USER MOD reduce.3.24.130724 H: found=0, std=0, add=1978, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1974 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: B 47 THR OG1 : rot 121:sc= 0.383 USER MOD Set 1.2: B 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: B 28 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 73 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 20 ASN : amide:sc= -1.53 K(o=-2.6,f=-5) USER MOD Set 3.2: B 125 ASN :FLIP amide:sc= -1.08 F(o=-3.6,f=-2.6) USER MOD Set 4.1: A 28 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 73 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 47 THR OG1 : rot 122:sc= 0.367 USER MOD Set 5.2: A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 20 ASN : amide:sc= -1.64 K(o=-2.7,f=-5) USER MOD Set 6.2: A 125 ASN :FLIP amide:sc= -1.03 F(o=-4.3,f=-2.7) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc=-0.00123 K(o=-0.0012,f=-1.8) USER MOD Single : A 3 SER OG : rot 39:sc= 0.708 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.579 USER MOD Single : A 12 GLN : amide:sc= -0.0403 K(o=-0.04,f=-1.5!) USER MOD Single : A 14 SER OG : rot -89:sc= 1.18 USER MOD Single : A 15 GLN : amide:sc= -0.0548 X(o=-0.055,f=-0.36) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 75:sc= -0.872 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 HIS : no HD1:sc= -1.33 K(o=-1.3,f=-1.9) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -1.27 USER MOD Single : A 35 ASN : amide:sc= -1.54 K(o=-1.5,f=-5.2!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 90:sc= -0.955 USER MOD Single : A 49 ASN :FLIP amide:sc= -0.128 F(o=-1.1,f=-0.13) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl 166:sc= -6.09! (180deg=-6.48!) USER MOD Single : A 74 CYS SG : rot 162:sc= 0.704 USER MOD Single : A 76 THR OG1 : rot -9:sc= 0.421! USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.169 K(o=-0.17,f=-2!) USER MOD Single : A 86 ASN :FLIP amide:sc= -0.0211 F(o=-0.74,f=-0.021) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.031 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -0.582 K(o=-0.58,f=-3.1!) USER MOD Single : A 96 THR OG1 : rot 41:sc= -1.09 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.409 K(o=-0.41,f=-3.3!) USER MOD Single : A 110 GLN : amide:sc= -0.0141 K(o=-0.014,f=-0.69) USER MOD Single : A 114 MET CE :methyl -155:sc= -0.0382 (180deg=-0.556) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc=-0.00529 X(o=-0.0053,f=0.38) USER MOD Single : A 124 TYR OH : rot -178:sc= 0.0105 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Single : B 3 SER OG : rot 38:sc= 0.711 USER MOD Single : B 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 11 THR OG1 : rot 180:sc= -0.58 USER MOD Single : B 12 GLN : amide:sc= -0.0506 K(o=-0.051,f=-1.6!) USER MOD Single : B 14 SER OG : rot -100:sc= 1.09 USER MOD Single : B 15 GLN : amide:sc= -0.0689 X(o=-0.069,f=-0.27) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 TYR OH : rot 43:sc= -0.873 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-1.9!) USER MOD Single : B 29 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 THR OG1 : rot 180:sc= -1.28 USER MOD Single : B 35 ASN : amide:sc= -1.57 K(o=-1.6,f=-5!) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 THR OG1 : rot 90:sc= -0.926 USER MOD Single : B 49 ASN :FLIP amide:sc= -0.132 F(o=-1.1,f=-0.13) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 CYS SG : rot 180:sc= 0 USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 MET CE :methyl 164:sc= -6.2! (180deg=-6.55!) USER MOD Single : B 74 CYS SG : rot 159:sc= 0.733 USER MOD Single : B 76 THR OG1 : rot -7:sc= 0.716! USER MOD Single : B 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 81 THR OG1 : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= -0.191 K(o=-0.19,f=-1.9!) USER MOD Single : B 86 ASN :FLIP amide:sc= -0.0215 F(o=-0.73,f=-0.021) USER MOD Single : B 90 THR OG1 : rot 180:sc= -0.0334 USER MOD Single : B 94 THR OG1 : rot 180:sc= 0 USER MOD Single : B 95 ASN : amide:sc= -0.571 K(o=-0.57,f=-3.4!) USER MOD Single : B 96 THR OG1 : rot -90:sc= -1.06 USER MOD Single : B 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 GLN : amide:sc= -0.386 K(o=-0.39,f=-3.2!) USER MOD Single : B 110 GLN : amide:sc= -0.015 K(o=-0.015,f=-0.58) USER MOD Single : B 114 MET CE :methyl -157:sc= -0.0487 (180deg=-0.567) USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 119 ASN : amide:sc=-0.00705 X(o=-0.007,f=0.43) USER MOD Single : B 124 TYR OH : rot -168:sc= 0.00857 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -41.694 2.285 -5.587 1.00 0.00 N ATOM 2 CA ALA A 1 -41.261 0.937 -6.037 1.00 0.00 C ATOM 3 C ALA A 1 -41.341 0.816 -7.556 1.00 0.00 C ATOM 4 O ALA A 1 -42.361 0.397 -8.103 1.00 0.00 O ATOM 5 CB ALA A 1 -42.113 -0.138 -5.378 1.00 0.00 C ATOM 0 H1 ALA A 1 -41.631 2.342 -4.551 1.00 0.00 H new ATOM 0 H2 ALA A 1 -41.078 3.007 -6.012 1.00 0.00 H new ATOM 0 H3 ALA A 1 -42.677 2.451 -5.883 1.00 0.00 H new ATOM 0 HA ALA A 1 -40.222 0.797 -5.739 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -41.785 -1.121 -5.717 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -42.007 -0.073 -4.295 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -43.158 0.009 -5.650 1.00 0.00 H new ATOM 13 N GLN A 2 -40.257 1.183 -8.231 1.00 0.00 N ATOM 14 CA GLN A 2 -40.204 1.115 -9.687 1.00 0.00 C ATOM 15 C GLN A 2 -38.788 0.815 -10.165 1.00 0.00 C ATOM 16 O GLN A 2 -38.545 -0.194 -10.826 1.00 0.00 O ATOM 17 CB GLN A 2 -40.693 2.429 -10.299 1.00 0.00 C ATOM 18 CG GLN A 2 -42.174 2.425 -10.639 1.00 0.00 C ATOM 19 CD GLN A 2 -42.470 1.715 -11.945 1.00 0.00 C ATOM 20 OE1 GLN A 2 -41.721 0.835 -12.369 1.00 0.00 O ATOM 21 NE2 GLN A 2 -43.567 2.095 -12.590 1.00 0.00 N ATOM 0 H GLN A 2 -39.404 1.530 -7.794 1.00 0.00 H new ATOM 0 HA GLN A 2 -40.858 0.306 -10.012 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -40.490 3.243 -9.603 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -40.121 2.634 -11.204 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -42.727 1.942 -9.833 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -42.532 3.453 -10.699 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -44.159 2.829 -12.201 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -43.818 1.653 -13.474 1.00 0.00 H new ATOM 30 N SER A 3 -37.855 1.699 -9.826 1.00 0.00 N ATOM 31 CA SER A 3 -36.462 1.529 -10.219 1.00 0.00 C ATOM 32 C SER A 3 -35.549 2.416 -9.379 1.00 0.00 C ATOM 33 O SER A 3 -34.910 1.946 -8.440 1.00 0.00 O ATOM 34 CB SER A 3 -36.286 1.857 -11.703 1.00 0.00 C ATOM 35 OG SER A 3 -36.448 0.698 -12.503 1.00 0.00 O ATOM 0 H SER A 3 -38.039 2.540 -9.280 1.00 0.00 H new ATOM 0 HA SER A 3 -36.186 0.488 -10.049 1.00 0.00 H new ATOM 0 HB2 SER A 3 -37.013 2.613 -12.001 1.00 0.00 H new ATOM 0 HB3 SER A 3 -35.297 2.283 -11.870 1.00 0.00 H new ATOM 0 HG SER A 3 -37.179 0.152 -12.144 1.00 0.00 H new ATOM 41 N VAL A 4 -35.496 3.700 -9.730 1.00 0.00 N ATOM 42 CA VAL A 4 -34.667 4.672 -9.021 1.00 0.00 C ATOM 43 C VAL A 4 -33.271 4.120 -8.717 1.00 0.00 C ATOM 44 O VAL A 4 -33.087 3.354 -7.772 1.00 0.00 O ATOM 45 CB VAL A 4 -35.321 5.133 -7.705 1.00 0.00 C ATOM 46 CG1 VAL A 4 -36.463 6.096 -7.988 1.00 0.00 C ATOM 47 CG2 VAL A 4 -35.807 3.945 -6.888 1.00 0.00 C ATOM 0 H VAL A 4 -36.023 4.094 -10.509 1.00 0.00 H new ATOM 0 HA VAL A 4 -34.572 5.528 -9.690 1.00 0.00 H new ATOM 0 HB VAL A 4 -34.566 5.655 -7.117 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -36.914 6.412 -7.047 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -36.081 6.968 -8.518 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -37.214 5.599 -8.602 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -36.264 4.301 -5.965 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -36.543 3.384 -7.464 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -34.963 3.298 -6.649 1.00 0.00 H new ATOM 57 N PRO A 5 -32.261 4.514 -9.512 1.00 0.00 N ATOM 58 CA PRO A 5 -30.882 4.059 -9.319 1.00 0.00 C ATOM 59 C PRO A 5 -30.219 4.717 -8.108 1.00 0.00 C ATOM 60 O PRO A 5 -30.226 5.940 -7.979 1.00 0.00 O ATOM 61 CB PRO A 5 -30.186 4.496 -10.607 1.00 0.00 C ATOM 62 CG PRO A 5 -30.958 5.685 -11.066 1.00 0.00 C ATOM 63 CD PRO A 5 -32.385 5.438 -10.654 1.00 0.00 C ATOM 0 HA PRO A 5 -30.827 2.987 -9.128 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -29.141 4.747 -10.427 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -30.199 3.702 -11.354 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -30.574 6.599 -10.612 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -30.880 5.808 -12.146 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -32.886 6.363 -10.369 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -32.966 4.998 -11.465 1.00 0.00 H new ATOM 71 N PRO A 6 -29.632 3.914 -7.200 1.00 0.00 N ATOM 72 CA PRO A 6 -28.967 4.438 -6.001 1.00 0.00 C ATOM 73 C PRO A 6 -27.893 5.468 -6.340 1.00 0.00 C ATOM 74 O PRO A 6 -27.157 5.313 -7.314 1.00 0.00 O ATOM 75 CB PRO A 6 -28.333 3.195 -5.370 1.00 0.00 C ATOM 76 CG PRO A 6 -29.139 2.053 -5.881 1.00 0.00 C ATOM 77 CD PRO A 6 -29.572 2.443 -7.265 1.00 0.00 C ATOM 0 HA PRO A 6 -29.665 4.956 -5.343 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -27.285 3.098 -5.655 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -28.364 3.245 -4.282 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -28.550 1.136 -5.900 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -30.001 1.865 -5.240 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -28.863 2.102 -8.019 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -30.540 2.012 -7.520 1.00 0.00 H new ATOM 85 N GLY A 7 -27.810 6.517 -5.529 1.00 0.00 N ATOM 86 CA GLY A 7 -26.822 7.556 -5.760 1.00 0.00 C ATOM 87 C GLY A 7 -25.401 7.035 -5.678 1.00 0.00 C ATOM 88 O GLY A 7 -25.048 6.322 -4.738 1.00 0.00 O ATOM 0 H GLY A 7 -28.408 6.667 -4.717 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -26.987 7.998 -6.743 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -26.957 8.351 -5.026 1.00 0.00 H new ATOM 92 N ASP A 8 -24.584 7.391 -6.664 1.00 0.00 N ATOM 93 CA ASP A 8 -23.193 6.955 -6.698 1.00 0.00 C ATOM 94 C ASP A 8 -22.497 7.252 -5.373 1.00 0.00 C ATOM 95 O ASP A 8 -22.548 8.375 -4.872 1.00 0.00 O ATOM 96 CB ASP A 8 -22.448 7.641 -7.844 1.00 0.00 C ATOM 97 CG ASP A 8 -23.168 7.496 -9.170 1.00 0.00 C ATOM 98 OD1 ASP A 8 -23.876 6.483 -9.353 1.00 0.00 O ATOM 99 OD2 ASP A 8 -23.024 8.395 -10.026 1.00 0.00 O ATOM 0 H ASP A 8 -24.861 7.980 -7.449 1.00 0.00 H new ATOM 0 HA ASP A 8 -23.181 5.877 -6.861 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -22.327 8.699 -7.613 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -21.447 7.217 -7.929 1.00 0.00 H new ATOM 104 N ILE A 9 -21.851 6.237 -4.809 1.00 0.00 N ATOM 105 CA ILE A 9 -21.148 6.388 -3.540 1.00 0.00 C ATOM 106 C ILE A 9 -19.644 6.509 -3.755 1.00 0.00 C ATOM 107 O ILE A 9 -19.076 5.855 -4.630 1.00 0.00 O ATOM 108 CB ILE A 9 -21.426 5.200 -2.601 1.00 0.00 C ATOM 109 CG1 ILE A 9 -20.926 3.899 -3.228 1.00 0.00 C ATOM 110 CG2 ILE A 9 -22.911 5.108 -2.287 1.00 0.00 C ATOM 111 CD1 ILE A 9 -19.701 3.329 -2.545 1.00 0.00 C ATOM 0 H ILE A 9 -21.800 5.301 -5.211 1.00 0.00 H new ATOM 0 HA ILE A 9 -21.521 7.303 -3.079 1.00 0.00 H new ATOM 0 HB ILE A 9 -20.888 5.361 -1.667 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -21.726 3.159 -3.197 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -20.696 4.076 -4.279 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -23.091 4.263 -1.622 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -23.238 6.028 -1.802 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -23.470 4.967 -3.212 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -19.403 2.407 -3.043 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -18.886 4.050 -2.599 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -19.931 3.119 -1.500 1.00 0.00 H new ATOM 123 N ASN A 10 -19.002 7.348 -2.948 1.00 0.00 N ATOM 124 CA ASN A 10 -17.562 7.554 -3.047 1.00 0.00 C ATOM 125 C ASN A 10 -16.803 6.391 -2.415 1.00 0.00 C ATOM 126 O ASN A 10 -17.288 5.757 -1.478 1.00 0.00 O ATOM 127 CB ASN A 10 -17.166 8.867 -2.367 1.00 0.00 C ATOM 128 CG ASN A 10 -16.551 9.858 -3.335 1.00 0.00 C ATOM 129 OD1 ASN A 10 -15.352 10.133 -3.282 1.00 0.00 O ATOM 130 ND2 ASN A 10 -17.371 10.400 -4.228 1.00 0.00 N ATOM 0 H ASN A 10 -19.457 7.896 -2.218 1.00 0.00 H new ATOM 0 HA ASN A 10 -17.298 7.606 -4.103 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -18.047 9.313 -1.905 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -16.457 8.658 -1.566 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.014 11.073 -4.906 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -18.358 10.143 -4.236 1.00 0.00 H new ATOM 137 N THR A 11 -15.610 6.116 -2.934 1.00 0.00 N ATOM 138 CA THR A 11 -14.787 5.028 -2.418 1.00 0.00 C ATOM 139 C THR A 11 -13.311 5.412 -2.418 1.00 0.00 C ATOM 140 O THR A 11 -12.862 6.198 -3.251 1.00 0.00 O ATOM 141 CB THR A 11 -14.996 3.763 -3.252 1.00 0.00 C ATOM 142 OG1 THR A 11 -15.157 4.085 -4.622 1.00 0.00 O ATOM 143 CG2 THR A 11 -16.205 2.958 -2.824 1.00 0.00 C ATOM 0 H THR A 11 -15.193 6.630 -3.710 1.00 0.00 H new ATOM 0 HA THR A 11 -15.092 4.833 -1.390 1.00 0.00 H new ATOM 0 HB THR A 11 -14.102 3.160 -3.091 1.00 0.00 H new ATOM 0 HG1 THR A 11 -15.288 3.262 -5.138 1.00 0.00 H new ATOM 0 HG21 THR A 11 -16.296 2.074 -3.456 1.00 0.00 H new ATOM 0 HG22 THR A 11 -16.088 2.651 -1.785 1.00 0.00 H new ATOM 0 HG23 THR A 11 -17.102 3.569 -2.923 1.00 0.00 H new ATOM 151 N GLN A 12 -12.561 4.851 -1.474 1.00 0.00 N ATOM 152 CA GLN A 12 -11.134 5.133 -1.361 1.00 0.00 C ATOM 153 C GLN A 12 -10.373 3.896 -0.873 1.00 0.00 C ATOM 154 O GLN A 12 -10.432 3.559 0.309 1.00 0.00 O ATOM 155 CB GLN A 12 -10.902 6.297 -0.396 1.00 0.00 C ATOM 156 CG GLN A 12 -11.446 7.624 -0.900 1.00 0.00 C ATOM 157 CD GLN A 12 -10.471 8.347 -1.807 1.00 0.00 C ATOM 158 OE1 GLN A 12 -9.376 7.853 -2.083 1.00 0.00 O ATOM 159 NE2 GLN A 12 -10.862 9.526 -2.279 1.00 0.00 N ATOM 0 H GLN A 12 -12.918 4.198 -0.776 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.761 5.404 -2.348 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -11.368 6.063 0.561 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.832 6.398 -0.213 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.377 7.449 -1.439 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.685 8.261 -0.049 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.777 9.899 -2.026 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.247 10.058 -2.895 1.00 0.00 H new ATOM 168 N PRO A 13 -9.646 3.195 -1.771 1.00 0.00 N ATOM 169 CA PRO A 13 -9.541 3.550 -3.194 1.00 0.00 C ATOM 170 C PRO A 13 -10.879 3.462 -3.916 1.00 0.00 C ATOM 171 O PRO A 13 -11.806 2.798 -3.451 1.00 0.00 O ATOM 172 CB PRO A 13 -8.563 2.515 -3.758 1.00 0.00 C ATOM 173 CG PRO A 13 -8.611 1.377 -2.799 1.00 0.00 C ATOM 174 CD PRO A 13 -8.865 1.988 -1.451 1.00 0.00 C ATOM 0 HA PRO A 13 -9.212 4.581 -3.327 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.856 2.200 -4.759 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -7.556 2.924 -3.835 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.401 0.675 -3.065 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -7.674 0.820 -2.806 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -9.418 1.311 -0.800 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -7.935 2.234 -0.939 1.00 0.00 H new ATOM 182 N SER A 14 -10.975 4.139 -5.055 1.00 0.00 N ATOM 183 CA SER A 14 -12.200 4.140 -5.844 1.00 0.00 C ATOM 184 C SER A 14 -12.014 3.389 -7.162 1.00 0.00 C ATOM 185 O SER A 14 -12.990 2.997 -7.802 1.00 0.00 O ATOM 186 CB SER A 14 -12.648 5.577 -6.124 1.00 0.00 C ATOM 187 OG SER A 14 -11.835 6.509 -5.433 1.00 0.00 O ATOM 0 H SER A 14 -10.218 4.695 -5.452 1.00 0.00 H new ATOM 0 HA SER A 14 -12.969 3.628 -5.266 1.00 0.00 H new ATOM 0 HB2 SER A 14 -12.602 5.773 -7.195 1.00 0.00 H new ATOM 0 HB3 SER A 14 -13.688 5.702 -5.822 1.00 0.00 H new ATOM 0 HG SER A 14 -12.207 6.669 -4.541 1.00 0.00 H new ATOM 193 N GLN A 15 -10.761 3.194 -7.566 1.00 0.00 N ATOM 194 CA GLN A 15 -10.464 2.493 -8.810 1.00 0.00 C ATOM 195 C GLN A 15 -9.939 1.087 -8.541 1.00 0.00 C ATOM 196 O GLN A 15 -10.380 0.120 -9.163 1.00 0.00 O ATOM 197 CB GLN A 15 -9.444 3.282 -9.633 1.00 0.00 C ATOM 198 CG GLN A 15 -9.805 4.749 -9.806 1.00 0.00 C ATOM 199 CD GLN A 15 -9.752 5.196 -11.254 1.00 0.00 C ATOM 200 OE1 GLN A 15 -10.234 4.499 -12.148 1.00 0.00 O ATOM 201 NE2 GLN A 15 -9.168 6.364 -11.492 1.00 0.00 N ATOM 0 H GLN A 15 -9.939 3.510 -7.052 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.392 2.408 -9.375 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -8.468 3.211 -9.152 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -9.349 2.822 -10.616 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -10.807 4.922 -9.413 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -9.122 5.360 -9.216 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -8.782 6.908 -10.720 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -9.105 6.718 -12.447 1.00 0.00 H new ATOM 210 N LYS A 16 -8.995 0.980 -7.615 1.00 0.00 N ATOM 211 CA LYS A 16 -8.409 -0.311 -7.269 1.00 0.00 C ATOM 212 C LYS A 16 -7.483 -0.193 -6.062 1.00 0.00 C ATOM 213 O LYS A 16 -7.316 0.887 -5.497 1.00 0.00 O ATOM 214 CB LYS A 16 -7.634 -0.874 -8.463 1.00 0.00 C ATOM 215 CG LYS A 16 -6.580 0.076 -9.004 1.00 0.00 C ATOM 216 CD LYS A 16 -5.835 -0.529 -10.182 1.00 0.00 C ATOM 217 CE LYS A 16 -4.457 0.091 -10.347 1.00 0.00 C ATOM 218 NZ LYS A 16 -3.859 -0.233 -11.672 1.00 0.00 N ATOM 0 H LYS A 16 -8.618 1.769 -7.090 1.00 0.00 H new ATOM 0 HA LYS A 16 -9.222 -0.990 -7.011 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -7.153 -1.807 -8.167 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.337 -1.117 -9.260 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.053 1.008 -9.312 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -5.872 0.324 -8.213 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -5.736 -1.605 -10.038 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -6.413 -0.381 -11.094 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -4.530 1.173 -10.236 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -3.800 -0.267 -9.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.920 0.208 -11.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.766 -1.264 -11.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -4.473 0.131 -12.428 1.00 0.00 H new ATOM 232 N ILE A 17 -6.882 -1.315 -5.675 1.00 0.00 N ATOM 233 CA ILE A 17 -5.971 -1.345 -4.536 1.00 0.00 C ATOM 234 C ILE A 17 -4.721 -2.159 -4.856 1.00 0.00 C ATOM 235 O ILE A 17 -4.801 -3.216 -5.481 1.00 0.00 O ATOM 236 CB ILE A 17 -6.651 -1.941 -3.289 1.00 0.00 C ATOM 237 CG1 ILE A 17 -5.686 -1.936 -2.102 1.00 0.00 C ATOM 238 CG2 ILE A 17 -7.139 -3.353 -3.576 1.00 0.00 C ATOM 239 CD1 ILE A 17 -6.374 -2.074 -0.762 1.00 0.00 C ATOM 0 H ILE A 17 -7.010 -2.216 -6.135 1.00 0.00 H new ATOM 0 HA ILE A 17 -5.688 -0.313 -4.328 1.00 0.00 H new ATOM 0 HB ILE A 17 -7.513 -1.324 -3.034 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.973 -2.752 -2.221 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -5.114 -1.008 -2.113 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -7.617 -3.761 -2.685 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -7.857 -3.330 -4.395 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -6.292 -3.981 -3.853 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.628 -2.063 0.033 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -7.067 -1.244 -0.622 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -6.924 -3.015 -0.730 1.00 0.00 H new ATOM 251 N VAL A 18 -3.567 -1.659 -4.424 1.00 0.00 N ATOM 252 CA VAL A 18 -2.301 -2.343 -4.666 1.00 0.00 C ATOM 253 C VAL A 18 -1.583 -2.657 -3.359 1.00 0.00 C ATOM 254 O VAL A 18 -0.808 -1.845 -2.853 1.00 0.00 O ATOM 255 CB VAL A 18 -1.369 -1.501 -5.560 1.00 0.00 C ATOM 256 CG1 VAL A 18 -0.054 -2.228 -5.806 1.00 0.00 C ATOM 257 CG2 VAL A 18 -2.054 -1.164 -6.876 1.00 0.00 C ATOM 0 H VAL A 18 -3.482 -0.785 -3.906 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.541 -3.275 -5.177 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.147 -0.569 -5.041 1.00 0.00 H new ATOM 0 HG11 VAL A 18 0.588 -1.615 -6.439 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.444 -2.411 -4.854 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.251 -3.179 -6.301 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.382 -0.569 -7.494 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.309 -2.085 -7.400 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -2.963 -0.596 -6.678 1.00 0.00 H new ATOM 267 N PHE A 19 -1.840 -3.843 -2.817 1.00 0.00 N ATOM 268 CA PHE A 19 -1.213 -4.265 -1.571 1.00 0.00 C ATOM 269 C PHE A 19 0.305 -4.293 -1.718 1.00 0.00 C ATOM 270 O PHE A 19 0.864 -5.211 -2.316 1.00 0.00 O ATOM 271 CB PHE A 19 -1.726 -5.645 -1.160 1.00 0.00 C ATOM 272 CG PHE A 19 -3.123 -5.625 -0.608 1.00 0.00 C ATOM 273 CD1 PHE A 19 -4.216 -5.535 -1.455 1.00 0.00 C ATOM 274 CD2 PHE A 19 -3.343 -5.696 0.759 1.00 0.00 C ATOM 275 CE1 PHE A 19 -5.503 -5.516 -0.949 1.00 0.00 C ATOM 276 CE2 PHE A 19 -4.627 -5.677 1.270 1.00 0.00 C ATOM 277 CZ PHE A 19 -5.708 -5.587 0.415 1.00 0.00 C ATOM 0 H PHE A 19 -2.478 -4.528 -3.221 1.00 0.00 H new ATOM 0 HA PHE A 19 -1.474 -3.546 -0.794 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.695 -6.308 -2.025 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.054 -6.066 -0.412 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.061 -5.479 -2.522 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.501 -5.767 1.432 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.347 -5.446 -1.620 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -4.785 -5.732 2.337 1.00 0.00 H new ATOM 0 HZ PHE A 19 -6.712 -5.572 0.812 1.00 0.00 H new ATOM 287 N ASN A 20 0.965 -3.274 -1.176 1.00 0.00 N ATOM 288 CA ASN A 20 2.418 -3.174 -1.253 1.00 0.00 C ATOM 289 C ASN A 20 3.097 -4.217 -0.370 1.00 0.00 C ATOM 290 O ASN A 20 2.673 -4.462 0.760 1.00 0.00 O ATOM 291 CB ASN A 20 2.874 -1.772 -0.844 1.00 0.00 C ATOM 292 CG ASN A 20 3.983 -1.243 -1.733 1.00 0.00 C ATOM 293 OD1 ASN A 20 3.787 -1.028 -2.929 1.00 0.00 O ATOM 294 ND2 ASN A 20 5.157 -1.029 -1.150 1.00 0.00 N ATOM 0 H ASN A 20 0.516 -2.505 -0.678 1.00 0.00 H new ATOM 0 HA ASN A 20 2.709 -3.363 -2.286 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.024 -1.091 -0.883 1.00 0.00 H new ATOM 0 HB3 ASN A 20 3.219 -1.792 0.190 1.00 0.00 H new ATOM 0 HD21 ASN A 20 5.941 -0.672 -1.697 1.00 0.00 H new ATOM 0 HD22 ASN A 20 5.275 -1.221 -0.155 1.00 0.00 H new ATOM 301 N ALA A 21 4.159 -4.819 -0.894 1.00 0.00 N ATOM 302 CA ALA A 21 4.913 -5.830 -0.160 1.00 0.00 C ATOM 303 C ALA A 21 5.485 -5.246 1.132 1.00 0.00 C ATOM 304 O ALA A 21 5.478 -4.030 1.320 1.00 0.00 O ATOM 305 CB ALA A 21 6.028 -6.383 -1.036 1.00 0.00 C ATOM 0 H ALA A 21 4.519 -4.624 -1.828 1.00 0.00 H new ATOM 0 HA ALA A 21 4.238 -6.643 0.107 1.00 0.00 H new ATOM 0 HB1 ALA A 21 6.586 -7.137 -0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 21 5.598 -6.834 -1.930 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.699 -5.574 -1.325 1.00 0.00 H new ATOM 311 N PRO A 22 5.991 -6.098 2.049 1.00 0.00 N ATOM 312 CA PRO A 22 6.032 -7.550 1.893 1.00 0.00 C ATOM 313 C PRO A 22 4.761 -8.226 2.393 1.00 0.00 C ATOM 314 O PRO A 22 3.963 -7.622 3.111 1.00 0.00 O ATOM 315 CB PRO A 22 7.230 -7.966 2.761 1.00 0.00 C ATOM 316 CG PRO A 22 7.634 -6.749 3.545 1.00 0.00 C ATOM 317 CD PRO A 22 6.573 -5.703 3.329 1.00 0.00 C ATOM 0 HA PRO A 22 6.118 -7.843 0.847 1.00 0.00 H new ATOM 0 HB2 PRO A 22 6.960 -8.785 3.428 1.00 0.00 H new ATOM 0 HB3 PRO A 22 8.054 -8.319 2.141 1.00 0.00 H new ATOM 0 HG2 PRO A 22 7.727 -6.988 4.604 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.606 -6.384 3.214 1.00 0.00 H new ATOM 0 HD2 PRO A 22 5.833 -5.706 4.129 1.00 0.00 H new ATOM 0 HD3 PRO A 22 6.996 -4.699 3.289 1.00 0.00 H new ATOM 325 N TYR A 23 4.585 -9.483 2.008 1.00 0.00 N ATOM 326 CA TYR A 23 3.416 -10.254 2.412 1.00 0.00 C ATOM 327 C TYR A 23 3.757 -11.203 3.555 1.00 0.00 C ATOM 328 O TYR A 23 3.408 -12.383 3.522 1.00 0.00 O ATOM 329 CB TYR A 23 2.867 -11.041 1.225 1.00 0.00 C ATOM 330 CG TYR A 23 2.234 -10.164 0.170 1.00 0.00 C ATOM 331 CD1 TYR A 23 1.195 -9.303 0.495 1.00 0.00 C ATOM 332 CD2 TYR A 23 2.678 -10.194 -1.145 1.00 0.00 C ATOM 333 CE1 TYR A 23 0.616 -8.494 -0.463 1.00 0.00 C ATOM 334 CE2 TYR A 23 2.105 -9.387 -2.108 1.00 0.00 C ATOM 335 CZ TYR A 23 1.074 -8.539 -1.762 1.00 0.00 C ATOM 336 OH TYR A 23 0.499 -7.735 -2.718 1.00 0.00 O ATOM 0 H TYR A 23 5.239 -9.992 1.414 1.00 0.00 H new ATOM 0 HA TYR A 23 2.654 -9.557 2.761 1.00 0.00 H new ATOM 0 HB2 TYR A 23 3.676 -11.615 0.773 1.00 0.00 H new ATOM 0 HB3 TYR A 23 2.128 -11.758 1.583 1.00 0.00 H new ATOM 0 HD1 TYR A 23 0.834 -9.265 1.512 1.00 0.00 H new ATOM 0 HD2 TYR A 23 3.484 -10.859 -1.419 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -0.192 -7.829 -0.195 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.462 -9.420 -3.127 1.00 0.00 H new ATOM 0 HH TYR A 23 0.806 -6.812 -2.597 1.00 0.00 H new ATOM 346 N ASP A 24 4.438 -10.677 4.568 1.00 0.00 N ATOM 347 CA ASP A 24 4.824 -11.474 5.725 1.00 0.00 C ATOM 348 C ASP A 24 4.220 -10.917 7.016 1.00 0.00 C ATOM 349 O ASP A 24 4.468 -11.446 8.100 1.00 0.00 O ATOM 350 CB ASP A 24 6.348 -11.526 5.847 1.00 0.00 C ATOM 351 CG ASP A 24 7.010 -12.074 4.598 1.00 0.00 C ATOM 352 OD1 ASP A 24 6.783 -11.509 3.508 1.00 0.00 O ATOM 353 OD2 ASP A 24 7.755 -13.070 4.710 1.00 0.00 O ATOM 0 H ASP A 24 4.734 -9.702 4.610 1.00 0.00 H new ATOM 0 HA ASP A 24 4.437 -12.482 5.576 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.728 -10.524 6.046 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.620 -12.146 6.701 1.00 0.00 H new ATOM 358 N ASP A 25 3.429 -9.850 6.902 1.00 0.00 N ATOM 359 CA ASP A 25 2.803 -9.241 8.071 1.00 0.00 C ATOM 360 C ASP A 25 1.366 -8.832 7.768 1.00 0.00 C ATOM 361 O ASP A 25 1.022 -8.537 6.624 1.00 0.00 O ATOM 362 CB ASP A 25 3.607 -8.023 8.528 1.00 0.00 C ATOM 363 CG ASP A 25 3.550 -6.885 7.528 1.00 0.00 C ATOM 364 OD1 ASP A 25 2.963 -7.076 6.442 1.00 0.00 O ATOM 365 OD2 ASP A 25 4.092 -5.801 7.830 1.00 0.00 O ATOM 0 H ASP A 25 3.209 -9.393 6.017 1.00 0.00 H new ATOM 0 HA ASP A 25 2.789 -9.980 8.872 1.00 0.00 H new ATOM 0 HB2 ASP A 25 3.225 -7.678 9.489 1.00 0.00 H new ATOM 0 HB3 ASP A 25 4.646 -8.314 8.684 1.00 0.00 H new ATOM 370 N LYS A 26 0.530 -8.814 8.802 1.00 0.00 N ATOM 371 CA LYS A 26 -0.870 -8.438 8.646 1.00 0.00 C ATOM 372 C LYS A 26 -0.993 -6.991 8.177 1.00 0.00 C ATOM 373 O LYS A 26 -0.519 -6.071 8.841 1.00 0.00 O ATOM 374 CB LYS A 26 -1.620 -8.625 9.968 1.00 0.00 C ATOM 375 CG LYS A 26 -2.259 -9.996 10.115 1.00 0.00 C ATOM 376 CD LYS A 26 -3.704 -9.890 10.578 1.00 0.00 C ATOM 377 CE LYS A 26 -4.102 -11.078 11.440 1.00 0.00 C ATOM 378 NZ LYS A 26 -5.446 -10.893 12.053 1.00 0.00 N ATOM 0 H LYS A 26 0.798 -9.055 9.756 1.00 0.00 H new ATOM 0 HA LYS A 26 -1.314 -9.086 7.890 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.928 -8.465 10.795 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.394 -7.862 10.048 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.219 -10.522 9.161 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.689 -10.590 10.830 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.839 -8.968 11.143 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.362 -9.832 9.711 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.101 -11.983 10.833 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -3.361 -11.221 12.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -5.681 -11.724 12.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.440 -10.043 12.