#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktk h ILE 19 N 0.00 1.26 -0.31 5.18 6.09 -2.06 -2.48 117.51 125.19 3ktk h ILE 19 Ca 0.00 -0.60 -0.18 0.00 -1.37 0.00 0.00 64.86 62.71 3ktk h ILE 19 Cb 0.00 0.01 -0.00 0.00 0.47 0.00 0.00 36.82 37.30 3ktk h ILE 19 CO 0.00 0.28 -0.50 1.88 -3.07 0.00 0.00 178.15 176.74 3ktk h TYR 20 N 1.26 1.09 -0.00 2.19 0.05 -1.99 -2.66 116.97 116.91 3ktk h TYR 20 Ca 0.32 -0.38 0.00 0.00 0.05 0.00 0.00 58.73 58.73 3ktk h TYR 20 Cb -0.01 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 37.52 3ktk h TYR 20 CO 0.01 1.20 0.00 1.03 -1.05 0.00 0.00 178.16 179.35 3ktk h SER 21 N 0.67 0.00 -0.31 3.88 0.87 -1.92 0.80 113.55 117.53 3ktk h SER 21 Ca 0.02 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.40 3ktk h SER 21 Cb 1.11 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.06 3ktk h SER 21 CO 0.11 0.00 -0.51 -0.09 -0.53 0.00 0.00 176.83 175.81 3ktk h ARG 22 N 0.00 0.89 -0.22 2.24 9.65 -1.14 -2.47 114.38 123.33 3ktk h ARG 22 Ca 0.00 -0.55 -0.09 0.00 -1.10 0.00 0.00 59.98 58.25 3ktk h ARG 22 Cb 0.01 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.63 3ktk h ARG 22 CO -0.00 1.19 -0.24 -0.07 2.80 0.00 0.00 179.97 183.65 3ktk h LEU 23 N 0.69 0.41 -1.07 3.80 3.38 -0.60 -2.28 115.31 119.63 3ktk h LEU 23 Ca 0.02 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 3ktk h LEU 23 Cb 1.12 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3ktk h LEU 23 CO 0.12 0.65 -0.25 0.25 0.09 0.00 0.00 178.44 179.30 3ktk h LEU 24 N 0.37 0.35 -2.30 1.67 5.85 -0.88 -0.12 115.31 120.25 3ktk h LEU 24 Ca 0.06 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 3ktk h LEU 24 Cb 0.62 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 3ktk h LEU 24 CO 0.04 0.61 -0.04 0.11 -0.34 0.00 0.00 178.44 178.82 3ktk h LYS 25 N 0.31 0.00 -0.53 1.25 6.56 -0.93 -1.33 116.57 121.91 3ktk h LYS 25 Ca 0.05 0.00 -0.24 0.00 -1.06 0.00 0.00 60.65 59.40 3ktk h LYS 25 Cb 0.62 0.00 -0.14 0.00 -0.57 0.00 0.00 32.23 32.14 3ktk h LYS 25 CO 0.04 0.04 0.13 -0.25 -2.06 0.00 0.00 179.45 177.36 3ktk n ASP 26 N -3.71 3.14 -3.62 0.86 8.00 -0.70 -4.96 116.55 115.57 3ktk n ASP 26 Ca -0.03 -3.60 -0.22 0.00 0.71 0.00 0.00 54.79 51.65 3ktk n ASP 26 Cb 0.14 -0.68 0.06 0.00 -0.02 0.00 0.00 41.12 40.62 3ktk n ASP 26 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3ktk n ARG 27 N -0.98 -6.41 -4.01 -1.24 1.74 -0.50 -4.90 116.66 100.36 3ktk n ARG 27 Ca 0.39 0.75 -0.30 0.00 -0.77 0.00 0.00 57.85 57.91 3ktk n ARG 27 Cb 1.20 -5.65 -0.16 0.00 -1.02 0.00 0.00 32.46 26.83 3ktk n ARG 27 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ktk s ILE 28 N -3.41 1.60 -0.16 0.55 1.01 -0.14 -1.13 121.20 119.52 3ktk s ILE 28 Ca 0.27 -0.76 -0.06 0.00 0.00 0.00 0.00 60.65 60.10 3ktk s ILE 28 Cb -0.13 -1.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 3ktk s ILE 28 CO 0.77 0.36 0.04 -0.63 0.00 0.00 0.00 174.94 175.48 3ktk s ILE 29 N 1.46 4.63 -0.32 2.92 1.01 0.61 -3.30 121.20 128.20 3ktk s ILE 29 Ca 0.03 -0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.47 3ktk s ILE 29 Cb -0.14 -3.06 -0.01 0.00 0.01 0.00 0.00 42.46 39.26 3ktk s ILE 29 CO -0.10 0.50 0.20 -0.04 0.00 0.00 0.00 174.94 175.50 3ktk s MET 30 N 0.08 3.44 -0.80 2.79 -1.94 -1.26 -0.24 119.30 121.37 3ktk s MET 30 Ca 0.04 -0.67 -0.07 0.00 -1.71 0.00 0.00 55.69 53.29 3ktk s MET 30 Cb -0.12 -3.69 0.20 0.00 2.01 0.00 0.00 34.83 33.23 3ktk s MET 30 CO 0.01 -0.42 0.69 -1.17 -0.01 0.00 0.00 175.02 174.11 3ktk s LEU 31 N 1.67 5.90 -0.31 -0.03 2.96 0.16 -4.89 118.68 124.14 3ktk s LEU 31 Ca 0.05 -3.07 0.08 0.00 -0.22 0.00 0.00 54.13 50.98 3ktk s LEU 31 Cb -0.17 -2.02 0.46 0.00 0.50 0.00 0.00 46.19 44.96 3ktk s LEU 31 CO 0.09 -0.38 1.16 0.61 -1.32 0.00 0.00 176.35 176.51 3ktk n GLY 32 N 3.31 5.81 3.63 7.98 0.00 -1.26 -1.31 105.19 123.35 3ktk n GLY 32 Ca 0.14 -2.51 -0.09 0.00 0.00 0.00 0.00 46.02 43.57 3ktk n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ktk s SER 33 N -3.60 -0.26 0.75 1.61 1.04 -1.24 -4.86 113.70 107.14 3ktk s SER 33 Ca 0.48 -0.55 -0.15 0.00 0.48 0.00 0.00 55.95 56.21 3ktk s SER 33 Cb 0.40 0.63 0.03 0.00 0.10 0.00 0.00 66.02 67.18 3ktk s SER 33 CO -0.01 -1.15 1.02 0.00 0.98 0.00 0.00 173.24 174.08 3ktk n ALA 34 N -0.39 -0.23 -2.56 5.32 0.00 -1.26 -4.57 120.51 116.81 3ktk n ALA 34 Ca -0.07 -0.24 -0.41 0.00 0.00 0.00 0.00 53.44 52.72 3ktk n ALA 34 Cb 0.62 -2.14 -0.08 0.00 0.00 0.00 0.00 19.45 17.84 3ktk n ALA 34 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ktk s ILE 35 N -1.90 5.01 0.34 0.00 1.01 0.34 -4.88 121.20 121.12 3ktk s ILE 35 Ca 0.73 0.40 0.03 0.00 0.00 0.00 0.00 60.65 61.81 3ktk s ILE 35 Cb -0.33 -3.96 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 3ktk s ILE 35 CO 0.51 -0.20 0.09 1.51 0.00 0.00 0.00 174.94 176.84 3ktk s ASP 36 N 1.75 2.28 0.34 3.58 -4.77 -1.26 -0.53 116.67 118.06 3ktk s ASP 36 Ca 0.19 -1.47 0.10 0.00 -3.30 0.00 0.00 52.55 48.07 3ktk s ASP 36 Cb -0.15 0.14 0.85 