#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tcz n ASP 1016N 0.00 -6.54 -4.76 4.04 2.03 -1.26 -4.93 116.55 105.13 1tcz n ASP 1016Ca 0.00 -0.48 -0.36 0.00 0.52 0.00 0.00 54.79 54.47 1tcz n ASP 1016Cb 0.00 -3.88 0.02 0.00 -0.72 0.00 0.00 41.12 36.54 1tcz n ASP 1016CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 1tcz s PRO 1017N -3.96 3.18 -0.59 -0.67 0.02 -1.26 -4.31 135.00 127.40 1tcz s PRO 1017Ca 0.05 1.81 -0.20 0.00 0.02 0.00 0.00 61.00 62.68 1tcz s PRO 1017Cb -0.02 -2.04 0.08 0.00 0.02 0.00 0.00 34.50 32.55 1tcz s PRO 1017CO 0.81 -1.04 0.77 0.00 -0.33 0.00 0.00 177.00 177.22 1tcz s ALA 1018N -1.60 3.31 0.21 -1.55 0.00 -1.26 -3.38 121.76 117.49 1tcz s ALA 1018Ca 0.74 -1.97 -0.17 0.00 0.00 0.00 0.00 51.96 50.56 1tcz s ALA 1018Cb -0.30 -3.60 -0.08 0.00 0.00 0.00 0.00 23.12 19.15 1tcz s ALA 1018CO 0.33 -2.40 0.67 -1.01 0.00 0.00 0.00 175.76 173.35 1tcz s HIS 1019N 3.13 3.60 0.45 0.00 3.76 -1.25 -4.93 115.29 120.06 1tcz s HIS 1019Ca 0.16 1.27 0.08 0.00 -0.15 0.00 0.00 55.06 56.42 1tcz s HIS 1019Cb -0.21 -2.53 0.02 0.00 1.11 0.00 0.00 32.58 30.97 1tcz s HIS 1019CO 0.09 0.33 0.58 0.95 -0.85 0.00 0.00 174.74 175.84 1tcz s THR 1020N -1.56 2.72 0.29 1.30 -4.23 -1.26 -1.14 115.64 111.76 1tcz s THR 1020Ca 0.43 -1.08 -0.18 0.00 -1.18 0.00 0.00 61.69 59.68 1tcz s THR 1020Cb -0.15 -2.80 0.02 0.00 1.34 0.00 0.00 72.50 70.91 1tcz s THR 1020CO 0.20 0.00 0.68 0.00 -0.54 0.00 0.00 174.62 174.96 1tcz s ALA 1021N -2.45 -0.90 0.07 3.99 0.00 0.69 -4.77 121.76 118.39 1tcz s ALA 1021Ca 0.54 -0.53 0.02 0.00 0.00 0.00 0.00 51.96 52.00 1tcz s ALA 1021Cb -0.08 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.88 1tcz s ALA 1021CO 0.33 -0.99 -0.08 0.95 0.00 0.00 0.00 175.76 175.97 1tcz s THR 1022N -3.64 0.65 -0.07 0.00 -4.23 -1.26 -1.27 115.64 105.82 1tcz s THR 1022Ca 0.14 -1.44 -0.31 0.00 -1.18 0.00 0.00 61.69 58.91 1tcz s THR 1022Cb -0.05 -1.07 0.12 0.00 1.34 0.00 0.00 72.50 72.84 1tcz s THR 1022CO 0.09 -0.56 1.00 0.00 -0.54 0.00 0.00 174.62 174.60 1tcz s ALA 1023N -2.25 -1.91 0.28 3.99 0.00 -1.05 -4.98 121.76 115.84 1tcz s ALA 1023Ca -0.01 1.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 1tcz s ALA 1023Cb -0.04 0.21 -0.13 0.00 0.00 0.00 0.00 23.12 23.16 1tcz s ALA 1023CO -0.01 -0.65 1.45 -2.30 0.00 0.00 0.00 175.76 174.25 1tcz n PRO 1024N -0.17 2.30 -4.21 0.00 -0.02 -1.26 -0.76 135.00 130.88 1tcz n PRO 1024Ca -0.06 0.81 -0.30 0.00 -2.02 0.00 0.00 63.50 61.93 1tcz n PRO 1024Cb 0.60 -2.50 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 1tcz n PRO 1024CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1tcz s GLY 1025N 0.24 1.86 -0.17 -1.23 0.00 -0.35 -0.98 107.32 106.68 1tcz s GLY 1025Ca 0.64 -1.14 0.21 0.00 0.00 0.00 0.00 44.72 44.43 1tcz s GLY 1025CO 0.52 -1.09 1.15 0.61 0.00 0.00 0.00 173.10 174.29 1tcz n GLY 1026N 0.79 2.49 3.67 0.20 0.00 0.93 -4.71 105.19 108.56 1tcz n GLY 1026Ca -0.12 -1.23 -0.36 0.00 0.00 0.00 0.00 46.02 44.30 1tcz n GLY 1026CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tcz n LEU 1027N -0.31 4.73 -0.40 0.99 4.77 -1.25 -4.82 117.00 120.71 1tcz n LEU 1027Ca 0.13 0.74 0.04 0.00 -0.03 0.00 0.00 56.01 56.89 1tcz n LEU 1027Cb 0.93 -1.48 0.06 0.00 -2.33 0.00 0.00 43.42 40.60 1tcz n LEU 1027CO 0.07 -1.54 