USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 859 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 47 SER OG : rot 73:sc= 1.22 USER MOD Set 1.2: A 106 MET CE :methyl 157:sc= -0.0347 (180deg=-0.455) USER MOD Set 2.1: A 92 TYR OH : rot 30:sc= 0.0129 USER MOD Set 2.2: A 110 TYR OH : rot -112:sc= 1.26 USER MOD Set 3.1: A 71 HIS : no HE2:sc= 0.874 K(o=1.8,f=-4!) USER MOD Set 3.2: A 73 GLN : amide:sc= 0.907 K(o=1.8,f=0.2) USER MOD Set 4.1: A 51 GLN : amide:sc= 0.0292 K(o=0.061,f=-0.99) USER MOD Set 4.2: A 61 LYS NZ :NH3+ 171:sc= 0.0315 (180deg=0) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= -0.5 K(o=-0.5,f=-2.2) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 66:sc= 1.29 USER MOD Single : A 53 ASN : amide:sc= 0.649 K(o=0.65,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 47:sc= 1.13 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -50:sc= 1.25 USER MOD Single : A 77 GLN : amide:sc= -0.806 K(o=-0.81,f=-1.5) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 170:sc=-0.000639 (180deg=-0.119) USER MOD Single : A 84 GLN : amide:sc= 1.1 K(o=1.1,f=-0.04) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : A 95 TYR OH : rot -129:sc= 1.19 USER MOD Single : A 96 THR OG1 : rot 180:sc= -1.23 USER MOD Single : A 98 TYR OH : rot -12:sc= 1.3 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00619) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= 1.01 K(o=1,f=-5.6!) USER MOD Single : A 131 THR OG1 : rot 28:sc= 1.27 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 167:sc= 0.0812 (180deg=-0.0742) USER MOD Single : A 141 TYR OH : rot 180:sc= -0.0441 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 35 -100.597-123.094 3.586 1.00 0.00 N ATOM 2 CA MET A 35 -99.262-123.613 3.787 1.00 0.00 C ATOM 3 C MET A 35 -99.324-125.126 3.737 1.00 0.00 C ATOM 4 O MET A 35 -98.398-125.842 4.113 1.00 0.00 O ATOM 5 CB MET A 35 -98.610-123.083 5.093 1.00 0.00 C ATOM 6 CG MET A 35 -99.494-123.185 6.349 1.00 0.00 C ATOM 7 SD MET A 35 -98.589-122.778 7.872 1.00 0.00 S ATOM 8 CE MET A 35 -98.035-124.474 8.195 1.00 0.00 C ATOM 0 HA MET A 35 -98.612-123.256 2.988 1.00 0.00 H new ATOM 0 HB2 MET A 35 -97.687-123.635 5.271 1.00 0.00 H new ATOM 0 HB3 MET A 35 -98.333-122.039 4.946 1.00 0.00 H new ATOM 0 HG2 MET A 35 -100.346-122.513 6.246 1.00 0.00 H new ATOM 0 HG3 MET A 35 -99.894-124.196 6.427 1.00 0.00 H new ATOM 0 HE1 MET A 35 -97.439-124.495 9.107 1.00 0.00 H new ATOM 0 HE2 MET A 35 -98.902-125.124 8.313 1.00 0.00 H new ATOM 0 HE3 MET A 35 -97.430-124.825 7.359 1.00 0.00 H new ATOM 18 N TYR A 36 -100.471-125.637 3.249 1.00 0.00 N ATOM 19 CA TYR A 36 -100.799-127.035 3.101 1.00 0.00 C ATOM 20 C TYR A 36 -101.964-127.033 2.118 1.00 0.00 C ATOM 21 O TYR A 36 -102.438-125.973 1.699 1.00 0.00 O ATOM 22 CB TYR A 36 -101.167-127.659 4.498 1.00 0.00 C ATOM 23 CG TYR A 36 -101.456-129.143 4.484 1.00 0.00 C ATOM 24 CD1 TYR A 36 -100.518-130.045 4.014 1.00 0.00 C ATOM 25 CD2 TYR A 36 -102.684-129.621 4.912 1.00 0.00 C ATOM 26 CE1 TYR A 36 -100.809-131.395 3.957 1.00 0.00 C ATOM 27 CE2 TYR A 36 -102.977-130.970 4.855 1.00 0.00 C ATOM 28 CZ TYR A 36 -102.037-131.859 4.377 1.00 0.00 C ATOM 29 OH TYR A 36 -102.313-133.241 4.313 1.00 0.00 O ATOM 0 H TYR A 36 -101.229-125.032 2.933 1.00 0.00 H new ATOM 0 HA TYR A 36 -99.976-127.647 2.732 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -100.346-127.472 5.189 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -102.040-127.139 4.892 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -99.551-129.691 3.689 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -103.421-128.931 5.295 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -100.071-132.089 3.582 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -103.941-131.328 5.184 1.00 0.00 H new ATOM 0 HH TYR A 36 -103.219-133.409 4.646 1.00 0.00 H new ATOM 39 N GLU A 37 -102.517-128.225 1.759 1.00 0.00 N ATOM 40 CA GLU A 37 -103.674-128.409 0.882 1.00 0.00 C ATOM 41 C GLU A 37 -104.987-128.225 1.657 1.00 0.00 C ATOM 42 O GLU A 37 -105.781-129.141 1.856 1.00 0.00 O ATOM 43 CB GLU A 37 -103.593-129.793 0.181 1.00 0.00 C ATOM 44 CG GLU A 37 -104.540-129.955 -1.025 1.00 0.00 C ATOM 45 CD GLU A 37 -104.307-131.317 -1.679 1.00 0.00 C ATOM 46 OE1 GLU A 37 -103.177-131.546 -2.186 1.00 0.00 O ATOM 47 OE2 GLU A 37 -105.255-132.146 -1.682 1.00 0.00 O ATOM 0 H GLU A 37 -102.142-129.112 2.095 1.00 0.00 H new ATOM 0 HA GLU A 37 -103.659-127.643 0.107 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -102.569-129.958 -0.153 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -103.819-130.570 0.911 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -105.577-129.869 -0.700 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -104.365-129.158 -1.748 1.00 0.00 H new ATOM 54 N GLU A 38 -105.187-126.979 2.150 1.00 0.00 N ATOM 55 CA GLU A 38 -106.274-126.560 3.009 1.00 0.00 C ATOM 56 C GLU A 38 -106.997-125.346 2.458 1.00 0.00 C ATOM 57 O GLU A 38 -107.839-124.762 3.129 1.00 0.00 O ATOM 58 CB GLU A 38 -105.733-126.267 4.441 1.00 0.00 C ATOM 59 CG GLU A 38 -104.669-125.144 4.527 1.00 0.00 C ATOM 60 CD GLU A 38 -104.082-125.006 5.936 1.00 0.00 C ATOM 61 OE1 GLU A 38 -104.505-125.759 6.853 1.00 0.00 O ATOM 62 OE2 GLU A 38 -103.188-124.134 6.104 1.00 0.00 O ATOM 0 H GLU A 38 -104.549-126.213 1.936 1.00 0.00 H new ATOM 0 HA GLU A 38 -106.998-127.374 3.053 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -106.573-125.999 5.082 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -105.304-127.184 4.845 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -103.866-125.352 3.820 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -105.119-124.197 4.229 1.00 0.00 H new ATOM 69 N PHE A 39 -106.724-124.910 1.198 1.00 0.00 N ATOM 70 CA PHE A 39 -107.352-123.737 0.578 1.00 0.00 C ATOM 71 C PHE A 39 -108.552-124.130 -0.298 1.00 0.00 C ATOM 72 O PHE A 39 -108.730-123.651 -1.422 1.00 0.00 O ATOM 73 CB PHE A 39 -106.337-122.821 -0.191 1.00 0.00 C ATOM 74 CG PHE A 39 -105.472-121.923 0.678 1.00 0.00 C ATOM 75 CD1 PHE A 39 -104.530-122.429 1.562 1.00 0.00 C ATOM 76 CD2 PHE A 39 -105.588-120.538 0.576 1.00 0.00 C ATOM 77 CE1 PHE A 39 -103.771-121.579 2.347 1.00 0.00 C ATOM 78 CE2 PHE A 39 -104.810-119.691 1.338 1.00 0.00 C ATOM 79 CZ PHE A 39 -103.899-120.211 2.233 1.00 0.00 C ATOM 0 H PHE A 39 -106.053-125.376 0.588 1.00 0.00 H new ATOM 0 HA PHE A 39 -107.731-123.130 1.400 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -105.683-123.456 -0.789 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -106.896-122.194 -0.886 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -104.388-123.497 1.638 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -106.303-120.118 -0.116 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -103.070-121.992 3.057 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -104.914-118.621 1.234 1.00 0.00 H new ATOM 0 HZ PHE A 39 -103.292-119.554 2.838 1.00 0.00 H new ATOM 89 N ARG A 40 -109.404-125.026 0.260 1.00 0.00 N ATOM 90 CA ARG A 40 -110.612-125.578 -0.326 1.00 0.00 C ATOM 91 C ARG A 40 -111.740-125.550 0.710 1.00 0.00 C ATOM 92 O ARG A 40 -112.500-126.501 0.883 1.00 0.00 O ATOM 93 CB ARG A 40 -110.335-127.013 -0.865 1.00 0.00 C ATOM 94 CG ARG A 40 -109.677-127.976 0.146 1.00 0.00 C ATOM 95 CD ARG A 40 -109.347-129.346 -0.462 1.00 0.00 C ATOM 96 NE ARG A 40 -108.634-130.163 0.580 1.00 0.00 N ATOM 97 CZ ARG A 40 -108.212-131.449 0.367 1.00 0.00 C ATOM 98 NH1 ARG A 40 -108.466-132.082 -0.815 1.00 0.00 N ATOM 99 NH2 ARG A 40 -107.521-132.100 1.348 1.00 0.00 N ATOM 0 H ARG A 40 -109.237-125.396 1.196 1.00 0.00 H new ATOM 0 HA ARG A 40 -110.929-124.973 -1.176 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -111.278-127.448 -1.197 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -109.692-126.937 -1.742 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -108.762-127.524 0.528 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -110.344-128.113 0.997 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -110.259-129.850 -0.781 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -108.721-129.229 -1.347 1.00 0.00 H new ATOM 0 HE ARG A 40 -108.456-129.739 1.490 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -108.976-131.598 -1.554 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -108.146-133.040 -0.960 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -107.323-131.629 2.231 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -107.203-133.058 1.198 1.00 0.00 H new ATOM 113 N ASP A 41 -111.887-124.416 1.440 1.00 0.00 N ATOM 114 CA ASP A 41 -112.904-124.214 2.478 1.00 0.00 C ATOM 115 C ASP A 41 -113.983-123.255 2.006 1.00 0.00 C ATOM 116 O ASP A 41 -113.848-122.608 0.976 1.00 0.00 O ATOM 117 CB ASP A 41 -112.300-123.657 3.805 1.00 0.00 C ATOM 118 CG ASP A 41 -111.317-124.659 4.417 1.00 0.00 C ATOM 119 OD1 ASP A 41 -111.707-125.845 4.592 1.00 0.00 O ATOM 120 OD2 ASP A 41 -110.173-124.244 4.736 1.00 0.00 O ATOM 0 H ASP A 41 -111.283-123.604 1.313 1.00 0.00 H new ATOM 0 HA ASP A 41 -113.332-125.198 2.672 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -111.790-122.713 3.610 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -113.101-123.446 4.514 1.00 0.00 H new ATOM 125 N VAL A 42 -115.075-123.107 2.797 1.00 0.00 N ATOM 126 CA VAL A 42 -116.177-122.171 2.581 1.00 0.00 C ATOM 127 C VAL A 42 -115.882-120.951 3.455 1.00 0.00 C ATOM 128 O VAL A 42 -115.547-121.094 4.633 1.00 0.00 O ATOM 129 CB VAL A 42 -117.523-122.811 2.953 1.00 0.00 C ATOM 130 CG1 VAL A 42 -118.712-121.849 2.727 1.00 0.00 C ATOM 131 CG2 VAL A 42 -117.726-124.080 2.097 1.00 0.00 C ATOM 0 H VAL A 42 -115.205-123.669 3.638 1.00 0.00 H new ATOM 0 HA VAL A 42 -116.254-121.888 1.531 1.00 0.00 H new ATOM 0 HB VAL A 42 -117.496-123.055 4.015 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -119.641-122.347 3.004 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -118.581-120.958 3.341 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -118.754-121.563 1.676 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -118.679-124.543 2.353 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -117.725-123.810 1.041 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -116.917-124.784 2.292 1.00 0.00 H new ATOM 141 N ILE A 43 -115.967-119.713 2.891 1.00 0.00 N ATOM 142 CA ILE A 43 -115.649-118.457 3.572 1.00 0.00 C ATOM 143 C ILE A 43 -116.856-117.523 3.445 1.00 0.00 C ATOM 144 O ILE A 43 -117.614-117.588 2.471 1.00 0.00 O ATOM 145 CB ILE A 43 -114.321-117.880 3.025 1.00 0.00 C ATOM 146 CG1 ILE A 43 -113.136-118.020 4.017 1.00 0.00 C ATOM 147 CG2 ILE A 43 -114.391-116.417 2.529 1.00 0.00 C ATOM 148 CD1 ILE A 43 -112.784-119.461 4.406 1.00 0.00 C ATOM 0 H ILE A 43 -116.267-119.575 1.926 1.00 0.00 H new ATOM 0 HA ILE A 43 -115.475-118.604 4.638 1.00 0.00 H new ATOM 0 HB ILE A 43 -114.140-118.507 2.152 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -112.255-117.553 3.576 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -113.372-117.462 4.923 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -113.410-116.108 2.166 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -115.117-116.342 1.720 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -114.695-115.768 3.351 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -111.945-119.455 5.101 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -113.646-119.931 4.881 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -112.511-120.023 3.513 1.00 0.00 H new ATOM 160 N THR A 44 -117.025-116.607 4.443 1.00 0.00 N ATOM 161 CA THR A 44 -118.137-115.653 4.487 1.00 0.00 C ATOM 162 C THR A 44 -117.638-114.207 4.493 1.00 0.00 C ATOM 163 O THR A 44 -117.044-113.771 5.483 1.00 0.00 O ATOM 164 CB THR A 44 -119.023-115.858 5.741 1.00 0.00 C ATOM 165 OG1 THR A 44 -118.844-117.129 6.376 1.00 0.00 O ATOM 166 CG2 THR A 44 -120.484-115.714 5.281 1.00 0.00 C ATOM 0 H THR A 44 -116.385-116.522 5.233 1.00 0.00 H new ATOM 0 HA THR A 44 -118.725-115.839 3.588 1.00 0.00 H new ATOM 0 HB THR A 44 -118.740-115.116 6.487 1.00 0.00 H new ATOM 0 HG1 THR A 44 -119.431-117.189 7.159 1.00 0.00 H new ATOM 0 HG21 THR A 44 -121.149-115.851 6.134 1.00 0.00 H new ATOM 0 HG22 THR A 44 -120.636-114.721 4.858 1.00 0.00 H new ATOM 0 HG23 THR A 44 -120.703-116.468 4.525 1.00 0.00 H new ATOM 174 N PHE A 45 -117.881-113.413 3.412 1.00 0.00 N ATOM 175 CA PHE A 45 -117.466-111.997 3.355 1.00 0.00 C ATOM 176 C PHE A 45 -118.571-110.961 3.621 1.00 0.00 C ATOM 177 O PHE A 45 -119.598-110.972 2.939 1.00 0.00 O ATOM 178 CB PHE A 45 -116.935-111.672 1.939 1.00 0.00 C ATOM 179 CG PHE A 45 -115.625-112.346 1.725 1.00 0.00 C ATOM 180 CD1 PHE A 45 -114.489-111.789 2.273 1.00 0.00 C ATOM 181 CD2 PHE A 45 -115.514-113.466 0.925 1.00 0.00 C ATOM 182 CE1 PHE A 45 -113.255-112.308 1.964 1.00 0.00 C ATOM 183 CE2 PHE A 45 -114.273-113.943 0.562 1.00 0.00 C ATOM 184 CZ PHE A 45 -113.141-113.343 1.064 1.00 0.00 C ATOM 0 H PHE A 45 -118.362-113.737 2.573 1.00 0.00 H new ATOM 0 HA PHE A 45 -116.725-111.912 4.150 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -117.652-112.003 1.187 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -116.823-110.594 1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -114.569-110.946 2.944 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -116.405-113.971 0.582 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -112.370-111.902 2.430 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -114.189-114.783 -0.112 1.00 0.00 H new ATOM 0 HZ PHE A 45 -112.165-113.684 0.752 1.00 0.00 H new ATOM 194 N GLN A 46 -118.338-109.984 4.557 1.00 0.00 N ATOM 195 CA GLN A 46 -119.220-108.853 4.844 1.00 0.00 C ATOM 196 C GLN A 46 -118.462-107.527 5.050 1.00 0.00 C ATOM 197 O GLN A 46 -117.238-107.510 5.206 1.00 0.00 O ATOM 198 CB GLN A 46 -120.143-109.166 6.053 1.00 0.00 C ATOM 199 CG GLN A 46 -119.556-109.065 7.476 1.00 0.00 C ATOM 200 CD GLN A 46 -120.720-109.225 8.450 1.00 0.00 C ATOM 201 OE1 GLN A 46 -121.435-108.272 8.761 1.00 0.00 O ATOM 202 NE2 GLN A 46 -120.965-110.465 8.914 1.00 0.00 N ATOM 0 H GLN A 46 -117.500-109.983 5.138 1.00 0.00 H new ATOM 0 HA GLN A 46 -119.839-108.711 3.958 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -120.998-108.493 5.999 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -120.526-110.178 5.924 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -118.806-109.839 7.640 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -119.060-108.105 7.622 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -120.359-111.240 8.643 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -121.756-110.630 9.536 1.00 0.00 H new ATOM 211 N SER A 47 -119.206-106.378 5.092 1.00 0.00 N ATOM 212 CA SER A 47 -118.683-105.020 5.353 1.00 0.00 C ATOM 213 C SER A 47 -119.604-104.200 6.287 1.00 0.00 C ATOM 214 O SER A 47 -120.754-104.559 6.554 1.00 0.00 O ATOM 215 CB SER A 47 -118.409-104.225 4.030 1.00 0.00 C ATOM 216 OG SER A 47 -117.567-103.072 4.195 1.00 0.00 O ATOM 0 H SER A 47 -120.214-106.384 4.939 1.00 0.00 H new ATOM 0 HA SER A 47 -117.732-105.166 5.865 1.00 0.00 H new ATOM 0 HB2 SER A 47 -117.948-104.896 3.306 1.00 0.00 H new ATOM 0 HB3 SER A 47 -119.362-103.907 3.608 1.00 0.00 H new ATOM 0 HG SER A 47 -116.643-103.361 4.346 1.00 0.00 H new ATOM 222 N TYR A 48 -119.075-103.043 6.794 1.00 0.00 N ATOM 223 CA TYR A 48 -119.708-102.048 7.659 1.00 0.00 C ATOM 224 C TYR A 48 -119.882-100.819 6.764 1.00 0.00 C ATOM 225 O TYR A 48 -118.892-100.289 6.260 1.00 0.00 O ATOM 226 CB TYR A 48 -118.696-101.791 8.827 1.00 0.00 C ATOM 227 CG TYR A 48 -119.213-101.193 10.108 1.00 0.00 C ATOM 228 CD1 TYR A 48 -120.477-101.449 10.607 1.00 0.00 C ATOM 229 CD2 TYR A 48 -118.329-100.474 10.896 1.00 0.00 C ATOM 230 CE1 TYR A 48 -120.853-100.983 11.851 1.00 0.00 C ATOM 231 CE2 TYR A 48 -118.699-100.011 12.142 1.00 0.00 C ATOM 232 CZ TYR A 48 -119.966-100.259 12.618 1.00 0.00 C ATOM 233 OH TYR A 48 -120.372 -99.710 13.849 1.00 0.00 O ATOM 0 H TYR A 48 -118.114-102.780 6.578 1.00 0.00 H new ATOM 0 HA TYR A 48 -120.669-102.333 8.088 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -118.225-102.743 9.072 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -117.912-101.135 8.448 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -121.178-102.020 10.017 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -117.334-100.273 10.529 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -121.846-101.187 12.224 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -117.995 -99.455 12.743 1.00 0.00 H new ATOM 0 HH TYR A 48 -119.620 -99.232 14.258 1.00 0.00 H new ATOM 243 N VAL A 49 -121.129-100.368 6.480 1.00 0.00 N ATOM 244 CA VAL A 49 -121.387 -99.377 5.432 1.00 0.00 C ATOM 245 C VAL A 49 -121.997 -98.136 6.036 1.00 0.00 C ATOM 246 O VAL A 49 -122.792 -98.226 6.975 1.00 0.00 O ATOM 247 CB VAL A 49 -122.281 -99.973 4.326 1.00 0.00 C ATOM 248 CG1 VAL A 49 -122.515 -98.991 3.153 1.00 0.00 C ATOM 249 CG2 VAL A 49 -121.605-101.238 3.749 1.00 0.00 C ATOM 0 H VAL A 49 -121.967-100.682 6.970 1.00 0.00 H new ATOM 0 HA VAL A 49 -120.442 -99.096 4.966 1.00 0.00 H new ATOM 0 HB VAL A 49 -123.243-100.198 4.786 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -123.151 -99.464 2.404 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -123.001 -98.089 3.525 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -121.558 -98.728 2.702 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -122.234-101.662 2.967 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -120.634-100.973 3.330 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -121.469-101.972 4.543 1.00 0.00 H new ATOM 259 N GLU A 50 -121.630 -96.940 5.485 1.00 0.00 N ATOM 260 CA GLU A 50 -122.121 -95.632 5.891 1.00 0.00 C ATOM 261 C GLU A 50 -123.375 -95.215 5.122 1.00 0.00 C ATOM 262 O GLU A 50 -123.526 -95.432 3.916 1.00 0.00 O ATOM 263 CB GLU A 50 -120.993 -94.558 5.875 1.00 0.00 C ATOM 264 CG GLU A 50 -120.336 -94.226 4.514 1.00 0.00 C ATOM 265 CD GLU A 50 -121.136 -93.188 3.722 1.00 0.00 C ATOM 266 OE1 GLU A 50 -121.378 -92.079 4.272 1.00 0.00 O ATOM 267 OE2 GLU A 50 -121.509 -93.488 2.556 1.00 0.00 O ATOM 0 H GLU A 50 -120.958 -96.884 4.719 1.00 0.00 H new ATOM 0 HA GLU A 50 -122.438 -95.715 6.931 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -121.403 -93.635 6.284 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -120.207 -94.886 6.556 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -119.326 -93.852 4.682 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -120.245 -95.138 3.925 1.00 0.00 H new ATOM 274 N GLN A 51 -124.324 -94.598 5.861 1.00 0.00 N ATOM 275 CA GLN A 51 -125.598 -94.169 5.319 1.00 0.00 C ATOM 276 C GLN A 51 -126.021 -92.870 5.972 1.00 0.00 C ATOM 277 O GLN A 51 -125.620 -92.572 7.096 1.00 0.00 O ATOM 278 CB GLN A 51 -126.665 -95.268 5.568 1.00 0.00 C ATOM 279 CG GLN A 51 -128.043 -95.013 4.915 1.00 0.00 C ATOM 280 CD GLN A 51 -128.970 -96.183 5.212 1.00 0.00 C ATOM 281 OE1 GLN A 51 -128.864 -96.829 6.255 1.00 0.00 O ATOM 282 NE2 GLN A 51 -129.912 -96.476 4.279 1.00 0.00 N ATOM 0 H GLN A 51 -124.211 -94.390 6.853 1.00 0.00 H new ATOM 0 HA GLN A 51 -125.500 -94.006 4.246 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -126.277 -96.218 5.199 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -126.806 -95.377 6.643 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -128.473 -94.088 5.298 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -127.930 -94.889 3.838 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -129.974 -95.922 3.425 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -130.558 -97.251 4.432 1.00 0.00 H new ATOM 291 N SER A 52 -126.864 -92.078 5.265 1.00 0.00 N ATOM 292 CA SER A 52 -127.482 -90.826 5.698 1.00 0.00 C ATOM 293 C SER A 52 -128.161 -90.292 4.462 1.00 0.00 C ATOM 294 O SER A 52 -127.505 -89.988 3.471 1.00 0.00 O ATOM 295 CB SER A 52 -126.539 -89.740 6.293 1.00 0.00 C ATOM 296 OG SER A 52 -126.189 -90.086 7.631 1.00 0.00 O ATOM 0 H SER A 52 -127.141 -92.324 4.315 1.00 0.00 H new ATOM 0 HA SER A 52 -128.143 -91.049 6.536 1.00 0.00 H new ATOM 0 HB2 SER A 52 -125.640 -89.652 5.683 1.00 0.00 H new ATOM 0 HB3 SER A 52 -127.032 -88.768 6.276 1.00 0.00 H new ATOM 0 HG SER A 52 -125.653 -90.906 7.627 1.00 0.00 H new ATOM 302 N ASN A 53 -129.517 -90.166 4.469 1.00 0.00 N ATOM 303 CA ASN A 53 -130.370 -89.788 3.339 1.00 0.00 C ATOM 304 C ASN A 53 -130.379 -88.277 3.003 1.00 0.00 C ATOM 305 O ASN A 53 -131.428 -87.650 2.856 1.00 0.00 O ATOM 306 CB ASN A 53 -131.796 -90.379 3.619 1.00 0.00 C ATOM 307 CG ASN A 53 -132.601 -90.729 2.360 1.00 0.00 C ATOM 308 OD1 ASN A 53 -132.916 -91.892 2.108 1.00 0.00 O ATOM 309 ND2 ASN A 53 -132.935 -89.695 1.554 1.00 0.00 N ATOM 0 H ASN A 53 -130.060 -90.338 5.315 1.00 0.00 H new ATOM 0 HA ASN A 53 -129.955 -90.214 2.425 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -131.690 -91.277 4.228 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -132.364 -89.659 4.209 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -133.468 -89.865 0.701 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -132.654 -88.746 1.799 1.00 0.00 H new ATOM 316 N GLY A 54 -129.168 -87.690 2.848 1.00 0.00 N ATOM 317 CA GLY A 54 -128.985 -86.291 2.495 1.00 0.00 C ATOM 318 C GLY A 54 -127.551 -85.873 2.658 1.00 0.00 C ATOM 319 O GLY A 54 -126.787 -85.820 1.699 1.00 0.00 O ATOM 0 H GLY A 54 -128.290 -88.194 2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -129.299 -86.129 1.464 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -129.622 -85.668 3.123 1.00 0.00 H new ATOM 323 N GLU A 55 -127.139 -85.546 3.902 1.00 0.00 N ATOM 324 CA GLU A 55 -125.788 -85.094 4.197 1.00 0.00 C ATOM 325 C GLU A 55 -125.433 -85.570 5.592 1.00 0.00 C ATOM 326 O GLU A 55 -126.014 -85.137 6.585 1.00 0.00 O ATOM 327 CB GLU A 55 -125.677 -83.545 4.054 1.00 0.00 C ATOM 328 CG GLU A 55 -124.245 -82.968 3.951 1.00 0.00 C ATOM 329 CD GLU A 55 -123.537 -82.893 5.305 1.00 0.00 C ATOM 330 OE1 GLU A 55 -124.055 -82.181 6.205 1.00 0.00 O ATOM 331 OE2 GLU A 55 -122.467 -83.543 5.452 1.00 0.00 O ATOM 0 H GLU A 55 -127.745 -85.593 4.721 1.00 0.00 H new ATOM 0 HA GLU A 55 -125.078 -85.514 3.484 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -126.233 -83.242 3.166 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -126.170 -83.086 4.911 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -123.657 -83.586 3.273 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -124.291 -81.970 3.514 1.00 0.00 H new ATOM 338 N GLY A 56 -124.443 -86.487 5.715 1.00 0.00 N ATOM 339 CA GLY A 56 -123.986 -86.981 7.004 1.00 0.00 C ATOM 340 C GLY A 56 -123.174 -88.223 6.788 1.00 0.00 C ATOM 341 O GLY A 56 -122.583 -88.407 5.725 1.00 0.00 O ATOM 0 H GLY A 56 -123.952 -86.893 4.919 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -123.387 -86.222 7.508 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -124.838 -87.195 7.649 1.00 0.00 H new ATOM 345 N GLY A 57 -123.135 -89.123 7.803 1.00 0.00 N ATOM 346 CA GLY A 57 -122.428 -90.399 7.723 1.00 0.00 C ATOM 347 C GLY A 57 -121.865 -90.878 9.035 1.00 0.00 C ATOM 348 O GLY A 57 -120.730 -91.346 9.088 1.00 0.00 O ATOM 0 H GLY A 57 -123.599 -88.971 8.698 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -123.110 -91.156 7.336 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -121.614 -90.306 7.004 1.00 0.00 H new ATOM 352 N LYS A 58 -122.647 -90.793 10.151 1.00 0.00 N ATOM 353 CA LYS A 58 -122.265 -91.238 11.499 1.00 0.00 C ATOM 354 C LYS A 58 -122.942 -92.564 11.856 1.00 0.00 C ATOM 355 O LYS A 58 -122.800 -93.105 12.951 1.00 0.00 O ATOM 356 CB LYS A 58 -122.619 -90.168 12.567 1.00 0.00 C ATOM 357 CG LYS A 58 -121.940 -88.813 12.307 1.00 0.00 C ATOM 358 CD LYS A 58 -122.219 -87.801 13.427 1.00 0.00 C ATOM 359 CE LYS A 58 -121.564 -86.436 13.178 1.00 0.00 C ATOM 360 NZ LYS A 58 -121.855 -85.498 14.286 1.00 0.00 N ATOM 0 H LYS A 58 -123.587 -90.399 10.122 1.00 0.00 H new ATOM 0 HA LYS A 58 -121.185 -91.384 11.494 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -123.700 -90.028 12.589 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -122.324 -90.533 13.551 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -120.864 -88.960 12.212 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -122.292 -88.408 11.358 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -123.296 -87.668 13.529 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -121.857 -88.205 14.373 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -120.486 -86.559 13.075 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -121.929 -86.020 12.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -121.401 -84.582 14.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -122.883 -85.365 14.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -121.485 -85.887 15.177 1.00 0.00 H new ATOM 374 N THR A 59 -123.714 -93.084 10.871 1.00 0.00 N ATOM 375 CA THR A 59 -124.519 -94.294 10.863 1.00 0.00 C ATOM 376 C THR A 59 -123.771 -95.399 10.136 1.00 0.00 C ATOM 377 O THR A 59 -123.696 -95.384 8.909 1.00 0.00 O ATOM 378 CB THR A 59 -125.857 -94.069 10.135 1.00 0.00 C ATOM 379 OG1 THR A 59 -126.431 -92.810 10.467 1.00 0.00 O ATOM 380 CG2 THR A 59 -126.862 -95.166 10.518 1.00 0.00 C ATOM 0 H THR A 59 -123.784 -92.602 9.975 1.00 0.00 H new ATOM 0 HA THR A 59 -124.713 -94.570 11.900 1.00 0.00 H new ATOM 0 HB THR A 59 -125.646 -94.097 9.066 1.00 0.00 H new ATOM 0 HG1 THR A 59 -127.278 -92.700 9.986 1.00 0.00 H new ATOM 0 HG21 THR A 59 -127.804 -94.995 9.996 1.00 0.00 H new ATOM 0 HG22 THR A 59 -126.463 -96.140 10.236 1.00 0.00 H new ATOM 0 HG23 THR A 59 -127.034 -95.142 11.594 1.00 0.00 H new ATOM 388 N TYR A 60 -123.212 -96.396 10.867 1.00 0.00 N ATOM 389 CA TYR A 60 -122.491 -97.529 10.296 1.00 0.00 C ATOM 390 C TYR A 60 -123.272 -98.792 10.635 1.00 0.00 C ATOM 391 O TYR A 60 -123.587 -99.032 11.799 1.00 0.00 O ATOM 392 CB TYR A 60 -121.042 -97.637 10.862 1.00 0.00 C ATOM 393 CG TYR A 60 -120.337 -96.315 10.797 1.00 0.00 C ATOM 394 CD1 TYR A 60 -120.091 -95.710 9.581 1.00 0.00 C ATOM 395 CD2 TYR A 60 -119.994 -95.651 11.965 1.00 0.00 C ATOM 396 CE1 TYR A 60 -119.607 -94.418 9.535 1.00 0.00 C ATOM 397 CE2 TYR A 60 -119.499 -94.363 11.920 1.00 0.00 C ATOM 398 CZ TYR A 60 -119.348 -93.739 10.704 1.00 0.00 C ATOM 399 OH TYR A 60 -119.006 -92.378 10.652 1.00 0.00 O ATOM 0 H TYR A 60 -123.258 -96.422 11.886 1.00 0.00 H new ATOM 0 HA TYR A 60 -122.405 -97.394 9.218 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -121.077 -97.984 11.895 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -120.481 -98.380 10.295 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -120.278 -96.249 8.664 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -120.115 -96.145 12.918 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -119.432 -93.940 8.582 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -119.233 -93.850 12.832 1.00 0.00 H new ATOM 0 HH TYR A 60 -119.630 -91.906 10.062 1.00 0.00 H new ATOM 409 N LYS A 61 -123.601 -99.639 9.628 1.00 0.00 N ATOM 410 CA LYS A 61 -124.409-100.838 9.822 1.00 0.00 C ATOM 411 C LYS A 61 -123.917-101.930 8.903 1.00 0.00 C ATOM 412 O LYS A 61 -123.394-101.635 7.827 1.00 0.00 O ATOM 413 CB LYS A 61 -125.922-100.548 9.610 1.00 0.00 C ATOM 414 CG LYS A 61 -126.277 -99.867 8.274 1.00 0.00 C ATOM 415 CD LYS A 61 -127.783 -99.586 8.116 1.00 0.00 C ATOM 416 CE LYS A 61 -128.359 -98.613 9.158 1.00 0.00 C ATOM 417 NZ LYS A 61 -129.802 -98.373 8.921 1.00 0.00 N ATOM 0 H LYS A 61 -123.306 -99.497 8.662 1.00 0.00 H new ATOM 0 HA LYS A 61 -124.300-101.173 10.853 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -126.469-101.488 9.677 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -126.273 -99.916 10.426 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -125.729 -98.928 8.196 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -125.944-100.500 7.451 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -127.962 -99.181 7.120 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -128.325-100.530 8.179 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -128.214 -99.019 10.159 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -127.818 -97.668 9.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -130.201 -97.839 9.