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.158 -10.782 11.303 1.00 0.00 H new ATOM 392 N HIS A 27 -1.631 -6.798 7.028 1.00 0.00 N ATOM 393 CA HIS A 27 -1.812 -5.463 6.470 1.00 0.00 C ATOM 394 C HIS A 27 -3.284 -5.060 6.478 1.00 0.00 C ATOM 395 O HIS A 27 -4.052 -5.461 5.604 1.00 0.00 O ATOM 396 CB HIS A 27 -1.265 -5.407 5.042 1.00 0.00 C ATOM 397 CG HIS A 27 0.194 -5.084 4.973 1.00 0.00 C ATOM 398 ND1 HIS A 27 0.729 -3.869 5.339 1.00 0.00 N ATOM 399 CD2 HIS A 27 1.242 -5.848 4.573 1.00 0.00 C ATOM 400 CE1 HIS A 27 2.055 -3.930 5.151 1.00 0.00 C ATOM 401 NE2 HIS A 27 2.416 -5.110 4.687 1.00 0.00 N ATOM 0 H HIS A 27 -2.031 -7.549 6.465 1.00 0.00 H new ATOM 0 HA HIS A 27 -1.260 -4.760 7.094 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -1.440 -6.367 4.557 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -1.822 -4.659 4.477 1.00 0.00 H new ATOM 0 HD2 HIS A 27 1.175 -6.867 4.222 1.00 0.00 H new ATOM 0 HE1 HIS A 27 2.738 -3.118 5.353 1.00 0.00 H new ATOM 0 HE2 HIS A 27 3.361 -5.418 4.459 1.00 0.00 H new ATOM 409 N THR A 28 -3.667 -4.258 7.466 1.00 0.00 N ATOM 410 CA THR A 28 -5.044 -3.794 7.585 1.00 0.00 C ATOM 411 C THR A 28 -5.183 -2.378 7.038 1.00 0.00 C ATOM 412 O THR A 28 -4.690 -1.421 7.633 1.00 0.00 O ATOM 413 CB THR A 28 -5.496 -3.837 9.046 1.00 0.00 C ATOM 414 OG1 THR A 28 -5.409 -5.154 9.560 1.00 0.00 O ATOM 415 CG2 THR A 28 -6.918 -3.359 9.246 1.00 0.00 C ATOM 0 H THR A 28 -3.042 -3.916 8.196 1.00 0.00 H new ATOM 0 HA THR A 28 -5.680 -4.458 6.999 1.00 0.00 H new ATOM 0 HB THR A 28 -4.824 -3.162 9.576 1.00 0.00 H new ATOM 0 HG1 THR A 28 -5.701 -5.160 10.496 1.00 0.00 H new ATOM 0 HG21 THR A 28 -7.175 -3.415 10.304 1.00 0.00 H new ATOM 0 HG22 THR A 28 -7.006 -2.327 8.905 1.00 0.00 H new ATOM 0 HG23 THR A 28 -7.598 -3.990 8.673 1.00 0.00 H new ATOM 423 N TYR A 29 -5.855 -2.253 5.897 1.00 0.00 N ATOM 424 CA TYR A 29 -6.055 -0.955 5.268 1.00 0.00 C ATOM 425 C TYR A 29 -7.363 -0.319 5.720 1.00 0.00 C ATOM 426 O TYR A 29 -8.236 -0.986 6.273 1.00 0.00 O ATOM 427 CB TYR A 29 -6.045 -1.097 3.745 1.00 0.00 C ATOM 428 CG TYR A 29 -4.710 -1.530 3.184 1.00 0.00 C ATOM 429 CD1 TYR A 29 -4.300 -2.856 3.258 1.00 0.00 C ATOM 430 CD2 TYR A 29 -3.858 -0.614 2.581 1.00 0.00 C ATOM 431 CE1 TYR A 29 -3.080 -3.256 2.747 1.00 0.00 C ATOM 432 CE2 TYR A 29 -2.636 -1.006 2.066 1.00 0.00 C ATOM 433 CZ TYR A 29 -2.252 -2.327 2.152 1.00 0.00 C ATOM 434 OH TYR A 29 -1.037 -2.721 1.641 1.00 0.00 O ATOM 0 H TYR A 29 -6.269 -3.036 5.391 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.235 -0.305 5.574 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.805 -1.821 3.451 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -6.325 -0.143 3.298 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.946 -3.586 3.723 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.155 0.422 2.513 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -2.776 -4.290 2.813 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.986 -0.281 1.599 1.00 0.00 H new ATOM 0 HH TYR A 29 -0.577 -1.946 1.256 1.00 0.00 H new ATOM 444 N HIS A 30 -7.484 0.978 5.479 1.00 0.00 N ATOM 445 CA HIS A 30 -8.681 1.721 5.854 1.00 0.00 C ATOM 446 C HIS A 30 -9.365 2.302 4.620 1.00 0.00 C ATOM 447 O HIS A 30 -8.858 3.234 3.999 1.00 0.00 O ATOM 448 CB HIS A 30 -8.326 2.845 6.830 1.00 0.00 C ATOM 449 CG HIS A 30 -7.381 2.423 7.911 1.00 0.00 C ATOM 450 ND1 HIS A 30 -6.203 3.078 8.199 1.00 0.00 N ATOM 451 CD2 HIS A 30 -7.457 1.388 8.785 1.00 0.00 C ATOM 452 CE1 HIS A 30 -5.614 2.435 9.217 1.00 0.00 C ATOM 453 NE2 HIS A 30 -6.336 1.402 9.610 1.00 0.00 N ATOM 0 H HIS A 30 -6.766 1.541 5.024 1.00 0.00 H new ATOM 0 HA HIS A 30 -9.370 1.031 6.342 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -7.883 3.671 6.274 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -9.242 3.222 7.286 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -8.260 0.667 8.833 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -4.672 2.724 9.658 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -6.118 0.749 10.363 1.00 0.00 H new ATOM 461 N ILE A 31 -10.520 1.744 4.272 1.00 0.00 N ATOM 462 CA ILE A 31 -11.272 2.207 3.113 1.00 0.00 C ATOM 463 C ILE A 31 -12.270 3.290 3.504 1.00 0.00 C ATOM 464 O ILE A 31 -12.884 3.228 4.570 1.00 0.00 O ATOM 465 CB ILE A 31 -12.025 1.049 2.431 1.00 0.00 C ATOM 466 CG1 ILE A 31 -11.125 -0.185 2.332 1.00 0.00 C ATOM 467 CG2 ILE A 31 -12.510 1.471 1.052 1.00 0.00 C ATOM 468 CD1 ILE A 31 -9.752 0.109 1.766 1.00 0.00 C ATOM 0 H ILE A 31 -10.955 0.971 4.776 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.548 2.621 2.411 1.00 0.00 H new ATOM 0 HB ILE A 31 -12.894 0.793 3.037 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -11.014 -0.623 3.324 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -11.614 -0.932 1.707 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -13.040 0.642 0.583 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -13.182 2.324 1.148 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -11.656 1.750 0.436 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -9.170 -0.812 1.726 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -9.853 0.519 0.761 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -9.243 0.832 2.403 1.00 0.00 H new ATOM 480 N LYS A 32 -12.426 4.284 2.637 1.00 0.00 N ATOM 481 CA LYS A 32 -13.348 5.384 2.895 1.00 0.00 C ATOM 482 C LYS A 32 -14.517 5.362 1.916 1.00 0.00 C ATOM 483 O LYS A 32 -14.323 5.299 0.701 1.00 0.00 O ATOM 484 CB LYS A 32 -12.616 6.723 2.800 1.00 0.00 C ATOM 485 CG LYS A 32 -12.961 7.686 3.923 1.00 0.00 C ATOM 486 CD LYS A 32 -11.711 8.225 4.598 1.00 0.00 C ATOM 487 CE LYS A 32 -12.018 8.774 5.983 1.00 0.00 C ATOM 488 NZ LYS A 32 -11.840 10.251 6.045 1.00 0.00 N ATOM 0 H LYS A 32 -11.927 4.351 1.750 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.742 5.261 3.904 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -11.541 6.541 2.806 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.855 7.191 1.845 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -13.547 8.515 3.526 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -13.584 7.179 4.660 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.968 7.432 4.677 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -11.274 9.011 3.982 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.042 8.520 6.256 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.366 8.298 6.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.059 10.587 7.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.856 10.492 5.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.481 10.707 5.364 1.00 0.00 H new ATOM 502 N ILE A 33 -15.731 5.419 2.454 1.00 0.00 N ATOM 503 CA ILE A 33 -16.936 5.413 1.633 1.00 0.00 C ATOM 504 C ILE A 33 -17.857 6.566 2.016 1.00 0.00 C ATOM 505 O ILE A 33 -17.828 7.043 3.150 1.00 0.00 O ATOM 506 CB ILE A 33 -17.702 4.083 1.768 1.00 0.00 C ATOM 507 CG1 ILE A 33 -16.798 2.906 1.398 1.00 0.00 C ATOM 508 CG2 ILE A 33 -18.946 4.097 0.894 1.00 0.00 C ATOM 509 CD1 ILE A 33 -17.258 1.585 1.975 1.00 0.00 C ATOM 0 H ILE A 33 -15.906 5.470 3.458 1.00 0.00 H new ATOM 0 HA ILE A 33 -16.620 5.531 0.596 1.00 0.00 H new ATOM 0 HB ILE A 33 -18.012 3.965 2.806 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.751 2.822 0.312 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -15.786 3.112 1.746 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -19.476 3.151 1.000 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -19.598 4.915 1.202 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -18.657 4.236 -0.148 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -16.570 0.796 1.672 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -17.278 1.650 3.063 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -18.258 1.356 1.607 1.00 0.00 H new ATOM 521 N THR A 34 -18.670 7.015 1.065 1.00 0.00 N ATOM 522 CA THR A 34 -19.592 8.118 1.313 1.00 0.00 C ATOM 523 C THR A 34 -20.860 7.978 0.477 1.00 0.00 C ATOM 524 O THR A 34 -20.869 7.303 -0.553 1.00 0.00 O ATOM 525 CB THR A 34 -18.912 9.454 1.008 1.00 0.00 C ATOM 526 OG1 THR A 34 -17.824 9.674 1.888 1.00 0.00 O ATOM 527 CG2 THR A 34 -19.844 10.641 1.124 1.00 0.00 C ATOM 0 H THR A 34 -18.709 6.634 0.120 1.00 0.00 H new ATOM 0 HA THR A 34 -19.873 8.089 2.366 1.00 0.00 H new ATOM 0 HB THR A 34 -18.575 9.378 -0.026 1.00 0.00 H new ATOM 0 HG1 THR A 34 -17.401 10.532 1.677 1.00 0.00 H new ATOM 0 HG21 THR A 34 -19.298 11.556 0.895 1.00 0.00 H new ATOM 0 HG22 THR A 34 -20.669 10.525 0.422 1.00 0.00 H new ATOM 0 HG23 THR A 34 -20.237 10.697 2.139 1.00 0.00 H new ATOM 535 N ASN A 35 -21.930 8.625 0.931 1.00 0.00 N ATOM 536 CA ASN A 35 -23.208 8.579 0.230 1.00 0.00 C ATOM 537 C ASN A 35 -23.468 9.882 -0.517 1.00 0.00 C ATOM 538 O ASN A 35 -24.294 10.695 -0.111 1.00 0.00 O ATOM 539 CB ASN A 35 -24.347 8.302 1.213 1.00 0.00 C ATOM 540 CG ASN A 35 -25.677 8.095 0.515 1.00 0.00 C ATOM 541 OD1 ASN A 35 -26.678 8.721 0.864 1.00 0.00 O ATOM 542 ND2 ASN A 35 -25.693 7.213 -0.477 1.00 0.00 N ATOM 0 H ASN A 35 -21.936 9.187 1.782 1.00 0.00 H new ATOM 0 HA ASN A 35 -23.163 7.769 -0.498 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -24.107 7.417 1.802 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -24.432 9.135 1.910 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -26.559 7.031 -0.984 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -24.839 6.717 -0.732 1.00 0.00 H new ATOM 549 N ALA A 36 -22.753 10.066 -1.615 1.00 0.00 N ATOM 550 CA ALA A 36 -22.896 11.265 -2.431 1.00 0.00 C ATOM 551 C ALA A 36 -24.335 11.436 -2.908 1.00 0.00 C ATOM 552 O ALA A 36 -24.782 12.549 -3.178 1.00 0.00 O ATOM 553 CB ALA A 36 -21.949 11.209 -3.620 1.00 0.00 C ATOM 0 H ALA A 36 -22.065 9.399 -1.964 1.00 0.00 H new ATOM 0 HA ALA A 36 -22.639 12.127 -1.815 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -22.066 12.111 -4.221 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -20.921 11.141 -3.264 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -22.180 10.335 -4.228 1.00 0.00 H new ATOM 559 N GLY A 37 -25.054 10.323 -3.007 1.00 0.00 N ATOM 560 CA GLY A 37 -26.435 10.367 -3.451 1.00 0.00 C ATOM 561 C GLY A 37 -27.268 11.360 -2.664 1.00 0.00 C ATOM 562 O GLY A 37 -27.784 12.328 -3.223 1.00 0.00 O ATOM 0 H GLY A 37 -24.705 9.390 -2.787 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -26.465 10.630 -4.508 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -26.875 9.374 -3.357 1.00 0.00 H new ATOM 566 N GLY A 38 -27.398 11.121 -1.364 1.00 0.00 N ATOM 567 CA GLY A 38 -28.174 12.011 -0.520 1.00 0.00 C ATOM 568 C GLY A 38 -29.373 11.325 0.107 1.00 0.00 C ATOM 569 O GLY A 38 -30.332 11.983 0.510 1.00 0.00 O ATOM 0 H GLY A 38 -26.980 10.327 -0.879 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -27.534 12.407 0.268 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -28.515 12.861 -1.111 1.00 0.00 H new ATOM 573 N ARG A 39 -29.318 10.000 0.191 1.00 0.00 N ATOM 574 CA ARG A 39 -30.408 9.226 0.774 1.00 0.00 C ATOM 575 C ARG A 39 -29.880 7.952 1.428 1.00 0.00 C ATOM 576 O ARG A 39 -28.785 7.490 1.111 1.00 0.00 O ATOM 577 CB ARG A 39 -31.440 8.870 -0.298 1.00 0.00 C ATOM 578 CG ARG A 39 -31.662 9.974 -1.319 1.00 0.00 C ATOM 579 CD ARG A 39 -32.799 9.633 -2.270 1.00 0.00 C ATOM 580 NE ARG A 39 -32.355 8.784 -3.372 1.00 0.00 N ATOM 581 CZ ARG A 39 -31.703 9.239 -4.437 1.00 0.00 C ATOM 582 NH1 ARG A 39 -31.416 10.530 -4.540 1.00 0.00 N ATOM 583 NH2 ARG A 39 -31.336 8.404 -5.400 1.00 0.00 N ATOM 0 H ARG A 39 -28.531 9.440 -0.137 1.00 0.00 H new ATOM 0 HA ARG A 39 -30.885 9.838 1.540 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -31.117 7.967 -0.816 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -32.389 8.638 0.186 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -31.885 10.908 -0.804 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -30.746 10.135 -1.888 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -33.592 9.127 -1.720 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -33.225 10.553 -2.670 1.00 0.00 H new ATOM 0 HE ARG A 39 -32.557 7.785 -3.322 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -31.696 11.175 -3.801 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -30.916 10.878 -5.358 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -31.554 7.410 -5.324 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -30.836 8.755 -6.216 1.00 0.00 H new ATOM 597 N ARG A 40 -30.667 7.389 2.339 1.00 0.00 N ATOM 598 CA ARG A 40 -30.276 6.168 3.033 1.00 0.00 C ATOM 599 C ARG A 40 -29.973 5.053 2.036 1.00 0.00 C ATOM 600 O ARG A 40 -30.559 5.002 0.954 1.00 0.00 O ATOM 601 CB ARG A 40 -31.383 5.723 3.992 1.00 0.00 C ATOM 602 CG ARG A 40 -30.880 4.872 5.148 1.00 0.00 C ATOM 603 CD ARG A 40 -32.022 4.408 6.035 1.00 0.00 C ATOM 604 NE ARG A 40 -33.035 5.445 6.210 1.00 0.00 N ATOM 605 CZ ARG A 40 -32.924 6.443 7.079 1.00 0.00 C ATOM 606 NH1 ARG A 40 -31.846 6.542 7.845 1.00 0.00 N ATOM 607 NH2 ARG A 40 -33.889 7.347 7.182 1.00 0.00 N ATOM 0 H ARG A 40 -31.577 7.758 2.613 1.00 0.00 H new ATOM 0 HA ARG A 40 -29.373 6.377 3.606 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -31.883 6.605 4.392 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -32.130 5.159 3.434 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -30.346 4.006 4.758 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -30.167 5.446 5.741 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -32.482 3.521 5.599 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -31.629 4.117 7.009 1.00 0.00 H new ATOM 0 HE ARG A 40 -33.875 5.400 5.633 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -31.100 5.851 7.767 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -31.763 7.309 8.512 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -34.719 7.277 6.593 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -33.801 8.113 7.850 1.00 0.00 H new ATOM 621 N ILE A 41 -29.054 4.167 2.403 1.00 0.00 N ATOM 622 CA ILE A 41 -28.676 3.059 1.533 1.00 0.00 C ATOM 623 C ILE A 41 -28.134 1.881 2.335 1.00 0.00 C ATOM 624 O ILE A 41 -27.838 2.007 3.523 1.00 0.00 O ATOM 625 CB ILE A 41 -27.612 3.491 0.506 1.00 0.00 C ATOM 626 CG1 ILE A 41 -26.452 4.197 1.208 1.00 0.00 C ATOM 627 CG2 ILE A 41 -28.225 4.395 -0.553 1.00 0.00 C ATOM 628 CD1 ILE A 41 -25.139 4.092 0.462 1.00 0.00 C ATOM 0 H ILE A 41 -28.558 4.194 3.294 1.00 0.00 H new ATOM 0 HA ILE A 41 -29.581 2.751 1.009 1.00 0.00 H new ATOM 0 HB ILE A 41 -27.227 2.599 0.012 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -26.703 5.250 1.338 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -26.329 3.773 2.205 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -27.457 4.689 -1.269 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -29.020 3.860 -1.073 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -28.638 5.285 -0.077 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -24.362 4.616 1.018 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -24.864 3.043 0.355 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -25.244 4.542 -0.525 1.00 0.00 H new ATOM 640 N GLY A 42 -27.999 0.739 1.670 1.00 0.00 N ATOM 641 CA GLY A 42 -27.483 -0.450 2.321 1.00 0.00 C ATOM 642 C GLY A 42 -26.361 -1.087 1.526 1.00 0.00 C ATOM 643 O GLY A 42 -26.609 -1.790 0.547 1.00 0.00 O ATOM 0 H GLY A 42 -28.239 0.616 0.686 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -27.121 -0.191 3.316 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -28.290 -1.171 2.453 1.00 0.00 H new ATOM 647 N TRP A 43 -25.125 -0.830 1.939 1.00 0.00 N ATOM 648 CA TRP A 43 -23.961 -1.372 1.247 1.00 0.00 C ATOM 649 C TRP A 43 -23.470 -2.660 1.900 1.00 0.00 C ATOM 650 O TRP A 43 -23.724 -2.910 3.079 1.00 0.00 O ATOM 651 CB TRP A 43 -22.833 -0.339 1.224 1.00 0.00 C ATOM 652 CG TRP A 43 -22.428 0.128 2.588 1.00 0.00 C ATOM 653 CD1 TRP A 43 -23.051 1.075 3.348 1.00 0.00 C ATOM 654 CD2 TRP A 43 -21.310 -0.332 3.354 1.00 0.00 C ATOM 655 NE1 TRP A 43 -22.388 1.231 4.542 1.00 0.00 N ATOM 656 CE2 TRP A 43 -21.315 0.380 4.569 1.00 0.00 C ATOM 657 CE3 TRP A 43 -20.304 -1.277 3.132 1.00 0.00 C ATOM 658 CZ2 TRP A 43 -20.354 0.176 5.556 1.00 0.00 C ATOM 659 CZ3 TRP A 43 -19.350 -1.479 4.112 1.00 0.00 C ATOM 660 CH2 TRP A 43 -19.382 -0.756 5.312 1.00 0.00 C ATOM 0 H TRP A 43 -24.903 -0.250 2.749 1.00 0.00 H new ATOM 0 HA TRP A 43 -24.262 -1.605 0.226 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -21.966 -0.769 0.723 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -23.149 0.520 0.633 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -23.935 1.622 3.054 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -22.652 1.876 5.287 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -20.273 -1.840 2.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -20.375 0.733 6.481 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -18.568 -2.206 3.950 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -18.624 -0.938 6.060 1.00 0.00 H new ATOM 671 N ALA A 44 -22.760 -3.468 1.121 1.00 0.00 N ATOM 672 CA ALA A 44 -22.219 -4.731 1.605 1.00 0.00 C ATOM 673 C ALA A 44 -20.971 -5.119 0.819 1.00 0.00 C ATOM 674 O ALA A 44 -20.979 -5.129 -0.412 1.00 0.00 O ATOM 675 CB ALA A 44 -23.269 -5.828 1.513 1.00 0.00 C ATOM 0 H ALA A 44 -22.545 -3.268 0.144 1.00 0.00 H new ATOM 0 HA ALA A 44 -21.939 -4.606 2.651 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -22.849 -6.765 1.878 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -24.133 -5.557 2.120 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -23.578 -5.949 0.475 1.00 0.00 H new ATOM 681 N ILE A 45 -19.897 -5.432 1.537 1.00 0.00 N ATOM 682 CA ILE A 45 -18.641 -5.813 0.902 1.00 0.00 C ATOM 683 C ILE A 45 -18.534 -7.324 0.740 1.00 0.00 C ATOM 684 O ILE A 45 -18.962 -8.087 1.607 1.00 0.00 O ATOM 685 CB ILE A 45 -17.429 -5.310 1.710 1.00 0.00 C ATOM 686 CG1 ILE A 45 -17.612 -3.838 2.084 1.00 0.00 C ATOM 687 CG2 ILE A 45 -16.147 -5.506 0.915 1.00 0.00 C ATOM 688 CD1 ILE A 45 -17.827 -2.934 0.889 1.00 0.00 C ATOM 0 H ILE A 45 -19.871 -5.429 2.557 1.00 0.00 H new ATOM 0 HA ILE A 45 -18.636 -5.347 -0.083 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.356 -5.891 2.629 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -18.464 -3.746 2.758 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -16.734 -3.499 2.633 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -15.299 -5.146 1.498 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -16.013 -6.565 0.695 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -16.209 -4.947 -0.019 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -17.949 -1.905 1.228 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -16.965 -2.997 0.225 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -18.722 -3.248 0.352 1.00 0.00 H new ATOM 700 N LYS A 46 -17.954 -7.750 -0.379 1.00 0.00 N ATOM 701 CA LYS A 46 -17.782 -9.171 -0.663 1.00 0.00 C ATOM 702 C LYS A 46 -16.478 -9.413 -1.416 1.00 0.00 C ATOM 703 O LYS A 46 -16.170 -8.717 -2.383 1.00 0.00 O ATOM 704 CB LYS A 46 -18.964 -9.699 -1.480 1.00 0.00 C ATOM 705 CG LYS A 46 -20.247 -9.836 -0.677 1.00 0.00 C ATOM 706 CD LYS A 46 -21.127 -10.950 -1.221 1.00 0.00 C ATOM 707 CE LYS A 46 -21.514 -11.937 -0.132 1.00 0.00 C ATOM 708 NZ LYS A 46 -22.285 -13.090 -0.676 1.00 0.00 N ATOM 0 H LYS A 46 -17.595 -7.130 -1.105 1.00 0.00 H new ATOM 0 HA LYS A 46 -17.742 -9.707 0.286 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -19.142 -9.029 -2.321 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -18.701 -10.671 -1.897 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -20.005 -10.038 0.366 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -20.795 -8.894 -0.700 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -22.027 -10.522 -1.662 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -20.600 -11.474 -2.018 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -20.614 -12.303 0.363 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -22.109 -11.427 0.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -22.530 -13.740 0.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -23.156 -12.744 -1.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -21.708 -13.592 -1.380 1.00 0.00 H new ATOM 722 N THR A 47 -15.713 -10.402 -0.965 1.00 0.00 N ATOM 723 CA THR A 47 -14.439 -10.730 -1.598 1.00 0.00 C ATOM 724 C THR A 47 -14.466 -12.136 -2.186 1.00 0.00 C ATOM 725 O THR A 47 -15.232 -12.992 -1.744 1.00 0.00 O ATOM 726 CB THR A 47 -13.300 -10.611 -0.585 1.00 0.00 C ATOM 727 OG1 THR A 47 -13.321 -11.699 0.322 1.00 0.00 O ATOM 728 CG2 THR A 47 -13.352 -9.336 0.226 1.00 0.00 C ATOM 0 H THR A 47 -15.952 -10.989 -0.166 1.00 0.00 H new ATOM 0 HA THR A 47 -14.273 -10.022 -2.410 1.00 0.00 H new ATOM 0 HB THR A 47 -12.385 -10.608 -1.177 1.00 0.00 H new ATOM 0 HG1 THR A 47 -12.465 -12.175 0.281 1.00 0.00 H new ATOM 0 HG21 THR A 47 -12.516 -9.315 0.925 1.00 0.00 H new ATOM 0 HG22 THR A 47 -13.288 -8.477 -0.442 1.00 0.00 H new ATOM 0 HG23 THR A 47 -14.290 -9.295 0.780 1.00 0.00 H new ATOM 736 N THR A 48 -13.625 -12.365 -3.188 1.00 0.00 N ATOM 737 CA THR A 48 -13.548 -13.664 -3.842 1.00 0.00 C ATOM 738 C THR A 48 -13.033 -14.729 -2.879 1.00 0.00 C ATOM 739 O THR A 48 -13.455 -15.884 -2.932 1.00 0.00 O ATOM 740 CB THR A 48 -12.635 -13.585 -5.065 1.00 0.00 C ATOM 741 OG1 THR A 48 -11.505 -12.775 -4.796 1.00 0.00 O ATOM 742 CG2 THR A 48 -13.324 -13.019 -6.289 1.00 0.00 C ATOM 0 H THR A 48 -12.986 -11.665 -3.565 1.00 0.00 H new ATOM 0 HA THR A 48 -14.552 -13.943 -4.161 1.00 0.00 H new ATOM 0 HB THR A 48 -12.342 -14.614 -5.274 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.783 -13.331 -4.436 1.00 0.00 H new ATOM 0 HG21 THR A 48 -12.621 -12.990 -7.121 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.173 -13.650 -6.553 1.00 0.00 H new ATOM 0 HG23 THR A 48 -13.675 -12.009 -6.075 1.00 0.00 H new ATOM 750 N ASN A 49 -12.120 -14.331 -2.001 1.00 0.00 N ATOM 751 CA ASN A 49 -11.545 -15.249 -1.024 1.00 0.00 C ATOM 752 C ASN A 49 -11.743 -14.725 0.394 1.00 0.00 C ATOM 753 O ASN A 49 -11.166 -13.706 0.776 1.00 0.00 O ATOM 754 CB ASN A 49 -10.055 -15.453 -1.302 1.00 0.00 C ATOM 755 CG ASN A 49 -9.704 -16.910 -1.529 1.00 0.00 C ATOM 756 OD1 ASN A 49 -8.666 -17.382 -0.847 1.00 0.00 O flip ATOM 757 ND2 ASN A 49 -10.357 -17.604 -2.308 1.00 0.00 N flip ATOM 0 H ASN A 49 -11.761 -13.378 -1.945 1.00 0.00 H new ATOM 0 HA ASN A 49 -12.058 -16.206 -1.114 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -9.769 -14.872 -2.179 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -9.476 -15.069 -0.462 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -11.147 -17.200 -2.811 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -10.108 -18.583 -2.450 1.00 0.00 H new ATOM 764 N MET A 50 -12.561 -15.427 1.171 1.00 0.00 N ATOM 765 CA MET A 50 -12.834 -15.031 2.547 1.00 0.00 C ATOM 766 C MET A 50 -11.955 -15.804 3.527 1.00 0.00 C ATOM 767 O MET A 50 -12.281 -15.918 4.710 1.00 0.00 O ATOM 768 CB MET A 50 -14.308 -15.255 2.882 1.00 0.00 C ATOM 769 CG MET A 50 -15.243 -14.264 2.208 1.00 0.00 C ATOM 770 SD MET A 50 -16.248 -13.345 3.389 1.00 0.00 S ATOM 771 CE MET A 50 -15.445 -11.745 3.345 1.00 0.00 C ATOM 0 H MET A 50 -13.046 -16.273 0.871 1.00 0.00 H new ATOM 0 HA MET A 50 -12.603 -13.970 2.642 1.00 0.00 H new ATOM 0 HB2 MET A 50 -14.589 -16.266 2.587 1.00 0.00 H new ATOM 0 HB3 MET A 50 -14.440 -15.190 3.962 1.00 0.00 H new ATOM 0 HG2 MET A 50 -14.657 -13.564 1.613 1.00 0.00 H new ATOM 0 HG3 MET A 50 -15.897 -14.798 1.519 1.00 0.00 H new ATOM 0 HE1 MET A 50 -15.954 -11.064 4.027 1.00 0.00 H new ATOM 0 HE2 MET A 50 -14.404 -11.852 3.649 1.00 0.00 H new ATOM 0 HE3 MET A 50 -15.488 -11.344 2.332 1.00 0.00 H new ATOM 781 N ARG A 51 -10.838 -16.331 3.033 1.00 0.00 N ATOM 782 CA ARG A 51 -9.916 -17.087 3.871 1.00 0.00 C ATOM 783 C ARG A 51 -8.775 -16.199 4.355 1.00 0.00 C ATOM 784 O ARG A 51 -8.426 -16.205 5.535 1.00 0.00 O ATOM 785 CB ARG A 51 -9.354 -18.283 3.099 1.00 0.00 C ATOM 786 CG ARG A 51 -10.358 -18.921 2.152 1.00 0.00 C ATOM 787 CD ARG A 51 -10.102 -20.411 1.990 1.00 0.00 C ATOM 788 NE ARG A 51 -9.883 -20.780 0.594 1.00 0.00 N ATOM 789 CZ ARG A 51 -8.743 -20.563 -0.054 1.00 0.00 C ATOM 790 NH1 ARG A 51 -7.725 -19.981 0.565 1.00 0.00 N ATOM 791 NH2 ARG A 51 -8.618 -20.929 -1.323 1.00 0.00 N ATOM 0 H ARG A 51 -10.551 -16.248 2.058 1.00 0.00 H new ATOM 0 HA ARG A 51 -10.466 -17.451 4.739 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.483 -17.960 2.529 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -9.009 -19.034 3.810 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -11.368 -18.763 2.531 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -10.303 -18.433 1.179 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -9.231 -20.696 2.581 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -10.951 -20.970 2.384 1.00 0.00 H new ATOM 0 HE ARG A 51 -10.647 -21.229 0.089 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -7.816 -19.699 1.541 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.851 -19.816 0.065 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -9.398 -21.378 -1.803 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.742 -20.761 -1.818 1.00 0.00 H new ATOM 805 N ARG A 52 -8.201 -15.431 3.434 1.00 0.00 N ATOM 806 CA ARG A 52 -7.101 -14.532 3.764 1.00 0.00 C ATOM 807 C ARG A 52 -7.574 -13.083 3.782 1.00 0.00 C ATOM 808 O ARG A 52 -7.083 -12.267 4.561 1.00 0.00 O ATOM 809 CB ARG A 52 -5.960 -14.698 2.760 1.00 0.00 C ATOM 810 CG ARG A 52 -5.636 -16.149 2.440 1.00 0.00 C ATOM 811 CD ARG A 52 -5.185 -16.905 3.679 1.00 0.00 C ATOM 812 NE ARG A 52 -5.681 -18.278 3.691 1.00 0.00 N ATOM 813 CZ ARG A 52 -5.232 -19.217 4.520 1.00 0.00 C ATOM 814 NH1 ARG A 52 -4.279 -18.932 5.396 1.00 0.00 N ATOM 815 NH2 ARG A 52 -5.737 -20.443 4.471 1.00 0.00 N ATOM 0 H ARG A 52 -8.480 -15.413 2.453 1.00 0.00 H new ATOM 0 HA ARG A 52 -6.738 -14.790 4.759 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.222 -14.181 1.837 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -5.067 -14.214 3.155 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.515 -16.634 2.016 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.853 -16.190 1.683 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -4.096 -16.912 3.723 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.537 -16.384 4.570 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.412 -18.532 3.027 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.888 -17.991 5.436 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -3.937 -19.654 6.030 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.470 -20.666 3.798 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -5.392 -21.162 5.107 1.00 0.00 H new ATOM 829 N LEU A 53 -8.536 -12.771 2.918 1.00 0.00 N ATOM 830 CA LEU A 53 -9.081 -11.420 2.834 1.00 0.00 C ATOM 831 C LEU A 53 -10.354 -11.299 3.665 1.00 0.00 C ATOM 832 O LEU A 53 -11.249 -12.139 3.573 1.00 0.00 O ATOM 833 CB LEU A 53 -9.374 -11.055 1.377 1.00 0.00 C ATOM 834 CG LEU A 53 -8.177 -11.162 0.429 1.00 0.00 C ATOM 835 CD1 LEU A 53 -8.648 -11.252 -1.014 1.00 0.00 C ATOM 836 CD2 LEU A 53 -7.243 -9.976 0.615 1.00 0.00 C ATOM 0 H LEU A 53 -8.954 -13.435 2.266 1.00 0.00 H new ATOM 0 HA LEU A 53 -8.338 -10.728 3.232 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -10.169 -11.704 1.009 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.754 -10.034 1.344 1.00 0.00 H new ATOM 0 HG LEU A 53 -7.627 -12.072 0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -7.784 -11.327 -1.675 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -9.277 -12.134 -1.137 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.221 -10.360 -1.266 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.398 -10.068 -0.067 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -7.781 -9.052 0.403 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.880 -9.956 1.643 1.00 0.00 H new ATOM 848 N SER A 54 -10.428 -10.249 4.477 1.00 0.00 N ATOM 849 CA SER A 54 -11.592 -10.021 5.324 1.00 0.00 C ATOM 850 C SER A 54 -11.860 -8.530 5.494 1.00 0.00 C ATOM 851 O SER A 54 -11.021 -7.695 5.158 1.00 0.00 O ATOM 852 CB SER A 54 -11.389 -10.674 6.692 1.00 0.00 C ATOM 853 OG SER A 54 -12.138 -11.872 6.802 1.00 0.00 O ATOM 0 H SER A 54 -9.696 -9.544 4.566 1.00 0.00 H new ATOM 0 HA SER A 54 -12.457 -10.473 4.838 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.331 -10.888 6.843 1.00 0.00 H new ATOM 0 HB3 SER A 54 -11.689 -9.980 7.478 1.00 0.00 H new ATOM 0 HG SER A 54 -11.990 -12.271 7.685 1.00 0.00 H new ATOM 859 N VAL A 55 -13.036 -8.202 6.020 1.00 0.00 N ATOM 860 CA VAL A 55 -13.417 -6.812 6.237 1.00 0.00 C ATOM 861 C VAL A 55 -14.394 -6.689 7.397 1.00 0.00 C ATOM 862 O VAL A 55 -15.041 -7.658 7.794 1.00 0.00 O ATOM 863 CB VAL A 55 -14.040 -6.194 4.965 1.00 0.00 C ATOM 864 CG1 VAL A 55 -15.113 -7.107 4.394 1.00 0.00 C ATOM 865 CG2 VAL A 55 -14.604 -4.803 5.234 1.00 0.00 C ATOM 0 H VAL A 55 -13.742 -8.881 6.304 1.00 0.00 H new ATOM 0 HA VAL A 55 -12.507 -6.263 6.480 1.00 0.00 H new ATOM 0 HB VAL A 55 -13.245 -6.090 4.227 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -15.539 -6.653 3.499 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -14.672 -8.070 4.138 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -15.899 -7.253 5.135 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.033 -4.401 4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.377 -4.866 6.000 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -13.805 -4.147 5.579 1.00 0.00 H new ATOM 875 N ASP A 56 -14.489 -5.481 7.930 1.00 0.00 N ATOM 876 CA ASP A 56 -15.384 -5.205 9.048 1.00 0.00 C ATOM 877 C ASP A 56 -15.574 -3.697 9.234 1.00 0.00 C ATOM 878 O ASP A 56 -14.596 -2.960 9.361 1.00 0.00 O ATOM 879 CB ASP A 56 -14.824 -5.818 10.334 1.00 0.00 C ATOM 880 CG ASP A 56 -15.858 -5.888 11.440 1.00 0.00 C ATOM 881 OD1 ASP A 56 -16.858 -6.618 11.274 1.00 0.00 O ATOM 882 OD2 ASP A 56 -15.668 -5.212 12.474 1.00 0.00 O ATOM 0 H ASP A 56 -13.957 -4.673 7.607 1.00 0.00 H new ATOM 0 HA ASP A 56 -16.353 -5.653 8.827 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -14.453 -6.821 10.123 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -13.973 -5.228 10.673 1.00 0.00 H new ATOM 887 N PRO A 57 -16.833 -3.204 9.255 1.00 0.00 N ATOM 888 CA PRO A 57 -18.038 -4.031 9.108 1.00 0.00 C ATOM 889 C PRO A 57 -18.268 -4.469 7.662 1.00 0.00 C ATOM 890 O PRO A 57 -18.000 -3.715 6.728 1.00 0.00 O ATOM 891 CB PRO A 57 -19.158 -3.099 9.568 1.00 0.00 C ATOM 892 CG PRO A 57 -18.662 -1.733 9.248 1.00 0.00 C ATOM 893 CD PRO A 57 -17.167 -1.777 9.426 1.00 0.00 C ATOM 0 HA PRO A 57 -17.972 -4.958 9.678 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -20.092 -3.314 9.048 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -19.354 -3.210 10.634 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -18.925 -1.452 8.228 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -19.111 -0.991 9.908 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -16.658 -1.156 8.689 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -16.870 -1.412 10.409 1.00 0.00 H new ATOM 901 N PRO A 58 -18.767 -5.702 7.458 1.00 0.00 N ATOM 902 CA PRO A 58 -19.027 -6.236 6.120 1.00 0.00 C ATOM 903 C PRO A 58 -20.328 -5.714 5.510 1.00 0.00 C ATOM 904 O PRO A 58 -20.728 -6.142 4.427 1.00 0.00 O ATOM 905 CB PRO A 58 -19.122 -7.740 6.368 1.00 0.00 C ATOM 906 CG PRO A 58 -19.650 -7.857 7.756 1.00 0.00 C ATOM 907 CD PRO A 58 -19.111 -6.672 8.516 1.00 0.00 C ATOM 0 HA PRO A 58 -18.255 -5.944 5.409 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -19.786 -8.220 5.649 