0.45 -1.54 -1.33 0.00 0.00 177.39 173.50 1tcz n SER 1028N -1.89 2.03 -3.29 -1.43 3.41 -1.26 -4.06 113.62 107.12 1tcz n SER 1028Ca 0.14 -1.55 -0.05 0.00 -0.26 0.00 0.00 58.87 57.15 1tcz n SER 1028Cb 0.49 -0.05 0.01 0.00 -0.26 0.00 0.00 64.21 64.40 1tcz n SER 1028CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tcz s ALA 1029N -0.81 -1.33 0.49 7.33 0.00 -1.26 -4.78 121.76 121.40 1tcz s ALA 1029Ca 0.13 -0.41 -0.23 0.00 0.00 0.00 0.00 51.96 51.45 1tcz s ALA 1029Cb 0.08 0.72 -0.07 0.00 0.00 0.00 0.00 23.12 23.86 1tcz s ALA 1029CO 0.11 -1.04 1.32 0.15 0.00 0.00 0.00 175.76 176.31 1tcz s LYS 1030N -2.41 3.51 -0.07 0.00 1.02 -1.26 -3.80 119.74 116.74 1tcz s LYS 1030Ca 0.18 2.15 -0.02 0.00 0.02 0.00 0.00 55.97 58.30 1tcz s LYS 1030Cb -0.03 -2.45 0.04 0.00 -0.52 0.00 0.00 37.83 34.87 1tcz s LYS 1030CO 0.07 -0.87 0.06 0.00 -0.92 0.00 0.00 175.35 173.69 1tcz s ALA 1031N -1.33 0.31 0.77 5.17 0.00 0.25 -4.96 121.76 121.98 1tcz s ALA 1031Ca 0.65 0.07 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 1tcz s ALA 1031Cb -0.38 -0.71 0.05 0.00 0.00 0.00 0.00 23.12 22.08 1tcz s ALA 1031CO 0.47 -0.62 1.10 -1.25 0.00 0.00 0.00 175.76 175.46 1tcz s PRO 1032N 2.14 2.29 0.55 0.00 0.04 -1.26 -1.60 135.00 137.17 1tcz s PRO 1032Ca 0.04 0.60 -0.21 0.00 0.04 0.00 0.00 61.00 61.48 1tcz s PRO 1032Cb -0.13 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 1tcz s PRO 1032CO -0.04 -1.47 1.23 0.00 0.04 0.00 0.00 177.00 176.76 1tcz n ALA 1033N -3.32 1.08 -0.76 8.56 0.00 -1.26 -2.69 120.51 122.12 1tcz n ALA 1033Ca 0.07 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1tcz n ALA 1033Cb 0.56 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1tcz n ALA 1033CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1tcz n MET 1034N -0.96 0.00 -2.88 0.00 2.81 0.18 -4.78 117.12 111.48 1tcz n MET 1034Ca 0.11 0.08 -0.42 0.00 -1.81 0.00 0.00 57.70 55.67 1tcz n MET 1034Cb 0.45 -2.44 -0.04 0.00 -0.71 0.00 0.00 33.22 30.48 1tcz n MET 1034CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1tcz s THR 1035N -2.00 4.86 0.39 2.03 2.01 -1.10 -0.52 115.64 121.32 1tcz s THR 1035Ca 0.00 1.62 -0.27 0.00 0.31 0.00 0.00 61.69 63.35 1tcz s THR 1035Cb 0.00 -4.14 -0.10 0.00 0.01 0.00 0.00 72.50 68.28 1tcz s THR 1035CO 0.00 -0.01 1.43 -2.84 -0.69 0.00 0.00 174.62 172.51 1tcz s PRO 1036N 2.39 4.01 0.21 4.92 0.02 -1.26 -0.95 135.00 144.34 1tcz s PRO 1036Ca 0.37 2.44 0.11 0.00 0.02 0.00 0.00 61.00 63.95 1tcz s PRO 1036Cb -0.16 -2.88 -0.05 0.00 0.02 0.00 0.00 34.50 31.44 1tcz s PRO 1036CO 0.11 -0.56 -0.23 -0.51 -0.33 0.00 0.00 177.00 175.47 1tcz s LEU 1037N -2.26 2.46 0.25 -5.54 1.43 0.37 -1.03 118.68 114.37 1tcz s LEU 1037Ca 0.55 -0.89 0.02 0.00 -1.03 0.00 0.00 54.13 52.77 1tcz s LEU 1037Cb -0.44 -1.16 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 1tcz s LEU 1037CO 0.59 0.11 0.20 0.00 0.23 0.00 0.00 176.35 177.47 1tcz s MET 1038N -2.82 1.43 -0.00 1.70 0.23 0.68 -0.37 119.30 120.15 1tcz s MET 1038Ca 0.22 -1.77 -0.11 0.00 -1.03 0.00 0.00 55.69 53.01 1tcz s MET 1038Cb -0.07 0.30 -0.05 0.00 -1.53 0.00 0.00 34.83 33.47 1tcz s MET 1038CO 0.11 -0.50 0.33 -0.51 -2.03 0.00 0.00 175.02 172.42 1tcz s LEU 1039N -3.24 4.41 -0.11 0.18 1.43 -1.26 -0.77 118.68 119.32 1tcz s LEU 1039Ca 0.39 