A 15 -11.638 -0.837 -2.498 1.00 3.77 H new ATOM 0 HH22 ARG A 15 -11.415 0.859 -2.053 1.00 3.77 H new ATOM 268 N SER A 16 -13.375 0.137 -8.415 1.00 0.36 N ATOM 269 CA SER A 16 -14.216 0.767 -9.428 1.00 0.41 C ATOM 270 C SER A 16 -15.432 1.457 -8.797 1.00 0.38 C ATOM 271 O SER A 16 -16.124 2.243 -9.443 1.00 0.41 O ATOM 272 CB SER A 16 -14.685 -0.291 -10.432 1.00 0.47 C ATOM 273 OG SER A 16 -15.197 -1.437 -9.767 1.00 1.10 O ATOM 0 H SER A 16 -13.404 -0.883 -8.417 1.00 0.36 H new ATOM 0 HA SER A 16 -13.625 1.528 -9.937 1.00 0.41 H new ATOM 0 HB2 SER A 16 -15.454 0.132 -11.078 1.00 0.47 H new ATOM 0 HB3 SER A 16 -13.853 -0.581 -11.074 1.00 0.47 H new ATOM 0 HG SER A 16 -15.317 -1.236 -8.815 1.00 1.10 H new ATOM 279 N ARG A 17 -15.666 1.169 -7.527 1.00 0.34 N ATOM 280 CA ARG A 17 -16.811 1.704 -6.803 1.00 0.34 C ATOM 281 C ARG A 17 -16.438 2.675 -5.674 1.00 0.30 C ATOM 282 O ARG A 17 -17.303 3.019 -4.865 1.00 0.32 O ATOM 283 CB ARG A 17 -17.661 0.559 -6.245 1.00 0.40 C ATOM 284 CG ARG A 17 -18.400 -0.226 -7.322 1.00 0.60 C ATOM 285 CD ARG A 17 -19.184 -1.393 -6.740 1.00 1.17 C ATOM 286 NE ARG A 17 -19.977 -2.075 -7.764 1.00 1.61 N ATOM 287 CZ ARG A 17 -21.311 -2.159 -7.753 1.00 2.24 C ATOM 288 NH1 ARG A 17 -22.014 -1.615 -6.763 1.00 2.71 N ATOM 289 NH2 ARG A 17 -21.942 -2.784 -8.741 1.00 2.95 N ATOM 0 H ARG A 17 -15.069 0.559 -6.968 1.00 0.34 H new ATOM 0 HA ARG A 17 -17.381 2.285 -7.528 1.00 0.34 H new ATOM 0 HB2 ARG A 17 -17.019 -0.121 -5.686 1.00 0.40 H new ATOM 0 HB3 ARG A 17 -18.386 0.965 -5.540 1.00 0.40 H new ATOM 0 HG2 ARG A 17 -19.081 0.439 -7.853 1.00 0.60 H new ATOM 0 HG3 ARG A 17 -17.684 -0.599 -8.054 1.00 0.60 H new ATOM 0 HD2 ARG A 17 -18.495 -2.102 -6.281 1.00 1.17 H new ATOM 0 HD3 ARG A 17 -19.843 -1.032 -5.950 1.00 1.17 H new ATOM 0 HE ARG A 17 -19.479 -2.515 -8.537 1.00 1.61 H new ATOM 0 HH11 ARG A 17 -21.535 -1.129 -6.005 1.00 2.71 H new ATOM 0 HH12 ARG A 17 -23.032 -1.684 -6.762 1.00 2.71 H new ATOM 0 HH21 ARG A 17 -21.409 -3.198 -9.505 1.00 2.95 H new ATOM 0 HH22 ARG A 17 -22.960 -2.850 -8.735 1.00 2.95 H new ATOM 303 N LEU A 18 -15.176 3.111 -5.583 1.00 0.27 N ATOM 304 CA LEU A 18 -14.808 3.970 -4.467 1.00 0.26 C ATOM 305 C LEU A 18 -14.963 5.445 -4.809 1.00 0.24 C ATOM 306 O LEU A 18 -14.800 5.851 -5.961 1.00 0.25 O ATOM 307 CB LEU A 18 -13.384 3.675 -4.011 1.00 0.30 C ATOM 308 CG LEU A 18 -13.241 3.426 -2.511 1.00 0.40 C ATOM 309 CD1 LEU A 18 -13.848 2.086 -2.135 1.00 0.63 C ATOM 310 CD2 LEU A 18 -11.783 3.490 -2.098 1.00 0.49 C ATOM 0 H LEU A 18 -14.427 2.892 -6.240 1.00 0.27 H new ATOM 0 HA LEU A 18 -15.494 3.751 -3.648 1.00 0.26 H new ATOM 0 HB2 LEU A 18 -13.017 2.801 -4.549 1.00 0.30 H new ATOM 0 HB3 LEU A 18 -12.745 4.513 -4.291 1.00 0.30 H new ATOM 0 HG LEU A 18 -13.781 4.208 -1.977 1.00 0.40 H new ATOM 0 HD11 LEU A 18 -13.737 1.925 -1.063 1.00 0.63 H new ATOM 0 HD12 LEU A 18 -14.906 2.080 -2.396 1.00 0.63 H new ATOM 0 HD13 LEU A 18 -13.337 1.290 -2.676 1.00 0.63 H new ATOM 0 HD21 LEU A 18 -11.700 3.310 -1.026 1.00 0.49 H new ATOM 0 HD22 LEU A 18 -11.218 2.730 -2.638 1.00 0.49 H new ATOM 0 HD23 LEU A 18 -11.381 4.476 -2.333 1.00 0.49 H new ATOM 322 N ALA A 19 -15.310 6.238 -3.798 1.00 0.25 N ATOM 323 CA ALA A 19 -15.471 7.675 -3.964 1.00 0.27 C ATOM 324 C ALA A 19 -15.387 8.372 -2.615 1.00 0.29 C ATOM 325 O ALA A 19 -15.975 7.917 -1.639 1.00 0.45 O ATOM 326 CB ALA A 19 -16.802 7.990 -4.638 1.00 0.32 C ATOM 0 H ALA A 19 -15.485 5.904 -2.850 1.00 0.25 H new ATOM 0 HA ALA A 19 -14.666 8.042 -4.601 1.00 0.27 H new ATOM 0 HB1 ALA A 19 -16.905 9.069 -4.754 1.00 0.32 H new ATOM 0 HB2 ALA A 19 -16.835 7.515 -5.619 1.00 0.32 H new ATOM 0 HB3 ALA A 19 -17.619 7.611 -4.024 1.00 0.32 H new ATOM 332 N PHE A 20 -14.653 9.466 -2.559 1.00 0.28 N ATOM 333 CA PHE A 20 -14.518 10.222 -1.329 1.00 0.29 C ATOM 334 C PHE A 20 -15.090 11.619 -1.514 1.00 0.33 C ATOM 335 O PHE A 20 -15.256 12.079 -2.642 1.00 0.35 O ATOM 336 CB PHE A 20 -13.048 10.281 -0.889 1.00 0.31 C ATOM 337 CG PHE A 20 -12.169 11.140 -1.753 1.00 0.32 C ATOM 338 CD1 PHE A 20 -11.538 10.613 -2.864 1.00 1.22 C ATOM 339 CD2 PHE A 20 -11.966 12.474 -1.444 1.00 1.20 C ATOM 340 CE1 PHE A 20 -10.723 11.396 -3.653 1.00 1.25 C ATOM 341 CE2 PHE A 20 -11.153 13.264 -2.228 1.00 1.21 C ATOM 342 CZ PHE A 20 -10.528 12.726 -3.336 1.00 0.41 C ATOM 0 H PHE A 20 -14.140 9.852 -3.352 1.00 0.28 H new ATOM 0 HA PHE A 20 -15.080 9.720 -0.542 1.00 0.29 H new ATOM 0 HB2 PHE A 20 -13.004 10.653 0.135 1.00 0.31 H new ATOM 0 HB3 PHE A 20 -12.645 9.268 -0.878 1.00 0.31 H new ATOM 0 HD1 PHE A 20 -11.686 9.574 -3.117 1.00 1.22 H new ATOM 0 HD2 PHE A 20 -12.450 12.901 -0.578 1.00 1.20 H new ATOM 0 HE1 PHE A 20 -10.237 10.970 -4.518 1.00 1.25 H new ATOM 0 HE2 PHE A 20 -11.005 14.304 -1.976 1.00 1.21 H new ATOM 0 HZ PHE A 20 -9.890 13.343 -3.952 1.00 0.41 H new ATOM 352 N GLU A 21 -15.415 12.282 -0.420 1.00 0.37 N ATOM 353 CA GLU A 21 -15.964 13.620 -0.493 1.00 0.43 C ATOM 354 C GLU A 21 -14.995 14.626 0.106 1.00 0.46 C ATOM 355 O GLU A 21 -14.424 14.411 1.195 1.00 0.44 O ATOM 356 CB GLU A 21 -17.317 13.701 0.214 1.00 0.48 C ATOM 357 CG GLU A 21 -18.359 14.501 -0.548 1.00 1.11 C ATOM 358 CD GLU A 21 -19.621 14.720 0.256 1.00 1.40 C ATOM 359 OE1 GLU A 21 -19.559 15.422 1.285 1.00 1.92 O ATOM 360 OE2 GLU A 21 -20.684 14.200 -0.141 1.00 1.89 O ATOM 0 H GLU A 21 -15.308 11.916 0.526 1.00 0.37 H new ATOM 0 HA GLU A 21 -16.117 13.862 -1.545 1.00 0.43 H new ATOM 0 HB2 GLU A 21 -17.694 12.691 0.375 1.00 0.48 H new ATOM 0 HB3 GLU A 21 -17.176 14.149 1.198 1.00 0.48 H new ATOM 0 HG2 GLU A 21 -17.938 15.467 -0.828 1.00 1.11 H new ATOM 0 HG3 GLU A 21 -18.607 13.981 -1.473 1.00 1.11 H new ATOM 367 N TYR A 22 -14.832 15.724 -0.617 1.00 0.52 N ATOM 368 CA TYR A 22 -13.950 16.802 -0.215 1.00 0.59 C ATOM 369 C TYR A 22 -14.661 18.138 -0.384 1.00 0.65 C ATOM 370 O TYR A 22 -15.083 18.489 -1.488 1.00 0.65 O ATOM 371 CB TYR A 22 -12.657 16.783 -1.042 1.00 0.60 C ATOM 372 CG TYR A 22 -11.927 18.115 -1.052 1.00 0.74 C ATOM 373 CD1 TYR A 22 -11.460 18.681 0.129 1.00 1.53 C ATOM 374 CD2 TYR A 22 -11.721 18.809 -2.237 1.00 1.38 C ATOM 375 CE1 TYR A 22 -10.805 19.899 0.127 1.00 1.69 C ATOM 376 CE2 TYR A 22 -11.063 20.026 -2.247 1.00 1.48 C ATOM 377 CZ TYR A 22 -10.612 20.568 -1.062 1.00 1.16 C ATOM 378 OH TYR A 22 -9.958 21.780 -1.069 1.00 1.40 O ATOM 0 H TYR A 22 -15.311 15.890 -1.502 1.00 0.52 H new ATOM 0 HA TYR A 22 -13.686 16.665 0.834 1.00 0.59 H new ATOM 0 HB2 TYR A 22 -11.992 16.016 -0.645 1.00 0.60 H new ATOM 0 HB3 TYR A 22 -12.895 16.500 -2.067 1.00 0.60 H new ATOM 0 HD1 TYR A 22 -11.611 18.161 1.063 1.00 1.53 H new ATOM 0 HD2 TYR A 22 -12.080 18.392 -3.166 1.00 1.38 H new ATOM 0 HE1 TYR A 22 -10.446 20.324 1.053 1.00 1.69 H new ATOM 0 HE2 TYR A 22 -10.903 20.549 -3.178 1.00 1.48 H new ATOM 0 HH TYR A 22 -9.904 22.118 -1.987 1.00 1.40 H new ATOM 388 N ASN A 23 -14.815 18.864 0.722 1.00 0.72 N ATOM 389 CA ASN A 23 -15.467 20.174 0.722 1.00 0.80 C ATOM 390 C ASN A 23 -16.870 20.108 0.129 1.00 0.78 C ATOM 391 O ASN A 23 -17.350 21.074 -0.468 1.00 0.83 O ATOM 392 CB ASN A 23 -14.623 21.184 -0.058 1.00 0.87 C ATOM 393 CG ASN A 23 -14.431 22.479 0.702 1.00 1.09 C ATOM 394 OD1 ASN A 23 -15.228 23.409 0.575 1.00 1.72 O ATOM 395 ND2 ASN A 23 -13.372 22.549 1.497 1.00 1.37 N ATOM 0 H ASN A 23 -14.493 18.562 1.641 1.00 0.72 H new ATOM 0 HA ASN A 23 -15.556 20.495 1.760 1.00 0.80 H new ATOM 0 HB2 ASN A 23 -13.649 20.747 -0.279 1.00 0.87 H new ATOM 0 HB3 ASN A 23 -15.103 21.394 -1.014 1.00 0.87 H new ATOM 0 HD21 ASN A 23 -13.192 23.398 2.033 1.00 1.37 H new ATOM 0 HD22 ASN A 23 -12.737 21.754 1.572 1.00 1.37 H new ATOM 402 N GLY A 24 -17.520 18.965 0.292 1.00 0.73 N ATOM 403 CA GLY A 24 -18.862 18.799 -0.224 1.00 0.73 C ATOM 404 C GLY A 24 -18.889 18.286 -1.650 1.00 0.68 C ATOM 405 O GLY A 24 -19.960 17.995 -2.186 1.00 0.70 O ATOM 0 H GLY A 24 -17.141 18.149 0.773 1.00 0.73 H new ATOM 0 HA2 GLY A 24 -19.408 18.106 0.416 1.00 0.73 H new ATOM 0 HA3 GLY A 24 -19.384 19.755 -0.178 1.00 0.73 H new ATOM 409 N GLN A 25 -17.726 18.179 -2.276 1.00 0.64 N ATOM 410 CA GLN A 25 -17.651 17.695 -3.648 1.00 0.60 C ATOM 411 C GLN A 25 -17.260 16.226 -3.674 1.00 0.54 C ATOM 412 O GLN A 25 -16.343 15.808 -2.965 1.00 0.53 O ATOM 413 CB GLN A 25 -16.647 18.513 -4.457 1.00 0.63 C ATOM 414 CG GLN A 25 -16.889 20.017 -4.399 1.00 0.76 C ATOM 415 CD GLN A 25 -18.220 20.423 -5.003 1.00 1.16 C ATOM 416 OE1 GLN A 25 -18.741 19.758 -5.899 1.00 1.91 O ATOM 417 NE2 GLN A 25 -18.778 21.521 -4.522 1.00 1.56 N ATOM 0 H GLN A 25 -16.826 18.419 -1.860 1.00 0.64 H new ATOM 0 HA GLN A 25 -18.637 17.807 -4.099 1.00 0.60 H new ATOM 0 HB2 GLN A 25 -15.642 18.302 -4.091 1.00 0.63 H new ATOM 0 HB3 GLN A 25 -16.682 18.189 -5.497 1.00 0.63 H new ATOM 0 HG2 GLN A 25 -16.851 20.347 -3.361 1.00 0.76 H new ATOM 0 HG3 GLN A 25 -16.085 20.530 -4.926 1.00 0.76 H new ATOM 0 HE21 GLN A 25 -18.315 22.045 -3.779 1.00 1.56 H new ATOM 0 HE22 GLN A 25 -19.671 21.844 -4.894 1.00 1.56 H new ATOM 426 N LEU A 26 -17.966 15.446 -4.478 1.00 0.50 N ATOM 427 CA LEU A 26 -17.693 14.022 -4.594 1.00 0.46 C ATOM 428 C LEU A 26 -16.552 13.761 -5.567 1.00 0.43 C ATOM 429 O LEU A 26 -16.560 14.250 -6.698 1.00 0.47 O ATOM 430 CB LEU A 26 -18.940 13.275 -5.062 1.00 0.49 C ATOM 431 CG LEU A 26 -19.682 12.474 -3.990 1.00 0.54 C ATOM 432 CD1 LEU A 26 -20.747 11.605 -4.636 1.00 0.59 C ATOM 433 CD2 LEU A 26 -18.717 11.614 -3.183 1.00 0.61 C ATOM 0 H LEU A 26 -18.735 15.777 -5.061 1.00 0.50 H new ATOM 0 HA LEU A 26 -17.403 13.659 -3.608 1.00 0.46 H new ATOM 0 HB2 LEU A 26 -19.633 13.998 -5.492 1.00 0.49 H new ATOM 0 HB3 LEU A 26 -18.652 12.594 -5.863 1.00 0.49 H new ATOM 0 HG LEU A 26 -20.160 13.176 -3.307 1.00 0.54 H new ATOM 0 HD11 LEU A 26 -21.270 11.038 -3.866 1.00 0.59 H new ATOM 0 HD12 LEU A 26 -21.458 12.237 -5.168 1.00 0.59 H new ATOM 0 HD13 LEU A 26 -20.278 10.916 -5.338 1.00 0.59 H new ATOM 0 HD21 LEU A 26 -19.271 11.056 -2.428 1.00 0.61 H new ATOM 0 HD22 LEU A 26 -18.207 10.917 -3.848 1.00 0.61 H new ATOM 0 HD23 LEU A 26 -17.982 12.253 -2.694 1.00 0.61 H new ATOM 445 N ILE A 27 -15.574 12.996 -5.116 1.00 0.39 N ATOM 446 CA ILE A 27 -14.417 12.648 -5.930 1.00 0.39 C ATOM 447 C ILE A 27 -14.220 11.124 -5.932 1.00 0.36 C ATOM 448 O ILE A 27 -13.839 10.539 -4.920 1.00 0.42 O ATOM 449 CB ILE A 27 -13.127 13.338 -5.413 1.00 0.41 C ATOM 450 CG1 ILE A 27 -13.424 14.746 -4.864 1.00 0.46 C ATOM 451 CG2 ILE A 27 -12.084 13.405 -6.521 1.00 0.48 C ATOM 452 CD1 ILE A 27 -13.700 15.791 -5.927 1.00 0.78 C ATOM 0 H ILE A 27 -15.557 12.598 -4.177 1.00 0.39 H new ATOM 0 HA ILE A 27 -14.605 12.999 -6.945 1.00 0.39 H new ATOM 0 HB ILE A 27 -12.731 12.740 -4.592 1.00 0.41 H new ATOM 0 HG12 ILE A 27 -14.285 14.688 -4.198 1.00 0.46 H new ATOM 0 HG13 ILE A 27 -12.576 15.074 -4.262 1.00 0.46 H new ATOM 0 HG21 ILE A 27 -11.184 13.891 -6.145 1.00 0.48 H new ATOM 0 HG22 ILE A 27 -11.840 12.396 -6.852 1.00 0.48 H new ATOM 0 HG23 ILE A 27 -12.481 13.976 -7.360 1.00 0.48 H new ATOM 0 HD11 ILE A 27 -13.899 16.751 -5.451 1.00 0.78 H new ATOM 0 HD12 ILE A 27 -12.833 15.883 -6.581 1.00 0.78 H new ATOM 0 HD13 ILE A 27 -14.567 15.491 -6.515 1.00 0.78 H new ATOM 464 N LYS A 28 -14.507 10.482 -7.064 1.00 0.31 N ATOM 465 CA LYS A 28 -14.383 9.028 -7.186 1.00 0.30 C ATOM 466 C LYS A 28 -12.915 8.579 -7.196 1.00 0.30 C ATOM 467 O LYS A 28 -12.046 9.280 -7.716 1.00 0.35 O ATOM 468 CB LYS A 28 -15.103 8.534 -8.453 1.00 0.32 C ATOM 469 CG LYS A 28 -14.416 8.925 -9.752 1.00 0.66 C ATOM 470 CD LYS A 28 -15.060 10.148 -10.389 1.00 1.05 C ATOM 471 CE LYS A 28 -14.079 10.887 -11.285 1.00 1.84 C ATOM 472 NZ LYS A 28 -14.652 12.149 -11.823 1.00 2.41 N ATOM 0 H LYS A 28 -14.828 10.947 -7.913 1.00 0.31 H new ATOM 0 HA LYS A 28 -14.856 8.583 -6.311 1.00 0.30 H new ATOM 0 HB2 LYS A 28 -15.185 7.448 -8.411 1.00 0.32 H new ATOM 0 HB3 LYS A 28 -16.118 8.930 -8.458 1.00 0.32 H new ATOM 0 HG2 LYS A 28 -13.363 9.129 -9.559 1.00 0.66 H new ATOM 0 HG3 LYS A 28 -14.456 8.089 -10.450 1.00 0.66 H new ATOM 0 HD2 LYS A 28 -15.928 9.842 -10.972 1.00 1.05 H new ATOM 0 HD3 LYS A 28 -15.420 10.819 -9.609 1.00 1.05 H new ATOM 0 HE2 LYS A 28 -13.173 11.112 -10.722 1.00 1.84 H new ATOM 0 HE3 LYS A 28 -13.787 10.240 -12.113 1.00 1.84 H new ATOM 0 HZ1 LYS A 28 -13.949 12.619 -12.428 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -15.502 11.934 -12.383 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -14.907 12.778 -11.035 1.00 2.41 H new ATOM 486 N ILE A 29 -12.655 7.410 -6.609 1.00 0.28 N ATOM 487 CA ILE A 29 -11.299 6.852 -6.542 1.00 0.31 C ATOM 488 C ILE A 29 -11.261 5.404 -7.057 1.00 0.29 C ATOM 489 O ILE A 29 -12.069 4.547 -6.642 1.00 0.31 O ATOM 490 CB ILE A 29 -10.717 6.906 -5.112 1.00 0.34 C ATOM 491 CG1 ILE A 29 -11.819 7.146 -4.076 1.00 0.31 C ATOM 492 CG2 ILE A 29 -9.656 7.994 -5.019 1.00 0.43 C ATOM 493 CD1 ILE A 29 -11.342 7.037 -2.641 1.00 0.36 C ATOM 0 H ILE A 29 -13.368 6.827 -6.170 1.00 0.28 H new ATOM 0 HA ILE A 29 -10.681 7.476 -7.187 1.00 0.31 H new ATOM 0 HB ILE A 29 -10.257 5.942 -4.895 1.00 0.34 H new ATOM 0 HG12 ILE A 29 -12.244 8.137 -4.234 1.00 0.31 H new ATOM 0 HG13 ILE A 29 -12.621 6.426 -4.238 1.00 0.31 H new ATOM 0 HG21 ILE A 29 -9.253 8.023 -4.007 1.00 0.43 H new ATOM 0 HG22 ILE A 29 -8.853 7.780 -5.724 1.00 0.43 H new ATOM 0 HG23 ILE A 29 -10.102 8.959 -5.260 1.00 0.43 H new ATOM 0 HD11 ILE A 29 -12.177 7.219 -1.965 1.00 0.36 H new ATOM 0 HD12 ILE A 29 -10.944 6.038 -2.465 1.00 0.36 H new ATOM 0 HD13 ILE A 29 -10.561 7.776 -2.460 1.00 0.36 H new ATOM 505 N LEU A 30 -10.383 5.192 -8.046 1.00 0.30 N ATOM 506 CA LEU A 30 -10.192 3.890 -8.695 1.00 0.31 C ATOM 507 C LEU A 30 -8.839 3.256 -8.385 1.00 0.29 C ATOM 508 O LEU A 30 -8.032 3.787 -7.627 1.00 0.28 O ATOM 509 CB LEU A 30 -10.408 3.966 -10.199 1.00 0.36 C ATOM 510 CG LEU A 30 -11.788 3.499 -10.659 1.00 1.41 C ATOM 511 CD1 LEU A 30 -12.843 4.547 -10.347 1.00 1.97 C ATOM 512 CD2 LEU A 30 -11.776 3.168 -12.142 1.00 2.00 C ATOM 0 H LEU A 30 -9.781 5.925 -8.420 1.00 0.30 H new ATOM 0 HA LEU A 30 -10.956 3.241 -8.268 1.00 0.31 H new ATOM 0 HB2 LEU A 30 -10.258 4.995 -10.524 1.00 0.36 H new ATOM 0 HB3 LEU A 30 -9.649 3.361 -10.695 1.00 0.36 H new ATOM 0 HG LEU A 30 -12.041 2.591 -10.111 1.00 1.41 H new ATOM 0 HD11 LEU A 30 -13.818 4.193 -10.683 1.00 1.97 H new ATOM 0 HD12 LEU A 30 -12.872 4.725 -9.272 1.00 1.97 H new ATOM 0 HD13 LEU A 30 -12.597 5.476 -10.862 1.00 1.97 H new ATOM 0 HD21 LEU A 30 -12.768 2.838 -12.449 1.00 2.00 H new ATOM 0 HD22 LEU A 30 -11.497 4.055 -12.711 1.00 2.00 H new ATOM 0 HD23 LEU A 30 -11.054 2.374 -12.332 1.00 2.00 H new ATOM 524 N SER A 31 -8.608 2.099 -8.994 1.00 0.31 N ATOM 525 CA SER A 31 -7.354 1.368 -8.858 1.00 0.33 C ATOM 526 C SER A 31 -6.182 2.161 -9.446 1.00 0.33 C ATOM 527 O SER A 31 -5.020 1.814 -9.243 1.00 0.36 O ATOM 528 CB SER A 31 -7.487 0.028 -9.569 1.00 0.41 C ATOM 529 OG SER A 31 -8.815 -0.148 -10.040 1.00 1.16 O ATOM 0 H SER A 31 -9.289 1.639 -9.599 1.00 0.31 H new ATOM 0 HA SER A 31 -7.149 1.212 -7.799 1.00 0.33 H new ATOM 0 HB2 SER A 31 -6.788 -0.020 -10.404 1.00 0.41 H new ATOM 0 HB3 SER A 31 -7.225 -0.781 -8.887 1.00 0.41 H new ATOM 0 HG SER A 31 -8.930 0.338 -10.883 1.00 1.16 H new ATOM 535 N LYS A 32 -6.496 3.216 -10.197 1.00 0.34 N ATOM 536 CA LYS A 32 -5.469 4.060 -10.800 1.00 0.38 C ATOM 537 C LYS A 32 -4.662 4.755 -9.715 1.00 0.36 C ATOM 538 O LYS A 32 -3.501 5.102 -9.909 1.00 0.40 O ATOM 539 CB LYS A 32 -6.118 5.126 -11.684 1.00 0.45 C ATOM 540 CG LYS A 32 -7.161 4.584 -12.644 1.00 1.10 C ATOM 541 CD LYS A 32 -8.185 5.650 -13.000 1.00 1.55 C ATOM 542 CE LYS A 32 -7.612 6.697 -13.945 1.00 1.94 C ATOM 543 NZ LYS A 32 -7.281 6.127 -15.278 1.00 2.47 N ATOM 0 H LYS A 32 -7.453 3.505 -10.401 1.00 0.34 H new ATOM 0 HA LYS A 32 -4.815 3.429 -11.401 1.00 0.38 H new ATOM 0 HB2 LYS A 32 -6.583 5.878 -11.046 1.00 0.45 H new ATOM 0 HB3 LYS A 32 -5.340 5.631 -12.257 1.00 0.45 H new ATOM 0 HG2 LYS A 32 -6.674 4.226 -13.551 1.00 1.10 H new ATOM 0 HG3 LYS A 32 -7.664 3.728 -12.194 1.00 1.10 H new ATOM 0 HD2 LYS A 32 -9.052 5.179 -13.463 1.00 1.55 H new ATOM 0 HD3 LYS A 32 -8.534 6.136 -12.089 1.00 1.55 H new ATOM 0 HE2 LYS A 32 -8.331 7.507 -14.066 1.00 1.94 H new ATOM 0 HE3 LYS A 32 -6.715 7.130 -13.504 1.00 1.94 H new ATOM 0 HZ1 LYS A 32 -7.155 6.899 -15.964 1.00 2.47 H new ATOM 0 HZ2 LYS A 32 -6.401 5.576 -15.211 1.00 2.47 H new ATOM 0 HZ3 LYS A 32 -8.055 5.507 -15.592 1.00 2.47 H new ATOM 557 N ASN A 33 -5.300 4.937 -8.568 1.00 0.31 N ATOM 558 CA ASN A 33 -4.680 5.590 -7.429 1.00 0.33 C ATOM 559 C ASN A 33 -4.423 4.598 -6.298 1.00 0.30 C ATOM 560 O ASN A 33 -3.506 4.778 -5.504 1.00 0.38 O ATOM 561 CB ASN A 33 -5.569 6.747 -6.934 1.00 0.36 C ATOM 562 CG ASN A 33 -6.929 6.809 -7.606 1.00 0.75 C ATOM 563 OD1 ASN A 33 -7.929 6.374 -7.047 1.00 1.28 O ATOM 564 ND2 ASN A 33 -6.977 7.341 -8.816 1.00 1.12 N ATOM 0 H ASN A 33 -6.260 4.636 -8.403 1.00 0.31 H new ATOM 0 HA ASN A 33 -3.718 5.991 -7.749 1.00 0.33 H new ATOM 0 HB2 ASN A 33 -5.711 6.648 -5.858 1.00 0.36 H new ATOM 0 HB3 ASN A 33 -5.048 7.690 -7.102 1.00 0.36 H new ATOM 0 HD21 ASN A 33 -7.866 7.399 -9.313 1.00 1.12 H new ATOM 0 HD22 ASN A 33 -6.125 7.694 -9.252 1.00 1.12 H new ATOM 571 N ILE A 34 -5.218 3.544 -6.231 1.00 0.33 N ATOM 572 CA ILE A 34 -5.060 2.554 -5.174 1.00 0.33 C ATOM 573 C ILE A 34 -4.539 1.225 -5.723 1.00 0.29 C ATOM 574 O ILE A 34 -5.085 0.681 -6.684 1.00 0.30 O ATOM 575 CB ILE A 34 -6.391 2.313 -4.428 1.00 0.35 C ATOM 576 CG1 ILE A 34 -6.729 3.505 -3.532 1.00 0.53 C ATOM 577 CG2 ILE A 34 -6.317 1.045 -3.590 1.00 0.58 C ATOM 578 CD1 ILE A 34 -7.569 4.570 -4.198 1.00 0.59 C ATOM 0 H ILE A 34 -5.973 3.350 -6.888 1.00 0.33 H new ATOM 0 HA ILE A 34 -4.328 2.956 -4.474 1.00 0.33 H new ATOM 0 HB ILE A 34 -7.177 2.196 -5.174 1.00 0.35 H new ATOM 0 HG12 ILE A 34 -7.257 3.142 -2.650 1.00 0.53 H new ATOM 0 HG13 ILE A 34 -5.800 3.957 -3.184 1.00 0.53 H new ATOM 0 HG21 ILE A 34 -7.265 0.895 -3.073 1.00 0.58 H new ATOM 0 HG22 ILE A 34 -6.118 0.192 -4.238 1.00 0.58 H new ATOM 0 HG23 ILE A 34 -5.515 1.139 -2.857 1.00 0.58 H new ATOM 0 HD11 ILE A 34 -7.761 5.377 -3.491 1.00 0.59 H new ATOM 0 HD12 ILE A 34 -7.037 4.965 -5.063 1.00 0.59 H new ATOM 0 HD13 ILE A 34 -8.516 4.137 -4.521 1.00 0.59 H new ATOM 590 N VAL A 35 -3.500 0.702 -5.091 1.00 0.27 N ATOM 591 CA VAL A 35 -2.908 -0.566 -5.493 1.00 0.26 C ATOM 592 C VAL A 35 -3.101 -1.599 -4.388 1.00 0.25 C ATOM 593 O VAL A 35 -2.756 -1.353 -3.231 1.00 0.26 O ATOM 594 CB VAL A 35 -1.403 -0.421 -5.820 1.00 0.30 C ATOM 595 CG1 VAL A 35 -0.748 -1.782 -6.016 1.00 0.45 C ATOM 596 CG2 VAL A 35 -1.206 0.441 -7.058 1.00 0.51 C ATOM 0 H VAL A 35 -3.045 1.140 -4.290 1.00 0.27 H new ATOM 0 HA VAL A 35 -3.414 -0.896 -6.400 1.00 0.26 H new ATOM 0 HB VAL A 35 -0.923 0.067 -4.972 1.00 0.30 H new ATOM 0 HG11 VAL A 35 0.309 -1.647 -6.245 1.00 0.45 H new ATOM 0 HG12 VAL A 35 -0.850 -2.370 -5.104 1.00 0.45 H new ATOM 0 HG13 VAL A 35 -1.234 -2.304 -6.840 1.00 0.45 H new ATOM 0 HG21 VAL A 35 -0.141 0.532 -7.272 1.00 0.51 H new ATOM 0 HG22 VAL A 35 -1.709 -0.021 -7.907 1.00 0.51 H new ATOM 0 HG23 VAL A 35 -1.626 1.431 -6.883 1.00 0.51 H new ATOM 606 N ALA A 36 -3.670 -2.744 -4.744 1.00 0.25 N ATOM 607 CA ALA A 36 -3.918 -3.807 -3.780 1.00 0.25 C ATOM 608 C ALA A 36 -2.620 -4.469 -3.345 1.00 0.24 C ATOM 609 O ALA A 36 -1.820 -4.887 -4.186 1.00 0.27 O ATOM 610 CB ALA A 36 -4.868 -4.840 -4.363 1.00 0.30 C ATOM 0 H ALA A 36 -3.969 -2.960 -5.695 1.00 0.25 H new ATOM 0 HA ALA A 36 -4.380 -3.361 -2.900 1.00 0.25 H new ATOM 0 HB1 ALA A 36 -5.043 -5.628 -3.630 1.00 0.30 H new ATOM 0 HB2 ALA A 36 -5.815 -4.362 -4.615 1.00 0.30 H new ATOM 0 HB3 ALA A 36 -4.429 -5.272 -5.262 1.00 0.30 H new ATOM 616 N VAL A 37 -2.408 -4.563 -2.042 1.00 0.23 N ATOM 617 CA VAL A 37 -1.202 -5.178 -1.517 1.00 0.24 C ATOM 618 C VAL A 37 -1.502 -6.111 -0.359 1.00 0.25 C ATOM 619 O VAL A 37 -2.502 -5.960 0.364 1.00 0.25 O ATOM 620 CB VAL A 37 -0.160 -4.150 -1.052 1.00 0.27 C ATOM 621 CG1 VAL A 37 0.629 -3.605 -2.232 1.00 0.29 C ATOM 622 CG2 VAL A 37 -0.812 -3.033 -0.253 1.00 0.30 C ATOM 0 H VAL A 37 -3.055 -4.222 -1.331 1.00 0.23 H new ATOM 0 HA VAL A 37 -0.788 -5.744 -2.351 1.00 0.24 H new ATOM 0 HB VAL A 37 0.543 -4.656 -0.391 1.00 0.27 H new ATOM 0 HG11 VAL A 37 1.360 -2.879 -1.877 1.00 0.29 H new ATOM 0 HG12 VAL A 37 1.145 -4.424 -2.734 1.00 0.29 H new ATOM 0 HG13 VAL A 37 -0.052 -3.121 -2.932 1.00 0.29 H new ATOM 0 HG21 VAL A 37 -0.051 -2.320 0.063 1.00 0.30 H new ATOM 0 HG22 VAL A 37 -1.550 -2.525 -0.874 1.00 0.30 H new ATOM 0 HG23 VAL A 37 -1.303 -3.453 0.625 1.00 0.30 H new ATOM 632 N GLY A 38 -0.702 -7.151 -0.282 1.00 0.27 N ATOM 633 CA GLY A 38 -0.831 -8.111 0.769 1.00 0.30 C ATOM 634 C GLY A 38 -0.466 -9.479 0.269 1.00 0.32 C ATOM 635 O GLY A 38 0.285 -9.625 -0.710 1.00 0.32 O ATOM 0 H GLY A 38 0.048 -7.346 -0.945 1.00 0.27 H new ATOM 0 HA2 GLY A 38 -0.186 -7.837 1.603 1.00 0.30 H new ATOM 0 HA3 GLY A 38 -1.854 -8.114 1.145 1.00 0.30 H new ATOM 639 N SER A 39 -1.053 -10.483 0.887 1.00 0.38 N ATOM 640 CA SER A 39 -0.855 -11.846 0.469 1.00 0.43 C ATOM 641 C SER A 39 -1.466 -12.015 -0.930 1.00 0.43 C ATOM 642 O SER A 39 -1.096 -12.922 -1.673 1.00 0.44 O ATOM 643 CB SER A 39 -1.454 -12.805 1.495 1.00 0.57 C ATOM 644 OG SER A 39 -1.122 -12.389 2.813 1.00 1.40 O ATOM 0 H SER A 39 -1.676 -10.374 1.687 1.00 0.38 H new ATOM 0 HA SER A 39 0.207 -12.085 0.410 1.00 0.43 H new ATOM 0 HB2 SER A 39 -2.537 -12.841 1.380 1.00 0.57 H new ATOM 0 HB3 SER A 39 -1.081 -13.814 1.320 1.00 0.57 H new ATOM 0 HG SER A 39 -1.514 -13.011 3.461 1.00 1.40 H new ATOM 650 N LEU A 40 -2.413 -11.122 -1.277 1.00 0.45 N ATOM 651 CA LEU A 40 -3.043 -11.124 -2.597 1.00 0.51 C ATOM 652 C LEU A 40 -1.980 -10.955 -3.672 1.00 0.47 C ATOM 653 O LEU A 40 -1.993 -11.637 -4.695 1.00 0.52 O ATOM 654 CB LEU A 40 -4.040 -9.965 -2.716 1.00 0.63 C ATOM 655 CG LEU A 40 -5.270 -10.046 -1.818 1.00 0.97 C ATOM 656 CD1 LEU A 40 -6.247 -8.932 -2.159 1.00 1.24 C ATOM 657 CD2 LEU A 40 -5.934 -11.406 -1.950 1.00 2.02 C ATOM 0 H LEU A 40 -2.755 -10.390 -0.654 1.00 0.45 H new ATOM 0 HA LEU A 40 -3.566 -12.072 -2.726 1.00 0.51 H new ATOM 0 HB2 LEU A 40 -3.514 -9.036 -2.496 1.00 0.63 H new ATOM 0 HB3 LEU A 40 -4.374 -9.904 -3.752 1.00 0.63 H new ATOM 0 HG LEU A 40 -4.956 -9.920 -0.782 1.00 0.97 H new ATOM 0 HD11 LEU A 40 -7.120 -9.002 -1.510 1.00 1.24 H new ATOM 0 HD12 LEU A 40 -5.763 -7.966 -2.013 1.00 1.24 H new ATOM 0 HD13 LEU A 40 -6.559 -9.028 -3.199 1.00 1.24 H new ATOM 0 HD21 LEU A 40 -6.810 -11.448 -1.303 1.00 2.02 H new ATOM 0 HD22 LEU A 40 -6.239 -11.563 -2.985 1.00 2.02 H new ATOM 0 HD23 LEU A 40 -5.230 -12.185 -1.658 1.00 2.02 H new ATOM 669 N ARG A 41 -1.054 -10.038 -3.421 1.00 0.43 N ATOM 670 CA ARG A 41 0.024 -9.782 -4.356 1.00 0.47 C ATOM 671 C ARG A 41 1.040 -10.907 -4.256 1.00 0.47 C ATOM 672 O ARG A 41 1.677 -11.271 -5.243 1.00 0.54 O ATOM 673 CB ARG A 41 0.683 -8.423 -4.076 1.00 0.50 C ATOM 674 CG ARG A 41 1.720 -8.011 -5.117 1.00 0.92 C ATOM 675 CD ARG A 41 3.109 -8.510 -4.747 1.00 1.30 C ATOM 676 NE ARG A 41 3.940 -8.764 -5.922 1.00 1.82 N ATOM 677 CZ ARG A 41 4.875 -7.927 -6.369 1.00 2.29 C ATOM 678 NH1 ARG A 41 5.048 -6.743 -5.799 1.00 2.67 N ATOM 679 NH2 ARG A 41 5.630 -8.271 -7.403 1.00 2.98 N ATOM 0 H ARG A 41 -1.031 -9.463 -2.579 1.00 0.43 H new ATOM 0 HA ARG A 41 -0.378 -9.745 -5.369 1.00 0.47 H new ATOM 0 HB2 ARG A 41 -0.092 -7.658 -4.027 1.00 0.50 H new ATOM 0 HB3 ARG A 41 1.160 -8.457 -3.096 1.00 0.50 H new ATOM 0 HG2 ARG A 41 1.437 -8.409 -6.092 1.00 0.92 H new ATOM 0 HG3 ARG A 41 1.734 -6.925 -5.208 1.00 0.92 H new ATOM 0 HD2 ARG A 41 3.599 -7.773 -4.111 1.00 1.30 H new ATOM 0 HD3 ARG A 41 3.020 -9.426 -4.163 1.00 1.30 H new ATOM 0 HE ARG A 41 3.795 -9.636 -6.431 1.00 1.82 H new ATOM 0 HH11 ARG A 41 4.463 -6.466 -5.011 1.00 2.67 H new ATOM 0 HH12 ARG A 41 5.767 -6.109 -6.148 1.00 2.67 H new ATOM 0 HH21 ARG A 41 5.494 -9.175 -7.855 1.00 2.98 H new ATOM 0 HH22 ARG A 41 6.346 -7.631 -7.747 1.00 2.98 H new ATOM 693 N ARG A 42 1.177 -11.469 -3.057 1.00 0.43 N ATOM 694 CA ARG A 42 2.110 -12.569 -2.829 1.00 0.48 C ATOM 695 C ARG A 42 1.578 -13.875 -3.412 1.00 0.47 C ATOM 696 O ARG A 42 2.291 -14.878 -3.447 1.00 0.52 O ATOM 697 CB ARG A 42 2.345 -12.727 -1.330 1.00 0.52 C ATOM 698 CG ARG A 42 3.806 -12.871 -0.947 1.00 1.06 C ATOM 699 CD ARG A 42 4.053 -12.383 0.472 1.00 1.93 C ATOM 700 NE ARG A 42 3.209 -13.075 1.446 1.00 2.68 N ATOM 701 CZ ARG A 42 2.390 -12.457 2.303 1.00 3.60 C ATOM 702 NH1 ARG A 42 2.311 -11.124 2.324 1.00 3.96 N ATOM 703 NH2 ARG A 42 1.656 -13.171 3.149 1.00 4.52 N ATOM 0 H ARG A 42 0.654 -11.181 -2.230 1.00 0.43 H new ATOM 0 HA ARG A 42 3.050 -12.337 -3.330 1.00 0.48 H new ATOM 0 HB2 ARG A 42 1.928 -11.862 -0.814 1.00 0.52 H new ATOM 0 HB3 ARG A 42 1.799 -13.602 -0.977 1.00 0.52 H new ATOM 0 HG2 ARG A 42 4.106 -13.915 -1.033 1.00 1.06 H new ATOM 0 HG3 ARG A 42 4.425 -12.304 -1.642 1.00 1.06 H new ATOM 0 HD2 ARG A 42 5.101 -12.534 0.729 1.00 1.93 H new ATOM 0 HD3 ARG A 42 3.863 -11.311 0.525 1.00 1.93 H new ATOM 0 HE ARG A 42 3.248 -14.094 1.473 1.00 2.68 H new ATOM 0 HH11 ARG A 42 2.878 -10.569 1.683 1.00 3.96 H new ATOM 0 HH12 ARG A 42 1.683 -10.661 2.981 1.00 3.96 H new ATOM 0 HH21 ARG A 42 1.718 -14.189 3.144 1.00 4.52 H new ATOM 0 HH22 ARG A 42 1.031 -12.701 3.804 1.00 4.52 H new ATOM 717 N GLU A 43 0.320 -13.845 -3.852 1.00 0.46 N ATOM 718 CA GLU A 43 -0.334 -14.998 -4.470 1.00 0.50 C ATOM 719 C GLU A 43 -0.546 -16.123 -3.452 1.00 0.47 C ATOM 720 O GLU A 43 -0.251 -17.289 -3.716 1.00 0.52 O ATOM 721 CB GLU A 43 0.484 -15.486 -5.680 1.00 0.59 C ATOM 722 CG GLU A 43 0.835 -14.368 -6.658 1.00 0.67 C ATOM 723 CD GLU A 43 1.837 -14.799 -7.713 1.00 0.95 C ATOM 724 OE1 GLU A 43 1.541 -15.754 -8.458 1.00 1.60 O ATOM 725 OE2 GLU A 43 2.927 -14.187 -7.806 1.00 1.53 O ATOM 0 H GLU A 43 -0.275 -13.019 -3.790 1.00 0.46 H new ATOM 0 HA GLU A 43 -1.318 -14.690 -4.823 1.00 0.50 H new ATOM 0 HB2 GLU A 43 1.403 -15.952 -5.325 1.00 0.59 H new ATOM 0 HB3 GLU A 43 -0.081 -16.256 -6.206 1.00 0.59 H new ATOM 0 HG2 GLU A 43 -0.075 -14.022 -7.148 1.00 0.67 H new ATOM 0 HG3 GLU A 43 1.240 -13.521 -6.104 1.00 0.67 H new ATOM 732 N GLU A 44 -1.069 -15.752 -2.289 1.00 0.43 N ATOM 733 CA GLU A 44 -1.335 -16.700 -1.211 1.00 0.43 C ATOM 734 C GLU A 44 -2.781 -17.177 -1.232 1.00 0.43 C ATOM 735 O GLU A 44 -3.671 -16.478 -1.714 1.00 0.52 O ATOM 736 CB GLU A 44 -1.012 -16.079 0.139 1.00 0.48 C ATOM 737 CG GLU A 44 0.475 -16.041 0.451 1.00 1.24 C ATOM 738 CD GLU A 44 1.018 -17.389 0.888 1.00 1.94 C ATOM 739 OE1 GLU A 44 0.465 -18.429 0.472 1.00 2.47 O ATOM 740 OE2 GLU A 44 2.008 -17.409 1.652 1.00 2.57 O ATOM 0 H GLU A 44 -1.320 -14.789 -2.066 1.00 0.43 H new ATOM 0 HA GLU A 44 -0.690 -17.565 -1.369 1.00 0.43 H new ATOM 0 HB2 GLU A 44 -1.406 -15.063 0.166 1.00 0.48 H new ATOM 0 HB3 GLU A 44 -1.524 -16.641 0.920 1.00 0.48 H new ATOM 0 HG2 GLU A 44 1.018 -15.704 -0.432 1.00 1.24 H new ATOM 0 HG3 GLU A 44 0.658 -15.308 1.237 1.00 1.24 H new ATOM 747 N LYS A 45 -2.992 -18.375 -0.704 1.00 0.46 N ATOM 748 CA LYS A 45 -4.310 -19.004 -0.666 1.00 0.50 C ATOM 749 C LYS A 45 -5.327 -18.210 0.156 1.00 0.49 C ATOM 750 O LYS A 45 -6.438 -17.950 -0.311 1.00 0.56 O ATOM 751 CB LYS A 45 -4.210 -20.427 -0.098 1.00 0.59 C ATOM 752 CG LYS A 45 -3.250 -21.337 -0.852 1.00 1.14 C ATOM 753 CD LYS A 45 -1.832 -21.235 -0.306 1.00 1.28 C ATOM 754 CE LYS A 45 -0.824 -20.996 -1.417 1.00 1.42 C ATOM 755 NZ LYS A 45 0.522 -20.657 -0.889 1.00 2.10 N ATOM 0 H LYS A 45 -2.253 -18.942 -0.288 1.00 0.46 H new ATOM 0 HA LYS A 45 -4.664 -19.031 -1.697 1.00 0.50 H new ATOM 0 HB2 LYS A 45 -3.894 -20.368 0.944 1.00 0.59 H new ATOM 0 HB3 LYS A 45 -5.202 -20.879 -0.105 1.00 0.59 H new ATOM 0 HG2 LYS A 45 -3.594 -22.369 -0.780 1.00 1.14 H new ATOM 0 HG3 LYS A 45 -3.253 -21.073 -1.909 1.00 1.14 H new ATOM 0 HD2 LYS A 45 -1.777 -20.422 0.418 1.00 1.28 H new ATOM 0 HD3 LYS A 45 -1.579 -22.152 0.226 1.00 1.28 H new ATOM 0 HE2 LYS A 45 -0.754 -21.888 -2.040 1.00 1.42 H new ATOM 0 HE3 LYS A 45 -1.176 -20.187 -2.057 1.00 1.42 H new ATOM 0 HZ1 LYS A 45 1.237 -20.832 -1.623 1.00 2.10 H new ATOM 0 HZ2 LYS A 45 0.545 -19.654 -0.616 1.00 2.10 H new ATOM 0 HZ3 LYS A 45 0.728 -21.247 -0.058 1.00 2.10 H new ATOM 769 N MET A 46 -4.948 -17.806 1.361 1.00 0.46 N ATOM 770 CA MET A 46 -5.873 -17.089 2.236 1.00 0.48 C ATOM 771 C MET A 46 -5.161 -16.126 3.182 1.00 0.46 C ATOM 772 O MET A 46 -4.078 -16.421 3.688 1.00 0.67 O ATOM 773 CB MET A 46 -6.691 -18.092 3.058 1.00 0.60 C ATOM 774 CG MET A 46 -7.658 -17.440 4.034 1.00 0.67 C ATOM 775 SD MET A 46 -8.422 -18.614 5.168 1.00 1.15 S ATOM 776 CE MET A 46 -7.015 -19.069 6.181 1.00 2.00 C ATOM 0 H MET A 46 -4.019 -17.959 1.754 1.00 0.46 H new ATOM 0 HA MET A 46 -6.525 -16.497 1.594 1.00 0.48 H new ATOM 0 HB2 MET A 46 -7.252 -18.733 2.378 1.00 0.60 H new ATOM 0 HB3 MET A 46 -6.008 -18.736 3.612 1.00 0.60 H new ATOM 0 HG2 MET A 46 -7.127 -16.682 4.610 1.00 0.67 H new ATOM 0 HG3 MET A 46 -8.439 -16.926 3.473 1.00 0.67 H new ATOM 0 HE1 MET A 46 -7.366 -19.492 7.122 1.00 2.00 H new ATOM 0 HE2 MET A 46 -6.411 -19.807 5.654 1.00 2.00 H new ATOM 0 HE3 MET A 46 -6.411 -18.184 6.384 1.00 2.00 H new ATOM 786 N LEU A 47 -5.792 -14.978 3.415 1.00 0.49 N ATOM 787 CA LEU A 47 -5.264 -13.970 4.317 1.00 0.56 C ATOM 788 C LEU A 47 -6.374 -13.427 5.216 1.00 0.55 C ATOM 789 O LEU A 47 -7.562 -13.684 4.982 1.00 0.59 O ATOM 790 CB LEU A 47 -4.591 -12.838 3.538 1.00 0.82 C ATOM 791 CG LEU A 47 -5.458 -12.095 2.526 1.00 0.43 C ATOM 792 CD1 LEU A 47 -6.161 -10.930 3.188 1.00 1.09 C ATOM 793 CD2 LEU A 47 -4.614 -11.589 1.373 1.00 1.09 C ATOM 0 H LEU A 47 -6.681 -14.725 2.983 1.00 0.49 H new ATOM 0 HA LEU A 47 -4.507 -14.437 4.948 1.00 0.56 H new ATOM 0 HB2 LEU A 47 -4.207 -12.112 4.255 1.00 0.82 H new ATOM 0 HB3 LEU A 47 -3.731 -13.251 3.011 1.00 0.82 H new ATOM 0 HG LEU A 47 -6.204 -12.791 2.142 1.00 0.43 H new ATOM 0 HD11 LEU A 47 -6.775 -10.410 2.453 1.00 1.09 H new ATOM 0 HD12 LEU A 47 -6.794 -11.298 3.995 1.00 1.09 H new ATOM 0 HD13 LEU A 47 -5.420 -10.241 3.594 1.00 1.09 H new ATOM 0 HD21 LEU A 47 -5.249 -11.062 0.661 1.00 1.09 H new ATOM 0 HD22 LEU A 47 -3.851 -10.909 1.752 1.00 1.09 H new ATOM 0 HD23 LEU A 47 -4.134 -12.432 0.876 1.00 1.09 H new ATOM 805 N ASN A 48 -5.989 -12.696 6.256 1.00 0.61 N ATOM 806 CA ASN A 48 -6.956 -12.137 7.197 1.00 0.64 C ATOM 807 C ASN A 48 -7.427 -10.743 6.786 1.00 0.52 C ATOM 808 O ASN A 48 -8.626 -10.485 6.695 1.00 0.54 O ATOM 809 CB ASN A 48 -6.345 -12.071 8.600 1.00 0.77 C ATOM 810 CG ASN A 48 -7.382 -11.779 9.667 1.00 1.47 C ATOM 811 OD1 ASN A 48 -7.705 -10.624 9.936 1.00 2.03 O ATOM 812 ND2 ASN A 48 -7.895 -12.824 10.295 1.00 2.14 N ATOM 0 H ASN A 48 -5.016 -12.476 6.470 1.00 0.61 H new ATOM 0 HA ASN A 48 -7.823 -12.797 7.194 1.00 0.64 H new ATOM 0 HB2 ASN A 48 -5.853 -13.017 8.824 1.00 0.77 H new ATOM 0 HB3 ASN A 48 -5.576 -11.299 8.623 1.00 0.77 H new ATOM 0 HD21 ASN A 48 -8.586 -12.687 11.033 1.00 2.14 H new ATOM 0 HD22 ASN A 48 -7.600 -13.767 10.041 1.00 2.14 H new ATOM 819 N ASP A 49 -6.485 -9.847 6.530 1.00 0.49 N ATOM 820 CA ASP A 49 -6.825 -8.477 6.158 1.00 0.39 C ATOM 821 C ASP A 49 -6.226 -8.123 4.806 1.00 0.34 C ATOM 822 O ASP A 49 -5.037 -8.410 4.563 1.00 0.42 O ATOM 823 CB ASP A 49 -6.344 -7.484 7.241 1.00 0.43 C ATOM 824 CG ASP A 49 -4.934 -6.948 6.983 1.00 0.52 C ATOM 825 OD1 ASP A 49 -3.980 -7.744 6.942 1.00 1.02 O ATOM 826 OD2 ASP A 49 -4.755 -5.741 6.791 1.00 1.05 O ATOM 0 H ASP A 49 -5.484 -10.040 6.572 1.00 0.49 H new ATOM 0 HA ASP A 49 -7.910 -8.404 6.081 1.00 0.39 H new ATOM 0 HB2 ASP A 49 -7.040 -6.647 7.292 1.00 0.43 H new ATOM 0 HB3 ASP A 49 -6.366 -7.977 8.213 1.00 0.43 H new ATOM 831 N VAL A 50 -7.041 -7.481 3.955 1.00 0.28 N ATOM 832 CA VAL A 50 -6.619 -7.071 2.616 1.00 0.27 C ATOM 833 C VAL A 50 -6.159 -5.636 2.690 1.00 0.24 C ATOM 834 O VAL A 50 -6.846 -4.782 3.255 1.00 0.26 O ATOM 835 CB VAL A 50 -7.750 -7.208 1.562 1.00 0.36 C ATOM 836 CG1 VAL A 50 -9.081 -6.707 2.105 1.00 0.88 C ATOM 837 CG2 VAL A 50 -7.382 -6.474 0.277 1.00 0.90 C ATOM 0 H VAL A 50 -8.005 -7.235 4.178 1.00 0.28 H new ATOM 0 HA VAL A 50 -5.813 -7.730 2.293 1.00 0.27 H new ATOM 0 HB VAL A 50 -7.863 -8.268 1.334 1.00 0.36 H new ATOM 0 HG11 VAL A 50 -9.850 -6.818 1.341 1.00 0.88 H new ATOM 0 HG12 VAL A 50 -9.357 -7.288 2.985 1.00 0.88 H new ATOM 0 HG13 VAL A 50 -8.990 -5.656 2.379 1.00 0.88 H new ATOM 0 HG21 VAL A 50 -8.189 -6.583 -0.448 1.00 0.90 H new ATOM 0 HG22 VAL A 50 -7.229 -5.417 0.493 1.00 0.90 H new ATOM 0 HG23 VAL A 50 -6.465 -6.897 -0.134 1.00 0.90 H new ATOM 847 N ASP A 51 -4.985 -5.365 2.160 1.00 0.24 N ATOM 848 CA ASP A 51 -4.421 -4.053 2.261 1.00 0.24 C ATOM 849 C ASP A 51 -4.424 -3.314 0.925 1.00 0.24 C ATOM 850 O ASP A 51 -4.328 -3.922 -0.141 1.00 0.26 O ATOM 851 CB ASP A 51 -3.033 -4.233 2.855 1.00 0.27 C ATOM 852 CG ASP A 51 -3.083 -5.151 4.088 1.00 0.31 C ATOM 853 OD1 ASP A 51 -3.255 -6.399 3.952 1.00 0.40 O ATOM 854 OD2 ASP A 51 -2.922 -4.648 5.221 1.00 0.38 O ATOM 0 H ASP A 51 -4.410 -6.041 1.657 1.00 0.24 H new ATOM 0 HA ASP A 51 -5.022 -3.413 2.906 1.00 0.24 H new ATOM 0 HB2 ASP A 51 -2.364 -4.658 2.106 1.00 0.27 H new ATOM 0 HB3 ASP A 51 -2.623 -3.262 3.135 1.00 0.27 H new ATOM 859 N LEU A 52 -4.563 -1.995 0.996 1.00 0.26 N ATOM 860 CA LEU A 52 -4.627 -1.149 -0.188 1.00 0.31 C ATOM 861 C LEU A 52 -3.751 0.092 -0.068 1.00 0.25 C ATOM 862 O LEU A 52 -3.992 0.959 0.777 1.00 0.32 O ATOM 863 CB LEU A 52 -6.067 -0.692 -0.410 1.00 0.41 C ATOM 864 CG LEU A 52 -7.050 -1.768 -0.857 1.00 0.64 C ATOM 865 CD1 LEU A 52 -8.430 -1.166 -1.031 1.00 1.28 C ATOM 866 CD2 LEU A 52 -6.586 -2.418 -2.148 1.00 1.07 C ATOM 0 H LEU A 52 -4.634 -1.483 1.875 1.00 0.26 H new ATOM 0 HA LEU A 52 -4.264 -1.746 -1.024 1.00 0.31 H new ATOM 0 HB2 LEU A 52 -6.435 -0.255 0.518 1.00 0.41 H new ATOM 0 HB3 LEU A 52 -6.064 0.102 -1.157 1.00 0.41 H new ATOM 0 HG LEU A 52 -7.096 -2.540 -0.089 1.00 0.64 H new ATOM 0 HD11 LEU A 52 -9.127 -1.941 -1.351 1.00 1.28 H new ATOM 0 HD12 LEU A 52 -8.765 -0.745 -0.083 1.00 1.28 H new ATOM 0 HD13 LEU A 52 -8.391 -0.379 -1.785 1.00 1.28 H new ATOM 0 HD21 LEU A 52 -7.302 -3.183 -2.448 1.00 1.07 H new ATOM 0 HD22 LEU A 52 -6.513 -1.662 -2.930 1.00 1.07 H new ATOM 0 HD23 LEU A 52 -5.609 -2.877 -1.994 1.00 1.07 H new ATOM 878 N LEU A 53 -2.721 0.165 -0.891 1.00 0.27 N ATOM 879 CA LEU A 53 -1.856 1.330 -0.912 1.00 0.31 C ATOM 880 C LEU A 53 -2.477 2.406 -1.786 1.00 0.26 C ATOM 881 O LEU A 53 -2.723 2.187 -2.970 1.00 0.26 O ATOM 882 CB LEU A 53 -0.476 0.971 -1.453 1.00 0.48 C ATOM 883 CG LEU A 53 0.558 0.565 -0.405 1.00 0.79 C ATOM 884 CD1 LEU A 53 1.769 -0.036 -1.083 1.00 1.59 C ATOM 885 CD2 LEU A 53 0.972 1.763 0.436 1.00 1.06 C ATOM 0 H LEU A 53 -2.463 -0.567 -1.553 1.00 0.27 H new ATOM 0 HA LEU A 53 -1.745 1.697 0.108 1.00 0.31 H new ATOM 0 HB2 LEU A 53 -0.586 0.153 -2.165 1.00 0.48 H new ATOM 0 HB3 LEU A 53 -0.089 1.826 -2.007 1.00 0.48 H new ATOM 0 HG LEU A 53 0.110 -0.178 0.254 1.00 0.79 H new ATOM 0 HD11 LEU A 53 2.503 -0.323 -0.330 1.00 1.59 H new ATOM 0 HD12 LEU A 53 1.468 -0.916 -1.651 1.00 1.59 H new ATOM 0 HD13 LEU A 53 2.210 0.698 -1.757 1.00 1.59 H new ATOM 0 HD21 LEU A 53 1.709 1.451 1.176 1.00 1.06 H new ATOM 0 HD22 LEU A 53 1.406 2.527 -0.208 1.00 1.06 H new ATOM 0 HD23 LEU A 53 0.098 2.170 0.944 1.00 1.06 H new ATOM 897 N ILE A 54 -2.744 3.553 -1.201 1.00 0.26 N ATOM 898 CA ILE A 54 -3.338 4.659 -1.929 1.00 0.25 C ATOM 899 C ILE A 54 -2.261 5.674 -2.292 1.00 0.25 C ATOM 900 O ILE A 54 -1.747 6.383 -1.425 1.00 0.27 O ATOM 901 CB ILE A 54 -4.434 5.344 -1.083 1.00 0.29 C ATOM 902 CG1 ILE A 54 -5.384 4.293 -0.494 1.00 0.52 C ATOM 903 CG2 ILE A 54 -5.197 6.375 -1.904 1.00 0.41 C ATOM 904 CD1 ILE A 54 -6.380 4.850 0.499 1.00 0.58 C ATOM 0 H ILE A 54 -2.559 3.747 -0.217 1.00 0.26 H new ATOM 0 HA ILE A 54 -3.794 4.269 -2.839 1.00 0.25 H new ATOM 0 HB ILE A 54 -3.953 5.873 -0.260 1.00 0.29 H new ATOM 0 HG12 ILE A 54 -5.928 3.813 -1.308 1.00 0.52 H new ATOM 0 HG13 ILE A 54 -4.794 3.518 -0.005 1.00 0.52 H new ATOM 0 HG21 ILE A 54 -5.962 6.841 -1.283 1.00 0.41 H new ATOM 0 HG22 ILE A 54 -4.506 7.138 -2.263 1.00 0.41 H new ATOM 0 HG23 ILE A 54 -5.670 5.885 -2.755 1.00 0.41 H new ATOM 0 HD11 ILE A 54 -7.014 4.044 0.869 1.00 0.58 H new ATOM 0 HD12 ILE A 54 -5.846 5.304 1.334 1.00 0.58 H new ATOM 0 HD13 ILE A 54 -6.998 5.603 0.011 1.00 0.58 H new ATOM 916 N ILE A 55 -1.910 5.726 -3.566 1.00 0.25 N ATOM 917 CA ILE A 55 -0.890 6.639 -4.049 1.00 0.26 C ATOM 918 C ILE A 55 -1.520 7.885 -4.637 1.00 0.25 C ATOM 919 O ILE A 55 -2.269 7.820 -5.610 1.00 0.29 O ATOM 920 CB ILE A 55 -0.020 5.989 -5.140 1.00 0.30 C ATOM 921 CG1 ILE A 55 0.367 4.564 -4.753 1.00 0.35 C ATOM 922 CG2 ILE A 55 1.214 6.824 -5.403 1.00 0.48 C ATOM 923 CD1 ILE A 55 -0.493 3.526 -5.429 1.00 0.44 C ATOM 0 H ILE A 55 -2.322 5.139 -4.291 1.00 0.25 H new ATOM 0 HA ILE A 55 -0.269 6.896 -3.191 1.00 0.26 H new ATOM 0 HB ILE A 55 -0.606 5.942 -6.058 1.00 0.30 H new ATOM 0 HG12 ILE A 55 1.411 4.391 -5.014 1.00 0.35 H new ATOM 0 HG13 ILE A 55 0.286 4.450 -3.672 1.00 0.35 H new ATOM 0 HG21 ILE A 55 1.817 6.349 -6.177 1.00 0.48 H new ATOM 0 HG22 ILE A 55 0.916 7.819 -5.735 1.00 0.48 H new ATOM 0 HG23 ILE A 55 1.799 6.907 -4.487 1.00 0.48 H new ATOM 0 HD11 ILE A 55 -0.174 2.531 -5.118 1.00 0.44 H new ATOM 0 HD12 ILE A 55 -1.535 3.678 -5.148 1.00 0.44 H new ATOM 0 HD13 ILE A 55 -0.392 3.618 -6.510 1.00 0.44 H new ATOM 935 N VAL A 56 -1.216 9.018 -4.045 1.00 0.24 N ATOM 936 CA VAL A 56 -1.750 10.277 -4.520 1.00 0.26 C ATOM 937 C VAL A 56 -0.622 11.215 -4.938 1.00 0.27 C ATOM 938 O VAL A 56 0.348 11.403 -4.200 1.00 0.25 O ATOM 939 CB VAL A 56 -2.624 10.960 -3.447 1.00 0.28 C ATOM 940 CG1 VAL A 56 -3.598 11.937 -4.087 1.00 0.34 C ATOM 941 CG2 VAL A 56 -3.373 9.921 -2.625 1.00 0.33 C ATOM 0 H VAL A 56 -0.602 9.095 -3.234 1.00 0.24 H new ATOM 0 HA VAL A 56 -2.376 10.060 -5.386 1.00 0.26 H new ATOM 0 HB VAL A 56 -1.968 11.519 -2.780 1.00 0.28 H new ATOM 0 HG11 VAL A 56 -4.204 12.407 -3.312 1.00 0.34 H new ATOM 0 HG12 VAL A 56 -3.042 12.703 -4.628 1.00 0.34 H new ATOM 0 HG13 VAL A 56 -4.247 11.402 -4.781 1.00 0.34 H new ATOM 0 HG21 VAL A 56 -3.984 10.422 -1.874 1.00 0.33 H new ATOM 0 HG22 VAL A 56 -4.015 9.332 -3.280 1.00 0.33 H new ATOM 0 HG23 VAL A 56 -2.658 9.263 -2.131 1.00 0.33 H new ATOM 951 N PRO A 57 -0.720 11.797 -6.145 1.00 0.31 N ATOM 952 CA PRO A 57 0.291 12.729 -6.656 1.00 0.34 C ATOM 953 C PRO A 57 0.275 14.066 -5.922 