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -18.148 -8.220 6.272 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -20.740 -7.857 7.758 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -19.330 -8.792 8.216 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -19.853 -6.267 9.204 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.238 -6.942 9.111 1.00 0.00 H new ATOM 915 N CYS A 59 -20.988 -4.790 6.205 1.00 0.00 N ATOM 916 CA CYS A 59 -22.241 -4.221 5.719 1.00 0.00 C ATOM 917 C CYS A 59 -22.784 -3.184 6.697 1.00 0.00 C ATOM 918 O CYS A 59 -22.441 -3.191 7.879 1.00 0.00 O ATOM 919 CB CYS A 59 -23.276 -5.326 5.502 1.00 0.00 C ATOM 920 SG CYS A 59 -23.501 -6.417 6.926 1.00 0.00 S ATOM 0 H CYS A 59 -20.677 -4.421 7.103 1.00 0.00 H new ATOM 0 HA CYS A 59 -22.042 -3.727 4.768 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -24.234 -4.868 5.254 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -22.977 -5.926 4.642 1.00 0.00 H new ATOM 0 HG CYS A 59 -24.397 -7.316 6.646 1.00 0.00 H new ATOM 926 N GLY A 60 -23.636 -2.294 6.196 1.00 0.00 N ATOM 927 CA GLY A 60 -24.212 -1.265 7.041 1.00 0.00 C ATOM 928 C GLY A 60 -25.082 -0.294 6.267 1.00 0.00 C ATOM 929 O GLY A 60 -25.026 -0.242 5.037 1.00 0.00 O ATOM 0 H GLY A 60 -23.937 -2.268 5.222 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -24.807 -1.734 7.825 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -23.411 -0.715 7.535 1.00 0.00 H new ATOM 933 N VAL A 61 -25.890 0.477 6.988 1.00 0.00 N ATOM 934 CA VAL A 61 -26.776 1.452 6.366 1.00 0.00 C ATOM 935 C VAL A 61 -26.189 2.857 6.445 1.00 0.00 C ATOM 936 O VAL A 61 -25.987 3.395 7.535 1.00 0.00 O ATOM 937 CB VAL A 61 -28.166 1.451 7.028 1.00 0.00 C ATOM 938 CG1 VAL A 61 -29.149 2.271 6.207 1.00 0.00 C ATOM 939 CG2 VAL A 61 -28.671 0.028 7.210 1.00 0.00 C ATOM 0 H VAL A 61 -25.949 0.444 8.006 1.00 0.00 H new ATOM 0 HA VAL A 61 -26.880 1.162 5.320 1.00 0.00 H new ATOM 0 HB VAL A 61 -28.078 1.910 8.013 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -30.126 2.259 6.690 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -28.793 3.299 6.134 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -29.233 1.844 5.208 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -29.655 0.048 7.679 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -28.743 -0.460 6.238 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -27.978 -0.526 7.843 1.00 0.00 H new ATOM 949 N LEU A 62 -25.918 3.448 5.287 1.00 0.00 N ATOM 950 CA LEU A 62 -25.355 4.791 5.226 1.00 0.00 C ATOM 951 C LEU A 62 -26.457 5.842 5.164 1.00 0.00 C ATOM 952 O LEU A 62 -27.599 5.539 4.819 1.00 0.00 O ATOM 953 CB LEU A 62 -24.436 4.926 4.009 1.00 0.00 C ATOM 954 CG LEU A 62 -23.131 5.682 4.263 1.00 0.00 C ATOM 955 CD1 LEU A 62 -22.324 4.999 5.356 1.00 0.00 C ATOM 956 CD2 LEU A 62 -22.318 5.783 2.982 1.00 0.00 C ATOM 0 H LEU A 62 -26.079 3.017 4.377 1.00 0.00 H new ATOM 0 HA LEU A 62 -24.773 4.955 6.133 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -24.194 3.928 3.643 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -24.983 5.433 3.214 1.00 0.00 H new ATOM 0 HG LEU A 62 -23.375 6.691 4.596 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -21.399 5.550 5.524 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -22.905 4.977 6.278 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -22.089 3.979 5.051 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -21.393 6.324 3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -22.083 4.782 2.620 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -22.895 6.316 2.226 1.00 0.00 H new ATOM 968 N ASP A 63 -26.106 7.079 5.499 1.00 0.00 N ATOM 969 CA ASP A 63 -27.065 8.176 5.481 1.00 0.00 C ATOM 970 C ASP A 63 -26.756 9.148 4.344 1.00 0.00 C ATOM 971 O ASP A 63 -25.790 8.962 3.604 1.00 0.00 O ATOM 972 CB ASP A 63 -27.051 8.914 6.821 1.00 0.00 C ATOM 973 CG ASP A 63 -28.384 8.828 7.541 1.00 0.00 C ATOM 974 OD1 ASP A 63 -28.916 7.705 7.670 1.00 0.00 O ATOM 975 OD2 ASP A 63 -28.893 9.882 7.974 1.00 0.00 O ATOM 0 H ASP A 63 -25.164 7.346 5.786 1.00 0.00 H new ATOM 0 HA ASP A 63 -28.058 7.758 5.317 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -26.270 8.495 7.456 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -26.798 9.961 6.654 1.00 0.00 H new ATOM 980 N PRO A 64 -27.579 10.199 4.187 1.00 0.00 N ATOM 981 CA PRO A 64 -27.396 11.199 3.129 1.00 0.00 C ATOM 982 C PRO A 64 -26.111 12.005 3.298 1.00 0.00 C ATOM 983 O PRO A 64 -26.025 12.878 4.160 1.00 0.00 O ATOM 984 CB PRO A 64 -28.620 12.117 3.275 1.00 0.00 C ATOM 985 CG PRO A 64 -29.588 11.356 4.116 1.00 0.00 C ATOM 986 CD PRO A 64 -28.757 10.492 5.017 1.00 0.00 C ATOM 0 HA PRO A 64 -27.312 10.730 2.149 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -28.348 13.062 3.746 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -29.049 12.357 2.302 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -30.218 12.031 4.695 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -30.252 10.751 3.498 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -28.486 11.010 5.937 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -29.285 9.583 5.306 1.00 0.00 H new ATOM 994 N LYS A 65 -25.118 11.710 2.463 1.00 0.00 N ATOM 995 CA LYS A 65 -23.839 12.413 2.511 1.00 0.00 C ATOM 996 C LYS A 65 -23.032 12.010 3.742 1.00 0.00 C ATOM 997 O LYS A 65 -22.152 12.750 4.184 1.00 0.00 O ATOM 998 CB LYS A 65 -24.063 13.927 2.510 1.00 0.00 C ATOM 999 CG LYS A 65 -23.345 14.647 1.381 1.00 0.00 C ATOM 1000 CD LYS A 65 -23.532 16.153 1.475 1.00 0.00 C ATOM 1001 CE LYS A 65 -22.867 16.871 0.311 1.00 0.00 C ATOM 1002 NZ LYS A 65 -22.687 18.322 0.585 1.00 0.00 N ATOM 0 H LYS A 65 -25.175 10.988 1.744 1.00 0.00 H new ATOM 0 HA LYS A 65 -23.272 12.133 1.623 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -25.132 14.128 2.436 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -23.727 14.336 3.463 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -22.282 14.408 1.413 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -23.723 14.291 0.422 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -24.596 16.388 1.489 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -23.113 16.515 2.414 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -21.897 16.416 0.110 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -23.471 16.743 -0.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -22.231 18.776 -0.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -23.615 18.762 0.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -22.090 18.445 1.427 1.00 0.00 H new ATOM 1016 N GLU A 66 -23.328 10.837 4.287 1.00 0.00 N ATOM 1017 CA GLU A 66 -22.621 10.344 5.462 1.00 0.00 C ATOM 1018 C GLU A 66 -21.362 9.586 5.058 1.00 0.00 C ATOM 1019 O GLU A 66 -21.304 8.987 3.984 1.00 0.00 O ATOM 1020 CB GLU A 66 -23.535 9.442 6.294 1.00 0.00 C ATOM 1021 CG GLU A 66 -23.894 10.030 7.648 1.00 0.00 C ATOM 1022 CD GLU A 66 -23.023 9.493 8.767 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -22.339 8.472 8.548 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -23.024 10.094 9.861 1.00 0.00 O ATOM 0 H GLU A 66 -24.052 10.210 3.935 1.00 0.00 H new ATOM 0 HA GLU A 66 -22.327 11.202 6.067 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -24.451 9.251 5.735 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.046 8.479 6.443 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.797 11.115 7.606 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -24.939 9.812 7.869 1.00 0.00 H new ATOM 1031 N LYS A 67 -20.352 9.620 5.921 1.00 0.00 N ATOM 1032 CA LYS A 67 -19.092 8.938 5.648 1.00 0.00 C ATOM 1033 C LYS A 67 -18.832 7.833 6.668 1.00 0.00 C ATOM 1034 O LYS A 67 -18.958 8.044 7.874 1.00 0.00 O ATOM 1035 CB LYS A 67 -17.934 9.939 5.659 1.00 0.00 C ATOM 1036 CG LYS A 67 -17.964 10.917 4.497 1.00 0.00 C ATOM 1037 CD LYS A 67 -18.371 12.309 4.951 1.00 0.00 C ATOM 1038 CE LYS A 67 -18.878 13.149 3.789 1.00 0.00 C ATOM 1039 NZ LYS A 67 -19.048 14.578 4.169 1.00 0.00 N ATOM 0 H LYS A 67 -20.381 10.112 6.814 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.164 8.483 4.660 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -17.957 10.498 6.594 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -16.992 9.392 5.638 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -16.980 10.959 4.030 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -18.662 10.562 3.739 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -19.148 12.232 5.712 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -17.519 12.805 5.415 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -18.179 13.076 2.956 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -19.831 12.750 3.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -19.395 15.116 3.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -19.734 14.651 4.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -18.134 14.967 4.476 1.00 0.00 H new ATOM 1053 N VAL A 68 -18.466 6.657 6.171 1.00 0.00 N ATOM 1054 CA VAL A 68 -18.183 5.515 7.032 1.00 0.00 C ATOM 1055 C VAL A 68 -16.780 4.975 6.776 1.00 0.00 C ATOM 1056 O VAL A 68 -16.307 4.963 5.638 1.00 0.00 O ATOM 1057 CB VAL A 68 -19.203 4.381 6.819 1.00 0.00 C ATOM 1058 CG1 VAL A 68 -19.175 3.902 5.375 1.00 0.00 C ATOM 1059 CG2 VAL A 68 -18.931 3.229 7.775 1.00 0.00 C ATOM 0 H VAL A 68 -18.358 6.469 5.174 1.00 0.00 H new ATOM 0 HA VAL A 68 -18.256 5.867 8.061 1.00 0.00 H new ATOM 0 HB VAL A 68 -20.199 4.770 7.030 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -19.902 3.101 5.243 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -19.424 4.731 4.712 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -18.179 3.531 5.134 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -19.662 2.438 7.609 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -17.928 2.839 7.599 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -19.007 3.583 8.803 1.00 0.00 H new ATOM 1069 N LEU A 69 -16.118 4.531 7.839 1.00 0.00 N ATOM 1070 CA LEU A 69 -14.768 3.991 7.727 1.00 0.00 C ATOM 1071 C LEU A 69 -14.752 2.495 8.020 1.00 0.00 C ATOM 1072 O LEU A 69 -15.221 2.051 9.068 1.00 0.00 O ATOM 1073 CB LEU A 69 -13.823 4.721 8.683 1.00 0.00 C ATOM 1074 CG LEU A 69 -12.347 4.346 8.546 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -11.813 4.774 7.187 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -11.531 4.978 9.664 1.00 0.00 C ATOM 0 H LEU A 69 -16.494 4.534 8.787 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.427 4.144 6.703 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -13.926 5.794 8.522 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -14.140 4.520 9.706 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.257 3.263 8.625 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.761 4.499 7.106 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.379 4.276 6.400 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.915 5.854 7.079 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.483 4.701 9.551 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.627 6.063 9.616 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.898 4.624 10.627 1.00 0.00 H new ATOM 1088 N MET A 70 -14.204 1.723 7.088 1.00 0.00 N ATOM 1089 CA MET A 70 -14.119 0.275 7.242 1.00 0.00 C ATOM 1090 C MET A 70 -12.677 -0.193 7.144 1.00 0.00 C ATOM 1091 O MET A 70 -11.787 0.564 6.757 1.00 0.00 O ATOM 1092 CB MET A 70 -14.975 -0.425 6.189 1.00 0.00 C ATOM 1093 CG MET A 70 -14.434 -0.284 4.777 1.00 0.00 C ATOM 1094 SD MET A 70 -15.483 -1.087 3.550 1.00 0.00 S ATOM 1095 CE MET A 70 -14.442 -0.957 2.102 1.00 0.00 C ATOM 0 H MET A 70 -13.811 2.077 6.216 1.00 0.00 H new ATOM 0 HA MET A 70 -14.499 0.015 8.230 1.00 0.00 H new ATOM 0 HB2 MET A 70 -15.049 -1.484 6.437 1.00 0.00 H new ATOM 0 HB3 MET A 70 -15.986 -0.018 6.225 1.00 0.00 H new ATOM 0 HG2 MET A 70 -14.339 0.774 4.532 1.00 0.00 H new ATOM 0 HG3 MET A 70 -13.433 -0.713 4.731 1.00 0.00 H new ATOM 0 HE1 MET A 70 -14.822 -1.614 1.320 1.00 0.00 H new ATOM 0 HE2 MET A 70 -14.444 0.072 1.743 1.00 0.00 H new ATOM 0 HE3 MET A 70 -13.424 -1.250 2.358 1.00 0.00 H new ATOM 1105 N ALA A 71 -12.454 -1.446 7.510 1.00 0.00 N ATOM 1106 CA ALA A 71 -11.118 -2.028 7.481 1.00 0.00 C ATOM 1107 C ALA A 71 -11.085 -3.327 6.684 1.00 0.00 C ATOM 1108 O ALA A 71 -11.974 -4.167 6.810 1.00 0.00 O ATOM 1109 CB ALA A 71 -10.626 -2.273 8.899 1.00 0.00 C ATOM 0 H ALA A 71 -13.183 -2.083 7.832 1.00 0.00 H new ATOM 0 HA ALA A 71 -10.457 -1.318 6.984 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.627 -2.708 8.867 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.593 -1.328 9.441 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -11.305 -2.959 9.406 1.00 0.00 H new ATOM 1115 N VAL A 72 -10.046 -3.489 5.871 1.00 0.00 N ATOM 1116 CA VAL A 72 -9.887 -4.690 5.062 1.00 0.00 C ATOM 1117 C VAL A 72 -8.646 -5.467 5.488 1.00 0.00 C ATOM 1118 O VAL A 72 -7.532 -5.164 5.060 1.00 0.00 O ATOM 1119 CB VAL A 72 -9.783 -4.352 3.563 1.00 0.00 C ATOM 1120 CG1 VAL A 72 -8.586 -3.453 3.297 1.00 0.00 C ATOM 1121 CG2 VAL A 72 -9.701 -5.623 2.731 1.00 0.00 C ATOM 0 H VAL A 72 -9.301 -2.802 5.756 1.00 0.00 H new ATOM 0 HA VAL A 72 -10.774 -5.304 5.221 1.00 0.00 H new ATOM 0 HB VAL A 72 -10.684 -3.812 3.270 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.531 -3.226 2.232 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.695 -2.526 3.860 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.673 -3.961 3.608 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -9.628 -5.363 1.675 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -8.821 -6.194 3.025 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -10.595 -6.224 2.896 1.00 0.00 H new ATOM 1131 N SER A 73 -8.845 -6.465 6.342 1.00 0.00 N ATOM 1132 CA SER A 73 -7.740 -7.280 6.836 1.00 0.00 C ATOM 1133 C SER A 73 -7.095 -8.080 5.709 1.00 0.00 C ATOM 1134 O SER A 73 -7.774 -8.540 4.791 1.00 0.00 O ATOM 1135 CB SER A 73 -8.230 -8.227 7.934 1.00 0.00 C ATOM 1136 OG SER A 73 -7.533 -8.005 9.148 1.00 0.00 O ATOM 0 H SER A 73 -9.760 -6.729 6.707 1.00 0.00 H new ATOM 0 HA SER A 73 -6.988 -6.608 7.250 1.00 0.00 H new ATOM 0 HB2 SER A 73 -9.299 -8.082 8.093 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.092 -9.260 7.616 1.00 0.00 H new ATOM 0 HG SER A 73 -7.866 -8.621 9.834 1.00 0.00 H new ATOM 1142 N CYS A 74 -5.778 -8.241 5.789 1.00 0.00 N ATOM 1143 CA CYS A 74 -5.033 -8.987 4.782 1.00 0.00 C ATOM 1144 C CYS A 74 -3.973 -9.867 5.437 1.00 0.00 C ATOM 1145 O CYS A 74 -2.801 -9.497 5.509 1.00 0.00 O ATOM 1146 CB CYS A 74 -4.375 -8.029 3.787 1.00 0.00 C ATOM 1147 SG CYS A 74 -3.877 -8.805 2.232 1.00 0.00 S ATOM 0 H CYS A 74 -5.204 -7.864 6.543 1.00 0.00 H new ATOM 0 HA CYS A 74 -5.734 -9.627 4.246 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -5.068 -7.216 3.569 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -3.498 -7.583 4.255 1.00 0.00 H new ATOM 0 HG CYS A 74 -3.702 -7.889 1.326 1.00 0.00 H new ATOM 1153 N ASP A 75 -4.395 -11.033 5.916 1.00 0.00 N ATOM 1154 CA ASP A 75 -3.486 -11.967 6.570 1.00 0.00 C ATOM 1155 C ASP A 75 -2.264 -12.243 5.700 1.00 0.00 C ATOM 1156 O ASP A 75 -2.323 -12.137 4.475 1.00 0.00 O ATOM 1157 CB ASP A 75 -4.209 -13.278 6.885 1.00 0.00 C ATOM 1158 CG ASP A 75 -5.381 -13.078 7.825 1.00 0.00 C ATOM 1159 OD1 ASP A 75 -5.942 -11.962 7.846 1.00 0.00 O ATOM 1160 OD2 ASP A 75 -5.739 -14.038 8.540 1.00 0.00 O ATOM 0 H ASP A 75 -5.362 -11.354 5.863 1.00 0.00 H new ATOM 0 HA ASP A 75 -3.148 -11.512 7.501 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.563 -13.727 5.957 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.505 -13.981 7.331 1.00 0.00 H new ATOM 1165 N THR A 76 -1.157 -12.599 6.343 1.00 0.00 N ATOM 1166 CA THR A 76 0.081 -12.892 5.634 1.00 0.00 C ATOM 1167 C THR A 76 -0.070 -14.136 4.766 1.00 0.00 C ATOM 1168 O THR A 76 -0.401 -15.214 5.262 1.00 0.00 O ATOM 1169 CB THR A 76 1.227 -13.087 6.627 1.00 0.00 C ATOM 1170 OG1 THR A 76 1.249 -14.416 7.113 1.00 0.00 O ATOM 1171 CG2 THR A 76 1.151 -12.161 7.822 1.00 0.00 C ATOM 0 H THR A 76 -1.093 -12.691 7.357 1.00 0.00 H new ATOM 0 HA THR A 76 0.309 -12.045 4.987 1.00 0.00 H new ATOM 0 HB THR A 76 2.134 -12.856 6.068 1.00 0.00 H new ATOM 0 HG1 THR A 76 0.443 -14.887 6.815 1.00 0.00 H new ATOM 0 HG21 THR A 76 1.994 -12.353 8.485 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.185 -11.126 7.483 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.219 -12.336 8.360 1.00 0.00 H new ATOM 1179 N PHE A 77 0.175 -13.982 3.469 1.00 0.00 N ATOM 1180 CA PHE A 77 0.067 -15.095 2.535 1.00 0.00 C ATOM 1181 C PHE A 77 1.308 -15.186 1.652 1.00 0.00 C ATOM 1182 O PHE A 77 2.226 -14.376 1.769 1.00 0.00 O ATOM 1183 CB PHE A 77 -1.182 -14.941 1.666 1.00 0.00 C ATOM 1184 CG PHE A 77 -1.082 -13.828 0.661 1.00 0.00 C ATOM 1185 CD1 PHE A 77 -1.060 -12.507 1.071 1.00 0.00 C ATOM 1186 CD2 PHE A 77 -1.006 -14.108 -0.694 1.00 0.00 C ATOM 1187 CE1 PHE A 77 -0.965 -11.481 0.149 1.00 0.00 C ATOM 1188 CE2 PHE A 77 -0.913 -13.087 -1.621 1.00 0.00 C ATOM 1189 CZ PHE A 77 -0.892 -11.772 -1.199 1.00 0.00 C ATOM 0 H PHE A 77 0.449 -13.097 3.042 1.00 0.00 H new ATOM 0 HA PHE A 77 -0.014 -16.015 3.113 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -1.367 -15.878 1.141 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -2.043 -14.761 2.310 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.118 -12.274 2.124 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.020 -15.135 -1.029 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.948 -10.454 0.482 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.857 -13.317 -2.675 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.819 -10.973 -1.922 1.00 0.00 H new ATOM 1199 N ASN A 78 1.326 -16.178 0.767 1.00 0.00 N ATOM 1200 CA ASN A 78 2.453 -16.374 -0.139 1.00 0.00 C ATOM 1201 C ASN A 78 2.042 -16.106 -1.583 1.00 0.00 C ATOM 1202 O ASN A 78 1.064 -16.670 -2.075 1.00 0.00 O ATOM 1203 CB ASN A 78 2.999 -17.797 -0.006 1.00 0.00 C ATOM 1204 CG ASN A 78 4.213 -17.869 0.900 1.00 0.00 C ATOM 1205 OD1 ASN A 78 5.349 -17.723 0.447 1.00 0.00 O ATOM 1206 ND2 ASN A 78 3.979 -18.094 2.187 1.00 0.00 N ATOM 0 H ASN A 78 0.574 -16.858 0.658 1.00 0.00 H new ATOM 0 HA ASN A 78 3.235 -15.666 0.134 1.00 0.00 H new ATOM 0 HB2 ASN A 78 2.217 -18.448 0.386 1.00 0.00 H new ATOM 0 HB3 ASN A 78 3.263 -18.175 -0.993 1.00 0.00 H new ATOM 0 HD21 ASN A 78 4.757 -18.152 2.844 1.00 0.00 H new ATOM 0 HD22 ASN A 78 3.021 -18.209 2.519 1.00 0.00 H new ATOM 1213 N ALA A 79 2.795 -15.243 -2.256 1.00 0.00 N ATOM 1214 CA ALA A 79 2.508 -14.901 -3.644 1.00 0.00 C ATOM 1215 C ALA A 79 3.246 -15.823 -4.612 1.00 0.00 C ATOM 1216 O ALA A 79 3.403 -15.500 -5.789 1.00 0.00 O ATOM 1217 CB ALA A 79 2.879 -13.451 -3.914 1.00 0.00 C ATOM 0 H ALA A 79 3.608 -14.768 -1.863 1.00 0.00 H new ATOM 0 HA ALA A 79 1.438 -15.034 -3.807 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.660 -13.207 -4.954 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.301 -12.799 -3.259 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.942 -13.306 -3.723 1.00 0.00 H new ATOM 1223 N ALA A 80 3.696 -16.971 -4.113 1.00 0.00 N ATOM 1224 CA ALA A 80 4.413 -17.933 -4.940 1.00 0.00 C ATOM 1225 C ALA A 80 3.483 -19.036 -5.429 1.00 0.00 C ATOM 1226 O ALA A 80 3.693 -19.611 -6.496 1.00 0.00 O ATOM 1227 CB ALA A 80 5.573 -18.535 -4.164 1.00 0.00 C ATOM 0 H ALA A 80 3.576 -17.256 -3.141 1.00 0.00 H new ATOM 0 HA ALA A 80 4.803 -17.404 -5.810 1.00 0.00 H new ATOM 0 HB1 ALA A 80 6.099 -19.252 -4.794 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.259 -17.743 -3.863 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.193 -19.042 -3.277 1.00 0.00 H new ATOM 1233 N THR A 81 2.458 -19.330 -4.637 1.00 0.00 N ATOM 1234 CA THR A 81 1.499 -20.371 -4.986 1.00 0.00 C ATOM 1235 C THR A 81 0.069 -19.913 -4.718 1.00 0.00 C ATOM 1236 O THR A 81 -0.748 -20.670 -4.195 1.00 0.00 O ATOM 1237 CB THR A 81 1.802 -21.642 -4.195 1.00 0.00 C ATOM 1238 OG1 THR A 81 1.733 -21.397 -2.802 1.00 0.00 O ATOM 1239 CG2 THR A 81 3.171 -22.205 -4.498 1.00 0.00 C ATOM 0 H THR A 81 2.270 -18.863 -3.750 1.00 0.00 H new ATOM 0 HA THR A 81 1.592 -20.579 -6.052 1.00 0.00 H new ATOM 0 HB THR A 81 1.047 -22.367 -4.499 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.929 -22.224 -2.314 1.00 0.00 H new ATOM 0 HG21 THR A 81 3.332 -23.107 -3.908 1.00 0.00 H new ATOM 0 HG22 THR A 81 3.238 -22.448 -5.558 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.932 -21.466 -4.247 1.00 0.00 H new ATOM 1247 N GLU A 82 -0.226 -18.669 -5.083 1.00 0.00 N ATOM 1248 CA GLU A 82 -1.558 -18.109 -4.884 1.00 0.00 C ATOM 1249 C GLU A 82 -1.944 -17.199 -6.045 1.00 0.00 C ATOM 1250 O GLU A 82 -1.156 -16.356 -6.476 1.00 0.00 O ATOM 1251 CB GLU A 82 -1.615 -17.329 -3.569 1.00 0.00 C ATOM 1252 CG GLU A 82 -1.745 -18.215 -2.342 1.00 0.00 C ATOM 1253 CD GLU A 82 -3.118 -18.850 -2.224 1.00 0.00 C ATOM 1254 OE1 GLU A 82 -3.976 -18.572 -3.088 1.00 0.00 O ATOM 1255 OE2 GLU A 82 -3.334 -19.623 -1.268 1.00 0.00 O ATOM 0 H GLU A 82 0.439 -18.030 -5.518 1.00 0.00 H new ATOM 0 HA GLU A 82 -2.269 -18.934 -4.840 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.713 -16.724 -3.476 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -2.459 -16.640 -3.601 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -0.989 -18.999 -2.382 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -1.544 -17.624 -1.449 1.00 0.00 H new ATOM 1262 N ASP A 83 -3.161 -17.376 -6.550 1.00 0.00 N ATOM 1263 CA ASP A 83 -3.651 -16.571 -7.663 1.00 0.00 C ATOM 1264 C ASP A 83 -3.496 -15.082 -7.370 1.00 0.00 C ATOM 1265 O ASP A 83 -3.831 -14.615 -6.282 1.00 0.00 O ATOM 1266 CB ASP A 83 -5.118 -16.895 -7.947 1.00 0.00 C ATOM 1267 CG ASP A 83 -5.942 -17.011 -6.679 1.00 0.00 C ATOM 1268 OD1 ASP A 83 -5.709 -16.214 -5.746 1.00 0.00 O ATOM 1269 OD2 ASP A 83 -6.819 -17.897 -6.620 1.00 0.00 O ATOM 0 H ASP A 83 -3.825 -18.069 -6.206 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.055 -16.814 -8.542 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -5.542 -16.118 -8.583 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -5.179 -17.830 -8.503 1.00 0.00 H new ATOM 1274 N LEU A 84 -2.990 -14.341 -8.349 1.00 0.00 N ATOM 1275 CA LEU A 84 -2.793 -12.904 -8.198 1.00 0.00 C ATOM 1276 C LEU A 84 -3.559 -12.130 -9.267 1.00 0.00 C ATOM 1277 O LEU A 84 -3.236 -10.980 -9.562 1.00 0.00 O ATOM 1278 CB LEU A 84 -1.307 -12.561 -8.277 1.00 0.00 C ATOM 1279 CG LEU A 84 -0.417 -13.287 -7.268 1.00 0.00 C ATOM 1280 CD1 LEU A 84 1.031 -13.284 -7.732 1.00 0.00 C ATOM 1281 CD2 LEU A 84 -0.540 -12.646 -5.894 1.00 0.00 C ATOM 0 H LEU A 84 -2.708 -14.712 -9.257 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.177 -12.614 -7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.951 -12.789 -9.282 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.190 -11.487 -8.133 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.750 -14.322 -7.197 1.00 0.00 H new ATOM 0 HD11 LEU A 84 1.649 -13.805 -7.001 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.105 -13.789 -8.695 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.379 -12.256 -7.833 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.100 -13.175 -5.187 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.233 -11.602 -5.951 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.575 -12.702 -5.558 1.00 0.00 H new ATOM 1293 N ASN A 85 -4.576 -12.765 -9.841 1.00 0.00 N ATOM 1294 CA ASN A 85 -5.386 -12.131 -10.874 1.00 0.00 C ATOM 1295 C ASN A 85 -6.847 -12.553 -10.755 1.00 0.00 C ATOM 1296 O ASN A 85 -7.607 -12.470 -11.720 1.00 0.00 O ATOM 1297 CB ASN A 85 -4.851 -12.487 -12.262 1.00 0.00 C ATOM 1298 CG ASN A 85 -5.290 -11.495 -13.322 1.00 0.00 C ATOM 1299 OD1 ASN A 85 -5.775 -10.407 -13.008 1.00 0.00 O ATOM 1300 ND2 ASN A 85 -5.123 -11.867 -14.585 1.00 0.00 N ATOM 0 H ASN A 85 -4.858 -13.717 -9.608 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.326 -11.051 -10.736 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.762 -12.523 -12.231 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -5.195 -13.484 -12.536 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -5.401 -11.242 -15.342 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.717 -12.778 -14.799 1.00 0.00 H new ATOM 1307 N ASN A 86 -7.235 -13.007 -9.565 1.00 0.00 N ATOM 1308 CA ASN A 86 -8.607 -13.442 -9.325 1.00 0.00 C ATOM 1309 C ASN A 86 -9.174 -12.841 -8.036 1.00 0.00 C ATOM 1310 O ASN A 86 -10.296 -13.158 -7.641 1.00 0.00 O ATOM 1311 CB ASN A 86 -8.671 -14.968 -9.257 1.00 0.00 C ATOM 1312 CG ASN A 86 -8.534 -15.614 -10.623 1.00 0.00 C ATOM 1313 OD1 ASN A 86 -7.340 -15.535 -11.199 1.00 0.00 O flip ATOM 1314 ND2 ASN A 86 -9.490 -16.179 -11.153 1.00 0.00 N flip ATOM 0 H ASN A 86 -6.620 -13.083 -8.755 1.00 0.00 H new ATOM 0 HA ASN A 86 -9.216 -13.088 -10.157 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.878 -15.333 -8.604 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -9.618 -15.270 -8.809 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -10.390 -16.216 -10.674 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -9.383 -16.610 -12.071 1.00 0.00 H new ATOM 1321 N ASP A 87 -8.403 -11.972 -7.381 1.00 0.00 N ATOM 1322 CA ASP A 87 -8.849 -11.340 -6.145 1.00 0.00 C ATOM 1323 C ASP A 87 -9.432 -9.960 -6.428 1.00 0.00 C ATOM 1324 O ASP A 87 -8.742 -9.078 -6.938 1.00 0.00 O ATOM 1325 CB ASP A 87 -7.686 -11.224 -5.158 1.00 0.00 C ATOM 1326 CG ASP A 87 -7.176 -12.578 -4.704 1.00 0.00 C ATOM 1327 OD1 ASP A 87 -7.433 -13.576 -5.410 1.00 0.00 O ATOM 1328 OD2 ASP A 87 -6.520 -12.639 -3.643 1.00 0.00 O ATOM 0 H ASP A 87 -7.471 -11.692 -7.687 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.627 -11.963 -5.703 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.871 -10.670 -5.624 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -8.006 -10.649 -4.289 1.00 0.00 H new ATOM 1333 N ARG A 88 -10.708 -9.781 -6.100 1.00 0.00 N ATOM 1334 CA ARG A 88 -11.378 -8.506 -6.330 1.00 0.00 C ATOM 1335 C ARG A 88 -12.532 -8.304 -5.355 1.00 0.00 C ATOM 1336 O ARG A 88 -13.352 -9.200 -5.151 1.00 0.00 O ATOM 1337 CB ARG A 88 -11.895 -8.435 -7.767 1.00 0.00 C ATOM 1338 CG ARG A 88 -12.749 -9.628 -8.165 1.00 0.00 C ATOM 1339 CD ARG A 88 -13.820 -9.235 -9.169 1.00 0.00 C ATOM 1340 NE ARG A 88 -13.283 -8.404 -10.241 1.00 0.00 N ATOM 1341 CZ ARG A 88 -13.980 -8.052 -11.317 1.00 0.00 C ATOM 1342 NH1 ARG A 88 -15.234 -8.456 -11.459 1.00 0.00 N ATOM 1343 NH2 ARG A 88 -13.422 -7.295 -12.253 1.00 0.00 N ATOM 0 H ARG A 88 -11.296 -10.499 -5.676 1.00 0.00 H new ATOM 0 HA ARG A 88 -10.651 -7.711 -6.167 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -12.479 -7.523 -7.890 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -11.046 -8.363 -8.447 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -12.115 -10.404 -8.593 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -13.219 -10.053 -7.278 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -14.265 -10.134 -9.595 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -14.617 -8.696 -8.657 1.00 0.00 H new ATOM 0 HE ARG A 88 -12.321 -8.075 -10.161 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -15.667 -9.038 -10.742 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -15.767 -8.185 -12.285 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -12.457 -6.982 -12.148 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -13.958 -7.026 -13.078 1.00 0.00 H new ATOM 1357 N ILE A 89 -12.593 -7.117 -4.761 1.00 0.00 N ATOM 1358 CA ILE A 89 -13.652 -6.787 -3.814 1.00 0.00 C ATOM 1359 C ILE A 89 -14.889 -6.279 -4.548 1.00 0.00 C ATOM 1360 O ILE A 89 -14.817 -5.928 -5.726 1.00 0.00 O ATOM 1361 CB ILE A 89 -13.187 -5.721 -2.803 1.00 0.00 C ATOM 1362 CG1 ILE A 89 -11.793 -6.061 -2.274 1.00 0.00 C ATOM 1363 CG2 ILE A 89 -14.180 -5.605 -1.656 1.00 0.00 C ATOM 1364 CD1 ILE A 89 -11.237 -5.023 -1.324 1.00 0.00 C ATOM 0 H ILE A 89 -11.921 -6.366 -4.919 1.00 0.00 H new ATOM 0 HA ILE A 89 -13.900 -7.700 -3.272 1.00 0.00 H new ATOM 0 HB ILE A 89 -13.138 -4.759 -3.313 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -11.831 -7.024 -1.765 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -11.111 -6.173 -3.117 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -13.836 -4.848 -0.952 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -15.156 -5.319 -2.047 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -14.260 -6.565 -1.146 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -10.246 -5.330 -0.989 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -11.166 -4.063 -1.835 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -11.898 -4.927 -0.462 1.00 0.00 H new ATOM 1376 N THR A 90 -16.022 -6.246 -3.858 1.00 0.00 N ATOM 1377 CA THR A 90 -17.263 -5.783 -4.465 1.00 0.00 C ATOM 1378 C THR A 90 -18.114 -5.003 -3.467 1.00 0.00 C ATOM 1379 O THR A 90 -18.494 -5.523 -2.419 1.00 0.00 O ATOM 1380 CB THR A 90 -18.058 -6.969 -5.012 1.00 0.00 C ATOM 1381 OG1 THR A 90 -17.192 -8.032 -5.367 1.00 0.00 O ATOM 1382 CG2 THR A 90 -18.886 -6.624 -6.231 1.00 0.00 C ATOM 0 H THR A 90 -16.107 -6.533 -2.883 1.00 0.00 H new ATOM 0 HA THR A 90 -17.003 -5.113 -5.285 1.00 0.00 H new ATOM 0 HB THR A 90 -18.732 -7.261 -4.207 1.00 0.00 H new ATOM 0 HG1 THR A 90 -17.719 -8.782 -5.713 1.00 0.00 H new ATOM 0 HG21 THR A 90 -19.425 -7.510 -6.568 1.00 0.00 H new ATOM 0 HG22 THR A 90 -19.600 -5.840 -5.976 1.00 0.00 H new ATOM 0 HG23 THR A 90 -18.231 -6.273 -7.028 1.00 0.00 H new ATOM 1390 N ILE A 91 -18.412 -3.752 -3.806 1.00 0.00 N ATOM 1391 CA ILE A 91 -19.223 -2.897 -2.948 1.00 0.00 C ATOM 1392 C ILE A 91 -20.609 -2.688 -3.547 1.00 0.00 C ATOM 1393 O ILE A 91 -20.822 -1.773 -4.341 1.00 0.00 O ATOM 1394 CB ILE A 91 -18.559 -1.523 -2.734 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -17.108 -1.697 -2.281 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -19.344 -0.707 -1.719 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -16.118 -1.719 -3.424 1.00 0.00 C ATOM 0 H ILE A 91 -18.103 -3.308 -4.671 1.00 0.00 H new ATOM 0 HA ILE A 91 -19.312 -3.402 -1.986 1.00 0.00 H new ATOM 0 HB ILE A 91 -18.560 -0.984 -3.682 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -16.848 -0.886 -1.601 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -17.021 -2.626 -1.717 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -18.862 0.261 -1.579 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -20.361 -0.557 -2.081 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -19.372 -1.239 -0.768 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -15.110 -1.845 -3.030 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -16.352 -2.547 -4.093 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -16.177 -0.780 -3.975 1.00 0.00 H new ATOM 1409 N GLU A 92 -21.550 -3.546 -3.165 1.00 0.00 N ATOM 1410 CA GLU A 92 -22.915 -3.455 -3.671 1.00 0.00 C ATOM 1411 C GLU A 92 -23.827 -2.763 -2.662 1.00 0.00 C ATOM 1412 O GLU A 92 -23.955 -3.207 -1.521 1.00 0.00 O ATOM 1413 CB GLU A 92 -23.457 -4.850 -3.992 1.00 0.00 C ATOM 1414 CG GLU A 92 -22.477 -5.721 -4.761 1.00 0.00 C ATOM 1415 CD GLU A 92 -23.162 -6.844 -5.515 1.00 0.00 C ATOM 1416 OE1 GLU A 92 -24.410 -6.906 -5.483 1.00 0.00 O ATOM 1417 OE2 GLU A 92 -22.452 -7.661 -6.138 1.00 0.00 O ATOM 0 H GLU A 92 -21.393 -4.310 -2.508 1.00 0.00 H new ATOM 0 HA GLU A 92 -22.897 -2.860 -4.584 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -23.722 -5.351 -3.061 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -24.374 -4.750 -4.572 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -21.921 -5.102 -5.465 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -21.751 -6.144 -4.067 1.00 0.00 H new ATOM 1424 N TRP A 93 -24.459 -1.675 -3.091 1.00 0.00 N ATOM 1425 CA TRP A 93 -25.360 -0.925 -2.223 1.00 0.00 C ATOM 1426 C TRP A 93 -26.663 -0.595 -2.945 1.00 0.00 C ATOM 1427 O TRP A 93 -26.668 -0.319 -4.144 1.00 0.00 O ATOM 1428 CB TRP A 93 -24.685 0.360 -1.733 1.00 0.00 C ATOM 1429 CG TRP A 93 -24.575 1.423 -2.786 1.00 0.00 C ATOM 1430 CD1 TRP A 93 -25.270 2.599 -2.838 1.00 0.00 C ATOM 1431 CD2 TRP A 93 -23.722 1.409 -3.937 1.00 0.00 C ATOM 1432 NE1 TRP A 93 -24.900 3.315 -3.951 1.00 0.00 N ATOM 1433 CE2 TRP A 93 -23.952 2.606 -4.641 1.00 0.00 C ATOM 1434 CE3 TRP A 93 -22.787 0.500 -4.439 1.00 0.00 C ATOM 1435 CZ2 TRP A 93 -23.279 2.917 -5.820 1.00 0.00 C ATOM 1436 CZ3 TRP A 93 -22.120 0.810 -5.610 1.00 0.00 C ATOM 1437 CH2 TRP A 93 -22.369 2.009 -6.288 1.00 0.00 C ATOM 0 H TRP A 93 -24.364 -1.294 -4.032 1.00 0.00 H new ATOM 0 HA TRP A 93 -25.595 -1.548 -1.360 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -25.248 0.756 -0.887 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -23.687 0.119 -1.367 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -26.002 2.918 -2.111 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -25.271 4.226 -4.220 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -22.589 -0.427 -3.922 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -23.469 3.841 -6.