0.00 -1.09 0.00 0.00 42.92 42.67 3ktk s ASP 36 CO 0.13 -0.73 1.80 0.44 0.70 0.00 0.00 175.17 177.52 3ktk h ASP 37 N 2.06 0.66 0.34 2.11 3.45 -1.96 0.83 116.42 123.91 3ktk h ASP 37 Ca -0.39 0.08 -0.02 0.00 0.43 0.00 0.00 57.03 57.13 3ktk h ASP 37 Cb 1.25 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 3ktk h ASP 37 CO 0.64 0.25 -0.16 0.78 -1.57 0.00 0.00 179.24 179.17 3ktk h ASN 38 N 0.65 -0.39 -0.39 6.45 2.35 -1.99 0.70 115.58 122.96 3ktk h ASN 38 Ca 0.54 -0.07 0.05 0.00 -0.55 0.00 0.00 56.30 56.26 3ktk h ASN 38 Cb 0.99 0.10 -0.04 0.00 0.05 0.00 0.00 38.32 39.42 3ktk h ASN 38 CO -0.31 -0.16 0.14 0.58 -1.65 0.00 0.00 177.43 176.03 3ktk h VAL 39 N -0.60 0.89 -0.32 2.81 2.07 -1.72 -1.61 116.25 117.78 3ktk h VAL 39 Ca -0.05 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.40 3ktk h VAL 39 Cb 0.44 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3ktk h VAL 39 CO 0.08 0.06 0.14 0.00 0.02 0.00 0.00 177.57 177.86 3ktk h ALA 40 N 1.25 0.38 -0.37 1.67 0.00 -0.71 -0.68 119.26 120.79 3ktk h ALA 40 Ca 0.18 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3ktk h ALA 40 Cb 0.16 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3ktk h ALA 40 CO -0.18 -0.25 0.09 -0.91 0.00 0.00 0.00 179.25 178.00 3ktk h ASN 41 N 0.30 0.50 0.15 0.00 2.35 -0.47 -0.60 115.58 117.81 3ktk h ASN 41 Ca 0.13 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 3ktk h ASN 41 Cb 0.07 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.31 3ktk h ASN 41 CO -0.11 0.51 -0.07 -1.28 -1.65 0.00 0.00 177.43 174.83 3ktk h SER 42 N 0.54 -0.17 -0.57 5.81 0.87 -0.64 -1.19 113.55 118.19 3ktk h SER 42 Ca 0.13 -0.27 0.05 0.00 -1.23 0.00 0.00 61.79 60.47 3ktk h SER 42 Cb 0.21 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.17 3ktk h SER 42 CO -0.00 0.19 0.29 0.40 -0.53 0.00 0.00 176.83 177.18 3ktk h ILE 43 N -0.56 0.94 -0.50 2.23 1.08 -0.96 -0.52 117.51 119.22 3ktk h ILE 43 Ca -0.02 -0.19 0.01 0.00 -0.39 0.00 0.00 64.86 64.27 3ktk h ILE 43 Cb 0.43 0.34 -0.03 0.00 -3.07 0.00 0.00 36.82 34.49 3ktk h ILE 43 CO 0.03 0.10 0.32 0.58 -0.69 0.00 0.00 178.15 178.50 3ktk h VAL 44 N 0.55 1.10 -0.46 1.67 2.07 -1.06 -0.79 116.25 119.33 3ktk h VAL 44 Ca 0.26 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 3ktk h VAL 44 Cb 0.18 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 3ktk h VAL 44 CO -0.18 0.12 0.23 0.28 0.02 0.00 0.00 177.57 178.04 3ktk h SER 45 N 0.65 0.60 -0.83 0.57 0.02 -0.62 -1.71 113.55 112.24 3ktk h SER 45 Ca 0.19 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 3ktk h SER 45 Cb -0.04 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 3ktk h SER 45 CO -0.06 0.55 0.43 1.56 -1.14 0.00 0.00 176.83 178.17 3ktk h GLN 46 N 0.61 1.17 -0.33 3.45 4.20 -0.82 0.97 115.11 124.36 3ktk h GLN 46 Ca 0.16 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3ktk h GLN 46 Cb 0.10 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 3ktk h GLN 46 CO -0.02 0.88 0.11 -0.07 -0.67 0.00 0.00 178.83 179.07 3ktk h LEU 47 N 1.16 0.48 -0.75 1.46 3.38 -0.89 0.14 115.31 120.30 3ktk h LEU 47 Ca 0.29 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 3ktk h LEU 47 Cb 0.07 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3ktk h LEU 47 CO -0.04 0.54 -0.05 -0.07 0.09 0.00 0.00 178.44 178.91 3ktk h LEU 48 N 0.39 0.89 0.64 1.67 3.38 -1.09 -1.26 115.31 119.93 3ktk h LEU 48 Ca 0.11 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 3ktk h LEU 48 Cb 0.23 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.74 3ktk h LEU 48 CO -0.01 0.98 -0.31 0.15 0.09 0.00 0.00 178.44 179.34 3ktk h PHE 49 N 0.83 -0.80 -0.88 1.13 3.57 -0.55 -0.81 116.94 119.43 3ktk h PHE 49 Ca 0.15 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.69 3ktk h PHE 49 Cb 0.56 0.26 -0.06 0.00 2.79 0.00 0.00 35.95 39.51 3ktk h PHE 49 CO 0.03 -0.47 0.58 -0.07 -2.23 0.00 0.00 178.31 176.15 3ktk h LEU 50 N -0.95 0.88 -1.13 0.59 3.38 -0.91 0.07 115.31 117.23 3ktk h LEU 50 Ca -0.09 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 3ktk h LEU 50 Cb 0.69 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3ktk h LEU 50 CO 0.14 0.56 -0.34 0.00 0.09 0.00 0.00 178.44 178.90 3ktk h ALA 51 N 1.52 1.28 -0.21 1.53 0.00 -1.09 -2.21 119.26 120.09 3ktk h ALA 51 Ca 0.38 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 3ktk h ALA 51 Cb 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3ktk h ALA 51 CO -0.14 0.50 -0.39 0.00 0.00 0.00 0.00 179.25 179.23 3ktk h ALA 52 N 1.51 0.33 -0.71 0.00 0.00 0.48 -2.62 119.26 118.24 3ktk h ALA 52 Ca 0.02 -0.45 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 3ktk h ALA 52 Cb 0.68 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3ktk h ALA 52 CO 0.05 0.42 0.20 0.93 0.00 0.00 0.00 179.25 180.85 3ktk h GLU 53 N 0.32 1.11 -1.20 0.00 5.08 -0.98 -3.41 114.58 115.50 3ktk h GLU 53 Ca 0.01 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 3ktk h GLU 53 Cb 0.98 -0.16 -0.23 0.00 0.50 0.00 0.00 