1.00 0.34 C ATOM 954 O PRO A 57 1.138 14.915 -6.145 1.00 0.37 O ATOM 955 CB PRO A 57 -0.102 12.917 -8.124 1.00 0.39 C ATOM 956 CG PRO A 57 -1.554 12.596 -8.188 1.00 0.41 C ATOM 957 CD PRO A 57 -1.805 11.564 -7.121 1.00 0.37 C ATOM 0 HA PRO A 57 1.302 12.344 -6.520 1.00 0.34 H new ATOM 0 HB2 PRO A 57 0.090 13.938 -8.455 1.00 0.39 H new ATOM 0 HB3 PRO A 57 0.475 12.258 -8.773 1.00 0.39 H new ATOM 0 HG2 PRO A 57 -2.157 13.487 -8.017 1.00 0.41 H new ATOM 0 HG3 PRO A 57 -1.825 12.212 -9.172 1.00 0.41 H new ATOM 0 HD2 PRO A 57 -2.787 11.690 -6.665 1.00 0.37 H new ATOM 0 HD3 PRO A 57 -1.769 10.553 -7.526 1.00 0.37 H new ATOM 965 N GLU A 58 -0.702 14.245 -5.044 1.00 0.33 N ATOM 966 CA GLU A 58 -0.819 15.474 -4.278 1.00 0.36 C ATOM 967 C GLU A 58 -1.010 15.190 -2.806 1.00 0.35 C ATOM 968 O GLU A 58 -1.801 14.328 -2.424 1.00 0.34 O ATOM 969 CB GLU A 58 -1.999 16.318 -4.736 1.00 0.40 C ATOM 970 CG GLU A 58 -1.604 17.554 -5.518 1.00 0.64 C ATOM 971 CD GLU A 58 -1.074 18.645 -4.613 1.00 1.32 C ATOM 972 OE1 GLU A 58 -0.882 18.383 -3.405 1.00 1.99 O ATOM 973 OE2 GLU A 58 -0.844 19.766 -5.097 1.00 2.00 O ATOM 0 H GLU A 58 -1.425 13.553 -4.846 1.00 0.33 H new ATOM 0 HA GLU A 58 0.112 16.017 -4.443 1.00 0.36 H new ATOM 0 HB2 GLU A 58 -2.654 15.704 -5.353 1.00 0.40 H new ATOM 0 HB3 GLU A 58 -2.576 16.622 -3.863 1.00 0.40 H new ATOM 0 HG2 GLU A 58 -0.844 17.291 -6.254 1.00 0.64 H new ATOM 0 HG3 GLU A 58 -2.467 17.927 -6.070 1.00 0.64 H new ATOM 980 N LYS A 59 -0.299 15.940 -1.992 1.00 0.36 N ATOM 981 CA LYS A 59 -0.406 15.816 -0.549 1.00 0.37 C ATOM 982 C LYS A 59 -1.784 16.288 -0.130 1.00 0.37 C ATOM 983 O LYS A 59 -2.385 15.775 0.819 1.00 0.37 O ATOM 984 CB LYS A 59 0.676 16.644 0.140 1.00 0.42 C ATOM 985 CG LYS A 59 0.873 16.287 1.605 1.00 1.10 C ATOM 986 CD LYS A 59 2.263 16.669 2.091 1.00 1.46 C ATOM 987 CE LYS A 59 2.504 18.165 1.974 1.00 2.16 C ATOM 988 NZ LYS A 59 3.904 18.530 2.308 1.00 2.64 N ATOM 0 H LYS A 59 0.365 16.648 -2.305 1.00 0.36 H new ATOM 0 HA LYS A 59 -0.266 14.776 -0.255 1.00 0.37 H new ATOM 0 HB2 LYS A 59 1.619 16.507 -0.389 1.00 0.42 H new ATOM 0 HB3 LYS A 59 0.418 17.700 0.063 1.00 0.42 H new ATOM 0 HG2 LYS A 59 0.123 16.797 2.209 1.00 1.10 H new ATOM 0 HG3 LYS A 59 0.720 15.217 1.743 1.00 1.10 H new ATOM 0 HD2 LYS A 59 2.384 16.360 3.129 1.00 1.46 H new ATOM 0 HD3 LYS A 59 3.013 16.132 1.510 1.00 1.46 H new ATOM 0 HE2 LYS A 59 2.277 18.491 0.959 1.00 2.16 H new ATOM 0 HE3 LYS A 59 1.822 18.695 2.639 1.00 2.16 H new ATOM 0 HZ1 LYS A 59 4.026 19.559 2.216 1.00 2.64 H new ATOM 0 HZ2 LYS A 59 4.114 18.243 3.285 1.00 2.64 H new ATOM 0 HZ3 LYS A 59 4.554 18.045 1.657 1.00 2.64 H new ATOM 1002 N LYS A 60 -2.287 17.265 -0.873 1.00 0.40 N ATOM 1003 CA LYS A 60 -3.593 17.822 -0.615 1.00 0.42 C ATOM 1004 C LYS A 60 -4.661 16.783 -0.915 1.00 0.40 C ATOM 1005 O LYS A 60 -5.364 16.344 -0.009 1.00 0.41 O ATOM 1006 CB LYS A 60 -3.811 19.079 -1.461 1.00 0.48 C ATOM 1007 CG LYS A 60 -3.450 20.376 -0.747 1.00 0.69 C ATOM 1008 CD LYS A 60 -2.040 20.341 -0.161 1.00 0.79 C ATOM 1009 CE LYS A 60 -0.967 20.464 -1.234 1.00 0.94 C ATOM 1010 NZ LYS A 60 -1.240 21.570 -2.192 1.00 1.50 N ATOM 0 H LYS A 60 -1.800 17.686 -1.664 1.00 0.40 H new ATOM 0 HA LYS A 60 -3.661 18.103 0.436 1.00 0.42 H new ATOM 0 HB2 LYS A 60 -3.217 19.000 -2.371 1.00 0.48 H new ATOM 0 HB3 LYS A 60 -4.857 19.123 -1.766 1.00 0.48 H new ATOM 0 HG2 LYS A 60 -3.530 21.208 -1.447 1.00 0.69 H new ATOM 0 HG3 LYS A 60 -4.169 20.561 0.051 1.00 0.69 H new ATOM 0 HD2 LYS A 60 -1.927 21.153 0.558 1.00 0.79 H new ATOM 0 HD3 LYS A 60 -1.899 19.409 0.386 1.00 0.79 H new ATOM 0 HE2 LYS A 60 -0.000 20.630 -0.759 1.00 0.94 H new ATOM 0 HE3 LYS A 60 -0.896 19.524 -1.781 1.00 0.94 H new ATOM 0 HZ1 LYS A 60 -0.366 21.812 -2.701 1.00 1.50 H new ATOM 0 HZ2 LYS A 60 -1.965 21.268 -2.874 1.00 1.50 H new ATOM 0 HZ3 LYS A 60 -1.580 22.404 -1.672 1.00 1.50 H new ATOM 1024 N LEU A 61 -4.733 16.341 -2.177 1.00 0.40 N ATOM 1025 CA LEU A 61 -5.715 15.339 -2.584 1.00 0.40 C ATOM 1026 C LEU A 61 -5.628 14.102 -1.703 1.00 0.37 C ATOM 1027 O LEU A 61 -6.618 13.399 -1.505 1.00 0.42 O ATOM 1028 CB LEU A 61 -5.501 14.945 -4.044 1.00 0.42 C ATOM 1029 CG LEU A 61 -5.559 16.092 -5.055 1.00 0.45 C ATOM 1030 CD1 LEU A 61 -5.186 15.597 -6.445 1.00 0.57 C ATOM 1031 CD2 LEU A 61 -6.944 16.721 -5.069 1.00 0.52 C ATOM 0 H LEU A 61 -4.123 16.663 -2.929 1.00 0.40 H new ATOM 0 HA LEU A 61 -6.706 15.778 -2.472 1.00 0.40 H new ATOM 0 HB2 LEU A 61 -4.530 14.457 -4.131 1.00 0.42 H new ATOM 0 HB3 LEU A 61 -6.255 14.206 -4.316 1.00 0.42 H new ATOM 0 HG LEU A 61 -4.838 16.852 -4.754 1.00 0.45 H new ATOM 0 HD11 LEU A 61 -5.233 16.426 -7.151 1.00 0.57 H new ATOM 0 HD12 LEU A 61 -4.174 15.192 -6.428 1.00 0.57 H new ATOM 0 HD13 LEU A 61 -5.884 14.818 -6.753 1.00 0.57 H new ATOM 0 HD21 LEU A 61 -6.967 17.535 -5.794 1.00 0.52 H new ATOM 0 HD22 LEU A 61 -7.683 15.968 -5.345 1.00 0.52 H new ATOM 0 HD23 LEU A 61 -7.177 17.111 -4.078 1.00 0.52 H new ATOM 1043 N LEU A 62 -4.439 13.840 -1.176 1.00 0.32 N ATOM 1044 CA LEU A 62 -4.211 12.705 -0.303 1.00 0.31 C ATOM 1045 C LEU A 62 -4.992 12.874 0.985 1.00 0.34 C ATOM 1046 O LEU A 62 -5.704 11.975 1.423 1.00 0.36 O ATOM 1047 CB LEU A 62 -2.719 12.604 -0.002 1.00 0.31 C ATOM 1048 CG LEU A 62 -2.321 11.645 1.116 1.00 0.40 C ATOM 1049 CD1 LEU A 62 -1.461 10.524 0.561 1.00 0.65 C ATOM 1050 CD2 LEU A 62 -1.577 12.386 2.217 1.00 0.58 C ATOM 0 H LEU A 62 -3.610 14.409 -1.344 1.00 0.32 H new ATOM 0 HA LEU A 62 -4.548 11.792 -0.794 1.00 0.31 H new ATOM 0 HB2 LEU A 62 -2.205 12.299 -0.914 1.00 0.31 H new ATOM 0 HB3 LEU A 62 -2.353 13.598 0.253 1.00 0.31 H new ATOM 0 HG LEU A 62 -3.227 11.215 1.543 1.00 0.40 H new ATOM 0 HD11 LEU A 62 -1.183 9.846 1.367 1.00 0.65 H new ATOM 0 HD12 LEU A 62 -2.022 9.976 -0.197 1.00 0.65 H new ATOM 0 HD13 LEU A 62 -0.560 10.944 0.113 1.00 0.65 H new ATOM 0 HD21 LEU A 62 -1.302 11.685 3.005 1.00 0.58 H new ATOM 0 HD22 LEU A 62 -0.676 12.841 1.805 1.00 0.58 H new ATOM 0 HD23 LEU A 62 -2.219 13.163 2.631 1.00 0.58 H new ATOM 1062 N LYS A 63 -4.854 14.041 1.586 1.00 0.37 N ATOM 1063 CA LYS A 63 -5.545 14.338 2.826 1.00 0.43 C ATOM 1064 C LYS A 63 -7.035 14.589 2.595 1.00 0.46 C ATOM 1065 O LYS A 63 -7.816 14.594 3.543 1.00 0.52 O ATOM 1066 CB LYS A 63 -4.928 15.559 3.499 1.00 0.47 C ATOM 1067 CG LYS A 63 -3.584 15.289 4.154 1.00 1.14 C ATOM 1068 CD LYS A 63 -3.024 16.541 4.815 1.00 1.36 C ATOM 1069 CE LYS A 63 -3.981 17.096 5.860 1.00 1.86 C ATOM 1070 NZ LYS A 63 -3.470 18.346 6.478 1.00 2.13 N ATOM 0 H LYS A 63 -4.269 14.799 1.235 1.00 0.37 H new ATOM 0 HA LYS A 63 -5.438 13.467 3.473 1.00 0.43 H new ATOM 0 HB2 LYS A 63 -4.807 16.348 2.757 1.00 0.47 H new ATOM 0 HB3 LYS A 63 -5.620 15.934 4.253 1.00 0.47 H new ATOM 0 HG2 LYS A 63 -3.693 14.501 4.899 1.00 1.14 H new ATOM 0 HG3 LYS A 63 -2.880 14.925 3.406 1.00 1.14 H new ATOM 0 HD2 LYS A 63 -2.067 16.310 5.283 1.00 1.36 H new ATOM 0 HD3 LYS A 63 -2.833 17.300 4.056 1.00 1.36 H new ATOM 0 HE2 LYS A 63 -4.949 17.290 5.398 1.00 1.86 H new ATOM 0 HE3 LYS A 63 -4.143 16.348 6.636 1.00 1.86 H new ATOM 0 HZ1 LYS A 63 -4.153 18.689 7.183 1.00 2.13 H new ATOM 0 HZ2 LYS A 63 -2.559 18.157 6.942 1.00 2.13 H new ATOM 0 HZ3 LYS A 63 -3.340 19.069 5.742 1.00 2.13 H new ATOM 1084 N HIS A 64 -7.427 14.803 1.342 1.00 0.45 N ATOM 1085 CA HIS A 64 -8.827 15.074 1.006 1.00 0.51 C ATOM 1086 C HIS A 64 -9.712 13.841 1.160 1.00 0.38 C ATOM 1087 O HIS A 64 -10.925 13.960 1.321 1.00 0.37 O ATOM 1088 CB HIS A 64 -8.943 15.599 -0.428 1.00 0.69 C ATOM 1089 CG HIS A 64 -8.353 16.959 -0.630 1.00 0.96 C ATOM 1090 ND1 HIS A 64 -8.367 17.575 -1.856 1.00 1.60 N ATOM 1091 CD2 HIS A 64 -7.748 17.772 0.265 1.00 0.76 C ATOM 1092 CE1 HIS A 64 -7.775 18.742 -1.679 1.00 1.71 C ATOM 1093 NE2 HIS A 64 -7.383 18.907 -0.409 1.00 1.18 N ATOM 0 H HIS A 64 -6.797 14.795 0.540 1.00 0.45 H new ATOM 0 HA HIS A 64 -9.175 15.830 1.710 1.00 0.51 H new ATOM 0 HB2 HIS A 64 -8.451 14.897 -1.101 1.00 0.69 H new ATOM 0 HB3 HIS A 64 -9.996 15.626 -0.710 1.00 0.69 H new ATOM 0 HD2 HIS A 64 -7.584 17.566 1.312 1.00 0.76 H new ATOM 0 HE1 HIS A 64 -7.626 19.472 -2.461 1.00 1.71 H new ATOM 0 HE2 HIS A 64 -6.906 19.720 -0.020 1.00 1.18 H new ATOM 1101 N VAL A 65 -9.110 12.665 1.112 1.00 0.36 N ATOM 1102 CA VAL A 65 -9.864 11.421 1.238 1.00 0.35 C ATOM 1103 C VAL A 65 -10.318 11.179 2.684 1.00 0.37 C ATOM 1104 O VAL A 65 -11.299 10.479 2.927 1.00 0.43 O ATOM 1105 CB VAL A 65 -9.068 10.199 0.710 1.00 0.41 C ATOM 1106 CG1 VAL A 65 -8.551 10.463 -0.698 1.00 1.04 C ATOM 1107 CG2 VAL A 65 -7.919 9.836 1.639 1.00 1.09 C ATOM 0 H VAL A 65 -8.105 12.541 0.987 1.00 0.36 H new ATOM 0 HA VAL A 65 -10.751 11.534 0.615 1.00 0.35 H new ATOM 0 HB VAL A 65 -9.751 9.350 0.679 1.00 0.41 H new ATOM 0 HG11 VAL A 65 -7.995 9.594 -1.050 1.00 1.04 H new ATOM 0 HG12 VAL A 65 -9.392 10.651 -1.365 1.00 1.04 H new ATOM 0 HG13 VAL A 65 -7.895 11.333 -0.687 1.00 1.04 H new ATOM 0 HG21 VAL A 65 -7.384 8.976 1.237 1.00 1.09 H new ATOM 0 HG22 VAL A 65 -7.236 10.682 1.721 1.00 1.09 H new ATOM 0 HG23 VAL A 65 -8.312 9.590 2.625 1.00 1.09 H new ATOM 1117 N LEU A 66 -9.589 11.758 3.633 1.00 0.41 N ATOM 1118 CA LEU A 66 -9.887 11.596 5.059 1.00 0.52 C ATOM 1119 C LEU A 66 -11.241 12.201 5.485 1.00 0.51 C ATOM 1120 O LEU A 66 -12.009 11.527 6.176 1.00 0.56 O ATOM 1121 CB LEU A 66 -8.764 12.197 5.915 1.00 0.67 C ATOM 1122 CG LEU A 66 -7.387 11.555 5.743 1.00 0.86 C ATOM 1123 CD1 LEU A 66 -6.335 12.358 6.492 1.00 1.65 C ATOM 1124 CD2 LEU A 66 -7.402 10.113 6.228 1.00 0.83 C ATOM 0 H LEU A 66 -8.780 12.349 3.441 1.00 0.41 H new ATOM 0 HA LEU A 66 -9.956 10.521 5.226 1.00 0.52 H new ATOM 0 HB2 LEU A 66 -8.682 13.259 5.682 1.00 0.67 H new ATOM 0 HB3 LEU A 66 -9.051 12.123 6.964 1.00 0.67 H new ATOM 0 HG LEU A 66 -7.136 11.555 4.682 1.00 0.86 H new ATOM 0 HD11 LEU A 66 -5.359 11.890 6.361 1.00 1.65 H new ATOM 0 HD12 LEU A 66 -6.306 13.375 6.100 1.00 1.65 H new ATOM 0 HD13 LEU A 66 -6.585 12.386 7.553 1.00 1.65 H new ATOM 0 HD21 LEU A 66 -6.413 9.675 6.097 1.00 0.83 H new ATOM 0 HD22 LEU A 66 -7.673 10.087 7.283 1.00 0.83 H new ATOM 0 HD23 LEU A 66 -8.131 9.543 5.652 1.00 0.83 H new ATOM 1136 N PRO A 67 -11.550 13.481 5.127 1.00 0.50 N ATOM 1137 CA PRO A 67 -12.821 14.127 5.502 1.00 0.53 C ATOM 1138 C PRO A 67 -14.038 13.240 5.267 1.00 0.46 C ATOM 1139 O PRO A 67 -14.853 13.047 6.170 1.00 0.54 O ATOM 1140 CB PRO A 67 -12.862 15.355 4.599 1.00 0.58 C ATOM 1141 CG PRO A 67 -11.438 15.712 4.399 1.00 0.68 C ATOM 1142 CD PRO A 67 -10.694 14.405 4.352 1.00 0.55 C ATOM 0 HA PRO A 67 -12.860 14.356 6.567 1.00 0.53 H new ATOM 0 HB2 PRO A 67 -13.354 15.135 3.651 1.00 0.58 H new ATOM 0 HB3 PRO A 67 -13.415 16.171 5.063 1.00 0.58 H new ATOM 0 HG2 PRO A 67 -11.301 16.274 3.475 1.00 0.68 H new ATOM 0 HG3 PRO A 67 -11.074 16.341 5.212 1.00 0.68 H new ATOM 0 HD2 PRO A 67 -10.558 14.059 3.327 1.00 0.55 H new ATOM 0 HD3 PRO A 67 -9.701 14.494 4.793 1.00 0.55 H new ATOM 1150 N ASN A 68 -14.167 12.707 4.060 1.00 0.38 N ATOM 1151 CA ASN A 68 -15.285 11.832 3.754 1.00 0.43 C ATOM 1152 C ASN A 68 -14.886 10.790 2.724 1.00 0.40 C ATOM 1153 O ASN A 68 -14.257 11.110 1.724 1.00 0.35 O ATOM 1154 CB ASN A 68 -16.479 12.642 3.254 1.00 0.53 C ATOM 1155 CG ASN A 68 -17.770 11.844 3.255 1.00 0.99 C ATOM 1156 OD1 ASN A 68 -18.103 11.175 2.278 1.00 1.73 O ATOM 1157 ND2 ASN A 68 -18.506 11.911 4.353 1.00 1.40 N ATOM 0 H ASN A 68 -13.520 12.863 3.287 1.00 0.38 H new ATOM 0 HA ASN A 68 -15.574 11.317 4.670 1.00 0.43 H new ATOM 0 HB2 ASN A 68 -16.602 13.525 3.881 1.00 0.53 H new ATOM 0 HB3 ASN A 68 -16.276 12.995 2.243 1.00 0.53 H new ATOM 0 HD21 ASN A 68 -19.385 11.396 4.410 1.00 1.40 H new ATOM 0 HD22 ASN A 68 -18.195 12.477 5.142 1.00 1.40 H new ATOM 1164 N ILE A 69 -15.246 9.545 2.988 1.00 0.46 N ATOM 1165 CA ILE A 69 -14.952 8.437 2.092 1.00 0.48 C ATOM 1166 C ILE A 69 -16.164 7.520 2.042 1.00 0.58 C ATOM 1167 O ILE A 69 -16.793 7.264 3.071 1.00 0.79 O ATOM 1168 CB ILE A 69 -13.688 7.644 2.513 1.00 0.56 C ATOM 1169 CG1 ILE A 69 -13.426 6.505 1.520 1.00 0.60 C ATOM 1170 CG2 ILE A 69 -13.825 7.103 3.932 1.00 0.70 C ATOM 1171 CD1 ILE A 69 -12.024 5.942 1.584 1.00 0.71 C ATOM 0 H ILE A 69 -15.751 9.273 3.831 1.00 0.46 H new ATOM 0 HA ILE A 69 -14.739 8.845 1.104 1.00 0.48 H new ATOM 0 HB ILE A 69 -12.836 8.324 2.500 1.00 0.56 H new ATOM 0 HG12 ILE A 69 -14.138 5.701 1.709 1.00 0.60 H new ATOM 0 HG13 ILE A 69 -13.615 6.867 0.510 1.00 0.60 H new ATOM 0 HG21 ILE A 69 -12.924 6.551 4.200 1.00 0.70 H new ATOM 0 HG22 ILE A 69 -13.962 7.932 4.626 1.00 0.70 H new ATOM 0 HG23 ILE A 69 -14.687 6.438 3.986 1.00 0.70 H new ATOM 0 HD11 ILE A 69 -11.920 5.142 0.852 1.00 0.71 H new ATOM 0 HD12 ILE A 69 -11.305 6.731 1.364 1.00 0.71 H new ATOM 0 HD13 ILE A 69 -11.836 5.547 2.582 1.00 0.71 H new ATOM 1183 N ARG A 70 -16.507 7.042 0.860 1.00 0.48 N ATOM 1184 CA ARG A 70 -17.671 6.190 0.706 1.00 0.61 C ATOM 1185 C ARG A 70 -17.461 5.116 -0.349 1.00 0.41 C ATOM 1186 O ARG A 70 -16.526 5.173 -1.153 1.00 0.34 O ATOM 1187 CB ARG A 70 -18.889 7.032 0.316 1.00 0.82 C ATOM 1188 CG ARG A 70 -19.491 7.824 1.462 1.00 1.23 C ATOM 1189 CD ARG A 70 -20.661 8.671 0.995 1.00 1.41 C ATOM 1190 NE ARG A 70 -21.452 9.168 2.118 1.00 1.74 N ATOM 1191 CZ ARG A 70 -22.452 8.490 2.681 1.00 2.19 C ATOM 1192 NH1 ARG A 70 -22.792 7.291 2.223 1.00 2.55 N ATOM 1193 NH2 ARG A 70 -23.111 9.010 3.704 1.00 2.92 N ATOM 0 H ARG A 70 -15.998 7.228 -0.004 1.00 0.48 H new ATOM 0 HA ARG A 70 -17.836 5.700 1.665 1.00 0.61 H new ATOM 0 HB2 ARG A 70 -18.600 7.723 -0.476 1.00 0.82 H new ATOM 0 HB3 ARG A 70 -19.654 6.375 -0.098 1.00 0.82 H new ATOM 0 HG2 ARG A 70 -19.823 7.141 2.243 1.00 1.23 H new ATOM 0 HG3 ARG A 70 -18.728 8.466 1.903 1.00 1.23 H new ATOM 0 HD2 ARG A 70 -20.290 9.513 0.411 1.00 1.41 H new ATOM 0 HD3 ARG A 70 -21.297 8.081 0.335 1.00 1.41 H new ATOM 0 HE ARG A 70 -21.226 10.089 2.494 1.00 1.74 H new ATOM 0 HH11 ARG A 70 -22.287 6.884 1.436 1.00 2.55 H new ATOM 0 HH12 ARG A 70 -23.558 6.777 2.658 1.00 2.55 H new ATOM 0 HH21 ARG A 70 -22.854 9.930 4.062 1.00 2.92 H new ATOM 0 HH22 ARG A 70 -23.876 8.491 4.135 1.00 2.92 H new ATOM 1207 N ILE A 71 -18.350 4.141 -0.322 1.00 0.62 N ATOM 1208 CA ILE A 71 -18.349 3.049 -1.276 1.00 0.48 C ATOM 1209 C ILE A 71 -19.750 2.932 -1.840 1.00 0.45 C ATOM 1210 O ILE A 71 -20.726 3.199 -1.134 1.00 0.58 O ATOM 1211 CB ILE A 71 -17.925 1.705 -0.644 1.00 0.56 C ATOM 1212 CG1 ILE A 71 -16.721 1.898 0.276 1.00 0.96 C ATOM 1213 CG2 ILE A 71 -17.598 0.695 -1.737 1.00 0.76 C ATOM 1214 CD1 ILE A 71 -16.268 0.630 0.967 1.00 1.09 C ATOM 0 H ILE A 71 -19.099 4.085 0.368 1.00 0.62 H new ATOM 0 HA ILE A 71 -17.619 3.267 -2.055 1.00 0.48 H new ATOM 0 HB ILE A 71 -18.754 1.325 -0.047 1.00 0.56 H new ATOM 0 HG12 ILE A 71 -15.892 2.299 -0.307 1.00 0.96 H new ATOM 0 HG13 ILE A 71 -16.969 2.643 1.032 1.00 0.96 H new ATOM 0 HG21 ILE A 71 -17.300 -0.250 -1.282 1.00 0.76 H new ATOM 0 HG22 ILE A 71 -18.478 0.536 -2.360 1.00 0.76 H new ATOM 0 HG23 ILE A 71 -16.782 1.075 -2.351 1.00 0.76 H new ATOM 0 HD11 ILE A 71 -15.410 0.849 1.602 1.00 1.09 H new ATOM 0 HD12 ILE A 71 -17.081 0.238 1.578 1.00 1.09 H new ATOM 0 HD13 ILE A 71 -15.987 -0.111 0.219 1.00 1.09 H new ATOM 1226 N LYS A 72 -19.862 2.556 -3.097 1.00 0.38 N ATOM 1227 CA LYS A 72 -21.165 2.453 -3.740 1.00 0.47 C ATOM 1228 C LYS A 72 -21.893 1.154 -3.397 1.00 0.43 C ATOM 1229 O LYS A 72 -21.519 0.077 -3.871 1.00 0.49 O ATOM 1230 CB LYS A 72 -21.016 2.588 -5.255 1.00 0.64 C ATOM 1231 CG LYS A 72 -20.500 3.948 -5.699 1.00 0.87 C ATOM 1232 CD LYS A 72 -20.591 4.111 -7.205 1.00 1.57 C ATOM 1233 CE LYS A 72 -20.242 5.525 -7.639 1.00 1.96 C ATOM 1234 NZ LYS A 72 -20.639 5.787 -9.047 1.00 2.63 N ATOM 0 H LYS A 72 -19.072 2.316 -3.696 1.00 0.38 H new ATOM 0 HA LYS A 72 -21.775 3.270 -3.355 1.00 0.47 H new ATOM 0 HB2 LYS A 72 -20.336 1.816 -5.615 1.00 0.64 H new ATOM 0 HB3 LYS A 72 -21.983 2.405 -5.724 1.00 0.64 H new ATOM 0 HG2 LYS A 72 -21.076 4.734 -5.211 1.00 0.87 H new ATOM 0 HG3 LYS A 72 -19.464 4.067 -5.381 1.00 0.87 H new ATOM 0 HD2 LYS A 72 -19.916 3.405 -7.689 1.00 1.57 H new ATOM 0 HD3 LYS A 72 -21.600 3.867 -7.537 1.00 1.57 H new ATOM 0 HE2 LYS A 72 -20.739 6.239 -6.983 1.00 1.96 H new ATOM 0 HE3 LYS A 72 -19.169 5.684 -7.529 1.00 1.96 H new ATOM 0 HZ1 LYS A 72 -20.384 6.762 -9.304 1.00 2.63 H new ATOM 0 HZ2 LYS A 72 -20.145 5.122 -9.676 1.00 2.63 H new ATOM 0 HZ3 LYS A 72 -21.666 5.660 -9.147 1.00 2.63 H new ATOM 1248 N GLY A 73 -22.933 1.272 -2.564 1.00 0.46 N ATOM 1249 CA GLY A 73 -23.741 0.121 -2.192 1.00 0.53 C ATOM 1250 C GLY A 73 -23.054 -0.842 -1.240 1.00 0.47 C ATOM 1251 O GLY A 73 -23.281 -2.051 -1.315 1.00 0.52 O ATOM 0 H GLY A 73 -23.228 2.151 -2.140 1.00 0.46 H new ATOM 0 HA2 GLY A 73 -24.664 0.473 -1.731 1.00 0.53 H new ATOM 0 HA3 GLY A 73 -24.022 -0.419 -3.096 1.00 0.53 H new ATOM 1255 N LEU A 74 -22.213 -0.326 -0.353 1.00 0.40 N ATOM 1256 CA LEU A 74 -21.487 -1.186 0.577 1.00 0.36 C ATOM 1257 C LEU A 74 -21.492 -0.635 2.005 1.00 0.34 C ATOM 1258 O LEU A 74 -21.733 0.553 2.218 1.00 0.35 O ATOM 1259 CB LEU A 74 -20.047 -1.314 0.099 1.00 0.38 C ATOM 1260 CG LEU A 74 -19.473 -2.722 0.134 1.00 0.47 C ATOM 1261 CD1 LEU A 74 -19.508 -3.345 -1.252 1.00 0.70 C ATOM 1262 CD2 LEU A 74 -18.057 -2.687 0.679 1.00 0.56 C ATOM 0 H LEU A 74 -22.017 0.670 -0.257 1.00 0.40 H new ATOM 0 HA LEU A 74 -21.986 -2.155 0.597 1.00 0.36 H new ATOM 0 HB2 LEU A 74 -19.986 -0.940 -0.923 1.00 0.38 H new ATOM 0 HB3 LEU A 74 -19.419 -0.668 0.713 1.00 0.38 H new ATOM 0 HG LEU A 74 -20.083 -3.339 0.793 1.00 0.47 H new ATOM 0 HD11 LEU A 74 -19.094 -4.352 -1.209 1.00 0.70 H new ATOM 0 HD12 LEU A 74 -20.539 -3.391 -1.604 1.00 0.70 H new ATOM 0 HD13 LEU A 74 -18.917 -2.739 -1.938 1.00 0.70 H new ATOM 0 HD21 LEU A 74 -17.651 -3.698 0.702 1.00 0.56 H new ATOM 0 HD22 LEU A 74 -17.436 -2.061 0.038 1.00 0.56 H new ATOM 0 HD23 LEU A 74 -18.066 -2.277 1.689 1.00 0.56 H new ATOM 1274 N SER A 75 -21.230 -1.513 2.981 1.00 0.33 N ATOM 1275 CA SER A 75 -21.156 -1.105 4.381 1.00 0.33 C ATOM 1276 C SER A 75 -19.691 -1.000 4.780 1.00 0.31 C ATOM 1277 O SER A 75 -18.894 -1.863 4.414 1.00 0.35 O ATOM 1278 CB SER A 75 -21.869 -2.119 5.273 1.00 0.37 C ATOM 1279 OG SER A 75 -23.092 -2.539 4.688 1.00 0.99 O ATOM 0 H SER A 75 -21.067 -2.507 2.823 1.00 0.33 H new ATOM 0 HA SER A 75 -21.647 -0.140 4.505 1.00 0.33 H new ATOM 0 HB2 SER A 75 -21.224 -2.983 5.436 1.00 0.37 H new ATOM 0 HB3 SER A 75 -22.062 -1.677 6.250 1.00 0.37 H new ATOM 0 HG SER A 75 -23.530 -3.189 5.276 1.00 0.99 H new ATOM 1285 N PHE A 76 -19.322 0.043 5.516 1.00 0.32 N ATOM 1286 CA PHE A 76 -17.931 0.223 5.911 1.00 0.31 C ATOM 1287 C PHE A 76 -17.795 0.855 7.300 1.00 0.32 C ATOM 1288 O PHE A 76 -18.776 1.328 7.875 1.00 0.38 O ATOM 1289 CB PHE A 76 -17.208 1.080 4.871 1.00 0.32 C ATOM 1290 CG PHE A 76 -18.028 2.226 4.358 1.00 0.35 C ATOM 1291 CD1 PHE A 76 -18.850 2.061 3.259 1.00 1.26 C ATOM 1292 CD2 PHE A 76 -17.977 3.466 4.971 1.00 1.24 C ATOM 1293 CE1 PHE A 76 -19.610 3.107 2.779 1.00 1.29 C ATOM 1294 CE2 PHE A 76 -18.735 4.519 4.497 1.00 1.28 C ATOM 1295 CZ PHE A 76 -19.554 4.340 3.399 1.00 0.53 C ATOM 0 H PHE A 76 -19.958 0.768 5.847 1.00 0.32 H new ATOM 0 HA PHE A 76 -17.474 -0.765 5.963 1.00 