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -21.395 0.116 -6.008 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -21.831 2.222 -7.200 1.00 0.00 H new ATOM 1448 N THR A 94 -27.767 -0.624 -2.204 1.00 0.00 N ATOM 1449 CA THR A 94 -29.077 -0.327 -2.771 1.00 0.00 C ATOM 1450 C THR A 94 -29.915 0.498 -1.801 1.00 0.00 C ATOM 1451 O THR A 94 -29.945 0.220 -0.601 1.00 0.00 O ATOM 1452 CB THR A 94 -29.811 -1.622 -3.121 1.00 0.00 C ATOM 1453 OG1 THR A 94 -31.102 -1.342 -3.633 1.00 0.00 O ATOM 1454 CG2 THR A 94 -29.980 -2.552 -1.941 1.00 0.00 C ATOM 0 H THR A 94 -27.780 -0.850 -1.209 1.00 0.00 H new ATOM 0 HA THR A 94 -28.927 0.255 -3.680 1.00 0.00 H new ATOM 0 HB THR A 94 -29.187 -2.116 -3.866 1.00 0.00 H new ATOM 0 HG1 THR A 94 -31.556 -2.182 -3.853 1.00 0.00 H new ATOM 0 HG21 THR A 94 -30.508 -3.451 -2.259 1.00 0.00 H new ATOM 0 HG22 THR A 94 -29.000 -2.826 -1.550 1.00 0.00 H new ATOM 0 HG23 THR A 94 -30.554 -2.050 -1.162 1.00 0.00 H new ATOM 1462 N ASN A 95 -30.594 1.513 -2.326 1.00 0.00 N ATOM 1463 CA ASN A 95 -31.433 2.376 -1.503 1.00 0.00 C ATOM 1464 C ASN A 95 -32.374 1.553 -0.631 1.00 0.00 C ATOM 1465 O ASN A 95 -32.856 0.498 -1.043 1.00 0.00 O ATOM 1466 CB ASN A 95 -32.241 3.329 -2.386 1.00 0.00 C ATOM 1467 CG ASN A 95 -32.817 4.493 -1.603 1.00 0.00 C ATOM 1468 OD1 ASN A 95 -33.575 4.302 -0.654 1.00 0.00 O ATOM 1469 ND2 ASN A 95 -32.457 5.708 -2.000 1.00 0.00 N ATOM 0 H ASN A 95 -30.580 1.758 -3.316 1.00 0.00 H new ATOM 0 HA ASN A 95 -30.781 2.958 -0.852 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -31.603 3.711 -3.183 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -33.052 2.779 -2.863 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -32.812 6.530 -1.512 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -31.825 5.819 -2.793 1.00 0.00 H new ATOM 1476 N THR A 96 -32.629 2.041 0.578 1.00 0.00 N ATOM 1477 CA THR A 96 -33.510 1.348 1.510 1.00 0.00 C ATOM 1478 C THR A 96 -34.974 1.679 1.225 1.00 0.00 C ATOM 1479 O THR A 96 -35.313 2.825 0.933 1.00 0.00 O ATOM 1480 CB THR A 96 -33.159 1.725 2.951 1.00 0.00 C ATOM 1481 OG1 THR A 96 -32.727 3.072 3.026 1.00 0.00 O ATOM 1482 CG2 THR A 96 -32.070 0.859 3.546 1.00 0.00 C ATOM 0 H THR A 96 -32.238 2.913 0.935 1.00 0.00 H new ATOM 0 HA THR A 96 -33.368 0.275 1.378 1.00 0.00 H new ATOM 0 HB THR A 96 -34.075 1.573 3.522 1.00 0.00 H new ATOM 0 HG1 THR A 96 -33.286 3.628 2.443 1.00 0.00 H new ATOM 0 HG21 THR A 96 -31.869 1.179 4.569 1.00 0.00 H new ATOM 0 HG22 THR A 96 -32.393 -0.182 3.548 1.00 0.00 H new ATOM 0 HG23 THR A 96 -31.162 0.956 2.951 1.00 0.00 H new ATOM 1490 N PRO A 97 -35.864 0.674 1.307 1.00 0.00 N ATOM 1491 CA PRO A 97 -37.295 0.867 1.055 1.00 0.00 C ATOM 1492 C PRO A 97 -37.980 1.647 2.170 1.00 0.00 C ATOM 1493 O PRO A 97 -37.464 1.743 3.284 1.00 0.00 O ATOM 1494 CB PRO A 97 -37.839 -0.561 0.990 1.00 0.00 C ATOM 1495 CG PRO A 97 -36.900 -1.361 1.823 1.00 0.00 C ATOM 1496 CD PRO A 97 -35.546 -0.726 1.648 1.00 0.00 C ATOM 0 HA PRO A 97 -37.475 1.448 0.150 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -38.856 -0.615 1.377 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -37.869 -0.927 -0.036 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -37.203 -1.352 2.870 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -36.886 -2.403 1.504 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -34.951 -0.792 2.559 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -34.974 -1.212 0.857 1.00 0.00 H new ATOM 1504 N ASP A 98 -39.145 2.204 1.861 1.00 0.00 N ATOM 1505 CA ASP A 98 -39.907 2.980 2.834 1.00 0.00 C ATOM 1506 C ASP A 98 -40.037 2.230 4.157 1.00 0.00 C ATOM 1507 O ASP A 98 -40.430 1.064 4.184 1.00 0.00 O ATOM 1508 CB ASP A 98 -41.296 3.304 2.281 1.00 0.00 C ATOM 1509 CG ASP A 98 -41.234 3.978 0.924 1.00 0.00 C ATOM 1510 OD1 ASP A 98 -40.286 4.758 0.691 1.00 0.00 O ATOM 1511 OD2 ASP A 98 -42.132 3.726 0.094 1.00 0.00 O ATOM 0 H ASP A 98 -39.584 2.133 0.943 1.00 0.00 H new ATOM 0 HA ASP A 98 -39.368 3.909 3.019 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -41.876 2.385 2.201 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -41.821 3.952 2.982 1.00 0.00 H new ATOM 1516 N GLY A 99 -39.705 2.909 5.250 1.00 0.00 N ATOM 1517 CA GLY A 99 -39.793 2.295 6.562 1.00 0.00 C ATOM 1518 C GLY A 99 -38.897 1.079 6.699 1.00 0.00 C ATOM 1519 O GLY A 99 -39.273 0.092 7.331 1.00 0.00 O ATOM 0 H GLY A 99 -39.376 3.875 5.251 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -39.522 3.029 7.321 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -40.826 2.004 6.754 1.00 0.00 H new ATOM 1523 N ALA A 100 -37.709 1.150 6.107 1.00 0.00 N ATOM 1524 CA ALA A 100 -36.759 0.047 6.168 1.00 0.00 C ATOM 1525 C ALA A 100 -36.155 -0.079 7.563 1.00 0.00 C ATOM 1526 O ALA A 100 -35.748 0.914 8.166 1.00 0.00 O ATOM 1527 CB ALA A 100 -35.662 0.234 5.131 1.00 0.00 C ATOM 0 H ALA A 100 -37.382 1.960 5.580 1.00 0.00 H new ATOM 0 HA ALA A 100 -37.297 -0.875 5.947 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -34.960 -0.598 5.189 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -36.104 0.267 4.135 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -35.134 1.168 5.324 1.00 0.00 H new ATOM 1533 N ALA A 101 -36.102 -1.307 8.070 1.00 0.00 N ATOM 1534 CA ALA A 101 -35.548 -1.564 9.394 1.00 0.00 C ATOM 1535 C ALA A 101 -34.148 -0.987 9.528 1.00 0.00 C ATOM 1536 O ALA A 101 -33.495 -0.664 8.536 1.00 0.00 O ATOM 1537 CB ALA A 101 -35.524 -3.057 9.678 1.00 0.00 C ATOM 0 H ALA A 101 -36.436 -2.139 7.584 1.00 0.00 H new ATOM 0 HA ALA A 101 -36.190 -1.072 10.124 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -35.108 -3.232 10.670 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -36.539 -3.452 9.636 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -34.908 -3.559 8.932 1.00 0.00 H new ATOM 1543 N LYS A 102 -33.694 -0.868 10.768 1.00 0.00 N ATOM 1544 CA LYS A 102 -32.367 -0.335 11.047 1.00 0.00 C ATOM 1545 C LYS A 102 -31.339 -1.456 11.087 1.00 0.00 C ATOM 1546 O LYS A 102 -30.811 -1.798 12.145 1.00 0.00 O ATOM 1547 CB LYS A 102 -32.362 0.433 12.370 1.00 0.00 C ATOM 1548 CG LYS A 102 -32.706 1.906 12.220 1.00 0.00 C ATOM 1549 CD LYS A 102 -31.510 2.791 12.532 1.00 0.00 C ATOM 1550 CE LYS A 102 -31.409 3.086 14.019 1.00 0.00 C ATOM 1551 NZ LYS A 102 -30.049 3.560 14.400 1.00 0.00 N ATOM 0 H LYS A 102 -34.225 -1.133 11.597 1.00 0.00 H new ATOM 0 HA LYS A 102 -32.101 0.354 10.245 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -33.075 -0.030 13.052 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -31.377 0.343 12.829 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -33.048 2.099 11.203 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -33.531 2.158 12.887 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -30.596 2.302 12.194 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -31.594 3.727 11.979 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -32.146 3.842 14.290 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -31.652 2.187 14.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -30.021 3.750 15.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -29.348 2.829 14.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -29.827 4.432 13.879 1.00 0.00 H new ATOM 1565 N GLN A 103 -31.062 -2.019 9.920 1.00 0.00 N ATOM 1566 CA GLN A 103 -30.097 -3.105 9.799 1.00 0.00 C ATOM 1567 C GLN A 103 -30.046 -3.628 8.366 1.00 0.00 C ATOM 1568 O GLN A 103 -31.061 -3.659 7.671 1.00 0.00 O ATOM 1569 CB GLN A 103 -30.452 -4.243 10.758 1.00 0.00 C ATOM 1570 CG GLN A 103 -29.250 -4.823 11.488 1.00 0.00 C ATOM 1571 CD GLN A 103 -29.240 -4.474 12.964 1.00 0.00 C ATOM 1572 OE1 GLN A 103 -30.256 -4.062 13.523 1.00 0.00 O ATOM 1573 NE2 GLN A 103 -28.087 -4.637 13.603 1.00 0.00 N ATOM 0 H GLN A 103 -31.494 -1.741 9.039 1.00 0.00 H new ATOM 0 HA GLN A 103 -29.114 -2.715 10.061 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -31.170 -3.877 11.492 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -30.945 -5.038 10.198 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -29.249 -5.907 11.375 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -28.335 -4.453 11.025 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -27.269 -4.981 13.100 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -28.019 -4.418 14.597 1.00 0.00 H new ATOM 1582 N PHE A 104 -28.859 -4.038 7.933 1.00 0.00 N ATOM 1583 CA PHE A 104 -28.675 -4.559 6.583 1.00 0.00 C ATOM 1584 C PHE A 104 -29.589 -5.753 6.327 1.00 0.00 C ATOM 1585 O PHE A 104 -29.456 -6.797 6.965 1.00 0.00 O ATOM 1586 CB PHE A 104 -27.215 -4.965 6.366 1.00 0.00 C ATOM 1587 CG PHE A 104 -26.956 -5.579 5.019 1.00 0.00 C ATOM 1588 CD1 PHE A 104 -26.642 -4.783 3.930 1.00 0.00 C ATOM 1589 CD2 PHE A 104 -27.028 -6.951 4.844 1.00 0.00 C ATOM 1590 CE1 PHE A 104 -26.403 -5.344 2.689 1.00 0.00 C ATOM 1591 CE2 PHE A 104 -26.789 -7.519 3.607 1.00 0.00 C ATOM 1592 CZ PHE A 104 -26.477 -6.715 2.528 1.00 0.00 C ATOM 0 H PHE A 104 -28.009 -4.020 8.497 1.00 0.00 H new ATOM 0 HA PHE A 104 -28.936 -3.769 5.879 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -26.581 -4.086 6.484 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -26.924 -5.674 7.141 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -26.583 -3.711 4.052 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -27.274 -7.584 5.684 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -26.159 -4.713 1.847 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -26.846 -8.590 3.484 1.00 0.00 H new ATOM 0 HZ PHE A 104 -26.291 -7.157 1.560 1.00 0.00 H new ATOM 1602 N ARG A 105 -30.515 -5.591 5.388 1.00 0.00 N ATOM 1603 CA ARG A 105 -31.449 -6.657 5.045 1.00 0.00 C ATOM 1604 C ARG A 105 -31.087 -7.284 3.703 1.00 0.00 C ATOM 1605 O ARG A 105 -30.474 -6.642 2.851 1.00 0.00 O ATOM 1606 CB ARG A 105 -32.880 -6.116 5.001 1.00 0.00 C ATOM 1607 CG ARG A 105 -33.719 -6.516 6.203 1.00 0.00 C ATOM 1608 CD ARG A 105 -34.156 -7.969 6.119 1.00 0.00 C ATOM 1609 NE ARG A 105 -33.254 -8.855 6.849 1.00 0.00 N ATOM 1610 CZ ARG A 105 -33.273 -8.999 8.170 1.00 0.00 C ATOM 1611 NH1 ARG A 105 -34.142 -8.317 8.902 1.00 0.00 N ATOM 1612 NH2 ARG A 105 -32.421 -9.826 8.761 1.00 0.00 N ATOM 0 H ARG A 105 -30.639 -4.732 4.851 1.00 0.00 H new ATOM 0 HA ARG A 105 -31.384 -7.426 5.815 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -32.846 -5.028 4.938 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -33.367 -6.473 4.094 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -33.145 -6.360 7.117 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -34.598 -5.874 6.265 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -35.165 -8.068 6.520 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -34.197 -8.275 5.074 1.00 0.00 H new ATOM 0 HE ARG A 105 -32.571 -9.393 6.316 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -34.799 -7.679 8.452 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -34.154 -8.430 9.916 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -31.750 -10.352 8.202 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -32.437 -9.935 9.775 1.00 0.00 H new ATOM 1626 N ARG A 106 -31.469 -8.544 3.523 1.00 0.00 N ATOM 1627 CA ARG A 106 -31.181 -9.259 2.285 1.00 0.00 C ATOM 1628 C ARG A 106 -32.274 -9.018 1.248 1.00 0.00 C ATOM 1629 O ARG A 106 -32.026 -9.082 0.044 1.00 0.00 O ATOM 1630 CB ARG A 106 -31.041 -10.757 2.557 1.00 0.00 C ATOM 1631 CG ARG A 106 -32.355 -11.442 2.892 1.00 0.00 C ATOM 1632 CD ARG A 106 -32.126 -12.778 3.580 1.00 0.00 C ATOM 1633 NE ARG A 106 -33.240 -13.699 3.372 1.00 0.00 N ATOM 1634 CZ ARG A 106 -33.329 -14.889 3.955 1.00 0.00 C ATOM 1635 NH1 ARG A 106 -32.375 -15.300 4.780 1.00 0.00 N ATOM 1636 NH2 ARG A 106 -34.373 -15.671 3.716 1.00 0.00 N ATOM 0 H ARG A 106 -31.978 -9.090 4.218 1.00 0.00 H new ATOM 0 HA ARG A 106 -30.240 -8.879 1.888 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -30.604 -11.237 1.681 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -30.344 -10.904 3.382 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -32.949 -10.796 3.538 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -32.930 -11.595 1.979 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -31.208 -13.228 3.201 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -31.984 -12.616 4.649 1.00 0.00 H new ATOM 0 HE ARG A 106 -33.991 -13.413 2.744 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -31.571 -14.702 4.968 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -32.446 -16.214 5.226 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -35.110 -15.359 3.083 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -34.439 -16.585 4.165 1.00 0.00 H new ATOM 1650 N GLU A 107 -33.484 -8.742 1.723 1.00 0.00 N ATOM 1651 CA GLU A 107 -34.614 -8.492 0.836 1.00 0.00 C ATOM 1652 C GLU A 107 -34.350 -7.284 -0.056 1.00 0.00 C ATOM 1653 O GLU A 107 -34.797 -7.237 -1.202 1.00 0.00 O ATOM 1654 CB GLU A 107 -35.891 -8.273 1.648 1.00 0.00 C ATOM 1655 CG GLU A 107 -35.884 -6.986 2.457 1.00 0.00 C ATOM 1656 CD GLU A 107 -36.807 -7.048 3.660 1.00 0.00 C ATOM 1657 OE1 GLU A 107 -37.942 -7.547 3.512 1.00 0.00 O ATOM 1658 OE2 GLU A 107 -36.394 -6.597 4.749 1.00 0.00 O ATOM 0 H GLU A 107 -33.707 -8.686 2.717 1.00 0.00 H new ATOM 0 HA GLU A 107 -34.744 -9.368 0.200 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -36.745 -8.262 0.971 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -36.031 -9.117 2.324 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -34.868 -6.778 2.793 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -36.184 -6.157 1.816 1.00 0.00 H new ATOM 1665 N TRP A 108 -33.621 -6.308 0.476 1.00 0.00 N ATOM 1666 CA TRP A 108 -33.298 -5.101 -0.273 1.00 0.00 C ATOM 1667 C TRP A 108 -32.653 -5.446 -1.611 1.00 0.00 C ATOM 1668 O TRP A 108 -32.822 -4.728 -2.596 1.00 0.00 O ATOM 1669 CB TRP A 108 -32.363 -4.205 0.541 1.00 0.00 C ATOM 1670 CG TRP A 108 -32.964 -3.731 1.829 1.00 0.00 C ATOM 1671 CD1 TRP A 108 -34.284 -3.759 2.176 1.00 0.00 C ATOM 1672 CD2 TRP A 108 -32.268 -3.157 2.941 1.00 0.00 C ATOM 1673 NE1 TRP A 108 -34.451 -3.239 3.436 1.00 0.00 N ATOM 1674 CE2 TRP A 108 -33.228 -2.863 3.927 1.00 0.00 C ATOM 1675 CE3 TRP A 108 -30.925 -2.867 3.199 1.00 0.00 C ATOM 1676 CZ2 TRP A 108 -32.887 -2.290 5.151 1.00 0.00 C ATOM 1677 CZ3 TRP A 108 -30.588 -2.298 4.414 1.00 0.00 C ATOM 1678 CH2 TRP A 108 -31.565 -2.017 5.376 1.00 0.00 C ATOM 0 H TRP A 108 -33.243 -6.330 1.423 1.00 0.00 H new ATOM 0 HA TRP A 108 -34.227 -4.565 -0.466 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -31.445 -4.752 0.757 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -32.085 -3.340 -0.061 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -35.080 -4.135 1.551 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -35.341 -3.148 3.927 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -30.165 -3.083 2.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -33.639 -2.070 5.895 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -29.554 -2.067 4.624 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -31.269 -1.575 6.316 1.00 0.00 H new ATOM 1689 N PHE A 109 -31.913 -6.550 -1.638 1.00 0.00 N ATOM 1690 CA PHE A 109 -31.241 -6.990 -2.856 1.00 0.00 C ATOM 1691 C PHE A 109 -32.165 -7.858 -3.704 1.00 0.00 C ATOM 1692 O PHE A 109 -32.096 -7.839 -4.933 1.00 0.00 O ATOM 1693 CB PHE A 109 -29.969 -7.764 -2.510 1.00 0.00 C ATOM 1694 CG PHE A 109 -28.798 -6.881 -2.183 1.00 0.00 C ATOM 1695 CD1 PHE A 109 -28.853 -6.003 -1.114 1.00 0.00 C ATOM 1696 CD2 PHE A 109 -27.644 -6.929 -2.948 1.00 0.00 C ATOM 1697 CE1 PHE A 109 -27.777 -5.188 -0.812 1.00 0.00 C ATOM 1698 CE2 PHE A 109 -26.565 -6.118 -2.652 1.00 0.00 C ATOM 1699 CZ PHE A 109 -26.631 -5.246 -1.583 1.00 0.00 C ATOM 0 H PHE A 109 -31.763 -7.156 -0.831 1.00 0.00 H new ATOM 0 HA PHE A 109 -30.973 -6.105 -3.434 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -30.170 -8.416 -1.660 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -29.705 -8.407 -3.350 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -29.746 -5.954 -0.509 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -27.587 -7.608 -3.786 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -27.832 -4.507 0.025 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -25.671 -6.166 -3.256 1.00 0.00 H new ATOM 0 HZ PHE A 109 -25.789 -4.611 -1.350 1.00 0.00 H new ATOM 1709 N GLN A 110 -33.029 -8.619 -3.041 1.00 0.00 N ATOM 1710 CA GLN A 110 -33.966 -9.494 -3.735 1.00 0.00 C ATOM 1711 C GLN A 110 -35.367 -8.891 -3.749 1.00 0.00 C ATOM 1712 O GLN A 110 -36.362 -9.605 -3.629 1.00 0.00 O ATOM 1713 CB GLN A 110 -34.000 -10.871 -3.071 1.00 0.00 C ATOM 1714 CG GLN A 110 -32.621 -11.430 -2.757 1.00 0.00 C ATOM 1715 CD GLN A 110 -32.590 -12.945 -2.773 1.00 0.00 C ATOM 1716 OE1 GLN A 110 -33.619 -13.601 -2.603 1.00 0.00 O ATOM 1717 NE2 GLN A 110 -31.406 -13.512 -2.977 1.00 0.00 N ATOM 0 H GLN A 110 -33.100 -8.647 -2.024 1.00 0.00 H new ATOM 0 HA GLN A 110 -33.625 -9.603 -4.765 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -34.575 -10.806 -2.147 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -34.525 -11.567 -3.725 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -31.904 -11.048 -3.483 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -32.303 -11.074 -1.777 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -30.579 -12.931 -3.113 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -31.324 -14.528 -2.997 1.00 0.00 H new ATOM 1726 N GLY A 111 -35.436 -7.571 -3.896 1.00 0.00 N ATOM 1727 CA GLY A 111 -36.719 -6.894 -3.922 1.00 0.00 C ATOM 1728 C GLY A 111 -36.837 -5.923 -5.079 1.00 0.00 C ATOM 1729 O GLY A 111 -36.294 -6.161 -6.158 1.00 0.00 O ATOM 0 H GLY A 111 -34.626 -6.959 -3.997 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -37.516 -7.634 -3.990 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -36.862 -6.357 -2.984 1.00 0.00 H new ATOM 1733 N ASP A 112 -37.549 -4.822 -4.855 1.00 0.00 N ATOM 1734 CA ASP A 112 -37.738 -3.809 -5.887 1.00 0.00 C ATOM 1735 C ASP A 112 -36.636 -2.757 -5.826 1.00 0.00 C ATOM 1736 O ASP A 112 -36.032 -2.536 -4.777 1.00 0.00 O ATOM 1737 CB ASP A 112 -39.105 -3.143 -5.734 1.00 0.00 C ATOM 1738 CG ASP A 112 -40.182 -3.843 -6.539 1.00 0.00 C ATOM 1739 OD1 ASP A 112 -39.832 -4.689 -7.389 1.00 0.00 O ATOM 1740 OD2 ASP A 112 -41.376 -3.547 -6.319 1.00 0.00 O ATOM 0 H ASP A 112 -38.004 -4.609 -3.967 1.00 0.00 H new ATOM 0 HA ASP A 112 -37.690 -4.303 -6.858 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -39.388 -3.138 -4.681 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -39.037 -2.102 -6.051 1.00 0.00 H new ATOM 1745 N GLY A 113 -36.381 -2.111 -6.959 1.00 0.00 N ATOM 1746 CA GLY A 113 -35.355 -1.089 -7.016 1.00 0.00 C ATOM 1747 C GLY A 113 -34.156 -1.517 -7.841 1.00 0.00 C ATOM 1748 O GLY A 113 -34.169 -2.580 -8.461 1.00 0.00 O ATOM 0 H GLY A 113 -36.868 -2.278 -7.840 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -35.777 -0.178 -7.440 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -35.029 -0.849 -6.004 1.00 0.00 H new ATOM 1752 N MET A 114 -33.118 -0.687 -7.848 1.00 0.00 N ATOM 1753 CA MET A 114 -31.906 -0.985 -8.602 1.00 0.00 C ATOM 1754 C MET A 114 -30.703 -1.107 -7.672 1.00 0.00 C ATOM 1755 O MET A 114 -30.490 -0.262 -6.802 1.00 0.00 O ATOM 1756 CB MET A 114 -31.649 0.101 -9.647 1.00 0.00 C ATOM 1757 CG MET A 114 -31.531 -0.435 -11.065 1.00 0.00 C ATOM 1758 SD MET A 114 -29.819 -0.656 -11.583 1.00 0.00 S ATOM 1759 CE MET A 114 -29.465 0.955 -12.279 1.00 0.00 C ATOM 0 H MET A 114 -33.092 0.197 -7.340 1.00 0.00 H new ATOM 0 HA MET A 114 -32.050 -1.939 -9.109 1.00 0.00 H new ATOM 0 HB2 MET A 114 -32.459 0.829 -9.609 1.00 0.00 H new ATOM 0 HB3 MET A 114 -30.732 0.631 -9.390 1.00 0.00 H new ATOM 0 HG2 MET A 114 -32.053 -1.389 -11.133 1.00 0.00 H new ATOM 0 HG3 MET A 114 -32.029 0.250 -11.751 1.00 0.00 H new ATOM 0 HE1 MET A 114 -28.663 0.866 -13.012 1.00 0.00 H new ATOM 0 HE2 MET A 114 -30.359 1.346 -12.765 1.00 0.00 H new ATOM 0 HE3 MET A 114 -29.157 1.635 -11.485 1.00 0.00 H new ATOM 1769 N VAL A 115 -29.921 -2.164 -7.861 1.00 0.00 N ATOM 1770 CA VAL A 115 -28.741 -2.398 -7.038 1.00 0.00 C ATOM 1771 C VAL A 115 -27.461 -2.090 -7.807 1.00 0.00 C ATOM 1772 O VAL A 115 -27.228 -2.633 -8.888 1.00 0.00 O ATOM 1773 CB VAL A 115 -28.686 -3.853 -6.537 1.00 0.00 C ATOM 1774 CG1 VAL A 115 -27.492 -4.059 -5.617 1.00 0.00 C ATOM 1775 CG2 VAL A 115 -29.982 -4.224 -5.833 1.00 0.00 C ATOM 0 H VAL A 115 -30.083 -2.872 -8.577 1.00 0.00 H new ATOM 0 HA VAL A 115 -28.817 -1.728 -6.182 1.00 0.00 H new ATOM 0 HB VAL A 115 -28.566 -4.510 -7.399 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -27.471 -5.093 -5.274 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -26.573 -3.838 -6.159 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -27.576 -3.393 -4.758 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -29.925 -5.256 -5.486 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -30.135 -3.562 -4.981 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -30.816 -4.120 -6.527 1.00 0.00 H new ATOM 1785 N ARG A 116 -26.631 -1.219 -7.242 1.00 0.00 N ATOM 1786 CA ARG A 116 -25.372 -0.843 -7.873 1.00 0.00 C ATOM 1787 C ARG A 116 -24.217 -1.657 -7.299 1.00 0.00 C ATOM 1788 O ARG A 116 -23.809 -1.452 -6.155 1.00 0.00 O ATOM 1789 CB ARG A 116 -25.105 0.651 -7.679 1.00 0.00 C ATOM 1790 CG ARG A 116 -24.367 1.293 -8.843 1.00 0.00 C ATOM 1791 CD ARG A 116 -25.254 2.273 -9.592 1.00 0.00 C ATOM 1792 NE ARG A 116 -25.677 1.749 -10.887 1.00 0.00 N ATOM 1793 CZ ARG A 116 -24.865 1.626 -11.932 1.00 0.00 C ATOM 1794 NH1 ARG A 116 -23.593 1.989 -11.833 1.00 0.00 N ATOM 1795 NH2 ARG A 116 -25.325 1.139 -13.078 1.00 0.00 N ATOM 0 H ARG A 116 -26.808 -0.761 -6.348 1.00 0.00 H new ATOM 0 HA ARG A 116 -25.450 -1.054 -8.940 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -26.055 1.166 -7.534 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -24.523 0.792 -6.768 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -23.482 1.811 -8.473 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -24.020 0.518 -9.527 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -26.133 2.501 -8.989 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -24.716 3.210 -9.738 1.00 0.00 H new ATOM 0 HE ARG A 116 -26.650 1.461 -10.996 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -23.236 2.363 -10.954 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -22.971 1.894 -12.636 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -26.303 0.859 -13.157 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -24.701 1.045 -13.879 1.00 0.00 H new ATOM 1809 N ARG A 117 -23.699 -2.585 -8.096 1.00 0.00 N ATOM 1810 CA ARG A 117 -22.596 -3.434 -7.661 1.00 0.00 C ATOM 1811 C ARG A 117 -21.276 -2.979 -8.276 1.00 0.00 C ATOM 1812 O ARG A 117 -21.094 -3.028 -9.492 1.00 0.00 O ATOM 1813 CB ARG A 117 -22.870 -4.891 -8.039 1.00 0.00 C ATOM 1814 CG ARG A 117 -23.357 -5.066 -9.468 1.00 0.00 C ATOM 1815 CD ARG A 117 -23.188 -6.500 -9.943 1.00 0.00 C ATOM 1816 NE ARG A 117 -23.822 -7.453 -9.036 1.00 0.00 N ATOM 1817 CZ ARG A 117 -23.708 -8.771 -9.155 1.00 0.00 C ATOM 1818 NH1 ARG A 117 -22.988 -9.289 -10.140 1.00 0.00 N ATOM 1819 NH2 ARG A 117 -24.314 -9.573 -8.290 1.00 0.00 N ATOM 0 H ARG A 117 -24.024 -2.768 -9.045 1.00 0.00 H new ATOM 0 HA ARG A 117 -22.516 -3.352 -6.577 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -21.958 -5.471 -7.901 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -23.615 -5.301 -7.357 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -24.407 -4.782 -9.533 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -22.804 -4.396 -10.126 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -23.618 -6.605 -10.939 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -22.126 -6.731 -10.028 1.00 0.00 H new ATOM 0 HE ARG A 117 -24.384 -7.086 -8.268 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -22.521 -8.675 -10.808 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -22.901 -10.301 -10.230 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -24.869 -9.178 -7.531 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -24.225 -10.585 -8.384 1.00 0.00 H new ATOM 1833 N LYS A 118 -20.355 -2.542 -7.422 1.00 0.00 N ATOM 1834 CA LYS A 118 -19.046 -2.084 -7.875 1.00 0.00 C ATOM 1835 C LYS A 118 -17.989 -3.148 -7.609 1.00 0.00 C ATOM 1836 O LYS A 118 -18.169 -4.014 -6.755 1.00 0.00 O ATOM 1837 CB LYS A 118 -18.664 -0.780 -7.171 1.00 0.00 C ATOM 1838 CG LYS A 118 -18.491 0.393 -8.122 1.00 0.00 C ATOM 1839 CD LYS A 118 -18.539 1.721 -7.383 1.00 0.00 C ATOM 1840 CE LYS A 118 -17.276 2.533 -7.613 1.00 0.00 C ATOM 1841 NZ LYS A 118 -17.540 3.998 -7.556 1.00 0.00 N ATOM 0 H LYS A 118 -20.491 -2.495 -6.412 1.00 0.00 H new ATOM 0 HA LYS A 118 -19.099 -1.902 -8.948 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -19.432 -0.533 -6.438 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -17.735 -0.932 -6.621 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -17.539 0.301 -8.646 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.275 0.368 -8.879 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.406 2.292 -7.716 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.667 1.540 -6.316 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -16.532 2.269 -6.861 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -16.852 2.278 -8.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -16.653 4.517 -7.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -18.231 4.255 -8.