USER MOD reduce.3.24.130724 H: found=0, std=0, add=1747, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1749 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 88 MET CE :methyl -139:sc= -0.221 (180deg=-0.814) USER MOD Set 1.2: B 90 THR OG1 : rot 124:sc= 1.2 USER MOD Set 1.3: B 110 ASN : amide:sc= -0.139 K(o=0.84,f=-1.8) USER MOD Set 2.1: B 16 HIS : no HE2:sc= 1.63 K(o=4.8,f=-16!) USER MOD Set 2.2: B 92 SER OG : rot -69:sc= 1.4 USER MOD Set 2.3: B 108 CYS SG : rot 137:sc= 1.73 USER MOD Set 3.1: B 73 SER OG : rot 180:sc= 1.05 USER MOD Set 3.2: B 91 SER OG : rot -82:sc= 1.2 USER MOD Set 4.1: A 14 SER OG : rot -73:sc= 0.316 USER MOD Set 4.2: A 90 THR OG1 : rot -64:sc= 0.592 USER MOD Set 4.3: A 110 ASN : amide:sc= 1.12 K(o=2,f=-2.6!) USER MOD Set 5.1: A 35 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 83 GLN : amide:sc= 0.915 K(o=0.92,f=-6.2!) USER MOD Set 6.1: A 16 HIS : no HE2:sc= 1.89 K(o=4.6,f=-17!) USER MOD Set 6.2: A 92 SER OG : rot -67:sc= 1.35 USER MOD Set 6.3: A 108 CYS SG : rot 113:sc= 1.36 USER MOD Set 7.1: A 8 GLN : amide:sc= 1.09 K(o=2.3,f=-3.9!) USER MOD Set 7.2: B 70 GLN : amide:sc= 1.18 K(o=2.3,f=-7.6!) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 17 ASN : amide:sc= 0.624 K(o=0.62,f=-8.7!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 HIS : no HE2:sc= -1.33 K(o=-1.3,f=-4.3!) USER MOD Single : A 29 CYS SG : rot 87:sc= 0.954 USER MOD Single : A 32 THR OG1 : rot 71:sc= 0.659 USER MOD Single : A 36 GLN :FLIP amide:sc= -0.0636 F(o=-2.4!,f=-0.064) USER MOD Single : A 38 GLN : amide:sc= -1.74! C(o=-1.7!,f=-3.5!) USER MOD Single : A 43 LYS NZ :NH3+ 160:sc= 0.982 (180deg=0.553) USER MOD Single : A 44 ASN : amide:sc= 0.35 X(o=0.35,f=0) USER MOD Single : A 49 CYS SG : rot 80:sc= 0.293 USER MOD Single : A 50 HIS : no HE2:sc= 0.142 K(o=0.14,f=-5.8!) USER MOD Single : A 54 GLN : amide:sc= -0.279 K(o=-0.28,f=-2.5) USER MOD Single : A 55 GLN : amide:sc= -0.337 K(o=-0.34,f=-1) USER MOD Single : A 60 SER OG : rot 80:sc= 1.25 USER MOD Single : A 62 GLN :FLIP amide:sc= -0.126 F(o=-0.76,f=-0.13) USER MOD Single : A 63 GLN : amide:sc= 1.04 K(o=1,f=-1.2!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ -121:sc= 0.237 (180deg=-1.51!) USER MOD Single : A 70 GLN : amide:sc= -0.0549 K(o=-0.055,f=-3.7!) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 173:sc= 0 (180deg=-0.087) USER MOD Single : A 80 SER OG : rot 180:sc= -0.659! USER MOD Single : A 81 LYS NZ :NH3+ -166:sc= 1.18 (180deg=0.651) USER MOD Single : A 82 ASN : amide:sc= 0.983 K(o=0.98,f=-0.048) USER MOD Single : A 88 MET CE :methyl -151:sc= -0.271 (180deg=-0.324) USER MOD Single : A 91 SER OG : rot 71:sc= 1.33 USER MOD Single : A 94 THR OG1 : rot -134:sc= 0.924 USER MOD Single : A 96 GLN : amide:sc= 1.16 K(o=1.2,f=-2.3!) USER MOD Single : A 97 ASN : amide:sc= 2.25 K(o=2.3,f=-0.18) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot -113:sc= 0.638 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot -113:sc= 1.26 USER MOD Single : A 112 ASN : amide:sc= 0.531 K(o=0.53,f=-0.98) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 CYS SG : rot 180:sc= 0 USER MOD Single : B 8 GLN : amide:sc= 0.358 K(o=0.36,f=-5.2!) USER MOD Single : B 10 THR OG1 : rot 180:sc= 0.111 USER MOD Single : B 14 SER OG : rot -80:sc= 0.868 USER MOD Single : B 17 ASN : amide:sc= 1.32 K(o=1.3,f=-7.6!) USER MOD Single : B 23 THR OG1 : rot 180:sc= 0 USER MOD Single : B 27 HIS : no HD1:sc= -0.255 X(o=-0.26,f=-0.014) USER MOD Single : B 29 CYS SG : rot 93:sc= 1.01 USER MOD Single : B 32 THR OG1 : rot 76:sc= 1.09 USER MOD Single : B 35 TYR OH : rot -91:sc= 0.436 USER MOD Single : B 36 GLN : amide:sc= -0.13 K(o=-0.13,f=-2.3!) USER MOD Single : B 38 GLN : amide:sc= 0.64 K(o=0.64,f=-6.8!) USER MOD Single : B 43 LYS NZ :NH3+ -144:sc= 0.0694! (180deg=-3.62!) USER MOD Single : B 44 ASN : amide:sc= 0.495 X(o=0.5,f=0.048) USER MOD Single : B 49 CYS SG : rot 73:sc= -0.137 USER MOD Single : B 50 HIS : no HE2:sc= 0.287 K(o=0.29,f=-5.1!) USER MOD Single : B 54 GLN : amide:sc= -0.0929 K(o=-0.093,f=-2.6!) USER MOD Single : B 55 GLN : amide:sc= -0.299 K(o=-0.3,f=-8.6!) USER MOD Single : B 60 SER OG : rot 65:sc= 1.23 USER MOD Single : B 62 GLN :FLIP amide:sc= -0.0793 F(o=-1.5!,f=-0.079) USER MOD Single : B 63 GLN : amide:sc= 0.82 K(o=0.82,f=-0.95) USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 LYS NZ :NH3+ 147:sc= 1.67 (180deg=0.83) USER MOD Single : B 75 MET CE :methyl 175:sc= -0.261 (180deg=-0.387) USER MOD Single : B 80 SER OG : rot 177:sc= 0.389 USER MOD Single : B 81 LYS NZ :NH3+ -157:sc= 1.25 (180deg=1.12) USER MOD Single : B 82 ASN : amide:sc= 1.23 K(o=1.2,f=-0.11) USER MOD Single : B 83 GLN : amide:sc= -0.0261 K(o=-0.026,f=-2.3!) USER MOD Single : B 94 THR OG1 : rot -156:sc= 0.35 USER MOD Single : B 96 GLN : amide:sc= -0.237 K(o=-0.24,f=-1) USER MOD Single : B 97 ASN : amide:sc= -2.42 K(o=-2.4,f=-3.8!) USER MOD Single : B 99 TYR OH : rot 180:sc= 0 USER MOD Single : B 100 SER OG : rot 89:sc= 1.03 USER MOD Single : B 105 TYR OH : rot -96:sc= 1.07 USER MOD Single : B 109 THR OG1 : rot 76:sc= 0.563 USER MOD Single : B 111 THR OG1 : rot 74:sc= 0.449 USER MOD Single : B 112 ASN :FLIP amide:sc= -0.211 F(o=-1.7!,f=-0.21) USER MOD Single : B 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 12 N GLN A 8 1.782 -2.827 -13.352 1.00 13.72 N ATOM 13 CA GLN A 8 0.967 -2.366 -12.244 1.00 13.30 C ATOM 14 C GLN A 8 0.651 -3.531 -11.315 1.00 12.74 C ATOM 15 O GLN A 8 0.018 -4.506 -11.724 1.00 12.41 O ATOM 16 CB GLN A 8 -0.327 -1.727 -12.751 1.00 13.55 C ATOM 17 CG GLN A 8 -0.105 -0.629 -13.778 1.00 14.28 C ATOM 18 CD GLN A 8 0.735 0.514 -13.240 1.00 14.71 C ATOM 19 OE1 GLN A 8 0.661 0.854 -12.061 1.00 14.83 O ATOM 20 NE2 GLN A 8 1.539 1.115 -14.099 1.00 15.08 N ATOM 0 HA GLN A 8 1.526 -1.610 -11.692 1.00 13.30 H new ATOM 0 HB2 GLN A 8 -0.956 -2.501 -13.190 1.00 13.55 H new ATOM 0 HB3 GLN A 8 -0.874 -1.314 -11.903 1.00 13.55 H new ATOM 0 HG2 GLN A 8 0.383 -1.052 -14.656 1.00 14.28 H new ATOM 0 HG3 GLN A 8 -1.070 -0.243 -14.105 1.00 14.28 H new ATOM 0 HE21 GLN A 8 1.572 0.804 -15.070 1.00 15.08 H new ATOM 0 HE22 GLN A 8 2.126 1.890 -13.791 1.00 15.08 H new ATOM 29 N PRO A 9 1.108 -3.454 -10.059 1.00 12.79 N ATOM 30 CA PRO A 9 0.878 -4.506 -9.072 1.00 12.47 C ATOM 31 C PRO A 9 -0.573 -4.551 -8.607 1.00 11.53 C ATOM 32 O PRO A 9 -1.282 -3.542 -8.654 1.00 11.34 O ATOM 33 CB PRO A 9 1.796 -4.113 -7.912 1.00 12.83 C ATOM 34 CG PRO A 9 1.949 -2.637 -8.034 1.00 13.43 C ATOM 35 CD PRO A 9 1.878 -2.329 -9.503 1.00 13.37 C ATOM 0 HA PRO A 9 1.082 -5.497 -9.477 1.00 12.47 H new ATOM 0 HB2 PRO A 9 1.360 -4.388 -6.952 1.00 12.83 H new ATOM 0 HB3 PRO A 9 2.759 -4.618 -7.981 1.00 12.83 H new ATOM 0 HG2 PRO A 9 1.161 -2.117 -7.489 1.00 13.43 H new ATOM 0 HG3 PRO A 9 2.899 -2.308 -7.613 1.00 13.43 H new ATOM 0 HD2 PRO A 9 1.384 -1.375 -9.689 1.00 13.37 H new ATOM 0 HD3 PRO A 9 2.871 -2.265 -9.947 1.00 13.37 H new ATOM 43 N THR A 10 -1.004 -5.720 -8.156 1.00 11.09 N ATOM 44 CA THR A 10 -2.364 -5.905 -7.672 1.00 10.34 C ATOM 45 C THR A 10 -2.499 -5.384 -6.242 1.00 9.71 C ATOM 46 O THR A 10 -2.906 -6.107 -5.328 1.00 9.71 O ATOM 47 CB THR A 10 -2.760 -7.390 -7.726 1.00 10.40 C ATOM 48 OG1 THR A 10 -1.591 -8.210 -7.583 1.00 11.09 O ATOM 49 CG2 THR A 10 -3.451 -7.717 -9.039 1.00 10.67 C ATOM 0 H THR A 10 -0.427 -6.560 -8.115 1.00 11.09 H new ATOM 0 HA THR A 10 -3.034 -5.339 -8.319 1.00 10.34 H new ATOM 0 HB THR A 10 -3.452 -7.591 -6.908 1.00 10.40 H new ATOM 0 HG1 THR A 10 -1.848 -9.155 -7.616 1.00 11.09 H new ATOM 0 HG21 THR A 10 -3.722 -8.773 -9.055 1.00 10.67 H new ATOM 0 HG22 THR A 10 -4.351 -7.110 -9.138 1.00 10.67 H new ATOM 0 HG23 THR A 10 -2.777 -7.503 -9.868 1.00 10.67 H new ATOM 57 N GLU A 11 -2.150 -4.118 -6.071 1.00 9.37 N ATOM 58 CA GLU A 11 -2.189 -3.458 -4.779 1.00 9.01 C ATOM 59 C GLU A 11 -2.291 -1.955 -4.995 1.00 8.63 C ATOM 60 O GLU A 11 -1.399 -1.352 -5.596 1.00 9.08 O ATOM 61 CB GLU A 11 -0.924 -3.808 -3.991 1.00 9.39 C ATOM 62 CG GLU A 11 -0.948 -3.357 -2.545 1.00 9.30 C ATOM 63 CD GLU A 11 -0.173 -4.286 -1.635 1.00 10.28 C ATOM 64 OE1 GLU A 11 0.707 -5.026 -2.125 1.00 10.48 O ATOM 65 OE2 GLU A 11 -0.453 -4.290 -0.420 1.00 10.59 O ATOM 0 H GLU A 11 -1.830 -3.518 -6.831 1.00 9.37 H new ATOM 0 HA GLU A 11 -3.055 -3.793 -4.209 1.00 9.01 H new ATOM 0 HB2 GLU A 11 -0.778 -4.888 -4.021 1.00 9.39 H new ATOM 0 HB3 GLU A 11 -0.064 -3.357 -4.486 1.00 9.39 H new ATOM 0 HG2 GLU A 11 -0.531 -2.353 -2.474 1.00 9.30 H new ATOM 0 HG3 GLU A 11 -1.981 -3.298 -2.203 1.00 9.30 H new ATOM 72 N PHE A 12 -3.378 -1.350 -4.531 1.00 8.06 N ATOM 73 CA PHE A 12 -3.574 0.083 -4.715 1.00 8.00 C ATOM 74 C PHE A 12 -4.190 0.743 -3.485 1.00 7.20 C ATOM 75 O PHE A 12 -4.778 0.079 -2.626 1.00 6.96 O ATOM 76 CB PHE A 12 -4.444 0.352 -5.952 1.00 8.48 C ATOM 77 CG PHE A 12 -5.830 -0.235 -5.893 1.00 7.99 C ATOM 78 CD1 PHE A 12 -6.042 -1.576 -6.171 1.00 8.45 C ATOM 79 CD2 PHE A 12 -6.920 0.557 -5.575 1.00 7.85 C ATOM 80 CE1 PHE A 12 -7.313 -2.116 -6.129 1.00 8.74 C ATOM 81 CE2 PHE A 12 -8.195 0.022 -5.535 1.00 8.21 C ATOM 82 CZ PHE A 12 -8.392 -1.316 -5.812 1.00 8.93 C ATOM 0 H PHE A 12 -4.130 -1.823 -4.030 1.00 8.06 H new ATOM 0 HA PHE A 12 -2.589 0.525 -4.865 1.00 8.00 H new ATOM 0 HB2 PHE A 12 -4.527 1.430 -6.092 1.00 8.48 H new ATOM 0 HB3 PHE A 12 -3.934 -0.045 -6.830 1.00 8.48 H new ATOM 0 HD1 PHE A 12 -5.203 -2.207 -6.424 1.00 8.45 H new ATOM 0 HD2 PHE A 12 -6.773 1.604 -5.356 1.00 7.85 H new ATOM 0 HE1 PHE A 12 -7.462 -3.164 -6.344 1.00 8.74 H new ATOM 0 HE2 PHE A 12 -9.037 0.651 -5.287 1.00 8.21 H new ATOM 0 HZ PHE A 12 -9.387 -1.735 -5.781 1.00 8.93 H new ATOM 92 N ILE A 13 -4.062 2.063 -3.421 1.00 7.08 N ATOM 93 CA ILE A 13 -4.584 2.842 -2.310 1.00 6.69 C ATOM 94 C ILE A 13 -5.979 3.368 -2.626 1.00 5.92 C ATOM 95 O ILE A 13 -6.191 4.026 -3.643 1.00 5.90 O ATOM 96 CB ILE A 13 -3.650 4.033 -1.988 1.00 7.52 C ATOM 97 CG1 ILE A 13 -2.280 3.530 -1.523 1.00 8.17 C ATOM 98 CG2 ILE A 13 -4.268 4.950 -0.939 1.00 7.63 C ATOM 99 CD1 ILE A 13 -2.327 2.727 -0.242 1.00 8.66 C ATOM 0 H ILE A 13 -3.595 2.620 -4.136 1.00 7.08 H new ATOM 0 HA ILE A 13 -4.638 2.184 -1.443 1.00 6.69 H new ATOM 0 HB ILE A 13 -3.516 4.612 -2.902 1.00 7.52 H new ATOM 0 HG12 ILE A 13 -1.843 2.916 -2.310 1.00 8.17 H new ATOM 0 HG13 ILE A 13 -1.619 4.385 -1.381 1.00 8.17 H new ATOM 0 HG21 ILE A 13 -3.589 5.777 -0.733 1.00 7.63 H new ATOM 0 HG22 ILE A 13 -5.215 5.342 -1.311 1.00 7.63 H new ATOM 0 HG23 ILE A 13 -4.443 4.388 -0.022 1.00 7.63 H new ATOM 0 HD11 ILE A 13 -1.320 2.406 0.023 1.00 8.66 H new ATOM 0 HD12 ILE A 13 -2.734 3.344 0.559 1.00 8.66 H new ATOM 0 HD13 ILE A 13 -2.961 1.852 -0.384 1.00 8.66 H new ATOM 111 N SER A 14 -6.930 3.065 -1.757 1.00 5.60 N ATOM 112 CA SER A 14 -8.296 3.514 -1.944 1.00 5.30 C ATOM 113 C SER A 14 -8.709 4.483 -0.836 1.00 5.64 C ATOM 114 O SER A 14 -8.935 4.077 0.308 1.00 6.11 O ATOM 115 CB SER A 14 -9.235 2.313 -1.971 1.00 5.40 C ATOM 116 OG SER A 14 -8.666 1.249 -2.713 1.00 5.67 O ATOM 0 H SER A 14 -6.779 2.509 -0.915 1.00 5.60 H new ATOM 0 HA SER A 14 -8.360 4.042 -2.896 1.00 5.30 H new ATOM 0 HB2 SER A 14 -9.441 1.983 -0.953 1.00 5.40 H new ATOM 0 HB3 SER A 14 -10.189 2.601 -2.412 1.00 5.40 H new ATOM 0 HG SER A 14 -8.698 1.463 -3.669 1.00 5.67 H new ATOM 122 N ARG A 15 -8.784 5.761 -1.177 1.00 5.77 N ATOM 123 CA ARG A 15 -9.183 6.788 -0.224 1.00 6.44 C ATOM 124 C ARG A 15 -10.695 6.960 -0.274 1.00 6.84 C ATOM 125 O ARG A 15 -11.237 7.413 -1.282 1.00 7.10 O ATOM 126 CB ARG A 15 -8.491 8.121 -0.543 1.00 6.76 C ATOM 127 CG ARG A 15 -7.124 8.285 0.106 1.00 7.07 C ATOM 128 CD ARG A 15 -6.317 9.384 -0.572 1.00 7.39 C ATOM 129 NE ARG A 15 -5.549 10.195 0.380 1.00 8.02 N ATOM 130 CZ ARG A 15 -4.225 10.353 0.338 1.00 8.40 C ATOM 131 NH1 ARG A 15 -3.502 9.713 -0.570 1.00 8.31 N ATOM 132 NH2 ARG A 15 -3.628 11.155 1.208 1.00 9.09 N ATOM 0 H ARG A 15 -8.573 6.113 -2.111 1.00 5.77 H new ATOM 0 HA ARG A 15 -8.883 6.479 0.777 1.00 6.44 H new ATOM 0 HB2 ARG A 15 -8.381 8.211 -1.624 1.00 6.76 H new ATOM 0 HB3 ARG A 15 -9.135 8.939 -0.219 1.00 6.76 H new ATOM 0 HG2 ARG A 15 -7.247 8.521 1.163 1.00 7.07 H new ATOM 0 HG3 ARG A 15 -6.578 7.343 0.051 1.00 7.07 H new ATOM 0 HD2 ARG A 15 -5.634 8.935 -1.293 1.00 7.39 H new ATOM 0 HD3 ARG A 15 -6.992 10.031 -1.132 1.00 7.39 H new ATOM 0 HE ARG A 15 -6.062 10.669 1.123 1.00 8.02 H new ATOM 0 HH11 ARG A 15 -3.958 9.095 -1.242 1.00 8.31 H new ATOM 0 HH12 ARG A 15 -2.490 9.838 -0.597 1.00 8.31 H new ATOM 0 HH21 ARG A 15 -4.181 11.650 1.908 1.00 9.09 H new ATOM 0 HH22 ARG A 15 -2.616 11.277 1.178 1.00 9.09 H new ATOM 146 N HIS A 16 -11.375 6.587 0.800 1.00 7.25 N ATOM 147 CA HIS A 16 -12.829 6.692 0.850 1.00 8.00 C ATOM 148 C HIS A 16 -13.293 7.188 2.211 1.00 8.80 C ATOM 149 O HIS A 16 -12.563 7.082 3.196 1.00 9.25 O ATOM 150 CB HIS A 16 -13.480 5.335 0.538 1.00 7.87 C ATOM 151 CG HIS A 16 -13.182 4.265 1.548 1.00 8.55 C ATOM 152 ND1 HIS A 16 -13.826 4.175 2.764 1.00 8.91 N ATOM 153 CD2 HIS A 16 -12.306 3.230 1.514 1.00 9.13 C ATOM 154 CE1 HIS A 16 -13.358 3.141 3.434 1.00 9.65 C ATOM 155 NE2 HIS A 16 -12.437 2.549 2.699 1.00 9.79 N ATOM 0 H HIS A 16 -10.947 6.210 1.646 1.00 7.25 H new ATOM 0 HA HIS A 16 -13.137 7.415 0.094 1.00 8.00 H new ATOM 0 HB2 HIS A 16 -14.560 5.468 0.474 1.00 7.87 H new ATOM 0 HB3 HIS A 16 -13.142 4.999 -0.442 1.00 7.87 H new ATOM 0 HD1 HIS A 16 -14.552 4.811 3.094 1.00 8.91 H new ATOM 0 HD2 HIS A 16 -11.632 2.987 0.706 1.00 9.13 H new ATOM 0 HE1 HIS A 16 -13.675 2.831 4.419 1.00 9.65 H new ATOM 164 N ASN A 17 -14.509 7.712 2.265 1.00 9.21 N ATOM 165 CA ASN A 17 -15.064 8.210 3.515 1.00 10.20 C ATOM 166 C ASN A 17 -15.550 7.043 4.381 1.00 10.40 C ATOM 167 O ASN A 17 -15.526 5.887 3.946 1.00 10.47 O ATOM 168 CB ASN A 17 -16.183 9.238 3.250 1.00 11.03 C ATOM 169 CG ASN A 17 -17.576 8.644 3.135 1.00 11.85 C ATOM 170 OD1 ASN A 17 -17.767 7.540 2.620 1.00 11.82 O ATOM 171 ND2 ASN A 17 -18.564 9.379 3.625 1.00 12.69 N ATOM 0 H ASN A 17 -15.129 7.803 1.460 1.00 9.21 H new ATOM 0 HA ASN A 17 -14.280 8.728 4.067 1.00 10.20 H new ATOM 0 HB2 ASN A 17 -16.181 9.972 4.055 1.00 11.03 H new ATOM 0 HB3 ASN A 17 -15.954 9.774 2.329 1.00 11.03 H new ATOM 0 HD21 ASN A 17 -19.524 9.036 3.584 1.00 12.69 H new ATOM 0 HD22 ASN A 17 -18.365 10.288 4.043 1.00 12.69 H new ATOM 178 N ILE A 18 -15.985 7.351 5.598 1.00 10.70 N ATOM 179 CA ILE A 18 -16.452 6.338 6.552 1.00 11.18 C ATOM 180 C ILE A 18 -17.607 5.485 6.012 1.00 11.08 C ATOM 181 O ILE A 18 -17.765 4.329 6.406 1.00 11.25 O ATOM 182 CB ILE A 18 -16.881 6.988 7.886 1.00 12.00 C ATOM 183 CG1 ILE A 18 -17.837 8.162 7.630 1.00 12.63 C ATOM 184 CG2 ILE A 18 -15.656 7.446 8.666 1.00 12.34 C ATOM 185 CD1 ILE A 18 -18.321 8.846 8.893 1.00 13.58 C ATOM 0 H ILE A 18 -16.026 8.306 5.955 1.00 10.70 H new ATOM 0 HA ILE A 18 -15.602 5.676 6.717 1.00 11.18 H new ATOM 0 HB ILE A 18 -17.410 6.245 8.483 1.00 12.00 H new ATOM 0 HG12 ILE A 18 -17.335 8.896 7.000 1.00 12.63 H new ATOM 0 HG13 ILE A 18 -18.700 7.800 7.071 1.00 12.63 H new ATOM 0 HG21 ILE A 18 -15.972 7.902 9.604 1.00 12.34 H new ATOM 0 HG22 ILE A 18 -15.017 6.588 8.877 1.00 12.34 H new ATOM 0 HG23 ILE A 18 -15.101 8.176 8.076 1.00 12.34 H new ATOM 0 HD11 ILE A 18 -18.991 9.664 8.630 1.00 13.58 H new ATOM 0 HD12 ILE A 18 -18.853 8.127 9.515 1.00 13.58 H new ATOM 0 HD13 ILE A 18 -17.467 9.240 9.444 1.00 13.58 H new ATOM 197 N GLU A 19 -18.403 6.045 5.109 1.00 10.98 N ATOM 198 CA GLU A 19 -19.542 5.321 4.538 1.00 11.15 C ATOM 199 C GLU A 19 -19.101 4.374 3.429 1.00 10.09 C ATOM 200 O GLU A 19 -19.832 3.461 3.044 1.00 10.09 O ATOM 201 CB GLU A 19 -20.578 6.302 4.002 1.00 12.03 C ATOM 202 CG GLU A 19 -21.145 7.213 5.071 1.00 13.15 C ATOM 203 CD GLU A 19 -21.960 8.346 4.492 1.00 13.37 C ATOM 204 OE1 GLU A 19 -21.367 9.382 4.134 1.00 13.50 O ATOM 205 OE2 GLU A 19 -23.197 8.210 4.402 1.00 13.85 O ATOM 0 H GLU A 19 -18.285 6.994 4.755 1.00 10.98 H new ATOM 0 HA GLU A 19 -19.989 4.725 5.334 1.00 11.15 H new ATOM 0 HB2 GLU A 19 -20.123 6.910 3.220 1.00 12.03 H new ATOM 0 HB3 GLU A 19 -21.392 5.744 3.540 1.00 12.03 H new ATOM 0 HG2 GLU A 19 -21.769 6.629 5.748 1.00 13.15 H new ATOM 0 HG3 GLU A 19 -20.328 7.623 5.665 1.00 13.15 H new ATOM 212 N GLY A 20 -17.906 4.601 2.908 1.00 9.38 N ATOM 213 CA GLY A 20 -17.390 3.752 1.857 1.00 8.49 C ATOM 214 C GLY A 20 -17.320 4.453 0.519 1.00 8.41 C ATOM 215 O GLY A 20 -16.895 3.855 -0.468 1.00 8.52 O ATOM 0 H GLY A 20 -17.285 5.358 3.194 1.00 9.38 H new ATOM 0 HA2 GLY A 20 -16.394 3.405 2.133 1.00 8.49 H new ATOM 0 HA3 GLY A 20 -18.022 2.869 1.767 1.00 8.49 H new ATOM 219 N ILE A 21 -17.727 5.715 0.490 1.00 8.47 N ATOM 220 CA ILE A 21 -17.704 6.500 -0.737 1.00 8.70 C ATOM 221 C ILE A 21 -16.268 6.859 -1.090 1.00 8.24 C ATOM 222 O ILE A 21 -15.579 7.525 -0.315 1.00 8.70 O ATOM 223 CB ILE A 21 -18.538 7.795 -0.596 1.00 9.49 C ATOM 224 CG1 ILE A 21 -19.999 7.464 -0.273 1.00 10.11 C ATOM 225 CG2 ILE A 21 -18.452 8.634 -1.864 1.00 9.59 C ATOM 226 CD1 ILE A 21 -20.737 6.797 -1.412 1.00 10.74 C ATOM 0 H ILE A 21 -18.078 6.218 1.305 1.00 8.47 H new ATOM 0 HA ILE A 21 -18.144 5.896 -1.530 1.00 8.70 H new ATOM 0 HB ILE A 21 -18.124 8.376 0.228 1.00 9.49 H new ATOM 0 HG12 ILE A 21 -20.030 6.812 0.600 1.00 10.11 H new ATOM 0 HG13 ILE A 21 -20.519 8.383 -0.003 1.00 10.11 H new ATOM 0 HG21 ILE A 21 -19.046 9.540 -1.742 1.00 9.59 H new ATOM 0 HG22 ILE A 21 -17.413 8.904 -2.052 1.00 9.59 H new ATOM 0 HG23 ILE A 21 -18.835 8.059 -2.707 1.00 9.59 H new ATOM 0 HD11 ILE A 21 -21.764 6.593 -1.110 1.00 10.74 H new ATOM 0 HD12 ILE A 21 -20.738 7.456 -2.280 1.00 10.74 H new ATOM 0 HD13 ILE A 21 -20.241 5.861 -1.668 1.00 10.74 H new ATOM 238 N PHE A 22 -15.815 6.396 -2.243 1.00 7.56 N ATOM 239 CA PHE A 22 -14.451 6.652 -2.687 1.00 7.35 C ATOM 240 C PHE A 22 -14.253 8.102 -3.109 1.00 7.07 C ATOM 241 O PHE A 22 -14.977 8.621 -3.962 1.00 7.53 O ATOM 242 CB PHE A 22 -14.083 5.724 -3.841 1.00 7.50 C ATOM 243 CG PHE A 22 -13.944 4.285 -3.434 1.00 8.14 C ATOM 244 CD1 PHE A 22 -12.734 3.798 -2.971 1.00 8.60 C ATOM 245 CD2 PHE A 22 -15.023 3.423 -3.517 1.00 8.51 C ATOM 246 CE1 PHE A 22 -12.604 2.475 -2.598 1.00 9.42 C ATOM 247 CE2 PHE A 22 -14.898 2.099 -3.146 1.00 9.27 C ATOM 248 CZ PHE A 22 -13.686 1.625 -2.687 1.00 9.73 C ATOM 0 H PHE A 22 -16.372 5.839 -2.891 1.00 7.56 H new ATOM 0 HA PHE A 22 -13.794 6.456 -1.840 1.00 7.35 H new ATOM 0 HB2 PHE A 22 -14.845 5.802 -4.616 1.00 7.50 H new ATOM 0 HB3 PHE A 22 -13.145 6.061 -4.282 1.00 7.50 H new ATOM 0 HD1 PHE A 22 -11.883 4.459 -2.901 1.00 8.60 H new ATOM 0 HD2 PHE A 22 -15.973 3.790 -3.876 1.00 8.51 H new ATOM 0 HE1 PHE A 22 -11.655 2.106 -2.237 1.00 9.42 H new ATOM 0 HE2 PHE A 22 -15.747 1.435 -3.215 1.00 9.27 H new ATOM 0 HZ PHE A 22 -13.585 0.589 -2.398 1.00 9.73 H new ATOM 258 N THR A 23 -13.270 8.741 -2.497 1.00 6.58 N ATOM 259 CA THR A 23 -12.938 10.125 -2.792 1.00 6.57 C ATOM 260 C THR A 23 -11.776 10.186 -3.779 1.00 5.83 C ATOM 261 O THR A 23 -11.657 11.125 -4.566 1.00 5.91 O ATOM 262 CB THR A 23 -12.555 10.875 -1.504 1.00 7.05 C ATOM 263 OG1 THR A 23 -13.287 10.326 -0.397 1.00 7.33 O ATOM 264 CG2 THR A 23 -12.846 12.362 -1.627 1.00 7.74 C ATOM 0 H THR A 23 -12.680 8.315 -1.782 1.00 6.58 H new ATOM 0 HA THR A 23 -13.814 10.601 -3.232 1.00 6.57 H new ATOM 0 HB THR A 23 -11.485 10.753 -1.338 1.00 7.05 H new ATOM 0 HG1 THR A 23 -13.043 10.801 0.425 1.00 7.33 H new ATOM 0 HG21 THR A 23 -12.565 12.865 -0.702 1.00 7.74 H new ATOM 0 HG22 THR A 23 -12.272 12.778 -2.455 1.00 7.74 H new ATOM 0 HG23 THR A 23 -13.910 12.510 -1.812 1.00 7.74 H new ATOM 272 N PHE A 24 -10.923 9.170 -3.728 1.00 5.35 N ATOM 273 CA PHE A 24 -9.770 9.082 -4.614 1.00 4.99 C ATOM 274 C PHE A 24 -9.302 7.637 -4.718 1.00 4.39 C ATOM 275 O PHE A 24 -9.039 6.986 -3.703 1.00 4.25 O ATOM 276 CB PHE A 24 -8.630 9.969 -4.103 1.00 5.47 C ATOM 277 CG PHE A 24 -7.622 10.309 -5.161 1.00 5.80 C ATOM 278 CD1 PHE A 24 -7.946 11.187 -6.180 1.00 5.92 C ATOM 279 CD2 PHE A 24 -6.355 9.750 -5.138 1.00 6.29 C ATOM 280 CE1 PHE A 24 -7.025 11.503 -7.159 1.00 6.43 C ATOM 281 CE2 PHE A 24 -5.429 10.063 -6.114 1.00 6.89 C ATOM 282 CZ PHE A 24 -5.766 10.940 -7.126 1.00 6.92 C ATOM 0 H PHE A 24 -11.010 8.390 -3.077 1.00 5.35 H new ATOM 0 HA PHE A 24 -10.064 9.433 -5.603 1.00 4.99 H new ATOM 0 HB2 PHE A 24 -9.049 10.891 -3.701 1.00 5.47 H new ATOM 0 HB3 PHE A 24 -8.126 9.462 -3.280 1.00 5.47 H new ATOM 0 HD1 PHE A 24 -8.930 11.630 -6.210 1.00 5.92 H new ATOM 0 HD2 PHE A 24 -6.088 9.062 -4.349 1.00 6.29 H new ATOM 0 HE1 PHE A 24 -7.290 12.190 -7.949 1.00 6.43 H new ATOM 0 HE2 PHE A 24 -4.443 9.623 -6.086 1.00 6.89 H new ATOM 0 HZ PHE A 24 -5.044 11.185 -7.891 1.00 6.92 H new ATOM 292 N VAL A 25 -9.206 7.135 -5.941 1.00 4.43 N ATOM 293 CA VAL A 25 -8.782 5.759 -6.172 1.00 4.39 C ATOM 294 C VAL A 25 -7.501 5.713 -7.000 1.00 4.75 C ATOM 295 O VAL A 25 -7.368 6.434 -7.992 1.00 5.12 O ATOM 296 CB VAL A 25 -9.878 4.945 -6.895 1.00 5.05 C ATOM 297 CG1 VAL A 25 -9.565 3.457 -6.853 1.00 5.18 C ATOM 298 CG2 VAL A 25 -11.246 5.218 -6.289 1.00 6.02 C ATOM 0 H VAL A 25 -9.416 7.660 -6.790 1.00 4.43 H new ATOM 0 HA VAL A 25 -8.597 5.315 -5.194 1.00 4.39 H new ATOM 0 HB VAL A 25 -9.896 5.262 -7.938 1.00 5.05 H new ATOM 0 HG11 VAL A 25 -10.351 2.905 -7.368 1.00 5.18 H new ATOM 0 HG12 VAL A 25 -8.610 3.272 -7.344 1.00 5.18 H new ATOM 0 HG13 VAL A 25 -9.510 3.126 -5.816 1.00 5.18 H new ATOM 0 HG21 VAL A 25 -12.000 4.633 -6.815 1.00 6.02 H new ATOM 0 HG22 VAL A 25 -11.240 4.938 -5.236 1.00 6.02 H new ATOM 0 HG23 VAL A 25 -11.480 6.279 -6.381 1.00 6.02 H new ATOM 308 N ASP A 26 -6.561 4.877 -6.573 1.00 5.07 N ATOM 309 CA ASP A 26 -5.291 4.709 -7.272 1.00 5.85 C ATOM 310 C ASP A 26 -5.534 4.076 -8.639 1.00 6.77 C ATOM 311 O ASP A 26 -6.344 3.157 -8.763 1.00 6.87 O ATOM 312 CB ASP A 26 -4.359 3.819 -6.446 1.00 5.75 C ATOM 313 CG ASP A 26 -2.923 3.838 -6.927 1.00 6.66 C ATOM 314 OD1 ASP A 26 -2.663 3.433 -8.078 1.00 7.31 O ATOM 315 OD2 ASP A 26 -2.042 4.226 -6.135 1.00 6.95 O ATOM 0 H ASP A 26 -6.656 4.300 -5.738 1.00 5.07 H new ATOM 0 HA ASP A 26 -4.825 5.685 -7.408 1.00 5.85 H new ATOM 0 HB2 ASP A 26 -4.390 4.141 -5.405 1.00 5.75 H new ATOM 0 HB3 ASP A 26 -4.730 2.794 -6.473 1.00 5.75 H new ATOM 320 N HIS A 27 -4.823 4.553 -9.658 1.00 7.68 N ATOM 321 CA HIS A 27 -4.983 4.038 -11.018 1.00 8.77 C ATOM 322 C HIS A 27 -4.605 2.559 -11.128 1.00 9.47 C ATOM 323 O HIS A 27 -4.929 1.906 -12.120 1.00 9.87 O ATOM 324 CB HIS A 27 -4.172 4.876 -12.020 1.00 9.42 C ATOM 325 CG HIS A 27 -2.687 4.630 -12.005 1.00 10.21 C ATOM 326 ND1 HIS A 27 -2.031 3.939 -13.000 1.00 10.91 N ATOM 327 CD2 HIS A 27 -1.727 5.028 -11.137 1.00 10.62 C ATOM 328 CE1 HIS A 27 -0.738 3.920 -12.742 1.00 11.67 C ATOM 329 NE2 HIS A 27 -0.521 4.577 -11.620 1.00 11.51 N ATOM 0 H HIS A 27 -4.130 5.296 -9.569 1.00 7.68 H new ATOM 0 HA HIS A 27 -6.041 4.121 -11.265 1.00 8.77 H new ATOM 0 HB2 HIS A 27 -4.547 4.677 -13.024 1.00 9.42 H new ATOM 0 HB3 HIS A 27 -4.352 5.932 -11.816 1.00 9.42 H new ATOM 0 HD1 HIS A 27 -2.476 3.509 -13.811 1.00 10.91 H new ATOM 0 HD2 HIS A 27 -1.880 5.596 -10.231 1.00 10.62 H new ATOM 0 HE1 HIS A 27 0.018 3.445 -13.349 1.00 11.67 H new ATOM 338 N ARG A 28 -3.929 2.027 -10.115 1.00 9.78 N ATOM 339 CA ARG A 28 -3.530 0.622 -10.119 1.00 10.59 C ATOM 340 C ARG A 28 -4.743 -0.300 -9.984 1.00 11.06 C ATOM 341 O ARG A 28 -4.637 -1.512 -10.183 1.00 11.12 O ATOM 342 CB ARG A 28 -2.536 0.344 -8.994 1.00 10.74 C ATOM 343 CG ARG A 28 -1.114 0.763 -9.322 1.00 11.22 C ATOM 344 CD ARG A 28 -0.207 0.644 -8.110 1.00 11.69 C ATOM 345 NE ARG A 28 -0.489 1.672 -7.109 1.00 11.31 N ATOM 346 CZ ARG A 28 0.014 1.671 -5.874 1.00 11.44 C ATOM 347 NH1 ARG A 28 0.788 0.668 -5.466 1.00 11.91 N ATOM 348 NH2 ARG A 28 -0.276 2.666 -5.045 1.00 11.23 N ATOM 0 H ARG A 28 -3.646 2.545 -9.283 1.00 9.78 H new ATOM 0 HA ARG A 28 -3.050 0.417 -11.076 1.00 10.59 H new ATOM 0 HB2 ARG A 28 -2.862 0.867 -8.095 1.00 10.74 H new ATOM 0 HB3 ARG A 28 -2.548 -0.722 -8.765 1.00 10.74 H new ATOM 0 HG2 ARG A 28 -0.727 0.142 -10.130 1.00 11.22 H new ATOM 0 HG3 ARG A 28 -1.110 1.792 -9.681 1.00 11.22 H new ATOM 0 HD2 ARG A 28 -0.330 -0.342 -7.661 1.00 11.69 H new ATOM 0 HD3 ARG A 28 0.833 0.723 -8.427 1.00 11.69 H new ATOM 0 HE ARG A 28 -1.109 2.438 -7.372 1.00 11.31 H new ATOM 0 HH11 ARG A 28 0.998 -0.104 -6.099 1.00 11.91 H new ATOM 0 HH12 ARG A 28 1.171 0.671 -4.521 1.00 11.91 H new ATOM 0 HH21 ARG A 28 -0.881 3.427 -5.354 1.00 11.23 H new ATOM 0 HH22 ARG A 28 0.106 2.670 -4.099 1.00 11.23 H new ATOM 362 N CYS A 29 -5.899 0.279 -9.662 1.00 11.56 N ATOM 363 CA CYS A 29 -7.128 -0.492 -9.514 1.00 12.23 C ATOM 364 C CYS A 29 -7.480 -1.193 -10.822 1.00 12.88 C ATOM 365 O CYS A 29 -8.032 -2.296 -10.818 1.00 12.99 O ATOM 366 CB CYS A 29 -8.279 0.420 -9.089 1.00 12.60 C ATOM 367 SG CYS A 29 -8.645 1.740 -10.268 1.00 12.95 S ATOM 0 H CYS A 29 -6.008 1.280 -9.499 1.00 11.56 H new ATOM 0 HA CYS A 29 -6.968 -1.246 -8.743 1.00 12.23 H new ATOM 0 HB2 CYS A 29 -9.175 -0.185 -8.947 1.00 12.60 H new ATOM 0 HB3 CYS A 29 -8.039 0.865 -8.124 1.00 12.60 H new ATOM 0 HG CYS A 29 -9.470 1.299 -11.171 1.00 12.95 H new ATOM 373 N VAL A 30 -7.126 -0.555 -11.933 1.00 13.46 N ATOM 374 CA VAL A 30 -7.396 -1.093 -13.257 1.00 14.27 C ATOM 375 C VAL A 30 -6.678 -2.424 -13.472 1.00 14.13 C ATOM 376 O VAL A 30 -7.209 -3.328 -14.109 1.00 14.19 O ATOM 377 CB VAL A 30 -6.969 -0.101 -14.360 1.00 15.19 C ATOM 378 CG1 VAL A 30 -7.348 -0.621 -15.738 1.00 16.15 C ATOM 379 CG2 VAL A 30 -7.582 1.270 -14.114 1.00 15.20 C ATOM 0 H VAL A 30 -6.646 0.345 -11.939 