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -129.924 -97.827 8.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -130.296 -99.284 8.833 1.00 0.00 H new ATOM 431 N TRP A 62 -124.060-103.210 9.349 1.00 0.00 N ATOM 432 CA TRP A 62 -123.593-104.440 8.733 1.00 0.00 C ATOM 433 C TRP A 62 -124.552-105.086 7.717 1.00 0.00 C ATOM 434 O TRP A 62 -125.748-105.279 7.961 1.00 0.00 O ATOM 435 CB TRP A 62 -123.258-105.453 9.870 1.00 0.00 C ATOM 436 CG TRP A 62 -122.210-104.965 10.871 1.00 0.00 C ATOM 437 CD1 TRP A 62 -122.342-104.418 12.119 1.00 0.00 C ATOM 438 CD2 TRP A 62 -120.798-105.025 10.621 1.00 0.00 C ATOM 439 NE1 TRP A 62 -121.109-104.126 12.640 1.00 0.00 N ATOM 440 CE2 TRP A 62 -120.160-104.491 11.731 1.00 0.00 C ATOM 441 CE3 TRP A 62 -120.091-105.481 9.554 1.00 0.00 C ATOM 442 CZ2 TRP A 62 -118.814-104.392 11.793 1.00 0.00 C ATOM 443 CZ3 TRP A 62 -118.715-105.409 9.618 1.00 0.00 C ATOM 444 CH2 TRP A 62 -118.083-104.867 10.725 1.00 0.00 C ATOM 0 H TRP A 62 -124.549-103.400 10.224 1.00 0.00 H new ATOM 0 HA TRP A 62 -122.717-104.173 8.141 1.00 0.00 H new ATOM 0 HB2 TRP A 62 -124.175-105.689 10.410 1.00 0.00 H new ATOM 0 HB3 TRP A 62 -122.906-106.381 9.419 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -123.282-104.242 12.620 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -120.931-103.707 13.553 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -120.589-105.886 8.686 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -118.326-103.955 12.652 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -118.123-105.780 8.794 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -117.005-104.816 10.752 1.00 0.00 H new ATOM 455 N VAL A 63 -123.970-105.445 6.537 1.00 0.00 N ATOM 456 CA VAL A 63 -124.595-106.113 5.398 1.00 0.00 C ATOM 457 C VAL A 63 -123.543-107.062 4.832 1.00 0.00 C ATOM 458 O VAL A 63 -122.343-106.836 5.013 1.00 0.00 O ATOM 459 CB VAL A 63 -125.108-105.169 4.291 1.00 0.00 C ATOM 460 CG1 VAL A 63 -126.370-104.432 4.786 1.00 0.00 C ATOM 461 CG2 VAL A 63 -124.027-104.157 3.843 1.00 0.00 C ATOM 0 H VAL A 63 -122.983-105.254 6.363 1.00 0.00 H new ATOM 0 HA VAL A 63 -125.491-106.624 5.751 1.00 0.00 H new ATOM 0 HB VAL A 63 -125.356-105.774 3.419 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -126.732-103.765 4.004 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -127.144-105.160 5.030 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -126.126-103.850 5.675 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -124.433-103.513 3.063 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -123.723-103.548 4.695 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -123.162-104.696 3.456 1.00 0.00 H new ATOM 471 N ASP A 64 -123.970-108.143 4.110 1.00 0.00 N ATOM 472 CA ASP A 64 -123.114-109.161 3.481 1.00 0.00 C ATOM 473 C ASP A 64 -122.633-108.735 2.095 1.00 0.00 C ATOM 474 O ASP A 64 -123.334-108.019 1.384 1.00 0.00 O ATOM 475 CB ASP A 64 -123.822-110.541 3.376 1.00 0.00 C ATOM 476 CG ASP A 64 -124.163-111.043 4.781 1.00 0.00 C ATOM 477 OD1 ASP A 64 -123.211-111.277 5.574 1.00 0.00 O ATOM 478 OD2 ASP A 64 -125.378-111.199 5.079 1.00 0.00 O ATOM 0 H ASP A 64 -124.962-108.322 3.953 1.00 0.00 H new ATOM 0 HA ASP A 64 -122.249-109.260 4.136 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -124.730-110.452 2.779 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -123.175-111.257 2.869 1.00 0.00 H new ATOM 483 N GLU A 65 -121.395-109.137 1.709 1.00 0.00 N ATOM 484 CA GLU A 65 -120.728-108.763 0.469 1.00 0.00 C ATOM 485 C GLU A 65 -120.848-109.849 -0.583 1.00 0.00 C ATOM 486 O GLU A 65 -121.325-109.612 -1.691 1.00 0.00 O ATOM 487 CB GLU A 65 -119.226-108.428 0.727 1.00 0.00 C ATOM 488 CG GLU A 65 -118.593-107.468 -0.299 1.00 0.00 C ATOM 489 CD GLU A 65 -119.240-106.086 -0.233 1.00 0.00 C ATOM 490 OE1 GLU A 65 -119.199-105.460 0.860 1.00 0.00 O ATOM 491 OE2 GLU A 65 -119.781-105.634 -1.278 1.00 0.00 O ATOM 0 H GLU A 65 -120.825-109.755 2.287 1.00 0.00 H new ATOM 0 HA GLU A 65 -121.228-107.872 0.089 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -119.131-107.990 1.720 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -118.657-109.358 0.733 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -117.523-107.381 -0.108 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -118.706-107.878 -1.303 1.00 0.00 H new ATOM 498 N PHE A 66 -120.393-111.080 -0.241 1.00 0.00 N ATOM 499 CA PHE A 66 -120.418-112.228 -1.129 1.00 0.00 C ATOM 500 C PHE A 66 -120.133-113.430 -0.241 1.00 0.00 C ATOM 501 O PHE A 66 -119.804-113.293 0.938 1.00 0.00 O ATOM 502 CB PHE A 66 -119.523-112.123 -2.433 1.00 0.00 C ATOM 503 CG PHE A 66 -118.040-111.959 -2.202 1.00 0.00 C ATOM 504 CD1 PHE A 66 -117.504-110.771 -1.746 1.00 0.00 C ATOM 505 CD2 PHE A 66 -117.178-113.006 -2.446 1.00 0.00 C ATOM 506 CE1 PHE A 66 -116.174-110.670 -1.401 1.00 0.00 C ATOM 507 CE2 PHE A 66 -115.839-112.904 -2.143 1.00 0.00 C ATOM 508 CZ PHE A 66 -115.328-111.746 -1.570 1.00 0.00 C ATOM 0 H PHE A 66 -119.997-111.287 0.676 1.00 0.00 H new ATOM 0 HA PHE A 66 -121.396-112.313 -1.603 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -119.681-113.020 -3.032 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -119.875-111.278 -3.025 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -118.141-109.903 -1.658 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -117.558-113.919 -2.881 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -115.792-109.744 -0.996 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -115.179-113.733 -2.353 1.00 0.00 H new ATOM 0 HZ PHE A 66 -114.294-111.690 -1.264 1.00 0.00 H new ATOM 518 N THR A 67 -120.264-114.651 -0.786 1.00 0.00 N ATOM 519 CA THR A 67 -120.052-115.912 -0.079 1.00 0.00 C ATOM 520 C THR A 67 -119.373-116.735 -1.148 1.00 0.00 C ATOM 521 O THR A 67 -119.830-116.772 -2.295 1.00 0.00 O ATOM 522 CB THR A 67 -121.356-116.566 0.463 1.00 0.00 C ATOM 523 OG1 THR A 67 -121.195-117.889 0.982 1.00 0.00 O ATOM 524 CG2 THR A 67 -122.496-116.609 -0.572 1.00 0.00 C ATOM 0 H THR A 67 -120.529-114.785 -1.762 1.00 0.00 H new ATOM 0 HA THR A 67 -119.472-115.801 0.837 1.00 0.00 H new ATOM 0 HB THR A 67 -121.619-115.900 1.285 1.00 0.00 H new ATOM 0 HG1 THR A 67 -122.059-118.223 1.301 1.00 0.00 H new ATOM 0 HG21 THR A 67 -123.374-117.077 -0.127 1.00 0.00 H new ATOM 0 HG22 THR A 67 -122.744-115.594 -0.882 1.00 0.00 H new ATOM 0 HG23 THR A 67 -122.178-117.186 -1.440 1.00 0.00 H new ATOM 532 N ALA A 68 -118.263-117.410 -0.775 1.00 0.00 N ATOM 533 CA ALA A 68 -117.525-118.220 -1.747 1.00 0.00 C ATOM 534 C ALA A 68 -116.683-119.330 -1.137 1.00 0.00 C ATOM 535 O ALA A 68 -116.302-119.304 0.035 1.00 0.00 O ATOM 536 CB ALA A 68 -116.604-117.330 -2.630 1.00 0.00 C ATOM 0 H ALA A 68 -117.873-117.407 0.168 1.00 0.00 H new ATOM 0 HA ALA A 68 -118.300-118.697 -2.347 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -116.068-117.956 -3.343 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -117.210-116.603 -3.170 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -115.888-116.807 -1.996 1.00 0.00 H new ATOM 542 N ALA A 69 -116.310-120.338 -1.983 1.00 0.00 N ATOM 543 CA ALA A 69 -115.379-121.414 -1.662 1.00 0.00 C ATOM 544 C ALA A 69 -113.975-120.885 -2.006 1.00 0.00 C ATOM 545 O ALA A 69 -113.686-120.554 -3.148 1.00 0.00 O ATOM 546 CB ALA A 69 -115.770-122.683 -2.455 1.00 0.00 C ATOM 0 H ALA A 69 -116.674-120.406 -2.934 1.00 0.00 H new ATOM 0 HA ALA A 69 -115.402-121.701 -0.611 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -115.076-123.489 -2.217 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -116.782-122.984 -2.184 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -115.728-122.472 -3.523 1.00 0.00 H new ATOM 552 N ALA A 70 -113.113-120.707 -0.985 1.00 0.00 N ATOM 553 CA ALA A 70 -111.880-119.955 -1.060 1.00 0.00 C ATOM 554 C ALA A 70 -111.184-120.093 0.271 1.00 0.00 C ATOM 555 O ALA A 70 -111.772-120.568 1.242 1.00 0.00 O ATOM 556 CB ALA A 70 -112.162-118.456 -1.220 1.00 0.00 C ATOM 0 H ALA A 70 -113.278-121.104 -0.060 1.00 0.00 H new ATOM 0 HA ALA A 70 -111.296-120.326 -1.902 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -111.219-117.912 -1.274 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -112.731-118.288 -2.135 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -112.737-118.101 -0.365 1.00 0.00 H new ATOM 562 N HIS A 71 -109.915-119.632 0.386 1.00 0.00 N ATOM 563 CA HIS A 71 -109.292-119.539 1.690 1.00 0.00 C ATOM 564 C HIS A 71 -108.484-118.259 1.691 1.00 0.00 C ATOM 565 O HIS A 71 -107.786-117.881 0.735 1.00 0.00 O ATOM 566 CB HIS A 71 -108.607-120.825 2.170 1.00 0.00 C ATOM 567 CG HIS A 71 -108.312-120.905 3.631 1.00 0.00 C ATOM 568 ND1 HIS A 71 -109.286-121.074 4.588 1.00 0.00 N ATOM 569 CD2 HIS A 71 -107.126-120.893 4.295 1.00 0.00 C ATOM 570 CE1 HIS A 71 -108.654-121.143 5.782 1.00 0.00 C ATOM 571 NE2 HIS A 71 -107.343-121.042 5.653 1.00 0.00 N ATOM 0 H HIS A 71 -109.332-119.331 -0.395 1.00 0.00 H new ATOM 0 HA HIS A 71 -110.036-119.462 2.483 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -109.239-121.671 1.901 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -107.671-120.939 1.624 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -110.291-121.135 4.428 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -106.157-120.783 3.831 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -109.161-121.266 6.728 1.00 0.00 H new ATOM 579 N VAL A 72 -108.729-117.500 2.789 1.00 0.00 N ATOM 580 CA VAL A 72 -108.376-116.105 3.029 1.00 0.00 C ATOM 581 C VAL A 72 -107.588-116.144 4.349 1.00 0.00 C ATOM 582 O VAL A 72 -108.192-116.204 5.408 1.00 0.00 O ATOM 583 CB VAL A 72 -109.766-115.337 3.117 1.00 0.00 C ATOM 584 CG1 VAL A 72 -109.889-113.785 3.323 1.00 0.00 C ATOM 585 CG2 VAL A 72 -110.642-115.662 1.885 1.00 0.00 C ATOM 0 H VAL A 72 -109.222-117.896 3.589 1.00 0.00 H new ATOM 0 HA VAL A 72 -107.769-115.603 2.275 1.00 0.00 H new ATOM 0 HB VAL A 72 -110.074-115.733 4.085 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -110.942-113.504 3.349 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -109.415-113.504 4.263 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -109.396-113.268 2.499 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -111.589-115.128 1.961 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -110.123-115.352 0.978 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -110.832-116.735 1.846 1.00 0.00 H new ATOM 595 N GLN A 73 -106.214-116.149 4.348 1.00 0.00 N ATOM 596 CA GLN A 73 -105.367-116.171 5.557 1.00 0.00 C ATOM 597 C GLN A 73 -104.083-115.317 5.422 1.00 0.00 C ATOM 598 O GLN A 73 -103.870-114.734 4.358 1.00 0.00 O ATOM 599 CB GLN A 73 -105.169-117.615 6.145 1.00 0.00 C ATOM 600 CG GLN A 73 -106.243-117.928 7.228 1.00 0.00 C ATOM 601 CD GLN A 73 -105.800-118.954 8.278 1.00 0.00 C ATOM 602 OE1 GLN A 73 -104.979-118.642 9.144 1.00 0.00 O ATOM 603 NE2 GLN A 73 -106.360-120.185 8.190 1.00 0.00 N ATOM 0 H GLN A 73 -105.671-116.137 3.485 1.00 0.00 H new ATOM 0 HA GLN A 73 -105.927-115.655 6.337 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -105.231-118.350 5.343 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -104.173-117.701 6.580 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -106.513-117.001 7.734 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -107.143-118.296 6.735 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -107.034-120.387 7.452 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -106.107-120.910 8.862 1.00 0.00 H new ATOM 612 N PRO A 74 -103.225-115.097 6.465 1.00 0.00 N ATOM 613 CA PRO A 74 -101.963-114.324 6.417 1.00 0.00 C ATOM 614 C PRO A 74 -100.827-114.820 5.469 1.00 0.00 C ATOM 615 O PRO A 74 -100.814-115.982 5.071 1.00 0.00 O ATOM 616 CB PRO A 74 -101.529-114.198 7.887 1.00 0.00 C ATOM 617 CG PRO A 74 -102.835-114.317 8.665 1.00 0.00 C ATOM 618 CD PRO A 74 -103.597-115.367 7.859 1.00 0.00 C ATOM 0 HA PRO A 74 -102.162-113.366 5.936 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -100.825-114.983 8.165 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -101.035-113.245 8.078 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -102.668-114.636 9.694 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -103.371-113.369 8.708 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -103.316-116.377 8.157 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -104.673-115.278 8.008 1.00 0.00 H new ATOM 626 N ILE A 75 -99.893-113.912 5.053 1.00 0.00 N ATOM 627 CA ILE A 75 -98.747-114.085 4.135 1.00 0.00 C ATOM 628 C ILE A 75 -97.636-115.105 4.486 1.00 0.00 C ATOM 629 O ILE A 75 -96.643-114.835 5.166 1.00 0.00 O ATOM 630 CB ILE A 75 -98.190-112.710 3.711 1.00 0.00 C ATOM 631 CG1 ILE A 75 -97.308-112.768 2.434 1.00 0.00 C ATOM 632 CG2 ILE A 75 -97.489-111.963 4.873 1.00 0.00 C ATOM 633 CD1 ILE A 75 -96.893-111.385 1.919 1.00 0.00 C ATOM 0 H ILE A 75 -99.938-112.951 5.391 1.00 0.00 H new ATOM 0 HA ILE A 75 -99.196-114.602 3.287 1.00 0.00 H new ATOM 0 HB ILE A 75 -99.065-112.118 3.442 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -96.413-113.353 2.646 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -97.853-113.292 1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -97.117-111.002 4.516 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -98.201-111.799 5.682 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -96.655-112.561 5.240 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -96.279-111.499 1.026 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -97.783-110.805 1.676 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -96.321-110.867 2.689 1.00 0.00 H new ATOM 645 N SER A 76 -97.771-116.376 4.007 1.00 0.00 N ATOM 646 CA SER A 76 -96.843-117.517 4.185 1.00 0.00 C ATOM 647 C SER A 76 -97.044-118.259 5.501 1.00 0.00 C ATOM 648 O SER A 76 -97.293-119.460 5.549 1.00 0.00 O ATOM 649 CB SER A 76 -95.317-117.270 3.875 1.00 0.00 C ATOM 650 OG SER A 76 -94.644-116.414 4.806 1.00 0.00 O ATOM 0 H SER A 76 -98.585-116.640 3.452 1.00 0.00 H new ATOM 0 HA SER A 76 -97.155-118.172 3.371 1.00 0.00 H new ATOM 0 HB2 SER A 76 -94.805-118.232 3.853 1.00 0.00 H new ATOM 0 HB3 SER