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -17.921 4.246 -6.620 1.00 0.00 H new ATOM 1855 N ASN A 119 -16.889 -3.083 -8.350 1.00 0.00 N ATOM 1856 CA ASN A 119 -15.810 -4.051 -8.191 1.00 0.00 C ATOM 1857 C ASN A 119 -14.442 -3.386 -8.319 1.00 0.00 C ATOM 1858 O ASN A 119 -14.155 -2.716 -9.311 1.00 0.00 O ATOM 1859 CB ASN A 119 -15.941 -5.170 -9.228 1.00 0.00 C ATOM 1860 CG ASN A 119 -16.403 -4.658 -10.578 1.00 0.00 C ATOM 1861 OD1 ASN A 119 -15.665 -3.963 -11.277 1.00 0.00 O ATOM 1862 ND2 ASN A 119 -17.629 -5.001 -10.953 1.00 0.00 N ATOM 0 H ASN A 119 -16.721 -2.374 -9.064 1.00 0.00 H new ATOM 0 HA ASN A 119 -15.891 -4.475 -7.190 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.979 -5.670 -9.342 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -16.647 -5.917 -8.865 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -17.994 -4.687 -11.852 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -18.206 -5.579 -10.342 1.00 0.00 H new ATOM 1869 N LEU A 120 -13.600 -3.588 -7.309 1.00 0.00 N ATOM 1870 CA LEU A 120 -12.256 -3.021 -7.303 1.00 0.00 C ATOM 1871 C LEU A 120 -11.209 -4.132 -7.386 1.00 0.00 C ATOM 1872 O LEU A 120 -11.089 -4.945 -6.470 1.00 0.00 O ATOM 1873 CB LEU A 120 -12.038 -2.195 -6.032 1.00 0.00 C ATOM 1874 CG LEU A 120 -12.439 -0.723 -6.139 1.00 0.00 C ATOM 1875 CD1 LEU A 120 -13.923 -0.553 -5.849 1.00 0.00 C ATOM 1876 CD2 LEU A 120 -11.608 0.126 -5.188 1.00 0.00 C ATOM 0 H LEU A 120 -13.826 -4.142 -6.483 1.00 0.00 H new ATOM 0 HA LEU A 120 -12.150 -2.372 -8.172 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -12.603 -2.651 -5.219 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -10.984 -2.250 -5.758 1.00 0.00 H new ATOM 0 HG LEU A 120 -12.247 -0.386 -7.158 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -14.191 0.500 -5.930 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -14.503 -1.131 -6.569 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -14.140 -0.906 -4.841 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.907 1.170 -5.277 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -11.769 -0.211 -4.164 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -10.552 0.028 -5.441 1.00 0.00 H new ATOM 1888 N PRO A 121 -10.439 -4.193 -8.488 1.00 0.00 N ATOM 1889 CA PRO A 121 -9.409 -5.222 -8.673 1.00 0.00 C ATOM 1890 C PRO A 121 -8.262 -5.090 -7.677 1.00 0.00 C ATOM 1891 O PRO A 121 -7.882 -3.983 -7.293 1.00 0.00 O ATOM 1892 CB PRO A 121 -8.907 -4.980 -10.099 1.00 0.00 C ATOM 1893 CG PRO A 121 -9.235 -3.556 -10.382 1.00 0.00 C ATOM 1894 CD PRO A 121 -10.510 -3.274 -9.637 1.00 0.00 C ATOM 0 HA PRO A 121 -9.809 -6.223 -8.512 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -7.835 -5.162 -10.177 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -9.396 -5.647 -10.809 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.434 -2.896 -10.049 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.362 -3.389 -11.452 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -10.568 -2.234 -9.317 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -11.388 -3.467 -10.254 1.00 0.00 H new ATOM 1902 N ILE A 122 -7.711 -6.228 -7.269 1.00 0.00 N ATOM 1903 CA ILE A 122 -6.603 -6.246 -6.323 1.00 0.00 C ATOM 1904 C ILE A 122 -5.266 -6.318 -7.054 1.00 0.00 C ATOM 1905 O ILE A 122 -5.180 -6.856 -8.158 1.00 0.00 O ATOM 1906 CB ILE A 122 -6.710 -7.438 -5.351 1.00 0.00 C ATOM 1907 CG1 ILE A 122 -8.065 -7.427 -4.641 1.00 0.00 C ATOM 1908 CG2 ILE A 122 -5.574 -7.402 -4.341 1.00 0.00 C ATOM 1909 CD1 ILE A 122 -8.272 -6.218 -3.755 1.00 0.00 C ATOM 0 H ILE A 122 -8.015 -7.151 -7.580 1.00 0.00 H new ATOM 0 HA ILE A 122 -6.656 -5.319 -5.752 1.00 0.00 H new ATOM 0 HB ILE A 122 -6.630 -8.362 -5.923 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -8.858 -7.460 -5.388 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -8.157 -8.330 -4.038 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -5.664 -8.250 -3.662 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -4.620 -7.456 -4.865 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -5.623 -6.474 -3.771 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -9.253 -6.276 -3.284 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -7.500 -6.194 -2.985 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -8.212 -5.311 -4.357 1.00 0.00 H new ATOM 1921 N GLU A 123 -4.227 -5.772 -6.433 1.00 0.00 N ATOM 1922 CA GLU A 123 -2.896 -5.774 -7.028 1.00 0.00 C ATOM 1923 C GLU A 123 -1.837 -6.131 -5.993 1.00 0.00 C ATOM 1924 O GLU A 123 -2.045 -5.961 -4.792 1.00 0.00 O ATOM 1925 CB GLU A 123 -2.587 -4.408 -7.642 1.00 0.00 C ATOM 1926 CG GLU A 123 -2.229 -4.470 -9.118 1.00 0.00 C ATOM 1927 CD GLU A 123 -0.732 -4.435 -9.356 1.00 0.00 C ATOM 1928 OE1 GLU A 123 -0.026 -3.736 -8.598 1.00 0.00 O ATOM 1929 OE2 GLU A 123 -0.266 -5.106 -10.300 1.00 0.00 O ATOM 0 H GLU A 123 -4.280 -5.323 -5.519 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.878 -6.530 -7.813 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -3.452 -3.757 -7.514 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -1.761 -3.952 -7.096 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -2.641 -5.382 -9.550 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -2.696 -3.633 -9.637 1.00 0.00 H new ATOM 1936 N TYR A 124 -0.701 -6.628 -6.467 1.00 0.00 N ATOM 1937 CA TYR A 124 0.392 -7.009 -5.582 1.00 0.00 C ATOM 1938 C TYR A 124 1.699 -6.354 -6.014 1.00 0.00 C ATOM 1939 O TYR A 124 2.316 -6.764 -6.997 1.00 0.00 O ATOM 1940 CB TYR A 124 0.555 -8.530 -5.561 1.00 0.00 C ATOM 1941 CG TYR A 124 -0.754 -9.280 -5.476 1.00 0.00 C ATOM 1942 CD1 TYR A 124 -1.518 -9.511 -6.614 1.00 0.00 C ATOM 1943 CD2 TYR A 124 -1.226 -9.756 -4.261 1.00 0.00 C ATOM 1944 CE1 TYR A 124 -2.716 -10.196 -6.542 1.00 0.00 C ATOM 1945 CE2 TYR A 124 -2.423 -10.443 -4.180 1.00 0.00 C ATOM 1946 CZ TYR A 124 -3.164 -10.660 -5.322 1.00 0.00 C ATOM 1947 OH TYR A 124 -4.356 -11.343 -5.246 1.00 0.00 O ATOM 0 H TYR A 124 -0.513 -6.776 -7.458 1.00 0.00 H new ATOM 0 HA TYR A 124 0.147 -6.662 -4.578 1.00 0.00 H new ATOM 0 HB2 TYR A 124 1.085 -8.842 -6.461 1.00 0.00 H new ATOM 0 HB3 TYR A 124 1.179 -8.808 -4.711 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -1.170 -9.149 -7.570 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -0.649 -9.587 -3.364 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -3.298 -10.367 -7.435 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -2.776 -10.808 -3.227 1.00 0.00 H new ATOM 0 HH TYR A 124 -4.542 -11.574 -4.312 1.00 0.00 H new ATOM 1957 N ASN A 125 2.116 -5.334 -5.272 1.00 0.00 N ATOM 1958 CA ASN A 125 3.352 -4.625 -5.576 1.00 0.00 C ATOM 1959 C ASN A 125 4.545 -5.324 -4.934 1.00 0.00 C ATOM 1960 O ASN A 125 5.048 -4.892 -3.897 1.00 0.00 O ATOM 1961 CB ASN A 125 3.268 -3.177 -5.092 1.00 0.00 C ATOM 1962 CG ASN A 125 3.449 -2.180 -6.220 1.00 0.00 C ATOM 1963 OD1 ASN A 125 4.188 -1.110 -5.950 1.00 0.00 O flip ATOM 1964 ND2 ASN A 125 2.930 -2.367 -7.320 1.00 0.00 N flip ATOM 0 H ASN A 125 1.616 -4.980 -4.456 1.00 0.00 H new ATOM 0 HA ASN A 125 3.490 -4.627 -6.657 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.302 -3.011 -4.616 1.00 0.00 H new ATOM 0 HB3 ASN A 125 4.031 -3.005 -4.333 1.00 0.00 H new ATOM 0 HD21 ASN A 125 2.370 -3.203 -7.484 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.060 -1.686 -8.068 1.00 0.00 H new ATOM 1971 N LEU A 126 4.989 -6.406 -5.561 1.00 0.00 N ATOM 1972 CA LEU A 126 6.123 -7.172 -5.056 1.00 0.00 C ATOM 1973 C LEU A 126 7.428 -6.410 -5.258 1.00 0.00 C ATOM 1974 O LEU A 126 7.653 -5.913 -6.381 1.00 0.00 O ATOM 1975 CB LEU A 126 6.200 -8.533 -5.753 1.00 0.00 C ATOM 1976 CG LEU A 126 5.115 -9.532 -5.348 1.00 0.00 C ATOM 1977 CD1 LEU A 126 5.104 -10.721 -6.295 1.00 0.00 C ATOM 1978 CD2 LEU A 126 5.327 -9.995 -3.913 1.00 0.00 C ATOM 1979 OXT LEU A 126 8.214 -6.316 -4.292 1.00 0.00 O ATOM 0 H LEU A 126 4.581 -6.774 -6.421 1.00 0.00 H new ATOM 0 HA LEU A 126 5.976 -7.328 -3.987 1.00 0.00 H new ATOM 0 HB2 LEU A 126 6.143 -8.376 -6.830 1.00 0.00 H new ATOM 0 HB3 LEU A 126 7.175 -8.975 -5.546 1.00 0.00 H new ATOM 0 HG LEU A 126 4.147 -9.034 -5.411 1.00 0.00 H new ATOM 0 HD11 LEU A 126 4.326 -11.421 -5.991 1.00 0.00 H new ATOM 0 HD12 LEU A 126 4.906 -10.376 -7.310 1.00 0.00 H new ATOM 0 HD13 LEU A 126 6.073 -11.220 -6.264 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.546 -10.705 -3.641 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.301 -10.476 -3.826 1.00 0.00 H new ATOM 0 HD23 LEU A 126 5.285 -9.136 -3.244 1.00 0.00 H new TER 1991 LEU A 126 ATOM 1992 N ALA B 1 41.663 -2.479 -5.550 1.00 0.00 N ATOM 1993 CA ALA B 1 41.243 -1.126 -6.000 1.00 0.00 C ATOM 1994 C ALA B 1 41.328 -1.004 -7.517 1.00 0.00 C ATOM 1995 O ALA B 1 42.352 -0.590 -8.060 1.00 0.00 O ATOM 1996 CB ALA B 1 42.101 -0.060 -5.335 1.00 0.00 C ATOM 0 H1 ALA B 1 41.596 -2.536 -4.514 1.00 0.00 H new ATOM 0 H2 ALA B 1 41.042 -3.195 -5.977 1.00 0.00 H new ATOM 0 H3 ALA B 1 42.645 -2.653 -5.844 1.00 0.00 H new ATOM 0 HA ALA B 1 40.204 -0.977 -5.706 1.00 0.00 H new ATOM 0 HB1 ALA B 1 41.783 0.926 -5.673 1.00 0.00 H new ATOM 0 HB2 ALA B 1 41.989 -0.126 -4.253 1.00 0.00 H new ATOM 0 HB3 ALA B 1 43.146 -0.215 -5.602 1.00 0.00 H new ATOM 2004 N GLN B 2 40.244 -1.366 -8.196 1.00 0.00 N ATOM 2005 CA GLN B 2 40.193 -1.298 -9.651 1.00 0.00 C ATOM 2006 C GLN B 2 38.780 -0.988 -10.132 1.00 0.00 C ATOM 2007 O GLN B 2 38.546 0.022 -10.795 1.00 0.00 O ATOM 2008 CB GLN B 2 40.676 -2.615 -10.262 1.00 0.00 C ATOM 2009 CG GLN B 2 42.157 -2.621 -10.601 1.00 0.00 C ATOM 2010 CD GLN B 2 42.459 -1.914 -11.908 1.00 0.00 C ATOM 2011 OE1 GLN B 2 41.717 -1.030 -12.335 1.00 0.00 O ATOM 2012 NE2 GLN B 2 43.554 -2.302 -12.551 1.00 0.00 N ATOM 0 H GLN B 2 39.388 -1.710 -7.760 1.00 0.00 H new ATOM 0 HA GLN B 2 40.852 -0.493 -9.975 1.00 0.00 H new ATOM 0 HB2 GLN B 2 40.468 -3.427 -9.565 1.00 0.00 H new ATOM 0 HB3 GLN B 2 40.104 -2.817 -11.167 1.00 0.00 H new ATOM 0 HG2 GLN B 2 42.712 -2.140 -9.796 1.00 0.00 H new ATOM 0 HG3 GLN B 2 42.508 -3.651 -10.660 1.00 0.00 H new ATOM 0 HE21 GLN B 2 44.141 -3.039 -12.160 1.00 0.00 H new ATOM 0 HE22 GLN B 2 43.809 -1.863 -13.436 1.00 0.00 H new ATOM 2021 N SER B 3 37.840 -1.864 -9.792 1.00 0.00 N ATOM 2022 CA SER B 3 36.449 -1.684 -10.190 1.00 0.00 C ATOM 2023 C SER B 3 35.527 -2.563 -9.352 1.00 0.00 C ATOM 2024 O SER B 3 34.888 -2.087 -8.416 1.00 0.00 O ATOM 2025 CB SER B 3 36.275 -2.012 -11.674 1.00 0.00 C ATOM 2026 OG SER B 3 36.444 -0.856 -12.475 1.00 0.00 O ATOM 0 H SER B 3 38.016 -2.705 -9.242 1.00 0.00 H new ATOM 0 HA SER B 3 36.180 -0.641 -10.022 1.00 0.00 H new ATOM 0 HB2 SER B 3 36.999 -2.772 -11.969 1.00 0.00 H new ATOM 0 HB3 SER B 3 35.284 -2.433 -11.843 1.00 0.00 H new ATOM 0 HG SER B 3 37.157 -0.298 -12.098 1.00 0.00 H new ATOM 2032 N VAL B 4 35.467 -3.847 -9.703 1.00 0.00 N ATOM 2033 CA VAL B 4 34.629 -4.814 -8.996 1.00 0.00 C ATOM 2034 C VAL B 4 33.236 -4.250 -8.695 1.00 0.00 C ATOM 2035 O VAL B 4 33.055 -3.483 -7.752 1.00 0.00 O ATOM 2036 CB VAL B 4 35.275 -5.280 -7.679 1.00 0.00 C ATOM 2037 CG1 VAL B 4 36.412 -6.251 -7.959 1.00 0.00 C ATOM 2038 CG2 VAL B 4 35.768 -4.094 -6.861 1.00 0.00 C ATOM 0 H VAL B 4 35.994 -4.244 -10.480 1.00 0.00 H new ATOM 0 HA VAL B 4 34.530 -5.669 -9.665 1.00 0.00 H new ATOM 0 HB VAL B 4 34.515 -5.797 -7.093 1.00 0.00 H new ATOM 0 HG11 VAL B 4 36.858 -6.571 -7.017 1.00 0.00 H new ATOM 0 HG12 VAL B 4 36.025 -7.120 -8.491 1.00 0.00 H new ATOM 0 HG13 VAL B 4 37.169 -5.759 -8.570 1.00 0.00 H new ATOM 0 HG21 VAL B 4 36.220 -4.453 -5.936 1.00 0.00 H new ATOM 0 HG22 VAL B 4 36.509 -3.539 -7.436 1.00 0.00 H new ATOM 0 HG23 VAL B 4 34.928 -3.440 -6.625 1.00 0.00 H new ATOM 2048 N PRO B 5 32.225 -4.637 -9.492 1.00 0.00 N ATOM 2049 CA PRO B 5 30.848 -4.172 -9.302 1.00 0.00 C ATOM 2050 C PRO B 5 30.178 -4.825 -8.093 1.00 0.00 C ATOM 2051 O PRO B 5 30.176 -6.050 -7.965 1.00 0.00 O ATOM 2052 CB PRO B 5 30.152 -4.605 -10.593 1.00 0.00 C ATOM 2053 CG PRO B 5 30.916 -5.798 -11.051 1.00 0.00 C ATOM 2054 CD PRO B 5 32.343 -5.564 -10.632 1.00 0.00 C ATOM 0 HA PRO B 5 30.800 -3.100 -9.111 1.00 0.00 H new ATOM 0 HB2 PRO B 5 29.105 -4.849 -10.416 1.00 0.00 H new ATOM 0 HB3 PRO B 5 30.172 -3.811 -11.340 1.00 0.00 H new ATOM 0 HG2 PRO B 5 30.522 -6.710 -10.602 1.00 0.00 H new ATOM 0 HG3 PRO B 5 30.841 -5.918 -12.132 1.00 0.00 H new ATOM 0 HD2 PRO B 5 32.833 -6.494 -10.343 1.00 0.00 H new ATOM 0 HD3 PRO B 5 32.932 -5.131 -11.441 1.00 0.00 H new ATOM 2062 N PRO B 6 29.596 -4.019 -7.186 1.00 0.00 N ATOM 2063 CA PRO B 6 28.922 -4.537 -5.989 1.00 0.00 C ATOM 2064 C PRO B 6 27.842 -5.557 -6.330 1.00 0.00 C ATOM 2065 O PRO B 6 27.109 -5.397 -7.307 1.00 0.00 O ATOM 2066 CB PRO B 6 28.296 -3.288 -5.359 1.00 0.00 C ATOM 2067 CG PRO B 6 29.116 -2.154 -5.867 1.00 0.00 C ATOM 2068 CD PRO B 6 29.545 -2.547 -7.252 1.00 0.00 C ATOM 0 HA PRO B 6 29.613 -5.061 -5.329 1.00 0.00 H new ATOM 0 HB2 PRO B 6 27.251 -3.181 -5.648 1.00 0.00 H new ATOM 0 HB3 PRO B 6 28.322 -3.339 -4.270 1.00 0.00 H new ATOM 0 HG2 PRO B 6 28.538 -1.230 -5.884 1.00 0.00 H new ATOM 0 HG3 PRO B 6 29.979 -1.978 -5.226 1.00 0.00 H new ATOM 0 HD2 PRO B 6 28.837 -2.202 -8.006 1.00 0.00 H new ATOM 0 HD3 PRO B 6 30.515 -2.122 -7.508 1.00 0.00 H new ATOM 2076 N GLY B 7 27.750 -6.607 -5.521 1.00 0.00 N ATOM 2077 CA GLY B 7 26.757 -7.640 -5.755 1.00 0.00 C ATOM 2078 C GLY B 7 25.340 -7.108 -5.676 1.00 0.00 C ATOM 2079 O GLY B 7 24.990 -6.394 -4.736 1.00 0.00 O ATOM 0 H GLY B 7 28.345 -6.761 -4.707 1.00 0.00 H new ATOM 0 HA2 GLY B 7 26.922 -8.083 -6.737 1.00 0.00 H new ATOM 0 HA3 GLY B 7 26.885 -8.436 -5.021 1.00 0.00 H new ATOM 2083 N ASP B 8 24.522 -7.457 -6.664 1.00 0.00 N ATOM 2084 CA ASP B 8 23.133 -7.010 -6.700 1.00 0.00 C ATOM 2085 C ASP B 8 22.435 -7.300 -5.375 1.00 0.00 C ATOM 2086 O ASP B 8 22.478 -8.422 -4.872 1.00 0.00 O ATOM 2087 CB ASP B 8 22.385 -7.691 -7.847 1.00 0.00 C ATOM 2088 CG ASP B 8 23.105 -7.548 -9.173 1.00 0.00 C ATOM 2089 OD1 ASP B 8 23.816 -6.537 -9.357 1.00 0.00 O ATOM 2090 OD2 ASP B 8 22.959 -8.446 -10.029 1.00 0.00 O ATOM 0 H ASP B 8 24.796 -8.047 -7.450 1.00 0.00 H new ATOM 0 HA ASP B 8 23.127 -5.932 -6.864 1.00 0.00 H new ATOM 0 HB2 ASP B 8 22.259 -8.749 -7.617 1.00 0.00 H new ATOM 0 HB3 ASP B 8 21.386 -7.262 -7.931 1.00 0.00 H new ATOM 2095 N ILE B 9 21.793 -6.280 -4.815 1.00 0.00 N ATOM 2096 CA ILE B 9 21.086 -6.426 -3.548 1.00 0.00 C ATOM 2097 C ILE B 9 19.581 -6.537 -3.766 1.00 0.00 C ATOM 2098 O ILE B 9 19.020 -5.881 -4.643 1.00 0.00 O ATOM 2099 CB ILE B 9 21.369 -5.239 -2.608 1.00 0.00 C ATOM 2100 CG1 ILE B 9 20.880 -3.934 -3.238 1.00 0.00 C ATOM 2101 CG2 ILE B 9 22.855 -5.157 -2.290 1.00 0.00 C ATOM 2102 CD1 ILE B 9 19.656 -3.357 -2.560 1.00 0.00 C ATOM 0 H ILE B 9 21.748 -5.344 -5.218 1.00 0.00 H new ATOM 0 HA ILE B 9 21.452 -7.343 -3.086 1.00 0.00 H new ATOM 0 HB ILE B 9 20.827 -5.396 -1.676 1.00 0.00 H new ATOM 0 HG12 ILE B 9 21.685 -3.200 -3.204 1.00 0.00 H new ATOM 0 HG13 ILE B 9 20.654 -4.110 -4.290 1.00 0.00 H new ATOM 0 HG21 ILE B 9 23.039 -4.313 -1.625 1.00 0.00 H new ATOM 0 HG22 ILE B 9 23.174 -6.079 -1.804 1.00 0.00 H new ATOM 0 HG23 ILE B 9 23.418 -5.020 -3.213 1.00 0.00 H new ATOM 0 HD11 ILE B 9 19.365 -2.433 -3.059 1.00 0.00 H new ATOM 0 HD12 ILE B 9 18.837 -4.073 -2.617 1.00 0.00 H new ATOM 0 HD13 ILE B 9 19.883 -3.149 -1.515 1.00 0.00 H new ATOM 2114 N ASN B 10 18.932 -7.370 -2.959 1.00 0.00 N ATOM 2115 CA ASN B 10 17.490 -7.566 -3.061 1.00 0.00 C ATOM 2116 C ASN B 10 16.738 -6.398 -2.431 1.00 0.00 C ATOM 2117 O ASN B 10 17.227 -5.764 -1.495 1.00 0.00 O ATOM 2118 CB ASN B 10 17.084 -8.876 -2.382 1.00 0.00 C ATOM 2119 CG ASN B 10 16.465 -9.862 -3.353 1.00 0.00 C ATOM 2120 OD1 ASN B 10 15.264 -10.129 -3.304 1.00 0.00 O ATOM 2121 ND2 ASN B 10 17.285 -10.410 -4.242 1.00 0.00 N ATOM 0 H ASN B 10 19.382 -7.920 -2.227 1.00 0.00 H new ATOM 0 HA ASN B 10 17.228 -7.616 -4.118 1.00 0.00 H new ATOM 0 HB2 ASN B 10 17.960 -9.329 -1.918 1.00 0.00 H new ATOM 0 HB3 ASN B 10 16.374 -8.663 -1.583 1.00 0.00 H new ATOM 0 HD21 ASN B 10 16.926 -11.082 -4.921 1.00 0.00 H new ATOM 0 HD22 ASN B 10 18.274 -10.159 -4.246 1.00 0.00 H new ATOM 2128 N THR B 11 15.547 -6.115 -2.951 1.00 0.00 N ATOM 2129 CA THR B 11 14.731 -5.021 -2.439 1.00 0.00 C ATOM 2130 C THR B 11 13.252 -5.394 -2.441 1.00 0.00 C ATOM 2131 O THR B 11 12.800 -6.176 -3.278 1.00 0.00 O ATOM 2132 CB THR B 11 14.952 -3.759 -3.273 1.00 0.00 C ATOM 2133 OG1 THR B 11 15.115 -4.083 -4.642 1.00 0.00 O ATOM 2134 CG2 THR B 11 16.166 -2.962 -2.843 1.00 0.00 C ATOM 0 H THR B 11 15.127 -6.628 -3.726 1.00 0.00 H new ATOM 0 HA THR B 11 15.035 -4.827 -1.410 1.00 0.00 H new ATOM 0 HB THR B 11 14.062 -3.150 -3.115 1.00 0.00 H new ATOM 0 HG1 THR B 11 15.253 -3.262 -5.158 1.00 0.00 H new ATOM 0 HG21 THR B 11 16.265 -2.080 -3.476 1.00 0.00 H new ATOM 0 HG22 THR B 11 16.049 -2.653 -1.804 1.00 0.00 H new ATOM 0 HG23 THR B 11 17.059 -3.579 -2.939 1.00 0.00 H new ATOM 2142 N GLN B 12 12.504 -4.828 -1.500 1.00 0.00 N ATOM 2143 CA GLN B 12 11.075 -5.098 -1.390 1.00 0.00 C ATOM 2144 C GLN B 12 10.321 -3.855 -0.905 1.00 0.00 C ATOM 2145 O GLN B 12 10.379 -3.519 0.278 1.00 0.00 O ATOM 2146 CB GLN B 12 10.832 -6.260 -0.427 1.00 0.00 C ATOM 2147 CG GLN B 12 11.367 -7.591 -0.930 1.00 0.00 C ATOM 2148 CD GLN B 12 10.387 -8.309 -1.838 1.00 0.00 C ATOM 2149 OE1 GLN B 12 9.298 -7.807 -2.116 1.00 0.00 O ATOM 2150 NE2 GLN B 12 10.771 -9.491 -2.306 1.00 0.00 N ATOM 0 H GLN B 12 12.864 -4.178 -0.801 1.00 0.00 H new ATOM 0 HA GLN B 12 10.702 -5.366 -2.378 1.00 0.00 H new ATOM 0 HB2 GLN B 12 11.298 -6.030 0.531 1.00 0.00 H new ATOM 0 HB3 GLN B 12 9.761 -6.353 -0.247 1.00 0.00 H new ATOM 0 HG2 GLN B 12 12.300 -7.423 -1.469 1.00 0.00 H new ATOM 0 HG3 GLN B 12 11.602 -8.229 -0.078 1.00 0.00 H new ATOM 0 HE21 GLN B 12 11.683 -9.869 -2.050 1.00 0.00 H new ATOM 0 HE22 GLN B 12 10.154 -10.021 -2.922 1.00 0.00 H new ATOM 2159 N PRO B 13 9.602 -3.149 -1.804 1.00 0.00 N ATOM 2160 CA PRO B 13 9.498 -3.504 -3.228 1.00 0.00 C ATOM 2161 C PRO B 13 10.840 -3.427 -3.945 1.00 0.00 C ATOM 2162 O PRO B 13 11.771 -2.772 -3.475 1.00 0.00 O ATOM 2163 CB PRO B 13 8.529 -2.462 -3.795 1.00 0.00 C ATOM 2164 CG PRO B 13 8.586 -1.324 -2.837 1.00 0.00 C ATOM 2165 CD PRO B 13 8.829 -1.936 -1.487 1.00 0.00 C ATOM 0 HA PRO B 13 9.161 -4.532 -3.362 1.00 0.00 H new ATOM 0 HB2 PRO B 13 8.826 -2.150 -4.797 1.00 0.00 H new ATOM 0 HB3 PRO B 13 7.518 -2.863 -3.872 1.00 0.00 H new ATOM 0 HG2 PRO B 13 9.384 -0.630 -3.101 1.00 0.00 H new ATOM 0 HG3 PRO B 13 7.655 -0.757 -2.847 1.00 0.00 H new ATOM 0 HD2 PRO B 13 9.385 -1.263 -0.834 1.00 0.00 H new ATOM 0 HD3 PRO B 13 7.895 -2.175 -0.979 1.00 0.00 H new ATOM 2173 N SER B 14 10.931 -4.100 -5.085 1.00 0.00 N ATOM 2174 CA SER B 14 12.159 -4.111 -5.871 1.00 0.00 C ATOM 2175 C SER B 14 11.982 -3.359 -7.190 1.00 0.00 C ATOM 2176 O SER B 14 12.962 -2.971 -7.826 1.00 0.00 O ATOM 2177 CB SER B 14 12.598 -5.550 -6.148 1.00 0.00 C ATOM 2178 OG SER B 14 11.774 -6.476 -5.461 1.00 0.00 O ATOM 0 H SER B 14 10.169 -4.646 -5.487 1.00 0.00 H new ATOM 0 HA SER B 14 12.930 -3.604 -5.291 1.00 0.00 H new ATOM 0 HB2 SER B 14 12.556 -5.746 -7.219 1.00 0.00 H new ATOM 0 HB3 SER B 14 13.635 -5.683 -5.840 1.00 0.00 H new ATOM 0 HG SER B 14 12.228 -6.776 -4.646 1.00 0.00 H new ATOM 2184 N GLN B 15 10.731 -3.158 -7.600 1.00 0.00 N ATOM 2185 CA GLN B 15 10.442 -2.457 -8.845 1.00 0.00 C ATOM 2186 C GLN B 15 9.925 -1.047 -8.579 1.00 0.00 C ATOM 2187 O GLN B 15 10.371 -0.084 -9.204 1.00 0.00 O ATOM 2188 CB GLN B 15 9.418 -3.239 -9.669 1.00 0.00 C ATOM 2189 CG GLN B 15 9.769 -4.707 -9.841 1.00 0.00 C ATOM 2190 CD GLN B 15 9.716 -5.153 -11.289 1.00 0.00 C ATOM 2191 OE1 GLN B 15 10.203 -4.460 -12.183 1.00 0.00 O ATOM 2192 NE2 GLN B 15 9.121 -6.316 -11.529 1.00 0.00 N ATOM 0 H GLN B 15 9.905 -3.470 -7.089 1.00 0.00 H new ATOM 0 HA GLN B 15 11.372 -2.379 -9.407 1.00 0.00 H new ATOM 0 HB2 GLN B 15 8.442 -3.161 -9.189 1.00 0.00 H new ATOM 0 HB3 GLN B 15 9.327 -2.778 -10.653 1.00 0.00 H new ATOM 0 HG2 GLN B 15 10.769 -4.886 -9.446 1.00 0.00 H new ATOM 0 HG3 GLN B 15 9.080 -5.313 -9.253 1.00 0.00 H new ATOM 0 HE21 GLN B 15 8.731 -6.858 -10.758 1.00 0.00 H new ATOM 0 HE22 GLN B 15 9.054 -6.667 -12.484 1.00 0.00 H new ATOM 2201 N LYS B 16 8.982 -0.932 -7.652 1.00 0.00 N ATOM 2202 CA LYS B 16 8.404 0.363 -7.310 1.00 0.00 C ATOM 2203 C LYS B 16 7.475 0.253 -6.103 1.00 0.00 C ATOM 2204 O LYS B 16 7.298 -0.826 -5.539 1.00 0.00 O ATOM 2205 CB LYS B 16 7.637 0.930 -8.504 1.00 0.00 C ATOM 2206 CG LYS B 16 6.578 -0.015 -9.050 1.00 0.00 C ATOM 2207 CD LYS B 16 5.839 0.597 -10.228 1.00 0.00 C ATOM 2208 CE LYS B 16 4.458 -0.015 -10.397 1.00 0.00 C ATOM 2209 NZ LYS B 16 3.864 0.312 -11.723 1.00 0.00 N ATOM 0 H LYS B 16 8.601 -1.718 -7.124 1.00 0.00 H new ATOM 0 HA LYS B 16 9.221 1.037 -7.052 1.00 0.00 H new ATOM 0 HB2 LYS B 16 7.161 1.865 -8.209 1.00 0.00 H new ATOM 0 HB3 LYS B 16 8.343 1.169 -9.299 1.00 0.00 H new ATOM 0 HG2 LYS B 16 7.047 -0.949 -9.359 1.00 0.00 H new ATOM 0 HG3 LYS B 16 5.867 -0.261 -8.261 1.00 0.00 H new ATOM 0 HD2 LYS B 16 5.746 1.673 -10.081 1.00 0.00 H new ATOM 0 HD3 LYS B 16 6.418 0.448 -11.139 1.00 0.00 H new ATOM 0 HE2 LYS B 16 4.525 -1.097 -10.286 1.00 0.00 H new ATOM 0 HE3 LYS B 16 3.801 0.347 -9.606 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 2.923 -0.124 -11.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 3.777 1.344 -11.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 4.477 -0.055 -12.478 1.00 0.00 H new ATOM 2223 N ILE B 17 6.883 1.379 -5.717 1.00 0.00 N ATOM 2224 CA ILE B 17 5.970 1.416 -4.581 1.00 0.00 C ATOM 2225 C ILE B 17 4.724 2.237 -4.905 1.00 0.00 C ATOM 2226 O ILE B 17 4.813 3.292 -5.533 1.00 0.00 O ATOM 2227 CB ILE B 17 6.650 2.011 -3.332 1.00 0.00 C ATOM 2228 CG1 ILE B 17 5.682 2.013 -2.148 1.00 0.00 C ATOM 2229 CG2 ILE B 17 7.146 3.419 -3.621 1.00 0.00 C ATOM 2230 CD1 ILE B 17 6.370 2.146 -0.807 1.00 0.00 C ATOM 0 H ILE B 17 7.020 2.280 -6.176 1.00 0.00 H new ATOM 0 HA ILE B 17 5.682 0.386 -4.373 1.00 0.00 H new ATOM 0 HB ILE B 17 7.508 1.390 -3.073 1.00 0.00 H new ATOM 0 HG12 ILE B 17 4.975 2.834 -2.268 1.00 0.00 H new ATOM 0 HG13 ILE B 17 5.103 1.090 -2.161 1.00 0.00 H new ATOM 0 HG21 ILE B 17 7.624 3.826 -2.730 1.00 0.00 H new ATOM 0 HG22 ILE B 17 7.867 3.390 -4.438 1.00 0.00 H new ATOM 0 HG23 ILE B 17 6.304 4.051 -3.902 1.00 0.00 H new ATOM 0 HD11 ILE B 17 5.623 2.140 -0.013 1.00 0.00 H new ATOM 0 HD12 ILE B 17 7.056 1.311 -0.666 1.00 0.00 H new ATOM 0 HD13 ILE B 17 6.927 3.083 -0.775 1.00 0.00 H new ATOM 2242 N VAL B 18 3.566 1.747 -4.474 1.00 0.00 N ATOM 2243 CA VAL B 18 2.305 2.439 -4.721 1.00 0.00 C ATOM 2244 C VAL B 18 1.585 2.759 -3.414 1.00 0.00 C ATOM 2245 O VAL B 18 0.802 1.953 -2.911 1.00 0.00 O ATOM 2246 CB VAL B 18 1.369 1.603 -5.617 1.00 0.00 C ATOM 2247 CG1 VAL B 18 0.060 2.340 -5.864 1.00 0.00 C ATOM 2248 CG2 VAL B 18 2.054 1.263 -6.932 1.00 0.00 C ATOM 0 H VAL B 18 3.474 0.875 -3.953 1.00 0.00 H new ATOM 0 HA VAL B 18 2.553 3.369 -5.233 1.00 0.00 H new ATOM 0 HB VAL B 18 1.140 0.671 -5.100 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -0.586 1.732 -6.498 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -0.438 2.526 -4.912 1.00 0.00 H new ATOM 0 HG13 VAL B 18 0.265 3.290 -6.358 1.00 0.00 H new ATOM 0 HG21 VAL B 18 1.379 0.673 -7.552 1.00 0.00 H new ATOM 0 HG22 VAL B 18 2.315 2.183 -7.455 1.00 0.00 H new ATOM 0 HG23 VAL B 18 2.959 0.689 -6.733 1.00 0.00 H new ATOM 2258 N PHE B 19 1.850 3.943 -2.873 1.00 0.00 N ATOM 2259 CA PHE B 19 1.222 4.372 -1.628 1.00 0.00 C ATOM 2260 C PHE B 19 -0.295 4.411 -1.779 1.00 0.00 C ATOM 2261 O PHE B 19 -0.846 5.334 -2.379 1.00 0.00 O ATOM 2262 CB PHE B 19 1.745 5.749 -1.216 1.00 0.00 C ATOM 2263 CG PHE B 19 3.141 5.719 -0.662 1.00 0.00 C ATOM 2264 CD1 PHE B 19 4.234 5.619 -1.507 1.00 0.00 C ATOM 2265 CD2 PHE B 19 3.360 5.789 0.705 1.00 0.00 C ATOM 2266 CE1 PHE B 19 5.519 5.590 -1.000 1.00 0.00 C ATOM 2267 CE2 PHE B 19 4.642 5.761 1.218 1.00 0.00 C ATOM 2268 CZ PHE B 19 5.724 5.662 0.364 1.00 0.00 C ATOM 0 H PHE B 19 2.495 4.623 -3.276 1.00 0.00 H new ATOM 0 HA PHE B 19 1.475 3.652 -0.850 1.00 0.00 H new ATOM 0 HB2 PHE B 19 1.720 6.412 -2.081 1.00 0.00 H new ATOM 0 HB3 PHE B 19 1.075 6.175 -0.469 1.00 0.00 H new ATOM 0 HD1 PHE B 19 4.080 5.563 -2.575 1.00 0.00 H new ATOM 0 HD2 PHE B 19 2.518 5.866 1.377 1.00 0.00 H new ATOM 0 HE1 PHE B 19 6.363 5.511 -1.670 1.00 0.00 H new ATOM 0 HE2 PHE B 19 4.799 5.816 2.285 1.00 0.00 H new ATOM 0 HZ PHE B 19 6.728 5.641 0.762 1.00 0.00 H new ATOM 2278 N ASN B 20 -0.964 3.398 -1.240 1.00 0.00 N ATOM 2279 CA ASN B 20 -2.418 3.309 -1.322 1.00 0.00 C ATOM 2280 C ASN B 20 -3.092 4.357 -0.442 1.00 0.00 C ATOM 2281 O ASN B 20 -2.669 4.603 0.688 1.00 0.00 O ATOM 2282 CB ASN B 20 -2.884 1.910 -0.912 1.00 0.00 C ATOM 2283 CG ASN B 20 -3.994 1.387 -1.802 1.00 0.00 C ATOM 2284 OD1 ASN B 20 -3.796 1.168 -2.998 1.00 0.00 O ATOM 2285 ND2 ASN B 20 -5.172 1.185 -1.224 1.00 0.00 N ATOM 0 H ASN B 20 -0.522 2.626 -0.741 1.00 0.00 H new ATOM 0 HA ASN B 20 -2.705 3.500 -2.356 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -2.038 1.223 -0.949 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -3.231 1.934 0.121 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -5.957 0.835 -1.774 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -5.292 1.380 -0.230 1.00 0.00 H new ATOM 2292 N ALA B 21 -4.150 4.965 -0.969 1.00 0.00 N ATOM 2293 CA ALA B 21 -4.897 5.982 -0.237 1.00 0.00 C ATOM 2294 C ALA B 21 -5.477 5.403 1.053 1.00 0.00 C ATOM 2295 O ALA B 21 -5.479 4.186 1.242 1.00 0.00 O ATOM 2296 CB ALA B 21 -6.007 6.542 -1.116 1.00 0.00 C ATOM 0 H ALA B 21 -4.510 4.770 -1.903 1.00 0.00 H new ATOM 0 HA ALA B 21 -4.216 6.790 0.031 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -6.561 7.301 -0.563 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -5.573 6.989 -2.010 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -6.683 5.737 -1.405 1.00 0.00 H new ATOM 2302 N PRO B 22 -5.979 6.258 1.970 1.00 0.00 N ATOM 2303 CA PRO B 22 -6.010 7.711 1.814 1.00 0.00 C ATOM 2304 C PRO B 22 -4.737 8.380 2.318 1.00 0.00 C ATOM 2305 O PRO B 22 -3.947 7.774 3.044 1.00 0.00 O ATOM 2306 CB PRO B 22 -7.208 8.134 2.678 1.00 0.00 C ATOM 2307 CG PRO B 22 -7.622 6.919 3.462 1.00 0.00 C ATOM 2308 CD PRO B 22 -6.567 5.867 3.248 1.00 0.00 C ATOM 0 HA PRO B 22 -6.090 8.004 0.767 1.00 0.00 H new ATOM 0 HB2 PRO B 22 -6.935 8.951 3.345 1.00 0.00 H new ATOM 0 HB3 PRO B 22 -8.028 8.491 2.055 1.00 0.00 H new ATOM 0 HG2 PRO B 22 -7.716 7.159 4.521 1.00 0.00 H new ATOM 0 HG3 PRO B 22 -8.596 6.560 3.129 1.00 0.00 H new ATOM 0 HD2 PRO B 22 -5.829 5.865 4.050 1.00 0.00 H new ATOM 0 HD3 PRO B 22 -6.996 4.866 3.207 1.00 0.00 H new ATOM 2316 N TYR B 23 -4.548 9.635 1.929 1.00 0.00 N ATOM 2317 CA TYR B 23 -3.375 10.398 2.339 1.00 0.00 C ATOM 2318 C TYR B 23 -3.712 11.349 3.480 1.00 0.00 C ATOM 2319 O TYR B 23 -3.354 12.528 3.447 1.00 0.00 O ATOM 2320 CB TYR B 23 -2.812 11.182 1.152 1.00 0.00 C ATOM 2321 CG TYR B 23 -2.186 10.300 0.100 1.00 0.00 C ATOM 2322 CD1 TYR B 23 -1.154 9.429 0.424 1.00 0.00 C ATOM 2323 CD2 TYR B 23 -2.629 10.332 -1.216 1.00 0.00 C ATOM 2324 CE1 TYR B 23 -0.580 8.617 -0.532 1.00 0.00 C ATOM 2325 CE2 TYR B 23 -2.060 9.522 -2.179 1.00 0.00 C ATOM 2326 CZ TYR B 23 -1.036 8.666 -1.833 1.00 0.00 C ATOM 2327 OH TYR B 23 -0.467 7.858 -2.788 1.00 0.00 O ATOM 0 H TYR B 23 -5.194 10.147 1.328 1.00 0.00 H new ATOM 0 HA TYR B 23 -2.621 9.695 2.692 1.00 0.00 H new ATOM 0 HB2 TYR B 23 -3.613 11.766 0.698 1.00 0.00 H new ATOM 0 HB3 TYR B 23 -2.067 11.890 1.513 1.00 0.00 H new ATOM 0 HD1 TYR B 23 -0.795 9.387 1.442 1.00 0.00 H new ATOM 0 HD2 TYR B 23 -3.431 11.001 -1.491 1.00 0.00 H new ATOM 0 HE1 TYR B 23 0.223 7.946 -0.263 1.00 0.00 H new ATOM 0 HE2 TYR B 23 -2.415 9.559 -3.198 1.00 0.00 H new ATOM 0 HH TYR B 23 -0.333 6.960 -2.419 1.00 0.00 H new ATOM 2337 N ASP B 24 -4.398 10.829 4.491 1.00 0.00 N ATOM 2338 CA ASP B 24 -4.780 11.631 5.648 1.00 0.00 C ATOM 2339 C ASP B 24 -4.181 11.070 6.940 1.00 0.00 C ATOM 2340 O ASP B 24 -4.424 11.602 8.023 1.00 0.00 O ATOM 2341 CB ASP B 24 -6.304 11.694 5.768 1.00 0.00 C ATOM 2342 CG ASP B 24 -6.961 12.248 4.519 1.00 0.00 C ATOM 2343 OD1 ASP B 24 -6.735 11.681 3.429 1.00 0.00 O ATOM 2344 OD2 ASP B 24 -7.701 13.247 4.630 1.00 0.00 O ATOM 0 H ASP B 24 -4.701 9.856 4.533 1.00 0.00 H new ATOM 0 HA ASP B 24 -4.386 12.636 5.499 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -6.692 10.695 5.966 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -6.573 12.315 6.622 1.00 0.00 H new ATOM 2349 N ASP B 25 -3.399 9.995 6.828 1.00 0.00 N ATOM 2350 CA ASP B 25 -2.780 9.382 7.998 1.00 0.00 C ATOM 2351 C ASP B 25 -1.344 8.962 7.699 1.00 0.00 C ATOM 2352 O ASP B 25 -0.998 8.667 6.555 1.00 0.00 O ATOM 2353 CB ASP B 25 -3.592 8.168 8.452 1.00 0.00 C ATOM 2354 CG ASP B 25 -3.540 7.029 7.452 1.00 0.00 C ATOM 2355 OD1 ASP B 25 -2.945 7.216 6.370 1.00 0.00 O ATOM 2356 OD2 ASP B 25 -4.094 5.951 7.751 1.00 0.00 O ATOM 0 H ASP B 25 -3.182 9.535 5.944 1.00 0.00 H new ATOM 0 HA ASP B 25 -2.764 10.122 8.798 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -3.214 7.821 9.414 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -4.629 8.465 8.606 1.00 0.00 H new ATOM 2361 N LYS B 26 -0.512 8.938 8.735 1.00 0.00 N ATOM 2362 CA LYS B 26 0.887 8.552 8.584 1.00 0.00 C ATOM 2363 C LYS B 26 1.000 7.106 8.116 1.00 0.00 C ATOM 2364 O LYS B 26 0.516 6.189 8.780 1.00 0.00 O ATOM 2365 CB LYS B 26 1.634 8.735 9.906 1.00 0.00 C ATOM 2366 CG LYS B 26 2.283 10.101 10.056 1.00 0.00 C ATOM 2367 CD LYS B 26 3.727 9.985 10.518 1.00 0.00 C ATOM 2368 CE LYS B 26 4.130 11.168 11.383 1.00 0.00 C ATOM 2369 NZ LYS B 26 5.471 10.972 12.002 1.00 0.00 N ATOM 0 H LYS B 26 -0.782 9.181 9.688 1.00 0.00 H new ATOM 0 HA LYS B 26 1.339 9.196 7.830 1.00 0.00 H new ATOM 0 HB2 LYS B 26 0.938 8.580 10.731 1.00 0.00 H new ATOM 0 HB3 LYS B 26 2.402 7.966 9.989 1.00 0.00 H new ATOM 0 HG2 LYS B 26 2.246 10.629 9.103 1.00 0.00 H new ATOM 0 HG3 LYS B 26 1.718 10.697 10.772 1.00 0.00 H new ATOM 0 HD2 LYS B 26 3.857 9.060 11.080 1.00 0.00 H new ATOM 0 HD3 LYS B 26 4.384 9.926 9.651 1.00 0.00 H new ATOM 0 HE2 LYS B 26 4.139 12.074 10.777 1.00 0.00 H new ATOM 0 HE3 LYS B 26 3.386 11.315 12.166 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 5.709 11.800 12.