0.31 H new ATOM 0 HB2 PHE A 76 -16.289 1.470 5.310 1.00 0.32 H new ATOM 0 HB3 PHE A 76 -16.917 0.448 4.032 1.00 0.32 H new ATOM 0 HD1 PHE A 76 -18.898 1.100 2.769 1.00 1.26 H new ATOM 0 HD2 PHE A 76 -17.338 3.612 5.829 1.00 1.24 H new ATOM 0 HE1 PHE A 76 -20.248 2.962 1.920 1.00 1.29 H new ATOM 0 HE2 PHE A 76 -18.687 5.482 4.984 1.00 1.28 H new ATOM 0 HZ PHE A 76 -20.148 5.161 3.027 1.00 0.53 H new ATOM 1305 N SER A 77 -16.569 0.844 7.830 1.00 0.30 N ATOM 1306 CA SER A 77 -16.276 1.424 9.141 1.00 0.32 C ATOM 1307 C SER A 77 -14.904 2.094 9.089 1.00 0.30 C ATOM 1308 O SER A 77 -13.994 1.572 8.448 1.00 0.29 O ATOM 1309 CB SER A 77 -16.305 0.348 10.232 1.00 0.36 C ATOM 1310 OG SER A 77 -16.707 0.890 11.479 1.00 1.18 O ATOM 0 H SER A 77 -15.758 0.436 7.366 1.00 0.30 H new ATOM 0 HA SER A 77 -17.038 2.164 9.386 1.00 0.32 H new ATOM 0 HB2 SER A 77 -16.990 -0.449 9.942 1.00 0.36 H new ATOM 0 HB3 SER A 77 -15.316 -0.101 10.330 1.00 0.36 H new ATOM 0 HG SER A 77 -16.780 0.170 12.140 1.00 1.18 H new ATOM 1316 N VAL A 78 -14.743 3.223 9.774 1.00 0.32 N ATOM 1317 CA VAL A 78 -13.482 3.960 9.728 1.00 0.33 C ATOM 1318 C VAL A 78 -12.684 3.839 11.031 1.00 0.34 C ATOM 1319 O VAL A 78 -13.119 4.298 12.086 1.00 0.38 O ATOM 1320 CB VAL A 78 -13.718 5.454 9.420 1.00 0.38 C ATOM 1321 CG1 VAL A 78 -12.396 6.164 9.167 1.00 0.41 C ATOM 1322 CG2 VAL A 78 -14.648 5.618 8.228 1.00 0.40 C ATOM 0 H VAL A 78 -15.462 3.645 10.362 1.00 0.32 H new ATOM 0 HA VAL A 78 -12.899 3.508 8.926 1.00 0.33 H new ATOM 0 HB VAL A 78 -14.193 5.910 10.289 1.00 0.38 H new ATOM 0 HG11 VAL A 78 -12.583 7.216 8.952 1.00 0.41 H new ATOM 0 HG12 VAL A 78 -11.764 6.082 10.051 1.00 0.41 H new ATOM 0 HG13 VAL A 78 -11.893 5.704 8.317 1.00 0.41 H new ATOM 0 HG21 VAL A 78 -14.800 6.679 8.029 1.00 0.40 H new ATOM 0 HG22 VAL A 78 -14.204 5.144 7.352 1.00 0.40 H new ATOM 0 HG23 VAL A 78 -15.607 5.149 8.447 1.00 0.40 H new ATOM 1332 N LYS A 79 -11.524 3.207 10.940 1.00 0.32 N ATOM 1333 CA LYS A 79 -10.627 3.032 12.075 1.00 0.34 C ATOM 1334 C LYS A 79 -9.258 3.611 11.722 1.00 0.34 C ATOM 1335 O LYS A 79 -8.961 3.833 10.550 1.00 0.33 O ATOM 1336 CB LYS A 79 -10.511 1.556 12.469 1.00 0.35 C ATOM 1337 CG LYS A 79 -11.447 1.146 13.601 1.00 0.48 C ATOM 1338 CD LYS A 79 -12.908 1.165 13.166 1.00 0.69 C ATOM 1339 CE LYS A 79 -13.786 1.884 14.180 1.00 0.89 C ATOM 1340 NZ LYS A 79 -15.232 1.803 13.832 1.00 1.48 N ATOM 0 H LYS A 79 -11.175 2.798 10.073 1.00 0.32 H new ATOM 0 HA LYS A 79 -11.034 3.563 12.936 1.00 0.34 H new ATOM 0 HB2 LYS A 79 -10.720 0.939 11.595 1.00 0.35 H new ATOM 0 HB3 LYS A 79 -9.483 1.349 12.767 1.00 0.35 H new ATOM 0 HG2 LYS A 79 -11.184 0.146 13.945 1.00 0.48 H new ATOM 0 HG3 LYS A 79 -11.311 1.820 14.447 1.00 0.48 H new ATOM 0 HD2 LYS A 79 -12.993 1.657 12.197 1.00 0.69 H new ATOM 0 HD3 LYS A 79 -13.263 0.143 13.037 1.00 0.69 H new ATOM 0 HE2 LYS A 79 -13.627 1.450 15.167 1.00 0.89 H new ATOM 0 HE3 LYS A 79 -13.487 2.930 14.240 1.00 0.89 H new ATOM 0 HZ1 LYS A 79 -15.651 2.754 13.867 1.00 1.48 H new ATOM 0 HZ2 LYS A 79 -15.337 1.413 12.873 1.00 1.48 H new ATOM 0 HZ3 LYS A 79 -15.719 1.185 14.512 1.00 1.48 H new ATOM 1354 N VAL A 80 -8.438 3.875 12.719 1.00 0.38 N ATOM 1355 CA VAL A 80 -7.117 4.438 12.478 1.00 0.40 C ATOM 1356 C VAL A 80 -6.016 3.434 12.844 1.00 0.41 C ATOM 1357 O VAL A 80 -6.196 2.598 13.734 1.00 0.43 O ATOM 1358 CB VAL A 80 -6.937 5.759 13.258 1.00 0.48 C ATOM 1359 CG1 VAL A 80 -7.020 5.503 14.744 1.00 1.43 C ATOM 1360 CG2 VAL A 80 -5.635 6.453 12.888 1.00 1.30 C ATOM 0 H VAL A 80 -8.658 3.711 13.701 1.00 0.38 H new ATOM 0 HA VAL A 80 -7.031 4.656 11.413 1.00 0.40 H new ATOM 0 HB VAL A 80 -7.748 6.432 12.979 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -6.892 6.442 15.283 1.00 1.43 H new ATOM 0 HG12 VAL A 80 -7.993 5.076 14.986 1.00 1.43 H new ATOM 0 HG13 VAL A 80 -6.235 4.806 15.038 1.00 1.43 H new ATOM 0 HG21 VAL A 80 -5.542 7.379 13.456 1.00 1.30 H new ATOM 0 HG22 VAL A 80 -4.795 5.799 13.121 1.00 1.30 H new ATOM 0 HG23 VAL A 80 -5.634 6.680 11.822 1.00 1.30 H new ATOM 1370 N CYS A 81 -4.889 3.507 12.143 1.00 0.42 N ATOM 1371 CA CYS A 81 -3.772 2.606 12.387 1.00 0.46 C ATOM 1372 C CYS A 81 -2.467 3.397 12.500 1.00 0.49 C ATOM 1373 O CYS A 81 -2.043 4.064 11.554 1.00 0.45 O ATOM 1374 CB CYS A 81 -3.658 1.568 11.267 1.00 0.47 C ATOM 1375 SG CYS A 81 -2.403 0.297 11.551 1.00 0.89 S ATOM 0 H CYS A 81 -4.726 4.185 11.398 1.00 0.42 H new ATOM 0 HA CYS A 81 -3.954 2.084 13.327 1.00 0.46 H new ATOM 0 HB2 CYS A 81 -4.626 1.083 11.138 1.00 0.47 H new ATOM 0 HB3 CYS A 81 -3.432 2.082 10.333 1.00 0.47 H new ATOM 0 HG CYS A 81 -2.389 -0.531 10.549 1.00 0.89 H new ATOM 1381 N GLY A 82 -1.826 3.333 13.652 1.00 0.67 N ATOM 1382 CA GLY A 82 -0.591 4.061 13.826 1.00 0.76 C ATOM 1383 C GLY A 82 -0.810 5.557 13.767 1.00 0.76 C ATOM 1384 O GLY A 82 -1.786 6.073 14.316 1.00 0.88 O ATOM 0 H GLY A 82 -2.134 2.796 14.463 1.00 0.67 H new ATOM 0 HA2 GLY A 82 -0.144 3.796 14.784 1.00 0.76 H new ATOM 0 HA3 GLY A 82 0.117 3.766 13.052 1.00 0.76 H new ATOM 1388 N GLU A 83 0.111 6.254 13.130 1.00 0.76 N ATOM 1389 CA GLU A 83 0.022 7.700 12.996 1.00 0.82 C ATOM 1390 C GLU A 83 -0.457 8.124 11.608 1.00 0.69 C ATOM 1391 O GLU A 83 -1.158 9.128 11.464 1.00 0.89 O ATOM 1392 CB GLU A 83 1.378 8.335 13.273 1.00 1.01 C ATOM 1393 CG GLU A 83 1.994 7.911 14.591 1.00 1.35 C ATOM 1394 CD GLU A 83 3.439 8.338 14.702 1.00 1.90 C ATOM 1395 OE1 GLU A 83 3.688 9.516 15.033 1.00 2.46 O ATOM 1396 OE2 GLU A 83 4.329 7.500 14.438 1.00 2.50 O ATOM 0 H GLU A 83 0.936 5.841 12.694 1.00 0.76 H new ATOM 0 HA GLU A 83 -0.712 8.044 13.725 1.00 0.82 H new ATOM 0 HB2 GLU A 83 2.061 8.078 12.464 1.00 1.01 H new ATOM 0 HB3 GLU A 83 1.269 9.420 13.266 1.00 1.01 H new ATOM 0 HG2 GLU A 83 1.424 8.343 15.414 1.00 1.35 H new ATOM 0 HG3 GLU A 83 1.927 6.828 14.691 1.00 1.35 H new ATOM 1403 N ARG A 84 -0.057 7.378 10.583 1.00 0.58 N ATOM 1404 CA ARG A 84 -0.411 7.722 9.205 1.00 0.72 C ATOM 1405 C ARG A 84 -1.284 6.669 8.529 1.00 0.64 C ATOM 1406 O ARG A 84 -1.822 6.911 7.451 1.00 0.81 O ATOM 1407 CB ARG A 84 0.862 7.910 8.376 1.00 0.98 C ATOM 1408 CG ARG A 84 1.858 8.895 8.970 1.00 1.09 C ATOM 1409 CD ARG A 84 1.424 10.336 8.754 1.00 1.37 C ATOM 1410 NE ARG A 84 0.506 10.798 9.794 1.00 1.46 N ATOM 1411 CZ ARG A 84 0.614 11.970 10.419 1.00 2.05 C ATOM 1412 NH1 ARG A 84 1.589 12.816 10.099 1.00 2.51 N ATOM 1413 NH2 ARG A 84 -0.257 12.297 11.366 1.00 2.36 N ATOM 0 H ARG A 84 0.510 6.535 10.677 1.00 0.58 H new ATOM 0 HA ARG A 84 -0.988 8.645 9.255 1.00 0.72 H new ATOM 0 HB2 ARG A 84 1.351 6.943 8.259 1.00 0.98 H new ATOM 0 HB3 ARG A 84 0.585 8.250 7.378 1.00 0.98 H new ATOM 0 HG2 ARG A 84 1.966 8.704 10.038 1.00 1.09 H new ATOM 0 HG3 ARG A 84 2.837 8.739 8.518 1.00 1.09 H new ATOM 0 HD2 ARG A 84 2.303 10.980 8.736 1.00 1.37 H new ATOM 0 HD3 ARG A 84 0.943 10.427 7.780 1.00 1.37 H new ATOM 0 HE ARG A 84 -0.265 10.185 10.058 1.00 1.46 H new ATOM 0 HH11 ARG A 84 2.260 12.569 9.371 1.00 2.51 H new ATOM 0 HH12 ARG A 84 1.666 13.711 10.581 1.00 2.51 H new ATOM 0 HH21 ARG A 84 -1.007 11.652 11.614 1.00 2.36 H new ATOM 0 HH22 ARG A 84 -0.176 13.194 11.846 1.00 2.36 H new ATOM 1427 N LYS A 85 -1.434 5.511 9.145 1.00 0.46 N ATOM 1428 CA LYS A 85 -2.221 4.437 8.550 1.00 0.41 C ATOM 1429 C LYS A 85 -3.675 4.485 9.011 1.00 0.38 C ATOM 1430 O LYS A 85 -4.001 5.071 10.044 1.00 0.39 O ATOM 1431 CB LYS A 85 -1.597 3.067 8.826 1.00 0.42 C ATOM 1432 CG LYS A 85 -0.202 2.910 8.231 1.00 0.55 C ATOM 1433 CD LYS A 85 0.232 1.454 8.169 1.00 0.88 C ATOM 1434 CE LYS A 85 0.471 0.870 9.550 1.00 1.17 C ATOM 1435 NZ LYS A 85 1.270 -0.377 9.481 1.00 1.22 N ATOM 0 H LYS A 85 -1.025 5.287 10.052 1.00 0.46 H new ATOM 0 HA LYS A 85 -2.214 4.591 7.471 1.00 0.41 H new ATOM 0 HB2 LYS A 85 -1.545 2.909 9.903 1.00 0.42 H new ATOM 0 HB3 LYS A 85 -2.247 2.291 8.421 1.00 0.42 H new ATOM 0 HG2 LYS A 85 -0.186 3.336 7.228 1.00 0.55 H new ATOM 0 HG3 LYS A 85 0.513 3.476 8.829 1.00 0.55 H new ATOM 0 HD2 LYS A 85 -0.532 0.870 7.656 1.00 0.88 H new ATOM 0 HD3 LYS A 85 1.145 1.373 7.579 1.00 0.88 H new ATOM 0 HE2 LYS A 85 0.989 1.601 10.171 1.00 1.17 H new ATOM 0 HE3 LYS A 85 -0.486 0.664 10.030 1.00 1.17 H new ATOM 0 HZ1 LYS A 85 1.415 -0.750 10.441 1.00 1.22 H new ATOM 0 HZ2 LYS A 85 0.764 -1.082 8.908 1.00 1.22 H new ATOM 0 HZ3 LYS A 85 2.192 -0.175 9.045 1.00 1.22 H new ATOM 1449 N CYS A 86 -4.551 3.934 8.194 1.00 0.36 N ATOM 1450 CA CYS A 86 -5.965 3.904 8.511 1.00 0.34 C ATOM 1451 C CYS A 86 -6.513 2.510 8.243 1.00 0.32 C ATOM 1452 O CYS A 86 -5.972 1.772 7.422 1.00 0.32 O ATOM 1453 CB CYS A 86 -6.731 4.962 7.717 1.00 0.38 C ATOM 1454 SG CYS A 86 -6.278 6.664 8.131 1.00 1.14 S ATOM 0 H CYS A 86 -4.308 3.500 7.304 1.00 0.36 H new ATOM 0 HA CYS A 86 -6.097 4.139 9.567 1.00 0.34 H new ATOM 0 HB2 CYS A 86 -6.558 4.799 6.653 1.00 0.38 H new ATOM 0 HB3 CYS A 86 -7.799 4.829 7.890 1.00 0.38 H new ATOM 0 HG CYS A 86 -5.276 6.657 8.959 1.00 1.14 H new ATOM 1460 N VAL A 87 -7.582 2.152 8.933 1.00 0.32 N ATOM 1461 CA VAL A 87 -8.187 0.838 8.777 1.00 0.34 C ATOM 1462 C VAL A 87 -9.649 0.993 8.392 1.00 0.32 C ATOM 1463 O VAL A 87 -10.348 1.856 8.919 1.00 0.36 O ATOM 1464 CB VAL A 87 -8.107 0.000 10.075 1.00 0.40 C ATOM 1465 CG1 VAL A 87 -8.610 -1.416 9.842 1.00 0.80 C ATOM 1466 CG2 VAL A 87 -6.692 -0.025 10.626 1.00 0.95 C ATOM 0 H VAL A 87 -8.051 2.754 9.609 1.00 0.32 H new ATOM 0 HA VAL A 87 -7.631 0.317 7.998 1.00 0.34 H new ATOM 0 HB VAL A 87 -8.752 0.476 10.814 1.00 0.40 H new ATOM 0 HG11 VAL A 87 -8.543 -1.983 10.770 1.00 0.80 H new ATOM 0 HG12 VAL A 87 -9.648 -1.384 9.511 1.00 0.80 H new ATOM 0 HG13 VAL A 87 -8.000 -1.898 9.078 1.00 0.80 H new ATOM 0 HG21 VAL A 87 -6.667 -0.621 11.538 1.00 0.95 H new ATOM 0 HG22 VAL A 87 -6.022 -0.464 9.887 1.00 0.95 H new ATOM 0 HG23 VAL A 87 -6.370 0.992 10.849 1.00 0.95 H new ATOM 1476 N LEU A 88 -10.107 0.176 7.470 1.00 0.30 N ATOM 1477 CA LEU A 88 -11.486 0.224 7.039 1.00 0.31 C ATOM 1478 C LEU A 88 -12.101 -1.152 7.165 1.00 0.30 C ATOM 1479 O LEU A 88 -11.441 -2.159 6.937 1.00 0.33 O ATOM 1480 CB LEU A 88 -11.580 0.694 5.587 1.00 0.33 C ATOM 1481 CG LEU A 88 -12.449 1.926 5.339 1.00 0.43 C ATOM 1482 CD1 LEU A 88 -12.151 2.518 3.974 1.00 0.89 C ATOM 1483 CD2 LEU A 88 -13.917 1.571 5.437 1.00 0.48 C ATOM 0 H LEU A 88 -9.542 -0.533 7.002 1.00 0.30 H new ATOM 0 HA LEU A 88 -12.026 0.930 7.670 1.00 0.31 H new ATOM 0 HB2 LEU A 88 -10.573 0.906 5.228 1.00 0.33 H new ATOM 0 HB3 LEU A 88 -11.967 -0.127 4.984 1.00 0.33 H new ATOM 0 HG LEU A 88 -12.216 2.666 6.104 1.00 0.43 H new ATOM 0 HD11 LEU A 88 -12.778 3.395 3.813 1.00 0.89 H new ATOM 0 HD12 LEU A 88 -11.102 2.809 3.925 1.00 0.89 H new ATOM 0 HD13 LEU A 88 -12.359 1.776 3.203 1.00 0.89 H new ATOM 0 HD21 LEU A 88 -14.519 2.461 5.257 1.00 0.48 H new ATOM 0 HD22 LEU A 88 -14.159 0.813 4.692 1.00 0.48 H new ATOM 0 HD23 LEU A 88 -14.132 1.182 6.433 1.00 0.48 H new ATOM 1495 N PHE A 89 -13.349 -1.204 7.550 1.00 0.30 N ATOM 1496 CA PHE A 89 -14.047 -2.463 7.662 1.00 0.31 C ATOM 1497 C PHE A 89 -15.122 -2.460 6.604 1.00 0.30 C ATOM 1498 O PHE A 89 -15.751 -1.438 6.386 1.00 0.30 O ATOM 1499 CB PHE A 89 -14.652 -2.638 9.053 1.00 0.34 C ATOM 1500 CG PHE A 89 -13.640 -2.992 10.105 1.00 0.89 C ATOM 1501 CD1 PHE A 89 -12.765 -2.035 10.592 1.00 1.75 C ATOM 1502 CD2 PHE A 89 -13.562 -4.282 10.602 1.00 1.75 C ATOM 1503 CE1 PHE A 89 -11.831 -2.358 11.557 1.00 2.42 C ATOM 1504 CE2 PHE A 89 -12.631 -4.610 11.568 1.00 2.40 C ATOM 1505 CZ PHE A 89 -11.764 -3.648 12.046 1.00 2.50 C ATOM 0 H PHE A 89 -13.908 -0.386 7.793 1.00 0.30 H new ATOM 0 HA PHE A 89 -13.360 -3.297 7.517 1.00 0.31 H new ATOM 0 HB2 PHE A 89 -15.156 -1.715 9.340 1.00 0.34 H new ATOM 0 HB3 PHE A 89 -15.413 -3.418 9.015 1.00 0.34 H new ATOM 0 HD1 PHE A 89 -12.814 -1.025 10.213 1.00 1.75 H new ATOM 0 HD2 PHE A 89 -14.236 -5.040 10.230 1.00 1.75 H new ATOM 0 HE1 PHE A 89 -11.154 -1.603 11.929 1.00 2.42 H new ATOM 0 HE2 PHE A 89 -12.581 -5.619 11.949 1.00 2.40 H new ATOM 0 HZ PHE A 89 -11.035 -3.904 12.801 1.00 2.50 H new ATOM 1515 N ILE A 90 -15.324 -3.569 5.935 1.00 0.30 N ATOM 1516 CA ILE A 90 -16.326 -3.619 4.881 1.00 0.31 C ATOM 1517 C ILE A 90 -17.250 -4.799 5.076 1.00 0.31 C ATOM 1518 O ILE A 90 -16.806 -5.895 5.400 1.00 0.33 O ATOM 1519 CB ILE A 90 -15.673 -3.681 3.489 1.00 0.32 C ATOM 1520 CG1 ILE A 90 -14.348 -4.449 3.565 1.00 0.39 C ATOM 1521 CG2 ILE A 90 -15.452 -2.270 2.954 1.00 0.37 C ATOM 1522 CD1 ILE A 90 -13.653 -4.625 2.233 1.00 0.48 C ATOM 0 H ILE A 90 -14.819 -4.441 6.093 1.00 0.30 H new ATOM 0 HA ILE A 90 -16.911 -2.701 4.941 1.00 0.31 H new ATOM 0 HB ILE A 90 -16.337 -4.208 2.804 1.00 0.32 H new ATOM 0 HG12 ILE A 90 -13.677 -3.925 4.245 1.00 0.39 H new ATOM 0 HG13 ILE A 90 -14.536 -5.432 3.996 1.00 0.39 H new ATOM 0 HG21 ILE A 90 -14.989 -2.323 1.968 1.00 0.37 H new ATOM 0 HG22 ILE A 90 -16.410 -1.755 2.878 1.00 0.37 H new ATOM 0 HG23 ILE A 90 -14.798 -1.722 3.633 1.00 0.37 H new ATOM 0 HD11 ILE A 90 -12.725 -5.178 2.377 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -14.303 -5.177 1.554 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -13.430 -3.647 1.807 1.00 0.48 H new ATOM 1534 N GLU A 91 -18.539 -4.572 4.895 1.00 0.31 N ATOM 1535 CA GLU A 91 -19.528 -5.622 5.089 1.00 0.34 C ATOM 1536 C GLU A 91 -20.518 -5.674 3.940 1.00 0.38 C ATOM 1537 O GLU A 91 -20.988 -4.628 3.453 1.00 0.41 O ATOM 1538 CB GLU A 91 -20.290 -5.399 6.393 1.00 0.39 C ATOM 1539 CG GLU A 91 -19.484 -4.673 7.454 1.00 1.34 C ATOM 1540 CD GLU A 91 -20.339 -4.197 8.607 1.00 1.32 C ATOM 1541 OE1 GLU A 91 -21.222 -3.345 8.382 1.00 1.74 O ATOM 1542 OE2 GLU A 91 -20.137 -4.679 9.740 1.00 1.72 O ATOM 0 H GLU A 91 -18.927 -3.671 4.614 1.00 0.31 H new ATOM 0 HA GLU A 91 -18.991 -6.570 5.130 1.00 0.34 H new ATOM 0 HB2 GLU A 91 -21.194 -4.828 6.182 1.00 0.39 H new ATOM 0 HB3 GLU A 91 -20.607 -6.364 6.788 1.00 0.39 H new ATOM 0 HG2 GLU A 91 -18.707 -5.337 7.832 1.00 1.34 H new ATOM 0 HG3 GLU A 91 -18.981 -3.818 7.002 1.00 1.34 H new ATOM 1549 N TRP A 92 -20.813 -6.898 3.507 1.00 0.41 N ATOM 1550 CA TRP A 92 -21.757 -7.135 2.422 1.00 0.51 C ATOM 1551 C TRP A 92 -22.139 -8.609 2.362 1.00 0.52 C ATOM 1552 O TRP A 92 -21.359 -9.465 2.782 1.00 0.50 O ATOM 1553 CB TRP A 92 -21.203 -6.665 1.074 1.00 0.66 C ATOM 1554 CG TRP A 92 -19.732 -6.882 0.906 1.00 0.82 C ATOM 1555 CD1 TRP A 92 -18.751 -5.944 1.005 1.00 1.79 C ATOM 1556 CD2 TRP A 92 -19.079 -8.113 0.608 1.00 0.89 C ATOM 1557 NE1 TRP A 92 -17.526 -6.516 0.778 1.00 1.87 N ATOM 1558 CE2 TRP A 92 -17.703 -7.848 0.535 1.00 1.04 C ATOM 1559 CE3 TRP A 92 -19.525 -9.414 0.399 1.00 1.87 C ATOM 1560 CZ2 TRP A 92 -16.773 -8.838 0.256 1.00 1.14 C ATOM 1561 CZ3 TRP A 92 -18.604 -10.396 0.126 1.00 2.35 C ATOM 1562 CH2 TRP A 92 -17.241 -10.106 0.052 1.00 1.76 C ATOM 0 H TRP A 92 -20.406 -7.748 3.897 1.00 0.41 H new ATOM 0 HA TRP A 92 -22.652 -6.548 2.629 1.00 0.51 H new ATOM 0 HB2 TRP A 92 -21.730 -7.188 0.275 1.00 0.66 H new ATOM 0 HB3 TRP A 92 -21.418 -5.603 0.956 1.00 0.66 H new ATOM 0 HD1 TRP A 92 -18.914 -4.900 1.230 1.00 1.79 H new ATOM 0 HE1 TRP A 92 -16.631 -6.028 0.789 1.00 1.87 H new ATOM 0 HE3 TRP A 92 -20.578 -9.648 0.451 1.00 1.87 H new ATOM 0 HZ2 TRP A 92 -15.718 -8.615 0.202 1.00 1.14 H new ATOM 0 HZ3 TRP A 92 -18.940 -11.410 -0.034 1.00 2.35 H new ATOM 0 HH2 TRP A 92 -16.542 -10.899 -0.171 1.00 1.76 H new ATOM 1573 N GLU A 93 -23.366 -8.885 1.924 1.00 0.61 N ATOM 1574 CA GLU A 93 -23.867 -10.255 1.786 1.00 0.67 C ATOM 1575 C GLU A 93 -23.857 -10.982 3.124 1.00 0.61 C ATOM 1576 O GLU A 93 -23.522 -12.168 3.200 1.00 0.64 O ATOM 1577 CB GLU A 93 -23.035 -11.031 0.765 1.00 0.74 C ATOM 1578 CG GLU A 93 -22.988 -10.385 -0.608 1.00 0.88 C ATOM 1579 CD GLU A 93 -22.702 -11.386 -1.707 1.00 1.08 C ATOM 1580 OE1 GLU A 93 -21.562 -11.892 -1.784 1.00 1.63 O ATOM 1581 OE2 GLU A 93 -23.628 -11.686 -2.492 1.00 1.58 O ATOM 0 H GLU A 93 -24.041 -8.169 1.655 1.00 0.61 H new ATOM 0 HA GLU A 93 -24.897 -10.197 1.434 1.00 0.67 H new ATOM 0 HB2 GLU A 93 -22.018 -11.134 1.143 1.00 0.74 H new ATOM 0 HB3 GLU A 93 -23.442 -12.037 0.669 1.00 0.74 H new ATOM 0 HG2 GLU A 93 -23.940 -9.892 -0.808 1.00 0.88 H new ATOM 0 HG3 GLU A 93 -22.221 -9.611 -0.616 1.00 0.88 H new ATOM 1588 N LYS A 94 -24.233 -10.257 4.172 1.00 0.59 N ATOM 1589 CA LYS A 94 -24.272 -10.794 5.527 1.00 0.61 C ATOM 1590 C LYS A 94 -22.878 -11.230 5.979 1.00 0.55 C ATOM 1591 O LYS A 94 -22.731 -12.151 6.789 1.00 0.63 O ATOM 1592 CB LYS A 94 -25.252 -11.969 5.629 1.00 0.71 C ATOM 1593 CG LYS A 94 -26.711 -11.597 5.378 1.00 0.85 C ATOM 1594 CD LYS A 94 -27.205 -10.506 6.322 1.00 0.93 C ATOM 1595 CE LYS A 94 -26.795 -10.760 7.766 1.00 1.23 C ATOM 1596 NZ LYS A 94 -27.348 -12.037 8.291 1.00 1.79 N ATOM 0 H LYS A 94 -24.519 -9.280 4.106 1.00 0.59 H new ATOM 0 HA LYS A 94 -24.620 -9.999 6.187 1.00 0.61 H new ATOM 0 HB2 LYS A 94 -24.957 -12.736 4.913 1.00 0.71 H new ATOM 0 HB3 LYS A 94 -25.168 -12.411 6.622 1.00 0.71 H new ATOM 0 HG2 LYS A 94 -26.825 -11.261 4.347 1.00 0.85 H new ATOM 0 HG3 LYS A 94 -27.334 -12.484 5.495 1.00 0.85 H new ATOM 0 HD2 LYS A 94 -26.810 -9.543 5.999 1.00 0.93 H new ATOM 0 HD3 LYS A 94 -28.291 -10.441 6.261 1.00 0.93 H new ATOM 0 HE2 LYS A 94 -25.707 -10.782 7.835 1.00 1.23 H new ATOM 0 HE3 LYS A 94 -27.137 -9.934 8.390 1.00 1.23 H new ATOM 0 HZ1 LYS A 94 -27.533 -11.942 9.310 1.00 1.79 H new ATOM 0 HZ2 LYS A 94 -28.236 -12.260 7.797 1.00 1.79 H new ATOM 0 HZ3 LYS A 94 -26.662 -12.803 8.133 1.00 1.79 H new ATOM 1610 N LYS A 95 -21.858 -10.571 5.442 1.00 0.47 N ATOM 1611 CA LYS A 95 -20.482 -10.878 5.790 1.00 0.46 C ATOM 1612 C LYS A 95 -19.714 -9.597 6.099 1.00 0.42 C ATOM 1613 O LYS A 95 -20.103 -8.515 5.672 1.00 0.42 O ATOM 1614 CB LYS A 95 -19.805 -11.651 4.658 1.00 0.52 C ATOM 1615 CG LYS A 95 -19.016 -12.870 5.122 1.00 0.63 C ATOM 1616 CD LYS A 95 -19.868 -13.840 5.935 1.00 0.77 C ATOM 1617 CE LYS A 95 -21.022 -14.411 5.125 1.00 0.94 C ATOM 1618 NZ LYS A 95 -22.035 -15.064 5.995 1.00 1.29 N ATOM 0 H LYS A 95 -21.962 -9.818 4.762 1.00 0.47 H new ATOM 0 HA LYS A 95 -20.481 -11.504 6.682 1.00 0.46 H new ATOM 0 HB2 LYS A 95 -20.566 -11.973 3.947 1.00 0.52 H new ATOM 0 HB3 LYS A 95 -19.134 -10.979 4.124 1.00 0.52 H new ATOM 0 HG2 LYS A 95 -18.609 -13.388 4.254 1.00 0.63 H new ATOM 0 HG3 LYS A 95 -18.168 -12.543 5.724 1.00 0.63 H new ATOM 0 HD2 LYS A 95 -19.242 -14.656 6.296 1.00 0.77 H new ATOM 0 HD3 LYS A 95 -20.261 -13.327 6.813 1.00 0.77 H new ATOM 0 HE2 LYS A 95 -21.494 -13.613 4.552 1.00 0.94 H new ATOM 0 HE3 LYS A 95 -20.639 -15.135 4.406 1.00 0.94 H new ATOM 0 HZ1 LYS A 95 -22.684 -15.627 5.409 1.00 1.29 H new ATOM 0 HZ2 LYS A 95 -21.557 -15.686 6.678 1.00 1.29 H new ATOM 0 HZ3 LYS A 95 -22.573 -14.336 6.507 1.00 1.29 H new ATOM 1632 N THR A 96 -18.620 -9.739 6.829 1.00 0.43 N ATOM 1633 CA THR A 96 -17.792 -8.609 7.243 1.00 0.41 C ATOM 1634 C THR A 96 -16.308 -8.899 6.997 1.00 0.40 C ATOM 1635 O THR A 96 -15.847 -10.017 7.231 1.00 0.45 O ATOM 1636 CB THR A 96 -17.988 -8.305 8.744 1.00 0.45 C ATOM 1637 OG1 THR A 96 -17.619 -9.450 9.526 1.00 0.73 O ATOM 1638 CG2 THR A 96 -19.430 -7.934 9.055 1.00 0.55 C ATOM 0 H THR A 96 -18.277 -10.643 7.154 1.00 0.43 H new ATOM 0 HA THR A 96 -18.101 -7.748 6.650 1.00 0.41 H new