28.75 29.85 3ktk h GLU 53 CO 0.09 0.96 -0.44 0.34 -1.00 0.00 0.00 179.01 178.96 3ktk s ASP 54 N -6.45 -1.05 0.00 1.42 -1.08 -0.85 -5.01 116.67 103.65 3ktk s ASP 54 Ca -0.12 -0.11 0.08 0.00 -0.52 0.00 0.00 52.55 51.89 3ktk s ASP 54 Cb 0.15 1.76 0.51 0.00 -1.46 0.00 0.00 42.92 43.88 3ktk s ASP 54 CO 0.84 -0.30 0.96 -0.81 0.52 0.00 0.00 175.17 176.39 3ktk n PRO 55 N 5.26 0.51 -0.09 4.34 -0.04 -0.99 -3.52 135.00 140.47 3ktk n PRO 55 Ca 0.05 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.33 3ktk n PRO 55 Cb 0.53 -1.26 -0.06 0.00 -0.04 0.00 0.00 33.50 32.67 3ktk n PRO 55 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3ktk n GLU 56 N -0.76 0.42 -1.73 0.54 -0.58 -1.26 -3.20 120.64 114.07 3ktk n GLU 56 Ca 0.06 0.18 -0.42 0.00 -0.42 0.00 0.00 57.16 56.56 3ktk n GLU 56 Cb 0.03 -1.21 -0.03 0.00 -0.57 0.00 0.00 31.44 29.66 3ktk n GLU 56 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3ktk s LYS 57 N -2.45 4.13 0.92 3.49 1.02 -1.23 -4.68 119.74 120.94 3ktk s LYS 57 Ca -0.27 2.61 -0.11 0.00 0.02 0.00 0.00 55.97 58.22 3ktk s LYS 57 Cb 0.09 -3.11 0.15 0.00 -0.52 0.00 0.00 37.83 34.44 3ktk s LYS 57 CO 0.35 -0.76 1.10 -1.83 -0.92 0.00 0.00 175.35 173.29 3ktk s GLU 58 N 1.28 1.01 0.09 1.68 -1.05 -1.26 -4.69 118.70 115.75 3ktk s GLU 58 Ca 0.75 1.10 0.10 0.00 -0.15 0.00 0.00 54.97 56.77 3ktk s GLU 58 Cb -0.49 -1.76 -0.04 0.00 -0.44 0.00 0.00 34.13 31.40 3ktk s GLU 58 CO 0.32 -2.49 -0.26 0.42 0.95 0.00 0.00 175.26 174.20 3ktk s ILE 59 N -2.77 2.25 -0.18 1.83 1.01 -0.42 -4.94 121.20 117.99 3ktk s ILE 59 Ca 0.65 -1.58 -0.01 0.00 0.00 0.00 0.00 60.65 59.71 3ktk s ILE 59 Cb -0.20 -1.95 -0.00 0.00 0.01 0.00 0.00 42.46 40.32 3ktk s ILE 59 CO 0.58 0.21 -0.13 -0.44 0.00 0.00 0.00 174.94 175.17 3ktk s SER 60 N -1.71 3.78 -0.39 3.58 0.01 -0.28 -0.91 113.70 117.78 3ktk s SER 60 Ca 0.13 -0.47 -0.09 0.00 1.31 0.00 0.00 55.95 56.84 3ktk s SER 60 Cb -0.10 -1.60 0.06 0.00 0.21 0.00 0.00 66.02 64.58 3ktk s SER 60 CO 0.04 0.04 0.20 -0.22 0.41 0.00 0.00 173.24 173.72 3ktk s LEU 61 N 1.07 4.83 -0.05 2.44 2.96 0.20 -0.29 118.68 129.84 3ktk s LEU 61 Ca -0.00 -1.31 -0.25 0.00 -0.22 0.00 0.00 54.13 52.34 3ktk s LEU 61 Cb -0.15 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 3ktk s LEU 61 CO -0.03 -0.45 0.79 -0.31 -1.32 0.00 0.00 176.35 175.03 3ktk s TYR 62 N 1.44 3.59 -0.09 5.38 2.02 0.67 -2.07 117.35 128.28 3ktk s TYR 62 Ca 0.02 1.37 0.04 0.00 -0.37 0.00 0.00 57.07 58.13 3ktk s TYR 62 Cb -0.21 -2.90 -0.00 0.00 -0.40 0.00 0.00 41.96 38.44 3ktk s TYR 62 CO 0.03 0.04 -0.24 0.42 -1.57 0.00 0.00 175.55 174.23 3ktk s ILE 63 N 0.95 2.11 -0.48 2.71 1.01 0.13 -0.67 121.20 126.96 3ktk s ILE 63 Ca 0.42 -1.01 0.06 0.00 0.00 0.00 0.00 60.65 60.12 3ktk s ILE 63 Cb -0.19 -1.80 0.22 0.00 0.01 0.00 0.00 42.46 40.70 3ktk s ILE 63 CO 0.20 0.56 0.72 -3.20 0.00 0.00 0.00 174.94 173.23 3ktk n ASN 64 N 3.41 -2.43 -4.04 3.58 5.15 -0.43 -0.48 115.26 120.02 3ktk n ASN 64 Ca -0.19 -2.99 -0.12 0.00 -0.60 0.00 0.00 54.58 50.68 3ktk n ASN 64 Cb 0.53 1.22 -0.11 0.00 -0.53 0.00 0.00 39.78 40.88 3ktk n ASN 64 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3ktk s SER 65 N -0.55 0.73 0.00 1.20 0.15 -0.63 -3.62 113.70 110.99 3ktk s SER 65 Ca 0.32 -0.52 0.27 0.00 0.70 0.00 0.00 55.95 56.72 3ktk s SER 65 Cb 0.12 0.04 0.95 0.00 -1.71 0.00 0.00 66.02 65.42 3ktk s SER 65 CO -0.16 -0.21 1.69 -0.81 1.20 0.00 0.00 173.24 174.95 3ktk n PRO 66 N 1.56 0.63 0.00 5.44 -0.04 -1.26 -1.77 135.00 139.56 3ktk n PRO 66 Ca -0.22 -0.30 0.00 0.00 -0.04 0.00 0.00 63.50 62.93 3ktk n PRO 66 Cb 0.55 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 3ktk n PRO 66 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ktk n GLY 67 N 1.34 -0.30 0.00 0.55 0.00 -1.14 -4.17 105.19 101.48 3ktk n GLY 67 Ca 0.12 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.12 3ktk n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktk n GLY 68 N 0.00 -0.39 3.75 -0.02 0.00 -1.26 0.13 105.19 107.39 3ktk n GLY 68 Ca 0.00 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 3ktk n GLY 68 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ktk s SER 69 N -4.00 6.42 0.09 1.61 0.15 0.31 -4.81 113.70 113.47 3ktk s SER 69 Ca 0.00 2.90 -0.17 0.00 0.70 0.00 0.00 55.95 59.38 3ktk s SER 69 Cb 0.00 -2.63 -0.08 0.00 -1.71 0.00 0.00 66.02 61.60 3ktk s SER 69 CO 0.00 -0.89 1.47 0.40 1.20 0.00 0.00 173.24 175.43 3ktk h ILE 70 N 3.45 1.29 0.00 6.45 2.04 -1.97 -1.59 117.51 127.18 3ktk h ILE 70 Ca -0.46 -1.16 -0.06 0.00 1.00 0.00 0.00 64.86 64.18 3ktk h ILE 70 Cb 1.22 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 3ktk h ILE 70 CO 0.81 0.37 -0.27 0.71 0.00 0.00 0.00 178.15 179.77 3ktk h THR 71 N 0.33 0.87 -0.11 -0.27 1.35 -1.99 -1.37 112.91 111.72 3ktk h THR 71 Ca 0.07 -1.04 -0.18 0.00 -0.55 0.00 0.00 66.41 64.71 3ktk h THR 71 Cb 0.60 1.62 0.01 0.00 -1.73 0.00 0.00 68.15 68.65 3ktk h THR 71 CO 0.03 0.26 -0.63 0.00 -0.25 0.00 0.00 175.52 174.93 3ktk h ALA 