0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 53.95 1tcz s LEU 1039Cb 0.05 -2.59 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 1tcz s LEU 1039CO 0.18 0.29 1.35 -0.62 0.23 0.00 0.00 176.35 177.78 1tcz s ASP 1040N -1.34 6.89 0.62 2.29 -1.08 0.05 -4.88 116.67 119.22 1tcz s ASP 1040Ca 0.25 1.86 0.41 0.00 -0.52 0.00 0.00 52.55 54.56 1tcz s ASP 1040Cb -0.14 -2.54 2.24 0.00 -1.46 0.00 0.00 42.92 41.01 1tcz s ASP 1040CO 0.13 -0.77 2.27 0.71 0.52 0.00 0.00 175.17 178.03 1tcz h THR 1041N 5.38 0.00 0.00 1.71 1.35 -1.96 0.47 112.91 119.87 1tcz h THR 1041Ca -0.31 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1tcz h THR 1041Cb 1.13 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 1tcz h THR 1041CO 0.95 0.00 -0.46 -0.24 -0.25 0.00 0.00 175.52 175.52 1tcz n SER 1042N -2.96 1.64 0.06 5.36 2.88 -1.26 -4.63 113.62 114.71 1tcz n SER 1042Ca -0.03 0.60 -0.01 0.00 -1.33 0.00 0.00 58.87 58.10 1tcz n SER 1042Cb 0.07 -0.84 -0.06 0.00 -0.75 0.00 0.00 64.21 62.63 1tcz n SER 1042CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1tcz h SER 1043N -0.90 0.00 -0.57 -3.46 4.64 -1.97 -3.48 113.55 107.80 1tcz h SER 1043Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 1tcz h SER 1043Cb 0.46 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.51 1tcz h SER 1043CO 0.00 0.66 -0.15 0.54 -0.87 0.00 0.00 176.83 177.01 1tcz n ARG 1044N -3.07 -0.54 -2.47 4.77 1.74 0.17 -4.97 116.66 112.29 1tcz n ARG 1044Ca -0.06 0.63 -0.27 0.00 -0.77 0.00 0.00 57.85 57.39 1tcz n ARG 1044Cb 0.85 -4.47 0.02 0.00 -1.02 0.00 0.00 32.46 27.83 1tcz n ARG 1044CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1tcz s LYS 1045N -3.18 3.19 0.17 5.56 1.02 -1.26 -4.65 119.74 120.60 1tcz s LYS 1045Ca 0.00 0.11 -0.30 0.00 0.02 0.00 0.00 55.97 55.80 1tcz s LYS 1045Cb 0.00 -2.30 -0.07 0.00 -0.52 0.00 0.00 37.83 34.93 1tcz s LYS 1045CO 0.00 -0.50 1.02 -0.51 -0.92 0.00 0.00 175.35 174.44 1tcz s LEU 1046N -4.90 4.53 0.21 3.17 1.43 -0.16 -0.77 118.68 122.20 1tcz s LEU 1046Ca 0.51 1.97 -0.04 0.00 -1.03 0.00 0.00 54.13 55.54 1tcz s LEU 1046Cb -0.10 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.48 1tcz s LEU 1046CO 0.45 -0.08 0.22 0.68 0.23 0.00 0.00 176.35 177.85 1tcz s VAL 1047N -0.41 0.00 0.33 -1.59 -7.23 0.05 -0.05 120.40 111.49 1tcz s VAL 1047Ca 0.46 -1.83 -0.29 0.00 -1.81 0.00 0.00 61.98 58.51 1tcz s VAL 1047Cb -0.27 -2.40 -0.10 0.00 0.56 0.00 0.00 36.38 34.16 1tcz s VAL 1047CO 0.33 -0.01 1.34 0.00 -0.31 0.00 0.00 175.10 176.45 1tcz s ALA 1048N -4.12 3.52 0.23 1.32 0.00 -1.26 -0.23 121.76 121.22 1tcz s ALA 1048Ca 0.34 1.30 -0.30 0.00 0.00 0.00 0.00 51.96 53.30 1tcz s ALA 1048Cb 0.05 -3.50 -0.10 0.00 0.00 0.00 0.00 23.12 19.57 1tcz s ALA 1048CO 0.11 -0.70 1.44 -0.46 0.00 0.00 0.00 175.76 176.14 1tcz s TRP 1049N -1.01 3.05 -0.30 0.00 -0.00 -0.20 -4.47 118.94 116.01 1tcz s TRP 1049Ca 0.50 1.01 0.27 0.00 -0.00 0.00 0.00 56.10 57.89 1tcz s TRP 1049Cb -0.41 -3.80 1.07 0.00 -0.00 0.00 0.00 33.47 30.33 1tcz s TRP 1049CO 0.53 -2.64 1.81 0.38 -0.00 0.00 0.00 176.95 177.03 1tcz h ASP 1050N 5.24 0.00 0.00 5.86 3.04 -1.92 -3.44 116.42 125.20 1tcz h ASP 1050Ca -0.45 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.34 1tcz h ASP 1050Cb 1.22 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.51 