ATOM 0 HB THR A 96 -17.351 -7.457 8.995 1.00 0.45 H new ATOM 0 HG1 THR A 96 -17.744 -9.250 10.477 1.00 0.73 H new ATOM 0 HG21 THR A 96 -19.531 -7.727 10.120 1.00 0.55 H new ATOM 0 HG22 THR A 96 -19.709 -7.048 8.485 1.00 0.55 H new ATOM 0 HG23 THR A 96 -20.085 -8.761 8.783 1.00 0.55 H new ATOM 1646 N TYR A 97 -15.568 -7.893 6.530 1.00 0.38 N ATOM 1647 CA TYR A 97 -14.139 -8.043 6.247 1.00 0.40 C ATOM 1648 C TYR A 97 -13.339 -6.849 6.741 1.00 0.35 C ATOM 1649 O TYR A 97 -13.894 -5.778 7.022 1.00 0.33 O ATOM 1650 CB TYR A 97 -13.888 -8.219 4.749 1.00 0.47 C ATOM 1651 CG TYR A 97 -14.694 -9.331 4.132 1.00 0.56 C ATOM 1652 CD1 TYR A 97 -16.028 -9.143 3.807 1.00 1.37 C ATOM 1653 CD2 TYR A 97 -14.127 -10.574 3.897 1.00 1.37 C ATOM 1654 CE1 TYR A 97 -16.778 -10.158 3.270 1.00 1.54 C ATOM 1655 CE2 TYR A 97 -14.869 -11.600 3.350 1.00 1.54 C ATOM 1656 CZ TYR A 97 -16.196 -11.388 3.036 1.00 1.13 C ATOM 1657 OH TYR A 97 -16.940 -12.410 2.491 1.00 1.45 O ATOM 0 H TYR A 97 -15.936 -6.961 6.339 1.00 0.38 H new ATOM 0 HA TYR A 97 -13.810 -8.935 6.780 1.00 0.40 H new ATOM 0 HB2 TYR A 97 -14.121 -7.285 4.237 1.00 0.47 H new ATOM 0 HB3 TYR A 97 -12.828 -8.416 4.587 1.00 0.47 H new ATOM 0 HD1 TYR A 97 -16.485 -8.180 3.980 1.00 1.37 H new ATOM 0 HD2 TYR A 97 -13.089 -10.741 4.146 1.00 1.37 H new ATOM 0 HE1 TYR A 97 -17.819 -9.996 3.031 1.00 1.54 H new ATOM 0 HE2 TYR A 97 -14.415 -12.563 3.169 1.00 1.54 H new ATOM 0 HH TYR A 97 -16.589 -12.633 1.603 1.00 1.45 H new ATOM 1667 N GLN A 98 -12.027 -7.041 6.806 1.00 0.37 N ATOM 1668 CA GLN A 98 -11.107 -6.013 7.274 1.00 0.34 C ATOM 1669 C GLN A 98 -10.194 -5.551 6.148 1.00 0.31 C ATOM 1670 O GLN A 98 -9.596 -6.372 5.435 1.00 0.31 O ATOM 1671 CB GLN A 98 -10.249 -6.540 8.423 1.00 0.40 C ATOM 1672 CG GLN A 98 -11.047 -7.048 9.611 1.00 0.80 C ATOM 1673 CD GLN A 98 -10.160 -7.561 10.730 1.00 1.21 C ATOM 1674 OE1 GLN A 98 -10.504 -7.461 11.907 1.00 1.83 O ATOM 1675 NE2 GLN A 98 -9.016 -8.127 10.371 1.00 1.84 N ATOM 0 H GLN A 98 -11.572 -7.913 6.536 1.00 0.37 H new ATOM 0 HA GLN A 98 -11.705 -5.171 7.623 1.00 0.34 H new ATOM 0 HB2 GLN A 98 -9.619 -7.347 8.051 1.00 0.40 H new ATOM 0 HB3 GLN A 98 -9.583 -5.745 8.759 1.00 0.40 H new ATOM 0 HG2 GLN A 98 -11.678 -6.245 9.991 1.00 0.80 H new ATOM 0 HG3 GLN A 98 -11.712 -7.847 9.283 1.00 0.80 H new ATOM 0 HE21 GLN A 98 -8.766 -8.191 9.384 1.00 1.84 H new ATOM 0 HE22 GLN A 98 -8.386 -8.499 11.082 1.00 1.84 H new ATOM 1684 N LEU A 99 -10.072 -4.244 6.010 1.00 0.29 N ATOM 1685 CA LEU A 99 -9.242 -3.660 4.989 1.00 0.28 C ATOM 1686 C LEU A 99 -8.271 -2.657 5.574 1.00 0.26 C ATOM 1687 O LEU A 99 -8.610 -1.898 6.480 1.00 0.28 O ATOM 1688 CB LEU A 99 -10.080 -2.968 3.949 1.00 0.31 C ATOM 1689 CG LEU A 99 -9.249 -2.365 2.833 1.00 0.37 C ATOM 1690 CD1 LEU A 99 -9.413 -3.168 1.566 1.00 0.46 C ATOM 1691 CD2 LEU A 99 -9.602 -0.912 2.635 1.00 0.48 C ATOM 0 H LEU A 99 -10.547 -3.564 6.604 1.00 0.29 H new ATOM 0 HA LEU A 99 -8.683 -4.475 4.529 1.00 0.28 H new ATOM 0 HB2 LEU A 99 -10.787 -3.681 3.525 1.00 0.31 H new ATOM 0 HB3 LEU A 99 -10.666 -2.182 4.425 1.00 0.31 H new ATOM 0 HG LEU A 99 -8.196 -2.405 3.111 1.00 0.37 H new ATOM 0 HD11 LEU A 99 -8.811 -2.724 0.773 1.00 0.46 H new ATOM 0 HD12 LEU A 99 -9.085 -4.193 1.740 1.00 0.46 H new ATOM 0 HD13 LEU A 99 -10.462 -3.168 1.268 1.00 0.46 H new ATOM 0 HD21 LEU A 99 -8.995 -0.497 1.830 1.00 0.48 H new ATOM 0 HD22 LEU A 99 -10.657 -0.826 2.376 1.00 0.48 H new ATOM 0 HD23 LEU A 99 -9.409 -0.362 3.556 1.00 0.48 H new ATOM 1703 N ASP A 100 -7.072 -2.659 5.042 1.00 0.25 N ATOM 1704 CA ASP A 100 -6.037 -1.736 5.482 1.00 0.26 C ATOM 1705 C ASP A 100 -5.800 -0.704 4.406 1.00 0.25 C ATOM 1706 O ASP A 100 -5.538 -1.058 3.260 1.00 0.26 O ATOM 1707 CB ASP A 100 -4.734 -2.480 5.738 1.00 0.32 C ATOM 1708 CG ASP A 100 -4.376 -2.625 7.199 1.00 0.41 C ATOM 1709 OD1 ASP A 100 -4.810 -1.801 8.014 1.00 0.74 O ATOM 1710 OD2 ASP A 100 -3.635 -3.598 7.520 1.00 0.43 O ATOM 0 H ASP A 100 -6.781 -3.293 4.297 1.00 0.25 H new ATOM 0 HA ASP A 100 -6.366 -1.257 6.404 1.00 0.26 H new ATOM 0 HB2 ASP A 100 -4.803 -3.473 5.293 1.00 0.32 H new ATOM 0 HB3 ASP A 100 -3.925 -1.957 5.228 1.00 0.32 H new ATOM 1715 N LEU A 101 -5.892 0.561 4.750 1.00 0.25 N ATOM 1716 CA LEU A 101 -5.671 1.601 3.770 1.00 0.25 C ATOM 1717 C LEU A 101 -4.502 2.489 4.190 1.00 0.25 C ATOM 1718 O LEU A 101 -4.443 2.979 5.323 1.00 0.27 O ATOM 1719 CB LEU A 101 -6.950 2.422 3.559 1.00 0.28 C ATOM 1720 CG LEU A 101 -7.250 3.471 4.626 1.00 0.34 C ATOM 1721 CD1 LEU A 101 -6.999 4.870 4.082 1.00 0.33 C ATOM 1722 CD2 LEU A 101 -8.681 3.336 5.117 1.00 0.51 C ATOM 0 H LEU A 101 -6.115 0.892 5.689 1.00 0.25 H new ATOM 0 HA LEU A 101 -5.413 1.137 2.818 1.00 0.25 H new ATOM 0 HB2 LEU A 101 -6.882 2.923 2.593 1.00 0.28 H new ATOM 0 HB3 LEU A 101 -7.795 1.735 3.504 1.00 0.28 H new ATOM 0 HG LEU A 101 -6.581 3.306 5.471 1.00 0.34 H new ATOM 0 HD11 LEU A 101 -7.218 5.606 4.856 1.00 0.33 H new ATOM 0 HD12 LEU A 101 -5.956 4.961 3.779 1.00 0.33 H new ATOM 0 HD13 LEU A 101 -7.643 5.047 3.221 1.00 0.33 H new ATOM 0 HD21 LEU A 101 -8.878 4.092 5.877 1.00 0.51 H new ATOM 0 HD22 LEU A 101 -9.367 3.475 4.281 1.00 0.51 H new ATOM 0 HD23 LEU A 101 -8.827 2.344 5.545 1.00 0.51 H new ATOM 1734 N PHE A 102 -3.548 2.660 3.289 1.00 0.24 N ATOM 1735 CA PHE A 102 -2.387 3.486 3.559 1.00 0.25 C ATOM 1736 C PHE A 102 -2.288 4.585 2.522 1.00 0.24 C ATOM 1737 O PHE A 102 -2.463 4.333 1.332 1.00 0.24 O ATOM 1738 CB PHE A 102 -1.112 2.648 3.528 1.00 0.28 C ATOM 1739 CG PHE A 102 -1.312 1.219 3.939 1.00 0.39 C ATOM 1740 CD1 PHE A 102 -1.515 0.888 5.266 1.00 1.29 C ATOM 1741 CD2 PHE A 102 -1.296 0.211 2.991 1.00 1.27 C ATOM 1742 CE1 PHE A 102 -1.698 -0.429 5.643 1.00 1.40 C ATOM 1743 CE2 PHE A 102 -1.480 -1.103 3.359 1.00 1.36 C ATOM 1744 CZ PHE A 102 -1.680 -1.424 4.687 1.00 0.81 C ATOM 0 H PHE A 102 -3.557 2.235 2.362 1.00 0.24 H new ATOM 0 HA PHE A 102 -2.499 3.923 4.551 1.00 0.25 H new ATOM 0 HB2 PHE A 102 -0.699 2.671 2.520 1.00 0.28 H new ATOM 0 HB3 PHE A 102 -0.373 3.105 4.186 1.00 0.28 H new ATOM 0 HD1 PHE A 102 -1.531 1.666 6.015 1.00 1.29 H new ATOM 0 HD2 PHE A 102 -1.138 0.458 1.952 1.00 1.27 H new ATOM 0 HE1 PHE A 102 -1.855 -0.679 6.682 1.00 1.40 H new ATOM 0 HE2 PHE A 102 -1.468 -1.881 2.610 1.00 1.36 H new ATOM 0 HZ PHE A 102 -1.822 -2.454 4.978 1.00 0.81 H new ATOM 1754 N THR A 103 -2.007 5.792 2.963 1.00 0.25 N ATOM 1755 CA THR A 103 -1.889 6.914 2.059 1.00 0.25 C ATOM 1756 C THR A 103 -0.424 7.279 1.828 1.00 0.25 C ATOM 1757 O THR A 103 0.324 7.533 2.775 1.00 0.28 O ATOM 1758 CB THR A 103 -2.663 8.127 2.602 1.00 0.29 C ATOM 1759 OG1 THR A 103 -2.894 7.965 4.011 1.00 0.37 O ATOM 1760 CG2 THR A 103 -3.995 8.285 1.882 1.00 0.38 C ATOM 0 H THR A 103 -1.856 6.021 3.945 1.00 0.25 H new ATOM 0 HA THR A 103 -2.322 6.623 1.102 1.00 0.25 H new ATOM 0 HB THR A 103 -2.066 9.022 2.429 1.00 0.29 H new ATOM 0 HG1 THR A 103 -3.386 8.741 4.353 1.00 0.37 H new ATOM 0 HG21 THR A 103 -4.525 9.149 2.283 1.00 0.38 H new ATOM 0 HG22 THR A 103 -3.818 8.430 0.816 1.00 0.38 H new ATOM 0 HG23 THR A 103 -4.598 7.389 2.031 1.00 0.38 H new ATOM 1768 N ALA A 104 -0.019 7.284 0.564 1.00 0.26 N ATOM 1769 CA ALA A 104 1.349 7.607 0.186 1.00 0.28 C ATOM 1770 C ALA A 104 1.358 8.548 -1.014 1.00 0.26 C ATOM 1771 O ALA A 104 0.335 8.724 -1.680 1.00 0.25 O ATOM 1772 CB ALA A 104 2.122 6.333 -0.127 1.00 0.34 C ATOM 0 H ALA A 104 -0.628 7.065 -0.224 1.00 0.26 H new ATOM 0 HA ALA A 104 1.835 8.111 1.022 1.00 0.28 H new ATOM 0 HB1 ALA A 104 3.144 6.587 -0.408 1.00 0.34 H new ATOM 0 HB2 ALA A 104 2.137 5.691 0.754 1.00 0.34 H new ATOM 0 HB3 ALA A 104 1.639 5.807 -0.951 1.00 0.34 H new ATOM 1778 N LEU A 105 2.507 9.150 -1.297 1.00 0.27 N ATOM 1779 CA LEU A 105 2.622 10.074 -2.411 1.00 0.27 C ATOM 1780 C LEU A 105 3.055 9.347 -3.668 1.00 0.26 C ATOM 1781 O LEU A 105 3.581 8.236 -3.605 1.00 0.27 O ATOM 1782 CB LEU A 105 3.614 11.195 -2.091 1.00 0.32 C ATOM 1783 CG LEU A 105 3.347 11.962 -0.791 1.00 0.39 C ATOM 1784 CD1 LEU A 105 4.286 13.151 -0.677 1.00 0.57 C ATOM 1785 CD2 LEU A 105 1.896 12.416 -0.723 1.00 0.49 C ATOM 0 H LEU A 105 3.369 9.013 -0.769 1.00 0.27 H new ATOM 0 HA LEU A 105 1.640 10.515 -2.580 1.00 0.27 H new ATOM 0 HB2 LEU A 105 4.615 10.767 -2.041 1.00 0.32 H new ATOM 0 HB3 LEU A 105 3.612 11.905 -2.918 1.00 0.32 H new ATOM 0 HG LEU A 105 3.533 11.293 0.049 1.00 0.39 H new ATOM 0 HD11 LEU A 105 4.085 13.686 0.251 1.00 0.57 H new ATOM 0 HD12 LEU A 105 5.318 12.801 -0.677 1.00 0.57 H new ATOM 0 HD13 LEU A 105 4.130 13.820 -1.523 1.00 0.57 H new ATOM 0 HD21 LEU A 105 1.728 12.958 0.207 1.00 0.49 H new ATOM 0 HD22 LEU A 105 1.679 13.069 -1.568 1.00 0.49 H new ATOM 0 HD23 LEU A 105 1.240 11.546 -0.759 1.00 0.49 H new ATOM 1797 N ALA A 106 2.825 9.984 -4.809 1.00 0.27 N ATOM 1798 CA ALA A 106 3.189 9.416 -6.105 1.00 0.30 C ATOM 1799 C ALA A 106 4.676 9.104 -6.177 1.00 0.31 C ATOM 1800 O ALA A 106 5.096 8.187 -6.880 1.00 0.36 O ATOM 1801 CB ALA A 106 2.790 10.356 -7.230 1.00 0.34 C ATOM 0 H ALA A 106 2.384 10.902 -4.865 1.00 0.27 H new ATOM 0 HA ALA A 106 2.645 8.479 -6.221 1.00 0.30 H new ATOM 0 HB1 ALA A 106 3.069 9.916 -8.188 1.00 0.34 H new ATOM 0 HB2 ALA A 106 1.712 10.517 -7.205 1.00 0.34 H new ATOM 0 HB3 ALA A 106 3.302 11.310 -7.106 1.00 0.34 H new ATOM 1807 N GLU A 107 5.462 9.858 -5.435 1.00 0.31 N ATOM 1808 CA GLU A 107 6.906 9.657 -5.415 1.00 0.35 C ATOM 1809 C GLU A 107 7.277 8.498 -4.494 1.00 0.36 C ATOM 1810 O GLU A 107 8.300 7.842 -4.686 1.00 0.43 O ATOM 1811 CB GLU A 107 7.647 10.935 -4.984 1.00 0.40 C ATOM 1812 CG GLU A 107 6.776 11.970 -4.282 1.00 0.44 C ATOM 1813 CD GLU A 107 6.077 12.903 -5.252 1.00 0.67 C ATOM 1814 OE1 GLU A 107 6.756 13.762 -5.856 1.00 1.35 O ATOM 1815 OE2 GLU A 107 4.844 12.782 -5.418 1.00 1.38 O ATOM 0 H GLU A 107 5.131 10.615 -4.837 1.00 0.31 H new ATOM 0 HA GLU A 107 7.216 9.413 -6.431 1.00 0.35 H new ATOM 0 HB2 GLU A 107 8.465 10.658 -4.319 1.00 0.40 H new ATOM 0 HB3 GLU A 107 8.094 11.394 -5.866 1.00 0.40 H new ATOM 0 HG2 GLU A 107 6.029 11.458 -3.675 1.00 0.44 H new ATOM 0 HG3 GLU A 107 7.393 12.556 -3.601 1.00 0.44 H new ATOM 1822 N GLU A 108 6.422 8.233 -3.518 1.00 0.33 N ATOM 1823 CA GLU A 108 6.657 7.166 -2.555 1.00 0.36 C ATOM 1824 C GLU A 108 6.117 5.836 -3.075 1.00 0.39 C ATOM 1825 O GLU A 108 6.347 4.782 -2.477 1.00 0.59 O ATOM 1826 CB GLU A 108 5.998 7.538 -1.228 1.00 0.39 C ATOM 1827 CG GLU A 108 6.313 8.965 -0.796 1.00 0.75 C ATOM 1828 CD GLU A 108 5.503 9.415 0.400 1.00 1.62 C ATOM 1829 OE1 GLU A 108 4.439 8.821 0.658 1.00 2.35 O ATOM 1830 OE2 GLU A 108 5.923 10.375 1.081 1.00 2.31 O ATOM 0 H GLU A 108 5.553 8.746 -3.371 1.00 0.33 H new ATOM 0 HA GLU A 108 7.730 7.047 -2.404 1.00 0.36 H new ATOM 0 HB2 GLU A 108 4.918 7.420 -1.317 1.00 0.39 H new ATOM 0 HB3 GLU A 108 6.332 6.846 -0.455 1.00 0.39 H new ATOM 0 HG2 GLU A 108 7.374 9.040 -0.558 1.00 0.75 H new ATOM 0 HG3 GLU A 108 6.125 9.641 -1.630 1.00 0.75 H new ATOM 1837 N LYS A 109 5.395 5.916 -4.190 1.00 0.37 N ATOM 1838 CA LYS A 109 4.786 4.762 -4.851 1.00 0.38 C ATOM 1839 C LYS A 109 5.702 3.522 -4.902 1.00 0.34 C ATOM 1840 O LYS A 109 5.351 2.487 -4.334 1.00 0.35 O ATOM 1841 CB LYS A 109 4.335 5.168 -6.260 1.00 0.44 C ATOM 1842 CG LYS A 109 3.882 4.008 -7.120 1.00 0.74 C ATOM 1843 CD LYS A 109 4.079 4.307 -8.598 1.00 1.00 C ATOM 1844 CE LYS A 109 4.077 3.037 -9.431 1.00 1.73 C ATOM 1845 NZ LYS A 109 4.364 3.312 -10.864 1.00 2.18 N ATOM 0 H LYS A 109 5.213 6.798 -4.668 1.00 0.37 H new ATOM 0 HA LYS A 109 3.926 4.462 -4.251 1.00 0.38 H new ATOM 0 HB2 LYS A 109 3.519 5.885 -6.176 1.00 0.44 H new ATOM 0 HB3 LYS A 109 5.158 5.678 -6.761 1.00 0.44 H new ATOM 0 HG2 LYS A 109 4.441 3.112 -6.850 1.00 0.74 H new ATOM 0 HG3 LYS A 109 2.830 3.798 -6.926 1.00 0.74 H new ATOM 0 HD2 LYS A 109 3.287 4.971 -8.944 1.00 1.00 H new ATOM 0 HD3 LYS A 109 5.022 4.835 -8.740 1.00 1.00 H new ATOM 0 HE2 LYS A 109 4.821 2.344 -9.038 1.00 1.73 H new ATOM 0 HE3 LYS A 109 3.108 2.547 -9.343 1.00 1.73 H new ATOM 0 HZ1 LYS A 109 4.750 2.456 -11.311 1.00 2.18 H new ATOM 0 HZ2 LYS A 109 3.486 3.589 -11.347 1.00 2.18 H new ATOM 0 HZ3 LYS A 109 5.057 4.084 -10.937 1.00 2.18 H new ATOM 1859 N PRO A 110 6.886 3.591 -5.557 1.00 0.34 N ATOM 1860 CA PRO A 110 7.789 2.435 -5.657 1.00 0.35 C ATOM 1861 C PRO A 110 8.225 1.906 -4.291 1.00 0.30 C ATOM 1862 O PRO A 110 8.280 0.698 -4.074 1.00 0.31 O ATOM 1863 CB PRO A 110 9.002 2.984 -6.419 1.00 0.42 C ATOM 1864 CG PRO A 110 8.909 4.465 -6.299 1.00 0.41 C ATOM 1865 CD PRO A 110 7.449 4.775 -6.234 1.00 0.37 C ATOM 0 HA PRO A 110 7.302 1.593 -6.148 1.00 0.35 H new ATOM 0 HB2 PRO A 110 9.934 2.613 -5.993 1.00 0.42 H new ATOM 0 HB3 PRO A 110 8.983 2.673 -7.463 1.00 0.42 H new ATOM 0 HG2 PRO A 110 9.424 4.818 -5.406 1.00 0.41 H new ATOM 0 HG3 PRO A 110 9.376 4.957 -7.152 1.00 0.41 H new ATOM 0 HD2 PRO A 110 7.256 5.690 -5.674 1.00 0.37 H new ATOM 0 HD3 PRO A 110 7.021 4.913 -7.227 1.00 0.37 H new ATOM 1873 N TYR A 111 8.509 2.823 -3.378 1.00 0.29 N ATOM 1874 CA TYR A 111 8.962 2.472 -2.035 1.00 0.27 C ATOM 1875 C TYR A 111 7.888 1.721 -1.270 1.00 0.26 C ATOM 1876 O TYR A 111 8.131 0.641 -0.726 1.00 0.26 O ATOM 1877 CB TYR A 111 9.352 3.733 -1.255 1.00 0.31 C ATOM 1878 CG TYR A 111 10.626 4.390 -1.731 1.00 0.27 C ATOM 1879 CD1 TYR A 111 10.903 4.524 -3.082 1.00 1.24 C ATOM 1880 CD2 TYR A 111 11.555 4.876 -0.824 1.00 1.20 C ATOM 1881 CE1 TYR A 111 12.064 5.120 -3.515 1.00 1.27 C ATOM 1882 CE2 TYR A 111 12.720 5.477 -1.249 1.00 1.21 C ATOM 1883 CZ TYR A 111 12.973 5.594 -2.597 1.00 0.41 C ATOM 1884 OH TYR A 111 14.135 6.188 -3.028 1.00 0.53 O ATOM 0 H TYR A 111 8.433 3.827 -3.543 1.00 0.29 H new ATOM 0 HA TYR A 111 9.832 1.825 -2.141 1.00 0.27 H new ATOM 0 HB2 TYR A 111 8.538 4.454 -1.323 1.00 0.31 H new ATOM 0 HB3 TYR A 111 9.462 3.475 -0.202 1.00 0.31 H new ATOM 0 HD1 TYR A 111 10.194 4.154 -3.808 1.00 1.24 H new ATOM 0 HD2 TYR A 111 11.362 4.782 0.234 1.00 1.20 H new ATOM 0 HE1 TYR A 111 12.262 5.216 -4.572 1.00 1.27 H new ATOM 0 HE2 TYR A 111 13.431 5.854 -0.528 1.00 1.21 H new ATOM 0 HH TYR A 111 14.251 7.048 -2.572 1.00 0.53 H new ATOM 1894 N ALA A 112 6.701 2.303 -1.235 1.00 0.26 N ATOM 1895 CA ALA A 112 5.580 1.705 -0.532 1.00 0.27 C ATOM 1896 C ALA A 112 5.266 0.322 -1.093 1.00 0.26 C ATOM 1897 O ALA A 112 5.043 -0.636 -0.340 1.00 0.26 O ATOM 1898 CB ALA A 112 4.363 2.611 -0.615 1.00 0.30 C ATOM 0 H ALA A 112 6.489 3.192 -1.687 1.00 0.26 H new ATOM 0 HA ALA A 112 5.852 1.588 0.517 1.00 0.27 H new ATOM 0 HB1 ALA A 112 3.530 2.151 -0.084 1.00 0.30 H new ATOM 0 HB2 ALA A 112 4.595 3.574 -0.161 1.00 0.30 H new ATOM 0 HB3 ALA A 112 4.090 2.759 -1.660 1.00 0.30 H new ATOM 1904 N ILE A 113 5.256 0.221 -2.421 1.00 0.27 N ATOM 1905 CA ILE A 113 4.989 -1.048 -3.079 1.00 0.29 C ATOM 1906 C ILE A 113 6.030 -2.079 -2.672 1.00 0.29 C ATOM 1907 O ILE A 113 5.679 -3.195 -2.324 1.00 0.31 O ATOM 1908 CB ILE A 113 4.966 -0.911 -4.624 1.00 0.33 C ATOM 1909 CG1 ILE A 113 3.775 -0.057 -5.077 1.00 0.35 C ATOM 1910 CG2 ILE A 113 4.910 -2.283 -5.282 1.00 0.37 C ATOM 1911 CD1 ILE A 113 2.425 -0.642 -4.719 1.00 0.39 C ATOM 0 H ILE A 113 5.429 1.000 -3.056 1.00 0.27 H new ATOM 0 HA ILE A 113 4.000 -1.376 -2.759 1.00 0.29 H new ATOM 0 HB ILE A 113 5.885 -0.413 -4.933 1.00 0.33 H new ATOM 0 HG12 ILE A 113 3.860 0.933 -4.630 1.00 0.35 H new ATOM 0 HG13 ILE A 113 3.827 0.076 -6.158 1.00 0.35 H new ATOM 0 HG21 ILE A 113 4.895 -2.166 -6.366 1.00 0.37 H new ATOM 0 HG22 ILE A 113 5.787 -2.862 -4.992 1.00 0.37 H new ATOM 0 HG23 ILE A 113 4.008 -2.804 -4.960 1.00 0.37 H new ATOM 0 HD11 ILE A 113 1.636 0.021 -5.074 1.00 0.39 H new ATOM 0 HD12 ILE A 113 2.316 -1.620 -5.189 1.00 0.39 H new ATOM 0 HD13 ILE A 113 2.350 -0.749 -3.637 1.00 0.39 H new ATOM 1923 N PHE A 114 7.300 -1.678 -2.671 1.00 0.28 N ATOM 1924 CA PHE A 114 8.394 -2.569 -2.307 1.00 0.31 C ATOM 1925 C PHE A 114 8.181 -3.175 -0.925 1.00 0.31 C ATOM 1926 O PHE A 114 8.391 -4.373 -0.723 1.00 0.33 O ATOM 1927 CB PHE A 114 9.708 -1.793 -2.351 1.00 0.34 C ATOM 1928 CG PHE A 114 10.871 -2.512 -1.741 1.00 0.36 C ATOM 1929 CD1 PHE A 114 11.425 -3.617 -2.361 1.00 1.27 C ATOM 1930 CD2 PHE A 114 11.406 -2.079 -0.542 1.00 1.24 C ATOM 1931 CE1 PHE A 114 12.496 -4.280 -1.797 1.00 1.33 C ATOM 1932 CE2 PHE A 114 12.478 -2.736 0.030 1.00 1.26 C ATOM 1933 CZ PHE A 114 13.024 -3.840 -0.598 1.00 0.55 C ATOM 0 H PHE A 114 7.595 -0.734 -2.921 1.00 0.28 H new ATOM 0 HA PHE A 114 8.428 -3.391 -3.022 1.00 0.31 H new ATOM 0 HB2 PHE A 114 9.944 -1.561 -3.389 1.00 0.34 H new ATOM 0 HB3 PHE A 114 9.572 -0.843 -1.835 1.00 0.34 H new ATOM 0 HD1 PHE A 114 11.015 -3.965 -3.297 1.00 1.27 H new ATOM 0 HD2 PHE A 114 10.981 -1.218 -0.047 1.00 1.24 H new ATOM 0 HE1 PHE A 114 12.921 -5.141 -2.292 1.00 1.33 H new ATOM 0 HE2 PHE A 114 12.889 -2.388 0.966 1.00 1.26 H new ATOM 0 HZ PHE A 114 13.861 -4.357 -0.153 1.00 0.55 H new ATOM 1943 N HIS A 115 7.759 -2.341 0.015 1.00 0.30 N ATOM 1944 CA HIS A 115 7.504 -2.776 1.371 1.00 0.33 C ATOM 1945 C HIS A 115 6.422 -3.861 1.390 1.00 0.32 C ATOM 1946 O HIS A 115 6.625 -4.955 1.913 1.00 0.34 O ATOM 1947 CB HIS A 115 7.096 -1.564 2.222 1.00 0.38 C ATOM 1948 CG HIS A 115 6.999 -1.874 3.678 1.00 0.42 C ATOM 1949 ND1 HIS A 115 7.890 -1.373 4.595 1.00 0.45 N ATOM 1950 CD2 HIS A 115 6.127 -2.675 4.311 1.00 0.47 C ATOM 1951 CE1 HIS A 115 7.544 -1.890 5.756 1.00 0.49 C ATOM 1952 NE2 HIS A 115 6.491 -2.690 5.629 1.00 0.51 N ATOM 0 H HIS A 115 7.586 -1.349 -0.145 1.00 0.30 H new ATOM 0 HA HIS A 115 8.410 -3.211 1.793 1.00 0.33 H new ATOM 0 HB2 HIS A 115 7.822 -0.764 2.075 1.00 0.38 H new ATOM 0 HB3 HIS A 115 6.134 -1.190 1.872 1.00 0.38 H new ATOM 0 HD2 HIS A 115 5.298 -3.205 3.865 1.00 0.47 H new ATOM 0 HE1 HIS A 115 8.050 -1.690 6.689 1.00 0.49 H new ATOM 0 HE2 HIS A 115 6.038 -3.217 6.376 1.00 0.51 H new ATOM 1960 N PHE A 116 5.278 -3.547 0.817 1.00 0.32 N ATOM 1961 CA PHE A 116 4.169 -4.493 0.786 1.00 0.33 C ATOM 1962 C PHE A 116 4.316 -5.565 -0.297 1.00 0.33 C ATOM 1963 O PHE A 116 3.429 -6.406 -0.455 1.00 0.36 O ATOM 1964 CB PHE A 116 2.848 -3.754 0.637 1.00 0.35 C ATOM 1965 CG PHE A 116 2.501 -2.951 1.853 1.00 0.37 C ATOM 1966 CD1 PHE A 116 3.008 -1.674 2.029 1.00 1.29 C ATOM 1967 CD2 PHE A 116 1.677 -3.481 2.829 1.00 1.21 C ATOM 1968 CE1 PHE A 116 2.698 -0.940 3.155 1.00 1.31 C ATOM 1969 CE2 PHE A 116 1.360 -2.753 3.958 1.00 1.25 C ATOM 1970 CZ PHE A 116 1.875 -1.480 4.123 1.00 0.50 C ATOM 0 H PHE A 116 5.087 -2.651 0.368 1.00 0.32 H new ATOM 0 HA PHE A 116 4.183 -5.021 1.739 1.00 0.33 H new ATOM 0 HB2 PHE A 116 2.900 -3.093 -0.228 1.00 0.35 H new ATOM 0 HB3 PHE A 116 2.053 -4.473 0.441 1.00 0.35 H new ATOM 0 HD1 PHE A 116 3.654 -1.248 1.276 1.00 1.29 H new ATOM 0 HD2 PHE A 116 1.277 -4.477 2.706 1.00 1.21 H new ATOM 0 HE1 PHE A 116 3.098 0.055 3.279 1.00 1.31 H new ATOM 0 HE2 PHE A 116 0.711 -3.176 4.711 1.00 1.25 H new ATOM 0 HZ PHE A 116 1.634 -0.909 5.008 1.00 0.50 H new ATOM 1980 N THR A 117 5.395 -5.508 -1.077 1.00 0.33 N ATOM 1981 CA THR A 117 5.613 -6.485 -2.138 1.00 0.37 C ATOM 1982 C THR A 117 5.538 -7.924 -1.613 1.00 0.36 C ATOM 1983 O THR A 117 4.640 -8.677 -2.004 1.00 0.47 O ATOM 1984 CB THR A 117 6.964 -6.252 -2.872 1.00 0.63 C ATOM 1985 OG1 THR A 117 6.841 -5.147 -3.777 