72 N 1.73 0.22 -0.63 6.62 0.00 -1.88 -2.49 119.26 122.84 3ktk h ALA 72 Ca -0.00 -0.55 -0.07 0.00 0.00 0.00 0.00 54.91 54.28 3ktk h ALA 72 Cb 0.60 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 3ktk h ALA 72 CO 0.03 0.50 0.12 0.78 0.00 0.00 0.00 179.25 180.68 3ktk h GLY 73 N 0.26 1.11 2.00 0.00 0.00 -0.98 -2.52 103.07 102.94 3ktk h GLY 73 Ca -0.05 -0.72 -0.05 0.00 0.00 0.00 0.00 47.33 46.51 3ktk h GLY 73 CO 0.13 0.67 -0.23 -0.33 0.00 0.00 0.00 176.54 176.78 3ktk h MET 74 N 0.95 0.00 -0.40 4.80 2.86 -1.28 0.30 114.93 122.15 3ktk h MET 74 Ca 0.19 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.77 3ktk h MET 74 Cb 0.41 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 3ktk h MET 74 CO 0.01 0.23 -0.01 0.00 1.06 0.00 0.00 176.91 178.19 3ktk h ALA 75 N 1.77 0.54 -0.08 6.32 0.00 -1.03 0.18 119.26 126.97 3ktk h ALA 75 Ca -0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3ktk h ALA 75 Cb 0.55 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3ktk h ALA 75 CO 0.03 0.34 -0.01 0.82 0.00 0.00 0.00 179.25 180.43 3ktk h ILE 76 N 0.55 1.27 -0.12 0.00 2.04 -0.98 -2.59 117.51 117.68 3ktk h ILE 76 Ca 0.11 -0.86 0.04 0.00 1.00 0.00 0.00 64.86 65.15 3ktk h ILE 76 Cb 0.50 1.69 -0.05 0.00 -0.74 0.00 0.00 36.82 38.23 3ktk h ILE 76 CO 0.02 0.24 -0.15 0.22 0.00 0.00 0.00 178.15 178.48 3ktk h TYR 77 N -0.17 -0.38 -0.71 1.37 3.20 -0.29 -0.21 116.97 119.79 3ktk h TYR 77 Ca 0.02 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.96 3ktk h TYR 77 Cb 0.38 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.80 3ktk h TYR 77 CO 0.04 -0.22 0.47 -0.44 -1.64 0.00 0.00 178.16 176.37 3ktk h ASP 78 N -0.19 0.70 -0.15 -2.11 3.45 -0.66 -1.89 116.42 115.58 3ktk h ASP 78 Ca 0.09 -0.00 -0.18 0.00 0.43 0.00 0.00 57.03 57.36 3ktk h ASP 78 Cb 0.32 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 38.93 3ktk h ASP 78 CO -0.24 0.47 -0.59 0.74 -1.57 0.00 0.00 179.24 178.06 3ktk h THR 79 N 0.81 1.29 -0.97 0.35 2.02 -0.96 -0.29 112.91 115.16 3ktk h THR 79 Ca 0.29 -1.80 0.06 0.00 0.77 0.00 0.00 66.41 65.73 3ktk h THR 79 Cb 0.14 1.74 -0.06 0.00 -1.74 0.00 0.00 68.15 68.22 3ktk h THR 79 CO -0.09 0.58 0.63 0.24 0.37 0.00 0.00 175.52 177.25 3ktk h MET 80 N 0.56 1.12 -0.05 6.66 2.86 -0.31 -2.53 114.93 123.24 3ktk h MET 80 Ca 0.00 -0.07 -0.25 0.00 -2.06 0.00 0.00 59.70 57.32 3ktk h MET 80 Cb 1.18 -0.25 0.02 0.00 0.06 0.00 0.00 31.60 32.60 3ktk h MET 80 CO 0.12 0.74 -0.95 1.96 1.06 0.00 0.00 176.91 179.85 3ktk h GLN 81 N 1.15 0.72 -0.01 1.72 1.08 -1.14 -3.36 115.11 115.28 3ktk h GLN 81 Ca 0.41 -0.70 -0.00 0.00 -1.45 0.00 0.00 58.65 56.91 3ktk h GLN 81 Cb 0.14 0.18 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 3ktk h GLN 81 CO -0.15 1.29 0.01 0.35 -0.95 0.00 0.00 178.83 179.37 3ktk h PHE 82 N 0.44 0.02 -4.14 2.96 3.57 -0.68 -3.45 116.94 115.65 3ktk h PHE 82 Ca -0.10 -0.00 -0.53 0.00 3.53 0.00 0.00 57.97 60.87 3ktk h PHE 82 Cb 1.59 -0.00 0.12 0.00 2.79 0.00 0.00 35.95 40.45 3ktk h PHE 82 CO 0.09 0.13 0.42 0.96 -2.23 0.00 0.00 178.31 177.68 3ktk s ILE 83 N -5.73 2.65 0.03 1.41 -4.36 -0.99 -4.98 121.20 109.24 3ktk s ILE 83 Ca -0.14 0.36 -0.21 0.00 -0.26 0.00 0.00 60.65 60.40 3ktk s ILE 83 Cb 0.05 -3.00 -0.16 0.00 1.25 0.00 0.00 42.46 40.60 3ktk s ILE 83 CO 0.67 -0.14 1.30 0.11 0.24 0.00 0.00 174.94 177.12 3ktk h LYS 84 N 0.32 0.33 -6.57 0.37 6.56 -1.87 -3.45 116.57 112.26 3ktk h LYS 84 Ca -0.49 -0.19 -0.59 0.00 -1.06 0.00 0.00 60.65 58.32 3ktk h LYS 84 Cb 1.29 0.02 0.13 0.00 -0.57 0.00 0.00 32.23 33.09 3ktk h LYS 84 CO 0.53 0.76 0.10 -2.30 -2.06 0.00 0.00 179.45 176.49 3ktk n PRO 85 N -4.55 1.29 -2.86 3.15 -0.02 -1.19 -4.91 135.00 125.91 3ktk n PRO 85 Ca -0.07 0.46 -0.41 0.00 -2.02 0.00 0.00 63.50 61.47 3ktk n PRO 85 Cb 0.39 -1.95 -0.04 0.00 -0.02 0.00 0.00 33.50 31.87 3ktk n PRO 85 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3ktk s LYS 86 N -1.86 4.57 -0.32 -0.52 1.02 -1.26 -4.85 119.74 116.52 3ktk s LYS 86 Ca 0.62 1.24 -0.10 0.00 0.02 0.00 0.00 55.97 57.74 3ktk s LYS 86 Cb -0.60 -3.39 -0.01 0.00 -0.52 0.00 0.00 37.83 33.32 3ktk s LYS 86 CO 0.58 0.18 0.17 0.08 -0.92 0.00 0.00 175.35 175.44 3ktk s VAL 87 N 0.22 4.70 0.20 3.17 1.01 -1.26 -1.30 120.40 127.13 3ktk s VAL 87 Ca 0.43 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.95 3ktk s VAL 87 Cb -0.21 -3.41 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 3ktk s VAL 87 CO 0.26 0.05 0.46 -0.94 0.00 0.00 0.00 175.10 174.93 3ktk s SER 88 N 1.63 6.53 -0.01 3.32 1.04 -0.09 -0.04 113.70 126.08 3ktk s SER 88 Ca 0.05 0.71 0.06 0.00 0.48 0.00 0.00 55.95 57.25 3ktk s SER 88 Cb -0.17 -2.14 -0.02 0.00 0.10 0.00 0.00 66.02 63.79 3ktk s SER 88 CO 0.07 -0.03 -0.19 0.42 0.98 0.00 0.00 173.24 174.49 3ktk s THR 89 N -1.78 1.51 -0.13 2.02 -4.23 -0.86 -0.63 115.64 111.54 3ktk s THR 89 Ca 0.44 -0.86 0.00 0.00 -1.18 0.00 0.00 61.69 60.09 3ktk s THR 89 Cb -0.12 -1.26 0.02 0.00 1.34 0.00 0.00 72.50 72.48 3ktk s THR 89 CO 0.24 0.39 