1.00 13.46 H new ATOM 0 HA VAL A 30 -8.472 -1.256 -13.321 1.00 14.27 H new ATOM 0 HB VAL A 30 -5.884 -0.003 -14.325 1.00 15.19 H new ATOM 0 HG11 VAL A 30 -7.036 0.097 -16.496 1.00 16.15 H new ATOM 0 HG12 VAL A 30 -6.852 -1.575 -15.916 1.00 16.15 H new ATOM 0 HG13 VAL A 30 -8.428 -0.758 -15.791 1.00 16.15 H new ATOM 0 HG21 VAL A 30 -7.269 1.955 -14.902 1.00 15.20 H new ATOM 0 HG22 VAL A 30 -8.669 1.188 -14.115 1.00 15.20 H new ATOM 0 HG23 VAL A 30 -7.247 1.650 -13.149 1.00 15.20 H new ATOM 389 N ALA A 31 -5.485 -2.553 -12.911 1.00 14.12 N ATOM 390 CA ALA A 31 -4.709 -3.776 -13.060 1.00 14.20 C ATOM 391 C ALA A 31 -4.992 -4.764 -11.933 1.00 14.41 C ATOM 392 O ALA A 31 -4.542 -5.908 -11.970 1.00 15.07 O ATOM 393 CB ALA A 31 -3.228 -3.453 -13.114 1.00 14.19 C ATOM 0 H ALA A 31 -5.034 -1.830 -12.351 1.00 14.12 H new ATOM 0 HA ALA A 31 -5.009 -4.247 -13.996 1.00 14.20 H new ATOM 0 HB1 ALA A 31 -2.658 -4.376 -13.226 1.00 14.19 H new ATOM 0 HB2 ALA A 31 -3.029 -2.799 -13.963 1.00 14.19 H new ATOM 0 HB3 ALA A 31 -2.931 -2.952 -12.193 1.00 14.19 H new ATOM 399 N THR A 32 -5.738 -4.321 -10.932 1.00 13.95 N ATOM 400 CA THR A 32 -6.066 -5.178 -9.803 1.00 14.24 C ATOM 401 C THR A 32 -7.445 -5.813 -9.970 1.00 14.03 C ATOM 402 O THR A 32 -7.586 -7.035 -9.932 1.00 14.20 O ATOM 403 CB THR A 32 -6.015 -4.396 -8.476 1.00 14.27 C ATOM 404 OG1 THR A 32 -4.769 -3.693 -8.372 1.00 14.90 O ATOM 405 CG2 THR A 32 -6.171 -5.331 -7.284 1.00 14.04 C ATOM 0 H THR A 32 -6.126 -3.379 -10.878 1.00 13.95 H new ATOM 0 HA THR A 32 -5.317 -5.969 -9.775 1.00 14.24 H new ATOM 0 HB THR A 32 -6.841 -3.685 -8.469 1.00 14.27 H new ATOM 0 HG1 THR A 32 -4.758 -2.950 -9.011 1.00 14.90 H new ATOM 0 HG21 THR A 32 -6.131 -4.753 -6.361 1.00 14.04 H new ATOM 0 HG22 THR A 32 -7.129 -5.846 -7.349 1.00 14.04 H new ATOM 0 HG23 THR A 32 -5.364 -6.064 -7.288 1.00 14.04 H new ATOM 413 N VAL A 33 -8.459 -4.979 -10.169 1.00 13.80 N ATOM 414 CA VAL A 33 -9.823 -5.472 -10.330 1.00 13.77 C ATOM 415 C VAL A 33 -10.385 -5.138 -11.706 1.00 13.68 C ATOM 416 O VAL A 33 -11.416 -5.671 -12.108 1.00 13.84 O ATOM 417 CB VAL A 33 -10.771 -4.909 -9.246 1.00 13.66 C ATOM 418 CG1 VAL A 33 -10.586 -5.655 -7.936 1.00 13.80 C ATOM 419 CG2 VAL A 33 -10.548 -3.417 -9.047 1.00 13.68 C ATOM 0 H VAL A 33 -8.365 -3.965 -10.223 1.00 13.80 H new ATOM 0 HA VAL A 33 -9.767 -6.555 -10.222 1.00 13.77 H new ATOM 0 HB VAL A 33 -11.796 -5.055 -9.586 1.00 13.66 H new ATOM 0 HG11 VAL A 33 -11.261 -5.245 -7.185 1.00 13.80 H new ATOM 0 HG12 VAL A 33 -10.807 -6.712 -8.085 1.00 13.80 H new ATOM 0 HG13 VAL A 33 -9.556 -5.544 -7.597 1.00 13.80 H new ATOM 0 HG21 VAL A 33 -11.228 -3.047 -8.279 1.00 13.68 H new ATOM 0 HG22 VAL A 33 -9.518 -3.241 -8.736 1.00 13.68 H new ATOM 0 HG23 VAL A 33 -10.738 -2.893 -9.983 1.00 13.68 H new ATOM 429 N GLY A 34 -9.715 -4.248 -12.422 1.00 13.56 N ATOM 430 CA GLY A 34 -10.170 -3.873 -13.748 1.00 13.65 C ATOM 431 C GLY A 34 -11.083 -2.664 -13.728 1.00 13.54 C ATOM 432 O GLY A 34 -11.336 -2.052 -14.764 1.00 13.85 O ATOM 0 H GLY A 34 -8.865 -3.778 -12.111 1.00 13.56 H new ATOM 0 HA2 GLY A 34 -9.306 -3.662 -14.379 1.00 13.65 H new ATOM 0 HA3 GLY A 34 -10.696 -4.714 -14.199 1.00 13.65 H new ATOM 436 N TYR A 35 -11.582 -2.321 -12.548 1.00 13.21 N ATOM 437 CA TYR A 35 -12.469 -1.177 -12.398 1.00 13.20 C ATOM 438 C TYR A 35 -11.685 0.125 -12.481 1.00 12.81 C ATOM 439 O TYR A 35 -10.580 0.226 -11.946 1.00 12.67 O ATOM 440 CB TYR A 35 -13.215 -1.249 -11.067 1.00 13.25 C ATOM 441 CG TYR A 35 -14.601 -1.836 -11.178 1.00 15.79 C ATOM 442 CD1 TYR A 35 -15.631 -1.125 -11.781 1.00 16.05 C ATOM 443 CD2 TYR A 35 -14.881 -3.103 -10.683 1.00 16.35 C ATOM 444 CE1 TYR A 35 -16.899 -1.658 -11.889 1.00 16.85 C ATOM 445 CE2 TYR A 35 -16.148 -3.643 -10.786 1.00 17.14 C ATOM 446 CZ TYR A 35 -17.153 -2.918 -11.389 1.00 15.43 C ATOM 447 OH TYR A 35 -18.415 -3.455 -11.499 1.00 18.28 O ATOM 0 H TYR A 35 -11.387 -2.820 -11.680 1.00 13.21 H new ATOM 0 HA TYR A 35 -13.194 -1.202 -13.211 1.00 13.20 H new ATOM 0 HB2 TYR A 35 -12.632 -1.847 -10.366 1.00 13.25 H new ATOM 0 HB3 TYR A 35 -13.288 -0.246 -10.647 1.00 13.25 H new ATOM 0 HD1 TYR A 35 -15.436 -0.137 -12.172 1.00 16.05 H new ATOM 0 HD2 TYR A 35 -14.096 -3.675 -10.210 1.00 16.35 H new ATOM 0 HE1 TYR A 35 -17.688 -1.092 -12.362 1.00 16.85 H new ATOM 0 HE2 TYR A 35 -16.350 -4.629 -10.396 1.00 17.14 H new ATOM 0 HH TYR A 35 -18.426 -4.349 -11.098 1.00 18.28 H new ATOM 457 N GLN A 36 -12.251 1.106 -13.167 1.00 12.79 N ATOM 458 CA GLN A 36 -11.611 2.404 -13.308 1.00 12.57 C ATOM 459 C GLN A 36 -11.857 3.229 -12.050 1.00 11.54 C ATOM 460 O GLN A 36 -12.890 3.069 -11.399 1.00 11.22 O ATOM 461 CB GLN A 36 -12.156 3.145 -14.534 1.00 13.45 C ATOM 462 CG GLN A 36 -12.203 2.308 -15.807 1.00 14.56 C ATOM 463 CD GLN A 36 -10.840 1.799 -16.237 1.00 15.07 C ATOM 464 OE1 GLN A 36 -10.537 0.553 -15.910 1.00 15.22 O flip ATOM 465 NE2 GLN A 36 -10.075 2.514 -16.878 1.00 15.48 N flip ATOM 0 H GLN A 36 -13.154 1.027 -13.635 1.00 12.79 H new ATOM 0 HA GLN A 36 -10.540 2.256 -13.445 1.00 12.57 H new ATOM 0 HB2 GLN A 36 -13.162 3.501 -14.311 1.00 13.45 H new ATOM 0 HB3 GLN A 36 -11.539 4.025 -14.715 1.00 13.45 H new ATOM 0 HG2 GLN A 36 -12.869 1.459 -15.652 1.00 14.56 H new ATOM 0 HG3 GLN A 36 -12.631 2.906 -16.612 1.00 14.56 H new ATOM 0 HE21 GLN A 36 -10.345 3.470 -17.111 1.00 15.48 H new ATOM 0 HE22 GLN A 36 -9.170 2.152 -17.178 1.00 15.48 H new ATOM 474 N PRO A 37 -10.926 4.125 -11.689 1.00 11.14 N ATOM 475 CA PRO A 37 -11.065 4.966 -10.494 1.00 10.29 C ATOM 476 C PRO A 37 -12.370 5.758 -10.489 1.00 10.51 C ATOM 477 O PRO A 37 -13.007 5.921 -9.449 1.00 10.47 O ATOM 478 CB PRO A 37 -9.870 5.916 -10.578 1.00 10.16 C ATOM 479 CG PRO A 37 -8.868 5.194 -11.411 1.00 10.93 C ATOM 480 CD PRO A 37 -9.661 4.382 -12.398 1.00 11.63 C ATOM 0 HA PRO A 37 -11.088 4.369 -9.582 1.00 10.29 H new ATOM 0 HB2 PRO A 37 -10.151 6.866 -11.032 1.00 10.16 H new ATOM 0 HB3 PRO A 37 -9.473 6.141 -9.588 1.00 10.16 H new ATOM 0 HG2 PRO A 37 -8.208 5.894 -11.922 1.00 10.93 H new ATOM 0 HG3 PRO A 37 -8.237 4.553 -10.795 1.00 10.93 H new ATOM 0 HD2 PRO A 37 -9.825 4.927 -13.328 1.00 11.63 H new ATOM 0 HD3 PRO A 37 -9.150 3.455 -12.658 1.00 11.63 H new ATOM 488 N GLN A 38 -12.777 6.222 -11.665 1.00 10.92 N ATOM 489 CA GLN A 38 -14.002 7.004 -11.802 1.00 11.42 C ATOM 490 C GLN A 38 -15.241 6.141 -11.573 1.00 11.86 C ATOM 491 O GLN A 38 -16.322 6.659 -11.287 1.00 12.08 O ATOM 492 CB GLN A 38 -14.076 7.663 -13.184 1.00 12.31 C ATOM 493 CG GLN A 38 -12.833 8.457 -13.559 1.00 12.40 C ATOM 494 CD GLN A 38 -11.742 7.580 -14.145 1.00 12.97 C ATOM 495 OE1 GLN A 38 -12.026 6.560 -14.770 1.00 13.31 O ATOM 496 NE2 GLN A 38 -10.495 7.956 -13.931 1.00 13.23 N ATOM 0 H GLN A 38 -12.276 6.070 -12.540 1.00 10.92 H new ATOM 0 HA GLN A 38 -13.978 7.782 -11.039 1.00 11.42 H new ATOM 0 HB2 GLN A 38 -14.241 6.891 -13.935 1.00 12.31 H new ATOM 0 HB3 GLN A 38 -14.941 8.326 -13.213 1.00 12.31 H new ATOM 0 HG2 GLN A 38 -13.102 9.229 -14.280 1.00 12.40 H new ATOM 0 HG3 GLN A 38 -12.450 8.967 -12.675 1.00 12.40 H new ATOM 0 HE21 GLN A 38 -10.303 8.810 -13.407 1.00 13.23 H new ATOM 0 HE22 GLN A 38 -9.724 7.393 -14.289 1.00 13.23 H new ATOM 505 N GLU A 39 -15.083 4.825 -11.683 1.00 12.10 N ATOM 506 CA GLU A 39 -16.195 3.901 -11.481 1.00 12.60 C ATOM 507 C GLU A 39 -16.404 3.639 -9.993 1.00 12.14 C ATOM 508 O GLU A 39 -17.432 3.101 -9.583 1.00 12.03 O ATOM 509 CB GLU A 39 -15.943 2.581 -12.219 1.00 13.06 C ATOM 510 CG GLU A 39 -15.805 2.740 -13.726 1.00 14.17 C ATOM 511 CD GLU A 39 -15.735 1.411 -14.452 1.00 16.63 C ATOM 512 OE1 GLU A 39 -14.686 0.737 -14.380 1.00 16.43 O ATOM 513 OE2 GLU A 39 -16.728 1.036 -15.110 1.00 17.34 O ATOM 0 H GLU A 39 -14.197 4.375 -11.911 1.00 12.10 H new ATOM 0 HA GLU A 39 -17.097 4.358 -11.888 1.00 12.60 H new ATOM 0 HB2 GLU A 39 -15.035 2.123 -11.826 1.00 13.06 H new ATOM 0 HB3 GLU A 39 -16.763 1.895 -12.008 1.00 13.06 H new ATOM 0 HG2 GLU A 39 -16.652 3.312 -14.106 1.00 14.17 H new ATOM 0 HG3 GLU A 39 -14.906 3.317 -13.945 1.00 14.17 H new ATOM 520 N LEU A 40 -15.414 4.019 -9.193 1.00 12.04 N ATOM 521 CA LEU A 40 -15.479 3.844 -7.748 1.00 11.75 C ATOM 522 C LEU A 40 -15.843 5.162 -7.071 1.00 11.42 C ATOM 523 O LEU A 40 -16.421 5.177 -5.984 1.00 11.04 O ATOM 524 CB LEU A 40 -14.137 3.335 -7.205 1.00 11.89 C ATOM 525 CG LEU A 40 -13.928 1.817 -7.246 1.00 12.41 C ATOM 526 CD1 LEU A 40 -15.110 1.095 -6.626 1.00 12.70 C ATOM 527 CD2 LEU A 40 -13.697 1.341 -8.671 1.00 13.25 C ATOM 0 H LEU A 40 -14.552 4.453 -9.524 1.00 12.04 H new ATOM 0 HA LEU A 40 -16.250 3.105 -7.528 1.00 11.75 H new ATOM 0 HB2 LEU A 40 -13.335 3.808 -7.772 1.00 11.89 H new ATOM 0 HB3 LEU A 40 -14.036 3.668 -6.172 1.00 11.89 H new ATOM 0 HG LEU A 40 -13.039 1.582 -6.661 1.00 12.41 H new ATOM 0 HD11 LEU A 40 -14.941 0.019 -6.666 1.00 12.70 H new ATOM 0 HD12 LEU A 40 -15.223 1.407 -5.588 1.00 12.70 H new ATOM 0 HD13 LEU A 40 -16.017 1.340 -7.179 1.00 12.70 H new ATOM 0 HD21 LEU A 40 -13.551 0.261 -8.675 1.00 13.25 H new ATOM 0 HD22 LEU A 40 -14.563 1.592 -9.283 1.00 13.25 H new ATOM 0 HD23 LEU A 40 -12.811 1.828 -9.078 1.00 13.25 H new ATOM 539 N LEU A 41 -15.493 6.266 -7.722 1.00 11.77 N ATOM 540 CA LEU A 41 -15.778 7.598 -7.196 1.00 11.76 C ATOM 541 C LEU A 41 -17.277 7.801 -7.031 1.00 12.25 C ATOM 542 O LEU A 41 -18.048 7.604 -7.973 1.00 12.72 O ATOM 543 CB LEU A 41 -15.204 8.675 -8.122 1.00 12.25 C ATOM 544 CG LEU A 41 -13.682 8.653 -8.281 1.00 12.23 C ATOM 545 CD1 LEU A 41 -13.236 9.668 -9.321 1.00 12.99 C ATOM 546 CD2 LEU A 41 -13.004 8.921 -6.948 1.00 11.79 C ATOM 0 H LEU A 41 -15.009 6.265 -8.620 1.00 11.77 H new ATOM 0 HA LEU A 41 -15.304 7.685 -6.218 1.00 11.76 H new ATOM 0 HB2 LEU A 41 -15.658 8.565 -9.107 1.00 12.25 H new ATOM 0 HB3 LEU A 41 -15.500 9.653 -7.743 1.00 12.25 H new ATOM 0 HG LEU A 41 -13.388 7.661 -8.624 1.00 12.23 H new ATOM 0 HD11 LEU A 41 -12.151 9.636 -9.419 1.00 12.99 H new ATOM 0 HD12 LEU A 41 -13.694 9.430 -10.281 1.00 12.99 H new ATOM 0 HD13 LEU A 41 -13.543 10.667 -9.010 1.00 12.99 H new ATOM 0 HD21 LEU A 41 -11.922 8.902 -7.080 1.00 11.79 H new ATOM 0 HD22 LEU A 41 -13.307 9.900 -6.576 1.00 11.79 H new ATOM 0 HD23 LEU A 41 -13.296 8.154 -6.231 1.00 11.79 H new ATOM 558 N GLY A 42 -17.686 8.173 -5.827 1.00 12.24 N ATOM 559 CA GLY A 42 -19.094 8.393 -5.554 1.00 12.82 C ATOM 560 C GLY A 42 -19.837 7.100 -5.276 1.00 13.07 C ATOM 561 O GLY A 42 -21.050 7.104 -5.069 1.00 13.39 O ATOM 0 H GLY A 42 -17.067 8.327 -5.031 1.00 12.24 H new ATOM 0 HA2 GLY A 42 -19.196 9.059 -4.697 1.00 12.82 H new ATOM 0 HA3 GLY A 42 -19.552 8.897 -6.405 1.00 12.82 H new ATOM 565 N LYS A 43 -19.107 5.998 -5.266 1.00 13.04 N ATOM 566 CA LYS A 43 -19.692 4.691 -5.020 1.00 13.33 C ATOM 567 C LYS A 43 -19.225 4.138 -3.685 1.00 12.82 C ATOM 568 O LYS A 43 -18.216 4.584 -3.136 1.00 13.01 O ATOM 569 CB LYS A 43 -19.314 3.721 -6.143 1.00 13.98 C ATOM 570 CG LYS A 43 -19.971 4.032 -7.478 1.00 15.04 C ATOM 571 CD LYS A 43 -21.361 3.423 -7.572 1.00 15.77 C ATOM 572 CE LYS A 43 -22.407 4.299 -6.903 1.00 16.37 C ATOM 573 NZ LYS A 43 -23.718 3.605 -6.784 1.00 16.87 N ATOM 0 H LYS A 43 -18.100 5.983 -5.427 1.00 13.04 H new ATOM 0 HA LYS A 43 -20.776 4.802 -4.993 1.00 13.33 H new ATOM 0 HB2 LYS A 43 -18.232 3.734 -6.271 1.00 13.98 H new ATOM 0 HB3 LYS A 43 -19.587 2.710 -5.842 1.00 13.98 H new ATOM 0 HG2 LYS A 43 -20.037 5.112 -7.609 1.00 15.04 H new ATOM 0 HG3 LYS A 43 -19.350 3.650 -8.288 1.00 15.04 H new ATOM 0 HD2 LYS A 43 -21.624 3.278 -8.620 1.00 15.77 H new ATOM 0 HD3 LYS A 43 -21.359 2.438 -7.105 1.00 15.77 H new ATOM 0 HE2 LYS A 43 -22.058 4.588 -5.912 1.00 16.37 H new ATOM 0 HE3 LYS A 43 -22.533 5.217 -7.477 1.00 16.37 H new ATOM 0 HZ1 LYS A 43 -24.290 4.068 -6.049 1.00 16.87 H new ATOM 0 HZ2 LYS A 43 -24.219 3.652 -7.694 1.00 16.87 H new ATOM 0 HZ3 LYS A 43 -23.562 2.610 -6.525 1.00 16.87 H new ATOM 587 N ASN A 44 -19.968 3.175 -3.163 1.00 12.28 N ATOM 588 CA ASN A 44 -19.628 2.549 -1.898 1.00 11.87 C ATOM 589 C ASN A 44 -18.863 1.262 -2.153 1.00 11.67 C ATOM 590 O ASN A 44 -19.240 0.469 -3.014 1.00 11.82 O ATOM 591 CB ASN A 44 -20.887 2.227 -1.082 1.00 11.97 C ATOM 592 CG ASN A 44 -21.655 3.457 -0.635 1.00 12.28 C ATOM 593 OD1 ASN A 44 -22.499 3.973 -1.367 1.00 12.50 O ATOM 594 ND2 ASN A 44 -21.393 3.917 0.579 1.00 12.46 N ATOM 0 H ASN A 44 -20.814 2.809 -3.599 1.00 12.28 H new ATOM 0 HA ASN A 44 -19.013 3.248 -1.331 1.00 11.87 H new ATOM 0 HB2 ASN A 44 -21.545 1.596 -1.679 1.00 11.97 H new ATOM 0 HB3 ASN A 44 -20.602 1.648 -0.203 1.00 11.97 H new ATOM 0 HD21 ASN A 44 -21.899 4.727 0.938 1.00 12.46 H new ATOM 0 HD22 ASN A 44 -20.686 3.461 1.155 1.00 12.46 H new ATOM 601 N ILE A 45 -17.794 1.055 -1.400 1.00 11.52 N ATOM 602 CA ILE A 45 -16.980 -0.151 -1.531 1.00 11.55 C ATOM 603 C ILE A 45 -17.816 -1.408 -1.265 1.00 11.53 C ATOM 604 O ILE A 45 -17.533 -2.483 -1.789 1.00 11.49 O ATOM 605 CB ILE A 45 -15.764 -0.103 -0.572 1.00 11.20 C ATOM 606 CG1 ILE A 45 -14.974 -1.417 -0.616 1.00 11.40 C ATOM 607 CG2 ILE A 45 -16.213 0.211 0.847 1.00 11.02 C ATOM 608 CD1 ILE A 45 -13.684 -1.382 0.178 1.00 11.72 C ATOM 0 H ILE A 45 -17.466 1.707 -0.688 1.00 11.52 H new ATOM 0 HA ILE A 45 -16.611 -0.193 -2.556 1.00 11.55 H new ATOM 0 HB ILE A 45 -15.102 0.696 -0.906 1.00 11.20 H new ATOM 0 HG12 ILE A 45 -15.603 -2.221 -0.234 1.00 11.40 H new ATOM 0 HG13 ILE A 45 -14.744 -1.657 -1.654 1.00 11.40 H new ATOM 0 HG21 ILE A 45 -15.345 0.240 1.505 1.00 11.02 H new ATOM 0 HG22 ILE A 45 -16.714 1.179 0.864 1.00 11.02 H new ATOM 0 HG23 ILE A 45 -16.902 -0.561 1.190 1.00 11.02 H new ATOM 0 HD11 ILE A 45 -13.182 -2.346 0.099 1.00 11.72 H new ATOM 0 HD12 ILE A 45 -13.034 -0.601 -0.217 1.00 11.72 H new ATOM 0 HD13 ILE A 45 -13.906 -1.174 1.225 1.00 11.72 H new ATOM 620 N VAL A 46 -18.874 -1.241 -0.479 1.00 11.77 N ATOM 621 CA VAL A 46 -19.762 -2.340 -0.129 1.00 11.99 C ATOM 622 C VAL A 46 -20.588 -2.801 -1.339 1.00 12.29 C ATOM 623 O VAL A 46 -21.057 -3.939 -1.384 1.00 12.37 O ATOM 624 CB VAL A 46 -20.698 -1.940 1.041 1.00 12.37 C ATOM 625 CG1 VAL A 46 -21.692 -0.870 0.614 1.00 12.89 C ATOM 626 CG2 VAL A 46 -21.424 -3.154 1.599 1.00 12.52 C ATOM 0 H VAL A 46 -19.138 -0.345 -0.069 1.00 11.77 H new ATOM 0 HA VAL A 46 -19.139 -3.175 0.192 1.00 11.99 H new ATOM 0 HB VAL A 46 -20.074 -1.522 1.831 1.00 12.37 H new ATOM 0 HG11 VAL A 46 -22.333 -0.612 1.457 1.00 12.89 H new ATOM 0 HG12 VAL A 46 -21.152 0.017 0.284 1.00 12.89 H new ATOM 0 HG13 VAL A 46 -22.304 -1.248 -0.205 1.00 12.89 H new ATOM 0 HG21 VAL A 46 -22.073 -2.845 2.418 1.00 12.52 H new ATOM 0 HG22 VAL A 46 -22.024 -3.612 0.813 1.00 12.52 H new ATOM 0 HG23 VAL A 46 -20.695 -3.877 1.967 1.00 12.52 H new ATOM 636 N GLU A 47 -20.742 -1.921 -2.329 1.00 12.64 N ATOM 637 CA GLU A 47 -21.512 -2.241 -3.529 1.00 13.14 C ATOM 638 C GLU A 47 -20.779 -3.269 -4.382 1.00 12.83 C ATOM 639 O GLU A 47 -21.391 -4.147 -4.994 1.00 12.91 O ATOM 640 CB GLU A 47 -21.759 -0.978 -4.361 1.00 14.14 C ATOM 641 CG GLU A 47 -22.564 0.094 -3.642 1.00 14.73 C ATOM 642 CD GLU A 47 -22.879 1.280 -4.534 1.00 15.67 C ATOM 643 OE1 GLU A 47 -23.735 1.146 -5.435 1.00 16.53 O ATOM 644 OE2 GLU A 47 -22.285 2.358 -4.332 1.00 15.65 O ATOM 0 H GLU A 47 -20.344 -0.982 -2.323 1.00 12.64 H new ATOM 0 HA GLU A 47 -22.468 -2.657 -3.211 1.00 13.14 H new ATOM 0 HB2 GLU A 47 -20.798 -0.558 -4.657 1.00 14.14 H new ATOM 0 HB3 GLU A 47 -22.281 -1.256 -5.277 1.00 14.14 H new ATOM 0 HG2 GLU A 47 -23.495 -0.339 -3.277 1.00 14.73 H new ATOM 0 HG3 GLU A 47 -22.008 0.437 -2.769 1.00 14.73 H new ATOM 651 N PHE A 48 -19.461 -3.160 -4.408 1.00 12.62 N ATOM 652 CA PHE A 48 -18.632 -4.060 -5.190 1.00 12.47 C ATOM 653 C PHE A 48 -17.999 -5.114 -4.293 1.00 11.91 C ATOM 654 O PHE A 48 -16.875 -5.556 -4.523 1.00 11.81 O ATOM 655 CB PHE A 48 -17.558 -3.265 -5.934 1.00 12.62 C ATOM 656 CG PHE A 48 -18.120 -2.130 -6.746 1.00 14.11 C ATOM 657 CD1 PHE A 48 -18.606 -2.348 -8.025 1.00 14.39 C ATOM 658 CD2 PHE A 48 -18.171 -0.846 -6.225 1.00 14.61 C ATOM 659 CE1 PHE A 48 -19.132 -1.309 -8.768 1.00 15.13 C ATOM 660 CE2 PHE A 48 -18.694 0.198 -6.966 1.00 15.34 C ATOM 661 CZ PHE A 48 -19.176 -0.036 -8.239 1.00 14.85 C ATOM 0 H PHE A 48 -18.940 -2.451 -3.892 1.00 12.62 H new ATOM 0 HA PHE A 48 -19.257 -4.571 -5.923 1.00 12.47 H new ATOM 0 HB2 PHE A 48 -16.843 -2.869 -5.213 1.00 12.62 H new ATOM 0 HB3 PHE A 48 -17.008 -3.937 -6.592 1.00 12.62 H new ATOM 0 HD1 PHE A 48 -18.573 -3.342 -8.446 1.00 14.39 H new ATOM 0 HD2 PHE A 48 -17.798 -0.659 -5.229 1.00 14.61 H new ATOM 0 HE1 PHE A 48 -19.509 -1.494 -9.763 1.00 15.13 H new ATOM 0 HE2 PHE A 48 -18.725 1.194 -6.550 1.00 15.34 H new ATOM 0 HZ PHE A 48 -19.587 0.777 -8.819 1.00 14.85 H new ATOM 671 N CYS A 49 -18.741 -5.521 -3.278 1.00 11.77 N ATOM 672 CA CYS A 49 -18.267 -6.515 -2.337 1.00 11.49 C ATOM 673 C CYS A 49 -19.199 -7.720 -2.327 1.00 11.83 C ATOM 674 O CYS A 49 -20.394 -7.593 -2.612 1.00 11.97 O ATOM 675 CB CYS A 49 -18.176 -5.908 -0.932 1.00 11.25 C ATOM 676 SG CYS A 49 -17.756 -7.090 0.372 1.00 11.37 S ATOM 0 H CYS A 49 -19.681 -5.174 -3.086 1.00 11.77 H new ATOM 0 HA CYS A 49 -17.274 -6.843 -2.645 1.00 11.49 H new ATOM 0 HB2 CYS A 49 -17.428 -5.115 -0.941 1.00 11.25 H new ATOM 0 HB3 CYS A 49 -19.131 -5.443 -0.689 1.00 11.25 H new ATOM 0 HG CYS A 49 -16.473 -7.302 0.369 1.00 11.37 H new ATOM 682 N HIS A 50 -18.634 -8.887 -2.036 1.00 12.10 N ATOM 683 CA HIS A 50 -19.395 -10.128 -1.957 1.00 12.66 C ATOM 684 C HIS A 50 -20.489 -9.979 -0.899 1.00 12.75 C ATOM 685 O HIS A 50 -20.199 -9.610 0.233 1.00 12.20 O ATOM 686 CB HIS A 50 -18.445 -11.280 -1.602 1.00 13.24 C ATOM 687 CG HIS A 50 -19.020 -12.654 -1.774 1.00 13.78 C ATOM 688 ND1 HIS A 50 -18.851 -13.651 -0.838 1.00 14.15 N ATOM 689 CD2 HIS A 50 -19.724 -13.210 -2.789 1.00 14.13 C ATOM 690 CE1 HIS A 50 -19.425 -14.758 -1.266 1.00 14.67 C ATOM 691 NE2 HIS A 50 -19.961 -14.517 -2.445 1.00 14.65 N ATOM 0 H HIS A 50 -17.638 -8.999 -1.849 1.00 12.10 H new ATOM 0 HA HIS A 50 -19.865 -10.347 -2.916 1.00 12.66 H new ATOM 0 HB2 HIS A 50 -17.551 -11.197 -2.220 1.00 13.24 H new ATOM 0 HB3 HIS A 50 -18.128 -11.163 -0.566 1.00 13.24 H new ATOM 0 HD1 HIS A 50 -18.358 -13.548 0.049 1.00 14.15 H new ATOM 0 HD2 HIS A 50 -20.039 -12.718 -3.697 1.00 14.13 H new ATOM 0 HE1 HIS A 50 -19.451 -15.701 -0.740 1.00 14.67 H new ATOM 700 N PRO A 51 -21.755 -10.248 -1.265 1.00 13.57 N ATOM 701 CA PRO A 51 -22.906 -10.118 -0.355 1.00 13.93 C ATOM 702 C PRO A 51 -22.669 -10.697 1.042 1.00 14.09 C ATOM 703 O PRO A 51 -22.925 -10.030 2.043 1.00 14.26 O ATOM 704 CB PRO A 51 -24.005 -10.891 -1.076 1.00 14.93 C ATOM 705 CG PRO A 51 -23.678 -10.751 -2.520 1.00 15.15 C ATOM 706 CD PRO A 51 -22.176 -10.692 -2.611 1.00 14.35 C ATOM 0 HA PRO A 51 -23.138 -9.070 -0.163 1.00 13.93 H new ATOM 0 HB2 PRO A 51 -24.018 -11.938 -0.772 1.00 14.93 H new ATOM 0 HB3 PRO A 51 -24.990 -10.482 -0.851 1.00 14.93 H new ATOM 0 HG2 PRO A 51 -24.069 -11.594 -3.090 1.00 15.15 H new ATOM 0 HG3 PRO A 51 -24.128 -9.849 -2.935 1.00 15.15 H new ATOM 0 HD2 PRO A 51 -21.752 -11.665 -2.861 1.00 14.35 H new ATOM 0 HD3 PRO A 51 -21.850 -9.994 -3.382 1.00 14.35 H new ATOM 714 N GLU A 52 -22.164 -11.923 1.108 1.00 14.17 N ATOM 715 CA GLU A 52 -21.912 -12.587 2.391 1.00 14.44 C ATOM 716 C GLU A 52 -20.689 -12.012 3.115 1.00 13.87 C ATOM 717 O GLU A 52 -20.389 -12.404 4.243 1.00 14.17 O ATOM 718 CB GLU A 52 -21.713 -14.093 2.186 1.00 15.45 C ATOM 719 CG GLU A 52 -22.855 -14.775 1.451 1.00 16.21 C ATOM 720 CD GLU A 52 -22.606 -14.885 -0.040 1.00 16.09 C ATOM 721 OE1 GLU A 52 -22.812 -13.885 -0.759 1.00 15.73 O ATOM 722 OE2 GLU A 52 -22.198 -15.972 -0.499 1.00 16.47 O ATOM 0 H GLU A 52 -21.919 -12.482 0.290 1.00 14.17 H new ATOM 0 HA GLU A 52 -22.789 -12.408 3.013 1.00 14.44 H new ATOM 0 HB2 GLU A 52 -20.789 -14.254 1.630 1.00 15.45 H new ATOM 0 HB3 GLU A 52 -21.586 -14.568 3.159 1.00 15.45 H new ATOM 0 HG2 GLU A 52 -23.004 -15.772 1.865 1.00 16.21 H new ATOM 0 HG3 GLU A 52 -23.776 -14.218 1.622 1.00 16.21 H new ATOM 729 N ASP A 53 -19.985 -11.091 2.476 1.00 13.16 N ATOM 730 CA ASP A 53 -18.796 -10.490 3.077 1.00 12.70 C ATOM 731 C ASP A 53 -19.000 -9.004 3.328 1.00 12.63 C ATOM 732 O ASP A 53 -18.127 -8.328 3.876 1.00 12.77 O ATOM 733 CB ASP A 53 -17.575 -10.697 2.178 1.00 12.21 C ATOM 734 CG ASP A 53 -17.098 -12.132 2.165 1.00 12.39 C ATOM 735 OD1 ASP A 53 -16.303 -12.511 3.046 1.00 11.90 O ATOM 736 OD2 ASP A 53 -17.510 -12.897 1.267 1.00 13.14 O ATOM 0 H ASP A 53 -20.212 -10.742 1.545 1.00 13.16 H new ATOM 0 HA ASP A 53 -18.624 -10.984 4.033 1.00 12.70 H new ATOM 0 HB2 ASP A 53 -17.821 -10.391 1.161 1.00 12.21 H new ATOM 0 HB3 ASP A 53 -16.765 -10.052 2.518 1.00 12.21 H new ATOM 741 N GLN A 54 -20.163 -8.504 2.934 1.00 12.56 N ATOM 742 CA GLN A 54 -20.489 -7.095 3.099 1.00 12.69 C ATOM 743 C GLN A 54 -20.531 -6.709 4.573 1.00 12.06 C ATOM 744 O GLN A 54 -20.047 -5.642 4.958 1.00 11.70 O ATOM 745 CB GLN A 54 -21.820 -6.776 2.421 1.00 13.60 C ATOM 746 CG GLN A 54 -21.714 -6.685 0.908 1.00 14.35 C ATOM 747 CD GLN A 54 -23.064 -6.557 0.235 1.00 15.27 C ATOM 748 OE1 GLN A 54 -24.060 -7.117 0.694 1.00 15.83 O ATOM 749 NE2 GLN A 54 -23.115 -5.798 -0.846 1.00 15.52 N ATOM 0 H GLN A 54 -20.900 -9.057 2.496 1.00 12.56 H new ATOM 0 HA GLN A 54 -19.704 -6.507 2.623 1.00 12.69 H new ATOM 0 HB2 GLN A 54 -22.547 -7.545 2.682 1.00 13.60 H new ATOM 0 HB3 GLN A 54 -22.201 -5.832 2.810 1.00 13.60 H new ATOM 0 HG2 GLN A 54 -21.097 -5.827 0.642 1.00 14.35 H new ATOM 0 HG3 GLN A 54 -21.206 -7.572 0.529 1.00 14.35 H new ATOM 0 HE21 GLN A 54 -22.268 -5.351 -1.196 1.00 15.52 H new ATOM 0 HE22 GLN A 54 -24.002 -5.660 -1.331 1.00 15.52 H new ATOM 758 N GLN A 55 -21.100 -7.581 5.396 1.00 12.07 N ATOM 759 CA GLN A 55 -21.188 -7.329 6.824 1.00 11.64 C ATOM 760 C GLN A 55 -19.788 -7.284 7.426 1.00 11.18 C ATOM 761 O GLN A 55 -19.472 -6.403 8.226 1.00 11.47 O ATOM 762 CB GLN A 55 -22.041 -8.404 7.504 1.00 12.30 C ATOM 763 CG GLN A 55 -22.197 -8.210 9.001 1.00 13.09 C ATOM 764 CD GLN A 55 -22.618 -6.802 9.374 1.00 13.56 C ATOM 765 OE1 GLN A 55 -23.373 -6.147 8.650 1.00 13.71 O ATOM 766 NE2 GLN A 55 -22.114 -6.322 10.497 1.00 13.94 N ATOM 0 H GLN A 55 -21.506 -8.467 5.097 1.00 12.07 H new ATOM 0 HA GLN A 55 -21.669 -6.365 6.988 1.00 11.64 H new ATOM 0 HB2 GLN A 55 -23.029 -8.414 7.044 1.00 12.30 H new ATOM 0 HB3 GLN A 55 -21.593 -9.380 7.319 1.00 12.30 H new ATOM 0 HG2 GLN A 55 -22.936 -8.917 9.379 1.00 13.09 H new ATOM 0 HG3 GLN A 55 -21.253 -8.443 9.493 1.00 13.09 H new ATOM 0 HE21 GLN A 55 -21.494 -6.899 11.065 1.00 13.94 H new ATOM 0 HE22 GLN A 55 -22.345 -5.375 10.796 1.00 13.94 H new ATOM 775 N LEU A 56 -18.950 -8.226 7.009 1.00 10.67 N ATOM 776 CA LEU A 56 -17.571 -8.300 7.477 1.00 10.41 C ATOM 777 C LEU A 56 -16.828 -7.016 7.126 1.00 9.74 C ATOM 778 O LEU A 56 -16.034 -6.505 7.916 1.00 10.08 O ATOM 779 CB LEU A 56 -16.866 -9.504 6.846 1.00 10.70 C ATOM 780 CG LEU A 56 -15.366 -9.611 7.130 1.00 11.52 C ATOM 781 CD1 LEU A 56 -15.115 -9.973 8.586 1.00 12.11 C ATOM 782 CD2 LEU A 56 -14.718 -10.629 6.204 1.00 11.94 C ATOM 0 H LEU A 56 -19.204 -8.955 6.342 1.00 10.67 H new ATOM 0 HA LEU A 56 -17.573 -8.420 8.560 1.00 10.41 H new ATOM 0 HB2 LEU A 56 -17.351 -10.414 7.200 1.00 10.70 H new ATOM 0 HB3 LEU A 56 -17.012 -9.464 5.767 1.00 10.70 H new ATOM 0 HG LEU A 56 -14.914 -8.638 6.941 1.00 11.52 H new ATOM 0 HD11 LEU A 56 -14.042 -10.043 8.764 1.00 12.11 H new ATOM 0 HD12 LEU A 56 -15.540 -9.204 9.231 1.00 12.11 H new ATOM 0 HD13 LEU A 56 -15.583 -10.932 8.808 1.00 12.11 H new ATOM 0 HD21 LEU A 56 -13.652 -10.691 6.421 1.00 11.94 H new ATOM 0 HD22 LEU A 56 -15.177 -11.605 6.358 1.00 11.94 H new ATOM 0 HD23 LEU A 56 -14.860 -10.321 5.168 1.00 11.94 H new ATOM 794 N LEU A 57 -17.103 -6.495 5.936 1.00 9.01 N ATOM 795 CA LEU A 57 -16.479 -5.265 5.471 1.00 8.57 C ATOM 796 C LEU A 57 -16.866 -4.098 6.374 1.00 8.01 C ATOM 797 O LEU A 57 -16.006 -3.372 6.869 1.00 7.76 O ATOM 798 CB LEU A 57 -16.900 -4.962 4.031 1.00 8.96 C ATOM 799 CG LEU A 57 -15.758 -4.802 3.026 1.00 9.22 C ATOM 800 CD1 LEU A 57 -16.260 -4.104 1.771 1.00 9.38 C ATOM 801 CD2 LEU A 57 -14.600 -4.029 3.639 1.00 9.71 C ATOM 0 H LEU A 57 -17.758 -6.909 5.273 1.00 9.01 H new ATOM 0 HA LEU A 57 -15.398 -5.398 5.504 1.00 8.57 H new ATOM 0 HB2 LEU A 57 -17.553 -5.764 3.686 1.00 8.96 H new ATOM 0 HB3 LEU A 57 -17.492 -4.046 4.030 1.00 8.96 H new ATOM 0 HG LEU A 57 -15.395 -5.794 2.756 1.00 9.22 H new ATOM 0 HD11 LEU A 57 -15.439 -3.995 1.062 1.00 9.38 H new ATOM 0 HD12 LEU A 57 -17.054 -4.697 1.318 1.00 9.38 H new ATOM 0 HD13 LEU A 57 -16.647 -3.119 2.032 1.00 9.38 H new ATOM 0 HD21 LEU A 57 -13.801 -3.928 2.905 1.00 9.71 H new ATOM 0 HD22 LEU A 57 -14.942 -3.039 3.941 1.00 9.71 H new ATOM 0 HD23 LEU A 57 -14.226 -4.565 4.511 1.00 9.71 H new ATOM 813 N ARG A 58 -18.165 -3.940 6.599 1.00 8.00 N ATOM 814 CA ARG A 58 -18.675 -2.858 7.432 1.00 7.77 C ATOM 815 C ARG A 58 -18.178 -3.000 8.866 1.00 7.79 C ATOM 816 O ARG A 58 -17.771 -2.018 9.487 1.00 7.99 O ATOM 817 CB ARG A 58 -20.203 -2.834 7.401 1.00 8.25 C ATOM 818 CG ARG A 58 -20.807 -1.586 8.027 1.00 8.49 C ATOM 819 CD ARG A 58 -22.309 -1.522 7.802 1.00 9.14 C ATOM 820 NE ARG A 58 -22.909 -0.318 8.380 1.00 9.67 N ATOM 821 CZ ARG A 58 -24.199 -0.208 8.696 1.00 10.46 C ATOM 822 NH1 ARG A 58 -25.019 -1.240 8.529 1.00 10.80 N ATOM 823 NH2 ARG A 58 -24.667 0.933 9.189 1.00 11.06 N ATOM 0 H ARG A 58 -18.886 -4.550 6.215 1.00 8.00 H new ATOM 0 HA ARG A 58 -18.303 -1.915 7.031 1.00 7.77 H new ATOM 0 HB2 ARG A 58 -20.538 -2.910 6.367 