1tcz h ASP 1050CO 0.79 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 178.60 1tcz n GLY 1051N 0.18 0.83 0.00 7.15 0.00 -1.26 -4.54 105.19 107.55 1tcz n GLY 1051Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1tcz n GLY 1051CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tcz n THR 1052N -2.26 0.00 -2.73 2.61 -2.24 -1.26 -3.71 114.28 104.69 1tcz n THR 1052Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 1tcz n THR 1052Cb 0.00 -0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 67.96 1tcz n THR 1052CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1tcz s THR 1053N -1.63 4.52 0.22 4.28 2.01 -1.26 -4.98 115.64 118.81 1tcz s THR 1053Ca 0.00 1.38 -0.31 0.00 0.31 0.00 0.00 61.69 63.06 1tcz s THR 1053Cb 0.00 -4.38 -0.11 0.00 0.01 0.00 0.00 72.50 68.01 1tcz s THR 1053CO 0.00 -0.56 1.66 -1.81 -0.69 0.00 0.00 174.62 173.22 1tcz s ASP 1054N 1.86 6.42 0.00 3.53 -0.00 -1.26 -2.77 116.67 124.45 1tcz s ASP 1054Ca 0.41 2.84 0.00 0.00 -0.00 0.00 0.00 52.55 55.80 1tcz s ASP 1054Cb -0.12 -2.61 0.00 0.00 -0.00 0.00 0.00 42.92 40.20 1tcz s ASP 1054CO 0.19 -0.93 0.00 0.61 -0.00 0.00 0.00 175.17 175.04 1tcz n GLY 1055N 3.45 0.16 0.11 0.21 0.00 -1.26 -4.88 105.19 102.98 1tcz n GLY 1055Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1tcz n GLY 1055CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tcz h ALA 1056N 0.00 0.83 -2.63 4.61 0.00 -1.81 -3.46 119.26 116.79 1tcz h ALA 1056Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 1tcz h ALA 1056Cb 0.67 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.50 1tcz h ALA 1056CO 0.00 0.00 0.80 0.00 0.00 0.00 0.00 179.25 180.05 1tcz s ALA 1057N -3.16 3.68 0.00 0.00 0.00 -1.26 -4.15 121.76 116.88 1tcz s ALA 1057Ca 0.08 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.33 1tcz s ALA 1057Cb 0.11 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1tcz s ALA 1057CO 0.66 -0.72 0.00 1.33 0.00 0.00 0.00 175.76 177.03 1tcz n VAL 1058N 3.47 0.00 -3.93 0.00 0.24 0.51 -4.81 118.33 113.81 1tcz n VAL 1058Ca 0.11 -0.35 0.01 0.00 -2.04 0.00 0.00 64.34 62.07 1tcz n VAL 1058Cb 0.40 0.89 0.01 0.00 -1.47 0.00 0.00 33.84 33.68 1tcz n VAL 1058CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1tcz s GLY 1059N -1.03 -0.09 -0.12 7.63 0.00 -1.21 -4.89 107.32 107.61 1tcz s GLY 1059Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.72 1tcz s GLY 1059CO 0.00 4.29 -0.11 -0.42 0.00 0.00 0.00 173.10 176.86 1tcz s ILE 1060N -2.10 1.29 0.12 0.90 1.01 -1.03 -0.48 121.20 120.90 1tcz s ILE 1060Ca 0.26 -0.48 -0.34 0.00 0.00 0.00 0.00 60.65 60.09 1tcz s ILE 1060Cb -0.01 -1.23 -0.14 0.00 0.01 0.00 0.00 42.46 41.10 1tcz s ILE 1060CO 0.01 0.41 1.61 -0.11 0.00 0.00 0.00 174.94 176.85 1tcz n LEU 1061N 4.62 3.05 -0.05 2.97 7.94 -0.13 0.71 117.00 136.12 1tcz n LEU 1061Ca -0.16 1.07 -0.01 0.00 -1.11 0.00 0.00 56.01 55.80 1tcz n LEU 1061Cb 0.50 -1.40 -0.15 0.00 0.53 0.00 0.00 43.42 42.90 1tcz n LEU 1061CO 0.20 -0.30 -0.90 0.00 -1.11 0.00 0.00 177.39 175.28 1tcz n ALA 1062N 3.83 2.03 -3.42 1.96 0.00 0.39 0.48 120.51 125.79 1tcz n ALA 1062Ca 0.18 -0.94 -0.26 0.00 0.00 0.00 0.00 53.44 52.42 1tcz n ALA 1062Cb 0.28 -0.49 -0.17 0.00 0.00 0.00 0.00 19.45 19.08 1tcz n ALA 1062CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1tcz