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 5.456 10.121 12.600 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 6.185 10.857 11.255 1.00 0.00 H new ATOM 2383 N HIS B 27 1.640 6.907 6.968 1.00 0.00 N ATOM 2384 CA HIS B 27 1.811 5.571 6.411 1.00 0.00 C ATOM 2385 C HIS B 27 3.280 5.157 6.424 1.00 0.00 C ATOM 2386 O HIS B 27 4.055 5.557 5.554 1.00 0.00 O ATOM 2387 CB HIS B 27 1.268 5.516 4.983 1.00 0.00 C ATOM 2388 CG HIS B 27 -0.194 5.204 4.911 1.00 0.00 C ATOM 2389 ND1 HIS B 27 -0.739 3.992 5.274 1.00 0.00 N ATOM 2390 CD2 HIS B 27 -1.235 5.976 4.503 1.00 0.00 C ATOM 2391 CE1 HIS B 27 -2.064 4.063 5.082 1.00 0.00 C ATOM 2392 NE2 HIS B 27 -2.415 5.246 4.616 1.00 0.00 N ATOM 0 H HIS B 27 2.048 7.654 6.406 1.00 0.00 H new ATOM 0 HA HIS B 27 1.250 4.873 7.033 1.00 0.00 H new ATOM 0 HB2 HIS B 27 1.451 6.474 4.496 1.00 0.00 H new ATOM 0 HB3 HIS B 27 1.820 4.762 4.422 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.159 6.993 4.148 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -2.754 3.257 5.283 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -3.357 5.561 4.386 1.00 0.00 H new ATOM 2400 N THR B 28 3.653 4.350 7.411 1.00 0.00 N ATOM 2401 CA THR B 28 5.027 3.877 7.533 1.00 0.00 C ATOM 2402 C THR B 28 5.158 2.460 6.985 1.00 0.00 C ATOM 2403 O THR B 28 4.653 1.505 7.576 1.00 0.00 O ATOM 2404 CB THR B 28 5.477 3.916 8.995 1.00 0.00 C ATOM 2405 OG1 THR B 28 5.401 5.236 9.507 1.00 0.00 O ATOM 2406 CG2 THR B 28 6.894 3.426 9.198 1.00 0.00 C ATOM 0 H THR B 28 3.024 4.010 8.138 1.00 0.00 H new ATOM 0 HA THR B 28 5.668 4.537 6.949 1.00 0.00 H new ATOM 0 HB THR B 28 4.799 3.247 9.525 1.00 0.00 H new ATOM 0 HG1 THR B 28 5.691 5.241 10.443 1.00 0.00 H new ATOM 0 HG21 THR B 28 7.150 3.480 10.256 1.00 0.00 H new ATOM 0 HG22 THR B 28 6.974 2.394 8.857 1.00 0.00 H new ATOM 0 HG23 THR B 28 7.580 4.051 8.627 1.00 0.00 H new ATOM 2414 N TYR B 29 5.836 2.331 5.849 1.00 0.00 N ATOM 2415 CA TYR B 29 6.028 1.030 5.218 1.00 0.00 C ATOM 2416 C TYR B 29 7.329 0.385 5.675 1.00 0.00 C ATOM 2417 O TYR B 29 8.205 1.045 6.231 1.00 0.00 O ATOM 2418 CB TYR B 29 6.023 1.171 3.696 1.00 0.00 C ATOM 2419 CG TYR B 29 4.691 1.616 3.133 1.00 0.00 C ATOM 2420 CD1 TYR B 29 4.292 2.945 3.208 1.00 0.00 C ATOM 2421 CD2 TYR B 29 3.833 0.706 2.527 1.00 0.00 C ATOM 2422 CE1 TYR B 29 3.075 3.354 2.695 1.00 0.00 C ATOM 2423 CE2 TYR B 29 2.616 1.108 2.012 1.00 0.00 C ATOM 2424 CZ TYR B 29 2.242 2.432 2.099 1.00 0.00 C ATOM 2425 OH TYR B 29 1.030 2.836 1.585 1.00 0.00 O ATOM 0 H TYR B 29 6.261 3.111 5.347 1.00 0.00 H new ATOM 0 HA TYR B 29 5.202 0.386 5.520 1.00 0.00 H new ATOM 0 HB2 TYR B 29 6.790 1.889 3.404 1.00 0.00 H new ATOM 0 HB3 TYR B 29 6.295 0.214 3.250 1.00 0.00 H new ATOM 0 HD1 TYR B 29 4.943 3.670 3.674 1.00 0.00 H new ATOM 0 HD2 TYR B 29 4.122 -0.332 2.458 1.00 0.00 H new ATOM 0 HE1 TYR B 29 2.779 4.390 2.761 1.00 0.00 H new ATOM 0 HE2 TYR B 29 1.961 0.389 1.543 1.00 0.00 H new ATOM 0 HH TYR B 29 0.565 2.065 1.199 1.00 0.00 H new ATOM 2435 N HIS B 30 7.442 -0.912 5.434 1.00 0.00 N ATOM 2436 CA HIS B 30 8.632 -1.664 5.814 1.00 0.00 C ATOM 2437 C HIS B 30 9.316 -2.249 4.583 1.00 0.00 C ATOM 2438 O HIS B 30 8.804 -3.179 3.961 1.00 0.00 O ATOM 2439 CB HIS B 30 8.265 -2.784 6.788 1.00 0.00 C ATOM 2440 CG HIS B 30 7.320 -2.354 7.867 1.00 0.00 C ATOM 2441 ND1 HIS B 30 6.137 -2.999 8.155 1.00 0.00 N ATOM 2442 CD2 HIS B 30 7.403 -1.318 8.740 1.00 0.00 C ATOM 2443 CE1 HIS B 30 5.551 -2.350 9.169 1.00 0.00 C ATOM 2444 NE2 HIS B 30 6.279 -1.322 9.562 1.00 0.00 N ATOM 0 H HIS B 30 6.722 -1.469 4.975 1.00 0.00 H new ATOM 0 HA HIS B 30 9.324 -0.980 6.305 1.00 0.00 H new ATOM 0 HB2 HIS B 30 7.817 -3.607 6.231 1.00 0.00 H new ATOM 0 HB3 HIS B 30 9.176 -3.169 7.246 1.00 0.00 H new ATOM 0 HD2 HIS B 30 8.212 -0.604 8.789 1.00 0.00 H new ATOM 0 HE1 HIS B 30 4.605 -2.631 9.608 1.00 0.00 H new ATOM 0 HE2 HIS B 30 6.063 -0.666 10.313 1.00 0.00 H new ATOM 2452 N ILE B 31 10.475 -1.699 4.236 1.00 0.00 N ATOM 2453 CA ILE B 31 11.225 -2.169 3.080 1.00 0.00 C ATOM 2454 C ILE B 31 12.215 -3.259 3.474 1.00 0.00 C ATOM 2455 O ILE B 31 12.826 -3.200 4.541 1.00 0.00 O ATOM 2456 CB ILE B 31 11.987 -1.018 2.396 1.00 0.00 C ATOM 2457 CG1 ILE B 31 11.096 0.222 2.294 1.00 0.00 C ATOM 2458 CG2 ILE B 31 12.469 -1.445 1.018 1.00 0.00 C ATOM 2459 CD1 ILE B 31 9.724 -0.063 1.724 1.00 0.00 C ATOM 0 H ILE B 31 10.914 -0.928 4.739 1.00 0.00 H new ATOM 0 HA ILE B 31 10.499 -2.579 2.378 1.00 0.00 H new ATOM 0 HB ILE B 31 12.858 -0.769 3.002 1.00 0.00 H new ATOM 0 HG12 ILE B 31 10.984 0.661 3.285 1.00 0.00 H new ATOM 0 HG13 ILE B 31 11.592 0.965 1.670 1.00 0.00 H new ATOM 0 HG21 ILE B 31 13.005 -0.620 0.548 1.00 0.00 H new ATOM 0 HG22 ILE B 31 13.135 -2.302 1.115 1.00 0.00 H new ATOM 0 HG23 ILE B 31 11.613 -1.719 0.402 1.00 0.00 H new ATOM 0 HD11 ILE B 31 9.148 0.862 1.681 1.00 0.00 H new ATOM 0 HD12 ILE B 31 9.825 -0.474 0.720 1.00 0.00 H new ATOM 0 HD13 ILE B 31 9.208 -0.782 2.360 1.00 0.00 H new ATOM 2471 N LYS B 32 12.366 -4.255 2.608 1.00 0.00 N ATOM 2472 CA LYS B 32 13.277 -5.362 2.869 1.00 0.00 C ATOM 2473 C LYS B 32 14.449 -5.351 1.892 1.00 0.00 C ATOM 2474 O LYS B 32 14.259 -5.289 0.678 1.00 0.00 O ATOM 2475 CB LYS B 32 12.533 -6.694 2.773 1.00 0.00 C ATOM 2476 CG LYS B 32 12.869 -7.662 3.895 1.00 0.00 C ATOM 2477 CD LYS B 32 11.613 -8.193 4.565 1.00 0.00 C ATOM 2478 CE LYS B 32 11.910 -8.742 5.952 1.00 0.00 C ATOM 2479 NZ LYS B 32 11.718 -10.217 6.018 1.00 0.00 N ATOM 0 H LYS B 32 11.869 -4.318 1.719 1.00 0.00 H new ATOM 0 HA LYS B 32 13.670 -5.242 3.878 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.460 -6.502 2.779 1.00 0.00 H new ATOM 0 HB3 LYS B 32 12.767 -7.163 1.818 1.00 0.00 H new ATOM 0 HG2 LYS B 32 13.450 -8.494 3.498 1.00 0.00 H new ATOM 0 HG3 LYS B 32 13.494 -7.161 4.635 1.00 0.00 H new ATOM 0 HD2 LYS B 32 10.874 -7.395 4.639 1.00 0.00 H new ATOM 0 HD3 LYS B 32 11.174 -8.978 3.948 1.00 0.00 H new ATOM 0 HE2 LYS B 32 12.936 -8.497 6.228 1.00 0.00 H new ATOM 0 HE3 LYS B 32 11.260 -8.258 6.681 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 11.930 -10.552 6.979 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 10.733 -10.450 5.780 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 12.357 -10.681 5.341 1.00 0.00 H new ATOM 2493 N ILE B 33 15.661 -5.416 2.434 1.00 0.00 N ATOM 2494 CA ILE B 33 16.868 -5.419 1.616 1.00 0.00 C ATOM 2495 C ILE B 33 17.781 -6.579 2.001 1.00 0.00 C ATOM 2496 O ILE B 33 17.745 -7.057 3.135 1.00 0.00 O ATOM 2497 CB ILE B 33 17.643 -4.094 1.753 1.00 0.00 C ATOM 2498 CG1 ILE B 33 16.747 -2.913 1.380 1.00 0.00 C ATOM 2499 CG2 ILE B 33 18.890 -4.117 0.882 1.00 0.00 C ATOM 2500 CD1 ILE B 33 17.212 -1.595 1.960 1.00 0.00 C ATOM 0 H ILE B 33 15.833 -5.467 3.438 1.00 0.00 H new ATOM 0 HA ILE B 33 16.554 -5.536 0.579 1.00 0.00 H new ATOM 0 HB ILE B 33 17.952 -3.977 2.792 1.00 0.00 H new ATOM 0 HG12 ILE B 33 16.705 -2.828 0.294 1.00 0.00 H new ATOM 0 HG13 ILE B 33 15.732 -3.114 1.724 1.00 0.00 H new ATOM 0 HG21 ILE B 33 19.426 -3.174 0.990 1.00 0.00 H new ATOM 0 HG22 ILE B 33 19.535 -4.939 1.192 1.00 0.00 H new ATOM 0 HG23 ILE B 33 18.603 -4.254 -0.161 1.00 0.00 H new ATOM 0 HD11 ILE B 33 16.529 -0.802 1.654 1.00 0.00 H new ATOM 0 HD12 ILE B 33 17.227 -1.661 3.048 1.00 0.00 H new ATOM 0 HD13 ILE B 33 18.215 -1.371 1.596 1.00 0.00 H new ATOM 2512 N THR B 34 18.592 -7.036 1.051 1.00 0.00 N ATOM 2513 CA THR B 34 19.505 -8.146 1.302 1.00 0.00 C ATOM 2514 C THR B 34 20.775 -8.016 0.468 1.00 0.00 C ATOM 2515 O THR B 34 20.789 -7.344 -0.563 1.00 0.00 O ATOM 2516 CB THR B 34 18.815 -9.476 0.996 1.00 0.00 C ATOM 2517 OG1 THR B 34 17.722 -9.687 1.872 1.00 0.00 O ATOM 2518 CG2 THR B 34 19.735 -10.672 1.116 1.00 0.00 C ATOM 0 H THR B 34 18.636 -6.657 0.105 1.00 0.00 H new ATOM 0 HA THR B 34 19.785 -8.119 2.355 1.00 0.00 H new ATOM 0 HB THR B 34 18.484 -9.396 -0.039 1.00 0.00 H new ATOM 0 HG1 THR B 34 17.293 -10.542 1.659 1.00 0.00 H new ATOM 0 HG21 THR B 34 19.181 -11.582 0.886 1.00 0.00 H new ATOM 0 HG22 THR B 34 20.564 -10.565 0.416 1.00 0.00 H new ATOM 0 HG23 THR B 34 20.124 -10.732 2.133 1.00 0.00 H new ATOM 2526 N ASN B 35 21.840 -8.667 0.926 1.00 0.00 N ATOM 2527 CA ASN B 35 23.120 -8.629 0.228 1.00 0.00 C ATOM 2528 C ASN B 35 23.373 -9.935 -0.517 1.00 0.00 C ATOM 2529 O ASN B 35 24.193 -10.752 -0.109 1.00 0.00 O ATOM 2530 CB ASN B 35 24.257 -8.360 1.215 1.00 0.00 C ATOM 2531 CG ASN B 35 25.592 -8.163 0.522 1.00 0.00 C ATOM 2532 OD1 ASN B 35 26.587 -8.792 0.879 1.00 0.00 O ATOM 2533 ND2 ASN B 35 25.618 -7.285 -0.473 1.00 0.00 N ATOM 0 H ASN B 35 21.842 -9.228 1.778 1.00 0.00 H new ATOM 0 HA ASN B 35 23.084 -7.819 -0.500 1.00 0.00 H new ATOM 0 HB2 ASN B 35 24.022 -7.473 1.803 1.00 0.00 H new ATOM 0 HB3 ASN B 35 24.333 -9.194 1.913 1.00 0.00 H new ATOM 0 HD21 ASN B 35 26.488 -7.109 -0.976 1.00 0.00 H new ATOM 0 HD22 ASN B 35 24.768 -6.786 -0.735 1.00 0.00 H new ATOM 2540 N ALA B 36 22.661 -10.115 -1.616 1.00 0.00 N ATOM 2541 CA ALA B 36 22.797 -11.316 -2.431 1.00 0.00 C ATOM 2542 C ALA B 36 24.236 -11.498 -2.906 1.00 0.00 C ATOM 2543 O ALA B 36 24.673 -12.615 -3.179 1.00 0.00 O ATOM 2544 CB ALA B 36 21.850 -11.255 -3.620 1.00 0.00 C ATOM 0 H ALA B 36 21.979 -9.443 -1.968 1.00 0.00 H new ATOM 0 HA ALA B 36 22.535 -12.176 -1.815 1.00 0.00 H new ATOM 0 HB1 ALA B 36 21.961 -12.158 -4.221 1.00 0.00 H new ATOM 0 HB2 ALA B 36 20.823 -11.181 -3.263 1.00 0.00 H new ATOM 0 HB3 ALA B 36 22.086 -10.383 -4.229 1.00 0.00 H new ATOM 2550 N GLY B 37 24.965 -10.390 -3.002 1.00 0.00 N ATOM 2551 CA GLY B 37 26.346 -10.448 -3.445 1.00 0.00 C ATOM 2552 C GLY B 37 27.169 -11.446 -2.655 1.00 0.00 C ATOM 2553 O GLY B 37 27.680 -12.418 -3.211 1.00 0.00 O ATOM 0 H GLY B 37 24.624 -9.454 -2.781 1.00 0.00 H new ATOM 0 HA2 GLY B 37 26.374 -10.715 -4.502 1.00 0.00 H new ATOM 0 HA3 GLY B 37 26.795 -9.459 -3.354 1.00 0.00 H new ATOM 2557 N GLY B 38 27.298 -11.207 -1.354 1.00 0.00 N ATOM 2558 CA GLY B 38 28.065 -12.101 -0.507 1.00 0.00 C ATOM 2559 C GLY B 38 29.265 -11.422 0.123 1.00 0.00 C ATOM 2560 O GLY B 38 30.218 -12.086 0.531 1.00 0.00 O ATOM 0 H GLY B 38 26.885 -10.409 -0.871 1.00 0.00 H new ATOM 0 HA2 GLY B 38 27.420 -12.493 0.279 1.00 0.00 H new ATOM 0 HA3 GLY B 38 28.403 -12.953 -1.097 1.00 0.00 H new ATOM 2564 N ARG B 39 29.221 -10.096 0.204 1.00 0.00 N ATOM 2565 CA ARG B 39 30.314 -9.329 0.790 1.00 0.00 C ATOM 2566 C ARG B 39 29.794 -8.050 1.440 1.00 0.00 C ATOM 2567 O ARG B 39 28.703 -7.580 1.121 1.00 0.00 O ATOM 2568 CB ARG B 39 31.352 -8.983 -0.280 1.00 0.00 C ATOM 2569 CG ARG B 39 31.563 -10.087 -1.303 1.00 0.00 C ATOM 2570 CD ARG B 39 32.708 -9.759 -2.247 1.00 0.00 C ATOM 2571 NE ARG B 39 32.278 -8.907 -3.353 1.00 0.00 N ATOM 2572 CZ ARG B 39 31.622 -9.357 -4.417 1.00 0.00 C ATOM 2573 NH1 ARG B 39 31.326 -10.645 -4.521 1.00 0.00 N ATOM 2574 NH2 ARG B 39 31.261 -8.519 -5.379 1.00 0.00 N ATOM 0 H ARG B 39 28.440 -9.530 -0.129 1.00 0.00 H new ATOM 0 HA ARG B 39 30.783 -9.942 1.559 1.00 0.00 H new ATOM 0 HB2 ARG B 39 31.040 -8.075 -0.797 1.00 0.00 H new ATOM 0 HB3 ARG B 39 32.303 -8.763 0.206 1.00 0.00 H new ATOM 0 HG2 ARG B 39 31.771 -11.026 -0.789 1.00 0.00 H new ATOM 0 HG3 ARG B 39 30.648 -10.233 -1.876 1.00 0.00 H new ATOM 0 HD2 ARG B 39 33.503 -9.260 -1.693 1.00 0.00 H new ATOM 0 HD3 ARG B 39 33.127 -10.684 -2.643 1.00 0.00 H new ATOM 0 HE ARG B 39 32.493 -7.911 -3.306 1.00 0.00 H new ATOM 0 HH11 ARG B 39 31.602 -11.293 -3.783 1.00 0.00 H new ATOM 0 HH12 ARG B 39 30.822 -10.988 -5.339 1.00 0.00 H new ATOM 0 HH21 ARG B 39 31.487 -7.527 -5.303 1.00 0.00 H new ATOM 0 HH22 ARG B 39 30.757 -8.866 -6.195 1.00 0.00 H new ATOM 2588 N ARG B 40 30.583 -7.493 2.352 1.00 0.00 N ATOM 2589 CA ARG B 40 30.201 -6.268 3.045 1.00 0.00 C ATOM 2590 C ARG B 40 29.909 -5.153 2.048 1.00 0.00 C ATOM 2591 O ARG B 40 30.498 -5.103 0.967 1.00 0.00 O ATOM 2592 CB ARG B 40 31.307 -5.832 4.007 1.00 0.00 C ATOM 2593 CG ARG B 40 30.807 -4.979 5.161 1.00 0.00 C ATOM 2594 CD ARG B 40 31.951 -4.522 6.052 1.00 0.00 C ATOM 2595 NE ARG B 40 32.956 -5.566 6.230 1.00 0.00 N ATOM 2596 CZ ARG B 40 32.835 -6.564 7.100 1.00 0.00 C ATOM 2597 NH1 ARG B 40 31.753 -6.654 7.862 1.00 0.00 N ATOM 2598 NH2 ARG B 40 33.794 -7.473 7.207 1.00 0.00 N ATOM 0 H ARG B 40 31.490 -7.870 2.628 1.00 0.00 H new ATOM 0 HA ARG B 40 29.295 -6.470 3.616 1.00 0.00 H new ATOM 0 HB2 ARG B 40 31.799 -6.718 4.408 1.00 0.00 H new ATOM 0 HB3 ARG B 40 32.060 -5.273 3.452 1.00 0.00 H new ATOM 0 HG2 ARG B 40 30.279 -4.109 4.770 1.00 0.00 H new ATOM 0 HG3 ARG B 40 30.089 -5.548 5.752 1.00 0.00 H new ATOM 0 HD2 ARG B 40 32.419 -3.639 5.617 1.00 0.00 H new ATOM 0 HD3 ARG B 40 31.558 -4.228 7.025 1.00 0.00 H new ATOM 0 HE ARG B 40 33.798 -5.528 5.655 1.00 0.00 H new ATOM 0 HH11 ARG B 40 31.013 -5.957 7.781 1.00 0.00 H new ATOM 0 HH12 ARG B 40 31.661 -7.420 8.529 1.00 0.00 H new ATOM 0 HH21 ARG B 40 34.626 -7.407 6.621 1.00 0.00 H new ATOM 0 HH22 ARG B 40 33.699 -8.238 7.875 1.00 0.00 H new ATOM 2612 N ILE B 41 28.994 -4.261 2.412 1.00 0.00 N ATOM 2613 CA ILE B 41 28.625 -3.150 1.542 1.00 0.00 C ATOM 2614 C ILE B 41 28.091 -1.968 2.341 1.00 0.00 C ATOM 2615 O ILE B 41 27.789 -2.090 3.529 1.00 0.00 O ATOM 2616 CB ILE B 41 27.558 -3.575 0.514 1.00 0.00 C ATOM 2617 CG1 ILE B 41 26.392 -4.273 1.215 1.00 0.00 C ATOM 2618 CG2 ILE B 41 28.168 -4.482 -0.544 1.00 0.00 C ATOM 2619 CD1 ILE B 41 25.083 -4.164 0.465 1.00 0.00 C ATOM 0 H ILE B 41 28.495 -4.285 3.301 1.00 0.00 H new ATOM 0 HA ILE B 41 29.533 -2.849 1.020 1.00 0.00 H new ATOM 0 HB ILE B 41 27.178 -2.681 0.020 1.00 0.00 H new ATOM 0 HG12 ILE B 41 26.638 -5.326 1.349 1.00 0.00 H new ATOM 0 HG13 ILE B 41 26.268 -3.845 2.210 1.00 0.00 H new ATOM 0 HG21 ILE B 41 27.400 -4.772 -1.261 1.00 0.00 H new ATOM 0 HG22 ILE B 41 28.966 -3.951 -1.062 1.00 0.00 H new ATOM 0 HG23 ILE B 41 28.575 -5.374 -0.068 1.00 0.00 H new ATOM 0 HD11 ILE B 41 24.301 -4.682 1.021 1.00 0.00 H new ATOM 0 HD12 ILE B 41 24.814 -3.114 0.353 1.00 0.00 H new ATOM 0 HD13 ILE B 41 25.189 -4.618 -0.520 1.00 0.00 H new ATOM 2631 N GLY B 42 27.967 -0.825 1.675 1.00 0.00 N ATOM 2632 CA GLY B 42 27.459 0.369 2.324 1.00 0.00 C ATOM 2633 C GLY B 42 26.343 1.013 1.526 1.00 0.00 C ATOM 2634 O GLY B 42 26.596 1.712 0.546 1.00 0.00 O ATOM 0 H GLY B 42 28.211 -0.704 0.692 1.00 0.00 H new ATOM 0 HA2 GLY B 42 27.094 0.114 3.319 1.00 0.00 H new ATOM 0 HA3 GLY B 42 28.271 1.084 2.456 1.00 0.00 H new ATOM 2638 N TRP B 43 25.103 0.765 1.937 1.00 0.00 N ATOM 2639 CA TRP B 43 23.945 1.315 1.243 1.00 0.00 C ATOM 2640 C TRP B 43 23.462 2.607 1.894 1.00 0.00 C ATOM 2641 O TRP B 43 23.716 2.857 3.072 1.00 0.00 O ATOM 2642 CB TRP B 43 22.809 0.290 1.217 1.00 0.00 C ATOM 2643 CG TRP B 43 22.397 -0.172 2.580 1.00 0.00 C ATOM 2644 CD1 TRP B 43 23.009 -1.124 3.344 1.00 0.00 C ATOM 2645 CD2 TRP B 43 21.278 0.296 3.343 1.00 0.00 C ATOM 2646 NE1 TRP B 43 22.341 -1.276 4.535 1.00 0.00 N ATOM 2647 CE2 TRP B 43 21.274 -0.415 4.558 1.00 0.00 C ATOM 2648 CE3 TRP B 43 20.281 1.248 3.117 1.00 0.00 C ATOM 2649 CZ2 TRP B 43 20.312 -0.204 5.542 1.00 0.00 C ATOM 2650 CZ3 TRP B 43 19.326 1.457 4.095 1.00 0.00 C ATOM 2651 CH2 TRP B 43 19.348 0.734 5.294 1.00 0.00 C ATOM 0 H TRP B 43 24.875 0.187 2.746 1.00 0.00 H new ATOM 0 HA TRP B 43 24.250 1.545 0.222 1.00 0.00 H new ATOM 0 HB2 TRP B 43 21.947 0.726 0.713 1.00 0.00 H new ATOM 0 HB3 TRP B 43 23.120 -0.572 0.627 1.00 0.00 H new ATOM 0 HD1 TRP B 43 23.890 -1.677 3.054 1.00 0.00 H new ATOM 0 HE1 TRP B 43 22.597 -1.924 5.280 1.00 0.00 H new ATOM 0 HE3 TRP B 43 20.257 1.810 2.195 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 20.326 -0.761 6.467 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 18.550 2.190 3.931 1.00 0.00 H new ATOM 0 HH2 TRP B 43 18.588 0.921 6.038 1.00 0.00 H new ATOM 2662 N ALA B 44 22.759 3.419 1.113 1.00 0.00 N ATOM 2663 CA ALA B 44 22.225 4.686 1.596 1.00 0.00 C ATOM 2664 C ALA B 44 20.983 5.084 0.806 1.00 0.00 C ATOM 2665 O ALA B 44 20.996 5.092 -0.425 1.00 0.00 O ATOM 2666 CB ALA B 44 23.284 5.777 1.507 1.00 0.00 C ATOM 0 H ALA B 44 22.545 3.220 0.136 1.00 0.00 H new ATOM 0 HA ALA B 44 21.941 4.562 2.641 1.00 0.00 H new ATOM 0 HB1 ALA B 44 22.870 6.717 1.871 1.00 0.00 H new ATOM 0 HB2 ALA B 44 24.144 5.499 2.116 1.00 0.00 H new ATOM 0 HB3 ALA B 44 23.597 5.896 0.470 1.00 0.00 H new ATOM 2672 N ILE B 45 19.910 5.406 1.520 1.00 0.00 N ATOM 2673 CA ILE B 45 18.657 5.796 0.883 1.00 0.00 C ATOM 2674 C ILE B 45 18.561 7.309 0.720 1.00 0.00 C ATOM 2675 O ILE B 45 18.993 8.068 1.586 1.00 0.00 O ATOM 2676 CB ILE B 45 17.441 5.301 1.688 1.00 0.00 C ATOM 2677 CG1 ILE B 45 17.615 3.830 2.063 1.00 0.00 C ATOM 2678 CG2 ILE B 45 16.162 5.504 0.890 1.00 0.00 C ATOM 2679 CD1 ILE B 45 17.823 2.923 0.869 1.00 0.00 C ATOM 0 H ILE B 45 19.882 5.405 2.540 1.00 0.00 H new ATOM 0 HA ILE B 45 18.650 5.330 -0.102 1.00 0.00 H new ATOM 0 HB ILE B 45 17.369 5.883 2.607 1.00 0.00 H new ATOM 0 HG12 ILE B 45 18.467 3.733 2.736 1.00 0.00 H new ATOM 0 HG13 ILE B 45 16.735 3.497 2.613 1.00 0.00 H new ATOM 0 HG21 ILE B 45 15.311 5.150 1.471 1.00 0.00 H new ATOM 0 HG22 ILE B 45 16.035 6.564 0.669 1.00 0.00 H new ATOM 0 HG23 ILE B 45 16.223 4.944 -0.043 1.00 0.00 H new ATOM 0 HD11 ILE B 45 17.939 1.894 1.210 1.00 0.00 H new ATOM 0 HD12 ILE B 45 16.960 2.991 0.206 1.00 0.00 H new ATOM 0 HD13 ILE B 45 18.719 3.230 0.330 1.00 0.00 H new ATOM 2691 N LYS B 46 17.987 7.738 -0.400 1.00 0.00 N ATOM 2692 CA LYS B 46 17.826 9.159 -0.685 1.00 0.00 C ATOM 2693 C LYS B 46 16.526 9.412 -1.441 1.00 0.00 C ATOM 2694 O LYS B 46 16.215 8.719 -2.409 1.00 0.00 O ATOM 2695 CB LYS B 46 19.013 9.677 -1.499 1.00 0.00 C ATOM 2696 CG LYS B 46 20.295 9.805 -0.693 1.00 0.00 C ATOM 2697 CD LYS B 46 21.185 10.912 -1.236 1.00 0.00 C ATOM 2698 CE LYS B 46 21.574 11.899 -0.147 1.00 0.00 C ATOM 2699 NZ LYS B 46 22.355 13.044 -0.688 1.00 0.00 N ATOM 0 H LYS B 46 17.625 7.120 -1.126 1.00 0.00 H new ATOM 0 HA LYS B 46 17.787 9.695 0.264 1.00 0.00 H new ATOM 0 HB2 LYS B 46 19.188 9.005 -2.339 1.00 0.00 H new ATOM 0 HB3 LYS B 46 18.758 10.651 -1.918 1.00 0.00 H new ATOM 0 HG2 LYS B 46 20.052 10.010 0.350 1.00 0.00 H new ATOM 0 HG3 LYS B 46 20.835 8.859 -0.714 1.00 0.00 H new ATOM 0 HD2 LYS B 46 22.084 10.476 -1.672 1.00 0.00 H new ATOM 0 HD3 LYS B 46 20.665 11.438 -2.037 1.00 0.00 H new ATOM 0 HE2 LYS B 46 20.675 12.272 0.343 1.00 0.00 H new ATOM 0 HE3 LYS B 46 22.162 11.386 0.614 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 22.600 13.694 0.086 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 23.226 12.691 -1.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 21.785 13.549 -1.396 1.00 0.00 H new ATOM 2713 N THR B 47 15.767 10.406 -0.992 1.00 0.00 N ATOM 2714 CA THR B 47 14.498 10.744 -1.628 1.00 0.00 C ATOM 2715 C THR B 47 14.537 12.149 -2.218 1.00 0.00 C ATOM 2716 O THR B 47 15.308 13.000 -1.774 1.00 0.00 O ATOM 2717 CB THR B 47 13.353 10.633 -0.620 1.00 0.00 C ATOM 2718 OG1 THR B 47 13.376 11.719 0.289 1.00 0.00 O ATOM 2719 CG2 THR B 47 13.391 9.356 0.191 1.00 0.00 C ATOM 0 H THR B 47 16.008 10.991 -0.192 1.00 0.00 H new ATOM 0 HA THR B 47 14.330 10.036 -2.440 1.00 0.00 H new ATOM 0 HB THR B 47 12.442 10.638 -1.218 1.00 0.00 H new ATOM 0 HG1 THR B 47 12.531 12.211 0.232 1.00 0.00 H new ATOM 0 HG21 THR B 47 12.552 9.341 0.886 1.00 0.00 H new ATOM 0 HG22 THR B 47 13.323 8.498 -0.478 1.00 0.00 H new ATOM 0 HG23 THR B 47 14.326 9.308 0.750 1.00 0.00 H new ATOM 2727 N THR B 48 13.699 12.384 -3.222 1.00 0.00 N ATOM 2728 CA THR B 48 13.632 13.684 -3.877 1.00 0.00 C ATOM 2729 C THR B 48 13.122 14.752 -2.916 1.00 0.00 C ATOM 2730 O THR B 48 13.551 15.904 -2.966 1.00 0.00 O ATOM 2731 CB THR B 48 12.722 13.609 -5.103 1.00 0.00 C ATOM 2732 OG1 THR B 48 11.583 12.810 -4.835 1.00 0.00 O ATOM 2733 CG2 THR B 48 13.407 13.036 -6.325 1.00 0.00 C ATOM 0 H THR B 48 13.055 11.689 -3.600 1.00 0.00 H new ATOM 0 HA THR B 48 14.638 13.958 -4.193 1.00 0.00 H new ATOM 0 HB THR B 48 12.440 14.640 -5.315 1.00 0.00 H new ATOM 0 HG1 THR B 48 10.865 13.373 -4.479 1.00 0.00 H new ATOM 0 HG21 THR B 48 12.704 13.011 -7.158 1.00 0.00 H new ATOM 0 HG22 THR B 48 14.261 13.659 -6.589 1.00 0.00 H new ATOM 0 HG23 THR B 48 13.749 12.024 -6.109 1.00 0.00 H new ATOM 2741 N ASN B 49 12.203 14.361 -2.040 1.00 0.00 N ATOM 2742 CA ASN B 49 11.632 15.282 -1.064 1.00 0.00 C ATOM 2743 C ASN B 49 11.823 14.757 0.354 1.00 0.00 C ATOM 2744 O ASN B 49 11.240 13.741 0.735 1.00 0.00 O ATOM 2745 CB ASN B 49 10.145 15.499 -1.345 1.00 0.00 C ATOM 2746 CG ASN B 49 9.806 16.958 -1.576 1.00 0.00 C ATOM 2747 OD1 ASN B 49 8.770 17.439 -0.898 1.00 0.00 O flip ATOM 2748 ND2 ASN B 49 10.467 17.646 -2.354 1.00 0.00 N flip ATOM 0 H ASN B 49 11.837 13.411 -1.986 1.00 0.00 H new ATOM 0 HA ASN B 49 12.153 16.235 -1.152 1.00 0.00 H new ATOM 0 HB2 ASN B 49 9.855 14.919 -2.221 1.00 0.00 H new ATOM 0 HB3 ASN B 49 9.561 15.122 -0.506 1.00 0.00 H new ATOM 0 HD21 ASN B 49 11.255 17.235 -2.854 1.00 0.00 H new ATOM 0 HD22 ASN B 49 10.226 18.627 -2.498 1.00 0.00 H new ATOM 2755 N MET B 50 12.644 15.455 1.132 1.00 0.00 N ATOM 2756 CA MET B 50 12.912 15.057 2.509 1.00 0.00 C ATOM 2757 C MET B 50 12.037 15.837 3.488 1.00 0.00 C ATOM 2758 O MET B 50 12.364 15.952 4.669 1.00 0.00 O ATOM 2759 CB MET B 50 14.388 15.272 2.846 1.00 0.00 C ATOM 2760 CG MET B 50 15.316 14.271 2.178 1.00 0.00 C ATOM 2761 SD MET B 50 16.311 13.347 3.364 1.00 0.00 S ATOM 2762 CE MET B 50 15.500 11.752 3.317 1.00 0.00 C ATOM 0 H MET B 50 13.135 16.298 0.833 1.00 0.00 H new ATOM 0 HA MET B 50 12.673 13.998 2.604 1.00 0.00 H new ATOM 0 HB2 MET B 50 14.678 16.279 2.547 1.00 0.00 H new ATOM 0 HB3 MET B 50 14.518 15.211 3.926 1.00 0.00 H new ATOM 0 HG2 MET B 50 14.725 13.574 1.584 1.00 0.00 H new ATOM 0 HG3 MET B 50 15.976 14.797 1.488 1.00 0.00 H new ATOM 0 HE1 MET B 50 16.002 11.068 4.001 1.00 0.00 H new ATOM 0 HE2 MET B 50 14.458 11.865 3.617 1.00 0.00 H new ATOM 0 HE3 MET B 50 15.545 11.351 2.305 1.00 0.00 H new ATOM 2772 N ARG B 51 10.924 16.369 2.992 1.00 0.00 N ATOM 2773 CA ARG B 51 10.005 17.133 3.826 1.00 0.00 C ATOM 2774 C ARG B 51 8.856 16.254 4.308 1.00 0.00 C ATOM 2775 O ARG B 51 8.504 16.265 5.488 1.00 0.00 O ATOM 2776 CB ARG B 51 9.454 18.332 3.052 1.00 0.00 C ATOM 2777 CG ARG B 51 10.464 18.962 2.107 1.00 0.00 C ATOM 2778 CD ARG B 51 10.219 20.454 1.945 1.00 0.00 C ATOM 2779 NE ARG B 51 10.006 20.825 0.549 1.00 0.00 N ATOM 2780 CZ ARG B 51 8.867 20.616 -0.103 1.00 0.00 C ATOM 2781 NH1 ARG B 51 7.843 20.043 0.516 1.00 0.00 N ATOM 2782 NH2 ARG B 51 8.749 20.981 -1.372 1.00 0.00 N ATOM 0 H ARG B 51 10.638 16.285 2.017 1.00 0.00 H new ATOM 0 HA ARG B 51 10.556 17.494 4.695 1.00 0.00 H new ATOM 0 HB2 ARG B 51 8.582 18.015 2.480 1.00 0.00 H new ATOM 0 HB3 ARG B 51 9.113 19.086 3.761 1.00 0.00 H new ATOM 0 HG2 ARG B 51 11.472 18.797 2.487 1.00 0.00 H new ATOM 0 HG3 ARG B 51 10.407 18.475 1.134 1.00 0.00 H new ATOM 0 HD2 ARG B 51 9.349 20.745 2.534 1.00 0.00 H new ATOM 0 HD3 ARG B 51 11.071 21.006 2.341 1.00 0.00 H new ATOM 0 HE ARG B 51 10.774 21.269 0.046 1.00 0.00 H new ATOM 0 HH11 ARG B 51 7.930 19.763 1.493 1.00 0.00 H new ATOM 0 HH12 ARG B 51 6.969 19.883 0.015 1.00 0.00 H new ATOM 0 HH21 ARG B 51 9.534 21.423 -1.850 1.00 0.00 H new ATOM 0 HH22 ARG B 51 7.874 20.819 -1.870 1.00 0.00 H new ATOM 2796 N ARG B 52 8.280 15.489 3.386 1.00 0.00 N ATOM 2797 CA ARG B 52 7.174 14.598 3.713 1.00 0.00 C ATOM 2798 C ARG B 52 7.639 13.145 3.732 1.00 0.00 C ATOM 2799 O ARG B 52 7.142 12.334 4.514 1.00 0.00 O ATOM 2800 CB ARG B 52 6.037 14.770 2.704 1.00 0.00 C ATOM 2801 CG ARG B 52 5.726 16.224 2.383 1.00 0.00 C ATOM 2802 CD ARG B 52 5.277 16.984 3.620 1.00 0.00 C ATOM 2803 NE ARG B 52 5.781 18.354 3.634 1.00 0.00 N ATOM 2804 CZ ARG B 52 5.337 19.296 4.461 1.00 0.00 C ATOM 2805 NH1 ARG B 52 4.379 19.016 5.335 1.00 0.00 N ATOM 2806 NH2 ARG B 52 5.849 20.518 4.415 1.00 0.00 N ATOM 0 H ARG B 52 8.562 15.469 2.406 1.00 0.00 H new ATOM 0 HA ARG B 52 6.809 14.859 4.706 1.00 0.00 H new ATOM 0 HB2 ARG B 52 6.298 14.250 1.782 1.00 0.00 H new ATOM 0 HB3 ARG B 52 5.139 14.292 3.096 1.00 0.00 H new ATOM 0 HG2 ARG B 52 6.611 16.702 1.962 1.00 0.00 H new ATOM 0 HG3 ARG B 52 4.946 16.271 1.623 1.00 0.00 H new ATOM 0 HD2 ARG B 52 4.188 16.998 3.661 1.00 0.00 H new ATOM 0 HD3 ARG B 52 5.623 16.461 4.512 1.00 0.00 H new ATOM 0 HE ARG B 52 6.516 18.603 2.972 1.00 0.00 H new ATOM 0 HH11 ARG B 52 3.982 18.077 5.373 1.00 0.00 H new ATOM 0 HH12 ARG B 52 4.039 19.740 5.969 1.00 0.00 H new ATOM 0 HH21 ARG B 52 6.585 20.738 3.744 1.00 0.00 H new ATOM 0 HH22 ARG B 52 5.507 21.239 5.050 1.00 0.00 H new ATOM 2820 N LEU B 53 8.597 12.826 2.869 1.00 0.00 N ATOM 2821 CA LEU B 53 9.133 11.473 2.787 1.00 0.00 C ATOM 2822 C LEU B 53 10.403 11.342 3.622 1.00 0.00 C ATOM 2823 O LEU B 53 11.306 12.175 3.532 1.00 0.00 O ATOM 2824 CB LEU B 53 9.427 11.104 1.331 1.00 0.00 C ATOM 2825 CG LEU B 53 8.233 11.220 0.382 1.00 0.00 C ATOM 2826 CD1 LEU B 53 8.706 11.307 -1.062 1.00 0.00 C ATOM 2827 CD2 LEU B 53 7.292 10.038 0.566 1.00 0.00 C ATOM 0 H LEU B 53 9.018 13.487 2.216 1.00 0.00 H new ATOM 0 HA LEU B 53 8.384 10.787 3.183 1.00 0.00 H new ATOM 0 HB2 LEU B 53 10.228 11.746 0.964 1.00 0.00 H new ATOM 0 HB3 LEU B 53 9.799 10.080 1.299 1.00 0.00 H new ATOM 0 HG LEU B 53 7.689 12.134 0.620 1.00 0.00 H new ATOM 0 HD11 LEU B 53 7.843 11.389 -1.723 1.00 0.00 H new ATOM 0 HD12 LEU B 53 9.342 12.184 -1.184 1.00 0.00 H new ATOM 0 HD13 LEU B 53 9.272 10.410 -1.314 1.00 0.00 H new ATOM 0 HD21 LEU B 53 6.448 10.135 -0.116 1.00 0.00 H new ATOM 0 HD22 LEU B 53 7.826 9.112 0.353 1.00 0.00 H new ATOM 0 HD23 LEU B 53 6.928 10.019 1.593 1.00 0.00 H new ATOM 2839 N SER B 54 10.466 10.292 4.435 1.00 0.00 N ATOM 2840 CA SER B 54 11.627 10.056 5.286 1.00 0.00 C ATOM 2841 C SER B 54 11.883 8.562 5.459 1.00 0.00 C ATOM 2842 O SER B 54 11.038 7.733 5.123 1.00 0.00 O ATOM 2843 CB SER B 54 11.426 10.714 6.652 1.00 0.00 C ATOM 2844 OG SER B 54 12.187 11.906 6.762 1.00 0.00 O ATOM 0 H SER B 54 9.729 9.593 4.522 1.00 0.00 H new ATOM 0 HA SER B 54 12.497 10.500 4.801 1.00 0.00 H new ATOM 0 HB2 SER B 54 10.370 10.939 6.799 1.00 0.00 H new ATOM 0 HB3 SER B 54 11.717 10.019 7.440 1.00 0.00 H new ATOM 0 HG SER B 54 12.040 12.308 7.644 1.00 0.00 H new ATOM 2850 N VAL B 55 13.056 8.227 5.986 1.00 0.00 N ATOM 2851 CA VAL B 55 13.427 6.834 6.205 1.00 0.00 C ATOM 2852 C VAL B 55 14.399 6.702 7.369 1.00 0.00 C ATOM 2853 O VAL B 55 15.050 7.667 7.770 1.00 0.00 O ATOM 2854 CB VAL B 55 14.051 6.212 4.935 1.00 0.00 C ATOM 2855 CG1 VAL B 55 15.132 7.120 4.369 1.00 0.00 C ATOM 2856 CG2 VAL B 55 14.606 4.818 5.206 1.00 0.00 C ATOM 0 H VAL B 55 13.766 8.902 6.269 1.00 0.00 H new ATOM 0 HA VAL B 55 12.512 6.293 6.446 1.00 0.00 H new ATOM 0 HB VAL B 55 13.258 6.111 4.194 1.00 0.00 H new ATOM 0 HG11 VAL B 55 15.559 6.664 3.476 1.00 0.00 H new ATOM 0 HG12 VAL B 55 14.698 8.086 4.112 1.00 0.00 H new ATOM 0 HG13 VAL B 55 15.915 7.261 5.114 1.00 0.00 H new ATOM 0 HG21 VAL B 55 15.036 4.413 4.290 1.00 0.00 H new ATOM 0 HG22 VAL B 55 15.377 4.876 5.974 1.00 0.00 H new ATOM 0 HG23 VAL B 55 13.802 4.166 5.548 1.00 0.00 H new ATOM 2866 N ASP B 56 14.486 5.493 7.901 1.00 0.00 N ATOM 2867 CA ASP B 56 15.375 5.210 9.021 1.00 0.00 C ATOM 2868 C ASP B 56 15.556 3.700 9.207 1.00 0.00 C ATOM 2869 O ASP B 56 14.573 2.970 9.332 1.00 0.00 O ATOM 2870 CB ASP B 56 14.818 5.827 10.305 1.00 0.00 C ATOM 2871 CG ASP B 56 15.851 5.890 11.413 1.00 0.00 C ATOM 2872 OD1 ASP B 56 16.856 6.614 11.248 1.00 0.00 O ATOM 2873 OD2 ASP B 56 15.656 5.216 12.447 1.00 0.00 O ATOM 0 H ASP B 56 13.951 4.688 7.575 1.00 0.00 H new ATOM 0 HA ASP B 56 16.348 5.651 8.802 1.00 0.00 H new ATOM 0 HB2 ASP B 56 14.455 6.833 10.093 1.00 0.00 H new ATOM 0 HB3 ASP B 56 13.962 5.243 10.643 1.00 0.00 H new ATOM 2878 N PRO B 57 16.811 3.200 9.233 1.00 0.00 N ATOM 2879 CA PRO B 57 18.021 4.020 9.090 1.00 0.00 C ATOM 2880 C PRO B 57 18.256 4.457 7.646 1.00 0.00 C ATOM 2881 O PRO B 57 17.985 3.703 6.711 1.00 0.00 O ATOM 2882 CB PRO B 57 19.134 3.083 9.554 1.00 0.00 C ATOM 2883 CG PRO B 57 18.632 1.720 9.228 1.00 0.00 C ATOM 2884 CD PRO B 57 17.136 1.771 9.405 1.00 0.00 C ATOM 0 HA PRO B 57 17.959 4.947 9.660 1.00 0.00 H new ATOM 0 HB2 PRO B 57 20.071 3.295 9.040 1.00 0.00 H new ATOM 0 HB3 PRO B 57 19.325 3.191 10.622 1.00 0.00 H new ATOM 0 HG2 PRO B 57 18.894 1.442 8.207 1.00 0.00 H new ATOM 0 HG3 PRO B 57 19.077 0.973 9.886 1.00 0.00 H new ATOM 0 HD2 PRO B 57 16.624 1.153 8.667 1.00 0.00 H new ATOM 0 HD3 PRO B 57 16.837 1.408 10.388 1.00 0.00 H new ATOM 2892 N PRO B 58 18.763 5.685 7.442 1.00 0.00 N ATOM 2893 CA PRO B 58 19.031 6.216 6.104 1.00 0.00 C ATOM 2894 C PRO B 58 20.329 5.683 5.496 1.00 0.00 C ATOM 2895 O PRO B 58 20.732 6.105 4.413 1.00 0.00 O ATOM 2896 CB PRO B 58 19.135 7.719 6.349 1.00 0.00 C ATOM 2897 CG PRO B 58 19.662 7.835 7.738 1.00 0.00 C ATOM 2898 CD PRO B 58 19.114 6.654 8.500 1.00 0.00 C ATOM 0 HA PRO B 58 18.258 5.928 5.391 1.00 0.00 H new ATOM 0 HB2 PRO B 58 19.803 8.193 5.630 1.00 0.00 H new ATOM 0 HB3 PRO B 58 18.164 8.205 6.251 1.00 0.00 H new ATOM 0 HG2 PRO B 58 20.752 7.828 7.742 1.00 0.00 H new ATOM 0 HG3 PRO B 58 19.347 8.773 8.196 1.00 0.00 H new ATOM 0 HD2 PRO B 58 19.853 6.244 9.189 1.00 0.00 H new ATOM 0 HD3 PRO B 58 18.243 6.930 9.094 1.00 0.00 H new ATOM 2906 N CYS B 59 20.981 4.756 6.195 1.00 0.00 N ATOM 2907 CA CYS B 59 22.230 4.177 5.712 1.00 0.00 C ATOM 2908 C CYS B 59 22.765 3.139 6.692 1.00 0.00 C ATOM 2909 O CYS B 59 22.420 3.150 7.873 1.00 0.00 O ATOM 2910 CB CYS B 59 23.274 5.274 5.493 1.00 0.00 C ATOM 2911 SG CYS B 59 23.505 6.368 6.915 1.00 0.00 S ATOM 0 H CYS B 59 20.666 4.392 7.094 1.00 0.00 H new ATOM 0 HA CYS B 59 22.027 3.682 4.762 1.00 0.00 H new ATOM 0 HB2 CYS B 59 24.229 4.808 5.247 1.00 0.00 H new ATOM 0 HB3 CYS B 59 22.980 5.873 4.631 1.00 0.00 H new ATOM 0 HG CYS B 59 24.408 7.260 6.634 1.00 0.00 H new ATOM 2917 N GLY B 60 23.610 2.242 6.193 1.00 0.00 N ATOM 2918 CA GLY B 60 24.177 1.210 7.039 1.00 0.00 C ATOM 2919 C GLY B 60 25.041 0.232 6.266 1.00 0.00 C ATOM 2920 O GLY B 60 24.985 0.180 5.037 1.00 0.00 O ATOM 0 H GLY B 60 23.911 2.212 5.219 1.00 0.00 H new ATOM 0 HA2 GLY B 60 24.774 1.676 7.823 1.00 0.00 H new ATOM 0 HA3 GLY B 60 23.371 0.666 7.532 1.00 0.00 