A 76 -95.229-116.839 2.878 1.00 0.00 H new ATOM 0 HG SER A 76 -95.166-115.594 4.933 1.00 0.00 H new ATOM 656 N GLN A 77 -96.975-117.500 6.612 1.00 0.00 N ATOM 657 CA GLN A 77 -97.264-117.918 7.972 1.00 0.00 C ATOM 658 C GLN A 77 -98.586-117.278 8.344 1.00 0.00 C ATOM 659 O GLN A 77 -98.883-116.147 7.969 1.00 0.00 O ATOM 660 CB GLN A 77 -96.111-117.638 8.969 1.00 0.00 C ATOM 661 CG GLN A 77 -95.024-118.739 8.907 1.00 0.00 C ATOM 662 CD GLN A 77 -95.601-120.107 9.307 1.00 0.00 C ATOM 663 OE1 GLN A 77 -96.424-120.214 10.221 1.00 0.00 O ATOM 664 NE2 GLN A 77 -95.173-121.179 8.601 1.00 0.00 N ATOM 0 H GLN A 77 -96.697-116.520 6.566 1.00 0.00 H new ATOM 0 HA GLN A 77 -97.350-119.003 8.030 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -95.663-116.670 8.745 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -96.511-117.577 9.981 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -94.614-118.794 7.898 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -94.200-118.479 9.572 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -94.492-121.057 7.851 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -95.531-122.109 8.818 1.00 0.00 H new ATOM 673 N GLU A 78 -99.421-118.111 9.016 1.00 0.00 N ATOM 674 CA GLU A 78 -100.840-117.920 9.279 1.00 0.00 C ATOM 675 C GLU A 78 -101.251-117.258 10.584 1.00 0.00 C ATOM 676 O GLU A 78 -102.434-117.276 10.923 1.00 0.00 O ATOM 677 CB GLU A 78 -101.520-119.324 9.245 1.00 0.00 C ATOM 678 CG GLU A 78 -101.247-120.168 7.978 1.00 0.00 C ATOM 679 CD GLU A 78 -101.958-119.613 6.742 1.00 0.00 C ATOM 680 OE1 GLU A 78 -101.519-118.555 6.219 1.00 0.00 O ATOM 681 OE2 GLU A 78 -102.944-120.258 6.292 1.00 0.00 O ATOM 0 H GLU A 78 -99.081-118.989 9.408 1.00 0.00 H new ATOM 0 HA GLU A 78 -101.156-117.219 8.507 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -101.188-119.890 10.115 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -102.597-119.189 9.345 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -100.174-120.202 7.792 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -101.573-121.194 8.151 1.00 0.00 H new ATOM 688 N GLU A 79 -100.309-116.712 11.403 1.00 0.00 N ATOM 689 CA GLU A 79 -100.493-116.089 12.733 1.00 0.00 C ATOM 690 C GLU A 79 -100.912-117.041 13.871 1.00 0.00 C ATOM 691 O GLU A 79 -100.428-116.954 14.995 1.00 0.00 O ATOM 692 CB GLU A 79 -101.227-114.708 12.735 1.00 0.00 C ATOM 693 CG GLU A 79 -102.766-114.704 12.851 1.00 0.00 C ATOM 694 CD GLU A 79 -103.278-113.264 12.774 1.00 0.00 C ATOM 695 OE1 GLU A 79 -102.924-112.460 13.677 1.00 0.00 O ATOM 696 OE2 GLU A 79 -104.032-112.952 11.813 1.00 0.00 O ATOM 0 H GLU A 79 -99.328-116.698 11.123 1.00 0.00 H new ATOM 0 HA GLU A 79 -99.468-115.831 12.998 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -100.829-114.120 13.562 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -100.960-114.187 11.815 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -103.204-115.300 12.050 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -103.072-115.161 13.792 1.00 0.00 H new ATOM 703 N TYR A 80 -101.805-118.007 13.514 1.00 0.00 N ATOM 704 CA TYR A 80 -102.407-119.144 14.198 1.00 0.00 C ATOM 705 C TYR A 80 -101.413-120.275 14.529 1.00 0.00 C ATOM 706 O TYR A 80 -101.674-121.134 15.369 1.00 0.00 O ATOM 707 CB TYR A 80 -103.525-119.615 13.207 1.00 0.00 C ATOM 708 CG TYR A 80 -104.437-120.746 13.623 1.00 0.00 C ATOM 709 CD1 TYR A 80 -104.884-120.919 14.922 1.00 0.00 C ATOM 710 CD2 TYR A 80 -104.884-121.618 12.645 1.00 0.00 C ATOM 711 CE1 TYR A 80 -105.753-121.949 15.235 1.00 0.00 C ATOM 712 CE2 TYR A 80 -105.756-122.641 12.950 1.00 0.00 C ATOM 713 CZ TYR A 80 -106.192-122.805 14.247 1.00 0.00 C ATOM 714 OH TYR A 80 -107.092-123.839 14.563 1.00 0.00 O ATOM 0 H TYR A 80 -102.169-117.978 12.562 1.00 0.00 H new ATOM 0 HA TYR A 80 -102.788-118.863 15.180 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -104.151-118.752 12.982 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -103.039-119.908 12.276 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -104.552-120.244 15.697 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -104.544-121.495 11.627 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -106.088-122.083 16.253 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -106.096-123.312 12.175 1.00 0.00 H new ATOM 0 HH TYR A 80 -107.301-124.349 13.753 1.00 0.00 H new ATOM 724 N TYR A 81 -100.235-120.277 13.854 1.00 0.00 N ATOM 725 CA TYR A 81 -99.125-121.202 14.049 1.00 0.00 C ATOM 726 C TYR A 81 -97.930-120.381 14.516 1.00 0.00 C ATOM 727 O TYR A 81 -97.590-120.364 15.692 1.00 0.00 O ATOM 728 CB TYR A 81 -98.778-122.025 12.767 1.00 0.00 C ATOM 729 CG TYR A 81 -99.990-122.758 12.241 1.00 0.00 C ATOM 730 CD1 TYR A 81 -100.728-123.621 13.036 1.00 0.00 C ATOM 731 CD2 TYR A 81 -100.390-122.570 10.931 1.00 0.00 C ATOM 732 CE1 TYR A 81 -101.857-124.241 12.534 1.00 0.00 C ATOM 733 CE2 TYR A 81 -101.502-123.205 10.416 1.00 0.00 C ATOM 734 CZ TYR A 81 -102.245-124.033 11.227 1.00 0.00 C ATOM 735 OH TYR A 81 -103.402-124.665 10.730 1.00 0.00 O ATOM 0 H TYR A 81 -100.039-119.592 13.124 1.00 0.00 H new ATOM 0 HA TYR A 81 -99.407-121.946 14.794 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -98.392-121.357 11.997 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -97.988-122.741 12.994 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -100.419-123.810 14.053 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -99.818-121.910 10.295 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -102.439-124.892 13.169 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -101.787-123.054 9.385 1.00 0.00 H new ATOM 0 HH TYR A 81 -103.536-124.412 9.793 1.00 0.00 H new ATOM 745 N LYS A 82 -97.259-119.646 13.592 1.00 0.00 N ATOM 746 CA LYS A 82 -96.110-118.796 13.886 1.00 0.00 C ATOM 747 C LYS A 82 -96.423-117.313 13.669 1.00 0.00 C ATOM 748 O LYS A 82 -96.546-116.829 12.540 1.00 0.00 O ATOM 749 CB LYS A 82 -94.871-119.205 13.045 1.00 0.00 C ATOM 750 CG LYS A 82 -94.448-120.667 13.269 1.00 0.00 C ATOM 751 CD LYS A 82 -93.288-121.100 12.357 1.00 0.00 C ATOM 752 CE LYS A 82 -92.923-122.587 12.488 1.00 0.00 C ATOM 753 NZ LYS A 82 -94.040-123.458 12.050 1.00 0.00 N ATOM 0 H LYS A 82 -97.519-119.638 12.606 1.00 0.00 H new ATOM 0 HA LYS A 82 -95.879-118.942 14.941 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -95.090-119.054 11.988 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -94.037-118.549 13.294 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -94.154-120.800 14.310 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -95.304-121.319 13.094 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -93.554-120.890 11.321 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -92.410-120.497 12.589 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -92.037-122.800 11.890 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -92.669-122.811 13.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -93.709-124.442 11.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -94.818-123.396 12.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -94.377-123.147 11.117 1.00 0.00 H new ATOM 767 N ALA A 83 -96.504-116.545 14.793 1.00 0.00 N ATOM 768 CA ALA A 83 -96.712-115.099 14.860 1.00 0.00 C ATOM 769 C ALA A 83 -95.398-114.363 15.132 1.00 0.00 C ATOM 770 O ALA A 83 -95.355-113.145 15.283 1.00 0.00 O ATOM 771 CB ALA A 83 -97.735-114.767 15.968 1.00 0.00 C ATOM 0 H ALA A 83 -96.419-116.959 15.721 1.00 0.00 H new ATOM 0 HA ALA A 83 -97.096-114.767 13.896 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -97.886-113.688 16.013 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -98.683-115.257 15.746 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -97.359-115.121 16.928 1.00 0.00 H new ATOM 777 N GLN A 84 -94.302-115.158 15.229 1.00 0.00 N ATOM 778 CA GLN A 84 -92.902-114.844 15.504 1.00 0.00 C ATOM 779 C GLN A 84 -92.623-114.264 16.892 1.00 0.00 C ATOM 780 O GLN A 84 -92.453-114.997 17.861 1.00 0.00 O ATOM 781 CB GLN A 84 -92.214-114.105 14.322 1.00 0.00 C ATOM 782 CG GLN A 84 -90.669-114.161 14.343 1.00 0.00 C ATOM 783 CD GLN A 84 -90.058-113.887 12.963 1.00 0.00 C ATOM 784 OE1 GLN A 84 -89.388-114.752 12.396 1.00 0.00 O ATOM 785 NE2 GLN A 84 -90.275-112.681 12.388 1.00 0.00 N ATOM 0 H GLN A 84 -94.410-116.164 15.096 1.00 0.00 H new ATOM 0 HA GLN A 84 -92.399-115.809 15.566 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -92.568-114.536 13.385 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -92.527-113.061 14.331 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -90.291-113.430 15.057 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -90.348-115.143 14.692 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -90.832-111.978 12.873 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -89.881-112.476 11.470 1.00 0.00 H new ATOM 794 N GLN A 85 -92.579-112.924 17.019 1.00 0.00 N ATOM 795 CA GLN A 85 -92.362-112.250 18.291 1.00 0.00 C ATOM 796 C GLN A 85 -92.556-110.774 18.025 1.00 0.00 C ATOM 797 O GLN A 85 -91.593-110.010 17.963 1.00 0.00 O ATOM 798 CB GLN A 85 -90.983-112.535 18.992 1.00 0.00 C ATOM 799 CG GLN A 85 -89.759-112.604 18.042 1.00 0.00 C ATOM 800 CD GLN A 85 -88.491-112.089 18.722 1.00 0.00 C ATOM 801 OE1 GLN A 85 -87.646-112.834 19.219 1.00 0.00 O ATOM 802 NE2 GLN A 85 -88.374-110.734 18.748 1.00 0.00 N ATOM 0 H GLN A 85 -92.695-112.285 16.232 1.00 0.00 H new ATOM 0 HA GLN A 85 -93.077-112.646 19.012 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -90.803-111.757 19.734 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -91.057-113.479 19.532 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -89.607-113.633 17.718 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -89.958-112.014 17.147 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -89.096-110.152 18.325 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -87.564-110.300 19.191 1.00 0.00 H new ATOM 811 N LEU A 86 -93.836-110.339 17.808 1.00 0.00 N ATOM 812 CA LEU A 86 -94.286-108.963 17.535 1.00 0.00 C ATOM 813 C LEU A 86 -94.007-108.497 16.099 1.00 0.00 C ATOM 814 O LEU A 86 -94.893-108.051 15.371 1.00 0.00 O ATOM 815 CB LEU A 86 -93.820-107.972 18.655 1.00 0.00 C ATOM 816 CG LEU A 86 -94.434-106.547 18.723 1.00 0.00 C ATOM 817 CD1 LEU A 86 -93.665-105.521 17.872 1.00 0.00 C ATOM 818 CD2 LEU A 86 -95.945-106.505 18.436 1.00 0.00 C ATOM 0 H LEU A 86 -94.619-110.992 17.823 1.00 0.00 H new ATOM 0 HA LEU A 86 -95.375-108.966 17.584 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -94.007-108.454 19.615 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -92.740-107.858 18.560 1.00 0.00 H new ATOM 0 HG LEU A 86 -94.318-106.250 19.765 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -94.142-104.545 17.960 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -92.635-105.455 18.224 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -93.672-105.835 16.828 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -96.299-105.476 18.502 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -96.136-106.891 17.435 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -96.471-107.118 19.168 1.00 0.00 H new ATOM 830 N GLN A 87 -92.729-108.637 15.671 1.00 0.00 N ATOM 831 CA GLN A 87 -92.201-108.366 14.350 1.00 0.00 C ATOM 832 C GLN A 87 -92.276-109.649 13.516 1.00 0.00 C ATOM 833 O GLN A 87 -91.483-110.578 13.654 1.00 0.00 O ATOM 834 CB GLN A 87 -90.750-107.836 14.471 1.00 0.00 C ATOM 835 CG GLN A 87 -90.123-107.358 13.142 1.00 0.00 C ATOM 836 CD GLN A 87 -88.700-106.865 13.411 1.00 0.00 C ATOM 837 OE1 GLN A 87 -87.874-107.610 13.944 1.00 0.00 O ATOM 838 NE2 GLN A 87 -88.415-105.596 13.033 1.00 0.00 N ATOM 0 H GLN A 87 -92.001-108.969 16.303 1.00 0.00 H new ATOM 0 HA GLN A 87 -92.789-107.598 13.848 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -90.738-107.009 15.181 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -90.124-108.624 14.889 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -90.109-108.173 12.418 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -90.723-106.558 12.709 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -89.135-105.020 12.596 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -87.481-105.216 13.186 1.00 0.00 H new ATOM 847 N THR A 88 -93.283-109.721 12.632 1.00 0.00 N ATOM 848 CA THR A 88 -93.595-110.809 11.728 1.00 0.00 C ATOM 849 C THR A 88 -94.237-110.041 10.601 1.00 0.00 C ATOM 850 O THR A 88 -94.650-108.915 10.907 1.00 0.00 O ATOM 851 CB THR A 88 -94.549-111.838 12.347 1.00 0.00 C ATOM 852 OG1 THR A 88 -94.572-113.035 11.579 1.00 0.00 O ATOM 853 CG2 THR A 88 -95.997-111.329 12.559 1.00 0.00 C ATOM 0 H THR A 88 -93.946-108.952 12.533 1.00 0.00 H new ATOM 0 HA THR A 88 -92.737-111.417 11.440 1.00 0.00 H new ATOM 0 HB THR A 88 -94.144-112.032 13.340 1.00 0.00 H new ATOM 0 HG1 THR A 88 -95.185-113.678 11.993 1.00 0.00 H new ATOM 0 HG21 THR A 88 -96.600-112.122 13.000 1.00 0.00 H new ATOM 0 HG22 THR A 88 -95.986-110.467 13.226 1.00 0.00 H new ATOM 0 HG23 THR A 88 -96.425-111.039 11.599 1.00 0.00 H new ATOM 861 N PRO A 89 -94.366-110.462 9.324 1.00 0.00 N ATOM 862 CA PRO A 89 -94.982-109.650 8.271 1.00 0.00 C ATOM 863 C PRO A 89 -96.507-109.517 8.461 1.00 0.00 C ATOM 864 O PRO A 89 -97.216-110.521 8.556 1.00 0.00 O ATOM 865 CB PRO A 89 -94.593-110.387 6.965 1.00 0.00 C ATOM 866 CG PRO A 89 -93.429-111.314 7.350 1.00 0.00 C ATOM 867 CD PRO A 89 -93.775-111.684 8.789 1.00 0.00 C ATOM 0 HA PRO A 89 -94.635-108.617 8.272 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.434-110.956 6.570 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -94.293-109.681 6.190 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -93.377-112.191 6.705 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -92.466-110.809 7.280 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -94.474-112.519 8.831 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -92.889-111.981 9.351 1.00 0.00 H new ATOM 875 N ILE A 90 -97.022-108.260 8.525 1.00 0.00 N ATOM 876 CA ILE A 90 -98.438-107.966 8.740 1.00 0.00 C ATOM 877 C ILE A 90 -99.137-107.847 7.389 1.00 0.00 C ATOM 878 O ILE A 