s VAL 1063N -2.92 1.32 0.28 0.00 1.01 -1.11 -4.73 120.40 114.26 1tcz s VAL 1063Ca -0.08 -0.59 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 1tcz s VAL 1063Cb 0.09 -1.19 -0.14 0.00 0.00 0.00 0.00 36.38 35.14 1tcz s VAL 1063CO 0.86 0.40 1.01 0.00 0.00 0.00 0.00 175.10 177.36 1tcz n ALA 1064N 3.77 -0.28 -2.89 5.51 0.00 -1.26 -4.66 120.51 120.70 1tcz n ALA 1064Ca -0.22 0.39 -0.13 0.00 0.00 0.00 0.00 53.44 53.48 1tcz n ALA 1064Cb 0.52 -2.02 -0.05 0.00 0.00 0.00 0.00 19.45 17.90 1tcz n ALA 1064CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tcz s ALA 1065N -1.01 0.58 0.00 0.00 0.00 -0.63 -4.94 121.76 115.75 1tcz s ALA 1065Ca 0.59 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1tcz s ALA 1065Cb -0.71 1.16 0.00 0.00 0.00 0.00 0.00 23.12 23.57 1tcz s ALA 1065CO 0.59 -0.79 0.00 -0.40 0.00 0.00 0.00 175.76 175.17 1tcz n ASP 1066N -1.06 0.00 0.18 0.00 5.68 -1.26 -0.58 116.55 119.51 1tcz n ASP 1066Ca 0.00 -0.78 0.13 0.00 -0.50 0.00 0.00 54.79 53.65 1tcz n ASP 1066Cb 0.62 0.00 0.64 0.00 -1.14 0.00 0.00 41.12 41.24 1tcz n ASP 1066CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 1tcz h GLN 1067N 0.00 0.00 0.00 0.11 -0.00 -1.70 -1.51 115.11 112.00 1tcz h GLN 1067Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1tcz h GLN 1067Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1tcz h GLN 1067CO 0.00 0.00 -0.58 0.25 -0.00 0.00 0.00 178.83 178.50 1tcz n THR 1068N -2.38 0.11 -2.23 1.86 -2.24 -1.26 -4.81 114.28 103.33 1tcz n THR 1068Ca -0.01 -0.10 -0.43 0.00 -2.27 0.00 0.00 64.05 61.25 1tcz n THR 1068Cb 0.10 0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 1tcz n THR 1068CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1tcz s SER 1069N -3.42 6.23 0.35 3.42 0.01 -0.57 -4.87 113.70 114.85 1tcz s SER 1069Ca 0.09 1.05 0.17 0.00 1.31 0.00 0.00 55.95 58.58 1tcz s SER 1069Cb 0.16 -2.54 0.58 0.00 0.21 0.00 0.00 66.02 64.43 1tcz s SER 1069CO 0.71 -1.48 1.69 0.71 0.41 0.00 0.00 173.24 175.28 1tcz h THR 1070N 6.51 0.97 -3.96 1.44 1.35 -1.88 -3.38 112.91 113.96 1tcz h THR 1070Ca -0.30 -1.68 -0.28 0.00 -0.55 0.00 0.00 66.41 63.60 1tcz h THR 1070Cb 1.13 2.01 -0.22 0.00 -1.73 0.00 0.00 68.15 69.33 1tcz h THR 1070CO 1.06 0.42 -0.74 0.42 -0.25 0.00 0.00 175.52 176.43 1tcz s THR 1071N -3.55 0.55 0.09 6.82 -4.23 -1.26 -1.21 115.64 112.85 1tcz s THR 1071Ca 0.00 -1.01 0.09 0.00 -1.18 0.00 0.00 61.69 59.59 1tcz s THR 1071Cb 0.11 -0.60 -0.04 0.00 1.34 0.00 0.00 72.50 73.31 1tcz s THR 1071CO 0.70 -0.33 -0.23 -0.76 -0.54 0.00 0.00 174.62 173.47 1tcz s LEU 1072N -1.46 2.46 -0.21 4.79 1.43 0.06 -4.75 118.68 121.01 1tcz s LEU 1072Ca -0.09 -0.60 -0.06 0.00 -1.03 0.00 0.00 54.13 52.35 1tcz s LEU 1072Cb -0.09 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.71 1tcz s LEU 1072CO 0.00 0.21 0.04 -0.89 0.23 0.00 0.00 176.35 175.94 1tcz s THR 1073N -1.01 4.31 0.05 5.49 2.01 -1.26 -2.54 115.64 122.68 1tcz s THR 1073Ca 0.15 -0.19 -0.01 0.00 0.31 0.00 0.00 61.69 61.95 1tcz s THR 1073Cb -0.10 -2.97 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 1tcz s THR 1073CO 0.06 0.41 -0.03 0.72 -0.69 0.00 0.00 174.62 175.09 1tcz s PHE 1074N 1.03 0.52 0.14 4.92 -0.12 -0.40 -0.46 117.98 123.62 1tcz s PHE 1074Ca 0.03 -1.00 -0.28 