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.96 3ktk s ILE 90 N -0.49 1.36 -0.36 2.99 1.09 -0.88 0.39 121.20 125.30 3ktk s ILE 90 Ca 0.07 -0.51 -0.20 0.00 -1.10 0.00 0.00 60.65 58.90 3ktk s ILE 90 Cb -0.07 -1.30 0.00 0.00 -1.06 0.00 0.00 42.46 40.03 3ktk s ILE 90 CO -0.00 0.42 0.63 0.00 -0.10 0.00 0.00 174.94 175.89 3ktk s ILE 92 N 2.71 2.17 0.00 0.00 2.07 0.36 -2.40 121.20 126.10 3ktk s ILE 92 Ca 0.24 -1.08 0.00 0.00 -1.41 0.00 0.00 60.65 58.40 3ktk s ILE 92 Cb -0.14 -2.00 0.00 0.00 0.13 0.00 0.00 42.46 40.45 3ktk s ILE 92 CO 0.15 0.40 0.00 0.61 -1.91 0.00 0.00 174.94 174.19 3ktk n GLY 93 N 4.59 1.37 2.90 1.50 0.00 -1.26 -4.09 105.19 110.19 3ktk n GLY 93 Ca -0.19 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 3ktk n GLY 93 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3ktk s MET 94 N 0.00 0.21 -0.41 1.61 -2.45 -1.26 -1.45 119.30 115.55 3ktk s MET 94 Ca 0.00 -0.06 0.02 0.00 -1.25 0.00 0.00 55.69 54.40 3ktk s MET 94 Cb 0.00 -0.23 0.13 0.00 1.25 0.00 0.00 34.83 35.98 3ktk s MET 94 CO 0.00 0.02 0.20 0.00 1.05 0.00 0.00 175.02 176.29 3ktk s ALA 95 N 0.10 2.20 0.15 4.11 0.00 0.22 -1.60 121.76 126.95 3ktk s ALA 95 Ca -0.01 -2.48 0.08 0.00 0.00 0.00 0.00 51.96 49.56 3ktk s ALA 95 Cb -0.03 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.18 3ktk s ALA 95 CO -0.00 -1.95 -0.07 0.00 0.00 0.00 0.00 175.76 173.73 3ktk s ALA 96 N 0.58 3.02 0.00 0.00 0.00 -0.73 -1.34 121.76 123.30 3ktk s ALA 96 Ca 0.15 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.74 3ktk s ALA 96 Cb -0.23 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.03 3ktk s ALA 96 CO -0.05 0.53 0.00 0.45 0.00 0.00 0.00 175.76 176.69 3ktk n SER 97 N 0.20 0.00 0.33 0.00 2.88 -0.09 -1.14 113.62 115.79 3ktk n SER 97 Ca -0.11 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.64 3ktk n SER 97 Cb 0.54 0.00 1.12 0.00 -0.75 0.00 0.00 64.21 65.12 3ktk n SER 97 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 3ktk h MET 98 N 0.00 0.00 -0.44 -1.46 1.85 -1.87 0.13 114.93 113.14 3ktk h MET 98 Ca 0.00 0.00 -0.14 0.00 -0.61 0.00 0.00 59.70 58.95 3ktk h MET 98 Cb 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 3ktk h MET 98 CO 0.00 0.00 -0.28 0.78 -0.40 0.00 0.00 176.91 177.02 3ktk h GLY 99 N 0.25 1.04 1.27 1.39 0.00 -1.41 0.43 103.07 106.04 3ktk h GLY 99 Ca -0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 47.33 46.25 3ktk h GLY 99 CO 0.00 0.89 -0.11 0.00 0.00 0.00 0.00 176.54 177.32 3ktk h ALA 100 N 0.82 0.92 -0.44 3.60 0.00 -0.76 -0.82 119.26 122.59 3ktk h ALA 100 Ca 0.09 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3ktk h ALA 100 Cb 0.86 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3ktk h ALA 100 CO 0.08 0.63 0.26 0.35 0.00 0.00 0.00 179.25 180.56 3ktk h PHE 101 N 0.78 0.59 -0.45 0.00 3.57 -0.94 -0.49 116.94 119.99 3ktk h PHE 101 Ca 0.13 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 3ktk h PHE 101 Cb 0.61 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3ktk h PHE 101 CO 0.03 0.43 0.01 -0.07 -2.23 0.00 0.00 178.31 176.48 3ktk h LEU 102 N 0.58 0.70 -0.01 0.59 3.38 -0.61 -1.31 115.31 118.63 3ktk h LEU 102 Ca 0.16 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ktk h LEU 102 Cb 0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3ktk h LEU 102 CO -0.03 0.77 0.00 0.25 0.09 0.00 0.00 178.44 179.52 3ktk h LEU 103 N 0.69 0.01 -2.41 1.67 5.85 -0.45 -1.67 115.31 119.00 3ktk h LEU 103 Ca 0.14 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3ktk h LEU 103 Cb 0.42 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 3ktk h LEU 103 CO 0.02 0.06 -0.02 0.00 -0.34 0.00 0.00 178.44 178.16 3ktk h ALA 104 N 0.95 1.12 -0.00 1.25 0.00 -0.79 -1.82 119.26 119.97 3ktk h ALA 104 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3ktk h ALA 104 Cb 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3ktk h ALA 104 CO -0.00 0.03 -0.01 0.00 0.00 0.00 0.00 179.25 179.27 3ktk n ALA 105 N -2.15 2.47 -0.78 0.00 0.00 -0.52 -4.89 120.51 114.63 3ktk n ALA 105 Ca -0.02 -0.14 -0.31 0.00 0.00 0.00 0.00 53.44 52.97 3ktk n ALA 105 Cb 0.15 -1.47 0.16 0.00 0.00 0.00 0.00 19.45 18.28 3ktk n ALA 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3ktk s GLY 106 N -2.69 1.73 -0.12 0.00 0.00 -0.69 -4.84 107.32 100.72 3ktk s GLY 106 Ca 0.24 0.59 -0.38 0.00 0.00 0.00 0.00 44.72 45.17 3ktk s GLY 106 CO 0.48 1.00 1.67 -2.21 0.00 0.00 0.00 173.10 174.04 3ktk n GLU 107 N -4.09 1.46 -1.66 2.90 4.07 0.94 -4.80 120.64 119.47 3ktk n GLU 107 Ca 0.12 0.53 -0.54 0.00 -0.06 0.00 0.00 57.16 57.22 3ktk n GLU 107 Cb 0.52 -2.25 -0.06 0.00 -0.06 0.00 0.00 31.44 29.59 3ktk n GLU 107 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 3ktk n LYS 108 N 4.83 1.35 0.00 5.31 3.00 -1.26 -0.01 118.16 131.39 3ktk n LYS 108 Ca 0.23 0.49 0.00 0.00 -0.00 0.00 0.00 58.31 59.03 3ktk n LYS 108 Cb 0.19 -2.19 0.00 0.00 0.00 0.00 0.00 35.03 33.04 3ktk n LYS 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ktk