90 -99.204-106.764 6.804 1.00 0.00 O ATOM 879 CB ILE A 90 -98.626-106.706 9.604 1.00 0.00 C ATOM 880 CG1 ILE A 90 -97.679-106.681 10.834 1.00 0.00 C ATOM 881 CG2 ILE A 90 -100.091-106.584 10.080 1.00 0.00 C ATOM 882 CD1 ILE A 90 -97.849-107.842 11.819 1.00 0.00 C ATOM 0 H ILE A 90 -96.447-107.423 8.426 1.00 0.00 H new ATOM 0 HA ILE A 90 -98.895-108.785 9.295 1.00 0.00 H new ATOM 0 HB ILE A 90 -98.372-105.856 8.971 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -96.649-106.677 10.478 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -97.834-105.745 11.371 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -100.202-105.687 10.689 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -100.751-106.519 9.215 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -100.355-107.460 10.673 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -97.141-107.729 12.640 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -98.865-107.839 12.213 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -97.662-108.785 11.306 1.00 0.00 H new ATOM 894 N GLY A 91 -99.648-108.982 6.853 1.00 0.00 N ATOM 895 CA GLY A 91 -100.246-109.018 5.536 1.00 0.00 C ATOM 896 C GLY A 91 -100.932-110.320 5.278 1.00 0.00 C ATOM 897 O GLY A 91 -100.666-111.342 5.912 1.00 0.00 O ATOM 0 H GLY A 91 -99.648-109.882 7.334 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -100.963-108.203 5.439 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -99.476-108.856 4.782 1.00 0.00 H new ATOM 901 N TYR A 92 -101.855-110.304 4.290 1.00 0.00 N ATOM 902 CA TYR A 92 -102.675-111.412 3.839 1.00 0.00 C ATOM 903 C TYR A 92 -102.262-111.919 2.468 1.00 0.00 C ATOM 904 O TYR A 92 -101.823-111.170 1.589 1.00 0.00 O ATOM 905 CB TYR A 92 -104.201-111.085 3.874 1.00 0.00 C ATOM 906 CG TYR A 92 -104.719-111.287 5.273 1.00 0.00 C ATOM 907 CD1 TYR A 92 -104.341-110.516 6.362 1.00 0.00 C ATOM 908 CD2 TYR A 92 -105.540-112.364 5.497 1.00 0.00 C ATOM 909 CE1 TYR A 92 -104.726-110.874 7.644 1.00 0.00 C ATOM 910 CE2 TYR A 92 -105.905-112.734 6.760 1.00 0.00 C ATOM 911 CZ TYR A 92 -105.497-112.003 7.843 1.00 0.00 C ATOM 912 OH TYR A 92 -105.851-112.466 9.127 1.00 0.00 O ATOM 0 H TYR A 92 -102.047-109.452 3.762 1.00 0.00 H new ATOM 0 HA TYR A 92 -102.499-112.216 4.554 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -104.372-110.057 3.555 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -104.739-111.728 3.178 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -103.742-109.630 6.210 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -105.906-112.932 4.655 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -104.424-110.271 8.487 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -106.520-113.610 6.905 1.00 0.00 H new ATOM 0 HH TYR A 92 -105.913-111.706 9.743 1.00 0.00 H new ATOM 922 N ASN A 93 -102.463-113.255 2.294 1.00 0.00 N ATOM 923 CA ASN A 93 -102.196-113.987 1.062 1.00 0.00 C ATOM 924 C ASN A 93 -103.421-114.866 0.874 1.00 0.00 C ATOM 925 O ASN A 93 -103.811-115.652 1.740 1.00 0.00 O ATOM 926 CB ASN A 93 -100.844-114.741 1.151 1.00 0.00 C ATOM 927 CG ASN A 93 -100.304-115.186 -0.206 1.00 0.00 C ATOM 928 OD1 ASN A 93 -101.029-115.395 -1.172 1.00 0.00 O ATOM 929 ND2 ASN A 93 -98.958-115.362 -0.271 1.00 0.00 N ATOM 0 H ASN A 93 -102.825-113.852 3.038 1.00 0.00 H new ATOM 0 HA ASN A 93 -102.064-113.353 0.185 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -100.109-114.096 1.632 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -100.967-115.616 1.789 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -98.526-115.676 -1.140 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -98.380-115.180 0.549 1.00 0.00 H new ATOM 936 N ILE A 94 -104.100-114.642 -0.276 1.00 0.00 N ATOM 937 CA ILE A 94 -105.452-115.113 -0.509 1.00 0.00 C ATOM 938 C ILE A 94 -105.666-115.606 -1.930 1.00 0.00 C ATOM 939 O ILE A 94 -105.286-114.921 -2.888 1.00 0.00 O ATOM 940 CB ILE A 94 -106.423-113.903 -0.380 1.00 0.00 C ATOM 941 CG1 ILE A 94 -106.150-112.907 0.781 1.00 0.00 C ATOM 942 CG2 ILE A 94 -107.903-114.377 -0.428 1.00 0.00 C ATOM 943 CD1 ILE A 94 -106.610-113.364 2.145 1.00 0.00 C ATOM 0 H ILE A 94 -103.707-114.124 -1.062 1.00 0.00 H new ATOM 0 HA ILE A 94 -105.625-115.917 0.206 1.00 0.00 H new ATOM 0 HB ILE A 94 -106.212-113.292 -1.258 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -105.079-112.710 0.824 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -106.639-111.961 0.549 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -108.564-113.515 -0.336 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -108.093-114.881 -1.376 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -108.091-115.068 0.394 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -106.373-112.599 2.884 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -107.687-113.532 2.129 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -106.102-114.292 2.408 1.00 0.00 H new ATOM 955 N TYR A 95 -106.438-116.728 -2.114 1.00 0.00 N ATOM 956 CA TYR A 95 -106.996-116.987 -3.441 1.00 0.00 C ATOM 957 C TYR A 95 -108.475-117.293 -3.225 1.00 0.00 C ATOM 958 O TYR A 95 -108.859-117.988 -2.272 1.00 0.00 O ATOM 959 CB TYR A 95 -106.179-117.914 -4.413 1.00 0.00 C ATOM 960 CG TYR A 95 -106.565-119.362 -4.407 1.00 0.00 C ATOM 961 CD1 TYR A 95 -107.631-119.786 -5.179 1.00 0.00 C ATOM 962 CD2 TYR A 95 -105.948-120.254 -3.562 1.00 0.00 C ATOM 963 CE1 TYR A 95 -108.130-121.061 -5.041 1.00 0.00 C ATOM 964 CE2 TYR A 95 -106.431-121.541 -3.448 1.00 0.00 C ATOM 965 CZ TYR A 95 -107.540-121.945 -4.166 1.00 0.00 C ATOM 966 OH TYR A 95 -108.117-123.222 -3.981 1.00 0.00 O ATOM 0 H TYR A 95 -106.665-117.415 -1.395 1.00 0.00 H new ATOM 0 HA TYR A 95 -106.897-116.099 -4.065 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -106.289-117.532 -5.428 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -105.122-117.837 -4.156 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -108.075-119.111 -5.896 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -105.086-119.947 -2.988 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -108.987-121.369 -5.621 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -105.937-122.241 -2.790 1.00 0.00 H new ATOM 0 HH TYR A 95 -108.242-123.389 -3.023 1.00 0.00 H new ATOM 976 N THR A 96 -109.338-116.732 -4.109 1.00 0.00 N ATOM 977 CA THR A 96 -110.779-116.996 -4.098 1.00 0.00 C ATOM 978 C THR A 96 -111.181-117.087 -5.562 1.00 0.00 C ATOM 979 O THR A 96 -110.423-116.570 -6.391 1.00 0.00 O ATOM 980 CB THR A 96 -111.577-115.928 -3.285 1.00 0.00 C ATOM 981 OG1 THR A 96 -112.957-116.218 -3.115 1.00 0.00 O ATOM 982 CG2 THR A 96 -111.528-114.503 -3.824 1.00 0.00 C ATOM 0 H THR A 96 -109.045-116.087 -4.843 1.00 0.00 H new ATOM 0 HA THR A 96 -111.019-117.924 -3.579 1.00 0.00 H new ATOM 0 HB THR A 96 -111.040-115.987 -2.338 1.00 0.00 H new ATOM 0 HG1 THR A 96 -113.380-115.503 -2.596 1.00 0.00 H new ATOM 0 HG21 THR A 96 -112.117-113.850 -3.180 1.00 0.00 H new ATOM 0 HG22 THR A 96 -110.495-114.157 -3.844 1.00 0.00 H new ATOM 0 HG23 THR A 96 -111.938-114.482 -4.834 1.00 0.00 H new ATOM 990 N PRO A 97 -112.319-117.687 -6.018 1.00 0.00 N ATOM 991 CA PRO A 97 -112.895-117.479 -7.357 1.00 0.00 C ATOM 992 C PRO A 97 -113.402-116.022 -7.488 1.00 0.00 C ATOM 993 O PRO A 97 -114.042-115.536 -6.556 1.00 0.00 O ATOM 994 CB PRO A 97 -114.020-118.531 -7.447 1.00 0.00 C ATOM 995 CG PRO A 97 -114.449-118.767 -5.998 1.00 0.00 C ATOM 996 CD PRO A 97 -113.133-118.607 -5.236 1.00 0.00 C ATOM 0 HA PRO A 97 -112.185-117.605 -8.175 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -114.852-118.170 -8.052 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -113.665-119.452 -7.910 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -115.197-118.044 -5.673 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -114.881-119.758 -5.859 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -113.309-118.216 -4.234 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -112.631-119.568 -5.120 1.00 0.00 H new ATOM 1004 N TYR A 98 -112.995-115.384 -8.618 1.00 0.00 N ATOM 1005 CA TYR A 98 -113.087-114.018 -9.132 1.00 0.00 C ATOM 1006 C TYR A 98 -113.043-112.793 -8.197 1.00 0.00 C ATOM 1007 O TYR A 98 -113.638-112.735 -7.122 1.00 0.00 O ATOM 1008 CB TYR A 98 -114.127-113.883 -10.294 1.00 0.00 C ATOM 1009 CG TYR A 98 -113.707-112.870 -11.345 1.00 0.00 C ATOM 1010 CD1 TYR A 98 -112.480-112.972 -11.989 1.00 0.00 C ATOM 1011 CD2 TYR A 98 -114.529-111.807 -11.671 1.00 0.00 C ATOM 1012 CE1 TYR A 98 -112.090-112.050 -12.942 1.00 0.00 C ATOM 1013 CE2 TYR A 98 -114.138-110.882 -12.619 1.00 0.00 C ATOM 1014 CZ TYR A 98 -112.918-110.993 -13.254 1.00 0.00 C ATOM 1015 OH TYR A 98 -112.553-109.995 -14.185 1.00 0.00 O ATOM 0 H TYR A 98 -112.500-115.946 -9.311 1.00 0.00 H new ATOM 0 HA TYR A 98 -112.071-113.924 -9.514 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -114.264-114.855 -10.767 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -115.092-113.591 -9.880 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -111.818-113.788 -11.740 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -115.485-111.699 -11.180 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -111.138-112.157 -13.441 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -114.795-110.062 -12.866 1.00 0.00 H new ATOM 0 HH TYR A 98 -111.599-110.076 -14.394 1.00 0.00 H new ATOM 1025 N ASP A 99 -112.277-111.751 -8.640 1.00 0.00 N ATOM 1026 CA ASP A 99 -111.990-110.485 -7.942 1.00 0.00 C ATOM 1027 C ASP A 99 -113.169-109.598 -7.547 1.00 0.00 C ATOM 1028 O ASP A 99 -113.594-108.689 -8.257 1.00 0.00 O ATOM 1029 CB ASP A 99 -110.846-109.627 -8.604 1.00 0.00 C ATOM 1030 CG ASP A 99 -111.178-108.951 -9.944 1.00 0.00 C ATOM 1031 OD1 ASP A 99 -111.682-109.653 -10.856 1.00 0.00 O ATOM 1032 OD2 ASP A 99 -110.927-107.723 -10.063 1.00 0.00 O ATOM 0 H ASP A 99 -111.821-111.788 -9.552 1.00 0.00 H new ATOM 0 HA ASP A 99 -111.630-110.883 -6.993 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -110.549-108.853 -7.897 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -109.980-110.272 -8.753 1.00 0.00 H new ATOM 1037 N ASP A 100 -113.658-109.866 -6.313 1.00 0.00 N ATOM 1038 CA ASP A 100 -114.678-109.128 -5.596 1.00 0.00 C ATOM 1039 C ASP A 100 -113.932-108.272 -4.586 1.00 0.00 C ATOM 1040 O ASP A 100 -113.044-107.508 -4.957 1.00 0.00 O ATOM 1041 CB ASP A 100 -115.720-110.052 -4.905 1.00 0.00 C ATOM 1042 CG ASP A 100 -116.477-110.870 -5.956 1.00 0.00 C ATOM 1043 OD1 ASP A 100 -117.130-110.247 -6.835 1.00 0.00 O ATOM 1044 OD2 ASP A 100 -116.417-112.126 -5.886 1.00 0.00 O ATOM 0 H ASP A 100 -113.315-110.660 -5.772 1.00 0.00 H new ATOM 0 HA ASP A 100 -115.266-108.522 -6.285 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -115.218-110.720 -4.205 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -116.422-109.452 -4.325 1.00 0.00 H new ATOM 1049 N ARG A 101 -114.239-108.350 -3.269 1.00 0.00 N ATOM 1050 CA ARG A 101 -113.544-107.472 -2.337 1.00 0.00 C ATOM 1051 C ARG A 101 -112.425-108.115 -1.544 1.00 0.00 C ATOM 1052 O ARG A 101 -111.318-107.582 -1.552 1.00 0.00 O ATOM 1053 CB ARG A 101 -114.547-106.849 -1.332 1.00 0.00 C ATOM 1054 CG ARG A 101 -115.766-106.180 -1.990 1.00 0.00 C ATOM 1055 CD ARG A 101 -115.442-105.018 -2.943 1.00 0.00 C ATOM 1056 NE ARG A 101 -116.729-104.441 -3.471 1.00 0.00 N ATOM 1057 CZ ARG A 101 -117.442-104.982 -4.511 1.00 0.00 C ATOM 1058 NH1 ARG A 101 -116.996-106.086 -5.178 1.00 0.00 N ATOM 1059 NH2 ARG A 101 -118.622-104.404 -4.882 1.00 0.00 N ATOM 0 H ARG A 101 -114.927-108.980 -2.857 1.00 0.00 H new ATOM 0 HA ARG A 101 -113.081-106.720 -2.976 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -114.896-107.628 -0.654 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -114.024-106.110 -0.725 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -116.321-106.938 -2.543 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -116.426-105.811 -1.204 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -114.872-104.250 -2.420 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -114.821-105.369 -3.767 1.00 0.00 H new ATOM 0 HE ARG A 101 -117.093-103.597 -3.029 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -116.117-106.525 -4.906 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -117.542-106.472 -5.948 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -118.964-103.580 -4.388 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -119.162-104.796 -5.654 1.00 0.00 H new ATOM 1073 N ILE A 102 -112.617-109.283 -0.834 1.00 0.00 N ATOM 1074 CA ILE A 102 -111.640-109.911 0.045 1.00 0.00 C ATOM 1075 C ILE A 102 -111.472-109.072 1.314 1.00 0.00 C ATOM 1076 O ILE A 102 -112.145-109.300 2.313 1.00 0.00 O ATOM 1077 CB ILE A 102 -110.353-110.399 -0.619 1.00 0.00 C ATOM 1078 CG1 ILE A 102 -110.621-111.516 -1.668 1.00 0.00 C ATOM 1079 CG2 ILE A 102 -109.376-110.961 0.439 1.00 0.00 C ATOM 1080 CD1 ILE A 102 -111.201-111.063 -3.015 1.00 0.00 C ATOM 0 H ILE A 102 -113.492-109.804 -0.881 1.00 0.00 H new ATOM 0 HA ILE A 102 -112.050-110.874 0.350 1.00 0.00 H new ATOM 0 HB ILE A 102 -109.920-109.535 -1.123 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -109.683-112.038 -1.858 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -111.306-112.241 -1.228 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -108.465-111.304 -0.052 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -109.129-110.179 1.157 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -109.844-111.797 0.959 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -111.343-111.930 -3.660 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -112.160-110.571 -2.851 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -110.512-110.365 -3.492 1.00 0.00 H new ATOM 1092 N ASP A 103 -110.608-108.043 1.205 1.00 0.00 N ATOM 1093 CA ASP A 103 -110.244-106.957 2.097 1.00 0.00 C ATOM 1094 C ASP A 103 -110.780-105.637 1.538 1.00 0.00 C ATOM 1095 O ASP A 103 -111.562-105.634 0.589 1.00 0.00 O ATOM 1096 CB ASP A 103 -108.710-106.925 2.394 1.00 0.00 C ATOM 1097 CG ASP A 103 -107.783-107.066 1.176 1.00 0.00 C ATOM 1098 OD1 ASP A 103 -108.244-106.914 0.014 1.00 0.00 O ATOM 1099 OD2 ASP A 103 -106.575-107.336 1.417 1.00 0.00 O ATOM 0 H ASP A 103 -110.071-107.957 0.342 1.00 0.00 H new ATOM 0 HA ASP A 103 -110.712-107.123 3.067 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -108.477-105.986 2.896 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -108.479-107.727 3.095 1.00 0.00 H new ATOM 1104 N LYS A 104 -110.410-104.491 2.170 1.00 0.00 N ATOM 1105 CA LYS A 104 -110.795-103.108 1.823 1.00 0.00 C ATOM 1106 C LYS A 104 -112.001-102.642 2.627 1.00 0.00 C ATOM 1107 O LYS A 104 -113.029-102.292 2.060 1.00 0.00 O ATOM 1108 CB LYS A 104 -110.995-102.824 0.296 1.00 0.00 C ATOM 1109 CG LYS A 104 -110.702-101.391 -0.170 1.00 0.00 C ATOM 1110 CD LYS A 104 -110.804-101.268 -1.698 1.00 0.00 C ATOM 1111 CE LYS A 104 -110.319 -99.918 -2.245 1.00 0.00 C ATOM 1112 NZ LYS A 104 -111.145 -98.800 -1.730 1.00 0.00 N ATOM 0 H LYS A 104 -109.797-104.517 2.985 1.00 0.00 H new ATOM 0 HA LYS A 104 -109.924-102.515 2.103 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -110.355-103.505 -0.266 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -112.025-103.066 0.034 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -111.405-100.703 0.300 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -109.704-101.098 0.155 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -110.221-102.066 -2.157 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -111.841-101.419 -1.997 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -109.277 -99.763 -1.964 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -110.357 -99.930 -3.