1.00 8.25 H new ATOM 0 HB3 ARG A 58 -20.582 -3.712 7.924 1.00 8.25 H new ATOM 0 HG2 ARG A 58 -20.597 -1.576 9.097 1.00 8.49 H new ATOM 0 HG3 ARG A 58 -20.336 -0.700 7.602 1.00 8.49 H new ATOM 0 HD2 ARG A 58 -22.515 -1.549 6.732 1.00 9.14 H new ATOM 0 HD3 ARG A 58 -22.777 -2.404 8.239 1.00 9.14 H new ATOM 0 HE ARG A 58 -22.303 0.485 8.551 1.00 9.67 H new ATOM 0 HH11 ARG A 58 -24.662 -2.120 8.158 1.00 10.80 H new ATOM 0 HH12 ARG A 58 -26.006 -1.152 8.772 1.00 10.80 H new ATOM 0 HH21 ARG A 58 -24.039 1.725 9.326 1.00 11.06 H new ATOM 0 HH22 ARG A 58 -25.654 1.017 9.431 1.00 11.06 H new ATOM 837 N ASP A 59 -18.208 -4.224 9.380 1.00 7.90 N ATOM 838 CA ASP A 59 -17.751 -4.495 10.739 1.00 8.29 C ATOM 839 C ASP A 59 -16.292 -4.087 10.902 1.00 8.20 C ATOM 840 O ASP A 59 -15.934 -3.389 11.852 1.00 8.39 O ATOM 841 CB ASP A 59 -17.916 -5.976 11.082 1.00 8.86 C ATOM 842 CG ASP A 59 -17.474 -6.289 12.497 1.00 9.31 C ATOM 843 OD1 ASP A 59 -18.197 -5.915 13.446 1.00 9.71 O ATOM 844 OD2 ASP A 59 -16.407 -6.911 12.670 1.00 9.46 O ATOM 0 H ASP A 59 -18.544 -5.045 8.877 1.00 7.90 H new ATOM 0 HA ASP A 59 -18.363 -3.908 11.423 1.00 8.29 H new ATOM 0 HB2 ASP A 59 -18.961 -6.262 10.958 1.00 8.86 H new ATOM 0 HB3 ASP A 59 -17.336 -6.576 10.381 1.00 8.86 H new ATOM 849 N SER A 60 -15.461 -4.506 9.953 1.00 8.16 N ATOM 850 CA SER A 60 -14.043 -4.180 9.975 1.00 8.37 C ATOM 851 C SER A 60 -13.839 -2.669 9.873 1.00 8.73 C ATOM 852 O SER A 60 -12.920 -2.115 10.480 1.00 9.52 O ATOM 853 CB SER A 60 -13.317 -4.897 8.835 1.00 8.66 C ATOM 854 OG SER A 60 -13.516 -6.300 8.917 1.00 8.89 O ATOM 0 H SER A 60 -15.749 -5.074 9.157 1.00 8.16 H new ATOM 0 HA SER A 60 -13.623 -4.519 10.922 1.00 8.37 H new ATOM 0 HB2 SER A 60 -13.682 -4.528 7.876 1.00 8.66 H new ATOM 0 HB3 SER A 60 -12.251 -4.673 8.878 1.00 8.66 H new ATOM 0 HG SER A 60 -14.397 -6.527 8.552 1.00 8.89 H new ATOM 860 N PHE A 61 -14.705 -2.004 9.113 1.00 8.33 N ATOM 861 CA PHE A 61 -14.627 -0.559 8.960 1.00 8.80 C ATOM 862 C PHE A 61 -14.875 0.117 10.300 1.00 8.83 C ATOM 863 O PHE A 61 -14.183 1.060 10.665 1.00 9.18 O ATOM 864 CB PHE A 61 -15.636 -0.061 7.925 1.00 9.15 C ATOM 865 CG PHE A 61 -15.162 -0.197 6.509 1.00 9.81 C ATOM 866 CD1 PHE A 61 -13.811 -0.137 6.207 1.00 10.30 C ATOM 867 CD2 PHE A 61 -16.068 -0.382 5.480 1.00 10.14 C ATOM 868 CE1 PHE A 61 -13.373 -0.261 4.904 1.00 11.11 C ATOM 869 CE2 PHE A 61 -15.636 -0.505 4.174 1.00 10.92 C ATOM 870 CZ PHE A 61 -14.287 -0.445 3.885 1.00 11.40 C ATOM 0 H PHE A 61 -15.466 -2.444 8.596 1.00 8.33 H new ATOM 0 HA PHE A 61 -13.627 -0.305 8.608 1.00 8.80 H new ATOM 0 HB2 PHE A 61 -16.567 -0.615 8.042 1.00 9.15 H new ATOM 0 HB3 PHE A 61 -15.861 0.987 8.125 1.00 9.15 H new ATOM 0 HD1 PHE A 61 -13.093 0.008 7.000 1.00 10.30 H new ATOM 0 HD2 PHE A 61 -17.124 -0.431 5.700 1.00 10.14 H new ATOM 0 HE1 PHE A 61 -12.317 -0.214 4.682 1.00 11.11 H new ATOM 0 HE2 PHE A 61 -16.353 -0.648 3.379 1.00 10.92 H new ATOM 0 HZ PHE A 61 -13.947 -0.542 2.864 1.00 11.40 H new ATOM 880 N GLN A 62 -15.855 -0.385 11.039 1.00 8.73 N ATOM 881 CA GLN A 62 -16.174 0.173 12.343 1.00 9.08 C ATOM 882 C GLN A 62 -15.039 -0.102 13.323 1.00 9.26 C ATOM 883 O GLN A 62 -14.759 0.708 14.208 1.00 9.50 O ATOM 884 CB GLN A 62 -17.492 -0.398 12.877 1.00 9.51 C ATOM 885 CG GLN A 62 -18.676 -0.183 11.946 1.00 9.32 C ATOM 886 CD GLN A 62 -18.873 1.273 11.557 1.00 9.53 C ATOM 887 OE1 GLN A 62 -18.623 2.182 12.486 1.00 9.42 O flip ATOM 888 NE2 GLN A 62 -19.266 1.577 10.430 1.00 10.04 N flip ATOM 0 H GLN A 62 -16.439 -1.173 10.759 1.00 8.73 H new ATOM 0 HA GLN A 62 -16.293 1.251 12.234 1.00 9.08 H new ATOM 0 HB2 GLN A 62 -17.369 -1.467 13.053 1.00 9.51 H new ATOM 0 HB3 GLN A 62 -17.712 0.061 13.841 1.00 9.51 H new ATOM 0 HG2 GLN A 62 -18.533 -0.778 11.044 1.00 9.32 H new ATOM 0 HG3 GLN A 62 -19.582 -0.549 12.429 1.00 9.32 H new ATOM 0 HE21 GLN A 62 -19.448 0.849 9.740 1.00 10.04 H new ATOM 0 HE22 GLN A 62 -19.409 2.557 10.187 1.00 10.04 H new ATOM 897 N GLN A 63 -14.375 -1.242 13.145 1.00 9.36 N ATOM 898 CA GLN A 63 -13.263 -1.623 14.007 1.00 9.71 C ATOM 899 C GLN A 63 -12.043 -0.741 13.750 1.00 10.03 C ATOM 900 O GLN A 63 -11.341 -0.361 14.685 1.00 10.60 O ATOM 901 CB GLN A 63 -12.892 -3.093 13.809 1.00 9.50 C ATOM 902 CG GLN A 63 -13.993 -4.064 14.206 1.00 9.75 C ATOM 903 CD GLN A 63 -13.460 -5.437 14.558 1.00 9.97 C ATOM 904 OE1 GLN A 63 -12.371 -5.569 15.119 1.00 10.06 O ATOM 905 NE2 GLN A 63 -14.219 -6.469 14.232 1.00 10.30 N ATOM 0 H GLN A 63 -14.589 -1.917 12.411 1.00 9.36 H new ATOM 0 HA GLN A 63 -13.586 -1.481 15.038 1.00 9.71 H new ATOM 0 HB2 GLN A 63 -12.638 -3.256 12.762 1.00 9.50 H new ATOM 0 HB3 GLN A 63 -11.998 -3.314 14.392 1.00 9.50 H new ATOM 0 HG2 GLN A 63 -14.538 -3.660 15.059 1.00 9.75 H new ATOM 0 HG3 GLN A 63 -14.706 -4.154 13.386 1.00 9.75 H new ATOM 0 HE21 GLN A 63 -15.115 -6.317 13.768 1.00 10.30 H new ATOM 0 HE22 GLN A 63 -13.909 -7.417 14.444 1.00 10.30 H new ATOM 914 N VAL A 64 -11.795 -0.399 12.485 1.00 9.80 N ATOM 915 CA VAL A 64 -10.650 0.443 12.146 1.00 10.18 C ATOM 916 C VAL A 64 -10.842 1.857 12.698 1.00 10.37 C ATOM 917 O VAL A 64 -9.869 2.572 12.962 1.00 10.25 O ATOM 918 CB VAL A 64 -10.375 0.484 10.622 1.00 10.36 C ATOM 919 CG1 VAL A 64 -11.287 1.470 9.908 1.00 10.34 C ATOM 920 CG2 VAL A 64 -8.917 0.820 10.358 1.00 10.62 C ATOM 0 H VAL A 64 -12.364 -0.688 11.689 1.00 9.80 H new ATOM 0 HA VAL A 64 -9.774 -0.005 12.614 1.00 10.18 H new ATOM 0 HB VAL A 64 -10.590 -0.507 10.222 1.00 10.36 H new ATOM 0 HG11 VAL A 64 -11.061 1.468 8.842 1.00 10.34 H new ATOM 0 HG12 VAL A 64 -12.327 1.179 10.060 1.00 10.34 H new ATOM 0 HG13 VAL A 64 -11.128 2.470 10.311 1.00 10.34 H new ATOM 0 HG21 VAL A 64 -8.738 0.845 9.283 1.00 10.62 H new ATOM 0 HG22 VAL A 64 -8.685 1.794 10.788 1.00 10.62 H new ATOM 0 HG23 VAL A 64 -8.281 0.062 10.814 1.00 10.62 H new ATOM 930 N VAL A 65 -12.103 2.247 12.877 1.00 10.88 N ATOM 931 CA VAL A 65 -12.434 3.554 13.433 1.00 11.34 C ATOM 932 C VAL A 65 -12.166 3.534 14.937 1.00 11.77 C ATOM 933 O VAL A 65 -11.966 4.572 15.570 1.00 11.90 O ATOM 934 CB VAL A 65 -13.910 3.934 13.151 1.00 11.81 C ATOM 935 CG1 VAL A 65 -14.270 5.274 13.776 1.00 12.41 C ATOM 936 CG2 VAL A 65 -14.169 3.972 11.654 1.00 11.68 C ATOM 0 H VAL A 65 -12.913 1.673 12.644 1.00 10.88 H new ATOM 0 HA VAL A 65 -11.809 4.308 12.955 1.00 11.34 H new ATOM 0 HB VAL A 65 -14.541 3.170 13.605 1.00 11.81 H new ATOM 0 HG11 VAL A 65 -15.312 5.509 13.558 1.00 12.41 H new ATOM 0 HG12 VAL A 65 -14.128 5.222 14.855 1.00 12.41 H new ATOM 0 HG13 VAL A 65 -13.629 6.052 13.363 1.00 12.41 H new ATOM 0 HG21 VAL A 65 -15.210 4.240 11.471 1.00 11.68 H new ATOM 0 HG22 VAL A 65 -13.517 4.712 11.191 1.00 11.68 H new ATOM 0 HG23 VAL A 65 -13.967 2.991 11.225 1.00 11.68 H new ATOM 946 N LYS A 66 -12.150 2.329 15.497 1.00 12.17 N ATOM 947 CA LYS A 66 -11.878 2.140 16.914 1.00 12.79 C ATOM 948 C LYS A 66 -10.374 2.058 17.136 1.00 12.52 C ATOM 949 O LYS A 66 -9.860 2.472 18.173 1.00 12.98 O ATOM 950 CB LYS A 66 -12.545 0.861 17.428 1.00 13.48 C ATOM 951 CG LYS A 66 -14.062 0.901 17.402 1.00 14.09 C ATOM 952 CD LYS A 66 -14.663 -0.414 17.876 1.00 14.62 C ATOM 953 CE LYS A 66 -14.338 -0.689 19.336 1.00 15.63 C ATOM 954 NZ LYS A 66 -14.848 -2.015 19.775 1.00 16.25 N ATOM 0 H LYS A 66 -12.324 1.464 14.985 1.00 12.17 H new ATOM 0 HA LYS A 66 -12.286 2.988 17.464 1.00 12.79 H new ATOM 0 HB2 LYS A 66 -12.204 0.019 16.826 1.00 13.48 H new ATOM 0 HB3 LYS A 66 -12.214 0.677 18.450 1.00 13.48 H new ATOM 0 HG2 LYS A 66 -14.416 1.714 18.036 1.00 14.09 H new ATOM 0 HG3 LYS A 66 -14.404 1.114 16.389 1.00 14.09 H new ATOM 0 HD2 LYS A 66 -15.745 -0.388 17.743 1.00 14.62 H new ATOM 0 HD3 LYS A 66 -14.285 -1.230 17.260 1.00 14.62 H new ATOM 0 HE2 LYS A 66 -13.259 -0.648 19.482 1.00 15.63 H new ATOM 0 HE3 LYS A 66 -14.774 0.092 19.959 1.00 15.63 H new ATOM 0 HZ1 LYS A 66 -14.607 -2.166 20.775 1.00 16.25 H new ATOM 0 HZ2 LYS A 66 -15.881 -2.045 19.659 1.00 16.25 H new ATOM 0 HZ3 LYS A 66 -14.413 -2.763 19.198 1.00 16.25 H new ATOM 968 N LEU A 67 -9.678 1.507 16.149 1.00 11.90 N ATOM 969 CA LEU A 67 -8.229 1.369 16.208 1.00 11.71 C ATOM 970 C LEU A 67 -7.558 2.734 16.119 1.00 11.44 C ATOM 971 O LEU A 67 -6.769 3.099 16.991 1.00 11.79 O ATOM 972 CB LEU A 67 -7.734 0.461 15.081 1.00 11.29 C ATOM 973 CG LEU A 67 -8.092 -1.018 15.237 1.00 11.71 C ATOM 974 CD1 LEU A 67 -7.662 -1.800 14.009 1.00 11.30 C ATOM 975 CD2 LEU A 67 -7.442 -1.593 16.485 1.00 12.66 C ATOM 0 H LEU A 67 -10.098 1.146 15.292 1.00 11.90 H new ATOM 0 HA LEU A 67 -7.965 0.915 17.163 1.00 11.71 H new ATOM 0 HB2 LEU A 67 -8.145 0.821 14.138 1.00 11.29 H new ATOM 0 HB3 LEU A 67 -6.650 0.551 15.012 1.00 11.29 H new ATOM 0 HG LEU A 67 -9.174 -1.102 15.340 1.00 11.71 H new ATOM 0 HD11 LEU A 67 -7.924 -2.850 14.136 1.00 11.30 H new ATOM 0 HD12 LEU A 67 -8.169 -1.404 13.129 1.00 11.30 H new ATOM 0 HD13 LEU A 67 -6.584 -1.708 13.878 1.00 11.30 H new ATOM 0 HD21 LEU A 67 -7.707 -2.646 16.581 1.00 12.66 H new ATOM 0 HD22 LEU A 67 -6.359 -1.497 16.408 1.00 12.66 H new ATOM 0 HD23 LEU A 67 -7.793 -1.049 17.362 1.00 12.66 H new ATOM 987 N LYS A 68 -7.893 3.473 15.060 1.00 11.01 N ATOM 988 CA LYS A 68 -7.355 4.817 14.822 1.00 10.94 C ATOM 989 C LYS A 68 -5.831 4.819 14.698 1.00 10.41 C ATOM 990 O LYS A 68 -5.108 4.833 15.695 1.00 10.69 O ATOM 991 CB LYS A 68 -7.796 5.777 15.928 1.00 11.97 C ATOM 992 CG LYS A 68 -9.276 6.112 15.876 1.00 12.39 C ATOM 993 CD LYS A 68 -9.665 7.121 16.941 1.00 13.41 C ATOM 994 CE LYS A 68 -11.092 7.598 16.750 1.00 13.95 C ATOM 995 NZ LYS A 68 -11.459 8.668 17.708 1.00 14.83 N ATOM 0 H LYS A 68 -8.545 3.158 14.342 1.00 11.01 H new ATOM 0 HA LYS A 68 -7.760 5.157 13.869 1.00 10.94 H new ATOM 0 HB2 LYS A 68 -7.564 5.335 16.897 1.00 11.97 H new ATOM 0 HB3 LYS A 68 -7.219 6.698 15.852 1.00 11.97 H new ATOM 0 HG2 LYS A 68 -9.524 6.509 14.892 1.00 12.39 H new ATOM 0 HG3 LYS A 68 -9.859 5.201 16.009 1.00 12.39 H new ATOM 0 HD2 LYS A 68 -9.558 6.671 17.928 1.00 13.41 H new ATOM 0 HD3 LYS A 68 -8.986 7.973 16.904 1.00 13.41 H new ATOM 0 HE2 LYS A 68 -11.217 7.966 15.732 1.00 13.95 H new ATOM 0 HE3 LYS A 68 -11.774 6.756 16.870 1.00 13.95 H new ATOM 0 HZ1 LYS A 68 -12.274 8.361 18.276 1.00 14.83 H new ATOM 0 HZ2 LYS A 68 -10.653 8.863 18.336 1.00 14.83 H new ATOM 0 HZ3 LYS A 68 -11.708 9.532 17.185 1.00 14.83 H new ATOM 1009 N GLY A 69 -5.350 4.807 13.464 1.00 9.80 N ATOM 1010 CA GLY A 69 -3.918 4.818 13.228 1.00 9.42 C ATOM 1011 C GLY A 69 -3.361 3.428 13.027 1.00 9.15 C ATOM 1012 O GLY A 69 -2.219 3.256 12.597 1.00 9.55 O ATOM 0 H GLY A 69 -5.924 4.790 12.621 1.00 9.80 H new ATOM 0 HA2 GLY A 69 -3.701 5.425 12.349 1.00 9.42 H new ATOM 0 HA3 GLY A 69 -3.416 5.290 14.073 1.00 9.42 H new ATOM 1016 N GLN A 70 -4.170 2.433 13.342 1.00 8.62 N ATOM 1017 CA GLN A 70 -3.773 1.047 13.189 1.00 8.50 C ATOM 1018 C GLN A 70 -4.352 0.498 11.896 1.00 7.86 C ATOM 1019 O GLN A 70 -5.507 0.768 11.563 1.00 7.96 O ATOM 1020 CB GLN A 70 -4.247 0.221 14.390 1.00 8.66 C ATOM 1021 CG GLN A 70 -3.711 -1.202 14.414 1.00 9.04 C ATOM 1022 CD GLN A 70 -2.209 -1.270 14.221 1.00 8.99 C ATOM 1023 OE1 GLN A 70 -1.725 -1.425 13.101 1.00 8.60 O ATOM 1024 NE2 GLN A 70 -1.463 -1.143 15.307 1.00 9.59 N ATOM 0 H GLN A 70 -5.113 2.562 13.708 1.00 8.62 H new ATOM 0 HA GLN A 70 -2.686 0.984 13.146 1.00 8.50 H new ATOM 0 HB2 GLN A 70 -3.946 0.727 15.307 1.00 8.66 H new ATOM 0 HB3 GLN A 70 -5.336 0.188 14.387 1.00 8.66 H new ATOM 0 HG2 GLN A 70 -3.971 -1.667 15.365 1.00 9.04 H new ATOM 0 HG3 GLN A 70 -4.199 -1.782 13.631 1.00 9.04 H new ATOM 0 HE21 GLN A 70 -1.905 -1.016 16.217 1.00 9.59 H new ATOM 0 HE22 GLN A 70 -0.446 -1.172 15.233 1.00 9.59 H new ATOM 1033 N VAL A 71 -3.548 -0.251 11.164 1.00 7.44 N ATOM 1034 CA VAL A 71 -3.987 -0.821 9.905 1.00 7.11 C ATOM 1035 C VAL A 71 -4.636 -2.188 10.125 1.00 6.68 C ATOM 1036 O VAL A 71 -4.029 -3.103 10.691 1.00 6.65 O ATOM 1037 CB VAL A 71 -2.822 -0.924 8.882 1.00 7.45 C ATOM 1038 CG1 VAL A 71 -1.626 -1.655 9.473 1.00 8.10 C ATOM 1039 CG2 VAL A 71 -3.283 -1.602 7.599 1.00 7.17 C ATOM 0 H VAL A 71 -2.587 -0.478 11.420 1.00 7.44 H new ATOM 0 HA VAL A 71 -4.733 -0.147 9.485 1.00 7.11 H new ATOM 0 HB VAL A 71 -2.507 0.091 8.641 1.00 7.45 H new ATOM 0 HG11 VAL A 71 -0.830 -1.709 8.731 1.00 8.10 H new ATOM 0 HG12 VAL A 71 -1.268 -1.117 10.351 1.00 8.10 H new ATOM 0 HG13 VAL A 71 -1.922 -2.664 9.762 1.00 8.10 H new ATOM 0 HG21 VAL A 71 -2.449 -1.662 6.899 1.00 7.17 H new ATOM 0 HG22 VAL A 71 -3.639 -2.607 7.826 1.00 7.17 H new ATOM 0 HG23 VAL A 71 -4.091 -1.023 7.152 1.00 7.17 H new ATOM 1049 N LEU A 72 -5.883 -2.306 9.700 1.00 6.60 N ATOM 1050 CA LEU A 72 -6.629 -3.545 9.832 1.00 6.50 C ATOM 1051 C LEU A 72 -6.820 -4.178 8.462 1.00 6.09 C ATOM 1052 O LEU A 72 -7.476 -3.609 7.589 1.00 5.82 O ATOM 1053 CB LEU A 72 -7.988 -3.286 10.488 1.00 6.93 C ATOM 1054 CG LEU A 72 -8.810 -4.541 10.803 1.00 7.33 C ATOM 1055 CD1 LEU A 72 -8.115 -5.384 11.861 1.00 7.61 C ATOM 1056 CD2 LEU A 72 -10.214 -4.161 11.253 1.00 7.80 C ATOM 0 H LEU A 72 -6.404 -1.550 9.256 1.00 6.60 H new ATOM 0 HA LEU A 72 -6.066 -4.229 10.467 1.00 6.50 H new ATOM 0 HB2 LEU A 72 -7.827 -2.734 11.414 1.00 6.93 H new ATOM 0 HB3 LEU A 72 -8.574 -2.643 9.831 1.00 6.93 H new ATOM 0 HG LEU A 72 -8.892 -5.136 9.893 1.00 7.33 H new ATOM 0 HD11 LEU A 72 -8.714 -6.270 12.071 1.00 7.61 H new ATOM 0 HD12 LEU A 72 -7.133 -5.687 11.497 1.00 7.61 H new ATOM 0 HD13 LEU A 72 -7.999 -4.800 12.774 1.00 7.61 H new ATOM 0 HD21 LEU A 72 -10.783 -5.065 11.472 1.00 7.80 H new ATOM 0 HD22 LEU A 72 -10.154 -3.544 12.149 1.00 7.80 H new ATOM 0 HD23 LEU A 72 -10.712 -3.602 10.460 1.00 7.80 H new ATOM 1068 N SER A 73 -6.232 -5.345 8.274 1.00 6.37 N ATOM 1069 CA SER A 73 -6.324 -6.051 7.010 1.00 6.44 C ATOM 1070 C SER A 73 -7.497 -7.027 7.012 1.00 6.58 C ATOM 1071 O SER A 73 -7.439 -8.088 7.636 1.00 7.12 O ATOM 1072 CB SER A 73 -5.012 -6.787 6.746 1.00 7.06 C ATOM 1073 OG SER A 73 -3.907 -5.978 7.115 1.00 7.59 O ATOM 0 H SER A 73 -5.682 -5.826 8.986 1.00 6.37 H new ATOM 0 HA SER A 73 -6.499 -5.328 6.213 1.00 6.44 H new ATOM 0 HB2 SER A 73 -4.992 -7.720 7.309 1.00 7.06 H new ATOM 0 HB3 SER A 73 -4.942 -7.050 5.691 1.00 7.06 H new ATOM 0 HG SER A 73 -3.074 -6.464 6.942 1.00 7.59 H new ATOM 1079 N VAL A 74 -8.566 -6.651 6.329 1.00 6.36 N ATOM 1080 CA VAL A 74 -9.750 -7.491 6.239 1.00 6.77 C ATOM 1081 C VAL A 74 -9.720 -8.289 4.939 1.00 6.50 C ATOM 1082 O VAL A 74 -9.565 -7.726 3.856 1.00 6.07 O ATOM 1083 CB VAL A 74 -11.054 -6.654 6.332 1.00 7.13 C ATOM 1084 CG1 VAL A 74 -11.006 -5.445 5.405 1.00 6.85 C ATOM 1085 CG2 VAL A 74 -12.274 -7.514 6.025 1.00 7.84 C ATOM 0 H VAL A 74 -8.638 -5.766 5.827 1.00 6.36 H new ATOM 0 HA VAL A 74 -9.743 -8.179 7.085 1.00 6.77 H new ATOM 0 HB VAL A 74 -11.138 -6.289 7.356 1.00 7.13 H new ATOM 0 HG11 VAL A 74 -11.934 -4.881 5.495 1.00 6.85 H new ATOM 0 HG12 VAL A 74 -10.166 -4.808 5.681 1.00 6.85 H new ATOM 0 HG13 VAL A 74 -10.884 -5.781 4.375 1.00 6.85 H new ATOM 0 HG21 VAL A 74 -13.175 -6.905 6.097 1.00 7.84 H new ATOM 0 HG22 VAL A 74 -12.189 -7.919 5.017 1.00 7.84 H new ATOM 0 HG23 VAL A 74 -12.331 -8.333 6.742 1.00 7.84 H new ATOM 1095 N MET A 75 -9.833 -9.603 5.053 1.00 7.05 N ATOM 1096 CA MET A 75 -9.810 -10.462 3.882 1.00 7.23 C ATOM 1097 C MET A 75 -11.216 -10.892 3.493 1.00 7.58 C ATOM 1098 O MET A 75 -11.899 -11.589 4.248 1.00 8.07 O ATOM 1099 CB MET A 75 -8.938 -11.691 4.137 1.00 7.58 C ATOM 1100 CG MET A 75 -8.591 -12.456 2.868 1.00 8.16 C ATOM 1101 SD MET A 75 -7.655 -13.959 3.199 1.00 8.88 S ATOM 1102 CE MET A 75 -7.188 -14.429 1.536 1.00 9.35 C ATOM 0 H MET A 75 -9.941 -10.095 5.940 1.00 7.05 H new ATOM 0 HA MET A 75 -9.384 -9.892 3.056 1.00 7.23 H new ATOM 0 HB2 MET A 75 -8.016 -11.379 4.628 1.00 7.58 H new ATOM 0 HB3 MET A 75 -9.456 -12.359 4.826 1.00 7.58 H new ATOM 0 HG2 MET A 75 -9.510 -12.713 2.341 1.00 8.16 H new ATOM 0 HG3 MET A 75 -8.013 -11.811 2.206 1.00 8.16 H new ATOM 0 HE1 MET A 75 -6.499 -15.273 1.576 1.00 9.35 H new ATOM 0 HE2 MET A 75 -8.078 -14.714 0.975 1.00 9.35 H new ATOM 0 HE3 MET A 75 -6.702 -13.587 1.043 1.00 9.35 H new ATOM 1112 N PHE A 76 -11.639 -10.457 2.320 1.00 7.53 N ATOM 1113 CA PHE A 76 -12.956 -10.790 1.794 1.00 7.96 C ATOM 1114 C PHE A 76 -12.871 -10.914 0.278 1.00 8.18 C ATOM 1115 O PHE A 76 -11.779 -10.874 -0.284 1.00 8.37 O ATOM 1116 CB PHE A 76 -13.992 -9.727 2.196 1.00 7.98 C ATOM 1117 CG PHE A 76 -13.736 -8.367 1.607 1.00 8.18 C ATOM 1118 CD1 PHE A 76 -12.818 -7.509 2.185 1.00 8.46 C ATOM 1119 CD2 PHE A 76 -14.415 -7.948 0.474 1.00 8.59 C ATOM 1120 CE1 PHE A 76 -12.580 -6.261 1.646 1.00 9.07 C ATOM 1121 CE2 PHE A 76 -14.182 -6.701 -0.071 1.00 9.23 C ATOM 1122 CZ PHE A 76 -13.262 -5.857 0.516 1.00 9.66 C ATOM 0 H PHE A 76 -11.083 -9.864 1.704 1.00 7.53 H new ATOM 0 HA PHE A 76 -13.281 -11.741 2.217 1.00 7.96 H new ATOM 0 HB2 PHE A 76 -14.981 -10.064 1.887 1.00 7.98 H new ATOM 0 HB3 PHE A 76 -14.008 -9.643 3.283 1.00 7.98 H new ATOM 0 HD1 PHE A 76 -12.281 -7.819 3.069 1.00 8.46 H new ATOM 0 HD2 PHE A 76 -15.136 -8.606 0.011 1.00 8.59 H new ATOM 0 HE1 PHE A 76 -11.861 -5.601 2.108 1.00 9.07 H new ATOM 0 HE2 PHE A 76 -14.718 -6.387 -0.954 1.00 9.23 H new ATOM 0 HZ PHE A 76 -13.076 -4.881 0.092 1.00 9.66 H new ATOM 1132 N ARG A 77 -14.008 -11.067 -0.381 1.00 8.33 N ATOM 1133 CA ARG A 77 -14.022 -11.189 -1.829 1.00 8.76 C ATOM 1134 C ARG A 77 -14.604 -9.936 -2.473 1.00 8.37 C ATOM 1135 O ARG A 77 -15.762 -9.580 -2.244 1.00 8.58 O ATOM 1136 CB ARG A 77 -14.790 -12.437 -2.256 1.00 9.53 C ATOM 1137 CG ARG A 77 -13.903 -13.671 -2.339 1.00 10.38 C ATOM 1138 CD ARG A 77 -14.710 -14.939 -2.540 1.00 11.13 C ATOM 1139 NE ARG A 77 -15.343 -15.394 -1.303 1.00 11.57 N ATOM 1140 CZ ARG A 77 -16.089 -16.492 -1.210 1.00 12.50 C ATOM 1141 NH1 ARG A 77 -16.252 -17.282 -2.264 1.00 13.10 N ATOM 1142 NH2 ARG A 77 -16.654 -16.810 -0.052 1.00 12.92 N ATOM 0 H ARG A 77 -14.927 -11.109 0.060 1.00 8.33 H new ATOM 0 HA ARG A 77 -12.993 -11.293 -2.175 1.00 8.76 H new ATOM 0 HB2 ARG A 77 -15.598 -12.622 -1.548 1.00 9.53 H new ATOM 0 HB3 ARG A 77 -15.252 -12.260 -3.227 1.00 9.53 H new ATOM 0 HG2 ARG A 77 -13.198 -13.556 -3.162 1.00 10.38 H new ATOM 0 HG3 ARG A 77 -13.315 -13.757 -1.425 1.00 10.38 H new ATOM 0 HD2 ARG A 77 -15.476 -14.764 -3.295 1.00 11.13 H new ATOM 0 HD3 ARG A 77 -14.059 -15.725 -2.923 1.00 11.13 H new ATOM 0 HE ARG A 77 -15.204 -14.836 -0.460 1.00 11.57 H new ATOM 0 HH11 ARG A 77 -15.804 -17.049 -3.150 1.00 13.10 H new ATOM 0 HH12 ARG A 77 -16.825 -18.123 -2.188 1.00 13.10 H new ATOM 0 HH21 ARG A 77 -16.516 -16.213 0.764 1.00 12.92 H new ATOM 0 HH22 ARG A 77 -17.226 -17.651 0.022 1.00 12.92 H new ATOM 1156 N PHE A 78 -13.780 -9.272 -3.272 1.00 8.00 N ATOM 1157 CA PHE A 78 -14.171 -8.044 -3.953 1.00 7.81 C ATOM 1158 C PHE A 78 -14.623 -8.347 -5.379 1.00 7.97 C ATOM 1159 O PHE A 78 -14.143 -9.296 -6.003 1.00 8.21 O ATOM 1160 CB PHE A 78 -12.991 -7.066 -3.968 1.00 8.16 C ATOM 1161 CG PHE A 78 -13.385 -5.629 -4.185 1.00 8.43 C ATOM 1162 CD1 PHE A 78 -13.941 -4.885 -3.157 1.00 8.53 C ATOM 1163 CD2 PHE A 78 -13.195 -5.022 -5.417 1.00 8.83 C ATOM 1164 CE1 PHE A 78 -14.301 -3.566 -3.354 1.00 8.94 C ATOM 1165 CE2 PHE A 78 -13.552 -3.702 -5.619 1.00 9.26 C ATOM 1166 CZ PHE A 78 -14.105 -2.974 -4.586 1.00 9.28 C ATOM 0 H PHE A 78 -12.824 -9.568 -3.467 1.00 8.00 H new ATOM 0 HA PHE A 78 -15.005 -7.591 -3.417 1.00 7.81 H new ATOM 0 HB2 PHE A 78 -12.455 -7.146 -3.022 1.00 8.16 H new ATOM 0 HB3 PHE A 78 -12.297 -7.364 -4.754 1.00 8.16 H new ATOM 0 HD1 PHE A 78 -14.095 -5.342 -2.190 1.00 8.53 H new ATOM 0 HD2 PHE A 78 -12.763 -5.588 -6.229 1.00 8.83 H new ATOM 0 HE1 PHE A 78 -14.736 -2.998 -2.545 1.00 8.94 H new ATOM 0 HE2 PHE A 78 -13.398 -3.241 -6.584 1.00 9.26 H new ATOM 0 HZ PHE A 78 -14.384 -1.942 -4.741 1.00 9.28 H new ATOM 1176 N ARG A 79 -15.542 -7.536 -5.886 1.00 7.99 N ATOM 1177 CA ARG A 79 -16.073 -7.710 -7.231 1.00 8.38 C ATOM 1178 C ARG A 79 -15.204 -6.994 -8.263 1.00 8.66 C ATOM 1179 O ARG A 79 -15.000 -5.783 -8.183 1.00 8.73 O ATOM 1180 CB ARG A 79 -17.508 -7.181 -7.291 1.00 8.53 C ATOM 1181 CG ARG A 79 -18.097 -7.117 -8.692 1.00 9.41 C ATOM 1182 CD ARG A 79 -19.565 -6.729 -8.650 1.00 9.82 C ATOM 1183 NE ARG A 79 -19.983 -6.007 -9.852 1.00 10.05 N ATOM 1184 CZ ARG A 79 -20.917 -5.054 -9.862 1.00 10.46 C ATOM 1185 NH1 ARG A 79 -21.553 -4.734 -8.743 1.00 10.67 N ATOM 1186 NH2 ARG A 79 -21.223 -4.436 -10.995 1.00 10.87 N ATOM 0 H ARG A 79 -15.938 -6.744 -5.380 1.00 7.99 H new ATOM 0 HA ARG A 79 -16.068 -8.774 -7.469 1.00 8.38 H new ATOM 0 HB2 ARG A 79 -18.142 -7.816 -6.672 1.00 8.53 H new ATOM 0 HB3 ARG A 79 -17.533 -6.183 -6.854 1.00 8.53 H new ATOM 0 HG2 ARG A 79 -17.543 -6.393 -9.290 1.00 9.41 H new ATOM 0 HG3 ARG A 79 -17.987 -8.085 -9.181 1.00 9.41 H new ATOM 0 HD2 ARG A 79 -20.173 -7.627 -8.538 1.00 9.82 H new ATOM 0 HD3 ARG A 79 -19.750 -6.108 -7.773 1.00 9.82 H new ATOM 0 HE ARG A 79 -19.533 -6.247 -10.736 1.00 10.05 H new ATOM 0 HH11 ARG A 79 -21.328 -5.217 -7.873 1.00 10.67 H new ATOM 0 HH12 ARG A 79 -22.267 -4.005 -8.753 1.00 10.67 H new ATOM 0 HH21 ARG A 79 -20.744 -4.689 -11.859 1.00 10.87 H new ATOM 0 HH22 ARG A 79 -21.937 -3.708 -11.002 1.00 10.87 H new ATOM 1200 N SER A 80 -14.694 -7.751 -9.223 1.00 9.00 N ATOM 1201 CA SER A 80 -13.857 -7.188 -10.274 1.00 9.50 C ATOM 1202 C SER A 80 -14.721 -6.712 -11.437 1.00 9.93 C ATOM 1203 O SER A 80 -15.945 -6.865 -11.419 1.00 10.23 O ATOM 1204 CB SER A 80 -12.855 -8.234 -10.771 1.00 10.33 C ATOM 1205 OG SER A 80 -13.502 -9.234 -11.542 1.00 10.77 O ATOM 0 H SER A 80 -14.845 -8.757 -9.297 1.00 9.00 H new ATOM 0 HA SER A 80 -13.311 -6.338 -9.864 1.00 9.50 H new ATOM 0 HB2 SER A 80 -12.085 -7.749 -11.371 1.00 10.33 H new ATOM 0 HB3 SER A 80 -12.353 -8.694 -9.920 1.00 10.33 H new ATOM 0 HG SER A 80 -12.840 -9.885 -11.855 1.00 10.77 H new ATOM 1211 N LYS A 81 -14.080 -6.149 -12.455 1.00 10.16 N ATOM 1212 CA LYS A 81 -14.784 -5.668 -13.637 1.00 10.81 C ATOM 1213 C LYS A 81 -15.305 -6.852 -14.451 1.00 11.44 C ATOM 1214 O LYS A 81 -16.139 -6.697 -15.341 1.00 11.77 O ATOM 1215 CB LYS A 81 -13.850 -4.804 -14.490 1.00 11.28 C ATOM 1216 CG LYS A 81 -14.557 -4.014 -15.581 1.00 11.83 C ATOM 1217 CD LYS A 81 -15.564 -3.034 -15.001 1.00 11.83 C ATOM 1218 CE LYS A 81 -16.074 -2.070 -16.059 1.00 12.62 C ATOM 1219 NZ LYS A 81 -15.071 -1.025 -16.394 1.00 12.66 N ATOM 0 H LYS A 81 -13.069 -6.014 -12.485 1.00 10.16 H new ATOM 0 HA LYS A 81 -15.631 -5.059 -13.323 1.00 10.81 H new ATOM 0 HB2 LYS A 81 -13.320 -4.109 -13.839 1.00 11.28 H new ATOM 0 HB3 LYS A 81 -13.099 -5.446 -14.950 1.00 11.28 H new ATOM 0 HG2 LYS A 81 -13.820 -3.471 -16.173 1.00 11.83 H new ATOM 0 HG3 LYS A 81 -15.066 -4.701 -16.257 1.00 11.83 H new ATOM 0 HD2 LYS A 81 -16.403 -3.583 -14.573 1.00 11.83 H new ATOM 0 HD3 LYS A 81 -15.102 -2.473 -14.189 1.00 11.83 H new ATOM 0 HE2 LYS A 81 -16.333 -2.626 -16.960 1.00 12.62 H new ATOM 0 HE3 LYS A 81 -16.988 -1.594 -15.704 1.00 12.62 H new ATOM 0 HZ1 LYS A 81 -15.531 -0.262 -16.930 1.00 12.66 H new ATOM 0 HZ2 LYS A 81 -14.667 -0.638 -15.517 1.00 12.66 H new ATOM 0 HZ3 LYS A 81 -14.312 -1.444 -16.969 1.00 12.66 H new ATOM 1233 N ASN A 82 -14.806 -8.037 -14.121 1.00 11.74 N ATOM 1234 CA ASN A 82 -15.212 -9.265 -14.793 1.00 12.49 C ATOM 1235 C ASN A 82 -16.406 -9.871 -14.072 1.00 12.28 C ATOM 1236 O ASN A 82 -16.882 -10.950 -14.436 1.00 12.86 O ATOM 1237 CB ASN A 82 -14.063 -10.279 -14.814 1.00 13.32 C ATOM 1238 CG ASN A 82 -12.779 -9.703 -15.374 1.00 13.91 C ATOM 1239 OD1 ASN A 82 -12.784 -8.992 -16.377 1.00 14.05 O ATOM 1240 ND2 ASN A 82 -11.668 -10.003 -14.719 1.00 14.42 N ATOM 0 H ASN A 82 -14.113 -8.174 -13.385 1.00 11.74 H new ATOM 0 HA ASN A 82 -15.483 -9.022 -15.820 1.00 12.49 H new ATOM 0 HB2 ASN A 82 -13.883 -10.637 -13.801 1.00 13.32 H new ATOM 0 HB3 ASN A 82 -14.358 -11.143 -15.410 1.00 13.32 H new ATOM 0 HD21 ASN A 82 -10.771 -9.640 -15.043 1.00 14.42 H new ATOM 0 HD22 ASN A 82 -11.709 -10.597 -13.891 1.00 14.42 H new ATOM 1247 N GLN A 83 -16.870 -9.165 -13.039 1.00 11.60 N ATOM 1248 CA GLN A 83 -18.008 -9.592 -12.226 1.00 11.56 C ATOM 1249 C GLN A 83 -17.669 -10.845 -11.424 1.00 11.14 C ATOM 1250 O GLN A 83 -18.534 -11.682 -11.160 1.00 11.21 O ATOM 1251 CB GLN A 83 -19.251 -9.821 -13.095 1.00 12.34 C ATOM 1252 CG GLN A 83 -20.169 -8.608 -13.192 1.00 12.60 C ATOM 1253 CD GLN A 83 -19.411 -7.298 -13.325 1.00 12.46 C ATOM 1254 OE1 GLN A 83 -19.134 -6.626 -12.332 1.00 12.29 O ATOM 1255 NE2 GLN A 83 -19.057 -6.933 -14.546 1.00 12.69 N ATOM 0 H GLN A 83 -16.464 -8.277 -12.742 1.00 11.60 H new ATOM 0 HA GLN A 83 -18.232 -8.791 -11.521 1.00 11.56 H new ATOM 0 HB2 GLN A 83 -18.933 -10.105 -14.098 1.00 12.34 H new ATOM 0 HB3 GLN A 83 -19.816 -10.660 -12.690 1.00 12.34 H new ATOM 0 HG2 GLN A 83 -20.830 -8.727 -14.050 1.00 12.60 H new ATOM 0 HG3 GLN A 83 -20.802 -8.567 -12.306 1.00 12.60 H new ATOM 0 HE21 GLN A 83 -19.305 -7.517 -15.345 1.00 12.69 H new ATOM 0 HE22 GLN A 83 -18.536 -6.068 -14.689 1.00 12.69 H new ATOM 1264 N GLU A 84 -16.404 -10.965 -11.040 1.00 10.85 N ATOM 1265 CA GLU A 84 -15.946 -12.100 -10.254 1.00 10.56 C ATOM 1266 C GLU A 84 -15.658 -11.643 -8.828 1.00 10.07 C ATOM 1267 O GLU A 84 -15.659 -10.443 -8.552 1.00 10.08 O ATOM 1268 CB GLU A 84 -14.692 -12.718 -10.883 1.00 10.45 C ATOM 1269 CG GLU A 84 -13.392 -12.064 -10.438 1.00 10.43 C ATOM 1270 CD GLU A 84 -12.253 -12.321 -11.392 1.00 10.44 C ATOM 1271 OE1 GLU A 84 -11.536 -13.331 -11.216 1.00 10.71 O ATOM 1272 OE2 GLU A 84 -12.062 -11.513 -12.324 1.00 10.24 O ATOM 0 H GLU A 84 -15.676 -10.286 -11.262 1.00 10.85 H new ATOM 0 HA GLU A 84 -16.725 -12.862 -10.237 1.00 10.56 H new ATOM 0 HB2 GLU A 84 -14.658 -13.779 -10.634 1.00 10.45 H new ATOM 0 HB3 GLU A 84 -14.770 -12.648 -11.968 1.00 10.45 H new ATOM 0 HG2 GLU A 84 -13.545 -10.989 -10.343 1.00 10.43 H new ATOM 0 HG3 GLU A 84 -13.123 -12.436 -9.449 1.00 10.43 H new ATOM 1279 N TRP A 85 -15.398 -12.589 -7.937 1.00 9.78 N ATOM 1280 CA TRP A 85 -15.118 -12.270 -6.546 1.00 9.50 C ATOM 1281 C TRP A 85 -13.730 -12.777 -6.161 1.00 9.40 C ATOM 1282 O TRP A 85 -13.551 -13.957 -5.860 1.00 9.53 O ATOM 1283 CB TRP A 85 -16.184 -12.885 -5.628 1.00 9.93 C ATOM 1284 CG TRP A 85 -17.588 -12.699 -6.123 1.00 10.24 C ATOM 1285 CD1 TRP A 85 -18.337 -13.607 -6.812 1.00 10.93 C ATOM 1286 CD2 TRP A 85 -18.411 -11.534 -5.969 1.00 10.07 C ATOM 1287 NE1 TRP A 85 -19.573 -13.080 -7.098 1.00 11.20 N ATOM 1288 CE2 TRP A 85 -19.643 -11.810 -6.590 1.00 10.68 C ATOM 1289 CE3 TRP A 85 -18.227 -10.288 -5.368 1.00 9.65 C ATOM 1290 CZ2 TRP A 85 -20.684 -10.887 -6.630 1.00 10.85 C ATOM 1291 CZ3 TRP A 85 -19.263 -9.373 -5.405 1.00 9.84 C ATOM 1292 CH2 TRP A 85 -20.478 -9.676 -6.031 1.00 10.42 C ATOM 0 H TRP A 85 -15.375 -13.585 -8.154 1.00 9.78 H new ATOM 0 HA TRP A 85 -15.143 -11.187 -6.425 1.00 9.50 H new ATOM 0 HB2 TRP A 85 -15.985 -13.951 -5.519 1.00 9.93 H new ATOM 0 HB3 TRP A 85 -16.096 -12.441 -4.636 1.00 9.93 H new ATOM 0 HD1 TRP A 85 -18.007 -14.596 -7.092 1.00 10.93 H new ATOM 0 HE1 TRP A 85 -20.318 -13.557 -7.606 1.00 11.20 H new ATOM 0 HE3 TRP A 85 -17.293 -10.043 -4.883 1.00 9.65 H new ATOM 0 HZ2 TRP A 85 -21.620 -11.119 -7.116 1.00 10.85 H new ATOM 0 HZ3 TRP A 85 -19.132 -8.406 -4.942 1.00 9.84 H new ATOM 0 HH2 TRP A 85 -21.267 -8.939 -6.041 1.00 10.42 H new ATOM 1303 N LEU A 86 -12.752 -11.883 -6.178 1.00 9.37 N ATOM 1304 CA LEU A 86 -11.382 -12.248 -5.842 1.00 9.51 C ATOM 1305 C LEU A 86 -11.075 -11.923 -4.386 1.00 8.86 C ATOM 1306 O LEU A 86 -11.663 -11.006 -3.811 1.00 8.45 O ATOM 1307 CB LEU A 86 -10.395 -11.530 -6.769 1.00 10.04 C ATOM 1308 CG LEU A 86 -10.621 -10.026 -6.938 1.00 10.26 C ATOM 1309 CD1 LEU A 86 -9.645 -9.233 -6.083 1.00 10.30 C ATOM 1310 CD2 LEU A 86 -10.489 -9.639 -8.403 1.00 11.12 C ATOM 0 H LEU A 86 -12.881 -10.901 -6.420 1.00 9.37 H new ATOM 0 HA LEU A 86 -11.273 -13.324 -5.981 1.00 9.51 H new ATOM 0 HB2 LEU A 86 -9.386 -11.687 -6.388 1.00 10.04 H new ATOM 0 HB3 LEU A 86 -10.441 -11.999 -7.752 1.00 10.04 H new ATOM 0 HG LEU A 86 -11.631 -9.788 -6.603 1.00 10.26 H new ATOM 0 HD11 LEU A 86 -9.825 -8.167 -6.220 1.00 10.30 H new ATOM 0 HD12 LEU A 86 -9.786 -9.493 -5.034 1.00 10.30 H new ATOM 0 HD13 LEU A 86 -8.624 -9.470 -6.382 1.00 10.30 H new ATOM 0 HD21 LEU A 86 -10.652 -8.567 -8.512 1.00 11.12 H new ATOM 0 HD22 LEU A 86 -9.490 -9.892 -8.758 1.00 11.12 H new ATOM 0 HD23 LEU A 86 -11.231 -10.180 -8.991 1.00 11.12 H new ATOM 1322 N TRP A 87 -10.155 -12.674 -3.798 1.00 8.98 N ATOM 1323 CA TRP A 87 -9.772 -12.470 -2.409 1.00 8.61 C ATOM 1324 C TRP A 87 -8.918 -11.220 -2.266 1.00 8.55 C ATOM 1325 O TRP A 87 -7.811 -11.134 -2.809 1.00 9.23 O ATOM 1326 CB TRP A 87 -9.029 -13.692 -1.874 1.00 9.13 C ATOM 1327 CG TRP A 87 -9.923 -14.879 -1.689 1.00 9.35 C ATOM 1328 CD1 TRP A 87 -10.130 -15.901 -2.572 1.00 9.76 C ATOM 1329 CD2 TRP A 87 -10.741 -15.160 -0.550 1.00 9.44 C ATOM 1330 NE1 TRP A 87 -11.026 -16.799 -2.048 1.00 10.06 N ATOM 1331 CE2 TRP A 87 -11.416 -16.370 -0.809 1.00 9.89 C ATOM 1332 CE3 TRP A 87 -10.969 -14.507 0.664 1.00 9.42 C ATOM 1333 CZ2 TRP A 87 -12.299 -16.935 0.104 1.00 10.28 C ATOM 1334 CZ3 TRP A 87 -11.845 -15.070 1.568 1.00 9.85 C ATOM 1335 CH2 TRP A 87 -12.501 -16.274 1.283 1.00 10.26 C ATOM 0 H TRP A 87 -9.658 -13.433 -4.264 1.00 8.98 H new ATOM 0 HA TRP A 87 -10.679 -12.333 -1.820 1.00 8.61 H new ATOM 0 HB2 TRP A 87 -8.224 -13.952 -2.562 1.00 9.13 H new ATOM 0 HB3 TRP A 87 -8.564 -13.441 -0.921 1.00 9.13 H new ATOM 0 HD1 TRP A 87 -9.658 -15.989 -3.539 1.00 9.76 H new ATOM 0 HE1 TRP A 87 -11.349 -17.650 -2.509 1.00 10.06 H new ATOM 0 HE3 TRP A 87 -10.468 -13.577 0.890 1.00 9.42 H new ATOM 0 HZ2 TRP A 87 -12.807 -17.863 -0.111 1.00 10.28 H new ATOM 0 HZ3 TRP A 87 -12.028 -14.575 2.510 1.00 9.85 H new ATOM 0 HH2 TRP A 87 -13.182 -16.689 2.011 1.00 10.26 H new ATOM 1346 N MET A 88 -9.442 -10.258 -1.532 1.00 7.94 N ATOM 1347 CA MET A 88 -8.763 -8.999 -1.313 1.00 7.99 C ATOM 1348 C MET A 88 -8.433 -8.812 0.163 1.00 7.92 C ATOM 1349 O MET A 88 -9.280 -9.023 1.029 1.00 7.76 O ATOM 1350 CB MET A 88 -9.642 -7.843 -1.795 1.00 8.19 C ATOM 1351 CG MET A 88 -8.932 -6.500 -1.804 1.00 8.29 C ATOM 1352 SD MET A 88 -7.962 -6.243 -3.302 1.00 8.99 S ATOM 1353 CE MET A 88 -9.259 -5.874 -4.479 1.00 9.32 C ATOM 0 H MET A 88 -10.350 -10.328 -1.072 1.00 7.94 H new ATOM 0 HA MET A 88 -7.831 -9.008 -1.879 1.00 7.99 H new ATOM 0 HB2 MET A 88 -9.997 -8.063 -2.802 1.00 8.19 H new ATOM 0 HB3 MET A 88 -10.521 -7.775 -1.155 1.00 8.19 H new ATOM 0 HG2 MET A 88 -9.669 -5.702 -1.711 1.00 8.29 H new ATOM 0 HG3 MET A 88 -8.278 -6.433 -0.935 1.00 8.29 H new ATOM 0 HE1 MET A 88 -8.947 -6.188 -5.475 1.00 9.32 H new ATOM 0 HE2 MET A 88 -10.167 -6.407 -4.198 1.00 9.32 H new ATOM 0 HE3 MET A 88 -9.454 -4.802 -4.481 1.00 9.32 H new ATOM 1363 N ARG A 89 -7.193 -8.441 0.435 1.00 8.22 N ATOM 1364 CA ARG A 89 -6.740 -8.189 1.793 1.00 8.32 C ATOM 1365 C ARG A 89 -6.722 -6.684 2.020 1.00 8.38 C ATOM 1366 O ARG A 89 -5.659 -6.066 2.103 1.00 8.80 O ATOM 1367 CB ARG A 89 -5.341 -8.773 2.017 1.00 8.70 C ATOM 1368 CG ARG A 89 -4.951 -8.891 3.483 1.00 8.73 C ATOM 1369 CD ARG A 89 -3.462 -8.661 3.692 1.00 9.56 C ATOM 1370 NE ARG A 89 -3.121 -7.242 3.650 1.00 9.63 N ATOM 1371 CZ ARG A 89 -2.086 -6.701 4.298 1.00 10.18 C ATOM 1372 NH1 ARG A 89 -1.263 -7.458 5.016 1.00 10.66 N ATOM 1373 NH2 ARG A 89 -1.872 -5.398 4.217 1.00 10.44 N ATOM 0 H ARG A 89 -6.474 -8.306 -0.276 1.00 8.22 H new ATOM 0 HA ARG A 89 -7.418 -8.669 2.499 1.00 8.32 H new ATOM 0 HB2 ARG A 89 -5.292 -9.760 1.557 1.00 8.70 H new ATOM 0 HB3 ARG A 89 -4.610 -8.147 1.506 1.00 8.70 H new ATOM 0 HG2 ARG A 89 -5.516 -8.166 4.069 1.00 8.73 H new ATOM 0 HG3 ARG A 89 -5.221 -9.880 3.853 1.00 8.73 H new ATOM 0 HD2 ARG A 89 -3.161 -9.079 4.653 1.00 9.56 H new ATOM 0 HD3 ARG A 89 -2.901 -9.193 2.923 1.00 9.56 H new ATOM 0 HE ARG A 89 -3.710 -6.625 3.091 1.00 9.63 H new ATOM 0 HH11 ARG A 89 -1.418 -8.464 5.077 1.00 10.66 H new ATOM 0 HH12 ARG A 89 -0.476 -7.033 5.506 1.00 10.66 H new ATOM 0 HH21 ARG A 89 -2.496 -4.812 3.662 1.00 10.44 H new ATOM 0 HH22 ARG A 89 -1.083 -4.979 4.710 1.00 10.44 H new ATOM 1387 N THR A 90 -7.907 -6.103 2.088 1.00 8.13 N ATOM 1388 CA THR A 90 -8.064 -4.671 2.265 1.00 8.31 C ATOM 1389 C THR A 90 -7.445 -4.178 3.571 1.00 7.80 C ATOM 1390 O THR A 90 -7.961 -4.425 4.663 1.00 7.13 O ATOM 1391 CB THR A 90 -9.551 -4.293 2.210 1.00 8.83 C ATOM 1392 OG1 THR A 90 -10.118 -4.790 0.992 1.00 9.37 O ATOM 1393 CG2 THR A 90 -9.743 -2.787 2.283 1.00 9.12 C ATOM 0 H THR A 90 -8.788 -6.612 2.022 1.00 8.13 H new ATOM 0 HA THR A 90 -7.532 -4.182 1.449 1.00 8.31 H new ATOM 0 HB THR A 90 -10.052 -4.739 3.069 1.00 8.83 H new ATOM 0 HG1 THR A 90 -9.692 -4.348 0.228 1.00 9.37 H new ATOM 0 HG21 THR A 90 -10.807 -2.553 2.242 1.00 9.12 H new ATOM 0 HG22 THR A 90 -9.325 -2.412 3.217 1.00 9.12 H new ATOM 0 HG23 THR A 90 -9.235 -2.314 1.443 1.00 9.12 H new ATOM 1401 N SER A 91 -6.326 -3.489 3.436 1.00 8.27 N ATOM 1402 CA SER A 91 -5.611 -2.935 4.569 1.00 8.04 C ATOM 1403 C SER A 91 -6.176 -1.561 4.912 1.00 8.00 C ATOM 1404 O SER A 91 -5.717 -0.543 4.392 1.00 8.20 O ATOM 1405 CB SER A 91 -4.124 -2.834 4.233 1.00 7.83 C ATOM 1406 OG SER A 91 -3.756 -3.811 3.269 1.00 8.08 O ATOM 0 H SER A 91 -5.888 -3.298 2.535 1.00 8.27 H new ATOM 0 HA SER A 91 -5.733 -3.587 5.434 1.00 8.04 H new ATOM 0 HB2 SER A 91 -3.900 -1.838 3.851 1.00 7.83 H new ATOM 0 HB3 SER A 91 -3.532 -2.969 5.138 1.00 7.83 H new ATOM 0 HG SER A 91 -4.142 -3.574 2.400 1.00 8.08 H new ATOM 1412 N SER A 92 -7.186 -1.543 5.765 1.00 7.99 N ATOM 1413 CA SER A 92 -7.833 -0.304 6.163 1.00 8.16 C ATOM 1414 C SER A 92 -7.002 0.450 7.195 1.00 8.34 C ATOM 1415 O SER A 92 -6.613 -0.107 8.221 1.00 8.27 O ATOM 1416 CB SER A 92 -9.223 -0.603 6.719 1.00 8.49 C ATOM 1417 OG SER A 92 -9.975 -1.377 5.797 1.00 8.65 O ATOM 0 H SER A 92 -7.578 -2.379 6.198 1.00 7.99 H new ATOM 0 HA SER A 92 -7.925 0.332 5.282 1.00 8.16 H new ATOM 0 HB2 SER A 92 -9.135 -1.138 7.664 1.00 8.49 H new ATOM 0 HB3 SER A 92 -9.745 0.331 6.929 1.00 8.49 H new ATOM 0 HG SER A 92 -10.166 -0.841 4.999 1.00 8.65 H new ATOM 1423 N PHE A 93 -6.722 1.709 6.902 1.00 8.79 N ATOM 1424 CA PHE A 93 -5.946 2.562 7.786 1.00 9.24 C ATOM 1425 C PHE A 93 -6.663 3.898 7.981 1.00 9.05 C ATOM 1426 O PHE A 93 -6.880 4.645 7.023 1.00 8.84 O ATOM 1427 CB PHE A 93 -4.543 2.774 7.199 1.00 9.87 C ATOM 1428 CG PHE A 93 -3.752 3.881 7.842 1.00 10.37 C ATOM 1429 CD1 PHE A 93 -3.449 3.845 9.194 1.00 10.90 C ATOM 1430 CD2 PHE A 93 -3.306 4.956 7.087 1.00 10.50 C ATOM 1431 CE1 PHE A 93 -2.717 4.860 9.781 1.00 11.50 C ATOM 1432 CE2 PHE A 93 -2.574 5.973 7.670 1.00 11.09 C ATOM 1433 CZ PHE A 93 -2.279 5.924 9.019 1.00 11.56 C ATOM 0 H PHE A 93 -7.027 2.169 6.044 1.00 8.79 H new ATOM 0 HA PHE A 93 -5.845 2.083 8.760 1.00 9.24 H new ATOM 0 HB2 PHE A 93 -3.982 1.844 7.291 1.00 9.87 H new ATOM 0 HB3 PHE A 93 -4.638 2.985 6.134 1.00 9.87 H new ATOM 0 HD1 PHE A 93 -3.789 3.015 9.795 1.00 10.90 H new ATOM 0 HD2 PHE A 93 -3.533 4.999 6.032 1.00 10.50 H new ATOM 0 HE1 PHE A 93 -2.488 4.820 10.836 1.00 11.50 H new ATOM 0 HE2 PHE A 93 -2.233 6.805 7.072 1.00 11.09 H new ATOM 0 HZ PHE A 93 -1.706 6.717 9.476 1.00 11.56 H new ATOM 1443 N THR A 94 -7.050 4.181 9.214 1.00 9.35 N ATOM 1444 CA THR A 94 -7.738 5.420 9.537 1.00 9.46 C ATOM 1445 C THR A 94 -6.772 6.602 9.493 1.00 9.94 C ATOM 1446 O THR A 94 -5.797 6.645 10.245 1.00 10.16 O ATOM 1447 CB THR A 94 -8.378 5.333 10.933 1.00 9.25 C ATOM 1448 OG1 THR A 94 -7.908 4.153 11.609 1.00 9.37 O ATOM 1449 CG2 THR A 94 -9.896 5.293 10.831 1.00 9.37 C ATOM 0 H THR A 94 -6.898 3.565 10.012 1.00 9.35 H new ATOM 0 HA THR A 94 -8.520 5.573 8.793 1.00 9.46 H new ATOM 0 HB THR A 94 -8.092 6.219 11.499 1.00 9.25 H new ATOM 0 HG1 THR A 94 -8.666 3.688 12.021 1.00 9.37 H new ATOM 0 HG21 THR A 94 -10.326 5.232 11.831 1.00 9.37 H new ATOM 0 HG22 THR A 94 -10.251 6.198 10.338 1.00 9.37 H new ATOM 0 HG23 THR A 94 -10.199 4.421 10.251 1.00 9.37 H new ATOM 1457 N PHE A 95 -7.040 7.556 8.610 1.00 10.31 N ATOM 1458 CA PHE A 95 -6.181 8.720 8.478 1.00 10.96 C ATOM 1459 C PHE A 95 -6.670 9.852 9.373 1.00 11.35 C ATOM 1460 O PHE A 95 -7.801 10.327 9.237 1.00 11.51 O ATOM 1461 CB PHE A 95 -6.120 9.190 7.026 1.00 11.11 C ATOM 1462 CG PHE A 95 -4.856 9.932 6.698 1.00 11.84 C ATOM 1463 CD1 PHE A 95 -3.712 9.243 6.332 1.00 12.08 C ATOM 1464 CD2 PHE A 95 -4.809 11.313 6.763 1.00 11.76 C ATOM 1465 CE1 PHE A 95 -2.544 9.920 6.039 1.00 12.25 C ATOM 1466 CE2 PHE A 95 -3.645 11.996 6.472 1.00 11.93 C ATOM 1467 CZ PHE A 95 -2.510 11.299 6.108 1.00 12.11 C ATOM 0 H PHE A 95 -7.841 7.545 7.979 1.00 10.31 H new ATOM 0 HA PHE A 95 -5.177 8.433 8.791 1.00 10.96 H new ATOM 0 HB2 PHE A 95 -6.208 8.326 6.367 1.00 11.11 H new ATOM 0 HB3 PHE A 95 -6.975 9.834 6.823 1.00 11.11 H new ATOM 0 HD1 PHE A 95 -3.733 8.165 6.275 1.00 12.08 H new ATOM 0 HD2 PHE A 95 -5.694 11.864 7.045 1.00 11.76 H new ATOM 0 HE1 PHE A 95 -1.658 9.371 5.756 1.00 12.25 H new ATOM 0 HE2 PHE A 95 -3.622 13.074 6.529 1.00 11.93 H new ATOM 0 HZ PHE A 95 -1.598 11.831 5.878 1.00 12.11 H new ATOM 1477 N GLN A 96 -5.814 10.269 10.292 1.00 11.67 N ATOM 1478 CA GLN A 96 -6.139 11.341 11.218 1.00 12.26 C ATOM 1479 C GLN A 96 -5.096 12.445 11.123 1.00 12.40 C ATOM 1480 O GLN A 96 -4.036 12.260 10.522 1.00 12.58 O ATOM 1481 CB GLN A 96 -6.190 10.815 12.653 1.00 12.87 C ATOM 1482 CG GLN A 96 -7.246 9.749 12.886 1.00 13.00 C ATOM 1483 CD GLN A 96 -7.557 9.563 14.357 1.00 13.42 C ATOM 1484 OE1 GLN A 96 -6.949 8.734 15.032 1.00 13.10 O ATOM 1485 NE2 GLN A 96 -8.493 10.345 14.865 1.00 14.24 N ATOM 0 H GLN A 96 -4.881 9.877 10.417 1.00 11.67 H new ATOM 0 HA GLN A 96 -7.118 11.739 10.951 1.00 12.26 H new ATOM 0 HB2 GLN A 96 -5.214 10.407 12.914 1.00 12.87 H new ATOM 0 HB3 GLN A 96 -6.377 11.650 13.328 1.00 12.87 H new ATOM 0 HG2 GLN A 96 -8.158 10.022 12.355 1.00 13.00 H new ATOM 0 HG3 GLN A 96 -6.904 8.803 12.466 1.00 13.00 H new ATOM 0 HE21 GLN A 96 -8.973 11.019 14.269 1.00 14.24 H new ATOM 0 HE22 GLN A 96 -8.736 10.274 15.853 1.00 14.24 H new ATOM 1494 N ASN A 97 -5.401 13.588 11.717 1.00 12.50 N ATOM 1495 CA ASN A 97 -4.492 14.723 11.715 1.00 12.84 C ATOM 1496 C ASN A 97 -4.055 15.024 13.145 1.00 13.26 C ATOM 1497 O ASN A 97 -4.567 14.413 14.084 1.00 13.46 O ATOM 1498 CB ASN A 97 -5.181 15.947 11.099 1.00 12.77 C ATOM 1499 CG ASN A 97 -5.544 15.746 9.646 1.00 13.20 C ATOM 1500 OD1 ASN A 97 -4.701 15.881 8.760 1.00 13.83 O ATOM 1501 ND2 ASN A 97 -6.803 15.435 9.389 1.00 13.02 N ATOM 0 H ASN A 97 -6.278 13.754 12.210 1.00 12.50 H new ATOM 0 HA ASN A 97 -3.613 14.483 11.116 1.00 12.84 H new ATOM 0 HB2 ASN A 97 -6.084 16.174 11.666 1.00 12.77 H new ATOM 0 HB3 ASN A 97 -4.523 16.812 11.188 1.00 12.77 H new ATOM 0 HD21 ASN A 97 -7.108 15.297 8.425 1.00 13.02 H new ATOM 0 HD22 ASN A 97 -7.469 15.333 10.154 1.00 13.02 H new ATOM 1508 N PRO A 98 -3.099 15.947 13.352 1.00 13.57 N ATOM 1509 CA PRO A 98 -2.635 16.315 14.695 1.00 14.16 C ATOM 1510 C PRO A 98 -3.635 17.211 15.430 1.00 14.64 C ATOM 1511 O PRO A 98 -3.258 18.015 16.284 1.00 15.34 O ATOM 1512 CB PRO A 98 -1.324 17.078 14.440 1.00 14.43 C ATOM 1513 CG PRO A 98 -1.033 16.916 12.982 1.00 14.13 C ATOM 1514 CD PRO A 98 -2.353 16.673 12.316 1.00 13.56 C ATOM 0 HA PRO A 98 -2.511 15.437 15.330 1.00 14.16 H new ATOM 0 HB2 PRO A 98 -1.427 18.131 14.703 1.00 14.43 H new ATOM 0 HB3 PRO A 98 -0.513 16.676 15.047 1.00 14.43 H new ATOM 0 HG2 PRO A 98 -0.552 17.808 12.580 1.00 14.13 H new ATOM 0 HG3 PRO A 98 -0.352 16.082 12.811 1.00 14.13 H new ATOM 0 HD2 PRO A 98 -2.846 17.605 12.038 1.00 13.56 H new ATOM 0 HD3 PRO A 98 -2.246 16.085 11.405 1.00 13.56 H new ATOM 1522 N TYR A 99 -4.913 17.058 15.104 1.00 14.40 N ATOM 1523 CA TYR A 99 -5.964 17.849 15.721 1.00 14.96 C ATOM 1524 C TYR A 99 -6.548 17.125 16.933 1.00 14.99 C ATOM 1525 O TYR A 99 -5.932 16.208 17.479 1.00 15.65 O ATOM 1526 CB TYR A 99 -7.062 18.163 14.704 1.00 15.01 C ATOM 1527 CG TYR A 99 -6.670 19.211 13.688 1.00 14.39 C ATOM 1528 CD1 TYR A 99 -6.670 20.561 14.019 1.00 14.52 C ATOM 1529 CD2 TYR A 99 -6.301 18.853 12.399 1.00 14.95 C ATOM 1530 CE1 TYR A 99 -6.313 21.521 13.094 1.00 15.18 C ATOM 1531 CE2 TYR A 99 -5.940 19.806 11.468 1.00 15.60 C ATOM 1532 CZ TYR A 99 -5.949 21.138 11.821 1.00 16.89 C ATOM 1533 OH TYR A 99 -5.587 22.093 10.899 1.00 16.50 O ATOM 0 H TYR A 99 -5.245 16.388 14.411 1.00 14.40 H new ATOM 0 HA TYR A 99 -5.529 18.788 16.063 1.00 14.96 H new ATOM 0 HB2 TYR A 99 -7.333 17.246 14.181 1.00 15.01 H new ATOM 0 HB3 TYR A 99 -7.951 18.501 15.236 1.00 15.01 H new ATOM 0 HD1 TYR A 99 -6.954 20.864 15.016 1.00 14.52 H new ATOM 0 HD2 TYR A 99 -6.296 17.810 12.119 1.00 14.95 H new ATOM 0 HE1 TYR A 99 -6.319 22.566 13.366 1.00 15.18 H new ATOM 0 HE2 TYR A 99 -5.653 19.510 10.470 1.00 15.60 H new ATOM 0 HH TYR A 99 -5.358 21.659 10.051 1.00 16.50 H new ATOM 1543 N SER A 100 -7.743 17.530 17.334 1.00 14.39 N ATOM 1544 CA SER A 100 -8.405 16.952 18.495 1.00 14.53 C ATOM 1545 C SER A 100 -9.147 15.652 18.164 1.00 14.18 C ATOM 1546 O SER A 100 -10.376 15.589 18.252 1.00 14.16 O ATOM 1547 CB SER A 100 -9.368 17.979 19.077 1.00 14.72 C ATOM 1548 OG SER A 100 -8.835 19.290 18.958 1.00 14.89 O ATOM 0 H SER A 100 -8.279 18.263 16.869 1.00 14.39 H new ATOM 0 HA SER A 100 -7.639 16.694 19.226 1.00 14.53 H new ATOM 0 HB2 SER A 100 -10.325 17.922 18.559 1.00 14.72 H new ATOM 0 HB3 SER A 100 -9.559 17.752 20.126 1.00 14.72 H new ATOM 0 HG SER A 100 -9.468 19.936 19.335 1.00 14.89 H new ATOM 1554 N ASP A 101 -8.379 14.629 17.787 1.00 14.07 N ATOM 1555 CA ASP A 101 -8.908 13.299 17.458 1.00 13.92 C ATOM 1556 C ASP A 101 -10.055 13.360 16.446 1.00 13.12 C ATOM 1557 O ASP A 101 -11.229 13.216 16.797 1.00 13.21 O ATOM 1558 CB ASP A 101 -9.359 12.579 18.732 1.00 14.53 C ATOM 1559 CG ASP A 101 -9.585 11.092 18.526 1.00 14.57 C ATOM 1560 OD1 ASP A 101 -9.073 10.526 17.539 1.00 14.75 O ATOM 1561 OD2 ASP A 101 -10.277 10.473 19.362 1.00 14.77 O ATOM 0 H ASP A 101 -7.365 14.698 17.700 1.00 14.07 H new ATOM 0 HA ASP A 101 -8.099 12.737 16.991 1.00 13.92 H new ATOM 0 HB2 ASP A 101 -8.608 12.722 19.509 1.00 14.53 H new ATOM 0 HB3 ASP A 101 -10.281 13.034 19.093 1.00 14.53 H new ATOM 1566 N GLU A 102 -9.705 13.578 15.192 1.00 12.49 N ATOM 1567 CA GLU A 102 -10.682 13.644 14.113 1.00 11.85 C ATOM 1568 C GLU A 102 -10.270 12.707 12.982 1.00 11.00 C ATOM 1569 O GLU A 102 -9.137 12.236 12.954 1.00 10.88 O ATOM 1570 CB GLU A 102 -10.825 15.082 13.596 1.00 11.92 C ATOM 1571 CG GLU A 102 -9.529 15.886 13.609 1.00 12.55 C ATOM 1572 CD GLU A 102 -8.513 15.392 12.598 1.00 12.62 C ATOM 1573 OE1 GLU A 102 -8.652 15.719 11.400 1.00 12.95 O ATOM 1574 OE2 GLU A 102 -7.568 14.682 13.000 1.00 12.82 O ATOM 0 H GLU A 102 -8.740 13.714 14.890 1.00 12.49 H new ATOM 0 HA GLU A 102 -11.651 13.327 14.499 1.00 11.85 H new ATOM 0 HB2 GLU A 102 -11.210 15.052 12.577 1.00 11.92 H new ATOM 0 HB3 GLU A 102 -11.567 15.601 14.202 1.00 11.92 H new ATOM 0 HG2 GLU A 102 -9.756 16.933 13.406 1.00 12.55 H new ATOM 0 HG3 GLU A 102 -9.091 15.842 14.606 1.00 12.55 H new ATOM 1581 N ILE A 103 -11.183 12.426 12.066 1.00 10.60 N ATOM 1582 CA ILE A 103 -10.892 11.540 10.944 1.00 9.97 C ATOM 1583 C ILE A 103 -11.464 12.116 9.657 1.00 9.53 C ATOM 1584 O ILE A 103 -12.670 12.340 9.560 1.00 9.56 O ATOM 1585 CB ILE A 103 -11.482 10.124 11.163 1.00 10.32 C ATOM 1586 CG1 ILE A 103 -10.935 9.497 12.449 1.00 10.72 C ATOM 1587 CG2 ILE A 103 -11.182 9.228 9.967 1.00 10.45 C ATOM 1588 CD1 ILE A 103 -11.606 8.192 12.823 1.00 11.11 C ATOM 0 H ILE A 103 -12.133 12.797 12.075 1.00 10.60 H new ATOM 0 HA ILE A 103 -9.808 11.458 10.871 1.00 9.97 H new ATOM 0 HB ILE A 103 -12.563 10.220 11.263 1.00 10.32 H new ATOM 0 HG12 ILE A 103 -9.865 9.325 12.332 1.00 10.72 H new ATOM 0 HG13 ILE A 103 -11.056 10.206 13.268 1.00 10.72 H new ATOM 0 HG21 ILE A 103 -11.604 8.238 10.139 1.00 10.45 H new ATOM 0 HG22 ILE A 103 -11.624 9.660 9.069 1.00 10.45 H new ATOM 0 HG23 ILE A 103 -10.103 9.145 9.836 1.00 10.45 H new ATOM 0 HD11 ILE A 103 -11.167 7.808 13.744 1.00 11.11 H new ATOM 0 HD12 ILE A 103 -12.672 8.361 12.973 1.00 11.11 H new ATOM 0 HD13 ILE A 103 -11.463 7.467 12.022 1.00 11.11 H new ATOM 1600 N GLU A 104 -10.610 12.364 8.672 1.00 9.35 N ATOM 1601 CA GLU A 104 -11.078 12.906 7.403 1.00 9.23 C ATOM 1602 C GLU A 104 -11.641 11.795 6.524 1.00 8.49 C ATOM 1603 O GLU A 104 -12.712 11.943 5.937 1.00 7.95 O ATOM 1604 CB GLU A 104 -9.965 13.673 6.672 1.00 9.71 C ATOM 1605 CG GLU A 104 -8.595 13.013 6.715 1.00 10.37 C ATOM 1606 CD GLU A 104 -7.496 13.946 6.236 1.00 11.10 C ATOM 1607 OE1 GLU A 104 -7.366 15.047 6.804 1.00 11.65 O ATOM 1608 OE2 GLU A 104 -6.764 13.592 5.285 1.00 11.22 O ATOM 0 H GLU A 104 -9.604 12.201 8.725 1.00 9.35 H new ATOM 0 HA GLU A 104 -11.876 13.616 7.617 1.00 9.23 H new ATOM 0 HB2 GLU A 104 -10.257 13.802 5.630 1.00 9.71 H new ATOM 0 HB3 GLU A 104 -9.885 14.670 7.106 1.00 9.71 H new ATOM 0 HG2 GLU A 104 -8.379 12.693 7.734 1.00 10.37 H new ATOM 0 HG3 GLU A 104 -8.605 12.117 6.095 1.00 10.37 H new ATOM 1615 N TYR A 105 -10.930 10.675 6.457 1.00 8.69 N ATOM 1616 CA TYR A 105 -11.359 9.536 5.655 1.00 8.30 C ATOM 1617 C TYR A 105 -10.569 8.286 6.035 1.00 8.30 C ATOM 1618 O TYR A 105 -9.680 8.337 6.890 1.00 8.50 O ATOM 1619 CB TYR A 105 -11.203 9.824 4.152 1.00 8.40 C ATOM 1620 CG TYR A 105 -9.850 10.383 3.756 1.00 8.90 C ATOM 1621 CD1 TYR A 105 -8.706 9.593 3.791 1.00 9.14 C ATOM 1622 CD2 TYR A 105 -9.720 11.703 3.347 1.00 9.14 C ATOM 1623 CE1 TYR A 105 -7.475 10.105 3.431 1.00 9.56 C ATOM 1624 CE2 TYR A 105 -8.492 12.221 2.985 1.00 9.54 C ATOM 1625 CZ TYR A 105 -7.373 11.417 3.031 1.00 9.84 C ATOM 1626 OH TYR A 105 -6.146 11.931 2.678 1.00 10.30 O ATOM 0 H TYR A 105 -10.049 10.532 6.951 1.00 8.69 H new ATOM 0 HA TYR A 105 -12.415 9.363 5.861 1.00 8.30 H new ATOM 0 HB2 TYR A 105 -11.377 8.901 3.598 1.00 8.40 H new ATOM 0 HB3 TYR A 105 -11.977 10.529 3.848 1.00 8.40 H new ATOM 0 HD1 TYR A 105 -8.782 8.562 4.105 1.00 9.14 H new ATOM 0 HD2 TYR A 105 -10.594 12.336 3.311 1.00 9.14 H new ATOM 0 HE1 TYR A 105 -6.596 9.478 3.463 1.00 9.56 H new ATOM 0 HE2 TYR A 105 -8.409 13.250 2.668 1.00 9.54 H new ATOM 0 HH TYR A 105 -5.872 12.605 3.335 1.00 10.30 H new ATOM 1636 N ILE A 106 -10.898 7.172 5.396 1.00 8.31 N ATOM 1637 CA ILE A 106 -10.233 5.909 5.656 1.00 8.58 C ATOM 1638 C ILE A 106 -9.480 5.443 4.412 1.00 7.97 C ATOM 1639 O ILE A 106 -10.066 5.293 3.337 1.00 7.37 O ATOM 1640 CB ILE A 106 -11.239 4.813 6.082 1.00 9.05 C ATOM 1641 CG1 ILE A 106 -12.146 5.319 7.211 1.00 9.92 C ATOM 1642 CG2 ILE A 106 -10.499 3.555 6.518 1.00 9.27 C ATOM 1643 CD1 ILE A 106 -13.268 4.364 7.565 1.00 10.29 C ATOM 0 H ILE A 106 -11.630 7.121 4.687 1.00 8.31 H new ATOM 0 HA ILE A 106 -9.532 6.072 6.475 1.00 8.58 H new ATOM 0 HB ILE A 106 -11.865 4.569 5.224 1.00 9.05 H new ATOM 0 HG12 ILE A 106 -11.540 5.499 8.099 1.00 9.92 H new ATOM 0 HG13 ILE A 106 -12.575 6.277 6.919 1.00 9.92 H new ATOM 0 HG21 ILE A 106 -11.220 2.793 6.815 1.00 9.27 H new ATOM 0 HG22 ILE A 106 -9.897 3.182 5.690 1.00 9.27 H new ATOM 0 HG23 ILE A 106 -9.850 3.789 7.362 1.00 9.27 H new ATOM 0 HD11 ILE A 106 -13.867 4.789 8.370 1.00 10.29 H new ATOM 0 HD12 ILE A 106 -13.898 4.203 6.690 1.00 10.29 H new ATOM 0 HD13 ILE A 106 -12.847 3.412 7.889 1.00 10.29 H new ATOM 1655 N ILE A 107 -8.183 5.229 4.562 1.00 8.33 N ATOM 1656 CA ILE A 107 -7.350 4.775 3.462 1.00 8.06 C ATOM 1657 C ILE A 107 -7.255 3.257 3.478 1.00 8.29 C ATOM 1658 O ILE A 107 -6.718 2.671 4.413 1.00 8.62 O ATOM 1659 CB ILE A 107 -5.929 5.379 3.537 1.00 8.25 C ATOM 1660 CG1 ILE A 107 -5.980 6.886 3.277 1.00 8.19 C ATOM 1661 CG2 ILE A 107 -4.999 4.696 2.540 1.00 8.99 C ATOM 1662 CD1 ILE A 107 -4.628 7.565 3.349 1.00 8.61 C ATOM 0 H ILE A 107 -7.683 5.364 5.441 1.00 8.33 H new ATOM 0 HA ILE A 107 -7.814 5.110 2.534 1.00 8.06 H new ATOM 0 HB ILE A 107 -5.535 5.211 4.539 1.00 8.25 H new ATOM 0 HG12 ILE A 107 -6.412 7.061 2.292 1.00 8.19 H new ATOM 0 HG13 ILE A 107 -6.648 7.348 4.004 1.00 8.19 H new ATOM 0 HG21 ILE A 107 -4.004 5.136 2.610 1.00 8.99 H new ATOM 0 HG22 ILE A 107 -4.941 3.631 2.767 1.00 8.99 H new ATOM 0 HG23 ILE A 107 -5.386 4.831 1.530 1.00 8.99 H new ATOM 0 HD11 ILE A 107 -4.745 8.631 3.154 1.00 8.61 H new ATOM 0 HD12 ILE A 107 -4.202 7.423 4.342 1.00 8.61 H new ATOM 0 HD13 ILE A 107 -3.963 7.131 2.603 1.00 8.61 H new ATOM 1674 N CYS A 108 -7.790 2.622 2.456 1.00 8.31 N ATOM 1675 CA CYS A 108 -7.755 1.175 2.377 1.00 8.72 C ATOM 1676 C CYS A 108 -6.793 0.700 1.296 1.00 8.90 C ATOM 1677 O CYS A 108 -6.938 1.039 0.122 1.00 8.95 O ATOM 1678 CB CYS A 108 -9.156 0.623 2.120 1.00 8.88 C ATOM 1679 SG CYS A 108 -10.270 0.772 3.536 1.00 9.83 S ATOM 0 H CYS A 108 -8.252 3.082 1.672 1.00 8.31 H new ATOM 0 HA CYS A 108 -7.395 0.797 3.334 1.00 8.72 H new ATOM 0 HB2 CYS A 108 -9.592 1.147 1.270 1.00 8.88 H new ATOM 0 HB3 CYS A 108 -9.077 -0.428 1.841 1.00 8.88 H new ATOM 0 HG CYS A 108 -11.214 1.621 3.258 1.00 9.83 H new ATOM 1685 N THR A 109 -5.791 -0.054 1.710 1.00 9.18 N ATOM 1686 CA THR A 109 -4.816 -0.609 0.792 1.00 9.57 C ATOM 1687 C THR A 109 -5.330 -1.952 0.289 1.00 9.52 C ATOM 1688 O THR A 109 -5.266 -2.957 0.999 1.00 9.93 O ATOM 1689 CB THR A 109 -3.449 -0.791 1.479 1.00 10.24 C ATOM 1690 OG1 THR A 109 -3.194 0.324 2.353 1.00 10.47 O ATOM 1691 CG2 THR A 109 -2.334 -0.903 0.450 1.00 10.84 C ATOM 0 H THR A 109 -5.631 -0.297 2.688 1.00 9.18 H new ATOM 0 HA THR A 109 -4.679 0.078 -0.043 1.00 9.57 H new ATOM 0 HB THR A 109 -3.475 -1.713 2.059 1.00 10.24 H new ATOM 0 HG1 THR A 109 -2.325 0.205 2.790 1.00 10.47 H new ATOM 0 HG21 THR A 109 -1.379 -1.031 0.960 1.00 10.84 H new ATOM 0 HG22 THR A 109 -2.519 -1.762 -0.195 1.00 10.84 H new ATOM 0 HG23 THR A 109 -2.304 0.004 -0.154 1.00 10.84 H new ATOM 1699 N ASN A 110 -5.871 -1.956 -0.917 1.00 9.26 N ATOM 1700 CA ASN A 110 -6.431 -3.166 -1.499 1.00 9.45 C ATOM 1701 C ASN A 110 -5.345 -4.071 -2.058 1.00 9.54 C ATOM 1702 O ASN A 110 -4.778 -3.797 -3.115 1.00 9.73 O ATOM 1703 CB ASN A 110 -7.445 -2.814 -2.588 1.00 10.33 C ATOM 1704 CG ASN A 110 -8.836 -2.596 -2.028 1.00 10.50 C ATOM 1705 OD1 ASN A 110 -9.237 -3.239 -1.060 1.00 10.11 O ATOM 1706 ND2 ASN A 110 -9.581 -1.681 -2.626 1.00 11.26 N ATOM 0 H ASN A 110 -5.935 -1.132 -1.515 1.00 9.26 H new ATOM 0 HA ASN A 110 -6.941 -3.711 -0.705 1.00 9.45 H new ATOM 0 HB2 ASN A 110 -7.119 -1.913 -3.107 1.00 10.33 H new ATOM 0 HB3 ASN A 110 -7.474 -3.615 -3.327 1.00 10.33 H new ATOM 0 HD21 ASN A 110 -10.523 -1.489 -2.286 1.00 11.26 H new ATOM 0 HD22 ASN A 110 -9.213 -1.168 -3.427 1.00 11.26 H new ATOM 1713 N THR A 111 -5.057 -5.139 -1.328 1.00 9.61 N ATOM 1714 CA THR A 111 -4.051 -6.109 -1.726 1.00 9.91 C ATOM 1715 C THR A 111 -4.713 -7.378 -2.262 1.00 10.65 C ATOM 1716 O THR A 111 -5.459 -8.041 -1.544 1.00 11.22 O ATOM 1717 CB THR A 111 -3.167 -6.486 -0.523 1.00 9.68 C ATOM 1718 OG1 THR A 111 -2.813 -5.307 0.216 1.00 9.38 O ATOM 1719 CG2 THR A 111 -1.911 -7.210 -0.976 1.00 9.85 C ATOM 0 H THR A 111 -5.515 -5.356 -0.443 1.00 9.61 H new ATOM 0 HA THR A 111 -3.440 -5.657 -2.507 1.00 9.91 H new ATOM 0 HB THR A 111 -3.736 -7.157 