H new ATOM 2924 N VAL B 61 25.842 -0.545 6.989 1.00 0.00 N ATOM 2925 CA VAL B 61 26.722 -1.526 6.368 1.00 0.00 C ATOM 2926 C VAL B 61 26.125 -2.927 6.448 1.00 0.00 C ATOM 2927 O VAL B 61 25.912 -3.461 7.537 1.00 0.00 O ATOM 2928 CB VAL B 61 28.111 -1.536 7.033 1.00 0.00 C ATOM 2929 CG1 VAL B 61 29.091 -2.363 6.213 1.00 0.00 C ATOM 2930 CG2 VAL B 61 28.625 -0.116 7.218 1.00 0.00 C ATOM 0 H VAL B 61 25.899 -0.513 8.007 1.00 0.00 H new ATOM 0 HA VAL B 61 26.829 -1.237 5.323 1.00 0.00 H new ATOM 0 HB VAL B 61 28.019 -1.996 8.017 1.00 0.00 H new ATOM 0 HG11 VAL B 61 30.067 -2.358 6.699 1.00 0.00 H new ATOM 0 HG12 VAL B 61 28.728 -3.388 6.138 1.00 0.00 H new ATOM 0 HG13 VAL B 61 29.181 -1.936 5.214 1.00 0.00 H new ATOM 0 HG21 VAL B 61 29.607 -0.143 7.689 1.00 0.00 H new ATOM 0 HG22 VAL B 61 28.702 0.373 6.247 1.00 0.00 H new ATOM 0 HG23 VAL B 61 27.934 0.441 7.851 1.00 0.00 H new ATOM 2940 N LEU B 62 25.854 -3.516 5.288 1.00 0.00 N ATOM 2941 CA LEU B 62 25.280 -4.855 5.228 1.00 0.00 C ATOM 2942 C LEU B 62 26.374 -5.914 5.171 1.00 0.00 C ATOM 2943 O LEU B 62 27.521 -5.620 4.832 1.00 0.00 O ATOM 2944 CB LEU B 62 24.365 -4.985 4.008 1.00 0.00 C ATOM 2945 CG LEU B 62 23.055 -5.730 4.260 1.00 0.00 C ATOM 2946 CD1 LEU B 62 22.249 -5.040 5.351 1.00 0.00 C ATOM 2947 CD2 LEU B 62 22.244 -5.830 2.977 1.00 0.00 C ATOM 0 H LEU B 62 26.022 -3.088 4.378 1.00 0.00 H new ATOM 0 HA LEU B 62 24.694 -5.013 6.133 1.00 0.00 H new ATOM 0 HB2 LEU B 62 24.132 -3.986 3.639 1.00 0.00 H new ATOM 0 HB3 LEU B 62 24.911 -5.498 3.216 1.00 0.00 H new ATOM 0 HG LEU B 62 23.292 -6.739 4.596 1.00 0.00 H new ATOM 0 HD11 LEU B 62 21.320 -5.585 5.516 1.00 0.00 H new ATOM 0 HD12 LEU B 62 22.828 -5.021 6.274 1.00 0.00 H new ATOM 0 HD13 LEU B 62 22.021 -4.019 5.045 1.00 0.00 H new ATOM 0 HD21 LEU B 62 21.314 -6.364 3.175 1.00 0.00 H new ATOM 0 HD22 LEU B 62 22.017 -4.829 2.611 1.00 0.00 H new ATOM 0 HD23 LEU B 62 22.819 -6.370 2.224 1.00 0.00 H new ATOM 2959 N ASP B 63 26.013 -7.150 5.504 1.00 0.00 N ATOM 2960 CA ASP B 63 26.964 -8.254 5.490 1.00 0.00 C ATOM 2961 C ASP B 63 26.651 -9.225 4.354 1.00 0.00 C ATOM 2962 O ASP B 63 25.688 -9.034 3.611 1.00 0.00 O ATOM 2963 CB ASP B 63 26.944 -8.990 6.830 1.00 0.00 C ATOM 2964 CG ASP B 63 28.274 -8.909 7.555 1.00 0.00 C ATOM 2965 OD1 ASP B 63 28.814 -7.790 7.682 1.00 0.00 O ATOM 2966 OD2 ASP B 63 28.775 -9.965 7.995 1.00 0.00 O ATOM 0 H ASP B 63 25.068 -7.411 5.787 1.00 0.00 H new ATOM 0 HA ASP B 63 27.960 -7.842 5.328 1.00 0.00 H new ATOM 0 HB2 ASP B 63 26.163 -8.567 7.462 1.00 0.00 H new ATOM 0 HB3 ASP B 63 26.688 -10.036 6.663 1.00 0.00 H new ATOM 2971 N PRO B 64 27.470 -10.280 4.198 1.00 0.00 N ATOM 2972 CA PRO B 64 27.281 -11.279 3.140 1.00 0.00 C ATOM 2973 C PRO B 64 25.989 -12.074 3.307 1.00 0.00 C ATOM 2974 O PRO B 64 25.890 -12.943 4.173 1.00 0.00 O ATOM 2975 CB PRO B 64 28.496 -12.208 3.289 1.00 0.00 C ATOM 2976 CG PRO B 64 29.469 -11.457 4.134 1.00 0.00 C ATOM 2977 CD PRO B 64 28.645 -10.579 5.029 1.00 0.00 C ATOM 0 HA PRO B 64 27.204 -10.809 2.160 1.00 0.00 H new ATOM 0 HB2 PRO B 64 28.214 -13.151 3.758 1.00 0.00 H new ATOM 0 HB3 PRO B 64 28.926 -12.451 2.317 1.00 0.00 H new ATOM 0 HG2 PRO B 64 30.087 -12.139 4.718 1.00 0.00 H new ATOM 0 HG3 PRO B 64 30.144 -10.863 3.518 1.00 0.00 H new ATOM 0 HD2 PRO B 64 28.369 -11.088 5.952 1.00 0.00 H new ATOM 0 HD3 PRO B 64 29.181 -9.673 5.313 1.00 0.00 H new ATOM 2985 N LYS B 65 25.002 -11.776 2.466 1.00 0.00 N ATOM 2986 CA LYS B 65 23.717 -12.470 2.513 1.00 0.00 C ATOM 2987 C LYS B 65 22.909 -12.061 3.741 1.00 0.00 C ATOM 2988 O LYS B 65 22.023 -12.794 4.182 1.00 0.00 O ATOM 2989 CB LYS B 65 23.931 -13.986 2.511 1.00 0.00 C ATOM 2990 CG LYS B 65 23.208 -14.701 1.383 1.00 0.00 C ATOM 2991 CD LYS B 65 23.384 -16.209 1.476 1.00 0.00 C ATOM 2992 CE LYS B 65 22.717 -16.922 0.311 1.00 0.00 C ATOM 2993 NZ LYS B 65 22.526 -18.373 0.583 1.00 0.00 N ATOM 0 H LYS B 65 25.067 -11.059 1.744 1.00 0.00 H new ATOM 0 HA LYS B 65 23.153 -12.185 1.625 1.00 0.00 H new ATOM 0 HB2 LYS B 65 24.998 -14.194 2.436 1.00 0.00 H new ATOM 0 HB3 LYS B 65 23.593 -14.393 3.464 1.00 0.00 H new ATOM 0 HG2 LYS B 65 22.147 -14.455 1.416 1.00 0.00 H new ATOM 0 HG3 LYS B 65 23.588 -14.348 0.424 1.00 0.00 H new ATOM 0 HD2 LYS B 65 24.446 -16.452 1.492 1.00 0.00 H new ATOM 0 HD3 LYS B 65 22.961 -16.568 2.414 1.00 0.00 H new ATOM 0 HE2 LYS B 65 21.751 -16.460 0.108 1.00 0.00 H new ATOM 0 HE3 LYS B 65 23.324 -16.798 -0.586 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 22.068 -18.822 -0.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 23.450 -18.819 0.751 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 21.926 -18.493 1.424 1.00 0.00 H new ATOM 3007 N GLU B 66 23.214 -10.889 4.288 1.00 0.00 N ATOM 3008 CA GLU B 66 22.507 -10.391 5.462 1.00 0.00 C ATOM 3009 C GLU B 66 21.253 -9.624 5.053 1.00 0.00 C ATOM 3010 O GLU B 66 21.202 -9.026 3.979 1.00 0.00 O ATOM 3011 CB GLU B 66 23.422 -9.494 6.296 1.00 0.00 C ATOM 3012 CG GLU B 66 23.774 -10.084 7.652 1.00 0.00 C ATOM 3013 CD GLU B 66 22.906 -9.539 8.769 1.00 0.00 C ATOM 3014 OE1 GLU B 66 22.230 -8.513 8.549 1.00 0.00 O ATOM 3015 OE2 GLU B 66 22.903 -10.139 9.864 1.00 0.00 O ATOM 0 H GLU B 66 23.944 -10.268 3.938 1.00 0.00 H new ATOM 0 HA GLU B 66 22.208 -11.247 6.066 1.00 0.00 H new ATOM 0 HB2 GLU B 66 24.341 -9.307 5.740 1.00 0.00 H new ATOM 0 HB3 GLU B 66 22.937 -8.529 6.443 1.00 0.00 H new ATOM 0 HG2 GLU B 66 23.668 -11.168 7.611 1.00 0.00 H new ATOM 0 HG3 GLU B 66 24.820 -9.874 7.875 1.00 0.00 H new ATOM 3022 N LYS B 67 20.241 -9.649 5.914 1.00 0.00 N ATOM 3023 CA LYS B 67 18.987 -8.958 5.637 1.00 0.00 C ATOM 3024 C LYS B 67 18.733 -7.851 6.655 1.00 0.00 C ATOM 3025 O LYS B 67 18.850 -8.063 7.862 1.00 0.00 O ATOM 3026 CB LYS B 67 17.822 -9.950 5.645 1.00 0.00 C ATOM 3027 CG LYS B 67 17.848 -10.928 4.482 1.00 0.00 C ATOM 3028 CD LYS B 67 18.242 -12.323 4.938 1.00 0.00 C ATOM 3029 CE LYS B 67 18.742 -13.167 3.778 1.00 0.00 C ATOM 3030 NZ LYS B 67 18.907 -14.597 4.162 1.00 0.00 N ATOM 0 H LYS B 67 20.265 -10.139 6.808 1.00 0.00 H new ATOM 0 HA LYS B 67 19.065 -8.504 4.649 1.00 0.00 H new ATOM 0 HB2 LYS B 67 17.839 -10.510 6.580 1.00 0.00 H new ATOM 0 HB3 LYS B 67 16.884 -9.396 5.622 1.00 0.00 H new ATOM 0 HG2 LYS B 67 16.866 -10.962 4.011 1.00 0.00 H new ATOM 0 HG3 LYS B 67 18.552 -10.578 3.727 1.00 0.00 H new ATOM 0 HD2 LYS B 67 19.019 -12.252 5.699 1.00 0.00 H new ATOM 0 HD3 LYS B 67 17.385 -12.811 5.402 1.00 0.00 H new ATOM 0 HE2 LYS B 67 18.041 -13.093 2.947 1.00 0.00 H new ATOM 0 HE3 LYS B 67 19.696 -12.773 3.427 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 19.250 -15.139 3.343 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 19.595 -14.671 4.938 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 17.992 -14.981 4.473 1.00 0.00 H new ATOM 3044 N VAL B 68 18.379 -6.671 6.156 1.00 0.00 N ATOM 3045 CA VAL B 68 18.102 -5.528 7.016 1.00 0.00 C ATOM 3046 C VAL B 68 16.704 -4.978 6.757 1.00 0.00 C ATOM 3047 O VAL B 68 16.232 -4.965 5.619 1.00 0.00 O ATOM 3048 CB VAL B 68 19.132 -4.403 6.805 1.00 0.00 C ATOM 3049 CG1 VAL B 68 19.111 -3.923 5.362 1.00 0.00 C ATOM 3050 CG2 VAL B 68 18.867 -3.249 7.761 1.00 0.00 C ATOM 0 H VAL B 68 18.277 -6.482 5.159 1.00 0.00 H new ATOM 0 HA VAL B 68 18.169 -5.880 8.045 1.00 0.00 H new ATOM 0 HB VAL B 68 20.124 -4.801 7.018 1.00 0.00 H new ATOM 0 HG11 VAL B 68 19.845 -3.128 5.232 1.00 0.00 H new ATOM 0 HG12 VAL B 68 19.354 -4.753 4.699 1.00 0.00 H new ATOM 0 HG13 VAL B 68 18.119 -3.543 5.119 1.00 0.00 H new ATOM 0 HG21 VAL B 68 19.605 -2.464 7.597 1.00 0.00 H new ATOM 0 HG22 VAL B 68 17.868 -2.851 7.583 1.00 0.00 H new ATOM 0 HG23 VAL B 68 18.938 -3.604 8.789 1.00 0.00 H new ATOM 3060 N LEU B 69 16.044 -4.526 7.818 1.00 0.00 N ATOM 3061 CA LEU B 69 14.698 -3.977 7.703 1.00 0.00 C ATOM 3062 C LEU B 69 14.691 -2.481 7.996 1.00 0.00 C ATOM 3063 O LEU B 69 15.158 -2.040 9.047 1.00 0.00 O ATOM 3064 CB LEU B 69 13.746 -4.699 8.658 1.00 0.00 C ATOM 3065 CG LEU B 69 12.272 -4.315 8.518 1.00 0.00 C ATOM 3066 CD1 LEU B 69 11.737 -4.738 7.158 1.00 0.00 C ATOM 3067 CD2 LEU B 69 11.449 -4.941 9.634 1.00 0.00 C ATOM 0 H LEU B 69 16.419 -4.529 8.767 1.00 0.00 H new ATOM 0 HA LEU B 69 14.359 -4.129 6.678 1.00 0.00 H new ATOM 0 HB2 LEU B 69 13.842 -5.773 8.499 1.00 0.00 H new ATOM 0 HB3 LEU B 69 14.062 -4.499 9.682 1.00 0.00 H new ATOM 0 HG LEU B 69 12.190 -3.231 8.597 1.00 0.00 H new ATOM 0 HD11 LEU B 69 10.687 -4.457 7.076 1.00 0.00 H new ATOM 0 HD12 LEU B 69 12.307 -4.242 6.372 1.00 0.00 H new ATOM 0 HD13 LEU B 69 11.833 -5.818 7.049 1.00 0.00 H new ATOM 0 HD21 LEU B 69 10.403 -4.657 9.518 1.00 0.00 H new ATOM 0 HD22 LEU B 69 11.538 -6.026 9.587 1.00 0.00 H new ATOM 0 HD23 LEU B 69 11.816 -4.589 10.598 1.00 0.00 H new ATOM 3079 N MET B 70 14.153 -1.705 7.061 1.00 0.00 N ATOM 3080 CA MET B 70 14.077 -0.258 7.215 1.00 0.00 C ATOM 3081 C MET B 70 12.637 0.220 7.115 1.00 0.00 C ATOM 3082 O MET B 70 11.743 -0.533 6.729 1.00 0.00 O ATOM 3083 CB MET B 70 14.939 0.436 6.162 1.00 0.00 C ATOM 3084 CG MET B 70 14.400 0.298 4.750 1.00 0.00 C ATOM 3085 SD MET B 70 15.458 1.087 3.525 1.00 0.00 S ATOM 3086 CE MET B 70 14.419 0.967 2.074 1.00 0.00 C ATOM 0 H MET B 70 13.762 -2.056 6.187 1.00 0.00 H new ATOM 0 HA MET B 70 14.457 -0.000 8.204 1.00 0.00 H new ATOM 0 HB2 MET B 70 15.019 1.494 6.410 1.00 0.00 H new ATOM 0 HB3 MET B 70 15.947 0.023 6.199 1.00 0.00 H new ATOM 0 HG2 MET B 70 14.295 -0.759 4.507 1.00 0.00 H new ATOM 0 HG3 MET B 70 13.404 0.737 4.701 1.00 0.00 H new ATOM 0 HE1 MET B 70 14.788 1.646 1.305 1.00 0.00 H new ATOM 0 HE2 MET B 70 14.439 -0.055 1.696 1.00 0.00 H new ATOM 0 HE3 MET B 70 13.396 1.237 2.336 1.00 0.00 H new ATOM 3096 N ALA B 71 12.424 1.474 7.477 1.00 0.00 N ATOM 3097 CA ALA B 71 11.092 2.066 7.446 1.00 0.00 C ATOM 3098 C ALA B 71 11.070 3.364 6.647 1.00 0.00 C ATOM 3099 O ALA B 71 11.967 4.198 6.775 1.00 0.00 O ATOM 3100 CB ALA B 71 10.602 2.315 8.864 1.00 0.00 C ATOM 0 H ALA B 71 13.158 2.106 7.797 1.00 0.00 H new ATOM 0 HA ALA B 71 10.425 1.362 6.949 1.00 0.00 H new ATOM 0 HB1 ALA B 71 9.606 2.757 8.832 1.00 0.00 H new ATOM 0 HB2 ALA B 71 10.562 1.370 9.406 1.00 0.00 H new ATOM 0 HB3 ALA B 71 11.286 2.996 9.371 1.00 0.00 H new ATOM 3106 N VAL B 72 10.033 3.534 5.833 1.00 0.00 N ATOM 3107 CA VAL B 72 9.884 4.736 5.023 1.00 0.00 C ATOM 3108 C VAL B 72 8.647 5.522 5.446 1.00 0.00 C ATOM 3109 O VAL B 72 7.532 5.225 5.017 1.00 0.00 O ATOM 3110 CB VAL B 72 9.781 4.399 3.524 1.00 0.00 C ATOM 3111 CG1 VAL B 72 8.578 3.510 3.255 1.00 0.00 C ATOM 3112 CG2 VAL B 72 9.710 5.672 2.694 1.00 0.00 C ATOM 0 H VAL B 72 9.283 2.853 5.717 1.00 0.00 H new ATOM 0 HA VAL B 72 10.775 5.343 5.184 1.00 0.00 H new ATOM 0 HB VAL B 72 10.678 3.852 3.232 1.00 0.00 H new ATOM 0 HG11 VAL B 72 8.524 3.284 2.190 1.00 0.00 H new ATOM 0 HG12 VAL B 72 8.678 2.582 3.818 1.00 0.00 H new ATOM 0 HG13 VAL B 72 7.668 4.026 3.563 1.00 0.00 H new ATOM 0 HG21 VAL B 72 9.638 5.414 1.637 1.00 0.00 H new ATOM 0 HG22 VAL B 72 8.833 6.249 2.987 1.00 0.00 H new ATOM 0 HG23 VAL B 72 10.608 6.266 2.862 1.00 0.00 H new ATOM 3122 N SER B 73 8.851 6.520 6.299 1.00 0.00 N ATOM 3123 CA SER B 73 7.752 7.344 6.791 1.00 0.00 C ATOM 3124 C SER B 73 7.115 8.148 5.662 1.00 0.00 C ATOM 3125 O SER B 73 7.799 8.604 4.746 1.00 0.00 O ATOM 3126 CB SER B 73 8.249 8.289 7.885 1.00 0.00 C ATOM 3127 OG SER B 73 7.549 8.078 9.099 1.00 0.00 O ATOM 0 H SER B 73 9.768 6.778 6.664 1.00 0.00 H new ATOM 0 HA SER B 73 6.995 6.679 7.206 1.00 0.00 H new ATOM 0 HB2 SER B 73 9.316 8.135 8.046 1.00 0.00 H new ATOM 0 HB3 SER B 73 8.121 9.322 7.563 1.00 0.00 H new ATOM 0 HG SER B 73 7.887 8.693 9.783 1.00 0.00 H new ATOM 3133 N CYS B 74 5.798 8.319 5.739 1.00 0.00 N ATOM 3134 CA CYS B 74 5.061 9.071 4.730 1.00 0.00 C ATOM 3135 C CYS B 74 4.006 9.959 5.382 1.00 0.00 C ATOM 3136 O CYS B 74 2.831 9.599 5.449 1.00 0.00 O ATOM 3137 CB CYS B 74 4.398 8.116 3.735 1.00 0.00 C ATOM 3138 SG CYS B 74 3.909 8.895 2.179 1.00 0.00 S ATOM 0 H CYS B 74 5.219 7.946 6.491 1.00 0.00 H new ATOM 0 HA CYS B 74 5.767 9.706 4.195 1.00 0.00 H new ATOM 0 HB2 CYS B 74 5.086 7.298 3.519 1.00 0.00 H new ATOM 0 HB3 CYS B 74 3.516 7.676 4.202 1.00 0.00 H new ATOM 0 HG CYS B 74 3.790 7.986 1.257 1.00 0.00 H new ATOM 3144 N ASP B 75 4.437 11.120 5.862 1.00 0.00 N ATOM 3145 CA ASP B 75 3.533 12.062 6.513 1.00 0.00 C ATOM 3146 C ASP B 75 2.314 12.346 5.641 1.00 0.00 C ATOM 3147 O ASP B 75 2.375 12.237 4.416 1.00 0.00 O ATOM 3148 CB ASP B 75 4.264 13.368 6.827 1.00 0.00 C ATOM 3149 CG ASP B 75 5.434 13.162 7.768 1.00 0.00 C ATOM 3150 OD1 ASP B 75 5.988 12.043 7.791 1.00 0.00 O ATOM 3151 OD2 ASP B 75 5.797 14.120 8.482 1.00 0.00 O ATOM 0 H ASP B 75 5.407 11.432 5.813 1.00 0.00 H new ATOM 0 HA ASP B 75 3.191 11.610 7.444 1.00 0.00 H new ATOM 0 HB2 ASP B 75 4.622 13.814 5.899 1.00 0.00 H new ATOM 0 HB3 ASP B 75 3.564 14.076 7.271 1.00 0.00 H new ATOM 3156 N THR B 76 1.207 12.710 6.282 1.00 0.00 N ATOM 3157 CA THR B 76 -0.027 13.010 5.569 1.00 0.00 C ATOM 3158 C THR B 76 0.136 14.254 4.701 1.00 0.00 C ATOM 3159 O THR B 76 0.474 15.329 5.197 1.00 0.00 O ATOM 3160 CB THR B 76 -1.173 13.212 6.558 1.00 0.00 C ATOM 3161 OG1 THR B 76 -1.191 14.544 7.044 1.00 0.00 O ATOM 3162 CG2 THR B 76 -1.106 12.288 7.755 1.00 0.00 C ATOM 0 H THR B 76 1.141 12.804 7.296 1.00 0.00 H new ATOM 0 HA THR B 76 -0.259 12.165 4.921 1.00 0.00 H new ATOM 0 HB THR B 76 -2.078 12.984 5.995 1.00 0.00 H new ATOM 0 HG1 THR B 76 -0.397 15.020 6.723 1.00 0.00 H new ATOM 0 HG21 THR B 76 -1.950 12.486 8.415 1.00 0.00 H new ATOM 0 HG22 THR B 76 -1.145 11.252 7.418 1.00 0.00 H new ATOM 0 HG23 THR B 76 -0.175 12.459 8.295 1.00 0.00 H new ATOM 3170 N PHE B 77 -0.107 14.101 3.404 1.00 0.00 N ATOM 3171 CA PHE B 77 0.013 15.212 2.467 1.00 0.00 C ATOM 3172 C PHE B 77 -1.223 15.311 1.581 1.00 0.00 C ATOM 3173 O PHE B 77 -2.150 14.508 1.697 1.00 0.00 O ATOM 3174 CB PHE B 77 1.264 15.046 1.603 1.00 0.00 C ATOM 3175 CG PHE B 77 1.157 13.935 0.597 1.00 0.00 C ATOM 3176 CD1 PHE B 77 1.126 12.612 1.009 1.00 0.00 C ATOM 3177 CD2 PHE B 77 1.088 14.213 -0.759 1.00 0.00 C ATOM 3178 CE1 PHE B 77 1.027 11.588 0.087 1.00 0.00 C ATOM 3179 CE2 PHE B 77 0.989 13.193 -1.686 1.00 0.00 C ATOM 3180 CZ PHE B 77 0.958 11.879 -1.262 1.00 0.00 C ATOM 0 H PHE B 77 -0.388 13.218 2.977 1.00 0.00 H new ATOM 0 HA PHE B 77 0.099 16.133 3.043 1.00 0.00 H new ATOM 0 HB2 PHE B 77 1.460 15.982 1.079 1.00 0.00 H new ATOM 0 HB3 PHE B 77 2.120 14.857 2.251 1.00 0.00 H new ATOM 0 HD1 PHE B 77 1.180 12.379 2.062 1.00 0.00 H new ATOM 0 HD2 PHE B 77 1.112 15.239 -1.095 1.00 0.00 H new ATOM 0 HE1 PHE B 77 1.004 10.561 0.420 1.00 0.00 H new ATOM 0 HE2 PHE B 77 0.936 13.423 -2.740 1.00 0.00 H new ATOM 0 HZ PHE B 77 0.880 11.080 -1.984 1.00 0.00 H new ATOM 3190 N ASN B 78 -1.232 16.302 0.695 1.00 0.00 N ATOM 3191 CA ASN B 78 -2.356 16.506 -0.212 1.00 0.00 C ATOM 3192 C ASN B 78 -1.944 16.235 -1.656 1.00 0.00 C ATOM 3193 O ASN B 78 -0.961 16.789 -2.145 1.00 0.00 O ATOM 3194 CB ASN B 78 -2.893 17.932 -0.081 1.00 0.00 C ATOM 3195 CG ASN B 78 -4.109 18.011 0.820 1.00 0.00 C ATOM 3196 OD1 ASN B 78 -5.244 17.870 0.366 1.00 0.00 O ATOM 3197 ND2 ASN B 78 -3.876 18.237 2.108 1.00 0.00 N ATOM 0 H ASN B 78 -0.474 16.976 0.586 1.00 0.00 H new ATOM 0 HA ASN B 78 -3.144 15.804 0.061 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -2.109 18.578 0.314 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -3.151 18.312 -1.069 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -4.655 18.300 2.764 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -2.918 18.348 2.441 1.00 0.00 H new ATOM 3204 N ALA B 79 -2.703 15.377 -2.331 1.00 0.00 N ATOM 3205 CA ALA B 79 -2.416 15.033 -3.718 1.00 0.00 C ATOM 3206 C ALA B 79 -3.142 15.961 -4.689 1.00 0.00 C ATOM 3207 O ALA B 79 -3.294 15.641 -5.868 1.00 0.00 O ATOM 3208 CB ALA B 79 -2.799 13.587 -3.989 1.00 0.00 C ATOM 0 H ALA B 79 -3.520 14.908 -1.940 1.00 0.00 H new ATOM 0 HA ALA B 79 -1.345 15.157 -3.877 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -2.580 13.341 -5.028 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -2.228 12.930 -3.333 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -3.864 13.451 -3.801 1.00 0.00 H new ATOM 3214 N ALA B 80 -3.588 17.111 -4.191 1.00 0.00 N ATOM 3215 CA ALA B 80 -4.295 18.077 -5.021 1.00 0.00 C ATOM 3216 C ALA B 80 -3.356 19.173 -5.508 1.00 0.00 C ATOM 3217 O ALA B 80 -3.558 19.750 -6.576 1.00 0.00 O ATOM 3218 CB ALA B 80 -5.453 18.690 -4.248 1.00 0.00 C ATOM 0 H ALA B 80 -3.472 17.395 -3.218 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.686 17.550 -5.891 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -5.972 19.410 -4.881 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -6.146 17.904 -3.948 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -5.071 19.196 -3.361 1.00 0.00 H new ATOM 3224 N THR B 81 -2.330 19.461 -4.714 1.00 0.00 N ATOM 3225 CA THR B 81 -1.365 20.493 -5.061 1.00 0.00 C ATOM 3226 C THR B 81 0.061 20.026 -4.790 1.00 0.00 C ATOM 3227 O THR B 81 0.882 20.777 -4.264 1.00 0.00 O ATOM 3228 CB THR B 81 -1.659 21.767 -4.273 1.00 0.00 C ATOM 3229 OG1 THR B 81 -1.597 21.521 -2.878 1.00 0.00 O ATOM 3230 CG2 THR B 81 -3.023 22.343 -4.578 1.00 0.00 C ATOM 0 H THR B 81 -2.147 18.993 -3.826 1.00 0.00 H new ATOM 0 HA THR B 81 -1.456 20.700 -6.127 1.00 0.00 H new ATOM 0 HB THR B 81 -0.897 22.484 -4.577 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.787 22.350 -2.391 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.176 23.247 -3.989 1.00 0.00 H new ATOM 0 HG22 THR B 81 -3.087 22.586 -5.639 1.00 0.00 H new ATOM 0 HG23 THR B 81 -3.791 21.612 -4.327 1.00 0.00 H new ATOM 3238 N GLU B 82 0.349 18.781 -5.152 1.00 0.00 N ATOM 3239 CA GLU B 82 1.676 18.212 -4.949 1.00 0.00 C ATOM 3240 C GLU B 82 2.057 17.298 -6.110 1.00 0.00 C ATOM 3241 O GLU B 82 1.263 16.462 -6.540 1.00 0.00 O ATOM 3242 CB GLU B 82 1.724 17.432 -3.634 1.00 0.00 C ATOM 3243 CG GLU B 82 1.860 18.320 -2.408 1.00 0.00 C ATOM 3244 CD GLU B 82 3.238 18.942 -2.289 1.00 0.00 C ATOM 3245 OE1 GLU B 82 4.095 18.654 -3.149 1.00 0.00 O ATOM 3246 OE2 GLU B 82 3.458 19.716 -1.334 1.00 0.00 O ATOM 0 H GLU B 82 -0.319 18.146 -5.588 1.00 0.00 H new ATOM 0 HA GLU B 82 2.393 19.031 -4.903 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.817 16.835 -3.542 1.00 0.00 H new ATOM 0 HB3 GLU B 82 2.562 16.736 -3.664 1.00 0.00 H new ATOM 0 HG2 GLU B 82 1.111 19.111 -2.452 1.00 0.00 H new ATOM 0 HG3 GLU B 82 1.652 17.733 -1.514 1.00 0.00 H new ATOM 3253 N ASP B 83 3.276 17.466 -6.611 1.00 0.00 N ATOM 3254 CA ASP B 83 3.762 16.656 -7.722 1.00 0.00 C ATOM 3255 C ASP B 83 3.596 15.169 -7.428 1.00 0.00 C ATOM 3256 O ASP B 83 3.922 14.702 -6.336 1.00 0.00 O ATOM 3257 CB ASP B 83 5.233 16.971 -8.005 1.00 0.00 C ATOM 3258 CG ASP B 83 6.056 17.077 -6.736 1.00 0.00 C ATOM 3259 OD1 ASP B 83 5.817 16.281 -5.804 1.00 0.00 O ATOM 3260 OD2 ASP B 83 6.940 17.958 -6.675 1.00 0.00 O ATOM 0 H ASP B 83 3.945 18.155 -6.266 1.00 0.00 H new ATOM 0 HA ASP B 83 3.168 16.901 -8.603 1.00 0.00 H new ATOM 0 HB2 ASP B 83 5.652 16.193 -8.643 1.00 0.00 H new ATOM 0 HB3 ASP B 83 5.301 17.908 -8.558 1.00 0.00 H new ATOM 3265 N LEU B 84 3.088 14.431 -8.408 1.00 0.00 N ATOM 3266 CA LEU B 84 2.880 12.995 -8.256 1.00 0.00 C ATOM 3267 C LEU B 84 3.643 12.214 -9.323 1.00 0.00 C ATOM 3268 O LEU B 84 3.313 11.065 -9.618 1.00 0.00 O ATOM 3269 CB LEU B 84 1.391 12.663 -8.339 1.00 0.00 C ATOM 3270 CG LEU B 84 0.505 13.397 -7.331 1.00 0.00 C ATOM 3271 CD1 LEU B 84 -0.942 13.404 -7.799 1.00 0.00 C ATOM 3272 CD2 LEU B 84 0.620 12.755 -5.958 1.00 0.00 C ATOM 0 H LEU B 84 2.812 14.803 -9.317 1.00 0.00 H new ATOM 0 HA LEU B 84 3.259 12.703 -7.277 1.00 0.00 H new ATOM 0 HB2 LEU B 84 1.039 12.894 -9.344 1.00 0.00 H new ATOM 0 HB3 LEU B 84 1.265 11.590 -8.196 1.00 0.00 H new ATOM 0 HG LEU B 84 0.846 14.430 -7.258 1.00 0.00 H new ATOM 0 HD11 LEU B 84 -1.558 13.930 -7.070 1.00 0.00 H new ATOM 0 HD12 LEU B 84 -1.010 13.908 -8.763 1.00 0.00 H new ATOM 0 HD13 LEU B 84 -1.297 12.378 -7.900 1.00 0.00 H new ATOM 0 HD21 LEU B 84 -0.016 13.289 -5.252 1.00 0.00 H new ATOM 0 HD22 LEU B 84 0.304 11.713 -6.016 1.00 0.00 H new ATOM 0 HD23 LEU B 84 1.655 12.802 -5.620 1.00 0.00 H new ATOM 3284 N ASN B 85 4.665 12.841 -9.897 1.00 0.00 N ATOM 3285 CA ASN B 85 5.473 12.201 -10.926 1.00 0.00 C ATOM 3286 C ASN B 85 6.937 12.613 -10.803 1.00 0.00 C ATOM 3287 O ASN B 85 7.700 12.522 -11.766 1.00 0.00 O ATOM 3288 CB ASN B 85 4.944 12.561 -12.316 1.00 0.00 C ATOM 3289 CG ASN B 85 5.381 11.567 -13.375 1.00 0.00 C ATOM 3290 OD1 ASN B 85 5.861 10.477 -13.061 1.00 0.00 O ATOM 3291 ND2 ASN B 85 5.218 11.939 -14.639 1.00 0.00 N ATOM 0 H ASN B 85 4.952 13.792 -9.666 1.00 0.00 H new ATOM 0 HA ASN B 85 5.406 11.122 -10.787 1.00 0.00 H new ATOM 0 HB2 ASN B 85 3.855 12.603 -12.288 1.00 0.00 H new ATOM 0 HB3 ASN B 85 5.294 13.556 -12.589 1.00 0.00 H new ATOM 0 HD21 ASN B 85 5.495 11.312 -15.395 1.00 0.00 H new ATOM 0 HD22 ASN B 85 4.816 12.851 -14.854 1.00 0.00 H new ATOM 3298 N ASN B 86 7.325 13.066 -9.614 1.00 0.00 N ATOM 3299 CA ASN B 86 8.699 13.491 -9.371 1.00 0.00 C ATOM 3300 C ASN B 86 9.259 12.888 -8.080 1.00 0.00 C ATOM 3301 O ASN B 86 10.383 13.197 -7.685 1.00 0.00 O ATOM 3302 CB ASN B 86 8.774 15.017 -9.304 1.00 0.00 C ATOM 3303 CG ASN B 86 8.648 15.661 -10.671 1.00 0.00 C ATOM 3304 OD1 ASN B 86 7.455 15.594 -11.250 1.00 0.00 O flip ATOM 3305 ND2 ASN B 86 9.614 16.212 -11.202 1.00 0.00 N flip ATOM 0 H ASN B 86 6.708 13.148 -8.806 1.00 0.00 H new ATOM 0 HA ASN B 86 9.306 13.131 -10.201 1.00 0.00 H new ATOM 0 HB2 ASN B 86 7.981 15.389 -8.655 1.00 0.00 H new ATOM 0 HB3 ASN B 86 9.721 15.312 -8.852 1.00 0.00 H new ATOM 0 HD21 ASN B 86 10.513 16.240 -10.721 1.00 0.00 H new ATOM 0 HD22 ASN B 86 9.515 16.640 -12.123 1.00 0.00 H new ATOM 3312 N ASP B 87 8.481 12.025 -7.427 1.00 0.00 N ATOM 3313 CA ASP B 87 8.921 11.391 -6.190 1.00 0.00 C ATOM 3314 C ASP B 87 9.496 10.007 -6.471 1.00 0.00 C ATOM 3315 O ASP B 87 8.801 9.129 -6.983 1.00 0.00 O ATOM 3316 CB ASP B 87 7.756 11.281 -5.204 1.00 0.00 C ATOM 3317 CG ASP B 87 7.251 12.638 -4.753 1.00 0.00 C ATOM 3318 OD1 ASP B 87 7.512 13.633 -5.461 1.00 0.00 O ATOM 3319 OD2 ASP B 87 6.596 12.704 -3.693 1.00 0.00 O ATOM 0 H ASP B 87 7.548 11.751 -7.734 1.00 0.00 H new ATOM 0 HA ASP B 87 9.701 12.011 -5.748 1.00 0.00 H new ATOM 0 HB2 ASP B 87 6.940 10.729 -5.670 1.00 0.00 H new ATOM 0 HB3 ASP B 87 8.073 10.707 -4.334 1.00 0.00 H new ATOM 3324 N ARG B 88 10.769 9.818 -6.139 1.00 0.00 N ATOM 3325 CA ARG B 88 11.429 8.538 -6.366 1.00 0.00 C ATOM 3326 C ARG B 88 12.579 8.328 -5.387 1.00 0.00 C ATOM 3327 O ARG B 88 13.405 9.219 -5.182 1.00 0.00 O ATOM 3328 CB ARG B 88 11.949 8.462 -7.801 1.00 0.00 C ATOM 3329 CG ARG B 88 12.809 9.650 -8.201 1.00 0.00 C ATOM 3330 CD ARG B 88 13.881 9.251 -9.203 1.00 0.00 C ATOM 3331 NE ARG B 88 13.343 8.422 -10.277 1.00 0.00 N ATOM 3332 CZ ARG B 88 14.039 8.066 -11.351 1.00 0.00 C ATOM 3333 NH1 ARG B 88 15.296 8.463 -11.492 1.00 0.00 N ATOM 3334 NH2 ARG B 88 13.478 7.311 -12.287 1.00 0.00 N ATOM 0 H ARG B 88 11.361 10.531 -5.714 1.00 0.00 H new ATOM 0 HA ARG B 88 10.695 7.748 -6.204 1.00 0.00 H new ATOM 0 HB2 ARG B 88 12.530 7.547 -7.920 1.00 0.00 H new ATOM 0 HB3 ARG B 88 11.101 8.392 -8.482 1.00 0.00 H new ATOM 0 HG2 ARG B 88 12.179 10.428 -8.632 1.00 0.00 H new ATOM 0 HG3 ARG B 88 13.279 10.075 -7.314 1.00 0.00 H new ATOM 0 HD2 ARG B 88 14.332 10.148 -9.628 1.00 0.00 H new ATOM 0 HD3 ARG B 88 14.674 8.708 -8.689 1.00 0.00 H new ATOM 0 HE ARG B 88 12.379 8.098 -10.199 1.00 0.00 H new ATOM 0 HH11 ARG B 88 15.731 9.043 -10.775 1.00 0.00 H new ATOM 0 HH12 ARG B 88 15.828 8.188 -12.318 1.00 0.00 H new ATOM 0 HH21 ARG B 88 12.511 7.003 -12.182 1.00 0.00 H new ATOM 0 HH22 ARG B 88 14.014 7.038 -13.111 1.00 0.00 H new ATOM 3348 N ILE B 89 12.631 7.141 -4.795 1.00 0.00 N ATOM 3349 CA ILE B 89 13.683 6.803 -3.846 1.00 0.00 C ATOM 3350 C ILE B 89 14.916 6.286 -4.577 1.00 0.00 C ATOM 3351 O ILE B 89 14.845 5.935 -5.754 1.00 0.00 O ATOM 3352 CB ILE B 89 13.208 5.740 -2.837 1.00 0.00 C ATOM 3353 CG1 ILE B 89 11.816 6.094 -2.310 1.00 0.00 C ATOM 3354 CG2 ILE B 89 14.198 5.615 -1.688 1.00 0.00 C ATOM 3355 CD1 ILE B 89 11.248 5.059 -1.363 1.00 0.00 C ATOM 0 H ILE B 89 11.955 6.395 -4.956 1.00 0.00 H new ATOM 0 HA ILE B 89 13.936 7.713 -3.302 1.00 0.00 H new ATOM 0 HB ILE B 89 13.152 4.778 -3.347 1.00 0.00 H new ATOM 0 HG12 ILE B 89 11.863 7.056 -1.799 1.00 0.00 H new ATOM 0 HG13 ILE B 89 11.137 6.215 -3.154 1.00 0.00 H new ATOM 0 HG21 ILE B 89 13.846 4.860 -0.985 1.00 0.00 H new ATOM 0 HG22 ILE B 89 15.173 5.322 -2.078 1.00 0.00 H new ATOM 0 HG23 ILE B 89 14.285 6.574 -1.177 1.00 0.00 H new ATOM 0 HD11 ILE B 89 10.260 5.375 -1.029 1.00 0.00 H new ATOM 0 HD12 ILE B 89 11.168 4.101 -1.876 1.00 0.00 H new ATOM 0 HD13 ILE B 89 11.906 4.955 -0.501 1.00 0.00 H new ATOM 3367 N THR B 90 16.049 6.245 -3.883 1.00 0.00 N ATOM 3368 CA THR B 90 17.287 5.771 -4.489 1.00 0.00 C ATOM 3369 C THR B 90 18.128 4.986 -3.489 1.00 0.00 C ATOM 3370 O THR B 90 18.509 5.503 -2.438 1.00 0.00 O ATOM 3371 CB THR B 90 18.094 6.951 -5.033 1.00 0.00 C ATOM 3372 OG1 THR B 90 17.238 8.021 -5.391 1.00 0.00 O ATOM 3373 CG2 THR B 90 18.922 6.598 -6.250 1.00 0.00 C ATOM 0 H THR B 90 16.135 6.532 -2.908 1.00 0.00 H new ATOM 0 HA THR B 90 17.023 5.104 -5.310 1.00 0.00 H new ATOM 0 HB THR B 90 18.768 7.238 -4.226 1.00 0.00 H new ATOM 0 HG1 THR B 90 17.773 8.767 -5.735 1.00 0.00 H new ATOM 0 HG21 THR B 90 19.470 7.479 -6.585 1.00 0.00 H new ATOM 0 HG22 THR B 90 19.628 5.808 -5.993 1.00 0.00 H new ATOM 0 HG23 THR B 90 18.266 6.253 -7.049 1.00 0.00 H new ATOM 3381 N ILE B 91 18.419 3.734 -3.827 1.00 0.00 N ATOM 3382 CA ILE B 91 19.223 2.873 -2.967 1.00 0.00 C ATOM 3383 C ILE B 91 20.608 2.654 -3.563 1.00 0.00 C ATOM 3384 O ILE B 91 20.814 1.738 -4.359 1.00 0.00 O ATOM 3385 CB ILE B 91 18.549 1.505 -2.752 1.00 0.00 C ATOM 3386 CG1 ILE B 91 17.099 1.690 -2.302 1.00 0.00 C ATOM 3387 CG2 ILE B 91 19.326 0.686 -1.733 1.00 0.00 C ATOM 3388 CD1 ILE B 91 16.110 1.718 -3.447 1.00 0.00 C ATOM 0 H ILE B 91 18.109 3.292 -4.693 1.00 0.00 H new ATOM 0 HA ILE B 91 19.314 3.378 -2.005 1.00 0.00 H new ATOM 0 HB ILE B 91 18.548 0.965 -3.699 1.00 0.00 H new ATOM 0 HG12 ILE B 91 16.832 0.881 -1.622 1.00 0.00 H new ATOM 0 HG13 ILE B 91 17.017 2.620 -1.739 1.00 0.00 H new ATOM 0 HG21 ILE B 91 18.837 -0.278 -1.592 1.00 0.00 H new ATOM 0 HG22 ILE B 91 20.343 0.528 -2.092 1.00 0.00 H new ATOM 0 HG23 ILE B 91 19.356 1.220 -0.783 1.00 0.00 H new ATOM 0 HD11 ILE B 91 15.102 1.852 -3.054 1.00 0.00 H new ATOM 0 HD12 ILE B 91 16.351 2.544 -4.116 1.00 0.00 H new ATOM 0 HD13 ILE B 91 16.163 0.778 -3.997 1.00 0.00 H new ATOM 3400 N GLU B 92 21.555 3.503 -3.177 1.00 0.00 N ATOM 3401 CA GLU B 92 22.921 3.402 -3.678 1.00 0.00 C ATOM 3402 C GLU B 92 23.825 2.705 -2.667 1.00 0.00 C ATOM 3403 O GLU B 92 23.952 3.147 -1.525 1.00 0.00 O ATOM 3404 CB GLU B 92 23.473 4.792 -3.998 1.00 0.00 C ATOM 3405 CG GLU B 92 22.501 5.670 -4.770 1.00 0.00 C ATOM 3406 CD GLU B 92 23.196 6.787 -5.524 1.00 0.00 C ATOM 3407 OE1 GLU B 92 24.443 6.839 -5.492 1.00 0.00 O ATOM 3408 OE2 GLU B 92 22.492 7.609 -6.148 1.00 0.00 O ATOM 0 H GLU B 92 21.402 4.268 -2.520 1.00 0.00 H new ATOM 0 HA GLU B 92 22.901 2.806 -4.590 1.00 0.00 H new ATOM 0 HB2 GLU B 92 23.739 5.291 -3.066 1.00 0.00 H new ATOM 0 HB3 GLU B 92 24.391 4.685 -4.576 1.00 0.00 H new ATOM 0 HG2 GLU B 92 21.942 5.054 -5.475 1.00 0.00 H new ATOM 0 HG3 GLU B 92 21.777 6.100 -4.078 1.00 0.00 H new ATOM 3415 N TRP B 93 24.453 1.613 -3.094 1.00 0.00 N ATOM 3416 CA TRP B 93 25.346 0.858 -2.223 1.00 0.00 C ATOM 3417 C TRP B 93 26.648 0.518 -2.943 1.00 0.00 C ATOM 3418 O TRP B 93 26.654 0.243 -4.142 1.00 0.00 O ATOM 3419 CB TRP B 93 24.662 -0.424 -1.734 1.00 0.00 C ATOM 3420 CG TRP B 93 24.548 -1.486 -2.786 1.00 0.00 C ATOM 3421 CD1 TRP B 93 25.235 -2.665 -2.838 1.00 0.00 C ATOM 3422 CD2 TRP B 93 23.698 -1.465 -3.939 1.00 0.00 C ATOM 3423 NE1 TRP B 93 24.864 -3.380 -3.950 1.00 0.00 N ATOM 3424 CE2 TRP B 93 23.921 -2.664 -4.643 1.00 0.00 C ATOM 3425 CE3 TRP B 93 22.770 -0.550 -4.444 1.00 0.00 C ATOM 3426 CZ2 TRP B 93 23.249 -2.970 -5.824 1.00 0.00 C ATOM 3427 CZ3 TRP B 93 22.103 -0.856 -5.616 1.00 0.00 C ATOM 3428 CH2 TRP B 93 22.345 -2.056 -6.294 1.00 0.00 C ATOM 0 H TRP B 93 24.360 1.233 -4.036 1.00 0.00 H new ATOM 0 HA TRP B 93 25.582 1.481 -1.360 1.00 0.00 H new ATOM 0 HB2 TRP B 93 25.220 -0.823 -0.887 1.00 0.00 H new ATOM 0 HB3 TRP B 93 23.665 -0.177 -1.370 1.00 0.00 H new ATOM 0 HD1 TRP B 93 25.964 -2.988 -2.110 1.00 0.00 H new ATOM 0 HE1 TRP B 93 25.230 -4.294 -4.217 1.00 0.00 H new ATOM 0 HE3 TRP B 93 22.577 0.379 -3.928 1.00 0.00 H new ATOM 0 HZ2 TRP B 93 23.434 -3.895 -6.350 1.00 0.00 H new ATOM 0 HZ3 TRP B 93 21.383 -0.157 -6.015 1.00 0.00 H new ATOM 0 HH2 TRP B 93 21.807 -2.265 -7.207 1.00 0.00 H new ATOM 3439 N THR B 94 27.750 0.538 -2.200 1.00 0.00 N ATOM 3440 CA THR B 94 29.057 0.229 -2.766 1.00 0.00 C ATOM 3441 C THR B 94 29.885 -0.601 -1.793 1.00 0.00 C ATOM 3442 O THR B 94 29.911 -0.327 -0.593 1.00 0.00 O ATOM 3443 CB THR B 94 29.803 1.518 -3.114 1.00 0.00 C ATOM 3444 OG1 THR B 94 31.092 1.230 -3.626 1.00 0.00 O ATOM 3445 CG2 THR B 94 29.975 2.448 -1.932 1.00 0.00 C ATOM 0 H THR B 94 27.763 0.765 -1.206 1.00 0.00 H new ATOM 0 HA THR B 94 28.904 -0.351 -3.676 1.00 0.00 H new ATOM 0 HB THR B 94 29.185 2.016 -3.861 1.00 0.00 H new ATOM 0 HG1 THR B 94 31.552 2.067 -3.844 1.00 0.00 H new ATOM 0 HG21 THR B 94 30.512 3.343 -2.248 1.00 0.00 H new ATOM 0 HG22 THR B 94 28.996 2.730 -1.545 1.00 0.00 H new ATOM 0 HG23 THR B 94 30.542 1.942 -1.150 1.00 0.00 H new ATOM 3453 N ASN B 95 30.563 -1.619 -2.316 1.00 0.00 N ATOM 3454 CA ASN B 95 31.392 -2.488 -1.490 