0.00 -0.05 0.00 0.00 56.93 55.63 1tcz s PHE 1074Cb -0.14 -0.38 -0.07 0.00 -0.63 0.00 0.00 43.02 41.80 1tcz s PHE 1074CO 0.03 -0.34 0.89 0.71 -0.05 0.00 0.00 175.22 176.45 1tcz s TYR 1075N -3.61 3.86 -0.62 3.49 1.51 0.22 -0.22 117.35 121.98 1tcz s TYR 1075Ca 0.05 1.74 0.05 0.00 -1.01 0.00 0.00 57.07 57.90 1tcz s TYR 1075Cb 0.06 -2.94 0.05 0.00 -0.11 0.00 0.00 41.96 39.02 1tcz s TYR 1075CO -0.09 0.34 0.71 0.36 -1.11 0.00 0.00 175.55 175.76 1tcz n LYS 1076N 2.24 0.03 -3.90 -0.62 2.85 -0.29 -2.46 118.16 116.01 1tcz n LYS 1076Ca -0.01 -0.90 -0.08 0.00 -1.05 0.00 0.00 58.31 56.27 1tcz n LYS 1076Cb 0.49 -1.10 -0.02 0.00 -0.65 0.00 0.00 35.03 33.74 1tcz n LYS 1076CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1tcz s SER 1077N -0.48 -0.13 0.00 -5.58 1.04 -1.23 -4.12 113.70 103.19 1tcz s SER 1077Ca 0.06 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.69 1tcz s SER 1077Cb 0.04 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.87 1tcz s SER 1077CO 0.07 -1.35 0.00 0.61 0.98 0.00 0.00 173.24 173.55 1tcz n GLY 1078N -0.46 1.70 3.26 7.32 0.00 -1.14 -3.74 105.19 112.13 1tcz n GLY 1078Ca -0.04 -2.17 -0.33 0.00 0.00 0.00 0.00 46.02 43.48 1tcz n GLY 1078CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tcz s THR 1079N -1.64 2.65 0.04 2.61 2.01 -1.26 -1.78 115.64 118.27 1tcz s THR 1079Ca 0.00 -0.77 0.08 0.00 0.31 0.00 0.00 61.69 61.31 1tcz s THR 1079Cb 0.00 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.36 1tcz s THR 1079CO 0.00 0.51 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.86 1tcz s PHE 1080N 0.87 2.43 0.19 4.92 0.40 -0.36 -4.95 117.98 121.47 1tcz s PHE 1080Ca -0.04 -0.34 -0.30 0.00 -0.60 0.00 0.00 56.93 55.65 1tcz s PHE 1080Cb -0.15 -1.43 -0.08 0.00 0.51 0.00 0.00 43.02 41.88 1tcz s PHE 1080CO -0.01 0.19 1.10 1.03 0.70 0.00 0.00 175.22 178.22 1tcz s ARG 1081N -1.33 4.60 0.37 0.44 0.52 -1.26 -1.07 118.95 121.22 1tcz s ARG 1081Ca 0.13 1.72 0.14 0.00 -0.52 0.00 0.00 55.73 57.19 1tcz s ARG 1081Cb -0.10 -3.27 0.97 0.00 0.52 0.00 0.00 34.95 33.06 1tcz s ARG 1081CO 0.03 0.09 1.79 -0.92 0.02 0.00 0.00 175.30 176.32 1tcz h TYR 1082N 5.00 0.78 0.00 -0.53 3.20 -1.31 0.10 116.97 124.21 1tcz h TYR 1082Ca -0.44 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1tcz h TYR 1082Cb 1.21 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.25 1tcz h TYR 1082CO 0.62 0.14 -0.10 1.05 -1.64 0.00 0.00 178.16 178.23 1tcz h GLU 1083N 0.53 0.00 0.00 1.82 9.09 -1.92 -3.28 114.58 120.82 1tcz h GLU 1083Ca 0.56 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.80 1tcz h GLU 1083Cb 1.20 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.27 1tcz h GLU 1083CO -0.30 0.00 -1.16 -0.44 0.05 0.00 0.00 179.01 177.16 1tcz h ASP 1084N 0.00 0.00 -3.38 3.06 3.32 -1.37 -3.45 116.42 114.60 1tcz h ASP 1084Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 1tcz h ASP 1084Cb 0.79 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.33 1tcz h ASP 1084CO 0.00 0.65 0.49 -0.69 -1.72 0.00 0.00 179.24 177.97 1tcz s VAL 1085N -2.88 4.13 -1.22 -1.35 1.01 -1.02 -4.87 120.40 114.21 1tcz s VAL 1085Ca -0.01 1.64 -0.11 0.00 0.00 0.00 0.00 61.98 63.50 1tcz s VAL 1085Cb 0.08 -4.05 0.19 0.00 0.00 0.00 0.00 36.38 32.60 1tcz s VAL 1085CO 0.80 0.19 1.54 0.18 0.00 0.00 