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -110.793 -97.901 -2.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -112.134 -98.938 -2.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -111.088 -98.776 -0.692 1.00 0.00 H new ATOM 1126 N LYS A 105 -111.907-102.685 3.988 1.00 0.00 N ATOM 1127 CA LYS A 105 -112.965-102.394 4.972 1.00 0.00 C ATOM 1128 C LYS A 105 -113.897-103.596 5.138 1.00 0.00 C ATOM 1129 O LYS A 105 -115.123-103.492 5.226 1.00 0.00 O ATOM 1130 CB LYS A 105 -113.771-101.067 4.772 1.00 0.00 C ATOM 1131 CG LYS A 105 -114.421-100.527 6.066 1.00 0.00 C ATOM 1132 CD LYS A 105 -115.395 -99.361 5.823 1.00 0.00 C ATOM 1133 CE LYS A 105 -115.930 -98.760 7.132 1.00 0.00 C ATOM 1134 NZ LYS A 105 -116.907 -97.677 6.866 1.00 0.00 N ATOM 0 H LYS A 105 -111.031-102.941 4.444 1.00 0.00 H new ATOM 0 HA LYS A 105 -112.418-102.212 5.897 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -113.104-100.306 4.367 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -114.550-101.235 4.029 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -114.954-101.338 6.561 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -113.636-100.199 6.748 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -114.890 -98.584 5.249 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -116.232 -99.711 5.219 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -116.403 -99.541 7.727 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -115.101 -98.368 7.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -117.251 -97.290 7.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -116.447 -96.922 6.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -117.709 -98.058 6.325 1.00 0.00 H new ATOM 1148 N MET A 106 -113.301-104.803 5.121 1.00 0.00 N ATOM 1149 CA MET A 106 -114.047-106.042 5.200 1.00 0.00 C ATOM 1150 C MET A 106 -113.783-106.721 6.522 1.00 0.00 C ATOM 1151 O MET A 106 -112.682-106.686 7.075 1.00 0.00 O ATOM 1152 CB MET A 106 -113.692-106.988 4.026 1.00 0.00 C ATOM 1153 CG MET A 106 -114.033-106.395 2.640 1.00 0.00 C ATOM 1154 SD MET A 106 -115.792-106.257 2.236 1.00 0.00 S ATOM 1155 CE MET A 106 -115.626-104.640 1.417 1.00 0.00 C ATOM 0 H MET A 106 -112.291-104.931 5.052 1.00 0.00 H new ATOM 0 HA MET A 106 -115.108-105.805 5.127 1.00 0.00 H new ATOM 0 HB2 MET A 106 -112.627-107.218 4.063 1.00 0.00 H new ATOM 0 HB3 MET A 106 -114.227-107.929 4.152 1.00 0.00 H new ATOM 0 HG2 MET A 106 -113.588-105.402 2.574 1.00 0.00 H new ATOM 0 HG3 MET A 106 -113.554-107.010 1.878 1.00 0.00 H new ATOM 0 HE1 MET A 106 -116.456-104.496 0.725 1.00 0.00 H new ATOM 0 HE2 MET A 106 -115.638-103.849 2.167 1.00 0.00 H new ATOM 0 HE3 MET A 106 -114.685-104.605 0.868 1.00 0.00 H new ATOM 1165 N ARG A 107 -114.844-107.402 6.997 1.00 0.00 N ATOM 1166 CA ARG A 107 -114.897-108.265 8.152 1.00 0.00 C ATOM 1167 C ARG A 107 -115.109-109.616 7.519 1.00 0.00 C ATOM 1168 O ARG A 107 -116.169-109.895 6.956 1.00 0.00 O ATOM 1169 CB ARG A 107 -115.996-107.894 9.177 1.00 0.00 C ATOM 1170 CG ARG A 107 -115.929-108.746 10.464 1.00 0.00 C ATOM 1171 CD ARG A 107 -116.809-108.241 11.618 1.00 0.00 C ATOM 1172 NE ARG A 107 -118.260-108.453 11.279 1.00 0.00 N ATOM 1173 CZ ARG A 107 -119.272-108.194 12.167 1.00 0.00 C ATOM 1174 NH1 ARG A 107 -119.000-107.706 13.412 1.00 0.00 N ATOM 1175 NH2 ARG A 107 -120.567-108.419 11.801 1.00 0.00 N ATOM 0 H ARG A 107 -115.750-107.346 6.532 1.00 0.00 H new ATOM 0 HA ARG A 107 -114.000-108.200 8.768 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -115.901-106.840 9.439 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -116.975-108.020 8.714 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -116.222-109.768 10.222 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -114.894-108.784 10.804 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -116.559-108.771 12.537 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -116.618-107.183 11.798 1.00 0.00 H new ATOM 0 HE ARG A 107 -118.500-108.803 10.352 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -118.035-107.530 13.691 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -119.762-107.517 14.063 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -120.779-108.778 10.870 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -121.323-108.228 12.458 1.00 0.00 H new ATOM 1189 N VAL A 108 -114.066-110.468 7.506 1.00 0.00 N ATOM 1190 CA VAL A 108 -114.117-111.756 6.847 1.00 0.00 C ATOM 1191 C VAL A 108 -114.105-112.788 7.923 1.00 0.00 C ATOM 1192 O VAL A 108 -113.481-112.598 8.971 1.00 0.00 O ATOM 1193 CB VAL A 108 -113.006-111.956 5.823 1.00 0.00 C ATOM 1194 CG1 VAL A 108 -111.623-111.655 6.425 1.00 0.00 C ATOM 1195 CG2 VAL A 108 -113.100-113.354 5.169 1.00 0.00 C ATOM 0 H VAL A 108 -113.172-110.269 7.956 1.00 0.00 H new ATOM 0 HA VAL A 108 -115.027-111.834 6.252 1.00 0.00 H new ATOM 0 HB VAL A 108 -113.143-111.232 5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -110.855-111.808 5.667 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -111.593-110.621 6.768 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -111.440-112.322 7.267 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -112.296-113.471 4.442 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -113.009-114.122 5.937 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -114.061-113.456 4.666 1.00 0.00 H new ATOM 1205 N ILE A 109 -114.848-113.887 7.653 1.00 0.00 N ATOM 1206 CA ILE A 109 -115.013-115.000 8.530 1.00 0.00 C ATOM 1207 C ILE A 109 -114.364-116.210 7.879 1.00 0.00 C ATOM 1208 O ILE A 109 -114.956-116.869 7.018 1.00 0.00 O ATOM 1209 CB ILE A 109 -116.520-115.247 8.767 1.00 0.00 C ATOM 1210 CG1 ILE A 109 -117.256-113.939 9.160 1.00 0.00 C ATOM 1211 CG2 ILE A 109 -116.709-116.349 9.833 1.00 0.00 C ATOM 1212 CD1 ILE A 109 -118.763-114.096 9.396 1.00 0.00 C ATOM 0 H ILE A 109 -115.356-113.997 6.776 1.00 0.00 H new ATOM 0 HA ILE A 109 -114.544-114.809 9.495 1.00 0.00 H new ATOM 0 HB ILE A 109 -116.967-115.589 7.834 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -116.800-113.540 10.066 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -117.100-113.201 8.373 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -117.773-116.519 9.996 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -116.243-117.272 9.489 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -116.244-116.035 10.768 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -119.192-113.131 9.666 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -119.238-114.462 8.486 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -118.933-114.807 10.205 1.00 0.00 H new ATOM 1224 N TYR A 110 -113.182-116.634 8.410 1.00 0.00 N ATOM 1225 CA TYR A 110 -112.534-117.906 8.041 1.00 0.00 C ATOM 1226 C TYR A 110 -112.987-118.942 9.074 1.00 0.00 C ATOM 1227 O TYR A 110 -112.318-119.176 10.075 1.00 0.00 O ATOM 1228 CB TYR A 110 -110.959-117.949 8.026 1.00 0.00 C ATOM 1229 CG TYR A 110 -110.364-116.598 8.086 1.00 0.00 C ATOM 1230 CD1 TYR A 110 -110.595-115.764 7.030 1.00 0.00 C ATOM 1231 CD2 TYR A 110 -109.582-116.169 9.146 1.00 0.00 C ATOM 1232 CE1 TYR A 110 -110.057-114.511 7.032 1.00 0.00 C ATOM 1233 CE2 TYR A 110 -109.038-114.898 9.142 1.00 0.00 C ATOM 1234 CZ TYR A 110 -109.280-114.070 8.069 1.00 0.00 C ATOM 1235 OH TYR A 110 -108.737-112.780 7.979 1.00 0.00 O ATOM 0 H TYR A 110 -112.661-116.098 9.104 1.00 0.00 H new ATOM 0 HA TYR A 110 -112.832-118.085 7.008 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -110.605-118.538 8.872 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -110.619-118.454 7.122 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -111.200-116.094 6.199 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -109.396-116.830 9.979 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -110.248-113.853 6.198 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -108.432-114.559 9.969 1.00 0.00 H new ATOM 0 HH TYR A 110 -107.764-112.841 7.875 1.00 0.00 H new ATOM 1245 N ARG A 111 -114.193-119.552 8.866 1.00 0.00 N ATOM 1246 CA ARG A 111 -114.824-120.578 9.708 1.00 0.00 C ATOM 1247 C ARG A 111 -115.091-120.189 11.173 1.00 0.00 C ATOM 1248 O ARG A 111 -114.822-120.952 12.097 1.00 0.00 O ATOM 1249 CB ARG A 111 -114.067-121.934 9.594 1.00 0.00 C ATOM 1250 CG ARG A 111 -114.082-122.501 8.159 1.00 0.00 C ATOM 1251 CD ARG A 111 -113.066-123.632 7.922 1.00 0.00 C ATOM 1252 NE ARG A 111 -113.383-124.783 8.837 1.00 0.00 N ATOM 1253 CZ ARG A 111 -112.664-125.948 8.843 1.00 0.00 C ATOM 1254 NH1 ARG A 111 -111.618-126.130 7.985 1.00 0.00 N ATOM 1255 NH2 ARG A 111 -113.001-126.940 9.718 1.00 0.00 N ATOM 0 H ARG A 111 -114.770-119.317 8.058 1.00 0.00 H new ATOM 0 HA ARG A 111 -115.827-120.686 9.295 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -113.035-121.798 9.917 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -114.520-122.657 10.272 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -115.082-122.873 7.937 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -113.879-121.692 7.457 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -113.103-123.958 6.882 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -112.054-123.272 8.108 1.00 0.00 H new ATOM 0 HE ARG A 111 -114.168-124.691 9.481 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -111.363-125.393 7.328 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -111.091-127.003 8.001 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -113.783-126.810 10.360 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -112.471-127.811 9.730 1.00 0.00 H new ATOM 1269 N GLY A 112 -115.620-118.957 11.398 1.00 0.00 N ATOM 1270 CA GLY A 112 -115.872-118.365 12.717 1.00 0.00 C ATOM 1271 C GLY A 112 -114.765-117.502 13.289 1.00 0.00 C ATOM 1272 O GLY A 112 -114.698-117.295 14.495 1.00 0.00 O ATOM 0 H GLY A 112 -115.888-118.337 10.634 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -116.778-117.762 12.654 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -116.075-119.172 13.421 1.00 0.00 H new ATOM 1276 N LYS A 113 -113.879-116.942 12.433 1.00 0.00 N ATOM 1277 CA LYS A 113 -112.785-116.046 12.806 1.00 0.00 C ATOM 1278 C LYS A 113 -113.018-114.704 12.112 1.00 0.00 C ATOM 1279 O LYS A 113 -112.743-114.622 10.916 1.00 0.00 O ATOM 1280 CB LYS A 113 -111.419-116.626 12.331 1.00 0.00 C ATOM 1281 CG LYS A 113 -111.027-117.966 12.982 1.00 0.00 C ATOM 1282 CD LYS A 113 -109.757-118.561 12.345 1.00 0.00 C ATOM 1283 CE LYS A 113 -109.333-119.916 12.933 1.00 0.00 C ATOM 1284 NZ LYS A 113 -108.947-119.793 14.359 1.00 0.00 N ATOM 0 H LYS A 113 -113.917-117.115 11.428 1.00 0.00 H new ATOM 0 HA LYS A 113 -112.760-115.932 13.890 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -111.453-116.759 11.250 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -110.638-115.895 12.538 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -110.863-117.817 14.049 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -111.850-118.674 12.881 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -109.922-118.678 11.274 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -108.937-117.853 12.466 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -110.153-120.628 12.837 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -108.495-120.316 12.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -108.634-120.719 14.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -108.171-119.107 14.