0.120 1.00 9.68 H new ATOM 0 HG1 THR A 111 -1.849 -5.148 0.136 1.00 9.38 H new ATOM 0 HG21 THR A 111 -1.304 -7.465 -0.107 1.00 9.85 H new ATOM 0 HG22 THR A 111 -2.188 -8.122 -1.505 1.00 9.85 H new ATOM 0 HG23 THR A 111 -1.338 -6.564 -1.641 1.00 9.85 H new ATOM 1727 N ASN A 112 -4.458 -7.714 -3.518 1.00 10.79 N ATOM 1728 CA ASN A 112 -5.039 -8.917 -4.106 1.00 11.60 C ATOM 1729 C ASN A 112 -4.238 -10.146 -3.695 1.00 12.13 C ATOM 1730 O ASN A 112 -3.050 -10.260 -3.999 1.00 12.20 O ATOM 1731 CB ASN A 112 -5.098 -8.814 -5.635 1.00 11.56 C ATOM 1732 CG ASN A 112 -5.590 -10.095 -6.300 1.00 12.27 C ATOM 1733 OD1 ASN A 112 -5.120 -10.466 -7.377 1.00 12.78 O ATOM 1734 ND2 ASN A 112 -6.552 -10.768 -5.682 1.00 12.44 N ATOM 0 H ASN A 112 -3.859 -7.178 -4.146 1.00 10.79 H new ATOM 0 HA ASN A 112 -6.058 -9.014 -3.733 1.00 11.60 H new ATOM 0 HB2 ASN A 112 -5.756 -7.991 -5.913 1.00 11.56 H new ATOM 0 HB3 ASN A 112 -4.106 -8.571 -6.016 1.00 11.56 H new ATOM 0 HD21 ASN A 112 -6.925 -11.621 -6.098 1.00 12.44 H new ATOM 0 HD22 ASN A 112 -6.918 -10.432 -4.791 1.00 12.44 H new ATOM 1741 N VAL A 113 -4.894 -11.053 -2.987 1.00 12.66 N ATOM 1742 CA VAL A 113 -4.256 -12.278 -2.536 1.00 13.37 C ATOM 1743 C VAL A 113 -4.592 -13.414 -3.489 1.00 13.66 C ATOM 1744 O VAL A 113 -3.707 -14.078 -4.032 1.00 13.93 O ATOM 1745 CB VAL A 113 -4.709 -12.660 -1.111 1.00 14.08 C ATOM 1746 CG1 VAL A 113 -3.872 -13.810 -0.565 1.00 14.64 C ATOM 1747 CG2 VAL A 113 -4.635 -11.455 -0.189 1.00 14.08 C ATOM 0 H VAL A 113 -5.872 -10.962 -2.712 1.00 12.66 H new ATOM 0 HA VAL A 113 -3.180 -12.107 -2.520 1.00 13.37 H new ATOM 0 HB VAL A 113 -5.746 -12.993 -1.160 1.00 14.08 H new ATOM 0 HG11 VAL A 113 -4.210 -14.061 0.440 1.00 14.64 H new ATOM 0 HG12 VAL A 113 -3.982 -14.680 -1.213 1.00 14.64 H new ATOM 0 HG13 VAL A 113 -2.824 -13.513 -0.532 1.00 14.64 H new ATOM 0 HG21 VAL A 113 -4.958 -11.742 0.812 1.00 14.08 H new ATOM 0 HG22 VAL A 113 -3.609 -11.090 -0.148 1.00 14.08 H new ATOM 0 HG23 VAL A 113 -5.285 -10.667 -0.568 1.00 14.08 H new ATOM 1757 N LYS A 114 -5.883 -13.620 -3.698 1.00 13.72 N ATOM 1758 CA LYS A 114 -6.362 -14.664 -4.582 1.00 14.09 C ATOM 1759 C LYS A 114 -7.496 -14.122 -5.442 1.00 14.38 C ATOM 1760 O LYS A 114 -7.208 -13.359 -6.385 1.00 14.73 O ATOM 1761 CB LYS A 114 -6.833 -15.882 -3.776 1.00 14.21 C ATOM 1762 CG LYS A 114 -5.709 -16.616 -3.055 1.00 14.60 C ATOM 1763 CD LYS A 114 -6.218 -17.389 -1.847 1.00 14.94 C ATOM 1764 CE LYS A 114 -7.141 -18.528 -2.247 1.00 15.49 C ATOM 1765 NZ LYS A 114 -7.694 -19.229 -1.059 1.00 16.02 N ATOM 0 H LYS A 114 -6.622 -13.070 -3.261 1.00 13.72 H new ATOM 0 HA LYS A 114 -5.545 -14.984 -5.228 1.00 14.09 H new ATOM 0 HB2 LYS A 114 -7.571 -15.557 -3.043 1.00 14.21 H new ATOM 0 HB3 LYS A 114 -7.336 -16.578 -4.448 1.00 14.21 H new ATOM 0 HG2 LYS A 114 -5.222 -17.303 -3.747 1.00 14.60 H new ATOM 0 HG3 LYS A 114 -4.954 -15.898 -2.735 1.00 14.60 H new ATOM 0 HD2 LYS A 114 -5.371 -17.788 -1.289 1.00 14.94 H new ATOM 0 HD3 LYS A 114 -6.748 -16.710 -1.179 1.00 14.94 H new ATOM 0 HE2 LYS A 114 -7.959 -18.138 -2.853 1.00 15.49 H new ATOM 0 HE3 LYS A 114 -6.595 -19.238 -2.868 1.00 15.49 H new ATOM 0 HZ1 LYS A 114 -8.319 -20.000 -1.370 1.00 16.02 H new ATOM 0 HZ2 LYS A 114 -6.914 -19.622 -0.494 1.00 16.02 H new ATOM 0 HZ3 LYS A 114 -8.236 -18.556 -0.480 1.00 16.02 H new ATOM 1780 N CYS B 7 -1.127 -15.935 7.905 1.00 7.31 N ATOM 1781 CA CYS B 7 0.246 -15.420 7.728 1.00 7.09 C ATOM 1782 C CYS B 7 0.289 -14.433 6.573 1.00 6.74 C ATOM 1783 O CYS B 7 -0.675 -14.312 5.819 1.00 6.90 O ATOM 1784 CB CYS B 7 1.221 -16.571 7.474 1.00 7.27 C ATOM 1785 SG CYS B 7 1.344 -17.750 8.839 1.00 7.49 S ATOM 0 HA CYS B 7 0.545 -14.908 8.642 1.00 7.09 H new ATOM 0 HB2 CYS B 7 0.911 -17.104 6.575 1.00 7.27 H new ATOM 0 HB3 CYS B 7 2.210 -16.158 7.275 1.00 7.27 H new ATOM 0 HG CYS B 7 2.190 -18.687 8.528 1.00 7.49 H new ATOM 1791 N GLN B 8 1.396 -13.720 6.446 1.00 6.40 N ATOM 1792 CA GLN B 8 1.556 -12.744 5.385 1.00 6.15 C ATOM 1793 C GLN B 8 2.634 -13.188 4.396 1.00 5.98 C ATOM 1794 O GLN B 8 3.572 -13.897 4.768 1.00 5.98 O ATOM 1795 CB GLN B 8 1.907 -11.385 5.992 1.00 6.04 C ATOM 1796 CG GLN B 8 0.811 -10.828 6.887 1.00 6.41 C ATOM 1797 CD GLN B 8 -0.495 -10.606 6.143 1.00 6.68 C ATOM 1798 OE1 GLN B 8 -0.503 -10.210 4.978 1.00 6.77 O ATOM 1799 NE2 GLN B 8 -1.606 -10.865 6.807 1.00 7.12 N ATOM 0 H GLN B 8 2.200 -13.801 7.069 1.00 6.40 H new ATOM 0 HA GLN B 8 0.618 -12.659 4.837 1.00 6.15 H new ATOM 0 HB2 GLN B 8 2.826 -11.479 6.570 1.00 6.04 H new ATOM 0 HB3 GLN B 8 2.107 -10.676 5.189 1.00 6.04 H new ATOM 0 HG2 GLN B 8 0.640 -11.515 7.716 1.00 6.41 H new ATOM 0 HG3 GLN B 8 1.144 -9.884 7.318 1.00 6.41 H new ATOM 0 HE21 GLN B 8 -1.559 -11.192 7.772 1.00 7.12 H new ATOM 0 HE22 GLN B 8 -2.512 -10.738 6.355 1.00 7.12 H new ATOM 1808 N PRO B 9 2.507 -12.787 3.122 1.00 5.94 N ATOM 1809 CA PRO B 9 3.466 -13.147 2.071 1.00 5.86 C ATOM 1810 C PRO B 9 4.786 -12.381 2.174 1.00 5.25 C ATOM 1811 O PRO B 9 4.940 -11.484 3.007 1.00 4.75 O ATOM 1812 CB PRO B 9 2.729 -12.768 0.785 1.00 6.04 C ATOM 1813 CG PRO B 9 1.826 -11.656 1.188 1.00 6.18 C ATOM 1814 CD PRO B 9 1.404 -11.957 2.600 1.00 6.07 C ATOM 0 HA PRO B 9 3.754 -14.197 2.131 1.00 5.86 H new ATOM 0 HB2 PRO B 9 3.424 -12.453 0.007 1.00 6.04 H new ATOM 0 HB3 PRO B 9 2.166 -13.612 0.386 1.00 6.04 H new ATOM 0 HG2 PRO B 9 2.339 -10.696 1.130 1.00 6.18 H new ATOM 0 HG3 PRO B 9 0.962 -11.596 0.527 1.00 6.18 H new ATOM 0 HD2 PRO B 9 1.277 -11.045 3.184 1.00 6.07 H new ATOM 0 HD3 PRO B 9 0.453 -12.489 2.630 1.00 6.07 H new ATOM 1822 N THR B 10 5.740 -12.746 1.322 1.00 5.38 N ATOM 1823 CA THR B 10 7.051 -12.110 1.303 1.00 4.87 C ATOM 1824 C THR B 10 7.038 -10.821 0.479 1.00 4.51 C ATOM 1825 O THR B 10 7.781 -10.680 -0.498 1.00 4.85 O ATOM 1826 CB THR B 10 8.112 -13.075 0.742 1.00 5.16 C ATOM 1827 OG1 THR B 10 7.476 -14.278 0.282 1.00 5.81 O ATOM 1828 CG2 THR B 10 9.148 -13.421 1.802 1.00 5.01 C ATOM 0 H THR B 10 5.626 -13.487 0.630 1.00 5.38 H new ATOM 0 HA THR B 10 7.304 -11.855 2.332 1.00 4.87 H new ATOM 0 HB THR B 10 8.618 -12.583 -0.089 1.00 5.16 H new ATOM 0 HG1 THR B 10 8.153 -14.890 -0.076 1.00 5.81 H new ATOM 0 HG21 THR B 10 9.886 -14.104 1.381 1.00 5.01 H new ATOM 0 HG22 THR B 10 9.645 -12.510 2.136 1.00 5.01 H new ATOM 0 HG23 THR B 10 8.656 -13.897 2.650 1.00 5.01 H new ATOM 1836 N GLU B 11 6.184 -9.892 0.878 1.00 4.02 N ATOM 1837 CA GLU B 11 6.054 -8.606 0.210 1.00 3.81 C ATOM 1838 C GLU B 11 5.255 -7.662 1.095 1.00 3.79 C ATOM 1839 O GLU B 11 4.250 -8.063 1.674 1.00 4.04 O ATOM 1840 CB GLU B 11 5.383 -8.761 -1.158 1.00 4.37 C ATOM 1841 CG GLU B 11 4.124 -9.608 -1.136 1.00 4.33 C ATOM 1842 CD GLU B 11 3.616 -9.911 -2.526 1.00 5.46 C ATOM 1843 OE1 GLU B 11 4.185 -10.806 -3.185 1.00 5.61 O ATOM 1844 OE2 GLU B 11 2.648 -9.254 -2.963 1.00 5.85 O ATOM 0 H GLU B 11 5.560 -10.008 1.676 1.00 4.02 H new ATOM 0 HA GLU B 11 7.048 -8.192 0.042 1.00 3.81 H new ATOM 0 HB2 GLU B 11 5.136 -7.772 -1.544 1.00 4.37 H new ATOM 0 HB3 GLU B 11 6.096 -9.206 -1.852 1.00 4.37 H new ATOM 0 HG2 GLU B 11 4.326 -10.543 -0.613 1.00 4.33 H new ATOM 0 HG3 GLU B 11 3.349 -9.089 -0.573 1.00 4.33 H new ATOM 1851 N PHE B 12 5.699 -6.419 1.212 1.00 3.64 N ATOM 1852 CA PHE B 12 5.006 -5.455 2.056 1.00 3.90 C ATOM 1853 C PHE B 12 5.080 -4.045 1.490 1.00 3.61 C ATOM 1854 O PHE B 12 5.982 -3.710 0.722 1.00 3.37 O ATOM 1855 CB PHE B 12 5.579 -5.472 3.479 1.00 3.97 C ATOM 1856 CG PHE B 12 7.043 -5.129 3.576 1.00 5.41 C ATOM 1857 CD1 PHE B 12 8.012 -6.087 3.325 1.00 5.81 C ATOM 1858 CD2 PHE B 12 7.451 -3.850 3.928 1.00 5.41 C ATOM 1859 CE1 PHE B 12 9.356 -5.780 3.421 1.00 6.08 C ATOM 1860 CE2 PHE B 12 8.794 -3.538 4.026 1.00 5.75 C ATOM 1861 CZ PHE B 12 9.748 -4.506 3.773 1.00 4.19 C ATOM 0 H PHE B 12 6.527 -6.056 0.739 1.00 3.64 H new ATOM 0 HA PHE B 12 3.958 -5.752 2.084 1.00 3.90 H new ATOM 0 HB2 PHE B 12 5.014 -4.769 4.091 1.00 3.97 H new ATOM 0 HB3 PHE B 12 5.423 -6.463 3.906 1.00 3.97 H new ATOM 0 HD1 PHE B 12 7.713 -7.088 3.050 1.00 5.81 H new ATOM 0 HD2 PHE B 12 6.710 -3.090 4.128 1.00 5.41 H new ATOM 0 HE1 PHE B 12 10.099 -6.538 3.220 1.00 6.08 H new ATOM 0 HE2 PHE B 12 9.098 -2.539 4.300 1.00 5.75 H new ATOM 0 HZ PHE B 12 10.798 -4.265 3.851 1.00 4.19 H new ATOM 1871 N ILE B 13 4.121 -3.223 1.888 1.00 4.06 N ATOM 1872 CA ILE B 13 4.060 -1.842 1.449 1.00 4.31 C ATOM 1873 C ILE B 13 4.916 -0.963 2.352 1.00 4.64 C ATOM 1874 O ILE B 13 4.685 -0.880 3.559 1.00 5.17 O ATOM 1875 CB ILE B 13 2.607 -1.320 1.443 1.00 4.65 C ATOM 1876 CG1 ILE B 13 1.800 -2.003 0.337 1.00 5.25 C ATOM 1877 CG2 ILE B 13 2.564 0.191 1.271 1.00 4.81 C ATOM 1878 CD1 ILE B 13 2.328 -1.739 -1.058 1.00 5.57 C ATOM 0 H ILE B 13 3.368 -3.495 2.521 1.00 4.06 H new ATOM 0 HA ILE B 13 4.445 -1.800 0.430 1.00 4.31 H new ATOM 0 HB ILE B 13 2.160 -1.562 2.407 1.00 4.65 H new ATOM 0 HG12 ILE B 13 1.794 -3.078 0.516 1.00 5.25 H new ATOM 0 HG13 ILE B 13 0.765 -1.665 0.394 1.00 5.25 H new ATOM 0 HG21 ILE B 13 1.527 0.528 1.271 1.00 4.81 H new ATOM 0 HG22 ILE B 13 3.100 0.666 2.093 1.00 4.81 H new ATOM 0 HG23 ILE B 13 3.034 0.463 0.326 1.00 4.81 H new ATOM 0 HD11 ILE B 13 1.704 -2.256 -1.787 1.00 5.57 H new ATOM 0 HD12 ILE B 13 2.308 -0.668 -1.258 1.00 5.57 H new ATOM 0 HD13 ILE B 13 3.353 -2.103 -1.134 1.00 5.57 H new ATOM 1890 N SER B 14 5.911 -0.327 1.764 1.00 4.50 N ATOM 1891 CA SER B 14 6.805 0.541 2.502 1.00 4.98 C ATOM 1892 C SER B 14 6.523 2.004 2.172 1.00 5.30 C ATOM 1893 O SER B 14 7.061 2.550 1.206 1.00 4.82 O ATOM 1894 CB SER B 14 8.250 0.192 2.163 1.00 4.87 C ATOM 1895 OG SER B 14 8.390 -1.198 1.950 1.00 4.53 O ATOM 0 H SER B 14 6.121 -0.397 0.768 1.00 4.50 H new ATOM 0 HA SER B 14 6.641 0.394 3.570 1.00 4.98 H new ATOM 0 HB2 SER B 14 8.561 0.735 1.271 1.00 4.87 H new ATOM 0 HB3 SER B 14 8.906 0.509 2.974 1.00 4.87 H new ATOM 0 HG SER B 14 8.453 -1.657 2.814 1.00 4.53 H new ATOM 1901 N ARG B 15 5.662 2.630 2.964 1.00 6.21 N ATOM 1902 CA ARG B 15 5.315 4.028 2.756 1.00 6.71 C ATOM 1903 C ARG B 15 6.343 4.910 3.449 1.00 7.20 C ATOM 1904 O ARG B 15 6.320 5.061 4.674 1.00 7.59 O ATOM 1905 CB ARG B 15 3.910 4.322 3.292 1.00 7.25 C ATOM 1906 CG ARG B 15 2.834 3.446 2.672 1.00 7.11 C ATOM 1907 CD ARG B 15 1.573 3.412 3.522 1.00 7.81 C ATOM 1908 NE ARG B 15 0.599 4.425 3.115 1.00 7.98 N ATOM 1909 CZ ARG B 15 -0.712 4.197 3.000 1.00 8.52 C ATOM 1910 NH1 ARG B 15 -1.207 2.985 3.256 1.00 8.97 N ATOM 1911 NH2 ARG B 15 -1.526 5.178 2.630 1.00 8.77 N ATOM 0 H ARG B 15 5.192 2.191 3.756 1.00 6.21 H new ATOM 0 HA ARG B 15 5.318 4.241 1.687 1.00 6.71 H new ATOM 0 HB2 ARG B 15 3.904 4.182 4.373 1.00 7.25 H new ATOM 0 HB3 ARG B 15 3.669 5.368 3.105 1.00 7.25 H new ATOM 0 HG2 ARG B 15 2.591 3.818 1.677 1.00 7.11 H new ATOM 0 HG3 ARG B 15 3.217 2.433 2.549 1.00 7.11 H new ATOM 0 HD2 ARG B 15 1.117 2.424 3.452 1.00 7.81 H new ATOM 0 HD3 ARG B 15 1.839 3.567 4.568 1.00 7.81 H new ATOM 0 HE ARG B 15 0.942 5.363 2.906 1.00 7.98 H new ATOM 0 HH11 ARG B 15 -0.584 2.229 3.540 1.00 8.97 H new ATOM 0 HH12 ARG B 15 -2.209 2.814 3.167 1.00 8.97 H new ATOM 0 HH21 ARG B 15 -1.150 6.106 2.434 1.00 8.77 H new ATOM 0 HH22 ARG B 15 -2.527 5.004 2.542 1.00 8.77 H new ATOM 1925 N HIS B 16 7.257 5.466 2.670 1.00 7.22 N ATOM 1926 CA HIS B 16 8.308 6.314 3.216 1.00 7.74 C ATOM 1927 C HIS B 16 8.420 7.611 2.431 1.00 8.16 C ATOM 1928 O HIS B 16 7.916 7.712 1.314 1.00 8.31 O ATOM 1929 CB HIS B 16 9.657 5.576 3.213 1.00 7.44 C ATOM 1930 CG HIS B 16 10.152 5.182 1.853 1.00 7.53 C ATOM 1931 ND1 HIS B 16 10.684 6.079 0.953 1.00 7.88 N ATOM 1932 CD2 HIS B 16 10.201 3.975 1.247 1.00 7.45 C ATOM 1933 CE1 HIS B 16 11.031 5.442 -0.146 1.00 7.94 C ATOM 1934 NE2 HIS B 16 10.751 4.164 0.004 1.00 7.70 N ATOM 0 H HIS B 16 7.294 5.346 1.658 1.00 7.22 H new ATOM 0 HA HIS B 16 8.043 6.555 4.246 1.00 7.74 H new ATOM 0 HB2 HIS B 16 10.405 6.212 3.687 1.00 7.44 H new ATOM 0 HB3 HIS B 16 9.567 4.679 3.826 1.00 7.44 H new ATOM 0 HD1 HIS B 16 10.792 7.081 1.113 1.00 7.88 H new ATOM 0 HD2 HIS B 16 9.869 3.036 1.664 1.00 7.45 H new ATOM 0 HE1 HIS B 16 11.471 5.892 -1.023 1.00 7.94 H new ATOM 1943 N ASN B 17 9.096 8.591 3.010 1.00 8.44 N ATOM 1944 CA ASN B 17 9.274 9.883 2.358 1.00 8.93 C ATOM 1945 C ASN B 17 10.369 9.802 1.290 1.00 8.16 C ATOM 1946 O ASN B 17 10.974 8.743 1.094 1.00 7.25 O ATOM 1947 CB ASN B 17 9.579 10.977 3.397 1.00 9.72 C ATOM 1948 CG ASN B 17 11.046 11.087 3.779 1.00 10.00 C ATOM 1949 OD1 ASN B 17 11.799 10.113 3.748 1.00 9.52 O ATOM 1950 ND2 ASN B 17 11.458 12.288 4.149 1.00 10.83 N ATOM 0 H ASN B 17 9.531 8.518 3.930 1.00 8.44 H new ATOM 0 HA ASN B 17 8.343 10.152 1.858 1.00 8.93 H new ATOM 0 HB2 ASN B 17 9.245 11.937 3.004 1.00 9.72 H new ATOM 0 HB3 ASN B 17 8.995 10.780 4.296 1.00 9.72 H new ATOM 0 HD21 ASN B 17 12.430 12.432 4.422 1.00 10.83 H new ATOM 0 HD22 ASN B 17 10.804 13.070 4.162 1.00 10.83 H new ATOM 1957 N ILE B 18 10.618 10.914 0.608 1.00 8.56 N ATOM 1958 CA ILE B 18 11.622 10.980 -0.459 1.00 7.97 C ATOM 1959 C ILE B 18 13.022 10.566 0.002 1.00 8.14 C ATOM 1960 O ILE B 18 13.783 9.985 -0.770 1.00 8.11 O ATOM 1961 CB ILE B 18 11.700 12.396 -1.069 1.00 8.20 C ATOM 1962 CG1 ILE B 18 11.900 13.443 0.032 1.00 8.36 C ATOM 1963 CG2 ILE B 18 10.447 12.691 -1.880 1.00 8.89 C ATOM 1964 CD1 ILE B 18 12.197 14.831 -0.494 1.00 8.53 C ATOM 0 H ILE B 18 10.133 11.796 0.775 1.00 8.56 H new ATOM 0 HA ILE B 18 11.289 10.265 -1.211 1.00 7.97 H new ATOM 0 HB ILE B 18 12.558 12.442 -1.739 1.00 8.20 H new ATOM 0 HG12 ILE B 18 11.003 13.483 0.650 1.00 8.36 H new ATOM 0 HG13 ILE B 18 12.719 13.126 0.678 1.00 8.36 H new ATOM 0 HG21 ILE B 18 10.516 13.693 -2.304 1.00 8.89 H new ATOM 0 HG22 ILE B 18 10.354 11.962 -2.685 1.00 8.89 H new ATOM 0 HG23 ILE B 18 9.572 12.630 -1.233 1.00 8.89 H new ATOM 0 HD11 ILE B 18 12.326 15.517 0.343 1.00 8.53 H new ATOM 0 HD12 ILE B 18 13.111 14.807 -1.088 1.00 8.53 H new ATOM 0 HD13 ILE B 18 11.368 15.169 -1.116 1.00 8.53 H new ATOM 1976 N GLU B 19 13.361 10.853 1.253 1.00 8.43 N ATOM 1977 CA GLU B 19 14.682 10.519 1.784 1.00 8.81 C ATOM 1978 C GLU B 19 14.796 9.029 2.096 1.00 8.59 C ATOM 1979 O GLU B 19 15.895 8.476 2.167 1.00 8.52 O ATOM 1980 CB GLU B 19 14.966 11.340 3.041 1.00 9.86 C ATOM 1981 CG GLU B 19 14.805 12.835 2.836 1.00 10.25 C ATOM 1982 CD GLU B 19 14.739 13.586 4.145 1.00 11.31 C ATOM 1983 OE1 GLU B 19 13.780 13.362 4.909 1.00 11.92 O ATOM 1984 OE2 GLU B 19 15.642 14.401 4.415 1.00 11.62 O ATOM 0 H GLU B 19 12.743 11.315 1.920 1.00 8.43 H new ATOM 0 HA GLU B 19 15.421 10.761 1.020 1.00 8.81 H new ATOM 0 HB2 GLU B 19 14.295 11.016 3.836 1.00 9.86 H new ATOM 0 HB3 GLU B 19 15.982 11.135 3.378 1.00 9.86 H new ATOM 0 HG2 GLU B 19 15.640 13.211 2.245 1.00 10.25 H new ATOM 0 HG3 GLU B 19 13.897 13.026 2.263 1.00 10.25 H new ATOM 1991 N GLY B 20 13.656 8.383 2.286 1.00 8.56 N ATOM 1992 CA GLY B 20 13.651 6.969 2.585 1.00 8.44 C ATOM 1993 C GLY B 20 13.138 6.678 3.978 1.00 8.57 C ATOM 1994 O GLY B 20 12.994 5.515 4.353 1.00 8.52 O ATOM 0 H GLY B 20 12.733 8.815 2.238 1.00 8.56 H new ATOM 0 HA2 GLY B 20 13.031 6.448 1.856 1.00 8.44 H new ATOM 0 HA3 GLY B 20 14.662 6.575 2.483 1.00 8.44 H new ATOM 1998 N ILE B 21 12.859 7.735 4.733 1.00 8.85 N ATOM 1999 CA ILE B 21 12.348 7.603 6.091 1.00 9.05 C ATOM 2000 C ILE B 21 10.949 7.009 6.063 1.00 8.72 C ATOM 2001 O ILE B 21 10.018 7.621 5.533 1.00 8.95 O ATOM 2002 CB ILE B 21 12.309 8.967 6.815 1.00 9.94 C ATOM 2003 CG1 ILE B 21 13.715 9.564 6.913 1.00 9.95 C ATOM 2004 CG2 ILE B 21 11.696 8.820 8.202 1.00 10.87 C ATOM 2005 CD1 ILE B 21 14.657 8.763 7.785 1.00 10.51 C ATOM 0 H ILE B 21 12.980 8.699 4.424 1.00 8.85 H new ATOM 0 HA ILE B 21 13.022 6.943 6.637 1.00 9.05 H new ATOM 0 HB ILE B 21 11.686 9.646 6.233 1.00 9.94 H new ATOM 0 HG12 ILE B 21 14.138 9.641 5.911 1.00 9.95 H new ATOM 0 HG13 ILE B 21 13.643 10.578 7.307 1.00 9.95 H new ATOM 0 HG21 ILE B 21 11.677 9.791 8.696 1.00 10.87 H new ATOM 0 HG22 ILE B 21 10.679 8.439 8.112 1.00 10.87 H new ATOM 0 HG23 ILE B 21 12.293 8.124 8.792 1.00 10.87 H new ATOM 0 HD11 ILE B 21 15.633 9.247 7.806 1.00 10.51 H new ATOM 0 HD12 ILE B 21 14.257 8.708 8.798 1.00 10.51 H new ATOM 0 HD13 ILE B 21 14.760 7.756 7.380 1.00 10.51 H new ATOM 2017 N PHE B 22 10.814 5.806 6.602 1.00 8.23 N ATOM 2018 CA PHE B 22 9.531 5.118 6.632 1.00 7.87 C ATOM 2019 C PHE B 22 8.554 5.814 7.568 1.00 7.79 C ATOM 2020 O PHE B 22 8.859 6.057 8.738 1.00 8.12 O ATOM 2021 CB PHE B 22 9.708 3.662 7.059 1.00 7.86 C ATOM 2022 CG PHE B 22 10.520 2.840 6.100 1.00 7.34 C ATOM 2023 CD1 PHE B 22 11.895 2.750 6.238 1.00 7.19 C ATOM 2024 CD2 PHE B 22 9.907 2.153 5.065 1.00 7.10 C ATOM 2025 CE1 PHE B 22 12.644 1.989 5.365 1.00 6.90 C ATOM 2026 CE2 PHE B 22 10.653 1.392 4.188 1.00 6.75 C ATOM 2027 CZ PHE B 22 12.022 1.310 4.337 1.00 6.69 C ATOM 0 H PHE B 22 11.581 5.284 7.026 1.00 8.23 H new ATOM 0 HA PHE B 22 9.121 5.145 5.622 1.00 7.87 H new ATOM 0 HB2 PHE B 22 10.186 3.637 8.038 1.00 7.86 H new ATOM 0 HB3 PHE B 22 8.725 3.205 7.172 1.00 7.86 H new ATOM 0 HD1 PHE B 22 12.387 3.282 7.039 1.00 7.19 H new ATOM 0 HD2 PHE B 22 8.836 2.213 4.943 1.00 7.10 H new ATOM 0 HE1 PHE B 22 13.715 1.925 5.486 1.00 6.90 H new ATOM 0 HE2 PHE B 22 10.165 0.860 3.385 1.00 6.75 H new ATOM 0 HZ PHE B 22 12.606 0.715 3.650 1.00 6.69 H new ATOM 2037 N THR B 23 7.386 6.137 7.038 1.00 7.44 N ATOM 2038 CA THR B 23 6.345 6.791 7.809 1.00 7.38 C ATOM 2039 C THR B 23 5.303 5.770 8.259 1.00 7.22 C ATOM 2040 O THR B 23 4.788 5.838 9.376 1.00 7.91 O ATOM 2041 CB THR B 23 5.663 7.894 6.976 1.00 7.22 C ATOM 2042 OG1 THR B 23 6.654 8.624 6.237 1.00 7.16 O ATOM 2043 CG2 THR B 23 4.885 8.848 7.870 1.00 7.36 C ATOM 0 H THR B 23 7.135 5.954 6.067 1.00 7.44 H new ATOM 0 HA THR B 23 6.805 7.247 8.686 1.00 7.38 H new ATOM 0 HB THR B 23 4.964 7.422 6.286 1.00 7.22 H new ATOM 0 HG1 THR B 23 6.218 9.323 5.707 1.00 7.16 H new ATOM 0 HG21 THR B 23 4.413 9.617 7.258 1.00 7.36 H new ATOM 0 HG22 THR B 23 4.118 8.295 8.412 1.00 7.36 H new ATOM 0 HG23 THR B 23 5.565 9.317 8.581 1.00 7.36 H new ATOM 2051 N PHE B 24 5.013 4.817 7.379 1.00 6.39 N ATOM 2052 CA PHE B 24 4.046 3.769 7.665 1.00 6.27 C ATOM 2053 C PHE B 24 4.461 2.486 6.954 1.00 5.44 C ATOM 2054 O PHE B 24 4.642 2.474 5.735 1.00 4.71 O ATOM 2055 CB PHE B 24 2.645 4.199 7.218 1.00 6.55 C ATOM 2056 CG PHE B 24 1.543 3.336 7.767 1.00 6.80 C ATOM 2057 CD1 PHE B 24 1.291 3.296 9.129 1.00 7.52 C ATOM 2058 CD2 PHE B 24 0.761 2.565 6.923 1.00 6.51 C ATOM 2059 CE1 PHE B 24 0.280 2.504 9.639 1.00 7.89 C ATOM 2060 CE2 PHE B 24 -0.251 1.771 7.426 1.00 6.98 C ATOM 2061 CZ PHE B 24 -0.491 1.739 8.786 1.00 7.64 C ATOM 0 H PHE B 24 5.439 4.751 6.455 1.00 6.39 H new ATOM 0 HA PHE B 24 4.020 3.589 8.740 1.00 6.27 H new ATOM 0 HB2 PHE B 24 2.475 5.230 7.528 1.00 6.55 H new ATOM 0 HB3 PHE B 24 2.600 4.182 6.129 1.00 6.55 H new ATOM 0 HD1 PHE B 24 1.892 3.891 9.800 1.00 7.52 H new ATOM 0 HD2 PHE B 24 0.945 2.585 5.859 1.00 6.51 H new ATOM 0 HE1 PHE B 24 0.093 2.483 10.703 1.00 7.89 H new ATOM 0 HE2 PHE B 24 -0.854 1.176 6.757 1.00 6.98 H new ATOM 0 HZ PHE B 24 -1.280 1.117 9.182 1.00 7.64 H new ATOM 2071 N VAL B 25 4.625 1.416 7.714 1.00 5.71 N ATOM 2072 CA VAL B 25 5.041 0.139 7.151 1.00 5.22 C ATOM 2073 C VAL B 25 4.002 -0.943 7.420 1.00 5.47 C ATOM 2074 O VAL B 25 3.430 -1.013 8.507 1.00 5.85 O ATOM 2075 CB VAL B 25 6.401 -0.315 7.731 1.00 5.58 C ATOM 2076 CG1 VAL B 25 6.957 -1.503 6.958 1.00 5.20 C ATOM 2077 CG2 VAL B 25 7.397 0.833 7.727 1.00 6.10 C ATOM 0 H VAL B 25 4.477 1.405 8.723 1.00 5.71 H new ATOM 0 HA VAL B 25 5.142 0.284 6.075 1.00 5.22 H new ATOM 0 HB VAL B 25 6.237 -0.628 8.762 1.00 5.58 H new ATOM 0 HG11 VAL B 25 7.914 -1.801 7.387 1.00 5.20 H new ATOM 0 HG12 VAL B 25 6.257 -2.336 7.018 1.00 5.20 H new ATOM 0 HG13 VAL B 25 7.099 -1.223 5.914 1.00 5.20 H new ATOM 0 HG21 VAL B 25 8.347 0.492 8.139 1.00 6.10 H new ATOM 0 HG22 VAL B 25 7.548 1.180 6.705 1.00 6.10 H new ATOM 0 HG23 VAL B 25 7.011 1.652 8.334 1.00 6.10 H new ATOM 2087 N ASP B 26 3.758 -1.773 6.415 1.00 5.31 N ATOM 2088 CA ASP B 26 2.802 -2.867 6.533 1.00 5.56 C ATOM 2089 C ASP B 26 3.362 -3.952 7.448 1.00 6.58 C ATOM 2090 O ASP B 26 4.577 -4.118 7.554 1.00 7.15 O ATOM 2091 CB ASP B 26 2.495 -3.444 5.150 1.00 4.87 C ATOM 2092 CG ASP B 26 1.258 -4.316 5.136 1.00 4.97 C ATOM 2093 OD1 ASP B 26 1.338 -5.486 5.565 1.00 5.05 O ATOM 2094 OD2 ASP B 26 0.206 -3.849 4.668 1.00 5.22 O ATOM 0 H ASP B 26 4.212 -1.709 5.504 1.00 5.31 H new ATOM 0 HA ASP B 26 1.877 -2.487 6.967 1.00 5.56 H new ATOM 0 HB2 ASP B 26 2.365 -2.626 4.442 1.00 4.87 H new ATOM 0 HB3 ASP B 26 3.349 -4.029 4.808 1.00 4.87 H new ATOM 2099 N HIS B 27 2.478 -4.710 8.081 1.00 6.95 N ATOM 2100 CA HIS B 27 2.891 -5.766 9.005 1.00 8.01 C ATOM 2101 C HIS B 27 3.540 -6.942 8.271 1.00 8.33 C ATOM 2102 O HIS B 27 4.128 -7.822 8.897 1.00 8.59 O ATOM 2103 CB HIS B 27 1.695 -6.264 9.823 1.00 8.34 C ATOM 2104 CG HIS B 27 1.086 -5.217 10.706 1.00 8.39 C ATOM 2105 ND1 HIS B 27 -0.269 -4.992 10.778 1.00 8.80 N ATOM 2106 CD2 HIS B 27 1.659 -4.334 11.556 1.00 8.34 C ATOM 2107 CE1 HIS B 27 -0.505 -4.015 11.632 1.00 8.97 C ATOM 2108 NE2 HIS B 27 0.647 -3.594 12.119 1.00 8.70 N ATOM 0 H HIS B 27 1.468 -4.616 7.974 1.00 6.95 H new ATOM 0 HA HIS B 27 3.634 -5.334 9.676 1.00 8.01 H new ATOM 0 HB2 HIS B 27 0.932 -6.639 9.141 1.00 8.34 H new ATOM 0 HB3 HIS B 27 2.013 -7.105 10.439 1.00 8.34 H new ATOM 0 HD2 HIS B 27 2.715 -4.230 11.755 1.00 8.34 H new ATOM 0 HE1 HIS B 27 -1.478 -3.625 11.890 1.00 8.97 H new ATOM 0 HE2 HIS B 27 0.766 -2.844 12.800 1.00 8.70 H new ATOM 2117 N ARG B 28 3.438 -6.951 6.947 1.00 8.41 N ATOM 2118 CA ARG B 28 4.020 -8.023 6.136 1.00 8.82 C ATOM 2119 C ARG B 28 5.551 -7.999 6.167 1.00 9.34 C ATOM 2120 O ARG B 28 6.200 -8.948 5.724 1.00 9.76 O ATOM 2121 CB ARG B 28 3.544 -7.906 4.689 1.00 8.65 C ATOM 2122 CG ARG B 28 2.132 -8.411 4.461 1.00 9.09 C ATOM 2123 CD ARG B 28 1.613 -8.024 3.085 1.00 9.23 C ATOM 2124 NE ARG B 28 1.141 -6.643 3.054 1.00 9.07 N ATOM 2125 CZ ARG B 28 0.819 -5.982 1.942 1.00 9.17 C ATOM 2126 NH1 ARG B 28 0.984 -6.543 0.747 1.00 9.42 N ATOM 2127 NH2 ARG B 28 0.339 -4.751 2.021 1.00 9.14 N ATOM 0 H ARG B 28 2.958 -6.230 6.409 1.00 8.41 H new ATOM 0 HA ARG B 28 3.686 -8.968 6.564 1.00 8.82 H new ATOM 0 HB2 ARG B 28 3.599 -6.861 4.383 1.00 8.65 H new ATOM 0 HB3 ARG B 28 4.226 -8.463 4.047 1.00 8.65 H new ATOM 0 HG2 ARG B 28 2.112 -9.496 4.566 1.00 9.09 H new ATOM 0 HG3 ARG B 28 1.472 -8.004 5.227 1.00 9.09 H new ATOM 0 HD2 ARG B 28 2.405 -8.154 2.348 1.00 9.23 H new ATOM 0 HD3 ARG B 28 0.800 -8.693 2.801 1.00 9.23 H new ATOM 0 HE ARG B 28 1.052 -6.151 3.943 1.00 9.07 H new ATOM 0 HH11 ARG B 28 1.360 -7.488 0.675 1.00 9.42 H new ATOM 0 HH12 ARG B 28 0.734 -6.028 -0.097 1.00 9.42 H new ATOM 0 HH21 ARG B 28 0.216 -4.309 2.932 1.00 9.14 H new ATOM 0 HH22 ARG B 28 0.092 -4.244 1.171 1.00 9.14 H new ATOM 2141 N CYS B 29 6.126 -6.923 6.695 1.00 9.40 N ATOM 2142 CA CYS B 29 7.578 -6.777 6.763 1.00 9.95 C ATOM 2143 C CYS B 29 8.229 -7.918 7.546 1.00 10.96 C ATOM 2144 O CYS B 29 9.291 -8.419 7.162 1.00 11.56 O ATOM 2145 CB CYS B 29 7.940 -5.434 7.398 1.00 9.64 C ATOM 2146 SG CYS B 29 7.192 -5.165 9.021 1.00 9.41 S ATOM 0 H CYS B 29 5.607 -6.136 7.084 1.00 9.40 H new ATOM 0 HA CYS B 29 7.962 -6.814 5.743 1.00 9.95 H new ATOM 0 HB2 CYS B 29 9.024 -5.369 7.493 1.00 9.64 H new ATOM 0 HB3 CYS B 29 7.630 -4.632 6.729 1.00 9.64 H new ATOM 0 HG CYS B 29 8.012 -5.563 9.948 1.00 9.41 H new ATOM 2152 N VAL B 30 7.575 -8.343 8.622 1.00 11.19 N ATOM 2153 CA VAL B 30 8.093 -9.415 9.465 1.00 12.16 C ATOM 2154 C VAL B 30 8.114 -10.743 8.713 1.00 12.13 C ATOM 2155 O VAL B 30 8.986 -11.580 8.934 1.00 12.06 O ATOM 2156 CB VAL B 30 7.257 -9.575 10.755 1.00 12.71 C ATOM 2157 CG1 VAL B 30 8.007 -10.407 11.785 1.00 13.64 C ATOM 2158 CG2 VAL B 30 6.894 -8.216 11.336 1.00 12.09 C ATOM 0 H VAL B 30 6.682 -7.960 8.932 1.00 11.19 H new ATOM 0 HA VAL B 30 9.112 -9.139 9.737 1.00 12.16 H new ATOM 0 HB VAL B 30 6.335 -10.096 10.496 1.00 12.71 H new ATOM 0 HG11 VAL B 30 7.400 -10.506 12.685 1.00 13.64 H new ATOM 0 HG12 VAL B 30 8.212 -11.396 11.375 1.00 13.64 H new ATOM 0 HG13 VAL B 30 8.947 -9.916 12.035 1.00 13.64 H new ATOM 0 HG21 VAL B 30 6.306 -8.354 12.243 1.00 12.09 H new ATOM 0 HG22 VAL B 30 7.805 -7.667 11.574 1.00 12.09 H new ATOM 0 HG23 VAL B 30 6.311 -7.653 10.607 1.00 12.09 H new ATOM 2168 N ALA B 31 7.164 -10.925 7.810 1.00 12.22 N ATOM 2169 CA ALA B 31 7.079 -12.153 7.032 1.00 12.23 C ATOM 2170 C ALA B 31 7.986 -12.101 5.806 1.00 12.35 C ATOM 2171 O ALA B 31 8.213 -13.115 5.143 1.00 12.90 O ATOM 2172 CB ALA B 31 5.644 -12.406 6.608 1.00 12.06 C ATOM 0 H ALA B 31 6.440 -10.239 7.597 1.00 12.22 H new ATOM 0 HA ALA B 31 7.417 -12.973 7.665 1.00 12.23 H new ATOM 0 HB1 ALA B 31 5.593 -13.327 6.027 1.00 12.06 H new ATOM 0 HB2 ALA B 31 5.014 -12.500 7.493 1.00 12.06 H new ATOM 0 HB3 ALA B 31 5.292 -11.573 5.999 1.00 12.06 H new ATOM 2178 N THR B 32 8.510 -10.922 5.521 1.00 11.87 N ATOM 2179 CA THR B 32 9.378 -10.738 4.369 1.00 11.93 C ATOM 2180 C THR B 32 10.854 -10.737 4.760 1.00 12.13 C ATOM 2181 O THR B 32 11.624 -11.574 4.292 1.00 12.07 O ATOM 2182 CB THR B 32 9.046 -9.429 3.636 1.00 11.28 C ATOM 2183 OG1 THR B 32 7.632 -9.335 3.429 1.00 10.74 O ATOM 2184 CG2 THR B 32 9.766 -9.357 2.298 1.00 11.32 C ATOM 0 H THR B 32 8.350 -10.078 6.070 1.00 11.87 H new ATOM 0 HA THR B 32 9.199 -11.583 3.704 1.00 11.93 H new ATOM 0 HB THR B 32 9.382 -8.596 4.253 1.00 11.28 H new ATOM 0 HG1 THR B 32 7.194 -9.088 4.270 1.00 10.74 H new ATOM 0 HG21 THR B 32 9.514 -8.421 1.799 1.00 11.32 