0.00 175.10 177.81 1tcz n LEU 1086N 3.32 5.74 -4.75 3.92 4.77 0.32 -5.01 117.00 125.32 1tcz n LEU 1086Ca 0.06 -4.61 -0.37 0.00 -0.03 0.00 0.00 56.01 51.06 1tcz n LEU 1086Cb 0.47 -1.55 0.04 0.00 -2.33 0.00 0.00 43.42 40.06 1tcz n LEU 1086CO 0.54 1.03 0.92 0.26 -1.33 0.00 0.00 177.39 178.81 1tcz s TRP 1087N 0.71 2.31 0.50 -1.77 0.52 -1.26 -4.32 118.94 115.63 1tcz s TRP 1087Ca 0.40 1.45 -0.21 0.00 0.02 0.00 0.00 56.10 57.76 1tcz s TRP 1087Cb 0.01 -3.67 -0.07 0.00 -1.15 0.00 0.00 33.47 28.59 1tcz s TRP 1087CO 0.00 -2.62 1.11 -1.25 0.02 0.00 0.00 176.95 174.21 1tcz s PRO 1088N -3.09 3.61 0.29 4.98 0.04 -1.26 -4.92 135.00 134.64 1tcz s PRO 1088Ca 0.75 1.59 0.01 0.00 0.04 0.00 0.00 61.00 63.39 1tcz s PRO 1088Cb -0.36 -2.16 0.54 0.00 0.04 0.00 0.00 34.50 32.56 1tcz s PRO 1088CO 0.41 -0.63 1.86 0.93 0.04 0.00 0.00 177.00 179.61 1tcz h GLU 1089N 1.58 0.99 0.00 4.56 4.39 -1.94 -1.57 114.58 122.59 1tcz h GLU 1089Ca -0.50 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.14 1tcz h GLU 1089Cb 1.25 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 1tcz h GLU 1089CO 0.59 0.65 0.07 0.00 -1.16 0.00 0.00 179.01 179.16 1tcz h ALA 1090N 1.52 1.07 -1.70 3.43 0.00 -1.90 -3.30 119.26 118.38 1tcz h ALA 1090Ca 0.47 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.65 1tcz h ALA 1090Cb 0.40 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.02 1tcz h ALA 1090CO -0.23 -0.07 1.30 0.00 0.00 0.00 0.00 179.25 180.26 1tcz s ALA 1091N -4.03 3.89 -1.56 0.00 0.00 -0.59 -4.69 121.76 114.78 1tcz s ALA 1091Ca -0.04 -3.26 0.27 0.00 0.00 0.00 0.00 51.96 48.93 1tcz s ALA 1091Cb 0.11 -4.13 0.95 0.00 0.00 0.00 0.00 23.12 20.05 1tcz s ALA 1091CO 0.35 -2.82 1.69 -1.13 0.00 0.00 0.00 175.76 173.85 1tcz n SER 1092N 5.86 0.66 -4.47 0.00 3.41 -1.25 -4.81 113.62 113.02 1tcz n SER 1092Ca 0.35 -0.58 -0.38 0.00 -0.26 0.00 0.00 58.87 58.00 1tcz n SER 1092Cb 0.44 0.02 -0.12 0.00 -0.26 0.00 0.00 64.21 64.29 1tcz n SER 1092CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1tcz s ASP 1093N -2.59 5.56 0.19 4.04 2.15 -1.26 -4.99 116.67 119.77 1tcz s ASP 1093Ca 0.24 -0.35 -0.12 0.00 0.43 0.00 0.00 52.55 52.75 1tcz s ASP 1093Cb 0.19 -2.01 0.19 0.00 -0.30 0.00 0.00 42.92 40.99 1tcz s ASP 1093CO 0.53 -0.13 1.76 -0.08 -0.17 0.00 0.00 175.17 177.07 1tcz h GLU 1094N 8.34 0.41 -0.60 4.34 4.81 -2.00 -2.24 114.58 127.64 1tcz h GLU 1094Ca -0.34 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 1tcz h GLU 1094Cb 1.16 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 1tcz h GLU 1094CO 0.60 0.27 0.38 1.15 -0.73 0.00 0.00 179.01 180.68 1tcz h THR 1095N 0.43 1.17 0.00 0.32 2.02 -1.99 0.71 112.91 115.57 1tcz h THR 1095Ca 0.25 -0.35 -0.05 0.00 0.77 0.00 0.00 66.41 67.03 1tcz h THR 1095Cb 0.25 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 1tcz h THR 1095CO -0.23 0.17 -0.24 0.11 0.37 0.00 0.00 175.52 175.70 1tcz h LYS 1096N 0.82 0.00 -0.10 6.66 1.57 -1.89 -2.01 116.57 121.62 1tcz h LYS 1096Ca 0.22 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.86 1tcz h LYS 1096Cb -0.05 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.27 1tcz h LYS 1096CO -0.04 0.24 -0.46 0.87 -0.57 0.00 0.00 179.45 179.48 1tcz h LYS 1097N 0.00 0.49 0.00 3.15 1.57 -0.81 -1.99 116.57 118.98 1tcz h LYS 