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -109.765-119.467 14.913 1.00 0.00 H new ATOM 1298 N ILE A 114 -113.535-113.652 12.834 1.00 0.00 N ATOM 1299 CA ILE A 114 -113.873-112.309 12.341 1.00 0.00 C ATOM 1300 C ILE A 114 -112.673-111.348 12.345 1.00 0.00 C ATOM 1301 O ILE A 114 -112.242-110.866 13.388 1.00 0.00 O ATOM 1302 CB ILE A 114 -115.059-111.664 13.108 1.00 0.00 C ATOM 1303 CG1 ILE A 114 -114.994-111.680 14.671 1.00 0.00 C ATOM 1304 CG2 ILE A 114 -116.388-112.245 12.578 1.00 0.00 C ATOM 1305 CD1 ILE A 114 -115.377-112.979 15.401 1.00 0.00 C ATOM 0 H ILE A 114 -113.730-113.746 13.831 1.00 0.00 H new ATOM 0 HA ILE A 114 -114.180-112.467 11.307 1.00 0.00 H new ATOM 0 HB ILE A 114 -114.986-110.598 12.893 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -113.977-111.420 14.965 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -115.644-110.887 15.039 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -117.222-111.794 13.115 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -116.481-112.028 11.514 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -116.400-113.324 12.730 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -115.282-112.833 16.477 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -116.407-113.242 15.160 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -114.714-113.784 15.084 1.00 0.00 H new ATOM 1317 N VAL A 115 -112.103-111.023 11.155 1.00 0.00 N ATOM 1318 CA VAL A 115 -110.943-110.128 11.017 1.00 0.00 C ATOM 1319 C VAL A 115 -111.345-108.920 10.182 1.00 0.00 C ATOM 1320 O VAL A 115 -111.952-109.093 9.130 1.00 0.00 O ATOM 1321 CB VAL A 115 -109.751-110.885 10.406 1.00 0.00 C ATOM 1322 CG1 VAL A 115 -108.667-109.984 9.762 1.00 0.00 C ATOM 1323 CG2 VAL A 115 -109.103-111.755 11.508 1.00 0.00 C ATOM 0 H VAL A 115 -112.444-111.382 10.263 1.00 0.00 H new ATOM 0 HA VAL A 115 -110.624-109.775 11.997 1.00 0.00 H new ATOM 0 HB VAL A 115 -110.155-111.485 9.591 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -107.868-110.607 9.359 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -109.112-109.399 8.957 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -108.257-109.312 10.516 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -108.255-112.299 11.091 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -108.759-111.116 12.321 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -109.837-112.465 11.890 1.00 0.00 H new ATOM 1333 N THR A 116 -110.996-107.672 10.640 1.00 0.00 N ATOM 1334 CA THR A 116 -111.263-106.393 9.955 1.00 0.00 C ATOM 1335 C THR A 116 -109.998-105.938 9.236 1.00 0.00 C ATOM 1336 O THR A 116 -108.971-105.732 9.878 1.00 0.00 O ATOM 1337 CB THR A 116 -111.761-105.276 10.876 1.00 0.00 C ATOM 1338 OG1 THR A 116 -112.884-105.732 11.617 1.00 0.00 O ATOM 1339 CG2 THR A 116 -112.240-104.049 10.071 1.00 0.00 C ATOM 0 H THR A 116 -110.506-107.543 11.525 1.00 0.00 H new ATOM 0 HA THR A 116 -112.074-106.584 9.252 1.00 0.00 H new ATOM 0 HB THR A 116 -110.928-105.001 11.522 1.00 0.00 H new ATOM 0 HG1 THR A 116 -113.200-105.016 12.207 1.00 0.00 H new ATOM 0 HG21 THR A 116 -112.586-103.276 10.757 1.00 0.00 H new ATOM 0 HG22 THR A 116 -111.415-103.661 9.474 1.00 0.00 H new ATOM 0 HG23 THR A 116 -113.058-104.342 9.413 1.00 0.00 H new ATOM 1347 N PHE A 117 -110.022-105.803 7.886 1.00 0.00 N ATOM 1348 CA PHE A 117 -108.826-105.481 7.102 1.00 0.00 C ATOM 1349 C PHE A 117 -109.042-104.621 5.855 1.00 0.00 C ATOM 1350 O PHE A 117 -110.135-104.519 5.292 1.00 0.00 O ATOM 1351 CB PHE A 117 -107.950-106.750 6.804 1.00 0.00 C ATOM 1352 CG PHE A 117 -108.521-107.878 5.962 1.00 0.00 C ATOM 1353 CD1 PHE A 117 -109.861-108.052 5.631 1.00 0.00 C ATOM 1354 CD2 PHE A 117 -107.617-108.835 5.521 1.00 0.00 C ATOM 1355 CE1 PHE A 117 -110.262-109.121 4.858 1.00 0.00 C ATOM 1356 CE2 PHE A 117 -108.018-109.895 4.735 1.00 0.00 C ATOM 1357 CZ PHE A 117 -109.342-110.031 4.385 1.00 0.00 C ATOM 0 H PHE A 117 -110.867-105.915 7.325 1.00 0.00 H new ATOM 0 HA PHE A 117 -108.263-104.824 7.765 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -107.038-106.408 6.315 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -107.657-107.176 7.764 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -110.595-107.342 5.983 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -106.577-108.748 5.799 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -111.308-109.246 4.621 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -107.293-110.619 4.394 1.00 0.00 H new ATOM 0 HZ PHE A 117 -109.657-110.843 3.746 1.00 0.00 H new ATOM 1367 N ILE A 118 -107.929-103.980 5.403 1.00 0.00 N ATOM 1368 CA ILE A 118 -107.781-103.055 4.281 1.00 0.00 C ATOM 1369 C ILE A 118 -106.662-103.559 3.360 1.00 0.00 C ATOM 1370 O ILE A 118 -105.616-103.989 3.836 1.00 0.00 O ATOM 1371 CB ILE A 118 -107.511-101.602 4.728 1.00 0.00 C ATOM 1372 CG1 ILE A 118 -106.507-101.470 5.913 1.00 0.00 C ATOM 1373 CG2 ILE A 118 -108.858-100.902 5.018 1.00 0.00 C ATOM 1374 CD1 ILE A 118 -107.109-101.529 7.331 1.00 0.00 C ATOM 0 H ILE A 118 -107.035-104.123 5.872 1.00 0.00 H new ATOM 0 HA ILE A 118 -108.728-103.031 3.742 1.00 0.00 H new ATOM 0 HB ILE A 118 -107.007-101.097 3.904 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -105.766-102.264 5.823 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -105.975-100.524 5.807 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -108.674 -99.875 5.334 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -109.469-100.900 4.115 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -109.383-101.437 5.810 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -106.313-101.426 8.069 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -107.826-100.718 7.456 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -107.614-102.485 7.473 1.00 0.00 H new ATOM 1386 N GLY A 119 -106.872-103.523 2.011 1.00 0.00 N ATOM 1387 CA GLY A 119 -105.963-103.994 0.960 1.00 0.00 C ATOM 1388 C GLY A 119 -106.802-104.048 -0.303 1.00 0.00 C ATOM 1389 O GLY A 119 -107.920-103.543 -0.261 1.00 0.00 O ATOM 0 H GLY A 119 -107.734-103.140 1.622 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -105.116-103.318 0.841 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -105.556-104.975 1.203 1.00 0.00 H new ATOM 1393 N ASP A 120 -106.343-104.665 -1.439 1.00 0.00 N ATOM 1394 CA ASP A 120 -107.074-104.728 -2.714 1.00 0.00 C ATOM 1395 C ASP A 120 -106.669-105.977 -3.564 1.00 0.00 C ATOM 1396 O ASP A 120 -105.483-106.315 -3.571 1.00 0.00 O ATOM 1397 CB ASP A 120 -106.799-103.418 -3.536 1.00 0.00 C ATOM 1398 CG ASP A 120 -107.786-103.182 -4.689 1.00 0.00 C ATOM 1399 OD1 ASP A 120 -108.989-102.948 -4.399 1.00 0.00 O ATOM 1400 OD2 ASP A 120 -107.344-103.227 -5.868 1.00 0.00 O ATOM 0 H ASP A 120 -105.438-105.135 -1.477 1.00 0.00 H new ATOM 0 HA ASP A 120 -108.136-104.817 -2.486 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -106.835-102.564 -2.860 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -105.788-103.461 -3.941 1.00 0.00 H new ATOM 1405 N PRO A 121 -107.584-106.700 -4.261 1.00 0.00 N ATOM 1406 CA PRO A 121 -107.309-107.848 -5.139 1.00 0.00 C ATOM 1407 C PRO A 121 -107.128-107.492 -6.636 1.00 0.00 C ATOM 1408 O PRO A 121 -107.579-106.450 -7.105 1.00 0.00 O ATOM 1409 CB PRO A 121 -108.591-108.681 -4.932 1.00 0.00 C ATOM 1410 CG PRO A 121 -109.719-107.653 -4.808 1.00 0.00 C ATOM 1411 CD PRO A 121 -109.030-106.462 -4.139 1.00 0.00 C ATOM 0 HA PRO A 121 -106.368-108.339 -4.893 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -108.763-109.355 -5.771 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -108.520-109.298 -4.036 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -110.130-107.386 -5.782 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -110.545-108.031 -4.206 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -109.312-105.527 -4.623 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -109.324-106.380 -3.092 1.00 0.00 H new ATOM 1419 N VAL A 122 -106.467-108.405 -7.405 1.00 0.00 N ATOM 1420 CA VAL A 122 -106.238-108.388 -8.852 1.00 0.00 C ATOM 1421 C VAL A 122 -106.706-109.738 -9.421 1.00 0.00 C ATOM 1422 O VAL A 122 -106.688-110.756 -8.725 1.00 0.00 O ATOM 1423 CB VAL A 122 -104.797-108.063 -9.274 1.00 0.00 C ATOM 1424 CG1 VAL A 122 -104.498-106.584 -8.937 1.00 0.00 C ATOM 1425 CG2 VAL A 122 -103.771-109.006 -8.609 1.00 0.00 C ATOM 0 H VAL A 122 -106.053-109.234 -6.978 1.00 0.00 H new ATOM 0 HA VAL A 122 -106.818-107.565 -9.269 1.00 0.00 H new ATOM 0 HB VAL A 122 -104.704-108.219 -10.349 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -103.477-106.343 -9.233 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -105.193-105.940 -9.476 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -104.612-106.425 -7.865 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -102.766-108.739 -8.936 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -103.837-108.910 -7.525 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -103.984-110.036 -8.895 1.00 0.00 H new ATOM 1435 N ASP A 123 -107.201-109.811 -10.687 1.00 0.00 N ATOM 1436 CA ASP A 123 -107.613-111.057 -11.368 1.00 0.00 C ATOM 1437 C ASP A 123 -106.416-111.802 -11.992 1.00 0.00 C ATOM 1438 O ASP A 123 -105.421-111.167 -12.322 1.00 0.00 O ATOM 1439 CB ASP A 123 -108.719-110.798 -12.439 1.00 0.00 C ATOM 1440 CG ASP A 123 -108.548-109.457 -13.171 1.00 0.00 C ATOM 1441 OD1 ASP A 123 -107.480-109.246 -13.804 1.00 0.00 O ATOM 1442 OD2 ASP A 123 -109.493-108.627 -13.101 1.00 0.00 O ATOM 0 H ASP A 123 -107.325-108.983 -11.270 1.00 0.00 H new ATOM 0 HA ASP A 123 -108.037-111.700 -10.597 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -108.706-111.608 -13.169 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -109.696-110.819 -11.956 1.00 0.00 H new ATOM 1447 N LEU A 124 -106.462-113.161 -12.149 1.00 0.00 N ATOM 1448 CA LEU A 124 -105.360-113.985 -12.669 1.00 0.00 C ATOM 1449 C LEU A 124 -105.377-114.211 -14.184 1.00 0.00 C ATOM 1450 O LEU A 124 -104.328-114.238 -14.823 1.00 0.00 O ATOM 1451 CB LEU A 124 -105.380-115.359 -11.932 1.00 0.00 C ATOM 1452 CG LEU A 124 -104.294-116.406 -12.267 1.00 0.00 C ATOM 1453 CD1 LEU A 124 -102.864-115.871 -12.080 1.00 0.00 C ATOM 1454 CD2 LEU A 124 -104.526-117.658 -11.402 1.00 0.00 C ATOM 0 H LEU A 124 -107.288-113.709 -11.909 1.00 0.00 H new ATOM 0 HA LEU A 124 -104.443-113.429 -12.476 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -105.325-115.159 -10.862 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -106.350-115.819 -12.121 1.00 0.00 H new ATOM 0 HG LEU A 124 -104.383-116.655 -13.324 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -102.147-116.653 -12.331 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -102.708-115.013 -12.734 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -102.722-115.568 -11.043 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -103.765-118.404 -11.630 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -104.465-117.388 -10.348 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -105.513-118.069 -11.615 1.00 0.00 H new ATOM 1466 N SER A 125 -106.582-114.368 -14.796 1.00 0.00 N ATOM 1467 CA SER A 125 -106.788-114.619 -16.228 1.00 0.00 C ATOM 1468 C SER A 125 -107.469-113.436 -16.896 1.00 0.00 C ATOM 1469 O SER A 125 -107.811-113.490 -18.079 1.00 0.00 O ATOM 1470 CB SER A 125 -107.672-115.880 -16.499 1.00 0.00 C ATOM 1471 OG SER A 125 -107.055-117.071 -16.013 1.00 0.00 O ATOM 0 H SER A 125 -107.459-114.320 -14.278 1.00 0.00 H new ATOM 0 HA SER A 125 -105.793-114.782 -16.641 1.00 0.00 H new ATOM 0 HB2 SER A 125 -108.644-115.753 -16.022 1.00 0.00 H new ATOM 0 HB3 SER A 125 -107.853-115.975 -17.570 1.00 0.00 H new ATOM 0 HG SER A 125 -107.635-117.839 -16.198 1.00 0.00 H new ATOM 1477 N GLY A 126 -107.709-112.330 -16.140 1.00 0.00 N ATOM 1478 CA GLY A 126 -108.376-111.111 -16.604 1.00 0.00 C ATOM 1479 C GLY A 126 -109.886-111.139 -16.514 1.00 0.00 C ATOM 1480 O GLY A 126 -110.494-110.474 -15.675 1.00 0.00 O ATOM 0 H GLY A 126 -107.429-112.274 -15.161 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -108.007-110.268 -16.020 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -108.091-110.930 -17.641 1.00 0.00 H new ATOM 1484 N LEU A 127 -110.527-111.919 -17.419 1.00 0.00 N ATOM 1485 CA LEU A 127 -111.965-112.067 -17.588 1.00 0.00 C ATOM 1486 C LEU A 127 -112.470-113.399 -17.024 1.00 0.00 C ATOM 1487 O LEU A 127 -112.322-114.454 -17.636 1.00 0.00 O ATOM 1488 CB LEU A 127 -112.430-111.786 -19.062 1.00 0.00 C ATOM 1489 CG LEU A 127 -111.568-112.241 -20.285 1.00 0.00 C ATOM 1490 CD1 LEU A 127 -110.334-111.357 -20.562 1.00 0.00 C ATOM 1491 CD2 LEU A 127 -111.189-113.731 -20.323 1.00 0.00 C ATOM 0 H LEU A 127 -110.007-112.491 -18.084 1.00 0.00 H new ATOM 0 HA LEU A 127 -112.443-111.291 -16.990 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -113.413-112.243 -19.178 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -112.567-110.708 -19.152 1.00 0.00 H new ATOM 0 HG LEU A 127 -112.270-112.092 -21.105 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -109.795-111.745 -21.426 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -110.656-110.335 -20.764 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -109.678-111.365 -19.692 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -110.593-113.932 -21.213 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -110.610-113.982 -19.434 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -112.095-114.336 -20.349 1.00 0.00 H new ATOM 1503 N GLN A 128 -113.091-113.356 -15.807 1.00 0.00 N ATOM 1504 CA GLN A 128 -113.634-114.484 -15.039 1.00 0.00 C ATOM 1505 C GLN A 128 -112.562-115.371 -14.372 1.00 0.00 C ATOM 1506 O GLN A 128 -111.377-115.046 -14.353 1.00 0.00 O ATOM 1507 CB GLN A 128 -114.771-115.275 -15.778 1.00 0.00 C ATOM 1508 CG GLN A 128 -116.198-115.019 -15.218 1.00 0.00 C ATOM 1509 CD GLN A 128 -116.384-115.627 -13.825 1.00 0.00 C ATOM 1510 OE1 GLN A 128 -115.676-116.555 -13.428 1.00 0.00 O ATOM 1511 NE2 GLN A 128 -117.334-115.066 -13.033 1.00 0.00 N ATOM 0 H GLN A 128 -113.226-112.470 -15.319 1.00 0.00 H new ATOM 0 HA GLN A 128 -114.145-114.018 -14.196 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -114.755-115.008 -16.835 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -114.555-116.342 -15.715 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -116.383-113.946 -15.173 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -116.936-115.441 -15.900 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -117.906-114.299 -13.387 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -117.476-115.411 -12.084 1.00 0.00 H new ATOM 1520 N GLU A 129 -112.971-116.509 -13.762 1.00 0.00 N ATOM 1521 CA GLU A 129 -112.138-117.511 -13.102 1.00 0.00 C ATOM 1522 C GLU A 129 -111.617-117.167 -11.702 1.00 0.00 C ATOM 1523 O GLU A 129 -112.374-117.189 -10.735 1.00 0.00 O ATOM 1524 CB GLU A 129 -111.059-118.125 -14.048 1.00 0.00 C ATOM 1525 CG GLU A 129 -110.480-119.484 -13.604 1.00 0.00 C ATOM 1526 CD GLU A 129 -109.450-119.955 -14.629 1.00 0.00 C ATOM 1527 OE1 GLU A 129 -109.847-120.204 -15.798 1.00 0.00 O ATOM 1528 OE2 GLU A 129 -108.251-120.071 -14.257 1.00 0.00 O ATOM 0 H GLU A 129 -113.960-116.756 -13.722 1.00 0.00 H new ATOM 0 HA GLU A 129 -112.848-118.307 -12.879 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -111.496-118.243 -15.040 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -110.238-117.414 -14.143 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -110.016-119.391 -12.622 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -111.279-120.219 -13.511 1.00 0.00 H new ATOM 1535 N ILE A 130 -110.298-116.884 -11.528 1.00 0.00 N ATOM 1536 CA ILE A 130 -109.678-116.714 -10.215 1.00 0.00 C ATOM 1537 C ILE A 130 -108.951-115.390 -10.062 1.00 0.00 C ATOM 1538 O ILE A 130 -108.262-114.884 -10.949 1.00 0.00 O ATOM 1539 CB ILE A 130 -108.791-117.946 -9.877 1.00 0.00 C ATOM 1540 CG1 ILE A 130 -109.717-119.069 -9.331 1.00 0.00 C ATOM 1541 CG2 ILE A 130 -107.619-117.691 -8.886 1.00 0.00 C ATOM 1542 CD1 ILE A 130 -109.013-120.396 -9.022 1.00 0.00 C ATOM 0 H ILE A 130 -109.647-116.770 -12.305 1.00 0.00 H new ATOM 0 HA ILE A 130 -110.476-116.668 -9.474 1.00 0.00 H new ATOM 0 HB ILE A 130 -108.294-118.227 -10.805 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -110.200-118.711 -8.422 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -110.506-119.255 -10.059 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -107.070-118.619 -8.725 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -106.948-116.940 -9.302 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -108.017-117.335 -7.936 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -109.741-121.115 -8.647 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -108.554-120.785 -9.931 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -108.243-120.232 -8.268 1.00 0.00 H new ATOM 1554 N THR A 131 -109.063-114.845 -8.825 1.00 0.00 N ATOM 1555 CA THR A 131 -108.292-113.751 -8.261 1.00 0.00 C ATOM 1556 C THR A 131 -107.240-114.318 -7.301 1.00 0.00 C ATOM 1557 O THR A 131 -107.495-115.169 -6.431 1.00 0.00 O ATOM 1558 CB THR A 131 -109.161-112.700 -7.564 1.00 0.00 C ATOM 1559 OG1 THR A 131 -108.463-111.588 -6.996 1.00 0.00 O ATOM 1560 CG2 THR A 131 -110.020-113.325 -6.465 1.00 0.00 C ATOM 0 H THR A 131 -109.751-115.198 -8.160 1.00 0.00 H new ATOM 0 HA THR A 131 -107.802-113.232 -9.085 1.00 0.00 H new ATOM 0 HB THR A 131 -109.769-112.308 -8.379 1.00 0.00 H new ATOM 0 HG1 THR A 131 -107.631-111.436 -7.492 1.00 0.00 H new ATOM 0 HG21 THR A 131 -110.624-112.551 -5.991 1.00 0.00 H new ATOM 0 HG22 THR A 131 -110.674-114.081 -6.900 1.00 0.00 H new ATOM 0 HG23 THR A 131 -109.375-113.790 -5.719 1.00 0.00 H new ATOM 1568 N ARG A 132 -106.025-113.736 -7.499 1.00 0.00 N ATOM 1569 CA ARG A 132 -104.811-113.883 -6.736 1.00 0.00 C ATOM 1570 C ARG A 132 -104.669-112.541 -6.046 1.00 0.00 C ATOM 1571 O ARG A 132 -104.595-111.490 -6.681 1.00 0.00 O ATOM 1572 CB ARG A 132 -103.581-114.159 -7.653 1.00 0.00 C ATOM 1573 CG ARG A 132 -103.476-115.625 -8.123 1.00 0.00 C ATOM 1574 CD ARG A 132 -103.220-116.647 -6.996 1.00 0.00 C ATOM 1575 NE ARG A 132 -101.880-116.356 -6.358 1.00 0.00 N ATOM 1576 CZ ARG A 132 -101.680-116.093 -5.026 1.00 0.00 C ATOM 1577 NH1 ARG A 132 -102.714-116.102 -4.139 1.00 0.00 N ATOM 1578 NH2 ARG A 132 -100.419-115.812 -4.583 1.00 0.00 N ATOM 0 H ARG A 132 -105.887-113.095 -8.280 1.00 0.00 H new ATOM 0 HA ARG A 132 -104.853-114.726 -6.047 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -103.637-113.510 -8.527 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -102.671-113.893 -7.116 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -104.399-115.895 -8.636 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -102.671-115.701 -8.854 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -104.012-116.590 -6.249 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -103.233-117.660 -7.397 1.00 0.00 H new ATOM 0 HE ARG A 132 -101.061-116.355 -6.965 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -103.660-116.307 -4.461 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -102.542-115.904 -3.153 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -99.639-115.799 -5.240 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -100.258-115.615 -3.595 1.00 0.00 H new ATOM 1592 N ILE A 133 -104.677-112.545 -4.701 1.00 0.00 N ATOM 1593 CA ILE A 133 -104.604-111.333 -3.911 1.00 0.00 C ATOM 1594 C ILE A 133 -103.477-111.543 -2.912 1.00 0.00 C ATOM 1595 O ILE A 133 -103.469-112.485 -2.111 1.00 0.00 O ATOM 1596 CB ILE A 133 -105.940-110.882 -3.287 1.00 0.00 C ATOM 1597 CG1 ILE A 133 -105.810-110.252 -1.869 1.00 0.00 C ATOM 1598 CG2 ILE A 133 -107.091-111.909 -3.486 1.00 0.00 C ATOM 1599 CD1 ILE A 133 -106.989-109.384 -1.482 1.00 0.00 C ATOM 0 H ILE A 133 -104.735-113.397 -4.144 1.00 0.00 H new ATOM 0 HA ILE A 133 -104.385-110.482 -4.555 1.00 0.00 H new ATOM 0 HB ILE A 133 -106.268-110.026 -3.877 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -105.700-111.050 -1.135 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -104.900-109.654 -1.828 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -108.002-111.529 -3.023 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -107.262-112.062 -4.552 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -106.817-112.857 -3.023 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -106.830-108.979 -0.483 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -107.087-108.565 -2.194 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -107.900-109.983 -1.490 1.00 0.00 H new ATOM 1611 N LYS A 134 -102.519-110.582 -2.925 1.00 0.00 N ATOM 1612 CA LYS A 134 -101.455-110.421 -1.958 1.00 0.00 C ATOM 1613 C LYS A 134 -101.586-108.961 -1.565 1.00 0.00 C ATOM 1614 O LYS A 134 -101.609-108.073 -2.419 1.00 0.00 O ATOM 1615 CB LYS A 134 -100.042-110.756 -2.504 1.00 0.00 C ATOM 1616 CG LYS A 134 -99.849-112.268 -2.697 1.00 0.00 C ATOM 1617 CD LYS A 134 -98.422-112.668 -3.107 1.00 0.00 C ATOM 1618 CE LYS A 134 -97.375-112.449 -2.004 1.00 0.00 C ATOM 1619 NZ LYS A 134 -96.049-112.961 -2.417 1.00 0.00 N ATOM 0 H LYS A 134 -102.485-109.872 -3.657 1.00 0.00 H new ATOM 0 HA LYS A 134 -101.552-111.116 -1.124 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -99.889-110.246 -3.455 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -99.287-110.378 -1.815 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -100.106-112.778 -1.769 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -100.547-112.619 -3.457 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -98.418-113.719 -3.395 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -98.133-112.095 -3.988 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -97.302-111.386 -1.774 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -97.694-112.952 -1.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -95.362-112.800 -1.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -96.116-113.980 -2.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -95.736-112.463 -3.275 1.00 0.00 H new ATOM 1633 N GLY A 135 -101.730-108.692 -0.245 1.00 0.00 N ATOM 1634 CA GLY A 135 -101.882-107.350 0.298 1.00 0.00 C ATOM 1635 C GLY A 135 -101.219-107.315 1.639 1.00 0.00 C ATOM 1636 O GLY A 135 -101.164-108.328 2.337 1.00 0.00 O ATOM 0 H GLY A 135 -101.742-109.420 0.469 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -101.431-106.616 -0.369 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -102.937-107.093 0.388 1.00 0.00 H new ATOM 1640 N LYS A 136 -100.704-106.135 2.057 1.00 0.00 N ATOM 1641 CA LYS A 136 -100.030-105.943 3.336 1.00 0.00 C ATOM 1642 C LYS A 136 -100.671-104.788 4.073 1.00 0.00 C ATOM 1643 O LYS A 136 -101.333-103.953 3.461 1.00 0.00 O ATOM 1644 CB LYS A 136 -98.503-105.697 3.152 1.00 0.00 C ATOM 1645 CG LYS A 136 -98.100-104.324 2.576 1.00 0.00 C ATOM 1646 CD LYS A 136 -96.598-104.235 2.274 1.00 0.00 C ATOM 1647 CE LYS A 136 -96.100-102.810 1.982 1.00 0.00 C ATOM 1648 NZ LYS A 136 -96.245-101.928 3.165 1.00 0.00 N ATOM 0 H LYS A 136 -100.753-105.284 1.497 1.00 0.00 H new ATOM 0 HA LYS A 136 -100.139-106.855 3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -98.017-105.819 4.120 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -98.107-106.473 2.497 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -98.663-104.137 1.662 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -98.373-103.542 3.284 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -96.043-104.635 3.123 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -96.372-104.870 1.417 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -95.053-102.845 1.679 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -96.660-102.392 1.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -95.707-101.051 3.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -97.249-101.698 3.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -95.880-102.415 4.008 1.00 0.00 H new ATOM 1662 N GLU A 137 -100.469-104.685 5.412 1.00 0.00 N ATOM 1663 CA GLU A 137 -100.961-103.592 6.246 1.00 0.00 C ATOM 1664 C GLU A 137 -99.756-102.921 6.911 1.00 0.00 C ATOM 1665 O GLU A 137 -98.758-103.564 7.244 1.00 0.00 O ATOM 1666 CB GLU A 137 -101.971-104.065 7.340 1.00 0.00 C ATOM 1667 CG GLU A 137 -103.332-104.582 6.812 1.00 0.00 C ATOM 1668 CD GLU A 137 -103.252-106.018 6.286 1.00 0.00 C ATOM 1669 OE1 GLU A 137 -102.832-106.913 7.068 1.00 0.00 O ATOM 1670 OE2 GLU A 137 -103.623-106.241 5.103 1.00 0.00 O ATOM 0 H GLU A 137 -99.946-105.383 5.940 1.00 0.00 H new ATOM 0 HA GLU A 137 -101.503-102.896 5.606 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -101.503-104.858 7.924 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -102.157-103.235 8.021 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -104.071-104.533 7.612 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -103.681-103.926 6.015 1.00 0.00 H new ATOM 1677 N ASP A 138 -99.807-101.582 7.179 1.00 0.00 N ATOM 1678 CA ASP A 138 -98.766-100.773 7.826 1.00 0.00 C ATOM 1679 C ASP A 138 -98.787-100.898 9.348 1.00 0.00 C ATOM 1680 O ASP A 138 -98.970 -99.935 10.089 1.00 0.00 O ATOM 1681 CB ASP A 138 -98.846 -99.276 7.412 1.00 0.00 C ATOM 1682 CG ASP A 138 -98.659 -99.157 5.897 1.00 0.00 C ATOM 1683 OD1 ASP A 138 -97.560 -99.531 5.406 1.00 0.00 O ATOM 1684 OD2 ASP A 138 -99.609 -98.690 5.215 1.00 0.00 O ATOM 0 H ASP A 138 -100.624-101.024 6.931 1.00 0.00 H new ATOM 0 HA ASP A 138 -97.818-101.177 7.471 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -99.809 -98.857 7.705 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -98.078 -98.702 7.931 1.00 0.00 H new ATOM 1689 N GLY A 139 -98.575-102.165 9.809 1.00 0.00 N ATOM 1690 CA GLY A 139 -98.545-102.614 11.200 1.00 0.00 C ATOM 1691 C GLY A 139 -97.153-102.604 11.768 1.00 0.00 C ATOM 1692 O GLY A 139 -96.837-101.760 12.596 1.00 0.00 O ATOM 0 H GLY A 139 -98.412-102.937 9.162 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -99.186-101.970 11.802 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -98.955-103.622 11.264 1.00 0.00 H new ATOM 1696 N ALA A 140 -96.249-103.521 11.308 1.00 0.00 N ATOM 1697 CA ALA A 140 -94.856-103.586 11.766 1.00 0.00 C ATOM 1698 C ALA A 140 -93.896-102.664 10.994 1.00 0.00 C ATOM 1699 O ALA A 140 -92.687-102.631 11.232 1.00 0.00 O ATOM 1700 CB ALA A 140 -94.343-105.046 11.767 1.00 0.00 C ATOM 0 H ALA A 140 -96.481-104.228 10.610 1.00 0.00 H new ATOM 0 HA ALA A 140 -94.864-103.209 12.789 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -93.309-105.068 12.110 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -94.960-105.648 12.435 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -94.399-105.452 10.757 1.00 0.00 H new ATOM 1706 N TYR A 141 -94.431-101.823 10.069 1.00 0.00 N ATOM 1707 CA TYR A 141 -93.723-100.840 9.243 1.00 0.00 C ATOM 1708 C TYR A 141 -93.359 -99.547 9.984 1.00 0.00 C ATOM 1709 O TYR A 141 -93.701 -98.435 9.581 1.00 0.00 O ATOM 1710 CB TYR A 141 -94.539-100.522 7.955 1.00 0.00 C ATOM 1711 CG TYR A 141 -94.444-101.688 7.010 1.00 0.00 C ATOM 1712 CD1 TYR A 141 -93.379-101.756 6.129 1.00 0.00 C ATOM 1713 CD2 TYR A 141 -95.365-102.720 7.022 1.00 0.00 C ATOM 1714 CE1 TYR A 141 -93.225-102.836 5.281 1.00 0.00 C ATOM 1715 CE2 TYR A 141 -95.214-103.801 6.176 1.00 0.00 C ATOM 1716 CZ TYR A 141 -94.138-103.866 5.319 1.00 0.00 C ATOM 1717 OH TYR A 141 -93.981-104.994 4.492 1.00 0.00 O ATOM 0 H TYR A 141 -95.433-101.823 9.877 1.00 0.00 H new ATOM 0 HA TYR A 141 -92.775-101.304 8.973 1.00 0.00 H new ATOM 0 HB2 TYR A 141 -95.581-100.328 8.209 1.00 0.00 H new ATOM 0 HB3 TYR A 141 -94.154 -99.620 7.479 1.00 0.00 H new ATOM 0 HD1 TYR A 141 -92.657-100.953 6.104 1.00 0.00 H new ATOM 0 HD2 TYR A 141 -96.207-102.680 7.697 1.00 0.00 H new ATOM 0 HE1 TYR A 141 -92.394-102.872 4.593 1.00 0.00 H new ATOM 0 HE2 TYR A 141 -95.942-104.598 6.187 1.00 0.00 H new ATOM 0 HH TYR A 141 -94.717-105.621 4.651 1.00 0.00 H new ATOM 1727 N VAL A 142 -92.617 -99.700 11.119 1.00 0.00 N ATOM 1728 CA VAL A 142 -92.059 -98.689 12.027 1.00 0.00 C ATOM 1729 C VAL A 142 -93.085 -97.898 12.847 1.00 0.00 C ATOM 1730 O VAL A 142 -93.018 -97.856 14.073 1.00 0.00 O ATOM 1731 CB VAL A 142 -90.981 -97.806 11.370 1.00 0.00 C ATOM 1732 CG1 VAL A 142 -90.328 -96.829 12.374 1.00 0.00 C ATOM 1733 CG2 VAL A 142 -89.879 -98.719 10.778 1.00 0.00 C ATOM 0 H VAL A 142 -92.378-100.638 11.442 1.00 0.00 H new ATOM 0 HA VAL A 142 -91.542 -99.282 12.781 1.00 0.00 H new ATOM 0 HB VAL A 142 -91.466 -97.213 10.595 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -89.576 -96.230 11.861 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -91.091 -96.173 12.792 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -89.856 -97.395 13.177 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -89.110 -98.104 10.310 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -89.433 -99.314 11.575 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -90.318 -99.382 10.032 1.00 0.00 H new ATOM 1743 N GLY A 143 -94.051 -97.236 12.168 1.00 0.00 N ATOM 1744 CA GLY A 143 -95.102 -96.439 12.792 1.00 0.00 C ATOM 1745 C GLY A 143 -95.335 -95.178 12.017 1.00 0.00 C ATOM 1746 O GLY A 143 -95.319 -94.085 12.581 1.00 0.00 O ATOM 0 H GLY A 143 -94.112 -97.249 11.150 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -96.024 -97.018 12.842 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -94.822 -96.196 13.817 1.00 0.00 H new TER 1750 GLY A 143