1.00 1.18 O ATOM 1986 CG2 THR A 117 7.398 -7.485 -3.656 1.00 0.92 C ATOM 0 H THR A 117 6.125 -4.801 -0.994 1.00 0.33 H new ATOM 0 HA THR A 117 4.806 -6.342 -2.857 1.00 0.37 H new ATOM 0 HB THR A 117 7.718 -6.040 -2.114 1.00 0.63 H new ATOM 0 HG1 THR A 117 6.206 -4.495 -3.413 1.00 1.18 H new ATOM 0 HG21 THR A 117 8.346 -7.284 -4.155 1.00 0.92 H new ATOM 0 HG22 THR A 117 7.519 -8.326 -2.973 1.00 0.92 H new ATOM 0 HG23 THR A 117 6.640 -7.728 -4.401 1.00 0.92 H new ATOM 1994 N GLY A 118 6.476 -8.338 -0.762 1.00 0.43 N ATOM 1995 CA GLY A 118 6.406 -9.694 -0.262 1.00 0.59 C ATOM 1996 C GLY A 118 6.516 -9.848 1.239 1.00 0.49 C ATOM 1997 O GLY A 118 5.613 -9.468 1.977 1.00 0.54 O ATOM 0 H GLY A 118 7.257 -7.777 -0.421 1.00 0.43 H new ATOM 0 HA2 GLY A 118 5.462 -10.132 -0.585 1.00 0.59 H new ATOM 0 HA3 GLY A 118 7.203 -10.275 -0.727 1.00 0.59 H new ATOM 2001 N PRO A 119 7.646 -10.414 1.723 1.00 0.51 N ATOM 2002 CA PRO A 119 7.879 -10.614 3.142 1.00 0.52 C ATOM 2003 C PRO A 119 8.686 -9.492 3.784 1.00 0.43 C ATOM 2004 O PRO A 119 9.747 -9.109 3.289 1.00 0.42 O ATOM 2005 CB PRO A 119 8.691 -11.922 3.184 1.00 0.65 C ATOM 2006 CG PRO A 119 9.055 -12.246 1.765 1.00 0.72 C ATOM 2007 CD PRO A 119 8.732 -11.024 0.943 1.00 0.70 C ATOM 0 HA PRO A 119 6.940 -10.640 3.696 1.00 0.52 H new ATOM 0 HB2 PRO A 119 9.585 -11.804 3.796 1.00 0.65 H new ATOM 0 HB3 PRO A 119 8.106 -12.727 3.627 1.00 0.65 H new ATOM 0 HG2 PRO A 119 10.113 -12.497 1.685 1.00 0.72 H new ATOM 0 HG3 PRO A 119 8.494 -13.110 1.410 1.00 0.72 H new ATOM 0 HD2 PRO A 119 9.590 -10.358 0.846 1.00 0.70 H new ATOM 0 HD3 PRO A 119 8.414 -11.283 -0.067 1.00 0.70 H new ATOM 2015 N VAL A 120 8.159 -8.981 4.885 1.00 0.43 N ATOM 2016 CA VAL A 120 8.809 -7.930 5.666 1.00 0.42 C ATOM 2017 C VAL A 120 10.262 -8.294 5.995 1.00 0.38 C ATOM 2018 O VAL A 120 11.124 -7.419 6.086 1.00 0.37 O ATOM 2019 CB VAL A 120 8.018 -7.613 6.957 1.00 0.49 C ATOM 2020 CG1 VAL A 120 7.848 -8.851 7.819 1.00 0.58 C ATOM 2021 CG2 VAL A 120 8.686 -6.493 7.746 1.00 0.53 C ATOM 0 H VAL A 120 7.263 -9.283 5.268 1.00 0.43 H new ATOM 0 HA VAL A 120 8.819 -7.031 5.050 1.00 0.42 H new ATOM 0 HB VAL A 120 7.025 -7.275 6.660 1.00 0.49 H new ATOM 0 HG11 VAL A 120 7.288 -8.594 8.718 1.00 0.58 H new ATOM 0 HG12 VAL A 120 7.305 -9.613 7.259 1.00 0.58 H new ATOM 0 HG13 VAL A 120 8.828 -9.236 8.100 1.00 0.58 H new ATOM 0 HG21 VAL A 120 8.110 -6.290 8.649 1.00 0.53 H new ATOM 0 HG22 VAL A 120 9.697 -6.794 8.021 1.00 0.53 H new ATOM 0 HG23 VAL A 120 8.730 -5.592 7.133 1.00 0.53 H new ATOM 2031 N SER A 121 10.511 -9.585 6.209 1.00 0.40 N ATOM 2032 CA SER A 121 11.848 -10.080 6.515 1.00 0.40 C ATOM 2033 C SER A 121 12.864 -9.579 5.484 1.00 0.36 C ATOM 2034 O SER A 121 13.959 -9.138 5.841 1.00 0.37 O ATOM 2035 CB SER A 121 11.838 -11.613 6.559 1.00 0.46 C ATOM 2036 OG SER A 121 13.065 -12.131 7.047 1.00 1.24 O ATOM 0 H SER A 121 9.796 -10.311 6.175 1.00 0.40 H new ATOM 0 HA SER A 121 12.146 -9.699 7.492 1.00 0.40 H new ATOM 0 HB2 SER A 121 11.021 -11.954 7.194 1.00 0.46 H new ATOM 0 HB3 SER A 121 11.649 -12.005 5.559 1.00 0.46 H new ATOM 0 HG SER A 121 13.023 -13.110 7.063 1.00 1.24 H new ATOM 2042 N TYR A 122 12.500 -9.641 4.205 1.00 0.36 N ATOM 2043 CA TYR A 122 13.374 -9.166 3.140 1.00 0.35 C ATOM 2044 C TYR A 122 13.668 -7.675 3.305 1.00 0.33 C ATOM 2045 O TYR A 122 14.792 -7.224 3.092 1.00 0.34 O ATOM 2046 CB TYR A 122 12.731 -9.422 1.780 1.00 0.38 C ATOM 2047 CG TYR A 122 13.686 -9.293 0.614 1.00 0.44 C ATOM 2048 CD1 TYR A 122 14.899 -9.966 0.612 1.00 1.29 C ATOM 2049 CD2 TYR A 122 13.373 -8.503 -0.484 1.00 1.29 C ATOM 2050 CE1 TYR A 122 15.775 -9.860 -0.452 1.00 1.36 C ATOM 2051 CE2 TYR A 122 14.243 -8.392 -1.555 1.00 1.35 C ATOM 2052 CZ TYR A 122 15.443 -9.073 -1.532 1.00 0.73 C ATOM 2053 OH TYR A 122 16.314 -8.970 -2.595 1.00 0.91 O ATOM 0 H TYR A 122 11.607 -10.015 3.883 1.00 0.36 H new ATOM 0 HA TYR A 122 14.315 -9.713 3.200 1.00 0.35 H new ATOM 0 HB2 TYR A 122 12.301 -10.424 1.775 1.00 0.38 H new ATOM 0 HB3 TYR A 122 11.908 -8.721 1.641 1.00 0.38 H new ATOM 0 HD1 TYR A 122 15.164 -10.584 1.457 1.00 1.29 H new ATOM 0 HD2 TYR A 122 12.436 -7.967 -0.503 1.00 1.29 H new ATOM 0 HE1 TYR A 122 16.715 -10.392 -0.436 1.00 1.36 H new ATOM 0 HE2 TYR A 122 13.984 -7.776 -2.404 1.00 1.35 H new ATOM 0 HH TYR A 122 15.924 -8.391 -3.283 1.00 0.91 H new ATOM 2063 N LEU A 123 12.651 -6.925 3.713 1.00 0.31 N ATOM 2064 CA LEU A 123 12.775 -5.483 3.904 1.00 0.31 C ATOM 2065 C LEU A 123 13.762 -5.155 5.015 1.00 0.31 C ATOM 2066 O LEU A 123 14.710 -4.400 4.810 1.00 0.31 O ATOM 2067 CB LEU A 123 11.418 -4.869 4.240 1.00 0.32 C ATOM 2068 CG LEU A 123 10.238 -5.407 3.435 1.00 0.34 C ATOM 2069 CD1 LEU A 123 8.934 -4.912 4.031 1.00 0.43 C ATOM 2070 CD2 LEU A 123 10.347 -4.995 1.977 1.00 0.34 C ATOM 0 H LEU A 123 11.723 -7.295 3.920 1.00 0.31 H new ATOM 0 HA LEU A 123 13.146 -5.061 2.970 1.00 0.31 H new ATOM 0 HB2 LEU A 123 11.217 -5.031 5.299 1.00 0.32 H new ATOM 0 HB3 LEU A 123 11.478 -3.791 4.088 1.00 0.32 H new ATOM 0 HG LEU A 123 10.255 -6.496 3.480 1.00 0.34 H new ATOM 0 HD11 LEU A 123 8.098 -5.301 3.450 1.00 0.43 H new ATOM 0 HD12 LEU A 123 8.851 -5.256 5.062 1.00 0.43 H new ATOM 0 HD13 LEU A 123 8.915 -3.822 4.010 1.00 0.43 H new ATOM 0 HD21 LEU A 123 9.495 -5.390 1.423 1.00 0.34 H new ATOM 0 HD22 LEU A 123 10.354 -3.907 1.906 1.00 0.34 H new ATOM 0 HD23 LEU A 123 11.270 -5.392 1.555 1.00 0.34 H new ATOM 2082 N ILE A 124 13.523 -5.714 6.198 1.00 0.36 N ATOM 2083 CA ILE A 124 14.398 -5.475 7.340 1.00 0.41 C ATOM 2084 C ILE A 124 15.830 -5.916 7.034 1.00 0.38 C ATOM 2085 O ILE A 124 16.790 -5.337 7.550 1.00 0.38 O ATOM 2086 CB ILE A 124 13.875 -6.142 8.633 1.00 0.52 C ATOM 2087 CG1 ILE A 124 13.791 -7.658 8.493 1.00 0.76 C ATOM 2088 CG2 ILE A 124 12.517 -5.576 9.001 1.00 1.01 C ATOM 2089 CD1 ILE A 124 13.165 -8.346 9.690 1.00 1.08 C ATOM 0 H ILE A 124 12.735 -6.332 6.390 1.00 0.36 H new ATOM 0 HA ILE A 124 14.400 -4.400 7.519 1.00 0.41 H new ATOM 0 HB ILE A 124 14.586 -5.922 9.429 1.00 0.52 H new ATOM 0 HG12 ILE A 124 13.212 -7.900 7.602 1.00 0.76 H new ATOM 0 HG13 ILE A 124 14.794 -8.056 8.340 1.00 0.76 H new ATOM 0 HG21 ILE A 124 12.159 -6.053 9.913 1.00 1.01 H new ATOM 0 HG22 ILE A 124 12.602 -4.502 9.163 1.00 1.01 H new ATOM 0 HG23 ILE A 124 11.812 -5.766 8.191 1.00 1.01 H new ATOM 0 HD11 ILE A 124 13.139 -9.422 9.519 1.00 1.08 H new ATOM 0 HD12 ILE A 124 13.756 -8.135 10.581 1.00 1.08 H new ATOM 0 HD13 ILE A 124 12.149 -7.977 9.832 1.00 1.08 H new ATOM 2101 N ARG A 125 15.965 -6.937 6.191 1.00 0.38 N ATOM 2102 CA ARG A 125 17.272 -7.426 5.774 1.00 0.41 C ATOM 2103 C ARG A 125 17.980 -6.350 4.953 1.00 0.36 C ATOM 2104 O ARG A 125 19.150 -6.040 5.179 1.00 0.38 O ATOM 2105 CB ARG A 125 17.114 -8.706 4.944 1.00 0.46 C ATOM 2106 CG ARG A 125 18.411 -9.220 4.340 1.00 1.30 C ATOM 2107 CD ARG A 125 19.278 -9.902 5.382 1.00 1.31 C ATOM 2108 NE ARG A 125 20.630 -9.352 5.413 1.00 2.16 N ATOM 2109 CZ ARG A 125 21.519 -9.630 6.365 1.00 2.81 C ATOM 2110 NH1 ARG A 125 21.196 -10.452 7.356 1.00 2.83 N ATOM 2111 NH2 ARG A 125 22.732 -9.087 6.328 1.00 3.80 N ATOM 0 H ARG A 125 15.179 -7.443 5.783 1.00 0.38 H new ATOM 0 HA ARG A 125 17.870 -7.655 6.656 1.00 0.41 H new ATOM 0 HB2 ARG A 125 16.686 -9.485 5.575 1.00 0.46 H new ATOM 0 HB3 ARG A 125 16.401 -8.519 4.141 1.00 0.46 H new ATOM 0 HG2 ARG A 125 18.186 -9.921 3.536 1.00 1.30 H new ATOM 0 HG3 ARG A 125 18.960 -8.390 3.895 1.00 1.30 H new ATOM 0 HD2 ARG A 125 18.819 -9.791 6.364 1.00 1.31 H new ATOM 0 HD3 ARG A 125 19.326 -10.970 5.171 1.00 1.31 H new ATOM 0 HE ARG A 125 20.909 -8.719 4.663 1.00 2.16 H new ATOM 0 HH11 ARG A 125 20.267 -10.871 7.389 1.00 2.83 H new ATOM 0 HH12 ARG A 125 21.877 -10.665 8.085 1.00 2.83 H new ATOM 0 HH21 ARG A 125 22.985 -8.455 5.569 1.00 3.80 H new ATOM 0 HH22 ARG A 125 23.410 -9.303 7.059 1.00 3.80 H new ATOM 2125 N ILE A 126 17.238 -5.773 4.014 1.00 0.34 N ATOM 2126 CA ILE A 126 17.751 -4.720 3.144 1.00 0.33 C ATOM 2127 C ILE A 126 18.039 -3.451 3.942 1.00 0.31 C ATOM 2128 O ILE A 126 19.058 -2.792 3.733 1.00 0.31 O ATOM 2129 CB ILE A 126 16.758 -4.438 1.980 1.00 0.34 C ATOM 2130 CG1 ILE A 126 17.156 -5.228 0.730 1.00 0.39 C ATOM 2131 CG2 ILE A 126 16.667 -2.955 1.648 1.00 0.38 C ATOM 2132 CD1 ILE A 126 17.125 -6.729 0.913 1.00 0.46 C ATOM 0 H ILE A 126 16.265 -6.021 3.834 1.00 0.34 H new ATOM 0 HA ILE A 126 18.690 -5.061 2.709 1.00 0.33 H new ATOM 0 HB ILE A 126 15.773 -4.763 2.316 1.00 0.34 H new ATOM 0 HG12 ILE A 126 16.486 -4.958 -0.086 1.00 0.39 H new ATOM 0 HG13 ILE A 126 18.160 -4.930 0.429 1.00 0.39 H new ATOM 0 HG21 ILE A 126 15.962 -2.808 0.830 1.00 0.38 H new ATOM 0 HG22 ILE A 126 16.324 -2.406 2.525 1.00 0.38 H new ATOM 0 HG23 ILE A 126 17.649 -2.588 1.351 1.00 0.38 H new ATOM 0 HD11 ILE A 126 17.419 -7.215 -0.017 1.00 0.46 H new ATOM 0 HD12 ILE A 126 17.817 -7.013 1.706 1.00 0.46 H new ATOM 0 HD13 ILE A 126 16.116 -7.042 1.182 1.00 0.46 H new ATOM 2144 N ARG A 127 17.153 -3.137 4.878 1.00 0.31 N ATOM 2145 CA ARG A 127 17.301 -1.970 5.720 1.00 0.33 C ATOM 2146 C ARG A 127 18.603 -2.049 6.511 1.00 0.33 C ATOM 2147 O ARG A 127 19.320 -1.057 6.656 1.00 0.34 O ATOM 2148 CB ARG A 127 16.098 -1.870 6.659 1.00 0.38 C ATOM 2149 CG ARG A 127 16.222 -0.783 7.704 1.00 1.09 C ATOM 2150 CD ARG A 127 16.092 0.603 7.093 1.00 1.30 C ATOM 2151 NE ARG A 127 16.101 1.656 8.108 1.00 1.79 N ATOM 2152 CZ ARG A 127 15.046 2.416 8.416 1.00 2.32 C ATOM 2153 NH1 ARG A 127 13.880 2.229 7.806 1.00 2.76 N ATOM 2154 NH2 ARG A 127 15.161 3.361 9.339 1.00 2.94 N ATOM 0 H ARG A 127 16.315 -3.686 5.070 1.00 0.31 H new ATOM 0 HA ARG A 127 17.341 -1.075 5.099 1.00 0.33 H new ATOM 0 HB2 ARG A 127 15.201 -1.689 6.066 1.00 0.38 H new ATOM 0 HB3 ARG A 127 15.961 -2.828 7.160 1.00 0.38 H new ATOM 0 HG2 ARG A 127 15.452 -0.919 8.464 1.00 1.09 H new ATOM 0 HG3 ARG A 127 17.185 -0.870 8.207 1.00 1.09 H new ATOM 0 HD2 ARG A 127 16.911 0.768 6.393 1.00 1.30 H new ATOM 0 HD3 ARG A 127 15.167 0.661 6.520 1.00 1.30 H new ATOM 0 HE ARG A 127 16.971 1.821 8.615 1.00 1.79 H new ATOM 0 HH11 ARG A 127 13.786 1.501 7.097 1.00 2.76 H new ATOM 0 HH12 ARG A 127 13.079 2.813 8.047 1.00 2.76 H new ATOM 0 HH21 ARG A 127 16.053 3.506 9.812 1.00 2.94 H new ATOM 0 HH22 ARG A 127 14.357 3.943 9.576 1.00 2.94 H new ATOM 2168 N ALA A 128 18.907 -3.242 7.005 1.00 0.35 N ATOM 2169 CA ALA A 128 20.125 -3.468 7.768 1.00 0.38 C ATOM 2170 C ALA A 128 21.350 -3.366 6.870 1.00 0.37 C ATOM 2171 O ALA A 128 22.364 -2.790 7.260 1.00 0.39 O ATOM 2172 CB ALA A 128 20.076 -4.827 8.445 1.00 0.42 C ATOM 0 H ALA A 128 18.323 -4.071 6.890 1.00 0.35 H new ATOM 0 HA ALA A 128 20.199 -2.697 8.535 1.00 0.38 H new ATOM 0 HB1 ALA A 128 20.993 -4.984 9.013 1.00 0.42 H new ATOM 0 HB2 ALA A 128 19.221 -4.867 9.119 1.00 0.42 H new ATOM 0 HB3 ALA A 128 19.979 -5.607 7.689 1.00 0.42 H new ATOM 2178 N ALA A 129 21.240 -3.919 5.668 1.00 0.36 N ATOM 2179 CA ALA A 129 22.333 -3.884 4.703 1.00 0.38 C ATOM 2180 C ALA A 129 22.702 -2.442 4.377 1.00 0.36 C ATOM 2181 O ALA A 129 23.877 -2.056 4.420 1.00 0.40 O ATOM 2182 CB ALA A 129 21.946 -4.640 3.442 1.00 0.40 C ATOM 0 H ALA A 129 20.403 -4.398 5.337 1.00 0.36 H new ATOM 0 HA ALA A 129 23.205 -4.371 5.140 1.00 0.38 H new ATOM 0 HB1 ALA A 129 22.771 -4.606 2.730 1.00 0.40 H new ATOM 0 HB2 ALA A 129 21.726 -5.678 3.693 1.00 0.40 H new ATOM 0 HB3 ALA A 129 21.064 -4.179 2.998 1.00 0.40 H new ATOM 2188 N LEU A 130 21.688 -1.641 4.071 1.00 0.33 N ATOM 2189 CA LEU A 130 21.895 -0.240 3.760 1.00 0.32 C ATOM 2190 C LEU A 130 22.525 0.470 4.953 1.00 0.33 C ATOM 2191 O LEU A 130 23.449 1.276 4.803 1.00 0.35 O ATOM 2192 CB LEU A 130 20.568 0.419 3.390 1.00 0.32 C ATOM 2193 CG LEU A 130 19.932 -0.097 2.101 1.00 0.36 C ATOM 2194 CD1 LEU A 130 18.420 -0.002 2.189 1.00 0.38 C ATOM 2195 CD2 LEU A 130 20.452 0.670 0.892 1.00 0.41 C ATOM 0 H LEU A 130 20.714 -1.943 4.033 1.00 0.33 H new ATOM 0 HA LEU A 130 22.571 -0.162 2.908 1.00 0.32 H new ATOM 0 HB2 LEU A 130 19.865 0.271 4.210 1.00 0.32 H new ATOM 0 HB3 LEU A 130 20.726 1.493 3.295 1.00 0.32 H new ATOM 0 HG LEU A 130 20.208 -1.144 1.976 1.00 0.36 H new ATOM 0 HD11 LEU A 130 17.978 -0.373 1.264 1.00 0.38 H new ATOM 0 HD12 LEU A 130 18.066 -0.603 3.027 1.00 0.38 H new ATOM 0 HD13 LEU A 130 18.129 1.038 2.339 1.00 0.38 H new ATOM 0 HD21 LEU A 130 19.984 0.283 -0.013 1.00 0.41 H new ATOM 0 HD22 LEU A 130 20.212 1.728 1.001 1.00 0.41 H new ATOM 0 HD23 LEU A 130 21.533 0.549 0.821 1.00 0.41 H new ATOM 2207 N LYS A 131 22.035 0.140 6.143 1.00 0.33 N ATOM 2208 CA LYS A 131 22.547 0.727 7.372 1.00 0.37 C ATOM 2209 C LYS A 131 24.055 0.514 7.475 1.00 0.39 C ATOM 2210 O LYS A 131 24.796 1.414 7.873 1.00 0.43 O ATOM 2211 CB LYS A 131 21.840 0.112 8.581 1.00 0.40 C ATOM 2212 CG LYS A 131 21.087 1.119 9.431 1.00 0.53 C ATOM 2213 CD LYS A 131 21.998 1.801 10.442 1.00 0.69 C ATOM 2214 CE LYS A 131 22.726 2.993 9.841 1.00 0.82 C ATOM 2215 NZ LYS A 131 23.908 3.383 10.651 1.00 1.09 N ATOM 0 H LYS A 131 21.281 -0.533 6.281 1.00 0.33 H new ATOM 0 HA LYS A 131 22.350 1.799 7.357 1.00 0.37 H new ATOM 0 HB2 LYS A 131 21.142 -0.649 8.233 1.00 0.40 H new ATOM 0 HB3 LYS A 131 22.579 -0.394 9.203 1.00 0.40 H new ATOM 0 HG2 LYS A 131 20.633 1.871 8.786 1.00 0.53 H new ATOM 0 HG3 LYS A 131 20.274 0.616 9.955 1.00 0.53 H new ATOM 0 HD2 LYS A 131 21.408 2.130 11.297 1.00 0.69 H new ATOM 0 HD3 LYS A 131 22.727 1.082 10.816 1.00 0.69 H new ATOM 0 HE2 LYS A 131 23.044 2.751 8.827 1.00 0.82 H new ATOM 0 HE3 LYS A 131 22.041 3.838 9.767 1.00 0.82 H new ATOM 0 HZ1 LYS A 131 24.378 4.199 10.209 1.00 1.09 H new ATOM 0 HZ2 LYS A 131 23.602 3.638 11.612 1.00 1.09 H new ATOM 0 HZ3 LYS A 131 24.574 2.585 10.700 1.00 1.09 H new ATOM 2229 N LYS A 132 24.499 -0.678 7.096 1.00 0.40 N ATOM 2230 CA LYS A 132 25.915 -1.013 7.126 1.00 0.45 C ATOM 2231 C LYS A 132 26.680 -0.251 6.044 1.00 0.44 C ATOM 2232 O LYS A 132 27.866 0.030 6.206 1.00 0.47 O ATOM 2233 CB LYS A 132 26.126 -2.520 6.942 1.00 0.49 C ATOM 2234 CG LYS A 132 25.298 -3.384 7.884 1.00 0.53 C ATOM 2235 CD LYS A 132 25.533 -3.031 9.345 1.00 0.59 C ATOM 2236 CE LYS A 132 26.958 -3.338 9.781 1.00 0.92 C ATOM 2237 NZ LYS A 132 27.107 -3.309 11.260 1.00 1.39 N ATOM 0 H LYS A 132 23.896 -1.430 6.763 1.00 0.40 H new ATOM 0 HA LYS A 132 26.300 -0.720 8.103 1.00 0.45 H new ATOM 0 HB2 LYS A 132 25.883 -2.787 5.914 1.00 0.49 H new ATOM 0 HB3 LYS A 132 27.181 -2.749 7.090 1.00 0.49 H new ATOM 0 HG2 LYS A 132 24.240 -3.264 7.649 1.00 0.53 H new ATOM 0 HG3 LYS A 132 25.544 -4.433 7.722 1.00 0.53 H new ATOM 0 HD2 LYS A 132 25.326 -1.972 9.500 1.00 0.59 H new ATOM 0 HD3 LYS A 132 24.834 -3.587 9.970 1.00 0.59 H new ATOM 0 HE2 LYS A 132 27.248 -4.320 9.407 1.00 0.92 H new ATOM 0 HE3 LYS A 132 27.638 -2.613 9.334 1.00 0.92 H new ATOM 0 HZ1 LYS A 132 28.092 -3.523 11.514 1.00 1.39 H new ATOM 0 HZ2 LYS A 132 26.855 -2.365 11.616 1.00 1.39 H new ATOM 0 HZ3 LYS A 132 26.478 -4.019 11.686 1.00 1.39 H new ATOM 2251 N LYS A 133 26.003 0.083 4.943 1.00 0.42 N ATOM 2252 CA LYS A 133 26.650 0.811 3.851 1.00 0.44 C ATOM 2253 C LYS A 133 26.462 2.326 3.998 1.00 0.42 C ATOM 2254 O LYS A 133 26.880 3.099 3.129 1.00 0.45 O ATOM 2255 CB LYS A 133 26.135 0.325 2.487 1.00 0.49 C ATOM 2256 CG LYS A 133 24.956 1.118 1.937 1.00 1.05 C ATOM 2257 CD LYS A 133 24.889 1.051 0.418 1.00 1.48 C ATOM 2258 CE LYS A 133 26.082 1.746 -0.225 1.00 2.08 C ATOM 2259 NZ LYS A 133 25.901 1.929 -1.688 1.00 2.52 N ATOM 0 H LYS A 133 25.019 -0.136 4.785 1.00 0.42 H new ATOM 0 HA LYS A 133 27.719 0.604 3.905 1.00 0.44 H new ATOM 0 HB2 LYS A 133 26.953 0.368 1.768 1.00 0.49 H new ATOM 0 HB3 LYS A 133 25.843 -0.722 2.575 1.00 0.49 H new ATOM 0 HG2 LYS A 133 24.029 0.731 2.359 1.00 1.05 H new ATOM 0 HG3 LYS A 133 25.039 2.158 2.252 1.00 1.05 H new ATOM 0 HD2 LYS A 133 24.859 0.009 0.100 1.00 1.48 H new ATOM 0 HD3 LYS A 133 23.966 1.517 0.073 1.00 1.48 H new ATOM 0 HE2 LYS A 133 26.232 2.718 0.246 1.00 2.08 H new ATOM 0 HE3 LYS A 133 26.983 1.161 -0.042 1.00 2.08 H new ATOM 0 HZ1 LYS A 133 26.736 2.406 -2.084 1.00 2.52 H new ATOM 0 HZ2 LYS A 133 25.784 1.001 -2.142 1.00 2.52 H new ATOM 0 HZ3 LYS A 133 25.056 2.509 -1.863 1.00 2.52 H new ATOM 2273 N ASN A 134 25.829 2.723 5.103 1.00 0.41 N ATOM 2274 CA ASN A 134 25.587 4.135 5.435 1.00 0.42 C ATOM 2275 C ASN A 134 24.467 4.728 4.588 1.00 0.40 C ATOM 2276 O ASN A 134 24.563 5.850 4.079 1.00 0.44 O ATOM 2277 CB ASN A 134 26.866 4.969 5.277 1.00 0.48 C ATOM 2278 CG ASN A 134 26.863 6.222 6.133 1.00 0.78 C ATOM 2279 OD1 ASN A 134 26.238 6.272 7.192 1.00 1.08 O ATOM 2280 ND2 ASN A 134 27.571 7.243 5.683 1.00 1.06 N ATOM 0 H ASN A 134 25.466 2.072 5.800 1.00 0.41 H new ATOM 0 HA ASN A 134 25.276 4.168 6.479 1.00 0.42 H new ATOM 0 HB2 ASN A 134 27.728 4.357 5.541 1.00 0.48 H new ATOM 0 HB3 ASN A 134 26.983 5.250 4.230 1.00 0.48 H new ATOM 0 HD21 ASN A 134 27.612 8.110 6.218 1.00 1.06 H new ATOM 0 HD22 ASN A 134 28.076 7.164 4.800 1.00 1.06 H new ATOM 2287 N TYR A 135 23.401 3.957 4.452 1.00 0.36 N ATOM 2288 CA TYR A 135 22.224 4.372 3.710 1.00 0.35 C ATOM 2289 C TYR A 135 20.982 4.042 4.520 1.00 0.34 C ATOM 2290 O TYR A 135 20.919 3.008 5.180 1.00 0.35 O ATOM 2291 CB TYR A 135 22.157 3.677 2.353 1.00 0.37 C ATOM 2292 CG TYR A 135 22.297 4.610 1.172 1.00 0.55 C ATOM 2293 CD1 TYR A 135 21.245 5.427 0.781 1.00 1.44 C ATOM 2294 CD2 TYR A 135 23.480 4.667 0.444 1.00 1.30 C ATOM 2295 CE1 TYR A 135 21.367 6.276 -0.303 1.00 1.66 C ATOM 2296 CE2 TYR A 135 23.609 5.515 -0.639 1.00 1.46 C ATOM 2297 CZ TYR A 135 22.549 6.316 -1.008 1.00 1.17 C ATOM 2298 OH TYR A 135 22.673 7.167 -2.083 1.00 1.51 O ATOM 0 H TYR A 135 23.328 3.023 4.855 1.00 0.36 H new ATOM 0 HA TYR A 135 22.281 5.447 3.536 1.00 0.35 H new ATOM 0 HB2 TYR A 135 22.944 2.925 2.303 1.00 0.37 H new ATOM 0 HB3 TYR A 135 21.207 3.149 2.274 1.00 0.37 H new ATOM 0 HD1 TYR A 135 20.317 5.399 1.332 1.00 1.44 H new ATOM 0 HD2 TYR A 135 24.311 4.039 0.729 1.00 1.30 H new ATOM 0 HE1 TYR A 135 20.539 6.905 -0.596 1.00 1.66 H new ATOM 0 HE2 TYR A 135 24.535 5.550 -1.194 1.00 1.46 H new ATOM 0 HH TYR A 135 23.568 7.076 -2.471 1.00 1.51 H new ATOM 2308 N LYS A 136 20.005 4.925 4.497 1.00 0.34 N ATOM 2309 CA LYS A 136 18.778 4.692 5.232 1.00 0.35 C ATOM 2310 C LYS A 136 17.581 4.900 4.325 1.00 0.34 C ATOM 2311 O LYS A 136 17.418 5.960 3.731 1.00 0.36 O ATOM 2312 CB LYS A 136 18.678 5.609 6.453 1.00 0.39 C ATOM 2313 CG LYS A 136 20.017 6.076 7.005 1.00 1.36 C ATOM 2314 CD LYS A 136 19.831 7.000 8.199 1.00 1.43 C ATOM 2315 CE LYS A 136 18.973 6.351 9.276 1.00 1.18 C ATOM 2316 NZ LYS A 136 18.884 7.182 10.504 1.00 1.36 N ATOM 0 H LYS A 136 20.035 5.805 3.981 1.00 0.34 H new ATOM 0 HA LYS A 136 18.787 3.661 5.585 1.00 0.35 H new ATOM 0 HB2 LYS A 136 18.085 6.484 6.187 1.00 0.39 H new ATOM 0 HB3 LYS A 136 18.138 5.085 7.241 1.00 0.39 H new ATOM 0 HG2 LYS A 136 20.612 5.212 7.300 1.00 1.36 H new ATOM 0 HG3 LYS A 136 20.574 6.595 6.224 1.00 1.36 H new ATOM 0 HD2 LYS A 136 20.804 7.260 8.615 1.00 1.43 H new ATOM 0 HD3 LYS A 136 19.365 7.930 7.872 1.00 1.43 H new ATOM 0 HE2 LYS A 136 17.971 6.178 8.884 1.00 1.18 H new ATOM 0 HE3 LYS A 136 19.389 5.376 9.529 1.00 1.18 H new ATOM 0 HZ1 LYS A 136 18.290 6.699 11.208 1.00 1.36 H new ATOM 