1.00 0.00 C ATOM 3455 C ASN B 95 32.334 -1.669 -0.614 1.00 0.00 C ATOM 3456 O ASN B 95 32.821 -0.616 -1.024 1.00 0.00 O ATOM 3457 CB ASN B 95 32.198 -3.447 -2.368 1.00 0.00 C ATOM 3458 CG ASN B 95 32.760 -4.614 -1.581 1.00 0.00 C ATOM 3459 OD1 ASN B 95 33.516 -4.428 -0.627 1.00 0.00 O ATOM 3460 ND2 ASN B 95 32.394 -5.827 -1.978 1.00 0.00 N ATOM 0 H ASN B 95 30.554 -1.861 -3.307 1.00 0.00 H new ATOM 0 HA ASN B 95 30.733 -3.067 -0.843 1.00 0.00 H new ATOM 0 HB2 ASN B 95 31.562 -3.824 -3.169 1.00 0.00 H new ATOM 0 HB3 ASN B 95 33.016 -2.903 -2.840 1.00 0.00 H new ATOM 0 HD21 ASN B 95 32.741 -6.651 -1.487 1.00 0.00 H new ATOM 0 HD22 ASN B 95 31.765 -5.935 -2.774 1.00 0.00 H new ATOM 3467 N THR B 96 32.586 -2.161 0.595 1.00 0.00 N ATOM 3468 CA THR B 96 33.470 -1.474 1.528 1.00 0.00 C ATOM 3469 C THR B 96 34.931 -1.817 1.246 1.00 0.00 C ATOM 3470 O THR B 96 35.262 -2.966 0.952 1.00 0.00 O ATOM 3471 CB THR B 96 33.112 -1.848 2.968 1.00 0.00 C ATOM 3472 OG1 THR B 96 32.669 -3.191 3.043 1.00 0.00 O ATOM 3473 CG2 THR B 96 32.029 -0.974 3.560 1.00 0.00 C ATOM 0 H THR B 96 32.191 -3.032 0.950 1.00 0.00 H new ATOM 0 HA THR B 96 33.337 -0.400 1.395 1.00 0.00 H new ATOM 0 HB THR B 96 34.028 -1.703 3.540 1.00 0.00 H new ATOM 0 HG1 THR B 96 31.697 -3.222 2.918 1.00 0.00 H new ATOM 0 HG21 THR B 96 31.823 -1.292 4.582 1.00 0.00 H new ATOM 0 HG22 THR B 96 32.361 0.064 3.563 1.00 0.00 H new ATOM 0 HG23 THR B 96 31.122 -1.063 2.962 1.00 0.00 H new ATOM 3481 N PRO B 97 35.829 -0.820 1.330 1.00 0.00 N ATOM 3482 CA PRO B 97 37.259 -1.024 1.081 1.00 0.00 C ATOM 3483 C PRO B 97 37.934 -1.810 2.197 1.00 0.00 C ATOM 3484 O PRO B 97 37.413 -1.906 3.309 1.00 0.00 O ATOM 3485 CB PRO B 97 37.814 0.399 1.017 1.00 0.00 C ATOM 3486 CG PRO B 97 36.880 1.205 1.850 1.00 0.00 C ATOM 3487 CD PRO B 97 35.522 0.581 1.675 1.00 0.00 C ATOM 0 HA PRO B 97 37.437 -1.606 0.177 1.00 0.00 H new ATOM 0 HB2 PRO B 97 38.832 0.445 1.405 1.00 0.00 H new ATOM 0 HB3 PRO B 97 37.847 0.766 -0.009 1.00 0.00 H new ATOM 0 HG2 PRO B 97 37.182 1.193 2.897 1.00 0.00 H new ATOM 0 HG3 PRO B 97 36.874 2.247 1.532 1.00 0.00 H new ATOM 0 HD2 PRO B 97 34.928 0.649 2.587 1.00 0.00 H new ATOM 0 HD3 PRO B 97 34.953 1.073 0.886 1.00 0.00 H new ATOM 3495 N ASP B 98 39.098 -2.374 1.893 1.00 0.00 N ATOM 3496 CA ASP B 98 39.852 -3.155 2.866 1.00 0.00 C ATOM 3497 C ASP B 98 39.985 -2.406 4.189 1.00 0.00 C ATOM 3498 O ASP B 98 40.386 -1.242 4.218 1.00 0.00 O ATOM 3499 CB ASP B 98 41.239 -3.490 2.316 1.00 0.00 C ATOM 3500 CG ASP B 98 41.175 -4.165 0.959 1.00 0.00 C ATOM 3501 OD1 ASP B 98 40.222 -4.937 0.724 1.00 0.00 O ATOM 3502 OD2 ASP B 98 42.078 -3.920 0.131 1.00 0.00 O ATOM 0 H ASP B 98 39.541 -2.304 0.977 1.00 0.00 H new ATOM 0 HA ASP B 98 39.306 -4.080 3.050 1.00 0.00 H new ATOM 0 HB2 ASP B 98 41.826 -2.575 2.236 1.00 0.00 H new ATOM 0 HB3 ASP B 98 41.758 -4.142 3.019 1.00 0.00 H new ATOM 3507 N GLY B 99 39.645 -3.082 5.282 1.00 0.00 N ATOM 3508 CA GLY B 99 39.735 -2.468 6.594 1.00 0.00 C ATOM 3509 C GLY B 99 38.850 -1.245 6.728 1.00 0.00 C ATOM 3510 O GLY B 99 39.233 -0.259 7.359 1.00 0.00 O ATOM 0 H GLY B 99 39.308 -4.045 5.282 1.00 0.00 H new ATOM 0 HA2 GLY B 99 39.456 -3.199 7.353 1.00 0.00 H new ATOM 0 HA3 GLY B 99 40.770 -2.186 6.789 1.00 0.00 H new ATOM 3514 N ALA B 100 37.662 -1.306 6.135 1.00 0.00 N ATOM 3515 CA ALA B 100 36.721 -0.194 6.195 1.00 0.00 C ATOM 3516 C ALA B 100 36.115 -0.063 7.587 1.00 0.00 C ATOM 3517 O ALA B 100 35.697 -1.052 8.189 1.00 0.00 O ATOM 3518 CB ALA B 100 35.627 -0.374 5.154 1.00 0.00 C ATOM 0 H ALA B 100 37.329 -2.113 5.608 1.00 0.00 H new ATOM 0 HA ALA B 100 37.266 0.725 5.978 1.00 0.00 H new ATOM 0 HB1 ALA B 100 34.931 0.463 5.209 1.00 0.00 H new ATOM 0 HB2 ALA B 100 36.073 -0.410 4.160 1.00 0.00 H new ATOM 0 HB3 ALA B 100 35.092 -1.304 5.346 1.00 0.00 H new ATOM 3524 N ALA B 101 36.069 1.164 8.096 1.00 0.00 N ATOM 3525 CA ALA B 101 35.514 1.425 9.418 1.00 0.00 C ATOM 3526 C ALA B 101 34.110 0.858 9.550 1.00 0.00 C ATOM 3527 O ALA B 101 33.456 0.539 8.556 1.00 0.00 O ATOM 3528 CB ALA B 101 35.498 2.917 9.704 1.00 0.00 C ATOM 0 H ALA B 101 36.410 1.994 7.611 1.00 0.00 H new ATOM 0 HA ALA B 101 36.153 0.928 10.148 1.00 0.00 H new ATOM 0 HB1 ALA B 101 35.080 3.093 10.695 1.00 0.00 H new ATOM 0 HB2 ALA B 101 36.515 3.306 9.665 1.00 0.00 H new ATOM 0 HB3 ALA B 101 34.887 3.424 8.958 1.00 0.00 H new ATOM 3534 N LYS B 102 33.652 0.743 10.788 1.00 0.00 N ATOM 3535 CA LYS B 102 32.321 0.222 11.064 1.00 0.00 C ATOM 3536 C LYS B 102 31.301 1.350 11.102 1.00 0.00 C ATOM 3537 O LYS B 102 30.776 1.698 12.160 1.00 0.00 O ATOM 3538 CB LYS B 102 32.307 -0.547 12.387 1.00 0.00 C ATOM 3539 CG LYS B 102 32.637 -2.023 12.237 1.00 0.00 C ATOM 3540 CD LYS B 102 31.433 -2.897 12.549 1.00 0.00 C ATOM 3541 CE LYS B 102 31.327 -3.191 14.036 1.00 0.00 C ATOM 3542 NZ LYS B 102 29.965 -3.658 14.415 1.00 0.00 N ATOM 0 H LYS B 102 34.183 1.004 11.619 1.00 0.00 H new ATOM 0 HA LYS B 102 32.052 -0.463 10.260 1.00 0.00 H new ATOM 0 HB2 LYS B 102 33.023 -0.091 13.070 1.00 0.00 H new ATOM 0 HB3 LYS B 102 31.323 -0.448 12.845 1.00 0.00 H new ATOM 0 HG2 LYS B 102 32.977 -2.219 11.220 1.00 0.00 H new ATOM 0 HG3 LYS B 102 33.459 -2.283 12.904 1.00 0.00 H new ATOM 0 HD2 LYS B 102 30.524 -2.400 12.210 1.00 0.00 H new ATOM 0 HD3 LYS B 102 31.509 -3.834 11.997 1.00 0.00 H new ATOM 0 HE2 LYS B 102 32.060 -3.950 14.309 1.00 0.00 H new ATOM 0 HE3 LYS B 102 31.573 -2.293 14.602 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 29.935 -3.848 15.437 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 29.268 -2.923 14.178 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 29.740 -4.530 13.895 1.00 0.00 H new ATOM 3556 N GLN B 103 31.028 1.913 9.934 1.00 0.00 N ATOM 3557 CA GLN B 103 30.071 3.007 9.810 1.00 0.00 C ATOM 3558 C GLN B 103 30.028 3.530 8.377 1.00 0.00 C ATOM 3559 O GLN B 103 31.043 3.553 7.683 1.00 0.00 O ATOM 3560 CB GLN B 103 30.433 4.143 10.769 1.00 0.00 C ATOM 3561 CG GLN B 103 29.233 4.730 11.495 1.00 0.00 C ATOM 3562 CD GLN B 103 29.217 4.384 12.971 1.00 0.00 C ATOM 3563 OE1 GLN B 103 30.230 3.969 13.534 1.00 0.00 O ATOM 3564 NE2 GLN B 103 28.062 4.554 13.604 1.00 0.00 N ATOM 0 H GLN B 103 31.457 1.630 9.053 1.00 0.00 H new ATOM 0 HA GLN B 103 29.084 2.624 10.069 1.00 0.00 H new ATOM 0 HB2 GLN B 103 31.147 3.773 11.505 1.00 0.00 H new ATOM 0 HB3 GLN B 103 30.932 4.934 10.210 1.00 0.00 H new ATOM 0 HG2 GLN B 103 29.238 5.814 11.380 1.00 0.00 H new ATOM 0 HG3 GLN B 103 28.317 4.364 11.030 1.00 0.00 H new ATOM 0 HE21 GLN B 103 27.248 4.901 13.096 1.00 0.00 H new ATOM 0 HE22 GLN B 103 27.989 4.338 14.598 1.00 0.00 H new ATOM 3573 N PHE B 104 28.844 3.948 7.941 1.00 0.00 N ATOM 3574 CA PHE B 104 28.668 4.469 6.591 1.00 0.00 C ATOM 3575 C PHE B 104 29.591 5.657 6.336 1.00 0.00 C ATOM 3576 O PHE B 104 29.462 6.702 6.971 1.00 0.00 O ATOM 3577 CB PHE B 104 27.212 4.884 6.369 1.00 0.00 C ATOM 3578 CG PHE B 104 26.960 5.499 5.023 1.00 0.00 C ATOM 3579 CD1 PHE B 104 26.644 4.706 3.931 1.00 0.00 C ATOM 3580 CD2 PHE B 104 27.042 6.872 4.848 1.00 0.00 C ATOM 3581 CE1 PHE B 104 26.412 5.270 2.691 1.00 0.00 C ATOM 3582 CE2 PHE B 104 26.812 7.442 3.610 1.00 0.00 C ATOM 3583 CZ PHE B 104 26.496 6.640 2.530 1.00 0.00 C ATOM 0 H PHE B 104 27.993 3.936 8.503 1.00 0.00 H new ATOM 0 HA PHE B 104 28.926 3.677 5.888 1.00 0.00 H new ATOM 0 HB2 PHE B 104 26.572 4.009 6.485 1.00 0.00 H new ATOM 0 HB3 PHE B 104 26.924 5.595 7.143 1.00 0.00 H new ATOM 0 HD1 PHE B 104 26.578 3.635 4.051 1.00 0.00 H new ATOM 0 HD2 PHE B 104 27.288 7.503 5.689 1.00 0.00 H new ATOM 0 HE1 PHE B 104 26.165 4.641 1.849 1.00 0.00 H new ATOM 0 HE2 PHE B 104 26.879 8.513 3.487 1.00 0.00 H new ATOM 0 HZ PHE B 104 26.315 7.083 1.562 1.00 0.00 H new ATOM 3593 N ARG B 105 30.519 5.487 5.400 1.00 0.00 N ATOM 3594 CA ARG B 105 31.463 6.546 5.057 1.00 0.00 C ATOM 3595 C ARG B 105 31.110 7.176 3.714 1.00 0.00 C ATOM 3596 O ARG B 105 30.497 6.535 2.859 1.00 0.00 O ATOM 3597 CB ARG B 105 32.889 5.995 5.017 1.00 0.00 C ATOM 3598 CG ARG B 105 33.727 6.389 6.221 1.00 0.00 C ATOM 3599 CD ARG B 105 34.175 7.839 6.137 1.00 0.00 C ATOM 3600 NE ARG B 105 33.277 8.731 6.863 1.00 0.00 N ATOM 3601 CZ ARG B 105 33.293 8.875 8.185 1.00 0.00 C ATOM 3602 NH1 ARG B 105 34.159 8.188 8.917 1.00 0.00 N ATOM 3603 NH2 ARG B 105 32.443 9.705 8.773 1.00 0.00 N ATOM 0 H ARG B 105 30.638 4.627 4.865 1.00 0.00 H new ATOM 0 HA ARG B 105 31.401 7.316 5.826 1.00 0.00 H new ATOM 0 HB2 ARG B 105 32.848 4.908 4.954 1.00 0.00 H new ATOM 0 HB3 ARG B 105 33.381 6.349 4.111 1.00 0.00 H new ATOM 0 HG2 ARG B 105 33.149 6.238 7.133 1.00 0.00 H new ATOM 0 HG3 ARG B 105 34.601 5.740 6.286 1.00 0.00 H new ATOM 0 HD2 ARG B 105 35.183 7.931 6.542 1.00 0.00 H new ATOM 0 HD3 ARG B 105 34.222 8.144 5.092 1.00 0.00 H new ATOM 0 HE ARG B 105 32.600 9.274 6.327 1.00 0.00 H new ATOM 0 HH11 ARG B 105 34.814 7.549 8.466 1.00 0.00 H new ATOM 0 HH12 ARG B 105 34.171 8.299 9.931 1.00 0.00 H new ATOM 0 HH21 ARG B 105 31.776 10.234 8.211 1.00 0.00 H new ATOM 0 HH22 ARG B 105 32.456 9.815 9.787 1.00 0.00 H new ATOM 3617 N ARG B 106 31.499 8.433 3.534 1.00 0.00 N ATOM 3618 CA ARG B 106 31.221 9.149 2.293 1.00 0.00 C ATOM 3619 C ARG B 106 32.314 8.900 1.260 1.00 0.00 C ATOM 3620 O ARG B 106 32.070 8.963 0.055 1.00 0.00 O ATOM 3621 CB ARG B 106 31.090 10.649 2.563 1.00 0.00 C ATOM 3622 CG ARG B 106 32.408 11.325 2.902 1.00 0.00 C ATOM 3623 CD ARG B 106 32.187 12.664 3.588 1.00 0.00 C ATOM 3624 NE ARG B 106 33.310 13.574 3.386 1.00 0.00 N ATOM 3625 CZ ARG B 106 33.406 14.766 3.966 1.00 0.00 C ATOM 3626 NH1 ARG B 106 32.451 15.184 4.786 1.00 0.00 N ATOM 3627 NH2 ARG B 106 34.456 15.538 3.729 1.00 0.00 N ATOM 0 H ARG B 106 32.007 8.978 4.231 1.00 0.00 H new ATOM 0 HA ARG B 106 30.279 8.775 1.893 1.00 0.00 H new ATOM 0 HB2 ARG B 106 30.660 11.131 1.685 1.00 0.00 H new ATOM 0 HB3 ARG B 106 30.391 10.802 3.385 1.00 0.00 H new ATOM 0 HG2 ARG B 106 32.995 10.675 3.551 1.00 0.00 H new ATOM 0 HG3 ARG B 106 32.987 11.473 1.991 1.00 0.00 H new ATOM 0 HD2 ARG B 106 31.276 13.122 3.204 1.00 0.00 H new ATOM 0 HD3 ARG B 106 32.038 12.504 4.656 1.00 0.00 H new ATOM 0 HE ARG B 106 34.063 13.279 2.765 1.00 0.00 H new ATOM 0 HH11 ARG B 106 31.642 14.591 4.972 1.00 0.00 H new ATOM 0 HH12 ARG B 106 32.525 16.099 5.231 1.00 0.00 H new ATOM 0 HH21 ARG B 106 35.193 15.218 3.100 1.00 0.00 H new ATOM 0 HH22 ARG B 106 34.528 16.452 4.175 1.00 0.00 H new ATOM 3641 N GLU B 107 33.521 8.616 1.737 1.00 0.00 N ATOM 3642 CA GLU B 107 34.652 8.357 0.852 1.00 0.00 C ATOM 3643 C GLU B 107 34.381 7.150 -0.039 1.00 0.00 C ATOM 3644 O GLU B 107 34.832 7.097 -1.183 1.00 0.00 O ATOM 3645 CB GLU B 107 35.924 8.130 1.669 1.00 0.00 C ATOM 3646 CG GLU B 107 35.907 6.842 2.476 1.00 0.00 C ATOM 3647 CD GLU B 107 36.825 6.898 3.682 1.00 0.00 C ATOM 3648 OE1 GLU B 107 37.965 7.391 3.539 1.00 0.00 O ATOM 3649 OE2 GLU B 107 36.406 6.449 4.770 1.00 0.00 O ATOM 0 H GLU B 107 33.742 8.559 2.731 1.00 0.00 H new ATOM 0 HA GLU B 107 34.790 9.230 0.215 1.00 0.00 H new ATOM 0 HB2 GLU B 107 36.781 8.116 0.995 1.00 0.00 H new ATOM 0 HB3 GLU B 107 36.066 8.972 2.347 1.00 0.00 H new ATOM 0 HG2 GLU B 107 34.889 6.639 2.808 1.00 0.00 H new ATOM 0 HG3 GLU B 107 36.205 6.012 1.835 1.00 0.00 H new ATOM 3656 N TRP B 108 33.642 6.181 0.491 1.00 0.00 N ATOM 3657 CA TRP B 108 33.312 4.974 -0.258 1.00 0.00 C ATOM 3658 C TRP B 108 32.672 5.322 -1.598 1.00 0.00 C ATOM 3659 O TRP B 108 32.837 4.600 -2.582 1.00 0.00 O ATOM 3660 CB TRP B 108 32.368 4.085 0.555 1.00 0.00 C ATOM 3661 CG TRP B 108 32.963 3.608 1.844 1.00 0.00 C ATOM 3662 CD1 TRP B 108 34.282 3.628 2.196 1.00 0.00 C ATOM 3663 CD2 TRP B 108 32.258 3.040 2.954 1.00 0.00 C ATOM 3664 NE1 TRP B 108 34.441 3.105 3.457 1.00 0.00 N ATOM 3665 CE2 TRP B 108 33.213 2.737 3.943 1.00 0.00 C ATOM 3666 CE3 TRP B 108 30.913 2.759 3.206 1.00 0.00 C ATOM 3667 CZ2 TRP B 108 32.863 2.168 5.165 1.00 0.00 C ATOM 3668 CZ3 TRP B 108 30.568 2.194 4.419 1.00 0.00 C ATOM 3669 CH2 TRP B 108 31.539 1.904 5.385 1.00 0.00 C ATOM 0 H TRP B 108 33.260 6.208 1.436 1.00 0.00 H new ATOM 0 HA TRP B 108 34.238 4.431 -0.448 1.00 0.00 H new ATOM 0 HB2 TRP B 108 31.454 4.638 0.768 1.00 0.00 H new ATOM 0 HB3 TRP B 108 32.085 3.222 -0.047 1.00 0.00 H new ATOM 0 HD1 TRP B 108 35.083 4.000 1.575 1.00 0.00 H new ATOM 0 HE1 TRP B 108 35.328 3.007 3.951 1.00 0.00 H new ATOM 0 HE3 TRP B 108 30.157 2.979 2.467 1.00 0.00 H new ATOM 0 HZ2 TRP B 108 33.610 1.943 5.912 1.00 0.00 H new ATOM 0 HZ3 TRP B 108 29.531 1.972 4.625 1.00 0.00 H new ATOM 0 HH2 TRP B 108 31.236 1.463 6.323 1.00 0.00 H new ATOM 3680 N PHE B 109 31.941 6.431 -1.628 1.00 0.00 N ATOM 3681 CA PHE B 109 31.275 6.876 -2.848 1.00 0.00 C ATOM 3682 C PHE B 109 32.207 7.738 -3.694 1.00 0.00 C ATOM 3683 O PHE B 109 32.142 7.716 -4.923 1.00 0.00 O ATOM 3684 CB PHE B 109 30.007 7.661 -2.504 1.00 0.00 C ATOM 3685 CG PHE B 109 28.829 6.786 -2.181 1.00 0.00 C ATOM 3686 CD1 PHE B 109 28.874 5.909 -1.109 1.00 0.00 C ATOM 3687 CD2 PHE B 109 27.678 6.842 -2.949 1.00 0.00 C ATOM 3688 CE1 PHE B 109 27.792 5.103 -0.810 1.00 0.00 C ATOM 3689 CE2 PHE B 109 26.593 6.039 -2.655 1.00 0.00 C ATOM 3690 CZ PHE B 109 26.649 5.168 -1.584 1.00 0.00 C ATOM 0 H PHE B 109 31.794 7.039 -0.822 1.00 0.00 H new ATOM 0 HA PHE B 109 31.002 5.993 -3.426 1.00 0.00 H new ATOM 0 HB2 PHE B 109 30.211 8.311 -1.653 1.00 0.00 H new ATOM 0 HB3 PHE B 109 29.750 8.307 -3.344 1.00 0.00 H new ATOM 0 HD1 PHE B 109 29.765 5.855 -0.500 1.00 0.00 H new ATOM 0 HD2 PHE B 109 27.628 7.521 -3.787 1.00 0.00 H new ATOM 0 HE1 PHE B 109 27.840 4.423 0.028 1.00 0.00 H new ATOM 0 HE2 PHE B 109 25.701 6.092 -3.262 1.00 0.00 H new ATOM 0 HZ PHE B 109 25.802 4.540 -1.352 1.00 0.00 H new ATOM 3700 N GLN B 110 33.073 8.495 -3.029 1.00 0.00 N ATOM 3701 CA GLN B 110 34.019 9.363 -3.722 1.00 0.00 C ATOM 3702 C GLN B 110 35.414 8.748 -3.734 1.00 0.00 C ATOM 3703 O GLN B 110 36.417 9.455 -3.616 1.00 0.00 O ATOM 3704 CB GLN B 110 34.061 10.740 -3.055 1.00 0.00 C ATOM 3705 CG GLN B 110 32.686 11.308 -2.747 1.00 0.00 C ATOM 3706 CD GLN B 110 32.665 12.823 -2.763 1.00 0.00 C ATOM 3707 OE1 GLN B 110 33.697 13.471 -2.589 1.00 0.00 O ATOM 3708 NE2 GLN B 110 31.485 13.397 -2.972 1.00 0.00 N ATOM 0 H GLN B 110 33.140 8.525 -2.012 1.00 0.00 H new ATOM 0 HA GLN B 110 33.683 9.476 -4.753 1.00 0.00 H new ATOM 0 HB2 GLN B 110 34.631 10.669 -2.129 1.00 0.00 H new ATOM 0 HB3 GLN B 110 34.594 11.433 -3.705 1.00 0.00 H new ATOM 0 HG2 GLN B 110 31.969 10.931 -3.476 1.00 0.00 H new ATOM 0 HG3 GLN B 110 32.361 10.954 -1.768 1.00 0.00 H new ATOM 0 HE21 GLN B 110 30.655 12.821 -3.112 1.00 0.00 H new ATOM 0 HE22 GLN B 110 31.409 14.414 -2.993 1.00 0.00 H new ATOM 3717 N GLY B 111 35.473 7.429 -3.878 1.00 0.00 N ATOM 3718 CA GLY B 111 36.750 6.740 -3.903 1.00 0.00 C ATOM 3719 C GLY B 111 36.863 5.765 -5.058 1.00 0.00 C ATOM 3720 O GLY B 111 36.324 6.006 -6.138 1.00 0.00 O ATOM 0 H GLY B 111 34.658 6.824 -3.978 1.00 0.00 H new ATOM 0 HA2 GLY B 111 37.553 7.474 -3.972 1.00 0.00 H new ATOM 0 HA3 GLY B 111 36.888 6.203 -2.964 1.00 0.00 H new ATOM 3724 N ASP B 112 37.568 4.661 -4.830 1.00 0.00 N ATOM 3725 CA ASP B 112 37.753 3.646 -5.859 1.00 0.00 C ATOM 3726 C ASP B 112 36.644 2.600 -5.799 1.00 0.00 C ATOM 3727 O ASP B 112 36.039 2.381 -4.751 1.00 0.00 O ATOM 3728 CB ASP B 112 39.116 2.970 -5.702 1.00 0.00 C ATOM 3729 CG ASP B 112 40.199 3.663 -6.506 1.00 0.00 C ATOM 3730 OD1 ASP B 112 39.857 4.508 -7.358 1.00 0.00 O ATOM 3731 OD2 ASP B 112 41.390 3.359 -6.283 1.00 0.00 O ATOM 0 H ASP B 112 38.020 4.447 -3.941 1.00 0.00 H new ATOM 0 HA ASP B 112 37.710 4.139 -6.830 1.00 0.00 H new ATOM 0 HB2 ASP B 112 39.397 2.964 -4.649 1.00 0.00 H new ATOM 0 HB3 ASP B 112 39.041 1.930 -6.018 1.00 0.00 H new ATOM 3736 N GLY B 113 36.386 1.958 -6.933 1.00 0.00 N ATOM 3737 CA GLY B 113 35.352 0.943 -6.993 1.00 0.00 C ATOM 3738 C GLY B 113 34.158 1.380 -7.821 1.00 0.00 C ATOM 3739 O GLY B 113 34.179 2.446 -8.437 1.00 0.00 O ATOM 0 H GLY B 113 36.875 2.123 -7.813 1.00 0.00 H new ATOM 0 HA2 GLY B 113 35.769 0.029 -7.416 1.00 0.00 H new ATOM 0 HA3 GLY B 113 35.022 0.705 -5.982 1.00 0.00 H new ATOM 3743 N MET B 114 33.116 0.556 -7.833 1.00 0.00 N ATOM 3744 CA MET B 114 31.908 0.863 -8.591 1.00 0.00 C ATOM 3745 C MET B 114 30.705 0.995 -7.663 1.00 0.00 C ATOM 3746 O MET B 114 30.484 0.153 -6.793 1.00 0.00 O ATOM 3747 CB MET B 114 31.644 -0.222 -9.636 1.00 0.00 C ATOM 3748 CG MET B 114 31.535 0.312 -11.055 1.00 0.00 C ATOM 3749 SD MET B 114 29.827 0.548 -11.578 1.00 0.00 S ATOM 3750 CE MET B 114 29.460 -1.063 -12.269 1.00 0.00 C ATOM 0 H MET B 114 33.083 -0.329 -7.327 1.00 0.00 H new ATOM 0 HA MET B 114 32.060 1.815 -9.099 1.00 0.00 H new ATOM 0 HB2 MET B 114 32.447 -0.958 -9.594 1.00 0.00 H new ATOM 0 HB3 MET B 114 30.721 -0.743 -9.381 1.00 0.00 H new ATOM 0 HG2 MET B 114 32.066 1.261 -11.124 1.00 0.00 H new ATOM 0 HG3 MET B 114 32.028 -0.380 -11.738 1.00 0.00 H new ATOM 0 HE1 MET B 114 28.637 -0.976 -12.979 1.00 0.00 H new ATOM 0 HE2 MET B 114 30.341 -1.449 -12.781 1.00 0.00 H new ATOM 0 HE3 MET B 114 29.178 -1.747 -11.468 1.00 0.00 H new ATOM 3760 N VAL B 115 29.930 2.058 -7.855 1.00 0.00 N ATOM 3761 CA VAL B 115 28.750 2.300 -7.033 1.00 0.00 C ATOM 3762 C VAL B 115 27.470 2.002 -7.806 1.00 0.00 C ATOM 3763 O VAL B 115 27.246 2.543 -8.890 1.00 0.00 O ATOM 3764 CB VAL B 115 28.705 3.756 -6.531 1.00 0.00 C ATOM 3765 CG1 VAL B 115 27.509 3.969 -5.615 1.00 0.00 C ATOM 3766 CG2 VAL B 115 30.002 4.117 -5.823 1.00 0.00 C ATOM 0 H VAL B 115 30.098 2.764 -8.571 1.00 0.00 H new ATOM 0 HA VAL B 115 28.818 1.629 -6.177 1.00 0.00 H new ATOM 0 HB VAL B 115 28.594 4.415 -7.392 1.00 0.00 H new ATOM 0 HG11 VAL B 115 27.494 5.003 -5.271 1.00 0.00 H new ATOM 0 HG12 VAL B 115 26.590 3.755 -6.161 1.00 0.00 H new ATOM 0 HG13 VAL B 115 27.585 3.302 -4.756 1.00 0.00 H new ATOM 0 HG21 VAL B 115 29.952 5.149 -5.475 1.00 0.00 H new ATOM 0 HG22 VAL B 115 30.148 3.454 -4.971 1.00 0.00 H new ATOM 0 HG23 VAL B 115 30.837 4.008 -6.515 1.00 0.00 H new ATOM 3776 N ARG B 116 26.631 1.140 -7.241 1.00 0.00 N ATOM 3777 CA ARG B 116 25.371 0.772 -7.874 1.00 0.00 C ATOM 3778 C ARG B 116 24.219 1.592 -7.302 1.00 0.00 C ATOM 3779 O ARG B 116 23.805 1.388 -6.161 1.00 0.00 O ATOM 3780 CB ARG B 116 25.096 -0.721 -7.681 1.00 0.00 C ATOM 3781 CG ARG B 116 24.355 -1.359 -8.845 1.00 0.00 C ATOM 3782 CD ARG B 116 25.235 -2.346 -9.593 1.00 0.00 C ATOM 3783 NE ARG B 116 25.664 -1.825 -10.888 1.00 0.00 N ATOM 3784 CZ ARG B 116 24.856 -1.698 -11.934 1.00 0.00 C ATOM 3785 NH1 ARG B 116 23.582 -2.053 -11.839 1.00 0.00 N ATOM 3786 NH2 ARG B 116 25.322 -1.216 -13.079 1.00 0.00 N ATOM 0 H ARG B 116 26.802 0.683 -6.345 1.00 0.00 H new ATOM 0 HA ARG B 116 25.451 0.983 -8.940 1.00 0.00 H new ATOM 0 HB2 ARG B 116 26.043 -1.240 -7.536 1.00 0.00 H new ATOM 0 HB3 ARG B 116 24.513 -0.860 -6.770 1.00 0.00 H new ATOM 0 HG2 ARG B 116 23.466 -1.870 -8.475 1.00 0.00 H new ATOM 0 HG3 ARG B 116 24.014 -0.583 -9.530 1.00 0.00 H new ATOM 0 HD2 ARG B 116 26.111 -2.581 -8.989 1.00 0.00 H new ATOM 0 HD3 ARG B 116 24.690 -3.278 -9.740 1.00 0.00 H new ATOM 0 HE ARG B 116 26.638 -1.543 -10.995 1.00 0.00 H new ATOM 0 HH11 ARG B 116 23.220 -2.425 -10.961 1.00 0.00 H new ATOM 0 HH12 ARG B 116 22.964 -1.954 -12.644 1.00 0.00 H new ATOM 0 HH21 ARG B 116 26.302 -0.943 -13.156 1.00 0.00 H new ATOM 0 HH22 ARG B 116 24.701 -1.119 -13.882 1.00 0.00 H new ATOM 3800 N ARG B 117 23.711 2.526 -8.101 1.00 0.00 N ATOM 3801 CA ARG B 117 22.611 3.381 -7.671 1.00 0.00 C ATOM 3802 C ARG B 117 21.289 2.934 -8.288 1.00 0.00 C ATOM 3803 O ARG B 117 21.111 2.985 -9.505 1.00 0.00 O ATOM 3804 CB ARG B 117 22.895 4.836 -8.049 1.00 0.00 C ATOM 3805 CG ARG B 117 23.389 5.007 -9.476 1.00 0.00 C ATOM 3806 CD ARG B 117 23.232 6.442 -9.951 1.00 0.00 C ATOM 3807 NE ARG B 117 23.871 7.390 -9.042 1.00 0.00 N ATOM 3808 CZ ARG B 117 23.768 8.710 -9.163 1.00 0.00 C ATOM 3809 NH1 ARG B 117 23.055 9.234 -10.149 1.00 0.00 N ATOM 3810 NH2 ARG B 117 24.380 9.506 -8.296 1.00 0.00 N ATOM 0 H ARG B 117 24.043 2.709 -9.048 1.00 0.00 H new ATOM 0 HA ARG B 117 22.527 3.299 -6.587 1.00 0.00 H new ATOM 0 HB2 ARG B 117 21.986 5.422 -7.915 1.00 0.00 H new ATOM 0 HB3 ARG B 117 23.639 5.242 -7.364 1.00 0.00 H new ATOM 0 HG2 ARG B 117 24.437 4.715 -9.537 1.00 0.00 H new ATOM 0 HG3 ARG B 117 22.834 4.341 -10.137 1.00 0.00 H new ATOM 0 HD2 ARG B 117 23.666 6.545 -10.946 1.00 0.00 H new ATOM 0 HD3 ARG B 117 22.172 6.681 -10.039 1.00 0.00 H new ATOM 0 HE ARG B 117 24.427 7.019 -8.272 1.00 0.00 H new ATOM 0 HH11 ARG B 117 22.584 8.624 -10.817 1.00 0.00 H new ATOM 0 HH12 ARG B 117 22.977 10.247 -10.240 1.00 0.00 H new ATOM 0 HH21 ARG B 117 24.930 9.105 -7.536 1.00 0.00 H new ATOM 0 HH22 ARG B 117 24.301 10.519 -8.389 1.00 0.00 H new ATOM 3824 N LYS B 118 20.364 2.505 -7.436 1.00 0.00 N ATOM 3825 CA LYS B 118 19.052 2.056 -7.890 1.00 0.00 C ATOM 3826 C LYS B 118 18.003 3.128 -7.628 1.00 0.00 C ATOM 3827 O LYS B 118 18.189 3.994 -6.775 1.00 0.00 O ATOM 3828 CB LYS B 118 18.661 0.755 -7.186 1.00 0.00 C ATOM 3829 CG LYS B 118 18.481 -0.418 -8.137 1.00 0.00 C ATOM 3830 CD LYS B 118 18.521 -1.745 -7.398 1.00 0.00 C ATOM 3831 CE LYS B 118 17.251 -2.547 -7.627 1.00 0.00 C ATOM 3832 NZ LYS B 118 17.502 -4.013 -7.567 1.00 0.00 N ATOM 0 H LYS B 118 20.498 2.459 -6.426 1.00 0.00 H new ATOM 0 HA LYS B 118 19.104 1.872 -8.963 1.00 0.00 H new ATOM 0 HB2 LYS B 118 19.427 0.504 -6.452 1.00 0.00 H new ATOM 0 HB3 LYS B 118 17.733 0.913 -6.637 1.00 0.00 H new ATOM 0 HG2 LYS B 118 17.530 -0.321 -8.661 1.00 0.00 H new ATOM 0 HG3 LYS B 118 19.265 -0.398 -8.894 1.00 0.00 H new ATOM 0 HD2 LYS B 118 19.383 -2.323 -7.732 1.00 0.00 H new ATOM 0 HD3 LYS B 118 18.652 -1.565 -6.331 1.00 0.00 H new ATOM 0 HE2 LYS B 118 16.509 -2.275 -6.876 1.00 0.00 H new ATOM 0 HE3 LYS B 118 16.830 -2.290 -8.599 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 16.611 -4.525 -7.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 18.191 -4.278 -8.300 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 17.880 -4.262 -6.631 1.00 0.00 H new ATOM 3846 N ASN B 119 16.906 3.071 -8.371 1.00 0.00 N ATOM 3847 CA ASN B 119 15.833 4.048 -8.216 1.00 0.00 C ATOM 3848 C ASN B 119 14.461 3.394 -8.348 1.00 0.00 C ATOM 3849 O ASN B 119 14.172 2.723 -9.339 1.00 0.00 O ATOM 3850 CB ASN B 119 15.980 5.165 -9.251 1.00 0.00 C ATOM 3851 CG ASN B 119 16.440 4.649 -10.602 1.00 0.00 C ATOM 3852 OD1 ASN B 119 15.698 3.958 -11.301 1.00 0.00 O ATOM 3853 ND2 ASN B 119 17.669 4.984 -10.975 1.00 0.00 N ATOM 0 H ASN B 119 16.735 2.362 -9.084 1.00 0.00 H new ATOM 0 HA ASN B 119 15.911 4.472 -7.215 1.00 0.00 H new ATOM 0 HB2 ASN B 119 15.024 5.676 -9.367 1.00 0.00 H new ATOM 0 HB3 ASN B 119 16.694 5.903 -8.885 1.00 0.00 H new ATOM 0 HD21 ASN B 119 18.034 4.667 -11.873 1.00 0.00 H new ATOM 0 HD22 ASN B 119 18.249 5.559 -10.363 1.00 0.00 H new ATOM 3860 N LEU B 120 13.618 3.601 -7.340 1.00 0.00 N ATOM 3861 CA LEU B 120 12.269 3.044 -7.337 1.00 0.00 C ATOM 3862 C LEU B 120 11.230 4.163 -7.423 1.00 0.00 C ATOM 3863 O LEU B 120 11.113 4.977 -6.507 1.00 0.00 O ATOM 3864 CB LEU B 120 12.042 2.220 -6.067 1.00 0.00 C ATOM 3865 CG LEU B 120 12.434 0.746 -6.172 1.00 0.00 C ATOM 3866 CD1 LEU B 120 13.916 0.565 -5.880 1.00 0.00 C ATOM 3867 CD2 LEU B 120 11.596 -0.097 -5.223 1.00 0.00 C ATOM 0 H LEU B 120 13.846 4.152 -6.513 1.00 0.00 H new ATOM 0 HA LEU B 120 12.160 2.396 -8.207 1.00 0.00 H new ATOM 0 HB2 LEU B 120 12.607 2.673 -5.253 1.00 0.00 H new ATOM 0 HB3 LEU B 120 10.988 2.281 -5.796 1.00 0.00 H new ATOM 0 HG LEU B 120 12.242 0.411 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU B 120 14.176 -0.490 -5.960 1.00 0.00 H new ATOM 0 HD12 LEU B 120 14.501 1.138 -6.599 1.00 0.00 H new ATOM 0 HD13 LEU B 120 14.134 0.917 -4.872 1.00 0.00 H new ATOM 0 HD21 LEU B 120 11.888 -1.143 -5.311 1.00 0.00 H new ATOM 0 HD22 LEU B 120 11.757 0.240 -4.199 1.00 0.00 H new ATOM 0 HD23 LEU B 120 10.541 0.008 -5.478 1.00 0.00 H new ATOM 3879 N PRO B 121 10.462 4.228 -8.526 1.00 0.00 N ATOM 3880 CA PRO B 121 9.440 5.265 -8.713 1.00 0.00 C ATOM 3881 C PRO B 121 8.290 5.141 -7.721 1.00 0.00 C ATOM 3882 O PRO B 121 7.901 4.037 -7.337 1.00 0.00 O ATOM 3883 CB PRO B 121 8.941 5.028 -10.141 1.00 0.00 C ATOM 3884 CG PRO B 121 9.264 3.603 -10.428 1.00 0.00 C ATOM 3885 CD PRO B 121 10.531 3.309 -9.676 1.00 0.00 C ATOM 0 HA PRO B 121 9.847 6.263 -8.550 1.00 0.00 H new ATOM 0 HB2 PRO B 121 7.870 5.214 -10.221 1.00 0.00 H new ATOM 0 HB3 PRO B 121 9.434 5.695 -10.848 1.00 0.00 H new ATOM 0 HG2 PRO B 121 8.456 2.947 -10.104 1.00 0.00 H new ATOM 0 HG3 PRO B 121 9.398 3.440 -11.497 1.00 0.00 H new ATOM 0 HD2 PRO B 121 10.577 2.268 -9.357 1.00 0.00 H new ATOM 0 HD3 PRO B 121 11.414 3.495 -10.287 1.00 0.00 H new ATOM 3893 N ILE B 122 7.747 6.284 -7.313 1.00 0.00 N ATOM 3894 CA ILE B 122 6.637 6.310 -6.370 1.00 0.00 C ATOM 3895 C ILE B 122 5.303 6.392 -7.103 1.00 0.00 C ATOM 3896 O ILE B 122 5.223 6.926 -8.210 1.00 0.00 O ATOM 3897 CB ILE B 122 6.751 7.504 -5.401 1.00 0.00 C ATOM 3898 CG1 ILE B 122 8.104 7.482 -4.687 1.00 0.00 C ATOM 3899 CG2 ILE B 122 5.613 7.480 -4.392 1.00 0.00 C ATOM 3900 CD1 ILE B 122 8.298 6.273 -3.799 1.00 0.00 C ATOM 0 H ILE B 122 8.059 7.205 -7.622 1.00 0.00 H new ATOM 0 HA ILE B 122 6.682 5.383 -5.798 1.00 0.00 H new ATOM 0 HB ILE B 122 6.680 8.427 -5.976 1.00 0.00 H new ATOM 0 HG12 ILE B 122 8.899 7.507 -5.432 1.00 0.00 H new ATOM 0 HG13 ILE B 122 8.203 8.385 -4.085 1.00 0.00 H new ATOM 0 HG21 ILE B 122 5.708 8.329 -3.716 1.00 0.00 H new ATOM 0 HG22 ILE B 122 4.660 7.540 -4.917 1.00 0.00 H new ATOM 0 HG23 ILE B 122 5.654 6.554 -3.819 1.00 0.00 H new ATOM 0 HD11 ILE B 122 9.278 6.323 -3.325 1.00 0.00 H new ATOM 0 HD12 ILE B 122 7.524 6.257 -3.032 1.00 0.00 H new ATOM 0 HD13 ILE B 122 8.232 5.366 -4.400 1.00 0.00 H new ATOM 3912 N GLU B 123 4.258 5.855 -6.484 1.00 0.00 N ATOM 3913 CA GLU B 123 2.928 5.867 -7.082 1.00 0.00 C ATOM 3914 C GLU B 123 1.868 6.231 -6.050 1.00 0.00 C ATOM 3915 O GLU B 123 2.069 6.058 -4.848 1.00 0.00 O ATOM 3916 CB GLU B 123 2.609 4.503 -7.696 1.00 0.00 C ATOM 3917 CG GLU B 123 2.259 4.568 -9.173 1.00 0.00 C ATOM 3918 CD GLU B 123 0.762 4.541 -9.417 1.00 0.00 C ATOM 3919 OE1 GLU B 123 0.051 3.842 -8.665 1.00 0.00 O ATOM 3920 OE2 GLU B 123 0.302 5.220 -10.359 1.00 0.00 O ATOM 0 H GLU B 123 4.306 5.406 -5.569 1.00 0.00 H new ATOM 0 HA GLU B 123 2.919 6.623 -7.867 1.00 0.00 H new ATOM 0 HB2 GLU B 123 3.467 3.844 -7.563 1.00 0.00 H new ATOM 0 HB3 GLU B 123 1.777 4.055 -7.153 1.00 0.00 H new ATOM 0 HG2 GLU B 123 2.678 5.478 -9.603 1.00 0.00 H new ATOM 0 HG3 GLU B 123 2.723 3.729 -9.690 1.00 0.00 H new ATOM 3927 N TYR B 124 0.738 6.738 -6.528 1.00 0.00 N ATOM 3928 CA TYR B 124 -0.356 7.127 -5.647 1.00 0.00 C ATOM 3929 C TYR B 124 -1.666 6.479 -6.082 1.00 0.00 C ATOM 3930 O TYR B 124 -2.277 6.892 -7.067 1.00 0.00 O ATOM 3931 CB TYR B 124 -0.508 8.649 -5.629 1.00 0.00 C ATOM 3932 CG TYR B 124 0.808 9.389 -5.542 1.00 0.00 C ATOM 3933 CD1 TYR B 124 1.575 9.614 -6.677 1.00 0.00 C ATOM 3934 CD2 TYR B 124 1.282 9.861 -4.324 1.00 0.00 C ATOM 3935 CE1 TYR B 124 2.778 10.290 -6.602 1.00 0.00 C ATOM 3936 CE2 TYR B 124 2.484 10.537 -4.241 1.00 0.00 C ATOM 3937 CZ TYR B 124 3.228 10.749 -5.383 1.00 0.00 C ATOM 3938 OH TYR B 124 4.426 11.423 -5.304 1.00 0.00 O ATOM 0 H TYR B 124 0.555 6.889 -7.520 1.00 0.00 H new ATOM 0 HA TYR B 124 -0.118 6.780 -4.642 1.00 0.00 H new ATOM 0 HB2 TYR B 124 -1.033 8.964 -6.531 1.00 0.00 H new ATOM 0 HB3 TYR B 124 -1.132 8.933 -4.781 1.00 0.00 H new ATOM 0 HD1 TYR B 124 1.226 9.255 -7.634 1.00 0.00 H new ATOM 0 HD2 TYR B 124 0.702 9.697 -3.428 1.00 0.00 H new ATOM 0 HE1 TYR B 124 3.363 10.458 -7.494 1.00 0.00 H new ATOM 0 HE2 TYR B 124 2.839 10.898 -3.287 1.00 0.00 H new ATOM 0 HH TYR B 124 4.691 11.511 -4.364 1.00 0.00 H new ATOM 3948 N ASN B 125 -2.093 5.464 -5.338 1.00 0.00 N ATOM 3949 CA ASN B 125 -3.333 4.763 -5.645 1.00 0.00 C ATOM 3950 C ASN B 125 -4.521 5.469 -5.006 1.00 0.00 C ATOM 3951 O ASN B 125 -5.030 5.042 -3.970 1.00 0.00 O ATOM 3952 CB ASN B 125 -3.260 3.314 -5.159 1.00 0.00 C ATOM 3953 CG ASN B 125 -3.445 2.315 -6.285 1.00 0.00 C ATOM 3954 OD1 ASN B 125 -4.194 1.252 -6.015 1.00 0.00 O flip ATOM 3955 ND2 ASN B 125 -2.922 2.498 -7.384 1.00 0.00 N flip ATOM 0 H ASN B 125 -1.599 5.109 -4.519 1.00 0.00 H new ATOM 0 HA ASN B 125 -3.468 4.766 -6.727 1.00 0.00 H new ATOM 0 HB2 ASN B 125 -2.296 3.143 -4.680 1.00 0.00 H new ATOM 0 HB3 ASN B 125 -4.026 3.149 -4.401 1.00 0.00 H new ATOM 0 HD21 ASN B 125 -2.354 3.330 -7.546 1.00 0.00 H new ATOM 0 HD22 ASN B 125 -3.056 1.818 -8.132 1.00 0.00 H new ATOM 3962 N LEU B 126 -4.958 6.553 -5.635 1.00 0.00 N ATOM 3963 CA LEU B 126 -6.088 7.327 -5.133 1.00 0.00 C ATOM 3964 C LEU B 126 -7.396 6.572 -5.338 1.00 0.00 C ATOM 3965 O LEU B 126 -7.623 6.077 -6.463 1.00 0.00 O ATOM 3966 CB LEU B 126 -6.153 8.687 -5.832 1.00 0.00 C ATOM 3967 CG LEU B 126 -5.061 9.680 -5.425 1.00 0.00 C ATOM 3968 CD1 LEU B 126 -5.038 10.868 -6.374 1.00 0.00 C ATOM 3969 CD2 LEU B 126 -5.270 10.145 -3.992 1.00 0.00 C ATOM 3970 OXT LEU B 126 -8.184 6.482 -4.374 1.00 0.00 O ATOM 0 H LEU B 126 -4.547 6.917 -6.495 1.00 0.00 H new ATOM 0 HA LEU B 126 -5.944 7.484 -4.064 1.00 0.00 H new ATOM 0 HB2 LEU B 126 -6.094 8.528 -6.909 1.00 0.00 H new ATOM 0 HB3 LEU B 126 -7.125 9.136 -5.629 1.00 0.00 H new ATOM 0 HG LEU B 126 -4.097 9.174 -5.485 1.00 0.00 H new ATOM 0 HD11 LEU B 126 -4.256 11.563 -6.068 1.00 0.00 H new ATOM 0 HD12 LEU B 126 -4.839 10.520 -7.388 1.00 0.00 H new ATOM 0 HD13 LEU B 126 -6.003 11.374 -6.347 1.00 0.00 H new ATOM 0 HD21 LEU B 126 -4.485 10.850 -3.720 1.00 0.00 H new ATOM 0 HD22 LEU B 126 -6.241 10.632 -3.906 1.00 0.00 H new ATOM 0 HD23 LEU B 126 -5.234 9.286 -3.322 1.00 0.00 H new TER 3982 LEU B 126