n GLY 109 N 3.55 2.99 2.09 3.14 0.00 -1.26 -4.91 105.19 110.79 3ktk n GLY 109 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 3ktk n GLY 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ktk n LYS 110 N -2.00 3.59 -3.89 1.61 5.02 0.99 -4.83 118.16 118.65 3ktk n LYS 110 Ca 0.00 -4.21 -0.35 0.00 -2.02 0.00 0.00 58.31 51.72 3ktk n LYS 110 Cb 0.00 -2.28 -0.14 0.00 -0.02 0.00 0.00 35.03 32.60 3ktk n LYS 110 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3ktk s ARG 111 N -3.59 2.81 0.40 1.97 0.52 -1.25 -2.03 118.95 117.77 3ktk s ARG 111 Ca 0.51 -1.01 0.07 0.00 -0.52 0.00 0.00 55.73 54.78 3ktk s ARG 111 Cb 0.41 -3.14 -0.06 0.00 0.52 0.00 0.00 34.95 32.68 3ktk s ARG 111 CO 0.01 -0.46 0.09 0.71 0.02 0.00 0.00 175.30 175.66 3ktk s TYR 112 N 1.35 2.56 -0.03 -0.53 1.51 0.16 -0.10 117.35 122.28 3ktk s TYR 112 Ca -0.00 -0.60 -0.24 0.00 -1.01 0.00 0.00 57.07 55.22 3ktk s TYR 112 Cb -0.17 -1.83 0.05 0.00 -0.11 0.00 0.00 41.96 39.90 3ktk s TYR 112 CO -0.02 0.33 0.52 0.00 -1.11 0.00 0.00 175.55 175.27 3ktk s ALA 113 N -2.63 -1.34 0.51 3.71 0.00 -1.09 -0.62 121.76 120.31 3ktk s ALA 113 Ca 0.38 0.87 -0.07 0.00 0.00 0.00 0.00 51.96 53.14 3ktk s ALA 113 Cb 0.06 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 3ktk s ALA 113 CO 0.20 -0.33 0.85 -0.51 0.00 0.00 0.00 175.76 175.97 3ktk s LEU 114 N -1.29 3.53 0.30 0.00 1.43 -1.01 -1.46 118.68 120.18 3ktk s LEU 114 Ca -0.12 1.06 -0.01 0.00 -1.03 0.00 0.00 54.13 54.04 3ktk s LEU 114 Cb -0.02 -4.04 0.67 0.00 0.03 0.00 0.00 46.19 42.83 3ktk s LEU 114 CO 0.07 -0.65 1.58 -0.65 0.23 0.00 0.00 176.35 176.93 3ktk h PRO 115 N 0.12 0.02 -0.49 1.29 0.11 -1.93 -0.84 132.00 130.27 3ktk h PRO 115 Ca -0.46 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.57 3ktk h PRO 115 Cb 1.20 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.26 3ktk h PRO 115 CO 0.62 0.01 0.07 0.09 -0.21 0.00 0.00 178.00 178.58 3ktk n ASN 116 N -5.50 4.56 -4.73 -2.05 4.13 -1.26 -4.43 115.26 105.98 3ktk n ASN 116 Ca 0.21 -3.12 -0.31 0.00 1.68 0.00 0.00 54.58 53.04 3ktk n ASN 116 Cb 0.69 -0.65 0.12 0.00 -1.54 0.00 0.00 39.78 38.40 3ktk n ASN 116 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 3ktk s SER 117 N -1.42 3.87 -0.04 6.41 0.01 -0.32 -4.84 113.70 117.37 3ktk s SER 117 Ca 0.50 1.85 0.03 0.00 1.31 0.00 0.00 55.95 59.64 3ktk s SER 117 Cb 0.40 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 64.15 3ktk s SER 117 CO 0.11 -2.44 -0.13 -0.70 0.41 0.00 0.00 173.24 170.49 3ktk s GLU 118 N -4.84 1.36 -0.10 12.44 2.12 -0.52 -3.40 118.70 125.76 3ktk s GLU 118 Ca 0.63 -0.44 0.02 0.00 0.36 0.00 0.00 54.97 55.55 3ktk s GLU 118 Cb -0.19 -1.21 0.01 0.00 0.26 0.00 0.00 34.13 33.01 3ktk s GLU 118 CO 0.57 0.16 -0.16 0.08 -0.54 0.00 0.00 175.26 175.36 3ktk s VAL 119 N 0.18 1.55 -0.09 3.70 1.01 0.08 -0.61 120.40 126.23 3ktk s VAL 119 Ca -0.04 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.27 3ktk s VAL 119 Cb -0.10 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.89 3ktk s VAL 119 CO 0.01 0.45 -0.14 -0.32 0.00 0.00 0.00 175.10 175.10 3ktk s MET 120 N 0.87 2.02 0.01 2.72 0.00 -0.45 0.67 119.30 125.14 3ktk s MET 120 Ca -0.09 -0.50 0.08 0.00 0.00 0.00 0.00 55.69 55.17 3ktk s MET 120 Cb -0.15 -1.68 -0.03 0.00 0.00 0.00 0.00 34.83 32.97 3ktk s MET 120 CO 0.00 -0.01 -0.23 0.96 0.00 0.00 0.00 175.02 175.75 3ktk s ILE 121 N 0.81 2.40 0.20 10.11 -4.36 -0.93 -0.91 121.20 128.52 3ktk s ILE 121 Ca -0.11 -1.17 -0.07 0.00 -0.26 0.00 0.00 60.65 59.04 3ktk s ILE 121 Cb -0.16 -1.93 0.03 0.00 1.25 0.00 0.00 42.46 41.66 3ktk s ILE 121 CO 0.02 0.45 0.39 0.00 0.24 0.00 0.00 174.94 176.04 3ktk n HIS 122 N 1.98 -1.65 -3.09 1.37 1.44 -1.26 -1.92 115.22 112.09 3ktk n HIS 122 Ca -0.16 -0.98 -0.24 0.00 -2.01 0.00 0.00 57.72 54.32 3ktk n HIS 122 Cb 0.52 0.46 -0.00 0.00 0.12 0.00 0.00 29.99 31.09 3ktk n HIS 122 CO 0.00 0.00 0.00 1.14 -2.81 0.00 0.00 176.34 174.67 3ktk s GLN 123 N -2.08 3.36 0.69 -1.40 -2.07 -0.51 -4.94 119.66 112.73 3ktk s GLN 123 Ca 0.09 -0.26 -0.17 0.00 -1.82 0.00 0.00 55.36 53.20 3ktk s GLN 123 Cb -0.02 -2.56 0.00 0.00 -1.09 0.00 0.00 33.01 29.33 3ktk s GLN 123 CO 0.06 -0.06 1.08 -2.30 -1.32 0.00 0.00 175.29 172.76 3ktk n PRO 124 N -1.99 0.70 -5.18 9.60 -0.02 -1.26 -5.04 135.00 131.81 3ktk n PRO 124 Ca -0.02 0.29 -0.31 0.00 -2.02 0.00 0.00 63.50 61.44 3ktk n PRO 124 Cb 0.56 -2.32 -0.15 0.00 -0.02 0.00 0.00 33.50 31.57 3ktk n PRO 124 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ktk s LEU 125 N -3.58 2.20 0.00 2.45 1.43 -1.26 -5.10 118.68 114.82 3ktk s LEU 125 Ca 0.77 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 3ktk s LEU 125 Cb -0.36 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.48 3ktk s LEU 125 CO 0.47 0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.98 3ktk n GLY 126 N 2.33 2.26 3.37 -3.19 0.00 -1.26 -5.06 105.19 103.64 3ktk n GLY 126 Ca -0.16 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.84 