0 HZ2 LYS A 136 19.837 7.326 10.895 1.00 1.36 H new ATOM 0 HZ3 LYS A 136 18.463 8.104 10.270 1.00 1.36 H new ATOM 2330 N LEU A 137 16.762 3.880 4.205 1.00 0.34 N ATOM 2331 CA LEU A 137 15.582 3.944 3.369 1.00 0.36 C ATOM 2332 C LEU A 137 14.381 4.401 4.193 1.00 0.35 C ATOM 2333 O LEU A 137 14.264 4.057 5.368 1.00 0.36 O ATOM 2334 CB LEU A 137 15.337 2.567 2.740 1.00 0.43 C ATOM 2335 CG LEU A 137 13.928 2.308 2.201 1.00 0.40 C ATOM 2336 CD1 LEU A 137 13.827 2.731 0.746 1.00 0.66 C ATOM 2337 CD2 LEU A 137 13.566 0.837 2.353 1.00 0.64 C ATOM 0 H LEU A 137 16.892 2.987 4.680 1.00 0.34 H new ATOM 0 HA LEU A 137 15.730 4.670 2.570 1.00 0.36 H new ATOM 0 HB2 LEU A 137 16.046 2.433 1.923 1.00 0.43 H new ATOM 0 HB3 LEU A 137 15.563 1.805 3.486 1.00 0.43 H new ATOM 0 HG LEU A 137 13.222 2.902 2.781 1.00 0.40 H new ATOM 0 HD11 LEU A 137 12.818 2.539 0.381 1.00 0.66 H new ATOM 0 HD12 LEU A 137 14.048 3.795 0.660 1.00 0.66 H new ATOM 0 HD13 LEU A 137 14.542 2.163 0.151 1.00 0.66 H new ATOM 0 HD21 LEU A 137 12.561 0.668 1.966 1.00 0.64 H new ATOM 0 HD22 LEU A 137 14.277 0.228 1.796 1.00 0.64 H new ATOM 0 HD23 LEU A 137 13.600 0.561 3.407 1.00 0.64 H new ATOM 2349 N ASN A 138 13.501 5.176 3.574 1.00 0.35 N ATOM 2350 CA ASN A 138 12.312 5.692 4.234 1.00 0.37 C ATOM 2351 C ASN A 138 11.228 5.920 3.197 1.00 0.40 C ATOM 2352 O ASN A 138 11.524 6.011 2.008 1.00 0.40 O ATOM 2353 CB ASN A 138 12.619 7.005 4.953 1.00 0.40 C ATOM 2354 CG ASN A 138 12.554 6.872 6.460 1.00 0.52 C ATOM 2355 OD1 ASN A 138 11.516 7.117 7.075 1.00 0.68 O ATOM 2356 ND2 ASN A 138 13.659 6.472 7.061 1.00 0.81 N ATOM 0 H ASN A 138 13.592 5.464 2.600 1.00 0.35 H new ATOM 0 HA ASN A 138 11.975 4.966 4.974 1.00 0.37 H new ATOM 0 HB2 ASN A 138 13.612 7.349 4.665 1.00 0.40 H new ATOM 0 HB3 ASN A 138 11.911 7.767 4.628 1.00 0.40 H new ATOM 0 HD21 ASN A 138 13.675 6.355 8.074 1.00 0.81 H new ATOM 0 HD22 ASN A 138 14.497 6.280 6.512 1.00 0.81 H new ATOM 2363 N GLN A 139 9.986 6.045 3.645 1.00 0.45 N ATOM 2364 CA GLN A 139 8.857 6.257 2.736 1.00 0.53 C ATOM 2365 C GLN A 139 9.019 7.553 1.943 1.00 0.60 C ATOM 2366 O GLN A 139 8.426 7.710 0.887 1.00 0.92 O ATOM 2367 CB GLN A 139 7.540 6.308 3.522 1.00 0.63 C ATOM 2368 CG GLN A 139 6.318 5.908 2.705 1.00 1.09 C ATOM 2369 CD GLN A 139 5.008 6.235 3.402 1.00 1.95 C ATOM 2370 OE1 GLN A 139 4.560 5.499 4.283 1.00 2.36 O ATOM 2371 NE2 GLN A 139 4.372 7.324 2.998 1.00 2.87 N ATOM 0 H GLN A 139 9.730 6.004 4.632 1.00 0.45 H new ATOM 0 HA GLN A 139 8.836 5.420 2.038 1.00 0.53 H new ATOM 0 HB2 GLN A 139 7.618 5.649 4.387 1.00 0.63 H new ATOM 0 HB3 GLN A 139 7.395 7.319 3.904 1.00 0.63 H new ATOM 0 HG2 GLN A 139 6.348 6.418 1.742 1.00 1.09 H new ATOM 0 HG3 GLN A 139 6.358 4.838 2.501 1.00 1.09 H new ATOM 0 HE21 GLN A 139 4.776 7.908 2.266 1.00 2.87 H new ATOM 0 HE22 GLN A 139 3.479 7.579 3.419 1.00 2.87 H new ATOM 2380 N TYR A 140 9.852 8.460 2.443 1.00 0.47 N ATOM 2381 CA TYR A 140 10.053 9.752 1.791 1.00 0.53 C ATOM 2382 C TYR A 140 11.221 9.719 0.813 1.00 0.49 C ATOM 2383 O TYR A 140 11.288 10.538 -0.104 1.00 0.54 O ATOM 2384 CB TYR A 140 10.307 10.850 2.829 1.00 0.60 C ATOM 2385 CG TYR A 140 9.677 10.591 4.180 1.00 0.63 C ATOM 2386 CD1 TYR A 140 8.379 10.996 4.458 1.00 1.37 C ATOM 2387 CD2 TYR A 140 10.392 9.948 5.180 1.00 1.33 C ATOM 2388 CE1 TYR A 140 7.813 10.767 5.698 1.00 1.42 C ATOM 2389 CE2 TYR A 140 9.833 9.712 6.417 1.00 1.38 C ATOM 2390 CZ TYR A 140 8.544 10.122 6.673 1.00 0.80 C ATOM 2391 OH TYR A 140 7.988 9.897 7.913 1.00 0.92 O ATOM 0 H TYR A 140 10.398 8.326 3.294 1.00 0.47 H new ATOM 0 HA TYR A 140 9.140 9.970 1.237 1.00 0.53 H new ATOM 0 HB2 TYR A 140 11.383 10.967 2.960 1.00 0.60 H new ATOM 0 HB3 TYR A 140 9.928 11.795 2.440 1.00 0.60 H new ATOM 0 HD1 TYR A 140 7.803 11.497 3.694 1.00 1.37 H new ATOM 0 HD2 TYR A 140 11.405 9.627 4.985 1.00 1.33 H new ATOM 0 HE1 TYR A 140 6.803 11.092 5.902 1.00 1.42 H new ATOM 0 HE2 TYR A 140 10.404 9.207 7.183 1.00 1.38 H new ATOM 0 HH TYR A 140 8.635 9.431 8.482 1.00 0.92 H new ATOM 2401 N GLY A 141 12.142 8.784 1.003 1.00 0.43 N ATOM 2402 CA GLY A 141 13.289 8.711 0.125 1.00 0.42 C ATOM 2403 C GLY A 141 14.446 7.955 0.742 1.00 0.38 C ATOM 2404 O GLY A 141 14.250 7.113 1.620 1.00 0.37 O ATOM 0 H GLY A 141 12.115 8.082 1.742 1.00 0.43 H new ATOM 0 HA2 GLY A 141 12.998 8.226 -0.807 1.00 0.42 H new ATOM 0 HA3 GLY A 141 13.613 9.720 -0.128 1.00 0.42 H new ATOM 2408 N LEU A 142 15.655 8.262 0.291 1.00 0.38 N ATOM 2409 CA LEU A 142 16.851 7.608 0.793 1.00 0.37 C ATOM 2410 C LEU A 142 17.667 8.579 1.630 1.00 0.38 C ATOM 2411 O LEU A 142 17.513 9.786 1.510 1.00 0.54 O ATOM 2412 CB LEU A 142 17.715 7.117 -0.367 1.00 0.40 C ATOM 2413 CG LEU A 142 17.095 6.065 -1.280 1.00 0.47 C ATOM 2414 CD1 LEU A 142 18.186 5.268 -1.975 1.00 0.85 C ATOM 2415 CD2 LEU A 142 16.168 5.143 -0.505 1.00 0.50 C ATOM 0 H LEU A 142 15.831 8.965 -0.427 1.00 0.38 H new ATOM 0 HA LEU A 142 16.543 6.760 1.405 1.00 0.37 H new ATOM 0 HB2 LEU A 142 17.989 7.978 -0.976 1.00 0.40 H new ATOM 0 HB3 LEU A 142 18.639 6.710 0.044 1.00 0.40 H new ATOM 0 HG LEU A 142 16.498 6.577 -2.035 1.00 0.47 H new ATOM 0 HD11 LEU A 142 17.732 4.520 -2.625 1.00 0.85 H new ATOM 0 HD12 LEU A 142 18.803 5.940 -2.571 1.00 0.85 H new ATOM 0 HD13 LEU A 142 18.806 4.772 -1.228 1.00 0.85 H new ATOM 0 HD21 LEU A 142 15.741 4.403 -1.182 1.00 0.50 H new ATOM 0 HD22 LEU A 142 16.731 4.635 0.278 1.00 0.50 H new ATOM 0 HD23 LEU A 142 15.366 5.728 -0.054 1.00 0.50 H new ATOM 2427 N PHE A 143 18.518 8.052 2.486 1.00 0.37 N ATOM 2428 CA PHE A 143 19.375 8.889 3.312 1.00 0.39 C ATOM 2429 C PHE A 143 20.826 8.439 3.214 1.00 0.40 C ATOM 2430 O PHE A 143 21.209 7.423 3.791 1.00 0.40 O ATOM 2431 CB PHE A 143 18.929 8.859 4.772 1.00 0.41 C ATOM 2432 CG PHE A 143 17.664 9.619 5.044 1.00 0.44 C ATOM 2433 CD1 PHE A 143 17.690 10.996 5.198 1.00 1.30 C ATOM 2434 CD2 PHE A 143 16.453 8.958 5.157 1.00 1.26 C ATOM 2435 CE1 PHE A 143 16.529 11.697 5.461 1.00 1.34 C ATOM 2436 CE2 PHE A 143 15.289 9.655 5.417 1.00 1.28 C ATOM 2437 CZ PHE A 143 15.327 11.026 5.570 1.00 0.58 C ATOM 0 H PHE A 143 18.637 7.049 2.631 1.00 0.37 H new ATOM 0 HA PHE A 143 19.292 9.910 2.940 1.00 0.39 H new ATOM 0 HB2 PHE A 143 18.789 7.822 5.076 1.00 0.41 H new ATOM 0 HB3 PHE A 143 19.726 9.268 5.392 1.00 0.41 H new ATOM 0 HD1 PHE A 143 18.627 11.526 5.112 1.00 1.30 H new ATOM 0 HD2 PHE A 143 16.418 7.885 5.041 1.00 1.26 H new ATOM 0 HE1 PHE A 143 16.561 12.770 5.581 1.00 1.34 H new ATOM 0 HE2 PHE A 143 14.350 9.128 5.500 1.00 1.28 H new ATOM 0 HZ PHE A 143 14.419 11.573 5.775 1.00 0.58 H new ATOM 2447 N LYS A 144 21.623 9.192 2.476 1.00 0.42 N ATOM 2448 CA LYS A 144 23.037 8.892 2.311 1.00 0.45 C ATOM 2449 C LYS A 144 23.852 9.812 3.207 1.00 0.56 C ATOM 2450 O LYS A 144 23.892 11.021 2.983 1.00 0.64 O ATOM 2451 CB LYS A 144 23.462 9.064 0.845 1.00 0.55 C ATOM 2452 CG LYS A 144 24.954 9.310 0.643 1.00 0.80 C ATOM 2453 CD LYS A 144 25.794 8.104 1.040 1.00 0.97 C ATOM 2454 CE LYS A 144 26.444 7.454 -0.169 1.00 1.96 C ATOM 2455 NZ LYS A 144 27.460 8.335 -0.806 1.00 2.30 N ATOM 0 H LYS A 144 21.312 10.025 1.976 1.00 0.42 H new ATOM 0 HA LYS A 144 23.216 7.855 2.594 1.00 0.45 H new ATOM 0 HB2 LYS A 144 23.176 8.171 0.290 1.00 0.55 H new ATOM 0 HB3 LYS A 144 22.908 9.898 0.415 1.00 0.55 H new ATOM 0 HG2 LYS A 144 25.142 9.553 -0.403 1.00 0.80 H new ATOM 0 HG3 LYS A 144 25.261 10.174 1.232 1.00 0.80 H new ATOM 0 HD2 LYS A 144 26.565 8.413 1.746 1.00 0.97 H new ATOM 0 HD3 LYS A 144 25.166 7.375 1.552 1.00 0.97 H new ATOM 0 HE2 LYS A 144 26.916 6.519 0.134 1.00 1.96 H new ATOM 0 HE3 LYS A 144 25.676 7.202 -0.900 1.00 1.96 H new ATOM 0 HZ1 LYS A 144 28.102 7.760 -1.388 1.00 2.30 H new ATOM 0 HZ2 LYS A 144 26.983 9.037 -1.407 1.00 2.30 H new ATOM 0 HZ3 LYS A 144 28.006 8.825 -0.069 1.00 2.30 H new ATOM 2469 N ASN A 145 24.474 9.242 4.235 1.00 0.62 N ATOM 2470 CA ASN A 145 25.292 10.017 5.170 1.00 0.81 C ATOM 2471 C ASN A 145 24.474 11.162 5.773 1.00 0.99 C ATOM 2472 O ASN A 145 24.933 12.305 5.838 1.00 1.97 O ATOM 2473 CB ASN A 145 26.537 10.566 4.455 1.00 0.92 C ATOM 2474 CG ASN A 145 27.768 10.567 5.340 1.00 1.20 C ATOM 2475 OD1 ASN A 145 27.671 10.638 6.565 1.00 1.57 O ATOM 2476 ND2 ASN A 145 28.939 10.483 4.724 1.00 1.70 N ATOM 0 H ASN A 145 24.429 8.245 4.444 1.00 0.62 H new ATOM 0 HA ASN A 145 25.614 9.361 5.979 1.00 0.81 H new ATOM 0 HB2 ASN A 145 26.734 9.967 3.566 1.00 0.92 H new ATOM 0 HB3 ASN A 145 26.337 11.583 4.116 1.00 0.92 H new ATOM 0 HD21 ASN A 145 29.802 10.476 5.268 1.00 1.70 H new ATOM 0 HD22 ASN A 145 28.977 10.426 3.706 1.00 1.70 H new ATOM 2483 N GLN A 146 23.239 10.836 6.175 1.00 0.56 N ATOM 2484 CA GLN A 146 22.301 11.792 6.782 1.00 0.58 C ATOM 2485 C GLN A 146 21.711 12.755 5.746 1.00 0.55 C ATOM 2486 O GLN A 146 20.902 13.617 6.082 1.00 0.60 O ATOM 2487 CB GLN A 146 22.960 12.587 7.918 1.00 0.66 C ATOM 2488 CG GLN A 146 23.236 11.773 9.169 1.00 1.54 C ATOM 2489 CD GLN A 146 21.980 11.538 9.976 1.00 2.42 C ATOM 2490 OE1 GLN A 146 21.694 12.245 10.944 1.00 2.97 O ATOM 2491 NE2 GLN A 146 21.210 10.552 9.568 1.00 3.02 N ATOM 0 H GLN A 146 22.859 9.894 6.088 1.00 0.56 H new ATOM 0 HA GLN A 146 21.486 11.200 7.199 1.00 0.58 H new ATOM 0 HB2 GLN A 146 23.899 13.006 7.556 1.00 0.66 H new ATOM 0 HB3 GLN A 146 22.316 13.427 8.179 1.00 0.66 H new ATOM 0 HG2 GLN A 146 23.673 10.814 8.889 1.00 1.54 H new ATOM 0 HG3 GLN A 146 23.972 12.291 9.784 1.00 1.54 H new ATOM 0 HE21 GLN A 146 21.484 9.991 8.762 1.00 3.02 H new ATOM 0 HE22 GLN A 146 20.339 10.349 10.058 1.00 3.02 H new ATOM 2500 N THR A 147 22.107 12.600 4.492 1.00 0.51 N ATOM 2501 CA THR A 147 21.613 13.454 3.421 1.00 0.52 C ATOM 2502 C THR A 147 20.476 12.773 2.661 1.00 0.47 C ATOM 2503 O THR A 147 20.653 11.680 2.123 1.00 0.46 O ATOM 2504 CB THR A 147 22.747 13.804 2.441 1.00 0.56 C ATOM 2505 OG1 THR A 147 23.849 14.363 3.167 1.00 0.64 O ATOM 2506 CG2 THR A 147 22.279 14.783 1.375 1.00 0.62 C ATOM 0 H THR A 147 22.772 11.888 4.189 1.00 0.51 H new ATOM 0 HA THR A 147 21.235 14.370 3.875 1.00 0.52 H new ATOM 0 HB THR A 147 23.060 12.889 1.939 1.00 0.56 H new ATOM 0 HG1 THR A 147 24.572 14.585 2.544 1.00 0.64 H new ATOM 0 HG21 THR A 147 23.105 15.008 0.700 1.00 0.62 H new ATOM 0 HG22 THR A 147 21.459 14.341 0.810 1.00 0.62 H new ATOM 0 HG23 THR A 147 21.938 15.703 1.850 1.00 0.62 H new ATOM 2514 N LEU A 148 19.308 13.408 2.642 1.00 0.47 N ATOM 2515 CA LEU A 148 18.157 12.856 1.940 1.00 0.44 C ATOM 2516 C LEU A 148 18.392 12.845 0.436 1.00 0.44 C ATOM 2517 O LEU A 148 18.852 13.828 -0.151 1.00 0.50 O ATOM 2518 CB LEU A 148 16.879 13.643 2.251 1.00 0.47 C ATOM 2519 CG LEU A 148 15.626 13.162 1.517 1.00 0.49 C ATOM 2520 CD1 LEU A 148 15.191 11.809 2.039 1.00 0.58 C ATOM 2521 CD2 LEU A 148 14.502 14.167 1.668 1.00 0.78 C ATOM 0 H LEU A 148 19.135 14.301 3.103 1.00 0.47 H new ATOM 0 HA LEU A 148 18.029 11.832 2.291 1.00 0.44 H new ATOM 0 HB2 LEU A 148 16.693 13.595 3.324 1.00 0.47 H new ATOM 0 HB3 LEU A 148 17.047 14.691 2.003 1.00 0.47 H new ATOM 0 HG LEU A 148 15.867 13.066 0.458 1.00 0.49 H new ATOM 0 HD11 LEU A 148 14.298 11.483 1.505 1.00 0.58 H new ATOM 0 HD12 LEU A 148 15.991 11.085 1.884 1.00 0.58 H new ATOM 0 HD13 LEU A 148 14.970 11.884 3.104 1.00 0.58 H new ATOM 0 HD21 LEU A 148 13.619 13.808 1.139 1.00 0.78 H new ATOM 0 HD22 LEU A 148 14.266 14.293 2.725 1.00 0.78 H new ATOM 0 HD23 LEU A 148 14.811 15.124 1.249 1.00 0.78 H new ATOM 2533 N VAL A 149 18.081 11.717 -0.163 1.00 0.40 N ATOM 2534 CA VAL A 149 18.226 11.521 -1.592 1.00 0.41 C ATOM 2535 C VAL A 149 16.893 11.067 -2.178 1.00 0.39 C ATOM 2536 O VAL A 149 16.344 10.043 -1.763 1.00 0.43 O ATOM 2537 CB VAL A 149 19.314 10.471 -1.912 1.00 0.44 C ATOM 2538 CG1 VAL A 149 19.537 10.360 -3.413 1.00 0.52 C ATOM 2539 CG2 VAL A 149 20.616 10.804 -1.195 1.00 0.48 C ATOM 0 H VAL A 149 17.717 10.902 0.330 1.00 0.40 H new ATOM 0 HA VAL A 149 18.530 12.469 -2.036 1.00 0.41 H new ATOM 0 HB VAL A 149 18.965 9.504 -1.550 1.00 0.44 H new ATOM 0 HG11 VAL A 149 20.307 9.615 -3.612 1.00 0.52 H new ATOM 0 HG12 VAL A 149 18.608 10.060 -3.898 1.00 0.52 H new ATOM 0 HG13 VAL A 149 19.856 11.325 -3.806 1.00 0.52 H new ATOM 0 HG21 VAL A 149 21.367 10.051 -1.435 1.00 0.48 H new ATOM 0 HG22 VAL A 149 20.969 11.784 -1.517 1.00 0.48 H new ATOM 0 HG23 VAL A 149 20.446 10.816 -0.118 1.00 0.48 H new ATOM 2549 N PRO A 150 16.339 11.840 -3.125 1.00 0.40 N ATOM 2550 CA PRO A 150 15.060 11.510 -3.758 1.00 0.42 C ATOM 2551 C PRO A 150 15.155 10.282 -4.666 1.00 0.35 C ATOM 2552 O PRO A 150 16.247 9.795 -4.967 1.00 0.42 O ATOM 2553 CB PRO A 150 14.724 12.761 -4.574 1.00 0.53 C ATOM 2554 CG PRO A 150 16.023 13.449 -4.806 1.00 0.68 C ATOM 2555 CD PRO A 150 16.911 13.099 -3.644 1.00 0.48 C ATOM 0 HA PRO A 150 14.299 11.255 -3.020 1.00 0.42 H new ATOM 0 HB2 PRO A 150 14.246 12.497 -5.518 1.00 0.53 H new ATOM 0 HB3 PRO A 150 14.030 13.406 -4.035 1.00 0.53 H new ATOM 0 HG2 PRO A 150 16.470 13.125 -5.746 1.00 0.68 H new ATOM 0 HG3 PRO A 150 15.883 14.528 -4.875 1.00 0.68 H new ATOM 0 HD2 PRO A 150 17.946 12.968 -3.958 1.00 0.48 H new ATOM 0 HD3 PRO A 150 16.905 13.883 -2.886 1.00 0.48 H new ATOM 2563 N LEU A 151 14.003 9.788 -5.090 1.00 0.43 N ATOM 2564 CA LEU A 151 13.928 8.619 -5.953 1.00 0.40 C ATOM 2565 C LEU A 151 13.760 9.007 -7.423 1.00 0.39 C ATOM 2566 O LEU A 151 13.194 10.050 -7.744 1.00 0.56 O ATOM 2567 CB LEU A 151 12.791 7.663 -5.525 1.00 0.62 C ATOM 2568 CG LEU A 151 11.473 8.272 -4.989 1.00 0.87 C ATOM 2569 CD1 LEU A 151 11.624 8.765 -3.556 1.00 1.11 C ATOM 2570 CD2 LEU A 151 10.957 9.387 -5.887 1.00 1.31 C ATOM 0 H LEU A 151 13.095 10.185 -4.847 1.00 0.43 H new ATOM 0 HA LEU A 151 14.877 8.094 -5.844 1.00 0.40 H new ATOM 0 HB2 LEU A 151 12.542 7.039 -6.384 1.00 0.62 H new ATOM 0 HB3 LEU A 151 13.187 7.001 -4.755 1.00 0.62 H new ATOM 0 HG LEU A 151 10.734 7.471 -4.994 1.00 0.87 H new ATOM 0 HD11 LEU A 151 10.678 9.186 -3.214 1.00 1.11 H new ATOM 0 HD12 LEU A 151 11.904 7.931 -2.912 1.00 1.11 H new ATOM 0 HD13 LEU A 151 12.398 9.531 -3.515 1.00 1.11 H new ATOM 0 HD21 LEU A 151 10.031 9.787 -5.475 1.00 1.31 H new ATOM 0 HD22 LEU A 151 11.701 10.181 -5.945 1.00 1.31 H new ATOM 0 HD23 LEU A 151 10.769 8.992 -6.886 1.00 1.31 H new ATOM 2582 N LYS A 152 14.294 8.175 -8.305 1.00 0.40 N ATOM 2583 CA LYS A 152 14.187 8.399 -9.740 1.00 0.53 C ATOM 2584 C LYS A 152 13.664 7.138 -10.414 1.00 0.50 C ATOM 2585 O LYS A 152 14.066 6.798 -11.527 1.00 0.58 O ATOM 2586 CB LYS A 152 15.540 8.776 -10.339 1.00 0.72 C ATOM 2587 CG LYS A 152 16.251 9.900 -9.605 1.00 0.84 C ATOM 2588 CD LYS A 152 17.588 9.432 -9.065 1.00 1.45 C ATOM 2589 CE LYS A 152 17.526 9.157 -7.574 1.00 1.66 C ATOM 2590 NZ LYS A 152 18.724 8.424 -7.087 1.00 2.55 N ATOM 0 H LYS A 152 14.809 7.333 -8.050 1.00 0.40 H new ATOM 0 HA LYS A 152 13.495 9.224 -9.909 1.00 0.53 H new ATOM 0 HB2 LYS A 152 16.182 7.895 -10.342 1.00 0.72 H new ATOM 0 HB3 LYS A 152 15.396 9.069 -11.379 1.00 0.72 H new ATOM 0 HG2 LYS A 152 16.402 10.743 -10.280 1.00 0.84 H new ATOM 0 HG3 LYS A 152 15.627 10.256 -8.785 1.00 0.84 H new ATOM 0 HD2 LYS A 152 17.896 8.527 -9.589 1.00 1.45 H new ATOM 0 HD3 LYS A 152 18.346 10.189 -9.264 1.00 1.45 H new ATOM 0 HE2 LYS A 152 17.436 10.101 -7.036 1.00 1.66 H new ATOM 0 HE3 LYS A 152 16.631 8.576 -7.350 1.00 1.66 H new ATOM 0 HZ1 LYS A 152 18.572 8.125 -6.103 1.00 2.55 H new ATOM 0 HZ2 LYS A 152 18.884 7.587 -7.682 1.00 2.55 H new ATOM 0 HZ3 LYS A 152 19.555 9.047 -7.135 1.00 2.55 H new ATOM 2604 N ILE A 153 12.762 6.449 -9.731 1.00 0.43 N ATOM 2605 CA ILE A 153 12.196 5.205 -10.245 1.00 0.43 C ATOM 2606 C ILE A 153 10.699 5.132 -10.011 1.00 0.45 C ATOM 2607 O ILE A 153 10.134 5.932 -9.263 1.00 0.48 O ATOM 2608 CB ILE A 153 12.822 3.955 -9.585 1.00 0.39 C ATOM 2609 CG1 ILE A 153 12.529 3.932 -8.079 1.00 0.38 C ATOM 2610 CG2 ILE A 153 14.316 3.886 -9.856 1.00 0.42 C ATOM 2611 CD1 ILE A 153 13.593 4.587 -7.233 1.00 0.40 C ATOM 0 H ILE A 153 12.404 6.729 -8.818 1.00 0.43 H new ATOM 0 HA ILE A 153 12.418 5.210 -11.312 1.00 0.43 H new ATOM 0 HB ILE A 153 12.365 3.071 -10.030 1.00 0.39 H new ATOM 0 HG12 ILE A 153 11.577 4.432 -7.897 1.00 0.38 H new ATOM 0 HG13 ILE A 153 12.412 2.897 -7.759 1.00 0.38 H new ATOM 0 HG21 ILE A 153 14.731 2.997 -9.381 1.00 0.42 H new ATOM 0 HG22 ILE A 153 14.489 3.837 -10.931 1.00 0.42 H new ATOM 0 HG23 ILE A 153 14.801 4.774 -9.451 1.00 0.42 H new ATOM 0 HD11 ILE A 153 13.310 4.528 -6.182 1.00 0.40 H new ATOM 0 HD12 ILE A 153 14.543 4.074 -7.382 1.00 0.40 H new ATOM 0 HD13 ILE A 153 13.696 5.633 -7.523 1.00 0.40 H new ATOM 2623 N THR A 154 10.072 4.153 -10.643 1.00 0.47 N ATOM 2624 CA THR A 154 8.644 3.939 -10.489 1.00 0.52 C ATOM 2625 C THR A 154 8.310 2.440 -10.472 1.00 0.53 C ATOM 2626 O THR A 154 7.184 2.048 -10.156 1.00 0.74 O ATOM 2627 CB THR A 154 7.839 4.655 -11.605 1.00 0.61 C ATOM 2628 OG1 THR A 154 6.525 4.969 -11.131 1.00 0.70 O ATOM 2629 CG2 THR A 154 7.730 3.804 -12.864 1.00 0.71 C ATOM 0 H THR A 154 10.532 3.492 -11.269 1.00 0.47 H new ATOM 0 HA THR A 154 8.354 4.371 -9.531 1.00 0.52 H new ATOM 0 HB THR A 154 8.376 5.569 -11.861 1.00 0.61 H new ATOM 0 HG1 THR A 154 6.021 5.422 -11.839 1.00 0.70 H new ATOM 0 HG21 THR A 154 7.159 4.343 -13.619 1.00 0.71 H new ATOM 0 HG22 THR A 154 8.728 3.591 -13.247 1.00 0.71 H new ATOM 0 HG23 THR A 154 7.225 2.867 -12.627 1.00 0.71 H new ATOM 2637 N THR A 155 9.295 1.604 -10.792 1.00 0.45 N ATOM 2638 CA THR A 155 9.086 0.164 -10.818 1.00 0.46 C ATOM 2639 C THR A 155 9.908 -0.532 -9.737 1.00 0.42 C ATOM 2640 O THR A 155 10.973 -0.048 -9.358 1.00 0.40 O ATOM 2641 CB THR A 155 9.464 -0.416 -12.196 1.00 0.51 C ATOM 2642 OG1 THR A 155 9.103 0.512 -13.228 1.00 0.62 O ATOM 2643 CG2 THR A 155 8.769 -1.749 -12.437 1.00 0.56 C ATOM 0 H THR A 155 10.240 1.900 -11.035 1.00 0.45 H new ATOM 0 HA THR A 155 8.028 -0.015 -10.627 1.00 0.46 H new ATOM 0 HB THR A 155 10.541 -0.583 -12.214 1.00 0.51 H new ATOM 0 HG1 THR A 155 9.346 0.141 -14.102 1.00 0.62 H new ATOM 0 HG21 THR A 155 9.053 -2.136 -13.416 1.00 0.56 H new ATOM 0 HG22 THR A 155 9.067 -2.459 -11.666 1.00 0.56 H new ATOM 0 HG23 THR A 155 7.689 -1.608 -12.402 1.00 0.56 H new ATOM 2651 N GLU A 156 9.398 -1.661 -9.246 1.00 0.44 N ATOM 2652 CA GLU A 156 10.074 -2.448 -8.214 1.00 0.43 C ATOM 2653 C GLU A 156 11.514 -2.768 -8.616 1.00 0.41 C ATOM 2654 O GLU A 156 12.449 -2.553 -7.843 1.00 0.39 O ATOM 2655 CB GLU A 156 9.323 -3.759 -7.966 1.00 0.50 C ATOM 2656 CG GLU A 156 7.840 -3.589 -7.692 1.00 0.53 C ATOM 2657 CD GLU A 156 7.143 -4.918 -7.481 1.00 1.06 C ATOM 2658 OE1 GLU A 156 7.395 -5.567 -6.447 1.00 1.72 O ATOM 2659 OE2 GLU A 156 6.352 -5.329 -8.354 1.00 1.75 O ATOM 0 H GLU A 156 8.508 -2.055 -9.551 1.00 0.44 H new ATOM 0 HA GLU A 156 10.086 -1.851 -7.302 1.00 0.43 H new ATOM 0 HB2 GLU A 156 9.448 -4.405 -8.835 1.00 0.50 H new ATOM 0 HB3 GLU A 156 9.780 -4.271 -7.119 1.00 0.50 H new ATOM 0 HG2 GLU A 156 7.704 -2.965 -6.809 1.00 0.53 H new ATOM 0 HG3 GLU A 156 7.375 -3.065 -8.527 1.00 0.53 H new ATOM 2666 N LYS A 157 11.674 -3.286 -9.827 1.00 0.44 N ATOM 2667 CA LYS A 157 12.991 -3.639 -10.349 1.00 0.44 C ATOM 2668 C LYS A 157 13.899 -2.417 -10.385 1.00 0.40 C ATOM 2669 O LYS A 157 15.040 -2.450 -9.920 1.00 0.39 O ATOM 2670 