H new ATOM 0 HG22 THR B 32 10.843 -9.403 2.461 1.00 11.32 H new ATOM 0 HG23 THR B 32 9.458 -10.195 1.673 1.00 11.32 H new ATOM 2192 N VAL B 33 11.245 -9.802 5.619 1.00 12.47 N ATOM 2193 CA VAL B 33 12.641 -9.701 6.041 1.00 12.77 C ATOM 2194 C VAL B 33 12.801 -9.955 7.535 1.00 13.33 C ATOM 2195 O VAL B 33 13.921 -10.004 8.044 1.00 13.87 O ATOM 2196 CB VAL B 33 13.239 -8.318 5.696 1.00 12.98 C ATOM 2197 CG1 VAL B 33 13.586 -8.242 4.219 1.00 12.95 C ATOM 2198 CG2 VAL B 33 12.276 -7.201 6.074 1.00 13.04 C ATOM 0 H VAL B 33 10.623 -9.108 6.035 1.00 12.47 H new ATOM 0 HA VAL B 33 13.183 -10.472 5.493 1.00 12.77 H new ATOM 0 HB VAL B 33 14.154 -8.190 6.275 1.00 12.98 H new ATOM 0 HG11 VAL B 33 14.006 -7.262 3.994 1.00 12.95 H new ATOM 0 HG12 VAL B 33 14.317 -9.014 3.977 1.00 12.95 H new ATOM 0 HG13 VAL B 33 12.685 -8.396 3.625 1.00 12.95 H new ATOM 0 HG21 VAL B 33 12.719 -6.238 5.822 1.00 13.04 H new ATOM 0 HG22 VAL B 33 11.342 -7.325 5.526 1.00 13.04 H new ATOM 0 HG23 VAL B 33 12.077 -7.239 7.145 1.00 13.04 H new ATOM 2208 N GLY B 34 11.686 -10.110 8.233 1.00 13.22 N ATOM 2209 CA GLY B 34 11.736 -10.353 9.663 1.00 13.79 C ATOM 2210 C GLY B 34 11.853 -9.070 10.460 1.00 13.48 C ATOM 2211 O GLY B 34 11.919 -9.095 11.688 1.00 13.67 O ATOM 0 H GLY B 34 10.747 -10.072 7.837 1.00 13.22 H new ATOM 0 HA2 GLY B 34 10.837 -10.888 9.970 1.00 13.79 H new ATOM 0 HA3 GLY B 34 12.585 -10.998 9.890 1.00 13.79 H new ATOM 2215 N TYR B 35 11.872 -7.947 9.757 1.00 13.06 N ATOM 2216 CA TYR B 35 11.982 -6.643 10.394 1.00 12.84 C ATOM 2217 C TYR B 35 10.638 -6.185 10.936 1.00 12.88 C ATOM 2218 O TYR B 35 9.610 -6.333 10.273 1.00 12.93 O ATOM 2219 CB TYR B 35 12.490 -5.598 9.396 1.00 12.71 C ATOM 2220 CG TYR B 35 13.996 -5.477 9.324 1.00 13.12 C ATOM 2221 CD1 TYR B 35 14.772 -5.476 10.474 1.00 13.55 C ATOM 2222 CD2 TYR B 35 14.639 -5.352 8.101 1.00 13.47 C ATOM 2223 CE1 TYR B 35 16.146 -5.354 10.406 1.00 14.27 C ATOM 2224 CE2 TYR B 35 16.011 -5.234 8.026 1.00 14.23 C ATOM 2225 CZ TYR B 35 16.758 -5.234 9.179 1.00 14.46 C ATOM 2226 OH TYR B 35 18.123 -5.109 9.104 1.00 15.38 O ATOM 0 H TYR B 35 11.812 -7.913 8.739 1.00 13.06 H new ATOM 0 HA TYR B 35 12.689 -6.742 11.218 1.00 12.84 H new ATOM 0 HB2 TYR B 35 12.111 -5.847 8.405 1.00 12.71 H new ATOM 0 HB3 TYR B 35 12.073 -4.627 9.663 1.00 12.71 H new ATOM 0 HD1 TYR B 35 14.294 -5.572 11.438 1.00 13.55 H new ATOM 0 HD2 TYR B 35 14.055 -5.347 7.192 1.00 13.47 H new ATOM 0 HE1 TYR B 35 16.737 -5.353 11.310 1.00 14.27 H new ATOM 0 HE2 TYR B 35 16.496 -5.142 7.065 1.00 14.23 H new ATOM 0 HH TYR B 35 18.366 -4.160 9.118 1.00 15.38 H new ATOM 2236 N GLN B 36 10.651 -5.636 12.138 1.00 12.95 N ATOM 2237 CA GLN B 36 9.436 -5.125 12.748 1.00 13.09 C ATOM 2238 C GLN B 36 9.131 -3.753 12.154 1.00 13.29 C ATOM 2239 O GLN B 36 10.051 -3.035 11.766 1.00 13.05 O ATOM 2240 CB GLN B 36 9.599 -5.021 14.265 1.00 13.40 C ATOM 2241 CG GLN B 36 9.619 -6.366 14.976 1.00 13.22 C ATOM 2242 CD GLN B 36 8.327 -7.143 14.801 1.00 13.36 C ATOM 2243 OE1 GLN B 36 7.258 -6.564 14.601 1.00 13.78 O ATOM 2244 NE2 GLN B 36 8.412 -8.462 14.884 1.00 13.13 N ATOM 0 H GLN B 36 11.489 -5.533 12.711 1.00 12.95 H new ATOM 0 HA GLN B 36 8.611 -5.808 12.545 1.00 13.09 H new ATOM 0 HB2 GLN B 36 10.525 -4.491 14.486 1.00 13.40 H new ATOM 0 HB3 GLN B 36 8.784 -4.420 14.668 1.00 13.40 H new ATOM 0 HG2 GLN B 36 10.450 -6.961 14.596 1.00 13.22 H new ATOM 0 HG3 GLN B 36 9.801 -6.207 16.039 1.00 13.22 H new ATOM 0 HE21 GLN B 36 9.315 -8.905 15.051 1.00 13.13 H new ATOM 0 HE22 GLN B 36 7.574 -9.035 14.781 1.00 13.13 H new ATOM 2253 N PRO B 37 7.849 -3.366 12.069 1.00 13.77 N ATOM 2254 CA PRO B 37 7.449 -2.067 11.509 1.00 14.06 C ATOM 2255 C PRO B 37 8.177 -0.900 12.174 1.00 14.37 C ATOM 2256 O PRO B 37 8.578 0.060 11.513 1.00 14.17 O ATOM 2257 CB PRO B 37 5.949 -1.996 11.805 1.00 14.71 C ATOM 2258 CG PRO B 37 5.516 -3.416 11.920 1.00 14.52 C ATOM 2259 CD PRO B 37 6.685 -4.160 12.503 1.00 14.10 C ATOM 0 HA PRO B 37 7.692 -1.990 10.449 1.00 14.06 H new ATOM 0 HB2 PRO B 37 5.753 -1.447 12.726 1.00 14.71 H new ATOM 0 HB3 PRO B 37 5.412 -1.482 11.007 1.00 14.71 H new ATOM 0 HG2 PRO B 37 4.638 -3.506 12.560 1.00 14.52 H new ATOM 0 HG3 PRO B 37 5.243 -3.821 10.946 1.00 14.52 H new ATOM 0 HD2 PRO B 37 6.622 -4.219 13.590 1.00 14.10 H new ATOM 0 HD3 PRO B 37 6.736 -5.183 12.131 1.00 14.10 H new ATOM 2267 N GLN B 38 8.369 -1.005 13.485 1.00 14.87 N ATOM 2268 CA GLN B 38 9.043 0.033 14.259 1.00 15.23 C ATOM 2269 C GLN B 38 10.522 0.131 13.891 1.00 14.56 C ATOM 2270 O GLN B 38 11.147 1.170 14.097 1.00 14.37 O ATOM 2271 CB GLN B 38 8.896 -0.233 15.761 1.00 16.33 C ATOM 2272 CG GLN B 38 7.452 -0.349 16.227 1.00 17.13 C ATOM 2273 CD GLN B 38 6.955 -1.783 16.245 1.00 17.26 C ATOM 2274 OE1 GLN B 38 7.431 -2.631 15.488 1.00 17.15 O ATOM 2275 NE2 GLN B 38 5.995 -2.065 17.107 1.00 17.54 N ATOM 0 H GLN B 38 8.064 -1.806 14.038 1.00 14.87 H new ATOM 0 HA GLN B 38 8.567 0.983 14.017 1.00 15.23 H new ATOM 0 HB2 GLN B 38 9.423 -1.154 16.011 1.00 16.33 H new ATOM 0 HB3 GLN B 38 9.382 0.572 16.312 1.00 16.33 H new ATOM 0 HG2 GLN B 38 7.362 0.075 17.227 1.00 17.13 H new ATOM 0 HG3 GLN B 38 6.814 0.244 15.571 1.00 17.13 H new ATOM 0 HE21 GLN B 38 5.627 -1.335 17.717 1.00 17.54 H new ATOM 0 HE22 GLN B 38 5.622 -3.013 17.163 1.00 17.54 H new ATOM 2284 N GLU B 39 11.072 -0.945 13.334 1.00 14.24 N ATOM 2285 CA GLU B 39 12.480 -0.973 12.941 1.00 13.70 C ATOM 2286 C GLU B 39 12.712 -0.141 11.684 1.00 13.37 C ATOM 2287 O GLU B 39 13.827 0.315 11.430 1.00 13.53 O ATOM 2288 CB GLU B 39 12.958 -2.409 12.702 1.00 13.16 C ATOM 2289 CG GLU B 39 12.970 -3.268 13.955 1.00 13.35 C ATOM 2290 CD GLU B 39 13.722 -4.567 13.755 1.00 12.51 C ATOM 2291 OE1 GLU B 39 14.962 -4.571 13.931 1.00 12.54 O ATOM 2292 OE2 GLU B 39 13.082 -5.584 13.417 1.00 12.57 O ATOM 0 H GLU B 39 10.565 -1.809 13.144 1.00 14.24 H new ATOM 0 HA GLU B 39 13.055 -0.543 13.761 1.00 13.70 H new ATOM 0 HB2 GLU B 39 12.314 -2.877 11.958 1.00 13.16 H new ATOM 0 HB3 GLU B 39 13.963 -2.382 12.282 1.00 13.16 H new ATOM 0 HG2 GLU B 39 13.426 -2.709 14.772 1.00 13.35 H new ATOM 0 HG3 GLU B 39 11.944 -3.487 14.253 1.00 13.35 H new ATOM 2299 N LEU B 40 11.657 0.055 10.904 1.00 12.99 N ATOM 2300 CA LEU B 40 11.750 0.835 9.677 1.00 12.68 C ATOM 2301 C LEU B 40 11.389 2.294 9.939 1.00 12.42 C ATOM 2302 O LEU B 40 11.957 3.204 9.335 1.00 12.12 O ATOM 2303 CB LEU B 40 10.828 0.263 8.592 1.00 13.01 C ATOM 2304 CG LEU B 40 11.299 -1.037 7.924 1.00 13.16 C ATOM 2305 CD1 LEU B 40 12.808 -1.039 7.735 1.00 13.20 C ATOM 2306 CD2 LEU B 40 10.854 -2.248 8.727 1.00 14.03 C ATOM 0 H LEU B 40 10.727 -0.315 11.099 1.00 12.99 H new ATOM 0 HA LEU B 40 12.781 0.780 9.326 1.00 12.68 H new ATOM 0 HB2 LEU B 40 9.847 0.087 9.033 1.00 13.01 H new ATOM 0 HB3 LEU B 40 10.698 1.019 7.818 1.00 13.01 H new ATOM 0 HG LEU B 40 10.838 -1.094 6.938 1.00 13.16 H new ATOM 0 HD11 LEU B 40 13.114 -1.971 7.260 1.00 13.20 H new ATOM 0 HD12 LEU B 40 13.097 -0.198 7.104 1.00 13.20 H new ATOM 0 HD13 LEU B 40 13.296 -0.949 8.705 1.00 13.20 H new ATOM 0 HD21 LEU B 40 11.199 -3.157 8.235 1.00 14.03 H new ATOM 0 HD22 LEU B 40 11.277 -2.195 9.730 1.00 14.03 H new ATOM 0 HD23 LEU B 40 9.766 -2.261 8.793 1.00 14.03 H new ATOM 2318 N LEU B 41 10.442 2.509 10.846 1.00 12.56 N ATOM 2319 CA LEU B 41 9.987 3.855 11.189 1.00 12.35 C ATOM 2320 C LEU B 41 11.140 4.717 11.692 1.00 11.89 C ATOM 2321 O LEU B 41 11.778 4.398 12.696 1.00 11.86 O ATOM 2322 CB LEU B 41 8.886 3.791 12.250 1.00 13.17 C ATOM 2323 CG LEU B 41 7.634 3.016 11.843 1.00 13.46 C ATOM 2324 CD1 LEU B 41 6.600 3.054 12.954 1.00 13.62 C ATOM 2325 CD2 LEU B 41 7.051 3.571 10.551 1.00 13.49 C ATOM 0 H LEU B 41 9.971 1.765 11.360 1.00 12.56 H new ATOM 0 HA LEU B 41 9.587 4.311 10.283 1.00 12.35 H new ATOM 0 HB2 LEU B 41 9.298 3.337 13.151 1.00 13.17 H new ATOM 0 HB3 LEU B 41 8.595 4.809 12.510 1.00 13.17 H new ATOM 0 HG LEU B 41 7.917 1.978 11.670 1.00 13.46 H new ATOM 0 HD11 LEU B 41 5.715 2.497 12.647 1.00 13.62 H new ATOM 0 HD12 LEU B 41 7.017 2.604 13.855 1.00 13.62 H new ATOM 0 HD13 LEU B 41 6.324 4.088 13.159 1.00 13.62 H new ATOM 0 HD21 LEU B 41 6.160 3.004 10.281 1.00 13.49 H new ATOM 0 HD22 LEU B 41 6.785 4.619 10.692 1.00 13.49 H new ATOM 0 HD23 LEU B 41 7.790 3.489 9.754 1.00 13.49 H new ATOM 2337 N GLY B 42 11.407 5.805 10.979 1.00 11.62 N ATOM 2338 CA GLY B 42 12.479 6.708 11.364 1.00 11.31 C ATOM 2339 C GLY B 42 13.815 6.314 10.769 1.00 11.25 C ATOM 2340 O GLY B 42 14.844 6.918 11.071 1.00 11.52 O ATOM 0 H GLY B 42 10.899 6.080 10.138 1.00 11.62 H new ATOM 0 HA2 GLY B 42 12.228 7.720 11.046 1.00 11.31 H new ATOM 0 HA3 GLY B 42 12.561 6.726 12.451 1.00 11.31 H new ATOM 2344 N LYS B 43 13.808 5.299 9.924 1.00 10.99 N ATOM 2345 CA LYS B 43 15.025 4.829 9.290 1.00 11.02 C ATOM 2346 C LYS B 43 14.919 4.960 7.782 1.00 10.14 C ATOM 2347 O LYS B 43 13.819 5.066 7.239 1.00 9.53 O ATOM 2348 CB LYS B 43 15.293 3.370 9.668 1.00 11.75 C ATOM 2349 CG LYS B 43 15.624 3.167 11.138 1.00 12.72 C ATOM 2350 CD LYS B 43 17.117 3.281 11.402 1.00 13.24 C ATOM 2351 CE LYS B 43 17.476 4.593 12.084 1.00 13.72 C ATOM 2352 NZ LYS B 43 17.531 5.730 11.123 1.00 13.82 N ATOM 0 H LYS B 43 12.969 4.783 9.660 1.00 10.99 H new ATOM 0 HA LYS B 43 15.855 5.443 9.640 1.00 11.02 H new ATOM 0 HB2 LYS B 43 14.417 2.773 9.417 1.00 11.75 H new ATOM 0 HB3 LYS B 43 16.119 2.994 9.064 1.00 11.75 H new ATOM 0 HG2 LYS B 43 15.092 3.907 11.736 1.00 12.72 H new ATOM 0 HG3 LYS B 43 15.272 2.186 11.458 1.00 12.72 H new ATOM 0 HD2 LYS B 43 17.440 2.448 12.026 1.00 13.24 H new ATOM 0 HD3 LYS B 43 17.659 3.202 10.460 1.00 13.24 H new ATOM 0 HE2 LYS B 43 16.742 4.810 12.860 1.00 13.72 H new ATOM 0 HE3 LYS B 43 18.442 4.491 12.579 1.00 13.72 H new ATOM 0 HZ1 LYS B 43 18.293 6.382 11.399 1.00 13.82 H new ATOM 0 HZ2 LYS B 43 17.716 5.367 10.166 1.00 13.82 H new ATOM 0 HZ3 LYS B 43 16.623 6.236 11.132 1.00 13.82 H new ATOM 2366 N ASN B 44 16.059 4.973 7.118 1.00 10.16 N ATOM 2367 CA ASN B 44 16.093 5.072 5.669 1.00 9.44 C ATOM 2368 C ASN B 44 16.200 3.680 5.072 1.00 9.58 C ATOM 2369 O ASN B 44 16.924 2.832 5.592 1.00 10.05 O ATOM 2370 CB ASN B 44 17.283 5.919 5.199 1.00 8.98 C ATOM 2371 CG ASN B 44 17.279 7.327 5.761 1.00 8.84 C ATOM 2372 OD1 ASN B 44 17.745 7.561 6.874 1.00 9.30 O ATOM 2373 ND2 ASN B 44 16.781 8.280 4.987 1.00 8.30 N ATOM 0 H ASN B 44 16.977 4.916 7.559 1.00 10.16 H new ATOM 0 HA ASN B 44 15.174 5.555 5.336 1.00 9.44 H new ATOM 0 HB2 ASN B 44 18.209 5.423 5.488 1.00 8.98 H new ATOM 0 HB3 ASN B 44 17.275 5.970 4.110 1.00 8.98 H new ATOM 0 HD21 ASN B 44 16.776 9.248 5.309 1.00 8.30 H new ATOM 0 HD22 ASN B 44 16.403 8.046 4.069 1.00 8.30 H new ATOM 2380 N ILE B 45 15.485 3.445 3.982 1.00 9.27 N ATOM 2381 CA ILE B 45 15.518 2.148 3.311 1.00 9.41 C ATOM 2382 C ILE B 45 16.934 1.832 2.822 1.00 9.62 C ATOM 2383 O ILE B 45 17.317 0.672 2.680 1.00 9.60 O ATOM 2384 CB ILE B 45 14.519 2.108 2.128 1.00 9.37 C ATOM 2385 CG1 ILE B 45 14.449 0.702 1.523 1.00 9.51 C ATOM 2386 CG2 ILE B 45 14.899 3.134 1.070 1.00 9.43 C ATOM 2387 CD1 ILE B 45 13.287 0.505 0.573 1.00 9.46 C ATOM 0 H ILE B 45 14.874 4.133 3.541 1.00 9.27 H new ATOM 0 HA ILE B 45 15.220 1.388 4.034 1.00 9.41 H new ATOM 0 HB ILE B 45 13.529 2.362 2.508 1.00 9.37 H new ATOM 0 HG12 ILE B 45 15.379 0.498 0.993 1.00 9.51 H new ATOM 0 HG13 ILE B 45 14.375 -0.028 2.329 1.00 9.51 H new ATOM 0 HG21 ILE B 45 14.185 3.090 0.248 1.00 9.43 H new ATOM 0 HG22 ILE B 45 14.886 4.132 1.509 1.00 9.43 H new ATOM 0 HG23 ILE B 45 15.899 2.916 0.695 1.00 9.43 H new ATOM 0 HD11 ILE B 45 13.303 -0.513 0.185 1.00 9.46 H new ATOM 0 HD12 ILE B 45 12.350 0.677 1.103 1.00 9.46 H new ATOM 0 HD13 ILE B 45 13.370 1.210 -0.254 1.00 9.46 H new ATOM 2399 N VAL B 46 17.719 2.883 2.606 1.00 9.93 N ATOM 2400 CA VAL B 46 19.092 2.745 2.140 1.00 10.30 C ATOM 2401 C VAL B 46 19.999 2.192 3.245 1.00 10.43 C ATOM 2402 O VAL B 46 21.039 1.595 2.965 1.00 10.29 O ATOM 2403 CB VAL B 46 19.636 4.101 1.625 1.00 10.71 C ATOM 2404 CG1 VAL B 46 19.809 5.091 2.765 1.00 11.50 C ATOM 2405 CG2 VAL B 46 20.942 3.918 0.868 1.00 11.12 C ATOM 0 H VAL B 46 17.422 3.848 2.748 1.00 9.93 H new ATOM 0 HA VAL B 46 19.092 2.034 1.314 1.00 10.30 H new ATOM 0 HB VAL B 46 18.900 4.509 0.932 1.00 10.71 H new ATOM 0 HG11 VAL B 46 20.192 6.033 2.374 1.00 11.50 H new ATOM 0 HG12 VAL B 46 18.847 5.263 3.247 1.00 11.50 H new ATOM 0 HG13 VAL B 46 20.513 4.688 3.493 1.00 11.50 H new ATOM 0 HG21 VAL B 46 21.299 4.887 0.519 1.00 11.12 H new ATOM 0 HG22 VAL B 46 21.686 3.473 1.529 1.00 11.12 H new ATOM 0 HG23 VAL B 46 20.778 3.262 0.013 1.00 11.12 H new ATOM 2415 N GLU B 47 19.583 2.363 4.499 1.00 10.71 N ATOM 2416 CA GLU B 47 20.362 1.885 5.637 1.00 10.91 C ATOM 2417 C GLU B 47 20.403 0.362 5.653 1.00 11.16 C ATOM 2418 O GLU B 47 21.404 -0.244 6.033 1.00 11.89 O ATOM 2419 CB GLU B 47 19.764 2.391 6.950 1.00 10.79 C ATOM 2420 CG GLU B 47 19.786 3.902 7.103 1.00 10.56 C ATOM 2421 CD GLU B 47 19.404 4.343 8.501 1.00 10.89 C ATOM 2422 OE1 GLU B 47 20.213 4.134 9.431 1.00 11.17 O ATOM 2423 OE2 GLU B 47 18.296 4.894 8.680 1.00 10.95 O ATOM 0 H GLU B 47 18.711 2.829 4.751 1.00 10.71 H new ATOM 0 HA GLU B 47 21.377 2.270 5.536 1.00 10.91 H new ATOM 0 HB2 GLU B 47 18.733 2.045 7.024 1.00 10.79 H new ATOM 0 HB3 GLU B 47 20.311 1.945 7.781 1.00 10.79 H new ATOM 0 HG2 GLU B 47 20.783 4.275 6.866 1.00 10.56 H new ATOM 0 HG3 GLU B 47 19.100 4.348 6.383 1.00 10.56 H new ATOM 2430 N PHE B 48 19.308 -0.247 5.225 1.00 10.58 N ATOM 2431 CA PHE B 48 19.203 -1.696 5.194 1.00 10.76 C ATOM 2432 C PHE B 48 19.351 -2.209 3.769 1.00 9.96 C ATOM 2433 O PHE B 48 18.874 -3.288 3.430 1.00 9.35 O ATOM 2434 CB PHE B 48 17.860 -2.136 5.780 1.00 11.00 C ATOM 2435 CG PHE B 48 17.558 -1.515 7.115 1.00 11.61 C ATOM 2436 CD1 PHE B 48 18.185 -1.973 8.260 1.00 12.05 C ATOM 2437 CD2 PHE B 48 16.650 -0.472 7.223 1.00 11.83 C ATOM 2438 CE1 PHE B 48 17.916 -1.405 9.489 1.00 12.71 C ATOM 2439 CE2 PHE B 48 16.377 0.101 8.450 1.00 12.47 C ATOM 2440 CZ PHE B 48 17.010 -0.367 9.585 1.00 13.60 C ATOM 0 H PHE B 48 18.477 0.243 4.893 1.00 10.58 H new ATOM 0 HA PHE B 48 20.006 -2.118 5.797 1.00 10.76 H new ATOM 0 HB2 PHE B 48 17.065 -1.879 5.080 1.00 11.00 H new ATOM 0 HB3 PHE B 48 17.855 -3.221 5.883 1.00 11.00 H new ATOM 0 HD1 PHE B 48 18.894 -2.785 8.191 1.00 12.05 H new ATOM 0 HD2 PHE B 48 16.151 -0.104 6.339 1.00 11.83 H new ATOM 0 HE1 PHE B 48 18.413 -1.772 10.375 1.00 12.71 H new ATOM 0 HE2 PHE B 48 15.670 0.914 8.522 1.00 12.47 H new ATOM 0 HZ PHE B 48 16.797 0.078 10.546 1.00 13.60 H new ATOM 2450 N CYS B 49 20.020 -1.426 2.942 1.00 10.07 N ATOM 2451 CA CYS B 49 20.231 -1.797 1.559 1.00 9.47 C ATOM 2452 C CYS B 49 21.692 -2.154 1.322 1.00 9.93 C ATOM 2453 O CYS B 49 22.586 -1.631 1.991 1.00 10.81 O ATOM 2454 CB CYS B 49 19.807 -0.655 0.633 1.00 9.48 C ATOM 2455 SG CYS B 49 19.868 -1.064 -1.127 1.00 9.00 S ATOM 0 H CYS B 49 20.426 -0.529 3.207 1.00 10.07 H new ATOM 0 HA CYS B 49 19.620 -2.672 1.337 1.00 9.47 H new ATOM 0 HB2 CYS B 49 18.791 -0.353 0.889 1.00 9.48 H new ATOM 0 HB3 CYS B 49 20.451 0.205 0.817 1.00 9.48 H new ATOM 0 HG CYS B 49 18.885 -1.862 -1.421 1.00 9.00 H new ATOM 2461 N HIS B 50 21.916 -3.068 0.392 1.00 9.34 N ATOM 2462 CA HIS B 50 23.256 -3.505 0.032 1.00 9.67 C ATOM 2463 C HIS B 50 24.017 -2.336 -0.585 1.00 9.57 C ATOM 2464 O HIS B 50 23.516 -1.708 -1.506 1.00 9.10 O ATOM 2465 CB HIS B 50 23.148 -4.668 -0.959 1.00 9.86 C ATOM 2466 CG HIS B 50 24.425 -5.411 -1.209 1.00 10.44 C ATOM 2467 ND1 HIS B 50 24.820 -5.799 -2.468 1.00 10.42 N ATOM 2468 CD2 HIS B 50 25.376 -5.867 -0.361 1.00 11.13 C ATOM 2469 CE1 HIS B 50 25.959 -6.460 -2.387 1.00 11.06 C ATOM 2470 NE2 HIS B 50 26.321 -6.515 -1.118 1.00 11.49 N ATOM 0 H HIS B 50 21.174 -3.528 -0.135 1.00 9.34 H new ATOM 0 HA HIS B 50 23.797 -3.843 0.916 1.00 9.67 H new ATOM 0 HB2 HIS B 50 22.403 -5.372 -0.589 1.00 9.86 H new ATOM 0 HB3 HIS B 50 22.778 -4.282 -1.909 1.00 9.86 H new ATOM 0 HD1 HIS B 50 24.311 -5.606 -3.331 1.00 10.42 H new ATOM 0 HD2 HIS B 50 25.389 -5.744 0.712 1.00 11.13 H new ATOM 0 HE1 HIS B 50 26.503 -6.884 -3.218 1.00 11.06 H new ATOM 2479 N PRO B 51 25.215 -2.014 -0.066 1.00 10.07 N ATOM 2480 CA PRO B 51 26.043 -0.904 -0.561 1.00 10.05 C ATOM 2481 C PRO B 51 26.109 -0.816 -2.092 1.00 9.24 C ATOM 2482 O PRO B 51 25.893 0.253 -2.666 1.00 9.13 O ATOM 2483 CB PRO B 51 27.433 -1.186 0.022 1.00 10.76 C ATOM 2484 CG PRO B 51 27.314 -2.447 0.821 1.00 11.35 C ATOM 2485 CD PRO B 51 25.851 -2.676 1.072 1.00 10.77 C ATOM 0 HA PRO B 51 25.623 0.054 -0.256 1.00 10.05 H new ATOM 0 HB2 PRO B 51 28.171 -1.299 -0.772 1.00 10.76 H new ATOM 0 HB3 PRO B 51 27.765 -0.359 0.650 1.00 10.76 H new ATOM 0 HG2 PRO B 51 27.748 -3.288 0.280 1.00 11.35 H new ATOM 0 HG3 PRO B 51 27.857 -2.359 1.762 1.00 11.35 H new ATOM 0 HD2 PRO B 51 25.609 -3.738 1.108 1.00 10.77 H new ATOM 0 HD3 PRO B 51 25.532 -2.244 2.020 1.00 10.77 H new ATOM 2493 N GLU B 52 26.384 -1.938 -2.748 1.00 8.71 N ATOM 2494 CA GLU B 52 26.481 -1.980 -4.208 1.00 7.99 C ATOM 2495 C GLU B 52 25.117 -1.808 -4.882 1.00 7.30 C ATOM 2496 O GLU B 52 25.033 -1.674 -6.102 1.00 7.14 O ATOM 2497 CB GLU B 52 27.109 -3.299 -4.661 1.00 7.73 C ATOM 2498 CG GLU B 52 28.511 -3.528 -4.123 1.00 8.39 C ATOM 2499 CD GLU B 52 28.524 -4.386 -2.878 1.00 8.75 C ATOM 2500 OE1 GLU B 52 28.031 -3.932 -1.828 1.00 8.56 O ATOM 2501 OE2 GLU B 52 29.020 -5.529 -2.944 1.00 9.28 O ATOM 0 H GLU B 52 26.545 -2.836 -2.292 1.00 8.71 H new ATOM 0 HA GLU B 52 27.113 -1.145 -4.510 1.00 7.99 H new ATOM 0 HB2 GLU B 52 26.469 -4.123 -4.344 1.00 7.73 H new ATOM 0 HB3 GLU B 52 27.140 -3.320 -5.750 1.00 7.73 H new ATOM 0 HG2 GLU B 52 29.118 -4.003 -4.893 1.00 8.39 H new ATOM 0 HG3 GLU B 52 28.973 -2.566 -3.901 1.00 8.39 H new ATOM 2508 N ASP B 53 24.053 -1.812 -4.093 1.00 6.93 N ATOM 2509 CA ASP B 53 22.701 -1.668 -4.623 1.00 6.34 C ATOM 2510 C ASP B 53 22.043 -0.402 -4.085 1.00 5.91 C ATOM 2511 O ASP B 53 20.911 -0.074 -4.445 1.00 5.54 O ATOM 2512 CB ASP B 53 21.851 -2.891 -4.251 1.00 6.55 C ATOM 2513 CG ASP B 53 22.346 -4.175 -4.890 1.00 6.92 C ATOM 2514 OD1 ASP B 53 22.001 -4.437 -6.060 1.00 6.70 O ATOM 2515 OD2 ASP B 53 23.076 -4.937 -4.222 1.00 7.52 O ATOM 0 H ASP B 53 24.098 -1.914 -3.079 1.00 6.93 H new ATOM 0 HA ASP B 53 22.768 -1.594 -5.708 1.00 6.34 H new ATOM 0 HB2 ASP B 53 21.849 -3.009 -3.167 1.00 6.55 H new ATOM 0 HB3 ASP B 53 20.819 -2.715 -4.555 1.00 6.55 H new ATOM 2520 N GLN B 54 22.771 0.317 -3.238 1.00 6.02 N ATOM 2521 CA GLN B 54 22.264 1.539 -2.621 1.00 5.71 C ATOM 2522 C GLN B 54 22.016 2.631 -3.656 1.00 5.50 C ATOM 2523 O GLN B 54 20.941 3.236 -3.677 1.00 5.31 O ATOM 2524 CB GLN B 54 23.232 2.032 -1.547 1.00 5.84 C ATOM 2525 CG GLN B 54 23.104 1.288 -0.227 1.00 6.08 C ATOM 2526 CD GLN B 54 24.078 1.787 0.817 1.00 6.24 C ATOM 2527 OE1 GLN B 54 25.195 2.194 0.501 1.00 6.57 O ATOM 2528 NE2 GLN B 54 23.659 1.773 2.070 1.00 6.11 N ATOM 0 H GLN B 54 23.722 0.073 -2.961 1.00 6.02 H new ATOM 0 HA GLN B 54 21.307 1.303 -2.155 1.00 5.71 H new ATOM 0 HB2 GLN B 54 24.253 1.930 -1.915 1.00 5.84 H new ATOM 0 HB3 GLN B 54 23.060 3.094 -1.374 1.00 5.84 H new ATOM 0 HG2 GLN B 54 22.087 1.395 0.149 1.00 6.08 H new ATOM 0 HG3 GLN B 54 23.271 0.224 -0.396 1.00 6.08 H new ATOM 0 HE21 GLN B 54 22.725 1.428 2.292 1.00 6.11 H new ATOM 0 HE22 GLN B 54 24.269 2.108 2.816 1.00 6.11 H new ATOM 2537 N GLN B 55 22.997 2.881 -4.518 1.00 5.71 N ATOM 2538 CA GLN B 55 22.847 3.903 -5.547 1.00 5.60 C ATOM 2539 C GLN B 55 21.748 3.491 -6.516 1.00 4.67 C ATOM 2540 O GLN B 55 21.007 4.331 -7.023 1.00 4.24 O ATOM 2541 CB GLN B 55 24.167 4.138 -6.289 1.00 6.32 C ATOM 2542 CG GLN B 55 24.081 5.210 -7.367 1.00 6.58 C ATOM 2543 CD GLN B 55 23.453 6.501 -6.872 1.00 6.45 C ATOM 2544 OE1 GLN B 55 23.650 6.911 -5.725 1.00 6.54 O ATOM 2545 NE2 GLN B 55 22.677 7.142 -7.734 1.00 6.35 N ATOM 0 H GLN B 55 23.894 2.396 -4.525 1.00 5.71 H new ATOM 0 HA GLN B 55 22.569 4.843 -5.070 1.00 5.60 H new ATOM 0 HB2 GLN B 55 24.934 4.421 -5.568 1.00 6.32 H new ATOM 0 HB3 GLN B 55 24.489 3.202 -6.745 1.00 6.32 H new ATOM 0 HG2 GLN B 55 25.082 5.420 -7.743 1.00 6.58 H new ATOM 0 HG3 GLN B 55 23.499 4.828 -8.206 1.00 6.58 H new ATOM 0 HE21 GLN B 55 22.541 6.768 -8.673 1.00 6.35 H new ATOM 0 HE22 GLN B 55 22.216 8.009 -7.458 1.00 6.35 H new ATOM 2554 N LEU B 56 21.646 2.190 -6.760 1.00 4.60 N ATOM 2555 CA LEU B 56 20.619 1.649 -7.639 1.00 4.04 C ATOM 2556 C LEU B 56 19.235 2.039 -7.119 1.00 4.15 C ATOM 2557 O LEU B 56 18.357 2.436 -7.888 1.00 4.24 O ATOM 2558 CB LEU B 56 20.746 0.127 -7.721 1.00 3.86 C ATOM 2559 CG LEU B 56 19.835 -0.552 -8.745 1.00 3.93 C ATOM 2560 CD1 LEU B 56 20.279 -0.219 -10.161 1.00 3.88 C ATOM 2561 CD2 LEU B 56 19.825 -2.056 -8.527 1.00 4.08 C ATOM 0 H LEU B 56 22.267 1.487 -6.358 1.00 4.60 H new ATOM 0 HA LEU B 56 20.750 2.063 -8.639 1.00 4.04 H new ATOM 0 HB2 LEU B 56 21.780 -0.122 -7.958 1.00 3.86 H new ATOM 0 HB3 LEU B 56 20.535 -0.292 -6.737 1.00 3.86 H new ATOM 0 HG LEU B 56 18.821 -0.176 -8.609 1.00 3.93 H new ATOM 0 HD11 LEU B 56 19.618 -0.711 -10.875 1.00 3.88 H new ATOM 0 HD12 LEU B 56 20.236 0.860 -10.311 1.00 3.88 H new ATOM 0 HD13 LEU B 56 21.301 -0.566 -10.313 1.00 3.88 H new ATOM 0 HD21 LEU B 56 19.173 -2.526 -9.263 1.00 4.08 H new ATOM 0 HD22 LEU B 56 20.837 -2.446 -8.637 1.00 4.08 H new ATOM 0 HD23 LEU B 56 19.459 -2.276 -7.524 1.00 4.08 H new ATOM 2573 N LEU B 57 19.056 1.933 -5.806 1.00 4.29 N ATOM 2574 CA LEU B 57 17.797 2.290 -5.170 1.00 4.67 C ATOM 2575 C LEU B 57 17.583 3.799 -5.232 1.00 4.68 C ATOM 2576 O LEU B 57 16.520 4.269 -5.636 1.00 4.66 O ATOM 2577 CB LEU B 57 17.792 1.835 -3.709 1.00 5.46 C ATOM 2578 CG LEU B 57 16.710 0.818 -3.337 1.00 5.72 C ATOM 2579 CD1 LEU B 57 16.621 0.671 -1.828 1.00 6.40 C ATOM 2580 CD2 LEU B 57 15.361 1.224 -3.912 1.00 5.94 C ATOM 0 H LEU B 57 19.772 1.601 -5.161 1.00 4.29 H new ATOM 0 HA LEU B 57 16.989 1.790 -5.704 1.00 4.67 H new ATOM 0 HB2 LEU B 57 18.766 1.403 -3.478 1.00 5.46 H new ATOM 0 HB3 LEU B 57 17.674 2.713 -3.074 1.00 5.46 H new ATOM 0 HG LEU B 57 16.985 -0.145 -3.767 1.00 5.72 H new ATOM 0 HD11 LEU B 57 15.848 -0.055 -1.578 1.00 6.40 H new ATOM 0 HD12 LEU B 57 17.580 0.329 -1.439 1.00 6.40 H new ATOM 0 HD13 LEU B 57 16.372 1.634 -1.383 1.00 6.40 H new ATOM 0 HD21 LEU B 57 14.610 0.485 -3.634 1.00 5.94 H new ATOM 0 HD22 LEU B 57 15.075 2.199 -3.517 1.00 5.94 H new ATOM 0 HD23 LEU B 57 15.430 1.279 -4.998 1.00 5.94 H new ATOM 2592 N ARG B 58 18.612 4.548 -4.843 1.00 4.80 N ATOM 2593 CA ARG B 58 18.551 6.007 -4.840 1.00 4.96 C ATOM 2594 C ARG B 58 18.221 6.550 -6.229 1.00 4.70 C ATOM 2595 O ARG B 58 17.361 7.419 -6.378 1.00 4.35 O ATOM 2596 CB ARG B 58 19.879 6.588 -4.354 1.00 5.25 C ATOM 2597 CG ARG B 58 19.916 8.107 -4.349 1.00 5.73 C ATOM 2598 CD ARG B 58 21.290 8.629 -3.973 1.00 6.55 C ATOM 2599 NE ARG B 58 21.438 10.051 -4.279 1.00 7.05 N ATOM 2600 CZ ARG B 58 22.489 10.568 -4.916 1.00 7.71 C ATOM 2601 NH1 ARG B 58 23.465 9.777 -5.344 1.00 8.02 N ATOM 2602 NH2 ARG B 58 22.556 11.876 -5.137 1.00 8.18 N ATOM 0 H ARG B 58 19.502 4.166 -4.524 1.00 4.80 H new ATOM 0 HA ARG B 58 17.755 6.309 -4.160 1.00 4.96 H new ATOM 0 HB2 ARG B 58 20.077 6.225 -3.345 1.00 5.25 H new ATOM 0 HB3 ARG B 58 20.683 6.216 -4.990 1.00 5.25 H new ATOM 0 HG2 ARG B 58 19.641 8.482 -5.335 1.00 5.73 H new ATOM 0 HG3 ARG B 58 19.176 8.488 -3.645 1.00 5.73 H new ATOM 0 HD2 ARG B 58 21.460 8.468 -2.909 1.00 6.55 H new ATOM 0 HD3 ARG B 58 22.052 8.062 -4.507 1.00 6.55 H new ATOM 0 HE ARG B 58 20.694 10.685 -3.988 1.00 7.05 H new ATOM 0 HH11 ARG B 58 23.412 8.771 -5.186 1.00 8.02 H new ATOM 0 HH12 ARG B 58 24.268 10.175 -5.831 1.00 8.02 H new ATOM 0 HH21 ARG B 58 21.803 12.486 -4.819 1.00 8.18 H new ATOM 0 HH22 ARG B 58 23.361 12.270 -5.624 1.00 8.18 H new ATOM 2616 N ASP B 59 18.901 6.027 -7.239 1.00 5.14 N ATOM 2617 CA ASP B 59 18.677 6.452 -8.615 1.00 5.25 C ATOM 2618 C ASP B 59 17.240 6.173 -9.039 1.00 5.09 C ATOM 2619 O ASP B 59 16.602 7.001 -9.694 1.00 5.01 O ATOM 2620 CB ASP B 59 19.652 5.741 -9.554 1.00 6.03 C ATOM 2621 CG ASP B 59 19.289 5.915 -11.013 1.00 6.00 C ATOM 2622 OD1 ASP B 59 19.459 7.027 -11.550 1.00 6.07 O ATOM 2623 OD2 ASP B 59 18.841 4.934 -11.637 1.00 6.01 O ATOM 0 H ASP B 59 19.614 5.306 -7.132 1.00 5.14 H new ATOM 0 HA ASP B 59 18.850 7.527 -8.674 1.00 5.25 H new ATOM 0 HB2 ASP B 59 20.658 6.125 -9.386 1.00 6.03 H new ATOM 0 HB3 ASP B 59 19.673 4.678 -9.313 1.00 6.03 H new ATOM 2628 N SER B 60 16.728 5.011 -8.645 1.00 5.19 N ATOM 2629 CA SER B 60 15.362 4.627 -8.977 1.00 5.23 C ATOM 2630 C SER B 60 14.364 5.578 -8.318 1.00 5.38 C ATOM 2631 O SER B 60 13.327 5.900 -8.898 1.00 5.59 O ATOM 2632 CB SER B 60 15.095 3.188 -8.539 1.00 5.37 C ATOM 2633 OG SER B 60 16.020 2.300 -9.145 1.00 5.26 O ATOM 0 H SER B 60 17.239 4.320 -8.096 1.00 5.19 H new ATOM 0 HA SER B 60 15.237 4.691 -10.058 1.00 5.23 H new ATOM 0 HB2 SER B 60 15.169 3.113 -7.454 1.00 5.37 H new ATOM 0 HB3 SER B 60 14.078 2.903 -8.810 1.00 5.37 H new ATOM 0 HG SER B 60 16.924 2.500 -8.824 1.00 5.26 H new ATOM 2639 N PHE B 61 14.693 6.035 -7.110 1.00 5.36 N ATOM 2640 CA PHE B 61 13.838 6.969 -6.390 1.00 5.54 C ATOM 2641 C PHE B 61 13.758 8.278 -7.158 1.00 5.60 C ATOM 2642 O PHE B 61 12.694 8.879 -7.278 1.00 5.81 O ATOM 2643 CB PHE B 61 14.362 7.215 -4.972 1.00 5.66 C ATOM 2644 CG PHE B 61 14.102 6.075 -4.030 1.00 6.31 C ATOM 2645 CD1 PHE B 61 12.930 5.340 -4.116 1.00 6.46 C ATOM 2646 CD2 PHE B 61 15.031 5.735 -3.061 1.00 6.89 C ATOM 2647 CE1 PHE B 61 12.689 4.290 -3.253 1.00 7.15 C ATOM 2648 CE2 