3ktk n GLY 126 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ktk s GLY 127 N -0.72 -0.40 -0.08 -0.02 0.00 -1.26 -5.16 107.32 99.68 3ktk s GLY 127 Ca 0.00 0.43 -0.05 0.00 0.00 0.00 0.00 44.72 45.10 3ktk s GLY 127 CO 0.00 0.14 0.19 0.00 0.00 0.00 0.00 173.10 173.42 3ktk s ALA 128 N -2.86 -0.41 0.04 3.20 0.00 -1.26 -4.97 121.76 115.49 3ktk s ALA 128 Ca -0.03 0.70 0.02 0.00 0.00 0.00 0.00 51.96 52.66 3ktk s ALA 128 Cb -0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 3ktk s ALA 128 CO -0.05 -0.14 -0.08 -1.14 0.00 0.00 0.00 175.76 174.35 3ktk s GLN 129 N 0.79 0.53 0.00 0.00 2.00 -1.26 -4.98 119.66 116.74 3ktk s GLN 129 Ca -0.06 -0.75 0.00 0.00 -2.00 0.00 0.00 55.36 52.56 3ktk s GLN 129 Cb -0.07 -0.31 0.00 0.00 0.80 0.00 0.00 33.01 33.43 3ktk s GLN 129 CO -0.04 0.05 0.00 0.41 -0.50 0.00 0.00 175.29 175.21 3ktk n GLY 130 N 1.50 0.22 3.77 2.59 0.00 -1.26 -4.62 105.19 107.39 3ktk n GLY 130 Ca -0.22 -1.86 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 3ktk n GLY 130 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ktk s GLN 131 N 0.00 3.15 0.27 1.61 -0.21 -1.26 -4.79 119.66 118.44 3ktk s GLN 131 Ca 0.00 1.67 0.00 0.00 0.02 0.00 0.00 55.36 57.05 3ktk s GLN 131 Cb 0.00 -1.97 0.62 0.00 1.00 0.00 0.00 33.01 32.65 3ktk s GLN 131 CO 0.00 -1.02 1.70 0.00 -2.12 0.00 0.00 175.29 173.84 3ktk h ALA 132 N 0.96 1.24 -0.98 6.09 0.00 -1.99 0.30 119.26 124.89 3ktk h ALA 132 Ca -0.50 0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.61 3ktk h ALA 132 Cb 1.27 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 19.18 3ktk h ALA 132 CO 0.56 -0.32 0.65 1.15 0.00 0.00 0.00 179.25 181.28 3ktk h THR 133 N 0.36 1.18 -0.17 0.00 2.02 -1.99 -0.21 112.91 114.10 3ktk h THR 133 Ca 0.50 -0.43 -0.20 0.00 0.77 0.00 0.00 66.41 67.05 3ktk h THR 133 Cb 0.90 -0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 3ktk h THR 133 CO -0.52 0.23 -0.69 -0.33 0.37 0.00 0.00 175.52 174.58 3ktk h GLU 134 N 1.25 0.70 -0.36 6.66 5.08 -0.85 -2.11 114.58 124.95 3ktk h GLU 134 Ca 0.39 -0.53 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 3ktk h GLU 134 Cb -0.01 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3ktk h GLU 134 CO -0.12 1.14 -0.01 0.82 -1.00 0.00 0.00 179.01 179.85 3ktk h ILE 135 N 0.50 1.21 -0.45 3.13 2.04 -0.58 -1.97 117.51 121.38 3ktk h ILE 135 Ca -0.03 -0.85 -0.13 0.00 1.00 0.00 0.00 64.86 64.86 3ktk h ILE 135 Cb 1.29 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 3ktk h ILE 135 CO 0.14 0.29 -0.22 -0.08 0.00 0.00 0.00 178.15 178.28 3ktk h GLU 136 N 0.55 0.93 -0.08 2.37 4.81 -0.86 0.09 114.58 122.38 3ktk h GLU 136 Ca 0.11 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 3ktk h GLU 136 Cb 0.36 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 3ktk h GLU 136 CO 0.01 1.05 0.04 0.82 -0.73 0.00 0.00 179.01 180.20 3ktk h ILE 137 N 0.80 1.00 -0.52 2.32 1.08 -0.87 -1.22 117.51 120.10 3ktk h ILE 137 Ca 0.11 -0.03 -0.02 0.00 -0.39 0.00 0.00 64.86 64.52 3ktk h ILE 137 Cb 0.78 0.91 -0.02 0.00 -3.07 0.00 0.00 36.82 35.42 3ktk h ILE 137 CO 0.06 0.01 0.23 0.00 -0.69 0.00 0.00 178.15 177.77 3ktk h ALA 138 N 1.04 0.67 -0.31 1.87 0.00 -1.20 -2.45 119.26 118.89 3ktk h ALA 138 Ca 0.03 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3ktk h ALA 138 Cb 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 3ktk h ALA 138 CO -0.02 0.26 0.09 0.00 0.00 0.00 0.00 179.25 179.58 3ktk h ALA 139 N 1.07 0.34 -0.57 0.00 0.00 -0.75 -1.53 119.26 117.82 3ktk h ALA 139 Ca 0.18 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3ktk h ALA 139 Cb 0.16 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3ktk h ALA 139 CO -0.02 -0.32 0.14 0.87 0.00 0.00 0.00 179.25 179.93 3ktk h LYS 140 N 0.21 0.89 0.47 0.00 1.57 -1.10 -1.14 116.57 117.47 3ktk h LYS 140 Ca 0.14 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3ktk h LYS 140 Cb 0.13 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3ktk h LYS 140 CO -0.16 0.79 -0.23 -0.09 -0.57 0.00 0.00 179.45 179.19 3ktk h ARG 141 N 0.85 -0.61 -0.47 3.15 2.43 -0.94 0.01 114.38 118.80 3ktk h ARG 141 Ca 0.19 0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.35 3ktk h ARG 141 Cb 0.30 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 3ktk h ARG 141 CO -0.00 -0.32 0.10 0.97 -1.51 0.00 0.00 179.97 179.21 3ktk h ILE 142 N -0.83 1.21 -0.32 1.20 2.10 -1.26 0.38 117.51 119.99 3ktk h ILE 142 Ca -0.06 -0.75 -0.11 0.00 1.08 0.00 0.00 64.86 65.01 3ktk h ILE 142 Cb 0.57 0.74 -0.01 0.00 -1.09 0.00 0.00 36.82 37.02 3ktk h ILE 142 CO 0.11 0.28 -0.27 -0.07 -1.08 0.00 0.00 178.15 177.11 3ktk h LEU 143 N 0.69 0.66 -0.60 2.19 3.38 -1.17 -0.80 115.31 119.66 3ktk h LEU 143 Ca 0.15 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 3ktk h LEU 143 Cb 0.27 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3ktk h LEU 143 CO -0.00 0.90 -0.07 -0.07 0.09 0.00 0.00 178.44 179.30 3ktk h LEU 144 N 0.56 1.03 -0.93 1.67 3.38 -0.24 -2.74 115.31 118.05 