CB LYS A 157 12.864 -4.229 -11.751 1.00 0.49 C ATOM 2671 CG LYS A 157 11.981 -5.466 -11.820 1.00 0.69 C ATOM 2672 CD LYS A 157 12.804 -6.745 -11.804 1.00 1.05 C ATOM 2673 CE LYS A 157 13.573 -6.928 -13.106 1.00 1.58 C ATOM 2674 NZ LYS A 157 14.257 -8.245 -13.175 1.00 2.00 N ATOM 0 H LYS A 157 10.905 -3.472 -10.470 1.00 0.44 H new ATOM 0 HA LYS A 157 13.432 -4.384 -9.687 1.00 0.44 H new ATOM 0 HB2 LYS A 157 12.461 -3.469 -12.420 1.00 0.49 H new ATOM 0 HB3 LYS A 157 13.858 -4.483 -12.120 1.00 0.49 H new ATOM 0 HG2 LYS A 157 11.290 -5.467 -10.977 1.00 0.69 H new ATOM 0 HG3 LYS A 157 11.378 -5.433 -12.727 1.00 0.69 H new ATOM 0 HD2 LYS A 157 13.503 -6.719 -10.968 1.00 1.05 H new ATOM 0 HD3 LYS A 157 12.147 -7.600 -11.644 1.00 1.05 H new ATOM 0 HE2 LYS A 157 12.887 -6.833 -13.947 1.00 1.58 H new ATOM 0 HE3 LYS A 157 14.311 -6.132 -13.205 1.00 1.58 H new ATOM 0 HZ1 LYS A 157 14.767 -8.324 -14.078 1.00 2.00 H new ATOM 0 HZ2 LYS A 157 14.932 -8.327 -12.388 1.00 2.00 H new ATOM 0 HZ3 LYS A 157 13.552 -9.006 -13.108 1.00 2.00 H new ATOM 2688 N GLU A 158 13.380 -1.333 -10.926 1.00 0.41 N ATOM 2689 CA GLU A 158 14.141 -0.105 -11.018 1.00 0.39 C ATOM 2690 C GLU A 158 14.524 0.370 -9.623 1.00 0.35 C ATOM 2691 O GLU A 158 15.626 0.871 -9.405 1.00 0.34 O ATOM 2692 CB GLU A 158 13.327 0.957 -11.747 1.00 0.43 C ATOM 2693 CG GLU A 158 14.138 1.750 -12.753 1.00 0.53 C ATOM 2694 CD GLU A 158 14.752 0.866 -13.819 1.00 1.06 C ATOM 2695 OE1 GLU A 158 14.043 0.515 -14.785 1.00 1.71 O ATOM 2696 OE2 GLU A 158 15.941 0.508 -13.694 1.00 1.71 O ATOM 0 H GLU A 158 12.436 -1.278 -11.308 1.00 0.41 H new ATOM 0 HA GLU A 158 15.054 -0.286 -11.584 1.00 0.39 H new ATOM 0 HB2 GLU A 158 12.494 0.477 -12.260 1.00 0.43 H new ATOM 0 HB3 GLU A 158 12.899 1.642 -11.015 1.00 0.43 H new ATOM 0 HG2 GLU A 158 13.498 2.495 -13.226 1.00 0.53 H new ATOM 0 HG3 GLU A 158 14.928 2.292 -12.233 1.00 0.53 H new ATOM 2703 N LEU A 159 13.609 0.184 -8.679 1.00 0.35 N ATOM 2704 CA LEU A 159 13.839 0.573 -7.300 1.00 0.32 C ATOM 2705 C LEU A 159 14.969 -0.245 -6.687 1.00 0.31 C ATOM 2706 O LEU A 159 15.930 0.319 -6.171 1.00 0.30 O ATOM 2707 CB LEU A 159 12.571 0.394 -6.471 1.00 0.34 C ATOM 2708 CG LEU A 159 12.733 0.685 -4.980 1.00 0.36 C ATOM 2709 CD1 LEU A 159 13.014 2.155 -4.743 1.00 0.55 C ATOM 2710 CD2 LEU A 159 11.498 0.254 -4.224 1.00 0.41 C ATOM 0 H LEU A 159 12.696 -0.237 -8.849 1.00 0.35 H new ATOM 0 HA LEU A 159 14.122 1.626 -7.295 1.00 0.32 H new ATOM 0 HB2 LEU A 159 11.796 1.048 -6.872 1.00 0.34 H new ATOM 0 HB3 LEU A 159 12.217 -0.630 -6.590 1.00 0.34 H new ATOM 0 HG LEU A 159 13.585 0.114 -4.611 1.00 0.36 H new ATOM 0 HD11 LEU A 159 13.125 2.336 -3.674 1.00 0.55 H new ATOM 0 HD12 LEU A 159 13.933 2.437 -5.257 1.00 0.55 H new ATOM 0 HD13 LEU A 159 12.186 2.750 -5.128 1.00 0.55 H new ATOM 0 HD21 LEU A 159 11.628 0.467 -3.163 1.00 0.41 H new ATOM 0 HD22 LEU A 159 10.632 0.799 -4.600 1.00 0.41 H new ATOM 0 HD23 LEU A 159 11.342 -0.816 -4.362 1.00 0.41 H new ATOM 2722 N ILE A 160 14.856 -1.573 -6.751 1.00 0.33 N ATOM 2723 CA ILE A 160 15.888 -2.440 -6.190 1.00 0.34 C ATOM 2724 C ILE A 160 17.238 -2.141 -6.837 1.00 0.33 C ATOM 2725 O ILE A 160 18.268 -2.124 -6.158 1.00 0.33 O ATOM 2726 CB ILE A 160 15.537 -3.942 -6.305 1.00 0.38 C ATOM 2727 CG1 ILE A 160 15.160 -4.317 -7.730 1.00 0.40 C ATOM 2728 CG2 ILE A 160 14.407 -4.286 -5.348 1.00 0.43 C ATOM 2729 CD1 ILE A 160 16.271 -5.006 -8.494 1.00 0.42 C ATOM 0 H ILE A 160 14.071 -2.064 -7.180 1.00 0.33 H new ATOM 0 HA ILE A 160 15.948 -2.221 -5.124 1.00 0.34 H new ATOM 0 HB ILE A 160 16.422 -4.519 -6.035 1.00 0.38 H new ATOM 0 HG12 ILE A 160 14.289 -4.971 -7.705 1.00 0.40 H new ATOM 0 HG13 ILE A 160 14.867 -3.415 -8.268 1.00 0.40 H new ATOM 0 HG21 ILE A 160 14.166 -5.345 -5.435 1.00 0.43 H new ATOM 0 HG22 ILE A 160 14.716 -4.067 -4.326 1.00 0.43 H new ATOM 0 HG23 ILE A 160 13.527 -3.692 -5.596 1.00 0.43 H new ATOM 0 HD11 ILE A 160 15.928 -5.242 -9.501 1.00 0.42 H new ATOM 0 HD12 ILE A 160 17.137 -4.346 -8.551 1.00 0.42 H new ATOM 0 HD13 ILE A 160 16.550 -5.926 -7.980 1.00 0.42 H new ATOM 2741 N LYS A 161 17.235 -1.898 -8.147 1.00 0.34 N ATOM 2742 CA LYS A 161 18.463 -1.565 -8.858 1.00 0.35 C ATOM 2743 C LYS A 161 19.001 -0.221 -8.369 1.00 0.34 C ATOM 2744 O LYS A 161 20.205 -0.057 -8.170 1.00 0.37 O ATOM 2745 CB LYS A 161 18.215 -1.514 -10.359 1.00 0.41 C ATOM 2746 CG LYS A 161 17.968 -2.876 -10.979 1.00 0.78 C ATOM 2747 CD LYS A 161 17.337 -2.748 -12.353 1.00 1.43 C ATOM 2748 CE LYS A 161 18.291 -2.094 -13.339 1.00 1.61 C ATOM 2749 NZ LYS A 161 17.575 -1.440 -14.463 1.00 2.63 N ATOM 0 H LYS A 161 16.400 -1.926 -8.732 1.00 0.34 H new ATOM 0 HA LYS A 161 19.203 -2.340 -8.656 1.00 0.35 H new ATOM 0 HB2 LYS A 161 17.355 -0.873 -10.555 1.00 0.41 H new ATOM 0 HB3 LYS A 161 19.074 -1.053 -10.846 1.00 0.41 H new ATOM 0 HG2 LYS A 161 18.910 -3.419 -11.058 1.00 0.78 H new ATOM 0 HG3 LYS A 161 17.316 -3.461 -10.330 1.00 0.78 H new ATOM 0 HD2 LYS A 161 17.053 -3.735 -12.718 1.00 1.43 H new ATOM 0 HD3 LYS A 161 16.423 -2.159 -12.282 1.00 1.43 H new ATOM 0 HE2 LYS A 161 18.898 -1.354 -12.818 1.00 1.61 H new ATOM 0 HE3 LYS A 161 18.974 -2.846 -13.734 1.00 1.61 H new ATOM 0 HZ1 LYS A 161 18.205 -0.751 -14.922 1.00 2.63 H new ATOM 0 HZ2 LYS A 161 17.285 -2.160 -15.156 1.00 2.63 H new ATOM 0 HZ3 LYS A 161 16.732 -0.950 -14.100 1.00 2.63 H new ATOM 2763 N GLU A 162 18.091 0.733 -8.179 1.00 0.33 N ATOM 2764 CA GLU A 162 18.440 2.063 -7.685 1.00 0.35 C ATOM 2765 C GLU A 162 18.994 1.957 -6.261 1.00 0.34 C ATOM 2766 O GLU A 162 19.882 2.716 -5.864 1.00 0.37 O ATOM 2767 CB GLU A 162 17.192 2.959 -7.726 1.00 0.36 C ATOM 2768 CG GLU A 162 17.345 4.328 -7.069 1.00 0.66 C ATOM 2769 CD GLU A 162 18.069 5.339 -7.938 1.00 0.92 C ATOM 2770 OE1 GLU A 162 17.520 5.728 -8.988 1.00 1.62 O ATOM 2771 OE2 GLU A 162 19.178 5.776 -7.562 1.00 1.73 O ATOM 0 H GLU A 162 17.096 0.606 -8.362 1.00 0.33 H new ATOM 0 HA GLU A 162 19.210 2.506 -8.316 1.00 0.35 H new ATOM 0 HB2 GLU A 162 16.905 3.105 -8.767 1.00 0.36 H new ATOM 0 HB3 GLU A 162 16.371 2.432 -7.240 1.00 0.36 H new ATOM 0 HG2 GLU A 162 16.357 4.716 -6.821 1.00 0.66 H new ATOM 0 HG3 GLU A 162 17.887 4.213 -6.130 1.00 0.66 H new ATOM 2778 N LEU A 163 18.472 1.000 -5.496 1.00 0.32 N ATOM 2779 CA LEU A 163 18.918 0.780 -4.127 1.00 0.33 C ATOM 2780 C LEU A 163 20.260 0.058 -4.096 1.00 0.34 C ATOM 2781 O LEU A 163 21.037 0.218 -3.155 1.00 0.36 O ATOM 2782 CB LEU A 163 17.888 -0.045 -3.359 1.00 0.33 C ATOM 2783 CG LEU A 163 16.522 0.612 -3.182 1.00 0.35 C ATOM 2784 CD1 LEU A 163 15.533 -0.377 -2.592 1.00 0.35 C ATOM 2785 CD2 LEU A 163 16.635 1.847 -2.305 1.00 0.46 C ATOM 0 H LEU A 163 17.737 0.364 -5.805 1.00 0.32 H new ATOM 0 HA LEU A 163 19.032 1.756 -3.656 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.751 -0.995 -3.875 1.00 0.33 H new ATOM 0 HB3 LEU A 163 18.293 -0.273 -2.373 1.00 0.33 H new ATOM 0 HG LEU A 163 16.156 0.922 -4.161 1.00 0.35 H new ATOM 0 HD11 LEU A 163 14.563 0.106 -2.472 1.00 0.35 H new ATOM 0 HD12 LEU A 163 15.432 -1.233 -3.260 1.00 0.35 H new ATOM 0 HD13 LEU A 163 15.893 -0.716 -1.620 1.00 0.35 H new ATOM 0 HD21 LEU A 163 15.652 2.303 -2.190 1.00 0.46 H new ATOM 0 HD22 LEU A 163 17.021 1.564 -1.326 1.00 0.46 H new ATOM 0 HD23 LEU A 163 17.314 2.562 -2.769 1.00 0.46 H new ATOM 2797 N GLY A 164 20.536 -0.713 -5.138 1.00 0.33 N ATOM 2798 CA GLY A 164 21.781 -1.450 -5.205 1.00 0.35 C ATOM 2799 C GLY A 164 21.617 -2.897 -4.778 1.00 0.37 C ATOM 2800 O GLY A 164 22.545 -3.501 -4.239 1.00 0.43 O ATOM 0 H GLY A 164 19.919 -0.841 -5.940 1.00 0.33 H new ATOM 0 HA2 GLY A 164 22.167 -1.416 -6.224 1.00 0.35 H new ATOM 0 HA3 GLY A 164 22.521 -0.967 -4.567 1.00 0.35 H new ATOM 2804 N PHE A 165 20.438 -3.460 -5.015 1.00 0.35 N ATOM 2805 CA PHE A 165 20.161 -4.842 -4.641 1.00 0.38 C ATOM 2806 C PHE A 165 19.583 -5.625 -5.811 1.00 0.41 C ATOM 2807 O PHE A 165 19.438 -5.101 -6.917 1.00 0.45 O ATOM 2808 CB PHE A 165 19.187 -4.904 -3.462 1.00 0.38 C ATOM 2809 CG PHE A 165 19.718 -4.296 -2.199 1.00 0.37 C ATOM 2810 CD1 PHE A 165 20.776 -4.883 -1.521 1.00 1.23 C ATOM 2811 CD2 PHE A 165 19.158 -3.140 -1.685 1.00 1.23 C ATOM 2812 CE1 PHE A 165 21.265 -4.327 -0.357 1.00 1.25 C ATOM 2813 CE2 PHE A 165 19.642 -2.579 -0.521 1.00 1.25 C ATOM 2814 CZ PHE A 165 20.697 -3.173 0.146 1.00 0.48 C ATOM 0 H PHE A 165 19.658 -2.981 -5.465 1.00 0.35 H new ATOM 0 HA PHE A 165 21.109 -5.293 -4.348 1.00 0.38 H new ATOM 0 HB2 PHE A 165 18.265 -4.393 -3.739 1.00 0.38 H new ATOM 0 HB3 PHE A 165 18.930 -5.946 -3.271 1.00 0.38 H new ATOM 0 HD1 PHE A 165 21.223 -5.787 -1.909 1.00 1.23 H new ATOM 0 HD2 PHE A 165 18.333 -2.671 -2.201 1.00 1.23 H new ATOM 0 HE1 PHE A 165 22.091 -4.793 0.160 1.00 1.25 H new ATOM 0 HE2 PHE A 165 19.197 -1.676 -0.131 1.00 1.25 H new ATOM 0 HZ PHE A 165 21.076 -2.736 1.058 1.00 0.48 H new ATOM 2824 N THR A 166 19.271 -6.887 -5.554 1.00 0.47 N ATOM 2825 CA THR A 166 18.701 -7.773 -6.554 1.00 0.52 C ATOM 2826 C THR A 166 17.209 -7.978 -6.280 1.00 0.51 C ATOM 2827 O THR A 166 16.760 -7.854 -5.139 1.00 0.51 O ATOM 2828 CB THR A 166 19.431 -9.137 -6.568 1.00 0.61 C ATOM 2829 OG1 THR A 166 19.015 -9.919 -7.696 1.00 1.46 O ATOM 2830 CG2 THR A 166 19.173 -9.917 -5.284 1.00 1.43 C ATOM 0 H THR A 166 19.407 -7.325 -4.643 1.00 0.47 H new ATOM 0 HA THR A 166 18.827 -7.310 -7.533 1.00 0.52 H new ATOM 0 HB THR A 166 20.500 -8.936 -6.642 1.00 0.61 H new ATOM 0 HG1 THR A 166 19.487 -10.778 -7.691 1.00 1.46 H new ATOM 0 HG21 THR A 166 19.700 -10.870 -5.325 1.00 1.43 H new ATOM 0 HG22 THR A 166 19.531 -9.341 -4.430 1.00 1.43 H new ATOM 0 HG23 THR A 166 18.103 -10.098 -5.177 1.00 1.43 H new ATOM 2838 N TYR A 167 16.438 -8.244 -7.325 1.00 0.55 N ATOM 2839 CA TYR A 167 15.010 -8.467 -7.168 1.00 0.57 C ATOM 2840 C TYR A 167 14.718 -9.947 -6.997 1.00 0.57 C ATOM 2841 O TYR A 167 14.986 -10.749 -7.891 1.00 0.67 O ATOM 2842 CB TYR A 167 14.230 -7.928 -8.367 1.00 0.68 C ATOM 2843 CG TYR A 167 12.736 -7.883 -8.131 1.00 0.74 C ATOM 2844 CD1 TYR A 167 12.203 -7.102 -7.117 1.00 1.43 C ATOM 2845 CD2 TYR A 167 11.864 -8.622 -8.918 1.00 1.41 C ATOM 2846 CE1 TYR A 167 10.839 -7.059 -6.890 1.00 1.49 C ATOM 2847 CE2 TYR A 167 10.500 -8.585 -8.700 1.00 1.49 C ATOM 2848 CZ TYR A 167 9.991 -7.802 -7.684 1.00 0.95 C ATOM 2849 OH TYR A 167 8.630 -7.762 -7.463 1.00 1.08 O ATOM 0 H TYR A 167 16.776 -8.310 -8.285 1.00 0.55 H new ATOM 0 HA TYR A 167 14.690 -7.930 -6.275 1.00 0.57 H new ATOM 0 HB2 TYR A 167 14.585 -6.925 -8.603 1.00 0.68 H new ATOM 0 HB3 TYR A 167 14.436 -8.552 -9.237 1.00 0.68 H new ATOM 0 HD1 TYR A 167 12.864 -6.517 -6.494 1.00 1.43 H new ATOM 0 HD2 TYR A 167 12.258 -9.236 -9.714 1.00 1.41 H new ATOM 0 HE1 TYR A 167 10.440 -6.447 -6.095 1.00 1.49 H new ATOM 0 HE2 TYR A 167 9.835 -9.166 -9.322 1.00 1.49 H new ATOM 0 HH TYR A 167 8.418 -7.019 -6.860 1.00 1.08 H new ATOM 2859 N ARG A 168 14.180 -10.303 -5.846 1.00 0.58 N ATOM 2860 CA ARG A 168 13.834 -11.683 -5.556 1.00 0.64 C ATOM 2861 C ARG A 168 12.323 -11.834 -5.506 1.00 0.61 C ATOM 2862 O ARG A 168 11.606 -10.866 -5.241 1.00 0.65 O ATOM 2863 CB ARG A 168 14.446 -12.113 -4.226 1.00 0.78 C ATOM 2864 CG ARG A 168 15.960 -12.197 -4.247 1.00 1.05 C ATOM 2865 CD ARG A 168 16.443 -13.297 -5.175 1.00 1.59 C ATOM 2866 NE ARG A 168 17.895 -13.450 -5.128 1.00 2.25 N ATOM 2867 CZ ARG A 168 18.609 -14.104 -6.040 1.00 3.01 C ATOM 2868 NH1 ARG A 168 18.017 -14.663 -7.090 1.00 3.43 N ATOM 2869 NH2 ARG A 168 19.923 -14.189 -5.906 1.00 3.74 N ATOM 0 H ARG A 168 13.971 -9.650 -5.091 1.00 0.58 H new ATOM 0 HA ARG A 168 14.232 -12.321 -6.345 1.00 0.64 H new ATOM 0 HB2 ARG A 168 14.141 -11.409 -3.452 1.00 0.78 H new ATOM 0 HB3 ARG A 168 14.041 -13.086 -3.948 1.00 0.78 H new ATOM 0 HG2 ARG A 168 16.374 -11.241 -4.568 1.00 1.05 H new ATOM 0 HG3 ARG A 168 16.329 -12.382 -3.238 1.00 1.05 H new ATOM 0 HD2 ARG A 168 15.969 -14.239 -4.899 1.00 1.59 H new ATOM 0 HD3 ARG A 168 16.134 -13.072 -6.196 1.00 1.59 H new ATOM 0 HE ARG A 168 18.394 -13.028 -4.345 1.00 2.25 H new ATOM 0 HH11 ARG A 168 17.006 -14.593 -7.203 1.00 3.43 H new ATOM 0 HH12 ARG A 168 18.574 -15.162 -7.784 1.00 3.43 H new ATOM 0 HH21 ARG A 168 20.383 -13.754 -5.106 1.00 3.74 H new ATOM 0 HH22 ARG A 168 20.475 -14.689 -6.602 1.00 3.74 H new ATOM 2883 N ILE A 169 11.831 -13.033 -5.780 1.00 0.63 N ATOM 2884 CA ILE A 169 10.400 -13.272 -5.755 1.00 0.61 C ATOM 2885 C ILE A 169 9.940 -13.585 -4.335 1.00 0.59 C ATOM 2886 O ILE A 169 10.523 -14.424 -3.645 1.00 0.56 O ATOM 2887 CB ILE A 169 9.979 -14.404 -6.721 1.00 0.63 C ATOM 2888 CG1 ILE A 169 10.485 -15.767 -6.235 1.00 0.61 C ATOM 2889 CG2 ILE A 169 10.499 -14.112 -8.120 1.00 0.71 C ATOM 2890 CD1 ILE A 169 9.976 -16.928 -7.056 1.00 0.67 C ATOM 0 H ILE A 169 12.397 -13.847 -6.020 1.00 0.63 H new ATOM 0 HA ILE A 169 9.913 -12.359 -6.097 1.00 0.61 H new ATOM 0 HB ILE A 169 8.890 -14.444 -6.746 1.00 0.63 H new ATOM 0 HG12 ILE A 169 11.575 -15.769 -6.255 1.00 0.61 H new ATOM 0 HG13 ILE A 169 10.185 -15.908 -5.197 1.00 0.61 H new ATOM 0 HG21 ILE A 169 10.198 -14.914 -8.795 1.00 0.71 H new ATOM 0 HG22 ILE A 169 10.085 -13.167 -8.472 1.00 0.71 H new ATOM 0 HG23 ILE A 169 11.587 -14.046 -8.097 1.00 0.71 H new ATOM 0 HD11 ILE A 169 10.375 -17.860 -6.655 1.00 0.67 H new ATOM 0 HD12 ILE A 169 8.887 -16.952 -7.016 1.00 0.67 H new ATOM 0 HD13 ILE A 169 10.299 -16.811 -8.091 1.00 0.67 H new ATOM 2902 N PRO A 170 8.873 -12.924 -3.886 1.00 0.65 N ATOM 2903 CA PRO A 170 8.342 -13.105 -2.530 1.00 0.69 C ATOM 2904 C PRO A 170 7.820 -14.514 -2.281 1.00 0.63 C ATOM 2905 O PRO A 170 7.775 -14.982 -1.144 1.00 0.66 O ATOM 2906 CB PRO A 170 7.205 -12.091 -2.473 1.00 0.83 C ATOM 2907 CG PRO A 170 6.814 -11.846 -3.882 1.00 0.83 C ATOM 2908 CD PRO A 170 8.085 -11.949 -4.666 1.00 0.76 C ATOM 0 HA PRO A 170 9.108 -12.961 -1.768 1.00 0.69 H new ATOM 0 HB2 PRO A 170 6.365 -12.477 -1.895 1.00 0.83 H new ATOM 0 HB3 PRO A 170 7.527 -11.168 -1.990 1.00 0.83 H new ATOM 0 HG2 PRO A 170 6.082 -12.579 -4.221 1.00 0.83 H new ATOM 0 HG3 PRO A 170 6.358 -10.863 -3.999 1.00 0.83 H new ATOM 0 HD2 PRO A 170 7.905 -12.296 -5.684 1.00 0.76 H new ATOM 0 HD3 PRO A 170 8.592 -10.987 -4.742 1.00 0.76 H new ATOM 2916 N LYS A 171 7.446 -15.178 -3.360 1.00 0.62 N ATOM 2917 CA LYS A 171 6.915 -16.529 -3.309 1.00 0.63 C ATOM 2918 C LYS A 171 7.904 -17.519 -2.703 1.00 0.63 C ATOM 2919 O LYS A 171 7.503 -18.501 -2.082 1.00 0.73 O ATOM 2920 CB LYS A 171 6.537 -16.957 -4.722 1.00 0.65 C ATOM 2921 CG LYS A 171 5.283 -16.260 -5.225 1.00 0.76 C ATOM 2922 CD LYS A 171 5.619 -15.139 -6.191 1.00 0.79 C ATOM 2923 CE LYS A 171 6.051 -15.695 -7.532 1.00 0.81 C ATOM 2924 NZ LYS A 171 4.886 -16.123 -8.349 1.00 1.03 N ATOM 0 H LYS A 171 7.502 -14.793 -4.303 1.00 0.62 H new ATOM 0 HA LYS A 171 6.038 -16.529 -2.662 1.00 0.63 H new ATOM 0 HB2 LYS A 171 7.365 -16.741 -5.397 1.00 0.65 H new ATOM 0 HB3 LYS A 171 6.382 -18.036 -4.742 1.00 0.65 H new ATOM 0 HG2 LYS A 171 4.636 -16.985 -5.718 1.00 0.76 H new ATOM 0 HG3 LYS A 171 4.725 -15.858 -4.379 1.00 0.76 H new ATOM 0 HD2 LYS A 171 4.750 -14.494 -6.323 1.00 0.79 H new ATOM 0 HD3 LYS A 171 6.415 -14.521 -5.775 1.00 0.79 H new ATOM 0 HE2 LYS A 171 6.618 -14.938 -8.074 1.00 0.81 H new ATOM 0 HE3 LYS A 171 6.718 -16.543 -7.377 1.00 0.81 H new ATOM 0 HZ1 LYS A 171 5.206 -16.371 -9.307 1.00 1.03 H new ATOM 0 HZ2 LYS A 171 4.439 -16.952 -7.908 1.00 1.03 H new ATOM 0 HZ3 LYS A 171 4.197 -15.346 -8.404 1.00 1.03 H new ATOM 2938 N LYS A 172 9.190 -17.266 -2.885 1.00 0.59 N ATOM 2939 CA LYS A 172 10.214 -18.158 -2.357 1.00 0.66 C ATOM 2940 C LYS A 172 10.876 -17.612 -1.091 1.00 0.70 C ATOM 2941 O LYS A 172 11.848 -18.197 -0.605 1.00 0.80 O ATOM 2942 CB LYS A 172 11.252 -18.450 -3.440 1.00 0.70 C ATOM 2943 CG LYS A 172 10.957 -19.715 -4.219 1.00 0.77 C ATOM 2944 CD LYS A 172 9.501 -19.762 -4.646 1.00 0.71 C ATOM 2945 CE LYS A 172 9.199 -21.008 -5.455 1.00 0.82 C ATOM 2946 NZ LYS A 172 9.188 -22.230 -4.605 1.00 1.16 N ATOM 0 H LYS A 172 9.550 -16.456 -3.391 1.00 0.59 H new ATOM 0 HA LYS A 172 9.725 -19.088 -2.066 1.00 0.66 H new ATOM 0 HB2 LYS A 172 11.296 -17.607 -4.130 1.00 0.70 H new ATOM 0 HB3 LYS A 172 12.236 -18.535 -2.979 1.00 0.70 H new ATOM 0 HG2 LYS A 172 11.600 -19.763 -5.098 1.00 0.77 H new ATOM 0 HG3 LYS A 172 11.189 -20.586 -3.606 1.00 0.77 H new ATOM 0 HD2 LYS A 172 8.861 -19.736 -3.764 1.00 0.71 H new ATOM 0 HD3 LYS A 172 9.265 -18.877 -5.237 1.00 0.71 H new ATOM 0 HE2 LYS A 172 8.232 -20.898 -5.945 1.00 0.82 H new ATOM 0 HE3 LYS A 172 9.944 -21.120 -6.242 1.00 0.82 H new ATOM 0 HZ1 LYS A 172 8.912 -23.051 -5.181 1.00 1.16 H new ATOM 0 HZ2 LYS A 172 10.138 -22.387 -4.211 1.00 1.16 H new ATOM 0 HZ3 LYS A 172 8.507 -22.107 -3.829 1.00 1.16 H new ATOM 2960 N ARG A 173 10.332 -16.508 -0.556 1.00 0.68 N ATOM 2961 CA ARG A 173 10.845 -15.880 0.673 1.00 0.76 C ATOM 2962 C ARG A 173 12.227 -15.249 0.463 1.00 0.61 C ATOM 2963 O ARG A 173 13.164 -15.926 0.034 1.00 0.97 O ATOM 2964 CB ARG A 173 10.891 -16.915 1.808 1.00 1.36 C ATOM 2965 CG ARG A 173 11.486 -16.392 3.103 1.00 1.98 C ATOM 2966 CD ARG A 173 10.547 -15.414 3.787 1.00 2.47 C ATOM 2967 NE ARG A 173 9.245 -16.013 4.063 1.00 2.99 N ATOM 2968 CZ ARG A 173 8.920 -16.601 5.216 1.00 3.79 C ATOM 2969 NH1 ARG A 173 9.809 -16.681 6.201 1.00 4.07 N ATOM 2970 NH2 ARG A 173 7.705 -17.110 5.377 1.00 4.60 N ATOM 0 H ARG A 173 9.528 -16.027 -0.960 1.00 0.68 H new ATOM 0 HA ARG A 173 10.163 -15.074 0.946 1.00 0.76 H new ATOM 0 HB2 ARG A 173 9.879 -17.269 2.003 1.00 1.36 H new ATOM 0 HB3 ARG A 173 11.471 -17.776 1.476 1.00 1.36 H new ATOM 0 HG2 ARG A 173 11.696 -17.226 3.772 1.00 1.98 H new ATOM 0 HG3 ARG A 173 12.437 -15.902 2.897 1.00 1.98 H new ATOM 0 HD2 ARG A 173 10.995 -15.073 4.720 1.00 2.47 H new ATOM 0 HD3 ARG A 173 10.416 -14.535 3.156 1.00 2.47 H new ATOM 0 HE ARG A 173 8.539 -15.980 3.328 1.00 2.99 H new ATOM 0 HH11 ARG A 173 10.744 -16.292 6.077 1.00 4.07 H new ATOM 0 HH12 ARG A 173 9.556 -17.131 7.081 1.00 4.07 H new ATOM 0 HH21 ARG A 173 7.023 -17.051 4.621 1.00 4.60 H new ATOM 0 HH22 ARG A 173 7.453 -17.560 6.257 1.00 4.60 H new ATOM 2984 N LEU A 174 12.355 -13.958 0.815 1.00 0.60 N ATOM 2985 CA LEU A 174 13.607 -13.226 0.649 1.00 1.13 C ATOM 2986 C LEU A 174 14.117 -13.346 -0.779 1.00 1.70 C ATOM 2987 O LEU A 174 15.336 -13.554 -0.964 1.00 2.14 O ATOM 2988 CB LEU A 174 14.664 -13.726 1.636 1.00 1.32 C ATOM 2989 CG LEU A 174 14.743 -12.953 2.952 1.00 1.64 C ATOM 2990 CD1 LEU A 174 13.550 -13.279 3.833 1.00 1.79 C ATOM 2991 CD2 LEU A 174 16.045 -13.259 3.672 1.00 2.09 C ATOM 2992 OXT LEU A 174 13.289 -13.261 -1.704 1.00 2.37 O ATOM 0 H LEU A 174 11.599 -13.404 1.217 1.00 0.60 H new ATOM 0 HA LEU A 174 13.412 -12.174 0.858 1.00 1.13 H new ATOM 0 HB2 LEU A 174 14.462 -14.773 1.860 1.00 1.32 H new ATOM 0 HB3 LEU A 174 15.639 -13.686 1.151 1.00 1.32 H new ATOM 0 HG LEU A 174 14.720 -11.886 2.729 1.00 1.64 H new ATOM 0 HD11 LEU A 174 13.623 -12.720 4.766 1.00 1.79 H new ATOM 0 HD12 LEU A 174 12.630 -13.005 3.316 1.00 1.79 H new ATOM 0 HD13 LEU A 174 13.539 -14.347 4.050 1.00 1.79 H new ATOM 0 HD21 LEU A 174 16.084 -12.700 4.607 1.00 2.09 H new ATOM 0 HD22 LEU A 174 16.101 -14.327 3.885 1.00 2.09 H new ATOM 0 HD23 LEU A 174 16.886 -12.970 3.041 1.00 2.09 H new