1097Ca -0.00 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.37 1tcz h LYS 1097Cb 0.42 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1tcz h LYS 1097CO 0.03 1.02 -0.05 0.00 -0.57 0.00 0.00 179.45 179.88 1tcz h ARG 1098N 0.08 0.00 -0.35 3.15 3.08 -0.26 -1.79 114.38 118.28 1tcz h ARG 1098Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1tcz h ARG 1098Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.15 1tcz h ARG 1098CO 0.10 0.05 0.00 0.25 -1.07 0.00 0.00 179.97 179.30 1tcz n THR 1099N -3.75 1.46 0.19 2.04 -2.24 -0.81 -4.40 114.28 106.77 1tcz n THR 1099Ca -0.02 -1.28 0.15 0.00 -2.27 0.00 0.00 64.05 60.63 1tcz n THR 1099Cb 0.15 0.24 0.77 0.00 -2.10 0.00 0.00 70.33 69.39 1tcz n THR 1099CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tcz h ALA 1100N 2.15 1.94 -0.36 6.98 0.00 -0.52 -2.13 119.26 127.32 1tcz h ALA 1100Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1tcz h ALA 1100Cb 1.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1tcz h ALA 1100CO 0.09 -0.25 0.00 1.19 0.00 0.00 0.00 179.25 180.28 1tcz n PHE 1101N -4.09 0.48 -1.69 0.00 3.01 -1.26 -4.32 117.46 109.58 1tcz n PHE 1101Ca 0.01 -0.37 -0.44 0.00 1.01 0.00 0.00 57.45 57.66 1tcz n PHE 1101Cb 0.29 -0.01 -0.03 0.00 -0.01 0.00 0.00 39.48 39.71 1tcz n PHE 1101CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1tcz n ALA 1102N 0.88 2.02 0.00 4.37 0.00 -0.80 -0.55 120.51 126.43 1tcz n ALA 1102Ca 0.14 0.42 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1tcz n ALA 1102Cb 0.46 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.49 1tcz n ALA 1102CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tcz n GLY 1103N 3.48 2.49 2.09 0.00 0.00 -1.26 -5.06 105.19 106.93 1tcz n GLY 1103Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 1tcz n GLY 1103CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tcz n THR 1104N -1.59 0.00 1.49 2.61 -2.24 0.28 -5.00 114.28 109.83 1tcz n THR 1104Ca 0.00 -1.07 0.14 0.00 -2.27 0.00 0.00 64.05 60.85 1tcz n THR 1104Cb 0.00 -0.62 0.57 0.00 -2.10 0.00 0.00 70.33 68.18 1tcz n THR 1104CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tcz n ALA 1105N -2.58 2.75 -2.51 6.98 0.00 -1.26 -4.85 120.51 119.03 1tcz n ALA 1105Ca -0.08 -0.36 -0.36 0.00 0.00 0.00 0.00 53.44 52.64 1tcz n ALA 1105Cb 0.33 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 1tcz n ALA 1105CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1tcz s ILE 1106N -2.23 5.03 0.15 0.00 1.01 -1.26 -2.89 121.20 121.02 1tcz s ILE 1106Ca 0.34 0.67 -0.05 0.00 0.00 0.00 0.00 60.65 61.62 1tcz s ILE 1106Cb 0.20 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 1tcz s ILE 1106CO 0.42 0.41 0.17 -0.94 0.00 0.00 0.00 174.94 175.00 1tcz s SER 1107N -1.45 0.17 -0.04 3.58 1.04 -0.74 -4.49 113.70 111.78 1tcz s SER 1107Ca 0.29 -1.07 0.06 0.00 0.48 0.00 0.00 55.95 55.72 1tcz s SER 1107Cb -0.15 0.37 -0.02 0.00 0.10 0.00 0.00 66.02 66.32 1tcz s SER 1107CO 0.16 -0.82 -0.23 -0.63 0.98 0.00 0.00 173.24 172.70 1tcz s ILE 1108N -4.02 2.27 0.00 -1.02 -1.09 -1.26 -1.23 121.20 114.85 1tcz s ILE 1108Ca 0.22 -1.01 0.00 0.00 -2.23 0.00 0.00 60.65 57.63 1tcz s ILE 1108Cb 0.05 -1.82 0.00 0.00 -1.58 0.00 0.00 42.46 39.11 1tcz s ILE 1108CO 0.02 0.58 0.47 0.55 -1.23 0.00 0.00 174.94 175.33