PHE B 61 14.795 4.685 -2.195 1.00 7.61 C ATOM 2649 CZ PHE B 61 13.622 3.961 -2.291 1.00 7.73 C ATOM 0 H PHE B 61 15.544 5.772 -6.613 1.00 5.36 H new ATOM 0 HA PHE B 61 12.841 6.536 -6.306 1.00 5.54 H new ATOM 0 HB2 PHE B 61 15.435 7.401 -5.017 1.00 5.66 H new ATOM 0 HB3 PHE B 61 13.899 8.118 -4.574 1.00 5.66 H new ATOM 0 HD1 PHE B 61 12.196 5.592 -4.867 1.00 6.46 H new ATOM 0 HD2 PHE B 61 15.950 6.297 -2.981 1.00 6.89 H new ATOM 0 HE1 PHE B 61 11.771 3.726 -3.331 1.00 7.15 H new ATOM 0 HE2 PHE B 61 15.527 4.430 -1.443 1.00 7.61 H new ATOM 0 HZ PHE B 61 13.436 3.140 -1.615 1.00 7.73 H new ATOM 2659 N GLN B 62 14.892 8.706 -7.695 1.00 5.57 N ATOM 2660 CA GLN B 62 14.946 9.931 -8.476 1.00 5.90 C ATOM 2661 C GLN B 62 14.079 9.792 -9.724 1.00 6.02 C ATOM 2662 O GLN B 62 13.387 10.726 -10.124 1.00 5.80 O ATOM 2663 CB GLN B 62 16.389 10.244 -8.875 1.00 6.31 C ATOM 2664 CG GLN B 62 17.268 10.676 -7.712 1.00 6.71 C ATOM 2665 CD GLN B 62 16.921 12.056 -7.186 1.00 6.63 C ATOM 2666 OE1 GLN B 62 16.440 12.924 -8.062 1.00 6.49 O flip ATOM 2667 NE2 GLN B 62 17.092 12.340 -6.000 1.00 6.89 N flip ATOM 0 H GLN B 62 15.786 8.223 -7.604 1.00 5.57 H new ATOM 0 HA GLN B 62 14.566 10.751 -7.867 1.00 5.90 H new ATOM 0 HB2 GLN B 62 16.827 9.361 -9.341 1.00 6.31 H new ATOM 0 HB3 GLN B 62 16.385 11.032 -9.628 1.00 6.31 H new ATOM 0 HG2 GLN B 62 17.173 9.951 -6.904 1.00 6.71 H new ATOM 0 HG3 GLN B 62 18.311 10.666 -8.029 1.00 6.71 H new ATOM 0 HE21 GLN B 62 17.465 11.642 -5.357 1.00 6.89 H new ATOM 0 HE22 GLN B 62 16.860 13.274 -5.661 1.00 6.89 H new ATOM 2676 N GLN B 63 14.112 8.602 -10.320 1.00 6.58 N ATOM 2677 CA GLN B 63 13.341 8.317 -11.525 1.00 6.98 C ATOM 2678 C GLN B 63 11.844 8.327 -11.235 1.00 7.01 C ATOM 2679 O GLN B 63 11.069 8.953 -11.958 1.00 7.34 O ATOM 2680 CB GLN B 63 13.723 6.953 -12.110 1.00 7.70 C ATOM 2681 CG GLN B 63 15.165 6.851 -12.567 1.00 7.92 C ATOM 2682 CD GLN B 63 15.428 5.597 -13.379 1.00 8.79 C ATOM 2683 OE1 GLN B 63 14.568 5.139 -14.135 1.00 9.40 O ATOM 2684 NE2 GLN B 63 16.606 5.021 -13.216 1.00 8.92 N ATOM 0 H GLN B 63 14.669 7.816 -9.984 1.00 6.58 H new ATOM 0 HA GLN B 63 13.573 9.100 -12.247 1.00 6.98 H new ATOM 0 HB2 GLN B 63 13.537 6.184 -11.360 1.00 7.70 H new ATOM 0 HB3 GLN B 63 13.070 6.738 -12.956 1.00 7.70 H new ATOM 0 HG2 GLN B 63 15.416 7.727 -13.165 1.00 7.92 H new ATOM 0 HG3 GLN B 63 15.821 6.861 -11.696 1.00 7.92 H new ATOM 0 HE21 GLN B 63 17.291 5.431 -12.581 1.00 8.92 H new ATOM 0 HE22 GLN B 63 16.831 4.166 -13.725 1.00 8.92 H new ATOM 2693 N VAL B 64 11.444 7.641 -10.168 1.00 6.75 N ATOM 2694 CA VAL B 64 10.035 7.549 -9.803 1.00 6.88 C ATOM 2695 C VAL B 64 9.440 8.922 -9.474 1.00 6.48 C ATOM 2696 O VAL B 64 8.252 9.159 -9.709 1.00 6.34 O ATOM 2697 CB VAL B 64 9.807 6.558 -8.635 1.00 7.00 C ATOM 2698 CG1 VAL B 64 10.176 7.164 -7.292 1.00 6.47 C ATOM 2699 CG2 VAL B 64 8.368 6.072 -8.631 1.00 7.57 C ATOM 0 H VAL B 64 12.076 7.141 -9.542 1.00 6.75 H new ATOM 0 HA VAL B 64 9.512 7.161 -10.677 1.00 6.88 H new ATOM 0 HB VAL B 64 10.468 5.706 -8.792 1.00 7.00 H new ATOM 0 HG11 VAL B 64 10.000 6.433 -6.502 1.00 6.47 H new ATOM 0 HG12 VAL B 64 11.229 7.446 -7.297 1.00 6.47 H new ATOM 0 HG13 VAL B 64 9.564 8.048 -7.111 1.00 6.47 H new ATOM 0 HG21 VAL B 64 8.221 5.376 -7.805 1.00 7.57 H new ATOM 0 HG22 VAL B 64 7.697 6.923 -8.512 1.00 7.57 H new ATOM 0 HG23 VAL B 64 8.152 5.568 -9.573 1.00 7.57 H new ATOM 2709 N VAL B 65 10.259 9.828 -8.945 1.00 6.45 N ATOM 2710 CA VAL B 65 9.791 11.173 -8.621 1.00 6.37 C ATOM 2711 C VAL B 65 9.488 11.933 -9.912 1.00 6.93 C ATOM 2712 O VAL B 65 8.516 12.689 -9.994 1.00 7.43 O ATOM 2713 CB VAL B 65 10.826 11.956 -7.780 1.00 6.49 C ATOM 2714 CG1 VAL B 65 10.413 13.413 -7.623 1.00 6.77 C ATOM 2715 CG2 VAL B 65 11.002 11.312 -6.413 1.00 6.40 C ATOM 0 H VAL B 65 11.242 9.657 -8.733 1.00 6.45 H new ATOM 0 HA VAL B 65 8.885 11.078 -8.023 1.00 6.37 H new ATOM 0 HB VAL B 65 11.779 11.924 -8.309 1.00 6.49 H new ATOM 0 HG11 VAL B 65 11.158 13.940 -7.028 1.00 6.77 H new ATOM 0 HG12 VAL B 65 10.339 13.878 -8.606 1.00 6.77 H new ATOM 0 HG13 VAL B 65 9.446 13.465 -7.123 1.00 6.77 H new ATOM 0 HG21 VAL B 65 11.734 11.877 -5.836 1.00 6.40 H new ATOM 0 HG22 VAL B 65 10.048 11.310 -5.886 1.00 6.40 H new ATOM 0 HG23 VAL B 65 11.350 10.287 -6.536 1.00 6.40 H new ATOM 2725 N LYS B 66 10.317 11.706 -10.924 1.00 6.93 N ATOM 2726 CA LYS B 66 10.142 12.346 -12.220 1.00 7.52 C ATOM 2727 C LYS B 66 8.932 11.756 -12.939 1.00 7.28 C ATOM 2728 O LYS B 66 8.239 12.451 -13.683 1.00 7.59 O ATOM 2729 CB LYS B 66 11.395 12.167 -13.077 1.00 8.01 C ATOM 2730 CG LYS B 66 12.632 12.840 -12.504 1.00 8.37 C ATOM 2731 CD LYS B 66 13.908 12.198 -13.028 1.00 8.79 C ATOM 2732 CE LYS B 66 14.054 12.386 -14.527 1.00 9.69 C ATOM 2733 NZ LYS B 66 15.157 11.559 -15.080 1.00 10.21 N ATOM 0 H LYS B 66 11.121 11.080 -10.870 1.00 6.93 H new ATOM 0 HA LYS B 66 9.976 13.411 -12.060 1.00 7.52 H new ATOM 0 HB2 LYS B 66 11.594 11.102 -13.195 1.00 8.01 H new ATOM 0 HB3 LYS B 66 11.203 12.567 -14.072 1.00 8.01 H new ATOM 0 HG2 LYS B 66 12.624 13.899 -12.762 1.00 8.37 H new ATOM 0 HG3 LYS B 66 12.611 12.776 -11.416 1.00 8.37 H new ATOM 0 HD2 LYS B 66 14.769 12.633 -12.521 1.00 8.79 H new ATOM 0 HD3 LYS B 66 13.903 11.134 -12.793 1.00 8.79 H new ATOM 0 HE2 LYS B 66 13.118 12.121 -15.020 1.00 9.69 H new ATOM 0 HE3 LYS B 66 14.243 13.437 -14.745 1.00 9.69 H new ATOM 0 HZ1 LYS B 66 15.226 11.714 -16.106 1.00 10.21 H new ATOM 0 HZ2 LYS B 66 16.054 11.829 -14.628 1.00 10.21 H new ATOM 0 HZ3 LYS B 66 14.964 10.554 -14.894 1.00 10.21 H new ATOM 2747 N LEU B 67 8.688 10.471 -12.704 1.00 6.76 N ATOM 2748 CA LEU B 67 7.561 9.777 -13.312 1.00 6.53 C ATOM 2749 C LEU B 67 6.246 10.320 -12.765 1.00 6.28 C ATOM 2750 O LEU B 67 5.375 10.743 -13.528 1.00 6.36 O ATOM 2751 CB LEU B 67 7.652 8.270 -13.046 1.00 6.25 C ATOM 2752 CG LEU B 67 8.876 7.570 -13.641 1.00 6.32 C ATOM 2753 CD1 LEU B 67 8.950 6.125 -13.167 1.00 5.80 C ATOM 2754 CD2 LEU B 67 8.838 7.632 -15.161 1.00 7.20 C ATOM 0 H LEU B 67 9.260 9.887 -12.093 1.00 6.76 H new ATOM 0 HA LEU B 67 7.595 9.947 -14.388 1.00 6.53 H new ATOM 0 HB2 LEU B 67 7.650 8.108 -11.968 1.00 6.25 H new ATOM 0 HB3 LEU B 67 6.755 7.794 -13.441 1.00 6.25 H new ATOM 0 HG LEU B 67 9.770 8.090 -13.297 1.00 6.32 H new ATOM 0 HD11 LEU B 67 9.827 5.644 -13.601 1.00 5.80 H new ATOM 0 HD12 LEU B 67 9.024 6.102 -12.080 1.00 5.80 H new ATOM 0 HD13 LEU B 67 8.052 5.593 -13.481 1.00 5.80 H new ATOM 0 HD21 LEU B 67 9.716 7.130 -15.568 1.00 7.20 H new ATOM 0 HD22 LEU B 67 7.937 7.138 -15.523 1.00 7.20 H new ATOM 0 HD23 LEU B 67 8.835 8.673 -15.483 1.00 7.20 H new ATOM 2766 N LYS B 68 6.131 10.312 -11.432 1.00 6.08 N ATOM 2767 CA LYS B 68 4.939 10.801 -10.730 1.00 6.00 C ATOM 2768 C LYS B 68 3.697 9.975 -11.066 1.00 5.93 C ATOM 2769 O LYS B 68 3.213 9.983 -12.197 1.00 6.24 O ATOM 2770 CB LYS B 68 4.685 12.278 -11.045 1.00 6.26 C ATOM 2771 CG LYS B 68 4.974 13.209 -9.881 1.00 6.39 C ATOM 2772 CD LYS B 68 4.477 14.616 -10.166 1.00 6.79 C ATOM 2773 CE LYS B 68 4.597 15.510 -8.946 1.00 7.05 C ATOM 2774 NZ LYS B 68 3.974 16.837 -9.177 1.00 7.58 N ATOM 0 H LYS B 68 6.862 9.966 -10.810 1.00 6.08 H new ATOM 0 HA LYS B 68 5.135 10.694 -9.663 1.00 6.00 H new ATOM 0 HB2 LYS B 68 5.302 12.570 -11.895 1.00 6.26 H new ATOM 0 HB3 LYS B 68 3.645 12.402 -11.348 1.00 6.26 H new ATOM 0 HG2 LYS B 68 4.495 12.827 -8.979 1.00 6.39 H new ATOM 0 HG3 LYS B 68 6.046 13.232 -9.688 1.00 6.39 H new ATOM 0 HD2 LYS B 68 5.049 15.044 -10.989 1.00 6.79 H new ATOM 0 HD3 LYS B 68 3.436 14.576 -10.488 1.00 6.79 H new ATOM 0 HE2 LYS B 68 4.121 15.028 -8.093 1.00 7.05 H new ATOM 0 HE3 LYS B 68 5.649 15.641 -8.692 1.00 7.05 H new ATOM 0 HZ1 LYS B 68 3.569 17.190 -8.286 1.00 7.58 H new ATOM 0 HZ2 LYS B 68 4.695 17.504 -9.519 1.00 7.58 H new ATOM 0 HZ3 LYS B 68 3.220 16.748 -9.888 1.00 7.58 H new ATOM 2788 N GLY B 69 3.182 9.264 -10.073 1.00 5.57 N ATOM 2789 CA GLY B 69 1.996 8.453 -10.277 1.00 5.53 C ATOM 2790 C GLY B 69 2.304 7.166 -11.003 1.00 5.28 C ATOM 2791 O GLY B 69 1.416 6.532 -11.574 1.00 5.43 O ATOM 0 H GLY B 69 3.564 9.233 -9.128 1.00 5.57 H new ATOM 0 HA2 GLY B 69 1.544 8.225 -9.312 1.00 5.53 H new ATOM 0 HA3 GLY B 69 1.262 9.023 -10.846 1.00 5.53 H new ATOM 2795 N GLN B 70 3.564 6.775 -10.979 1.00 4.96 N ATOM 2796 CA GLN B 70 3.988 5.557 -11.637 1.00 4.76 C ATOM 2797 C GLN B 70 4.727 4.665 -10.651 1.00 4.34 C ATOM 2798 O GLN B 70 5.301 5.151 -9.675 1.00 3.78 O ATOM 2799 CB GLN B 70 4.880 5.884 -12.840 1.00 4.98 C ATOM 2800 CG GLN B 70 5.091 4.708 -13.780 1.00 5.08 C ATOM 2801 CD GLN B 70 3.789 4.018 -14.136 1.00 5.18 C ATOM 2802 OE1 GLN B 70 3.360 3.085 -13.456 1.00 5.27 O ATOM 2803 NE2 GLN B 70 3.148 4.480 -15.193 1.00 5.43 N ATOM 0 H GLN B 70 4.312 7.285 -10.510 1.00 4.96 H new ATOM 0 HA GLN B 70 3.108 5.025 -11.998 1.00 4.76 H new ATOM 0 HB2 GLN B 70 4.436 6.709 -13.397 1.00 4.98 H new ATOM 0 HB3 GLN B 70 5.849 6.229 -12.480 1.00 4.98 H new ATOM 0 HG2 GLN B 70 5.577 5.056 -14.692 1.00 5.08 H new ATOM 0 HG3 GLN B 70 5.765 3.989 -13.314 1.00 5.08 H new ATOM 0 HE21 GLN B 70 3.539 5.255 -15.728 1.00 5.43 H new ATOM 0 HE22 GLN B 70 2.261 4.062 -15.475 1.00 5.43 H new ATOM 2812 N VAL B 71 4.697 3.368 -10.902 1.00 4.77 N ATOM 2813 CA VAL B 71 5.358 2.409 -10.040 1.00 4.57 C ATOM 2814 C VAL B 71 6.562 1.787 -10.753 1.00 4.76 C ATOM 2815 O VAL B 71 6.424 1.124 -11.783 1.00 5.54 O ATOM 2816 CB VAL B 71 4.370 1.317 -9.565 1.00 5.23 C ATOM 2817 CG1 VAL B 71 3.629 0.689 -10.736 1.00 5.54 C ATOM 2818 CG2 VAL B 71 5.085 0.257 -8.748 1.00 5.65 C ATOM 0 H VAL B 71 4.218 2.954 -11.702 1.00 4.77 H new ATOM 0 HA VAL B 71 5.719 2.936 -9.157 1.00 4.57 H new ATOM 0 HB VAL B 71 3.630 1.799 -8.926 1.00 5.23 H new ATOM 0 HG11 VAL B 71 2.944 -0.074 -10.366 1.00 5.54 H new ATOM 0 HG12 VAL B 71 3.065 1.458 -11.264 1.00 5.54 H new ATOM 0 HG13 VAL B 71 4.346 0.232 -11.418 1.00 5.54 H new ATOM 0 HG21 VAL B 71 4.369 -0.499 -8.426 1.00 5.65 H new ATOM 0 HG22 VAL B 71 5.858 -0.212 -9.357 1.00 5.65 H new ATOM 0 HG23 VAL B 71 5.543 0.719 -7.873 1.00 5.65 H new ATOM 2828 N LEU B 72 7.743 2.036 -10.209 1.00 4.15 N ATOM 2829 CA LEU B 72 8.979 1.515 -10.777 1.00 4.35 C ATOM 2830 C LEU B 72 9.540 0.405 -9.895 1.00 4.51 C ATOM 2831 O LEU B 72 9.898 0.637 -8.737 1.00 4.34 O ATOM 2832 CB LEU B 72 10.011 2.638 -10.928 1.00 3.90 C ATOM 2833 CG LEU B 72 11.234 2.286 -11.779 1.00 3.93 C ATOM 2834 CD1 LEU B 72 10.851 2.182 -13.249 1.00 4.31 C ATOM 2835 CD2 LEU B 72 12.332 3.321 -11.585 1.00 4.11 C ATOM 0 H LEU B 72 7.873 2.600 -9.369 1.00 4.15 H new ATOM 0 HA LEU B 72 8.761 1.104 -11.763 1.00 4.35 H new ATOM 0 HB2 LEU B 72 9.519 3.506 -11.368 1.00 3.90 H new ATOM 0 HB3 LEU B 72 10.351 2.934 -9.936 1.00 3.90 H new ATOM 0 HG LEU B 72 11.612 1.317 -11.454 1.00 3.93 H new ATOM 0 HD11 LEU B 72 11.733 1.931 -13.838 1.00 4.31 H new ATOM 0 HD12 LEU B 72 10.098 1.404 -13.375 1.00 4.31 H new ATOM 0 HD13 LEU B 72 10.448 3.136 -13.588 1.00 4.31 H new ATOM 0 HD21 LEU B 72 13.194 3.056 -12.197 1.00 4.11 H new ATOM 0 HD22 LEU B 72 11.964 4.303 -11.883 1.00 4.11 H new ATOM 0 HD23 LEU B 72 12.626 3.347 -10.536 1.00 4.11 H new ATOM 2847 N SER B 73 9.607 -0.797 -10.442 1.00 5.01 N ATOM 2848 CA SER B 73 10.117 -1.943 -9.710 1.00 5.35 C ATOM 2849 C SER B 73 11.619 -2.093 -9.909 1.00 5.09 C ATOM 2850 O SER B 73 12.090 -2.332 -11.022 1.00 5.62 O ATOM 2851 CB SER B 73 9.409 -3.217 -10.163 1.00 6.05 C ATOM 2852 OG SER B 73 8.006 -3.031 -10.205 1.00 6.35 O ATOM 0 H SER B 73 9.313 -1.005 -11.396 1.00 5.01 H new ATOM 0 HA SER B 73 9.922 -1.779 -8.650 1.00 5.35 H new ATOM 0 HB2 SER B 73 9.771 -3.507 -11.150 1.00 6.05 H new ATOM 0 HB3 SER B 73 9.651 -4.033 -9.482 1.00 6.05 H new ATOM 0 HG SER B 73 7.575 -3.860 -10.499 1.00 6.35 H new ATOM 2858 N VAL B 74 12.365 -1.944 -8.831 1.00 4.34 N ATOM 2859 CA VAL B 74 13.810 -2.077 -8.876 1.00 4.11 C ATOM 2860 C VAL B 74 14.250 -3.297 -8.071 1.00 3.81 C ATOM 2861 O VAL B 74 13.867 -3.460 -6.911 1.00 3.69 O ATOM 2862 CB VAL B 74 14.517 -0.798 -8.356 1.00 3.94 C ATOM 2863 CG1 VAL B 74 13.957 -0.369 -7.006 1.00 3.77 C ATOM 2864 CG2 VAL B 74 16.023 -1.001 -8.275 1.00 3.75 C ATOM 0 H VAL B 74 11.991 -1.729 -7.907 1.00 4.34 H new ATOM 0 HA VAL B 74 14.103 -2.213 -9.917 1.00 4.11 H new ATOM 0 HB VAL B 74 14.321 0.001 -9.070 1.00 3.94 H new ATOM 0 HG11 VAL B 74 14.472 0.530 -6.667 1.00 3.77 H new ATOM 0 HG12 VAL B 74 12.891 -0.162 -7.103 1.00 3.77 H new ATOM 0 HG13 VAL B 74 14.106 -1.168 -6.280 1.00 3.77 H new ATOM 0 HG21 VAL B 74 16.494 -0.089 -7.908 1.00 3.75 H new ATOM 0 HG22 VAL B 74 16.243 -1.823 -7.594 1.00 3.75 H new ATOM 0 HG23 VAL B 74 16.412 -1.237 -9.266 1.00 3.75 H new ATOM 2874 N MET B 75 15.027 -4.166 -8.701 1.00 3.91 N ATOM 2875 CA MET B 75 15.511 -5.368 -8.044 1.00 3.74 C ATOM 2876 C MET B 75 16.897 -5.136 -7.458 1.00 3.48 C ATOM 2877 O MET B 75 17.870 -4.926 -8.185 1.00 3.88 O ATOM 2878 CB MET B 75 15.542 -6.543 -9.023 1.00 4.24 C ATOM 2879 CG MET B 75 15.893 -7.871 -8.375 1.00 4.67 C ATOM 2880 SD MET B 75 15.986 -9.219 -9.567 1.00 5.41 S ATOM 2881 CE MET B 75 16.267 -10.612 -8.480 1.00 5.42 C ATOM 0 H MET B 75 15.335 -4.060 -9.667 1.00 3.91 H new ATOM 0 HA MET B 75 14.825 -5.611 -7.232 1.00 3.74 H new ATOM 0 HB2 MET B 75 14.567 -6.630 -9.503 1.00 4.24 H new ATOM 0 HB3 MET B 75 16.266 -6.330 -9.809 1.00 4.24 H new ATOM 0 HG2 MET B 75 16.850 -7.779 -7.861 1.00 4.67 H new ATOM 0 HG3 MET B 75 15.146 -8.111 -7.618 1.00 4.67 H new ATOM 0 HE1 MET B 75 16.259 -11.534 -9.061 1.00 5.42 H new ATOM 0 HE2 MET B 75 17.234 -10.501 -7.989 1.00 5.42 H new ATOM 0 HE3 MET B 75 15.480 -10.650 -7.727 1.00 5.42 H new ATOM 2891 N PHE B 76 16.973 -5.171 -6.143 1.00 3.08 N ATOM 2892 CA PHE B 76 18.225 -4.968 -5.435 1.00 3.15 C ATOM 2893 C PHE B 76 18.329 -5.970 -4.295 1.00 3.14 C ATOM 2894 O PHE B 76 17.476 -6.845 -4.157 1.00 3.00 O ATOM 2895 CB PHE B 76 18.305 -3.537 -4.891 1.00 3.19 C ATOM 2896 CG PHE B 76 17.232 -3.208 -3.892 1.00 3.34 C ATOM 2897 CD1 PHE B 76 15.981 -2.794 -4.315 1.00 3.27 C ATOM 2898 CD2 PHE B 76 17.474 -3.316 -2.533 1.00 3.47 C ATOM 2899 CE1 PHE B 76 14.993 -2.495 -3.401 1.00 3.36 C ATOM 2900 CE2 PHE B 76 16.489 -3.018 -1.614 1.00 3.54 C ATOM 2901 CZ PHE B 76 15.246 -2.607 -2.048 1.00 2.78 C ATOM 0 H PHE B 76 16.172 -5.340 -5.535 1.00 3.08 H new ATOM 0 HA PHE B 76 19.055 -5.119 -6.125 1.00 3.15 H new ATOM 0 HB2 PHE B 76 19.280 -3.389 -4.426 1.00 3.19 H new ATOM 0 HB3 PHE B 76 18.240 -2.837 -5.724 1.00 3.19 H new ATOM 0 HD1 PHE B 76 15.777 -2.704 -5.372 1.00 3.27 H new ATOM 0 HD2 PHE B 76 18.446 -3.637 -2.188 1.00 3.47 H new ATOM 0 HE1 PHE B 76 14.021 -2.173 -3.743 1.00 3.36 H new ATOM 0 HE2 PHE B 76 16.691 -3.106 -0.557 1.00 3.54 H new ATOM 0 HZ PHE B 76 14.472 -2.373 -1.331 1.00 2.78 H new ATOM 2911 N ARG B 77 19.363 -5.846 -3.482 1.00 3.59 N ATOM 2912 CA ARG B 77 19.535 -6.741 -2.352 1.00 3.88 C ATOM 2913 C ARG B 77 19.259 -6.001 -1.052 1.00 4.20 C ATOM 2914 O ARG B 77 19.973 -5.061 -0.692 1.00 4.62 O ATOM 2915 CB ARG B 77 20.934 -7.355 -2.339 1.00 4.60 C ATOM 2916 CG ARG B 77 20.952 -8.792 -2.827 1.00 4.59 C ATOM 2917 CD ARG B 77 22.340 -9.395 -2.745 1.00 5.39 C ATOM 2918 NE ARG B 77 23.199 -8.952 -3.839 1.00 5.55 N ATOM 2919 CZ ARG B 77 24.280 -9.612 -4.240 1.00 6.25 C ATOM 2920 NH1 ARG B 77 24.620 -10.758 -3.661 1.00 6.80 N ATOM 2921 NH2 ARG B 77 25.010 -9.137 -5.237 1.00 6.51 N ATOM 0 H ARG B 77 20.092 -5.139 -3.582 1.00 3.59 H new ATOM 0 HA ARG B 77 18.819 -7.557 -2.451 1.00 3.88 H new ATOM 0 HB2 ARG B 77 21.594 -6.755 -2.965 1.00 4.60 H new ATOM 0 HB3 ARG B 77 21.333 -7.316 -1.326 1.00 4.60 H new ATOM 0 HG2 ARG B 77 20.261 -9.387 -2.231 1.00 4.59 H new ATOM 0 HG3 ARG B 77 20.599 -8.831 -3.857 1.00 4.59 H new ATOM 0 HD2 ARG B 77 22.797 -9.123 -1.794 1.00 5.39 H new ATOM 0 HD3 ARG B 77 22.264 -10.482 -2.763 1.00 5.39 H new ATOM 0 HE ARG B 77 22.956 -8.087 -4.323 1.00 5.55 H new ATOM 0 HH11 ARG B 77 24.050 -11.136 -2.904 1.00 6.80 H new ATOM 0 HH12 ARG B 77 25.451 -11.260 -3.973 1.00 6.80 H new ATOM 0 HH21 ARG B 77 24.742 -8.266 -5.695 1.00 6.51 H new ATOM 0 HH22 ARG B 77 25.840 -9.642 -5.547 1.00 6.51 H new ATOM 2935 N PHE B 78 18.214 -6.424 -0.364 1.00 4.21 N ATOM 2936 CA PHE B 78 17.813 -5.809 0.892 1.00 4.81 C ATOM 2937 C PHE B 78 18.293 -6.649 2.068 1.00 5.56 C ATOM 2938 O PHE B 78 18.398 -7.873 1.963 1.00 5.79 O ATOM 2939 CB PHE B 78 16.289 -5.654 0.936 1.00 4.67 C ATOM 2940 CG PHE B 78 15.800 -4.695 1.984 1.00 4.78 C ATOM 2941 CD1 PHE B 78 15.995 -3.331 1.840 1.00 5.01 C ATOM 2942 CD2 PHE B 78 15.143 -5.157 3.114 1.00 4.79 C ATOM 2943 CE1 PHE B 78 15.547 -2.446 2.801 1.00 5.19 C ATOM 2944 CE2 PHE B 78 14.691 -4.277 4.078 1.00 5.05 C ATOM 2945 CZ PHE B 78 14.893 -2.920 3.922 1.00 5.22 C ATOM 0 H PHE B 78 17.620 -7.200 -0.657 1.00 4.21 H new ATOM 0 HA PHE B 78 18.269 -4.822 0.963 1.00 4.81 H new ATOM 0 HB2 PHE B 78 15.940 -5.317 -0.040 1.00 4.67 H new ATOM 0 HB3 PHE B 78 15.840 -6.631 1.115 1.00 4.67 H new ATOM 0 HD1 PHE B 78 16.504 -2.955 0.965 1.00 5.01 H new ATOM 0 HD2 PHE B 78 14.983 -6.217 3.242 1.00 4.79 H new ATOM 0 HE1 PHE B 78 15.708 -1.385 2.676 1.00 5.19 H new ATOM 0 HE2 PHE B 78 14.180 -4.650 4.953 1.00 5.05 H new ATOM 0 HZ PHE B 78 14.540 -2.230 4.675 1.00 5.22 H new ATOM 2955 N ARG B 79 18.593 -5.987 3.173 1.00 6.05 N ATOM 2956 CA ARG B 79 19.068 -6.665 4.369 1.00 6.84 C ATOM 2957 C ARG B 79 17.900 -7.152 5.211 1.00 6.93 C ATOM 2958 O ARG B 79 16.940 -6.419 5.440 1.00 7.29 O ATOM 2959 CB ARG B 79 19.943 -5.724 5.204 1.00 7.82 C ATOM 2960 CG ARG B 79 20.827 -6.439 6.212 1.00 8.65 C ATOM 2961 CD ARG B 79 21.614 -5.451 7.059 1.00 9.63 C ATOM 2962 NE ARG B 79 20.940 -5.148 8.323 1.00 10.06 N ATOM 2963 CZ ARG B 79 21.222 -4.088 9.087 1.00 10.62 C ATOM 2964 NH1 ARG B 79 22.096 -3.175 8.679 1.00 10.80 N ATOM 2965 NH2 ARG B 79 20.604 -3.933 10.251 1.00 11.08 N ATOM 0 H ARG B 79 18.516 -4.974 3.267 1.00 6.05 H new ATOM 0 HA ARG B 79 19.661 -7.525 4.056 1.00 6.84 H new ATOM 0 HB2 ARG B 79 20.573 -5.139 4.534 1.00 7.82 H new ATOM 0 HB3 ARG B 79 19.301 -5.020 5.733 1.00 7.82 H new ATOM 0 HG2 ARG B 79 20.212 -7.065 6.858 1.00 8.65 H new ATOM 0 HG3 ARG B 79 21.516 -7.102 5.688 1.00 8.65 H new ATOM 0 HD2 ARG B 79 22.603 -5.859 7.265 1.00 9.63 H new ATOM 0 HD3 ARG B 79 21.760 -4.529 6.497 1.00 9.63 H new ATOM 0 HE ARG B 79 20.210 -5.786 8.640 1.00 10.06 H new ATOM 0 HH11 ARG B 79 22.558 -3.279 7.776 1.00 10.80 H new ATOM 0 HH12 ARG B 79 22.305 -2.369 9.269 1.00 10.80 H new ATOM 0 HH21 ARG B 79 19.917 -4.621 10.559 1.00 11.08 H new ATOM 0 HH22 ARG B 79 20.816 -3.126 10.837 1.00 11.08 H new ATOM 2979 N SER B 80 17.978 -8.392 5.654 1.00 6.76 N ATOM 2980 CA SER B 80 16.939 -8.965 6.487 1.00 7.04 C ATOM 2981 C SER B 80 17.299 -8.772 7.955 1.00 7.47 C ATOM 2982 O SER B 80 18.353 -8.214 8.275 1.00 7.38 O ATOM 2983 CB SER B 80 16.784 -10.457 6.184 1.00 6.83 C ATOM 2984 OG SER B 80 17.960 -11.163 6.540 1.00 7.21 O ATOM 0 H SER B 80 18.753 -9.023 5.450 1.00 6.76 H new ATOM 0 HA SER B 80 15.995 -8.463 6.275 1.00 7.04 H new ATOM 0 HB2 SER B 80 15.932 -10.858 6.733 1.00 6.83 H new ATOM 0 HB3 SER B 80 16.575 -10.599 5.124 1.00 6.83 H new ATOM 0 HG SER B 80 17.825 -12.122 6.388 1.00 7.21 H new ATOM 2990 N LYS B 81 16.433 -9.238 8.845 1.00 8.04 N ATOM 2991 CA LYS B 81 16.681 -9.145 10.276 1.00 8.55 C ATOM 2992 C LYS B 81 17.851 -10.054 10.652 1.00 8.41 C ATOM 2993 O LYS B 81 18.436 -9.941 11.731 1.00 8.72 O ATOM 2994 CB LYS B 81 15.423 -9.536 11.059 1.00 9.27 C ATOM 2995 CG LYS B 81 15.535 -9.314 12.560 1.00 10.06 C ATOM 2996 CD LYS B 81 15.958 -7.890 12.881 1.00 10.72 C ATOM 2997 CE LYS B 81 16.186 -7.695 14.369 1.00 11.62 C ATOM 2998 NZ LYS B 81 16.786 -6.370 14.663 1.00 12.24 N ATOM 0 H LYS B 81 15.550 -9.685 8.599 1.00 8.04 H new ATOM 0 HA LYS B 81 16.935 -8.116 10.531 1.00 8.55 H new ATOM 0 HB2 LYS B 81 14.578 -8.962 10.679 1.00 9.27 H new ATOM 0 HB3 LYS B 81 15.204 -10.587 10.873 1.00 9.27 H new ATOM 0 HG2 LYS B 81 14.576 -9.525 13.033 1.00 10.06 H new ATOM 0 HG3 LYS B 81 16.258 -10.013 12.980 1.00 10.06 H new ATOM 0 HD2 LYS B 81 16.872 -7.651 12.338 1.00 10.72 H new ATOM 0 HD3 LYS B 81 15.192 -7.196 12.536 1.00 10.72 H new ATOM 0 HE2 LYS B 81 15.238 -7.791 14.898 1.00 11.62 H new ATOM 0 HE3 LYS B 81 16.841 -8.482 14.743 1.00 11.62 H new ATOM 0 HZ1 LYS B 81 17.278 -6.407 15.579 1.00 12.24 H new ATOM 0 HZ2 LYS B 81 17.465 -6.123 13.915 1.00 12.24 H new ATOM 0 HZ3 LYS B 81 16.036 -5.650 14.701 1.00 12.24 H new ATOM 3012 N ASN B 82 18.193 -10.944 9.729 1.00 8.00 N ATOM 3013 CA ASN B 82 19.289 -11.883 9.917 1.00 7.89 C ATOM 3014 C ASN B 82 20.589 -11.258 9.430 1.00 7.36 C ATOM 3015 O ASN B 82 21.642 -11.900 9.434 1.00 7.24 O ATOM 3016 CB ASN B 82 19.020 -13.177 9.144 1.00 7.92 C ATOM 3017 CG ASN B 82 17.630 -13.735 9.390 1.00 8.51 C ATOM 3018 OD1 ASN B 82 17.144 -13.763 10.522 1.00 9.25 O ATOM 3019 ND2 ASN B 82 16.975 -14.168 8.327 1.00 8.28 N ATOM 0 H ASN B 82 17.719 -11.034 8.831 1.00 8.00 H new ATOM 0 HA ASN B 82 19.372 -12.117 10.978 1.00 7.89 H new ATOM 0 HB2 ASN B 82 19.147 -12.990 8.078 1.00 7.92 H new ATOM 0 HB3 ASN B 82 19.761 -13.924 9.428 1.00 7.92 H new ATOM 0 HD21 ASN B 82 16.032 -14.543 8.427 1.00 8.28 H new ATOM 0 HD22 ASN B 82 17.413 -14.128 7.407 1.00 8.28 H new ATOM 3026 N GLN B 83 20.489 -10.002 8.993 1.00 7.14 N ATOM 3027 CA GLN B 83 21.628 -9.235 8.493 1.00 6.77 C ATOM 3028 C GLN B 83 22.170 -9.821 7.194 1.00 6.51 C ATOM 3029 O GLN B 83 23.336 -9.630 6.851 1.00 6.48 O ATOM 3030 CB GLN B 83 22.735 -9.142 9.550 1.00 7.42 C ATOM 3031 CG GLN B 83 22.621 -7.925 10.460 1.00 7.60 C ATOM 3032 CD GLN B 83 21.283 -7.829 11.168 1.00 7.62 C ATOM 3033 OE1 GLN B 83 20.374 -7.128 10.722 1.00 7.12 O ATOM 3034 NE2 GLN B 83 21.145 -8.550 12.270 1.00 8.30 N ATOM 0 H GLN B 83 19.609 -9.486 8.976 1.00 7.14 H new ATOM 0 HA GLN B 83 21.274 -8.226 8.280 1.00 6.77 H new ATOM 0 HB2 GLN B 83 22.716 -10.044 10.162 1.00 7.42 H new ATOM 0 HB3 GLN B 83 23.702 -9.118 9.048 1.00 7.42 H new ATOM 0 HG2 GLN B 83 23.416 -7.961 11.204 1.00 7.60 H new ATOM 0 HG3 GLN B 83 22.777 -7.022 9.869 1.00 7.60 H new ATOM 0 HE21 GLN B 83 21.921 -9.118 12.608 1.00 8.30 H new ATOM 0 HE22 GLN B 83 20.262 -8.537 12.781 1.00 8.30 H new ATOM 3043 N GLU B 84 21.312 -10.524 6.465 1.00 6.48 N ATOM 3044 CA GLU B 84 21.700 -11.119 5.197 1.00 6.41 C ATOM 3045 C GLU B 84 21.118 -10.293 4.056 1.00 6.26 C ATOM 3046 O GLU B 84 20.249 -9.451 4.281 1.00 6.30 O ATOM 3047 CB GLU B 84 21.221 -12.571 5.113 1.00 6.62 C ATOM 3048 CG GLU B 84 19.808 -12.731 4.575 1.00 6.46 C ATOM 3049 CD GLU B 84 19.102 -13.940 5.143 1.00 6.60 C ATOM 3050 OE1 GLU B 84 19.476 -15.076 4.785 1.00 6.74 O ATOM 3051 OE2 GLU B 84 18.164 -13.764 5.944 1.00 6.78 O ATOM 0 H GLU B 84 20.343 -10.695 6.732 1.00 6.48 H new ATOM 0 HA GLU B 84 22.787 -11.123 5.119 1.00 6.41 H new ATOM 0 HB2 GLU B 84 21.906 -13.131 4.476 1.00 6.62 H new ATOM 0 HB3 GLU B 84 21.272 -13.017 6.106 1.00 6.62 H new ATOM 0 HG2 GLU B 84 19.231 -11.836 4.808 1.00 6.46 H new ATOM 0 HG3 GLU B 84 19.844 -12.813 3.489 1.00 6.46 H new ATOM 3058 N TRP B 85 21.583 -10.535 2.841 1.00 6.19 N ATOM 3059 CA TRP B 85 21.098 -9.795 1.688 1.00 6.19 C ATOM 3060 C TRP B 85 20.239 -10.685 0.800 1.00 6.20 C ATOM 3061 O TRP B 85 20.701 -11.706 0.286 1.00 6.38 O ATOM 3062 CB TRP B 85 22.272 -9.227 0.885 1.00 6.55 C ATOM 3063 CG TRP B 85 23.278 -8.512 1.730 1.00 6.95 C ATOM 3064 CD1 TRP B 85 24.497 -8.981 2.115 1.00 7.63 C ATOM 3065 CD2 TRP B 85 23.153 -7.205 2.300 1.00 6.78 C ATOM 3066 NE1 TRP B 85 25.139 -8.050 2.891 1.00 7.89 N ATOM 3067 CE2 TRP B 85 24.337 -6.950 3.018 1.00 7.40 C ATOM 3068 CE3 TRP B 85 22.159 -6.227 2.273 1.00 6.23 C ATOM 3069 CZ2 TRP B 85 24.551 -5.757 3.702 1.00 7.53 C ATOM 3070 CZ3 TRP B 85 22.374 -5.043 2.952 1.00 6.39 C ATOM 3071 CH2 TRP B 85 23.560 -4.817 3.657 1.00 7.05 C ATOM 0 H TRP B 85 22.293 -11.236 2.628 1.00 6.19 H new ATOM 0 HA TRP B 85 20.485 -8.968 2.047 1.00 6.19 H new ATOM 0 HB2 TRP B 85 22.767 -10.040 0.354 1.00 6.55 H new ATOM 0 HB3 TRP B 85 21.888 -8.540 0.130 1.00 6.55 H new ATOM 0 HD1 TRP B 85 24.900 -9.947 1.848 1.00 7.63 H new ATOM 0 HE1 TRP B 85 26.064 -8.160 3.306 1.00 7.89 H new ATOM 0 HE3 TRP B 85 21.239 -6.392 1.732 1.00 6.23 H new ATOM 0 HZ2 TRP B 85 25.466 -5.581 4.248 1.00 7.53 H new ATOM 0 HZ3 TRP B 85 21.612 -4.278 2.938 1.00 6.39 H new ATOM 0 HH2 TRP B 85 23.696 -3.880 4.177 1.00 7.05 H new ATOM 3082 N LEU B 86 18.983 -10.304 0.639 1.00 6.05 N ATOM 3083 CA LEU B 86 18.057 -11.053 -0.193 1.00 6.08 C ATOM 3084 C LEU B 86 17.617 -10.204 -1.375 1.00 5.83 C ATOM 3085 O LEU B 86 17.569 -8.977 -1.279 1.00 5.96 O ATOM 3086 CB LEU B 86 16.844 -11.499 0.628 1.00 6.32 C ATOM 3087 CG LEU B 86 16.168 -10.403 1.457 1.00 6.76 C ATOM 3088 CD1 LEU B 86 15.004 -9.788 0.697 1.00 6.60 C ATOM 3089 CD2 LEU B 86 15.697 -10.966 2.787 1.00 6.97 C ATOM 0 H LEU B 86 18.580 -9.476 1.076 1.00 6.05 H new ATOM 0 HA LEU B 86 18.562 -11.943 -0.570 1.00 6.08 H new ATOM 0 HB2 LEU B 86 16.105 -11.925 -0.051 1.00 6.32 H new ATOM 0 HB3 LEU B 86 17.157 -12.298 1.300 1.00 6.32 H new ATOM 0 HG LEU B 86 16.899 -9.617 1.648 1.00 6.76 H new ATOM 0 HD11 LEU B 86 14.540 -9.012 1.307 1.00 6.60 H new ATOM 0 HD12 LEU B 86 15.367 -9.350 -0.233 1.00 6.60 H new ATOM 0 HD13 LEU B 86 14.268 -10.560 0.471 1.00 6.60 H new ATOM 0 HD21 LEU B 86 15.218 -10.177 3.367 1.00 6.97 H new ATOM 0 HD22 LEU B 86 14.983 -11.770 2.609 1.00 6.97 H new ATOM 0 HD23 LEU B 86 16.552 -11.355 3.340 1.00 6.97 H new ATOM 3101 N TRP B 87 17.305 -10.850 -2.484 1.00 5.64 N ATOM 3102 CA TRP B 87 16.870 -10.134 -3.671 1.00 5.53 C ATOM 3103 C TRP B 87 15.459 -9.604 -3.467 1.00 4.89 C ATOM 3104 O TRP B 87 14.536 -10.369 -3.189 1.00 4.93 O ATOM 3105 CB TRP B 87 16.934 -11.042 -4.899 1.00 6.09 C ATOM 3106 CG TRP B 87 18.332 -11.408 -5.287 1.00 6.88 C ATOM 3107 CD1 TRP B 87 18.926 -12.627 -5.148 1.00 7.60 C ATOM 3108 CD2 TRP B 87 19.316 -10.544 -5.871 1.00 7.12 C ATOM 3109 NE1 TRP B 87 20.217 -12.578 -5.611 1.00 8.31 N ATOM 3110 CE2 TRP B 87 20.483 -11.310 -6.059 1.00 8.03 C ATOM 3111 CE3 TRP B 87 19.326 -9.197 -6.251 1.00 6.72 C ATOM 3112 CZ2 TRP B 87 21.644 -10.777 -6.613 1.00 8.55 C ATOM 3113 CZ3 TRP B 87 20.479 -8.669 -6.801 1.00 7.21 C ATOM 3114 CH2 TRP B 87 21.624 -9.457 -6.978 1.00 8.12 C ATOM 0 H TRP B 87 17.344 -11.864 -2.588 1.00 5.64 H new ATOM 0 HA TRP B 87 17.540 -9.291 -3.840 1.00 5.53 H new ATOM 0 HB2 TRP B 87 16.369 -11.952 -4.700 1.00 6.09 H new ATOM 0 HB3 TRP B 87 16.449 -10.543 -5.738 1.00 6.09 H new ATOM 0 HD1 TRP B 87 18.450 -13.504 -4.734 1.00 7.60 H new ATOM 0 HE1 TRP B 87 20.873 -13.359 -5.620 1.00 8.31 H new ATOM 0 HE3 TRP B 87 18.449 -8.581 -6.117 1.00 6.72 H new ATOM 0 HZ2 TRP B 87 22.528 -11.382 -6.750 1.00 8.55 H new ATOM 0 HZ3 TRP B 87 20.498 -7.631 -7.099 1.00 7.21 H new ATOM 0 HH2 TRP B 87 22.509 -9.014 -7.411 1.00 8.12 H new ATOM 3125 N MET B 88 15.304 -8.296 -3.592 1.00 4.38 N ATOM 3126 CA MET B 88 14.014 -7.657 -3.403 1.00 3.86 C ATOM 3127 C MET B 88 13.671 -6.762 -4.586 1.00 4.20 C ATOM 3128 O MET B 88 14.462 -5.905 -4.980 1.00 4.46 O ATOM 3129 CB MET B 88 14.023 -6.827 -2.115 1.00 3.90 C ATOM 3130 CG MET B 88 12.688 -6.169 -1.800 1.00 3.23 C ATOM 3131 SD MET B 88 11.694 -7.131 -0.643 1.00 2.82 S ATOM 3132 CE MET B 88 12.594 -6.859 0.879 1.00 3.18 C ATOM 0 H MET B 88 16.061 -7.654 -3.825 1.00 4.38 H new ATOM 0 HA MET B 88 13.257 -8.437 -3.328 1.00 3.86 H new ATOM 0 HB2 MET B 88 14.306 -7.470 -1.282 1.00 3.90 H new ATOM 0 HB3 MET B 88 14.788 -6.055 -2.197 1.00 3.90 H new ATOM 0 HG2 MET B 88 12.866 -5.178 -1.383 1.00 3.23 H new ATOM 0 HG3 MET B 88 12.129 -6.030 -2.725 1.00 3.23 H new ATOM 0 HE1 MET B 88 12.646 -7.791 1.442 1.00 3.18 H new ATOM 0 HE2 MET B 88 13.603 -6.517 0.649 1.00 3.18 H new ATOM 0 HE3 MET B 88 12.082 -6.103 1.474 1.00 3.18 H new ATOM 3142 N ARG B 89 12.500 -6.985 -5.156 1.00 4.41 N ATOM 3143 CA ARG B 89 12.021 -6.189 -6.271 1.00 5.04 C ATOM 3144 C ARG B 89 11.035 -5.163 -5.736 1.00 5.07 C ATOM 3145 O ARG B 89 9.828 -5.413 -5.673 1.00 5.15 O ATOM 3146 CB ARG B 89 11.350 -7.070 -7.328 1.00 5.18 C ATOM 3147 CG ARG B 89 10.887 -6.304 -8.554 1.00 5.63 C ATOM 3148 CD ARG B 89 9.649 -6.937 -9.169 1.00 5.93 C ATOM 3149 NE ARG B 89 8.514 -6.928 -8.243 1.00 5.96 N ATOM 3150 CZ ARG B 89 7.390 -7.618 -8.436 1.00 6.42 C ATOM 3151 NH1 ARG B 89 7.244 -8.369 -9.524 1.00 6.87 N ATOM 3152 NH2 ARG B 89 6.416 -7.560 -7.537 1.00 6.59 N ATOM 0 H ARG B 89 11.857 -7.720 -4.860 1.00 4.41 H new ATOM 0 HA ARG B 89 12.863 -5.689 -6.749 1.00 5.04 H new ATOM 0 HB2 ARG B 89 12.049 -7.847 -7.638 1.00 5.18 H new ATOM 0 HB3 ARG B 89 10.493 -7.573 -6.879 1.00 5.18 H new ATOM 0 HG2 ARG B 89 10.671 -5.271 -8.280 1.00 5.63 H new ATOM 0 HG3 ARG B 89 11.689 -6.277 -9.292 1.00 5.63 H new ATOM 0 HD2 ARG B 89 9.380 -6.400 -10.078 1.00 5.93 H new ATOM 0 HD3 ARG B 89 9.872 -7.964 -9.460 1.00 5.93 H new ATOM 0 HE ARG B 89 8.588 -6.359 -7.399 1.00 5.96 H new ATOM 0 HH11 ARG B 89 7.994 -8.418 -10.214 1.00 6.87 H new ATOM 0 HH12 ARG B 89 6.382 -8.896 -9.668 1.00 6.87 H new ATOM 0 HH21 ARG B 89 6.528 -6.988 -6.700 1.00 6.59 H new ATOM 0 HH22 ARG B 89 5.555 -8.087 -7.683 1.00 6.59 H new ATOM 3166 N THR B 90 11.560 -4.029 -5.323 1.00 5.17 N ATOM 3167 CA THR B 90 10.750 -2.972 -4.755 1.00 5.29 C ATOM 3168 C THR B 90 10.060 -2.133 -5.825 1.00 5.66 C ATOM 3169 O THR B 90 10.709 -1.428 -6.599 1.00 6.18 O ATOM 3170 CB THR B 90 11.607 -2.064 -3.854 1.00 5.07 C ATOM 3171 OG1 THR B 90 12.016 -2.795 -2.692 1.00 5.02 O ATOM 3172 CG2 THR B 90 10.845 -0.819 -3.431 1.00 4.69 C ATOM 0 H THR B 90 12.556 -3.814 -5.371 1.00 5.17 H new ATOM 0 HA THR B 90 9.973 -3.452 -4.159 1.00 5.29 H new ATOM 0 HB THR B 90 12.480 -1.747 -4.424 1.00 5.07 H new ATOM 0 HG1 THR B 90 12.993 -2.773 -2.619 1.00 5.02 H new ATOM 0 HG21 THR B 90 11.481 -0.202 -2.796 1.00 4.69 H new ATOM 0 HG22 THR B 90 10.555 -0.252 -4.315 1.00 4.69 H new ATOM 0 HG23 THR B 90 9.952 -1.109 -2.877 1.00 4.69 H new ATOM 3180 N SER B 91 8.742 -2.235 -5.869 1.00 5.49 N ATOM 3181 CA SER B 91 7.947 -1.466 -6.804 1.00 5.86 C ATOM 3182 C SER B 91 7.583 -0.125 -6.169 1.00 5.46 C ATOM 3183 O SER B 91 6.573 -0.009 -5.475 1.00 4.98 O ATOM 3184 CB SER B 91 6.687 -2.248 -7.181 1.00 6.04 C ATOM 3185 OG SER B 91 7.018 -3.511 -7.733 1.00 6.30 O ATOM 0 H SER B 91 8.199 -2.849 -5.262 1.00 5.49 H new ATOM 0 HA SER B 91 8.519 -1.283 -7.713 1.00 5.86 H new ATOM 0 HB2 SER B 91 6.063 -2.386 -6.298 1.00 6.04 H new ATOM 0 HB3 SER B 91 6.101 -1.675 -7.900 1.00 6.04 H new ATOM 0 HG SER B 91 7.244 -3.405 -8.681 1.00 6.30 H new ATOM 3191 N SER B 92 8.427 0.873 -6.384 1.00 5.80 N ATOM 3192 CA SER B 92 8.220 2.197 -5.813 1.00 5.57 C ATOM 3193 C SER B 92 7.181 2.989 -6.600 1.00 5.56 C ATOM 3194 O SER B 92 7.331 3.194 -7.801 1.00 5.52 O ATOM 3195 CB SER B 92 9.547 2.956 -5.783 1.00 6.27 C ATOM 3196 OG SER B 92 10.560 2.181 -5.159 1.00 6.65 O ATOM 0 H SER B 92 9.269 0.790 -6.954 1.00 5.80 H new ATOM 0 HA SER B 92 7.844 2.075 -4.797 1.00 5.57 H new ATOM 0 HB2 SER B 92 9.850 3.207 -6.799 1.00 6.27 H new ATOM 0 HB3 SER B 92 9.421 3.896 -5.247 1.00 6.27 H new ATOM 0 HG SER B 92 10.367 2.101 -4.201 1.00 6.65 H new ATOM 3202 N PHE B 93 6.129 3.418 -5.917 1.00 5.71 N ATOM 3203 CA PHE B 93 5.066 4.195 -6.540 1.00 5.89 C ATOM 3204 C PHE B 93 4.966 5.578 -5.899 1.00 6.45 C ATOM 3205 O PHE B 93 4.760 5.699 -4.690 1.00 6.45 O ATOM 3206 CB PHE B 93 3.731 3.452 -6.408 1.00 5.69 C ATOM 3207 CG PHE B 93 2.553 4.193 -6.983 1.00 5.63 C ATOM 3208 CD1 PHE B 93 1.817 5.069 -6.202 1.00 5.63 C ATOM 3209 CD2 PHE B 93 2.186 4.014 -8.305 1.00 5.74 C ATOM 3210 CE1 PHE B 93 0.737 5.751 -6.729 1.00 5.68 C ATOM 3211 CE2 PHE B 93 1.106 4.691 -8.837 1.00 5.78 C ATOM 3212 CZ PHE B 93 0.380 5.562 -8.047 1.00 5.73 C ATOM 0 H PHE B 93 5.988 3.239 -4.923 1.00 5.71 H new ATOM 0 HA PHE B 93 5.300 4.322 -7.597 1.00 5.89 H new ATOM 0 HB2 PHE B 93 3.815 2.485 -6.904 1.00 5.69 H new ATOM 0 HB3 PHE B 93 3.541 3.253 -5.353 1.00 5.69 H new ATOM 0 HD1 PHE B 93 2.091 5.221 -5.168 1.00 5.63 H new ATOM 0 HD2 PHE B 93 2.751 3.337 -8.928 1.00 5.74 H new ATOM 0 HE1 PHE B 93 0.173 6.432 -6.109 1.00 5.68 H new ATOM 0 HE2 PHE B 93 0.829 4.540 -9.870 1.00 5.78 H new ATOM 0 HZ PHE B 93 -0.464 6.093 -8.461 1.00 5.73 H new ATOM 3222 N THR B 94 5.122 6.613 -6.706 1.00 7.02 N ATOM 3223 CA THR B 94 5.029 7.980 -6.221 1.00 7.65 C ATOM 3224 C THR B 94 3.580 8.442 -6.228 1.00 7.67 C ATOM 3225 O THR B 94 3.041 8.798 -7.276 1.00 8.38 O ATOM 3226 CB THR B 94 5.867 8.935 -7.087 1.00 8.72 C ATOM 3227 OG1 THR B 94 6.014 8.393 -8.408 1.00 8.98 O ATOM 3228 CG2 THR B 94 7.237 9.167 -6.467 1.00 9.17 C ATOM 0 H THR B 94 5.314 6.532 -7.704 1.00 7.02 H new ATOM 0 HA THR B 94 5.417 7.998 -5.203 1.00 7.65 H new ATOM 0 HB THR B 94 5.349 9.892 -7.144 1.00 8.72 H new ATOM 0 HG1 THR B 94 6.814 8.771 -8.830 1.00 8.98 H new ATOM 0 HG21 THR B 94 7.811 9.846 -7.097 1.00 9.17 H new ATOM 0 HG22 THR B 94 7.118 9.605 -5.476 1.00 9.17 H new ATOM 0 HG23 THR B 94 7.764 8.217 -6.383 1.00 9.17 H new ATOM 3236 N PHE B 95 2.946 8.424 -5.066 1.00 7.03 N ATOM 3237 CA PHE B 95 1.554 8.834 -4.967 1.00 7.23 C ATOM 3238 C PHE B 95 1.425 10.352 -5.012 1.00 7.66 C ATOM 3239 O PHE B 95 2.068 11.067 -4.240 1.00 7.94 O ATOM 3240 CB PHE B 95 0.918 8.296 -3.683 1.00 6.55 C ATOM 3241 CG PHE B 95 -0.581 8.195 -3.765 1.00 6.95 C ATOM 3242 CD1 PHE B 95 -1.380 9.312 -3.575 1.00 6.97 C ATOM 3243 CD2 PHE B 95 -1.190 6.981 -4.036 1.00 7.38 C ATOM 3244 CE1 PHE B 95 -2.757 9.217 -3.655 1.00 7.38 C ATOM 3245 CE2 PHE B 95 -2.565 6.881 -4.115 1.00 7.77 C ATOM 3246 CZ PHE B 95 -3.350 8.000 -3.924 1.00 8.33 C ATOM 0 H PHE B 95 3.369 8.132 -4.185 1.00 7.03 H new ATOM 0 HA PHE B 95 1.026 8.415 -5.824 1.00 7.23 H new ATOM 0 HB2 PHE B 95 1.331 7.311 -3.465 1.00 6.55 H new ATOM 0 HB3 PHE B 95 1.188 8.946 -2.851 1.00 6.55 H new ATOM 0 HD1 PHE B 95 -0.922 10.267 -3.362 1.00 6.97 H new ATOM 0 HD2 PHE B 95 -0.582 6.101 -4.187 1.00 7.38 H new ATOM 0 HE1 PHE B 95 -3.368 10.095 -3.507 1.00 7.38 H new ATOM 0 HE2 PHE B 95 -3.026 5.927 -4.326 1.00 7.77 H new ATOM 0 HZ PHE B 95 -4.426 7.924 -3.985 1.00 8.33 H new ATOM 3256 N GLN B 96 0.597 10.835 -5.927 1.00 7.77 N ATOM 3257 CA GLN B 96 0.361 12.262 -6.072 1.00 8.24 C ATOM 3258 C GLN B 96 -0.878 12.661 -5.282 1.00 8.05 C ATOM 3259 O GLN B 96 -1.983 12.195 -5.573 1.00 8.10 O ATOM 3260 CB GLN B 96 0.168 12.632 -7.545 1.00 8.94 C ATOM 3261 CG GLN B 96 1.363 12.321 -8.430 1.00 9.25 C ATOM 3262 CD GLN B 96 1.018 12.402 -9.906 1.00 9.90 C ATOM 3263 OE1 GLN B 96 0.623 11.411 -10.516 1.00 9.95 O ATOM 3264 NE2 GLN B 96 1.140 13.581 -10.489 1.00 10.53 N ATOM 0 H GLN B 96 0.075 10.254 -6.583 1.00 7.77 H new ATOM 0 HA GLN B 96 1.230 12.796 -5.688 1.00 8.24 H new ATOM 0 HB2 GLN B 96 -0.702 12.100 -7.930 1.00 8.94 H new ATOM 0 HB3 GLN B 96 -0.053 13.697 -7.614 1.00 8.94 H new ATOM 0 HG2 GLN B 96 2.169 13.020 -8.208 1.00 9.25 H new ATOM 0 HG3 GLN B 96 1.734 11.322 -8.199 1.00 9.25 H new ATOM 0 HE21 GLN B 96 1.471 14.383 -9.953 1.00 10.53 H new ATOM 0 HE22 GLN B 96 0.903 13.689 -11.475 1.00 10.53 H new ATOM 3273 N ASN B 97 -0.688 13.500 -4.278 1.00 7.96 N ATOM 3274 CA ASN B 97 -1.790 13.970 -3.449 1.00 7.92 C ATOM 3275 C ASN B 97 -2.738 14.820 -4.293 1.00 8.14 C ATOM 3276 O ASN B 97 -2.306 15.768 -4.953 1.00 8.43 O ATOM 3277 CB ASN B 97 -1.242 14.782 -2.273 1.00 7.98 C ATOM 3278 CG ASN B 97 -2.310 15.246 -1.302 1.00 8.09 C ATOM 3279 OD1 ASN B 97 -3.241 14.513 -0.965 1.00 8.16 O ATOM 3280 ND2 ASN B 97 -2.176 16.479 -0.847 1.00 8.31 N ATOM 0 H ASN B 97 0.224 13.873 -4.014 1.00 7.96 H new ATOM 0 HA ASN B 97 -2.341 13.116 -3.055 1.00 7.92 H new ATOM 0 HB2 ASN B 97 -0.512 14.178 -1.735 1.00 7.98 H new ATOM 0 HB3 ASN B 97 -0.712 15.653 -2.660 1.00 7.98 H new ATOM 0 HD21 ASN B 97 -2.859 16.857 -0.191 1.00 8.31 H new ATOM 0 HD22 ASN B 97 -1.390 17.053 -1.152 1.00 8.31 H new ATOM 3287 N PRO B 98 -4.039 14.486 -4.288 1.00 8.11 N ATOM 3288 CA PRO B 98 -5.055 15.203 -5.074 1.00 8.36 C ATOM 3289 C PRO B 98 -5.370 16.603 -4.541 1.00 8.56 C ATOM 3290 O PRO B 98 -6.531 17.011 -4.490 1.00 9.16 O ATOM 3291 CB PRO B 98 -6.287 14.305 -4.954 1.00 8.39 C ATOM 3292 CG PRO B 98 -6.102 13.582 -3.666 1.00 8.29 C ATOM 3293 CD PRO B 98 -4.622 13.372 -3.520 1.00 7.99 C ATOM 0 HA PRO B 98 -4.714 15.373 -6.095 1.00 8.36 H new ATOM 0 HB2 PRO B 98 -7.206 14.891 -4.951 1.00 8.39 H new ATOM 0 HB3 PRO B 98 -6.355 13.611 -5.792 1.00 8.39 H new ATOM 0 HG2 PRO B 98 -6.498 14.162 -2.832 1.00 8.29 H new ATOM 0 HG3 PRO B 98 -6.633 12.630 -3.673 1.00 8.29 H new ATOM 0 HD2 PRO B 98 -4.314 13.400 -2.475 1.00 7.99 H new ATOM 0 HD3 PRO B 98 -4.313 12.405 -3.917 1.00 7.99 H new ATOM 3301 N TYR B 99 -4.338 17.337 -4.161 1.00 8.20 N ATOM 3302 CA TYR B 99 -4.502 18.687 -3.652 1.00 8.49 C ATOM 3303 C TYR B 99 -3.772 19.663 -4.563 1.00 8.25 C ATOM 3304 O TYR B 99 -4.381 20.546 -5.168 1.00 8.70 O ATOM 3305 CB TYR B 99 -3.966 18.782 -2.222 1.00 8.61 C ATOM 3306 CG TYR B 99 -4.532 19.932 -1.424 1.00 9.49 C ATOM 3307 CD1 TYR B 99 -5.807 19.863 -0.881 1.00 9.79 C ATOM 3308 CD2 TYR B 99 -3.782 21.079 -1.199 1.00 9.80 C ATOM 3309 CE1 TYR B 99 -6.322 20.906 -0.137 1.00 10.35 C ATOM 3310 CE2 TYR B 99 -4.291 22.128 -0.459 1.00 10.36 C ATOM 3311 CZ TYR B 99 -5.561 22.036 0.073 1.00 10.60 C ATOM 3312 OH TYR B 99 -6.069 23.075 0.820 1.00 11.34 O ATOM 0 H TYR B 99 -3.370 17.017 -4.196 1.00 8.20 H new ATOM 0 HA TYR B 99 -5.562 18.941 -3.636 1.00 8.49 H new ATOM 0 HB2 TYR B 99 -4.186 17.850 -1.701 1.00 8.61 H new ATOM 0 HB3 TYR B 99 -2.881 18.879 -2.258 1.00 8.61 H new ATOM 0 HD1 TYR B 99 -6.406 18.979 -1.043 1.00 9.79 H new ATOM 0 HD2 TYR B 99 -2.785 21.152 -1.609 1.00 9.80 H new ATOM 0 HE1 TYR B 99 -7.316 20.837 0.278 1.00 10.35 H new ATOM 0 HE2 TYR B 99 -3.698 23.016 -0.297 1.00 10.36 H new ATOM 0 HH TYR B 99 -5.406 23.795 0.873 1.00 11.34 H new ATOM 3322 N SER B 100 -2.464 19.482 -4.666 1.00 7.67 N ATOM 3323 CA SER B 100 -1.630 20.319 -5.507 1.00 7.55 C ATOM 3324 C SER B 100 -0.662 19.451 -6.305 1.00 7.32 C ATOM 3325 O SER B 100 0.395 19.919 -6.741 1.00 7.75 O ATOM 3326 CB SER B 100 -0.852 21.316 -4.645 1.00 7.45 C ATOM 3327 OG SER B 100 -1.425 21.427 -3.348 1.00 7.36 O ATOM 0 H SER B 100 -1.954 18.752 -4.169 1.00 7.67 H new ATOM 0 HA SER B 100 -2.264 20.872 -6.200 1.00 7.55 H new ATOM 0 HB2 SER B 100 0.187 20.996 -4.561 1.00 7.45 H new ATOM 0 HB3 SER B 100 -0.847 22.293 -5.128 1.00 7.45 H new ATOM 0 HG SER B 100 -1.023 20.759 -2.754 1.00 7.36 H new ATOM 3333 N ASP B 101 -1.032 18.176 -6.470 1.00 6.80 N ATOM 3334 CA ASP B 101 -0.222 17.203 -7.206 1.00 6.71 C ATOM 3335 C ASP B 101 1.118 16.980 -6.511 1.00 6.51 C ATOM 3336 O ASP B 101 2.098 16.573 -7.134 1.00 6.46 O ATOM 3337 CB ASP B 101 -0.001 17.666 -8.653 1.00 7.30 C ATOM 3338 CG ASP B 101 0.302 16.516 -9.594 1.00 8.84 C ATOM 3339 OD1 ASP B 101 -0.641 15.794 -9.974 1.00 9.08 O ATOM 3340 OD2 ASP B 101 1.485 16.328 -9.967 1.00 8.97 O ATOM 0 H ASP B 101 -1.900 17.792 -6.097 1.00 6.80 H new ATOM 0 HA ASP B 101 -0.763 16.257 -7.224 1.00 6.71 H new ATOM 0 HB2 ASP B 101 -0.890 18.192 -9.002 1.00 7.30 H new ATOM 0 HB3 ASP B 101 0.823 18.380 -8.680 1.00 7.30 H new ATOM 3345 N GLU B 102 1.157 17.235 -5.211 1.00 6.62 N ATOM 3346 CA GLU B 102 2.382 17.072 -4.447 1.00 6.76 C ATOM 3347 C GLU B 102 2.540 15.625 -3.996 1.00 6.49 C ATOM 3348 O GLU B 102 1.562 14.951 -3.675 1.00 6.08 O ATOM 3349 CB GLU B 102 2.408 18.018 -3.236 1.00 6.92 C ATOM 3350 CG GLU B 102 1.336 17.734 -2.190 1.00 7.00 C ATOM 3351 CD GLU B 102 0.044 18.481 -2.446 1.00 7.52 C ATOM 3352 OE1 GLU B 102 -0.771 18.001 -3.256 1.00 7.71 O ATOM 3353 OE2 GLU B 102 -0.168 19.547 -1.829 1.00 7.71 O ATOM 0 H GLU B 102 0.356 17.555 -4.666 1.00 6.62 H new ATOM 0 HA GLU B 102 3.220 17.329 -5.094 1.00 6.76 H new ATOM 0 HB2 GLU B 102 3.387 17.954 -2.761 1.00 6.92 H new ATOM 0 HB3 GLU B 102 2.291 19.043 -3.589 1.00 6.92 H new ATOM 0 HG2 GLU B 102 1.132 16.664 -2.169 1.00 7.00 H new ATOM 0 HG3 GLU B 102 1.717 18.005 -1.205 1.00 7.00 H new ATOM 3360 N ILE B 103 3.770 15.143 -3.996 1.00 6.89 N ATOM 3361 CA ILE B 103 4.052 13.780 -3.576 1.00 6.86 C ATOM 3362 C ILE B 103 4.078 13.701 -2.053 1.00 6.92 C ATOM 3363 O ILE B 103 4.993 14.229 -1.414 1.00 6.97 O ATOM 3364 CB ILE B 103 5.399 13.277 -4.141 1.00 7.13 C ATOM 3365 CG1 ILE B 103 5.420 13.402 -5.669 1.00 7.47 C ATOM 3366 CG2 ILE B 103 5.655 11.836 -3.720 1.00 6.71 C ATOM 3367 CD1 ILE B 103 6.780 13.139 -6.283 1.00 8.04 C ATOM 0 H ILE B 103 4.592 15.675 -4.282 1.00 6.89 H new ATOM 0 HA ILE B 103 3.260 13.142 -3.968 1.00 6.86 H new ATOM 0 HB ILE B 103 6.195 13.899 -3.732 1.00 7.13 H new ATOM 0 HG12 ILE B 103 4.699 12.703 -6.092 1.00 7.47 H new ATOM 0 HG13 ILE B 103 5.093 14.404 -5.947 1.00 7.47 H new ATOM 0 HG21 ILE B 103 6.609 11.502 -4.129 1.00 6.71 H new ATOM 0 HG22 ILE B 103 5.685 11.775 -2.632 1.00 6.71 H new ATOM 0 HG23 ILE B 103 4.855 11.199 -4.098 1.00 6.71 H new ATOM 0 HD11 ILE B 103 6.717 13.246 -7.366 1.00 8.04 H new ATOM 0 HD12 ILE B 103 7.502 13.855 -5.889 1.00 8.04 H new ATOM 0 HD13 ILE B 103 7.101 12.127 -6.036 1.00 8.04 H new ATOM 3379 N GLU B 104 3.068 13.058 -1.477 1.00 7.07 N ATOM 3380 CA GLU B 104 2.985 12.921 -0.027 1.00 7.39 C ATOM 3381 C GLU B 104 4.038 11.941 0.482 1.00 7.24 C ATOM 3382 O GLU B 104 4.681 12.183 1.505 1.00 7.56 O ATOM 3383 CB GLU B 104 1.578 12.484 0.411 1.00 7.11 C ATOM 3384 CG GLU B 104 0.909 11.468 -0.506 1.00 7.06 C ATOM 3385 CD GLU B 104 -0.412 10.962 0.052 1.00 8.47 C ATOM 3386 OE1 GLU B 104 -0.990 11.630 0.935 1.00 8.35 O ATOM 3387 OE2 GLU B 104 -0.879 9.890 -0.386 1.00 8.81 O ATOM 0 H GLU B 104 2.299 12.625 -1.989 1.00 7.07 H new ATOM 0 HA GLU B 104 3.183 13.898 0.414 1.00 7.39 H new ATOM 0 HB2 GLU B 104 1.640 12.061 1.414 1.00 7.11 H new ATOM 0 HB3 GLU B 104 0.943 13.367 0.476 1.00 7.11 H new ATOM 0 HG2 GLU B 104 0.738 11.922 -1.482 1.00 7.06 H new ATOM 0 HG3 GLU B 104 1.582 10.624 -0.660 1.00 7.06 H new ATOM 3394 N TYR B 105 4.212 10.839 -0.237 1.00 6.81 N ATOM 3395 CA TYR B 105 5.195 9.826 0.124 1.00 6.65 C ATOM 3396 C TYR B 105 5.339 8.818 -1.006 1.00 5.83 C ATOM 3397 O TYR B 105 4.540 8.807 -1.945 1.00 5.31 O ATOM 3398 CB TYR B 105 4.817 9.109 1.432 1.00 7.23 C ATOM 3399 CG TYR B 105 3.365 8.693 1.523 1.00 7.06 C ATOM 3400 CD1 TYR B 105 2.884 7.606 0.803 1.00 6.65 C ATOM 3401 CD2 TYR B 105 2.475 9.391 2.328 1.00 7.40 C ATOM 3402 CE1 TYR B 105 1.558 7.230 0.881 1.00 6.52 C ATOM 3403 CE2 TYR B 105 1.149 9.020 2.413 1.00 7.32 C ATOM 3404 CZ TYR B 105 0.695 7.941 1.688 1.00 6.94 C ATOM 3405 OH TYR B 105 -0.630 7.579 1.760 1.00 6.84 O ATOM 0 H TYR B 105 3.680 10.623 -1.080 1.00 6.81 H new ATOM 0 HA TYR B 105 6.149 10.327 0.287 1.00 6.65 H new ATOM 0 HB2 TYR B 105 5.443 8.223 1.540 1.00 7.23 H new ATOM 0 HB3 TYR B 105 5.047 9.766 2.271 1.00 7.23 H new ATOM 0 HD1 TYR B 105 3.559 7.046 0.172 1.00 6.65 H new ATOM 0 HD2 TYR B 105 2.827 10.239 2.897 1.00 7.40 H new ATOM 0 HE1 TYR B 105 1.199 6.384 0.314 1.00 6.52 H new ATOM 0 HE2 TYR B 105 0.470 9.573 3.045 1.00 7.32 H new ATOM 0 HH TYR B 105 -1.153 8.128 1.139 1.00 6.84 H new ATOM 3415 N ILE B 106 6.361 7.980 -0.913 1.00 5.84 N ATOM 3416 CA ILE B 106 6.611 6.964 -1.919 1.00 5.13 C ATOM 3417 C ILE B 106 6.164 5.602 -1.407 1.00 4.98 C ATOM 3418 O ILE B 106 6.662 5.110 -0.390 1.00 5.41 O ATOM 3419 CB ILE B 106 8.104 6.898 -2.312 1.00 5.45 C ATOM 3420 CG1 ILE B 106 8.657 8.305 -2.564 1.00 6.30 C ATOM 3421 CG2 ILE B 106 8.286 6.026 -3.550 1.00 4.84 C ATOM 3422 CD1 ILE B 106 10.149 8.331 -2.811 1.00 6.78 C ATOM 0 H ILE B 106 7.033 7.986 -0.146 1.00 5.84 H new ATOM 0 HA ILE B 106 6.039 7.236 -2.806 1.00 5.13 H new ATOM 0 HB ILE B 106 8.660 6.453 -1.487 1.00 5.45 H new ATOM 0 HG12 ILE B 106 8.147 8.739 -3.424 1.00 6.30 H new ATOM 0 HG13 ILE B 106 8.428 8.936 -1.705 1.00 6.30 H new ATOM 0 HG21 ILE B 106 9.342 5.988 -3.816 1.00 4.84 H new ATOM 0 HG22 ILE B 106 7.928 5.018 -3.341 1.00 4.84 H new ATOM 0 HG23 ILE B 106 7.718 6.448 -4.379 1.00 4.84 H new ATOM 0 HD11 ILE B 106 10.472 9.358 -2.982 1.00 6.78 H new ATOM 0 HD12 ILE B 106 10.669 7.927 -1.942 1.00 6.78 H new ATOM 0 HD13 ILE B 106 10.383 7.727 -3.687 1.00 6.78 H new ATOM 3434 N ILE B 107 5.213 5.009 -2.108 1.00 4.66 N ATOM 3435 CA ILE B 107 4.686 3.706 -1.747 1.00 4.86 C ATOM 3436 C ILE B 107 5.512 2.612 -2.407 1.00 4.29 C ATOM 3437 O ILE B 107 5.270 2.238 -3.553 1.00 3.98 O ATOM 3438 CB ILE B 107 3.210 3.561 -2.169 1.00 5.29 C ATOM 3439 CG1 ILE B 107 2.391 4.749 -1.656 1.00 6.01 C ATOM 3440 CG2 ILE B 107 2.630 2.253 -1.649 1.00 5.80 C ATOM 3441 CD1 ILE B 107 0.987 4.798 -2.212 1.00 6.31 C ATOM 0 H ILE B 107 4.786 5.416 -2.940 1.00 4.66 H new ATOM 0 HA ILE B 107 4.744 3.610 -0.663 1.00 4.86 H new ATOM 0 HB ILE B 107 3.163 3.549 -3.258 1.00 5.29 H new ATOM 0 HG12 ILE B 107 2.341 4.703 -0.568 1.00 6.01 H new ATOM 0 HG13 ILE B 107 2.907 5.674 -1.913 1.00 6.01 H new ATOM 0 HG21 ILE B 107 1.588 2.169 -1.957 1.00 5.80 H new ATOM 0 HG22 ILE B 107 3.197 1.416 -2.056 1.00 5.80 H new ATOM 0 HG23 ILE B 107 2.689 2.236 -0.561 1.00 5.80 H new ATOM 0 HD11 ILE B 107 0.465 5.664 -1.806 1.00 6.31 H new ATOM 0 HD12 ILE B 107 1.028 4.875 -3.298 1.00 6.31 H new ATOM 0 HD13 ILE B 107 0.453 3.889 -1.933 1.00 6.31 H new ATOM 3453 N CYS B 108 6.505 2.119 -1.690 1.00 4.36 N ATOM 3454 CA CYS B 108 7.369 1.077 -2.212 1.00 4.09 C ATOM 3455 C CYS B 108 6.799 -0.306 -1.931 1.00 4.49 C ATOM 3456 O CYS B 108 6.632 -0.698 -0.779 1.00 5.31 O ATOM 3457 CB CYS B 108 8.769 1.202 -1.610 1.00 3.74 C ATOM 3458 SG CYS B 108 9.715 2.605 -2.243 1.00 3.04 S ATOM 0 H CYS B 108 6.733 2.424 -0.744 1.00 4.36 H new ATOM 0 HA CYS B 108 7.432 1.202 -3.293 1.00 4.09 H new ATOM 0 HB2 CYS B 108 8.681 1.294 -0.527 1.00 3.74 H new ATOM 0 HB3 CYS B 108 9.322 0.284 -1.808 1.00 3.74 H new ATOM 0 HG CYS B 108 10.332 3.191 -1.260 1.00 3.04 H new ATOM 3464 N THR B 109 6.480 -1.026 -2.989 1.00 4.08 N ATOM 3465 CA THR B 109 5.952 -2.370 -2.867 1.00 4.65 C ATOM 3466 C THR B 109 7.112 -3.363 -2.835 1.00 5.11 C ATOM 3467 O THR B 109 7.504 -3.917 -3.864 1.00 5.24 O ATOM 3468 CB THR B 109 4.997 -2.698 -4.032 1.00 5.03 C ATOM 3469 OG1 THR B 109 4.294 -1.508 -4.436 1.00 4.85 O ATOM 3470 CG2 THR B 109 3.997 -3.771 -3.628 1.00 5.48 C ATOM 0 H THR B 109 6.579 -0.699 -3.950 1.00 4.08 H new ATOM 0 HA THR B 109 5.382 -2.443 -1.941 1.00 4.65 H new ATOM 0 HB THR B 109 5.589 -3.074 -4.866 1.00 5.03 H new ATOM 0 HG1 THR B 109 4.892 -0.937 -4.962 1.00 4.85 H new ATOM 0 HG21 THR B 109 3.334 -3.985 -4.467 1.00 5.48 H new ATOM 0 HG22 THR B 109 4.531 -4.679 -3.347 1.00 5.48 H new ATOM 0 HG23 THR B 109 3.408 -3.419 -2.781 1.00 5.48 H new ATOM 3478 N ASN B 110 7.683 -3.543 -1.651 1.00 5.49 N ATOM 3479 CA ASN B 110 8.817 -4.439 -1.459 1.00 6.04 C ATOM 3480 C ASN B 110 8.414 -5.885 -1.674 1.00 6.71 C ATOM 3481 O ASN B 110 7.780 -6.490 -0.817 1.00 6.90 O ATOM 3482 CB ASN B 110 9.390 -4.278 -0.047 1.00 6.01 C ATOM 3483 CG ASN B 110 10.370 -3.127 0.066 1.00 6.09 C ATOM 3484 OD1 ASN B 110 10.286 -2.148 -0.670 1.00 6.05 O ATOM 3485 ND2 ASN B 110 11.307 -3.237 0.994 1.00 6.27 N ATOM 0 H ASN B 110 7.375 -3.074 -0.799 1.00 5.49 H new ATOM 0 HA ASN B 110 9.577 -4.174 -2.194 1.00 6.04 H new ATOM 0 HB2 ASN B 110 8.572 -4.122 0.656 1.00 6.01 H new ATOM 0 HB3 ASN B 110 9.888 -5.202 0.245 1.00 6.01 H new ATOM 0 HD21 ASN B 110 11.993 -2.492 1.117 1.00 6.27 H new ATOM 0 HD22 ASN B 110 11.343 -4.067 1.586 1.00 6.27 H new ATOM 3492 N THR B 111 8.772 -6.431 -2.825 1.00 7.16 N ATOM 3493 CA THR B 111 8.455 -7.813 -3.140 1.00 7.90 C ATOM 3494 C THR B 111 9.725 -8.656 -3.162 1.00 8.33 C ATOM 3495 O THR B 111 10.596 -8.451 -4.005 1.00 8.01 O ATOM 3496 CB THR B 111 7.756 -7.920 -4.507 1.00 8.30 C ATOM 3497 OG1 THR B 111 6.948 -6.755 -4.741 1.00 8.18 O ATOM 3498 CG2 THR B 111 6.887 -9.167 -4.577 1.00 8.61 C ATOM 0 H THR B 111 9.283 -5.937 -3.557 1.00 7.16 H new ATOM 0 HA THR B 111 7.782 -8.184 -2.367 1.00 7.90 H new ATOM 0 HB THR B 111 8.525 -7.989 -5.276 1.00 8.30 H new ATOM 0 HG1 THR B 111 7.527 -5.992 -4.948 1.00 8.18 H new ATOM 0 HG21 THR B 111 6.404 -9.220 -5.553 1.00 8.61 H new ATOM 0 HG22 THR B 111 7.507 -10.051 -4.431 1.00 8.61 H new ATOM 0 HG23 THR B 111 6.126 -9.125 -3.797 1.00 8.61 H new ATOM 3506 N ASN B 112 9.838 -9.595 -2.231 1.00 9.14 N ATOM 3507 CA ASN B 112 11.016 -10.452 -2.163 1.00 9.70 C ATOM 3508 C ASN B 112 11.066 -11.396 -3.355 1.00 10.21 C ATOM 3509 O ASN B 112 10.054 -11.977 -3.747 1.00 10.32 O ATOM 3510 CB ASN B 112 11.036 -11.250 -0.854 1.00 10.52 C ATOM 3511 CG ASN B 112 11.913 -12.490 -0.933 1.00 11.13 C ATOM 3512 OD1 ASN B 112 13.220 -12.302 -0.834 1.00 11.84 O flip ATOM 3513 ND2 ASN B 112 11.418 -13.606 -1.093 1.00 10.90 N flip ATOM 0 H ASN B 112 9.134 -9.782 -1.517 1.00 9.14 H new ATOM 0 HA ASN B 112 11.898 -9.812 -2.190 1.00 9.70 H new ATOM 0 HB2 ASN B 112 11.393 -10.609 -0.048 1.00 10.52 H new ATOM 0 HB3 ASN B 112 10.018 -11.546 -0.599 1.00 10.52 H new ATOM 0 HD21 ASN B 112 10.406 -13.709 -1.165 1.00 10.90 H new ATOM 0 HD22 ASN B 112 12.020 -14.427 -1.154 1.00 10.90 H new ATOM 3520 N VAL B 113 12.244 -11.519 -3.945 1.00 10.57 N ATOM 3521 CA VAL B 113 12.444 -12.397 -5.085 1.00 11.22 C ATOM 3522 C VAL B 113 13.176 -13.653 -4.640 1.00 11.42 C ATOM 3523 O VAL B 113 12.665 -14.764 -4.778 1.00 11.44 O ATOM 3524 CB VAL B 113 13.260 -11.716 -6.205 1.00 11.03 C ATOM 3525 CG1 VAL B 113 13.185 -12.527 -7.491 1.00 11.77 C ATOM 3526 CG2 VAL B 113 12.779 -10.291 -6.438 1.00 10.85 C ATOM 0 H VAL B 113 13.082 -11.017 -3.650 1.00 10.57 H new ATOM 0 HA VAL B 113 11.460 -12.644 -5.482 1.00 11.22 H new ATOM 0 HB VAL B 113 14.302 -11.672 -5.887 1.00 11.03 H new ATOM 0 HG11 VAL B 113 13.766 -12.031 -8.268 1.00 11.77 H new ATOM 0 HG12 VAL B 113 13.589 -13.524 -7.316 1.00 11.77 H new ATOM 0 HG13 VAL B 113 12.146 -12.607 -7.810 1.00 11.77 H new ATOM 0 HG21 VAL B 113 13.369 -9.833 -7.231 1.00 10.85 H new ATOM 0 HG22 VAL B 113 11.729 -10.305 -6.729 1.00 10.85 H new ATOM 0 HG23 VAL B 113 12.894 -9.714 -5.521 1.00 10.85 H new ATOM 3536 N LYS B 114 14.366 -13.456 -4.089 1.00 11.62 N ATOM 3537 CA LYS B 114 15.196 -14.553 -3.613 1.00 11.92 C ATOM 3538 C LYS B 114 15.894 -14.153 -2.317 1.00 12.21 C ATOM 3539 O LYS B 114 15.262 -14.269 -1.246 1.00 12.68 O ATOM 3540 CB LYS B 114 16.229 -14.942 -4.677 1.00 12.06 C ATOM 3541 CG LYS B 114 15.625 -15.639 -5.884 1.00 11.92 C ATOM 3542 CD LYS B 114 16.244 -15.157 -7.185 1.00 12.03 C ATOM 3543 CE LYS B 114 17.644 -15.711 -7.385 1.00 11.97 C ATOM 3544 NZ LYS B 114 18.101 -15.544 -8.788 1.00 12.15 N ATOM 0 H LYS B 114 14.782 -12.534 -3.960 1.00 11.62 H new ATOM 0 HA LYS B 114 14.560 -15.417 -3.419 1.00 11.92 H new ATOM 0 HB2 LYS B 114 16.751 -14.045 -5.010 1.00 12.06 H new ATOM 0 HB3 LYS B 114 16.975 -15.596 -4.225 1.00 12.06 H new ATOM 0 HG2 LYS B 114 15.768 -16.716 -5.791 1.00 11.92 H new ATOM 0 HG3 LYS B 114 14.550 -15.461 -5.906 1.00 11.92 H new ATOM 0 HD2 LYS B 114 15.612 -15.457 -8.021 1.00 12.03 H new ATOM 0 HD3 LYS B 114 16.281 -14.068 -7.188 1.00 12.03 H new ATOM 0 HE2 LYS B 114 18.336 -15.204 -6.713 1.00 11.97 H new ATOM 0 HE3 LYS B 114 17.659 -16.768 -7.120 1.00 11.97 H new ATOM 0 HZ1 LYS B 114 19.060 -15.933 -8.889 1.00 12.15 H new ATOM 0 HZ2 LYS B 114 17.454 -16.049 -9.426 1.00 12.15 H new ATOM 0 HZ3 LYS B 114 18.110 -14.533 -9.032 1.00 12.15 H new