3ktk h LEU 144 Ca 0.07 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 3ktk h LEU 144 Cb 0.75 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3ktk h LEU 144 CO 0.06 1.12 -0.06 -0.07 0.09 0.00 0.00 178.44 179.58 3ktk h LEU 145 N 0.93 0.69 -0.82 1.67 3.38 -0.57 -1.38 115.31 119.21 3ktk h LEU 145 Ca 0.15 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3ktk h LEU 145 Cb 0.63 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 3ktk h LEU 145 CO 0.04 0.80 0.44 -0.09 0.09 0.00 0.00 178.44 179.73 3ktk h ARG 146 N 0.66 1.16 -0.15 1.13 2.43 -0.98 -0.90 114.38 117.73 3ktk h ARG 146 Ca 0.12 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 3ktk h ARG 146 Cb 0.50 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3ktk h ARG 146 CO 0.03 0.86 -0.02 -0.44 -1.51 0.00 0.00 179.97 178.89 3ktk h ASP 147 N 1.15 0.27 -0.64 -3.80 5.19 -1.15 0.32 116.42 117.76 3ktk h ASP 147 Ca 0.29 -0.34 0.03 0.00 -0.62 0.00 0.00 57.03 56.39 3ktk h ASP 147 Cb 0.04 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 39.44 3ktk h ASP 147 CO -0.04 0.54 0.40 0.50 -3.12 0.00 0.00 179.24 177.51 3ktk h LYS 148 N -0.01 0.76 -0.09 3.56 3.64 -1.06 -0.12 116.57 123.24 3ktk h LYS 148 Ca 0.04 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3ktk h LYS 148 Cb 0.41 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3ktk h LYS 148 CO 0.01 0.50 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.58 3ktk h LEU 149 N 0.78 0.20 -1.10 5.20 3.38 -1.12 -2.78 115.31 119.88 3ktk h LEU 149 Ca 0.26 -0.41 0.06 0.00 0.09 0.00 0.00 57.88 57.88 3ktk h LEU 149 Cb 0.02 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.65 3ktk h LEU 149 CO -0.10 0.56 0.61 0.78 0.09 0.00 0.00 178.44 180.38 3ktk h ASN 150 N -0.16 0.96 -0.34 -0.43 2.35 -0.70 -0.63 115.58 116.63 3ktk h ASN 150 Ca 0.02 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 3ktk h ASN 150 Cb 0.49 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 3ktk h ASN 150 CO 0.01 0.62 0.11 0.11 -1.65 0.00 0.00 177.43 176.64 3ktk h LYS 151 N 1.10 0.53 -0.57 0.81 1.57 -0.96 -0.64 116.57 118.40 3ktk h LYS 151 Ca 0.40 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 59.02 3ktk h LYS 151 Cb 0.15 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3ktk h LYS 151 CO -0.15 0.56 0.20 0.28 -0.57 0.00 0.00 179.45 179.77 3ktk h VAL 152 N 0.40 1.23 -0.61 0.50 2.07 -1.16 -1.72 116.25 116.98 3ktk h VAL 152 Ca 0.11 -0.77 0.06 0.00 0.82 0.00 0.00 66.70 66.92 3ktk h VAL 152 Cb 0.24 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 3ktk h VAL 152 CO -0.00 0.29 0.32 -0.07 0.02 0.00 0.00 177.57 178.13 3ktk h LEU 153 N 0.80 0.46 -0.44 2.57 3.38 -0.90 0.28 115.31 121.46 3ktk h LEU 153 Ca 0.19 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.22 3ktk h LEU 153 Cb 0.25 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 3ktk h LEU 153 CO -0.01 0.30 0.24 0.00 0.09 0.00 0.00 178.44 179.07 3ktk h ALA 154 N 1.33 0.55 -0.23 1.53 0.00 -0.73 0.14 119.26 121.85 3ktk h ALA 154 Ca 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3ktk h ALA 154 Cb 0.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3ktk h ALA 154 CO -0.18 -0.09 0.11 0.93 0.00 0.00 0.00 179.25 180.02 3ktk h GLU 155 N 0.49 0.34 -0.04 0.00 5.08 -0.65 0.16 114.58 119.97 3ktk h GLU 155 Ca 0.18 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 3ktk h GLU 155 Cb 0.04 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3ktk h GLU 155 CO -0.10 0.36 -0.34 0.00 -1.00 0.00 0.00 179.01 177.93 3ktk h ARG 156 N 0.24 0.08 0.04 2.33 2.47 -0.65 -3.28 114.38 115.61 3ktk h ARG 156 Ca 0.08 -0.03 -0.36 0.00 -1.26 0.00 0.00 59.98 58.41 3ktk h ARG 156 Cb 0.14 -0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.40 3ktk h ARG 156 CO -0.01 0.41 -2.15 0.25 0.56 0.00 0.00 179.97 179.03 3ktk n THR 157 N -4.12 1.60 0.00 2.04 -2.24 0.44 -4.84 114.28 107.17 3ktk n THR 157 Ca -0.02 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 3ktk n THR 157 Cb 0.39 -1.30 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 3ktk n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ktk n GLY 158 N 1.95 0.27 3.78 3.38 0.00 0.56 -4.57 105.19 110.56 3ktk n GLY 158 Ca -0.33 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 3ktk n GLY 158 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ktk s GLN 159 N -0.85 4.12 0.56 1.61 -1.52 -1.20 -5.00 119.66 117.39 3ktk s GLN 159 Ca 0.00 1.62 -0.18 0.00 -1.95 0.00 0.00 55.36 54.84 3ktk s GLN 159 Cb 0.00 -2.59 -0.05 0.00 -0.22 0.00 0.00 33.01 30.15 3ktk s GLN 159 CO 0.00 -0.20 1.10 -1.25 -0.25 0.00 0.00 175.29 174.69 3ktk s PRO 160 N -2.42 3.34 0.24 2.91 0.04 -1.26 -4.53 135.00 133.32 3ktk s PRO 160 Ca 0.58 1.48 -0.06 0.00 0.04 0.00 0.00 61.00 63.04 3ktk s PRO 160 Cb -0.25 -2.02 0.44 0.00 0.04 0.00 0.00 34.50 32.72 3ktk s PRO 160 CO 0.31 -0.84 1.67 1.25 0.04 0.00 0.00 177.00 179.44 3ktk h LEU 161 N 0.98 -0.10 -1.26 -3.56 5.85 -1.92 0.35 115.31 115.65 3ktk h LEU 161 Ca -0.49 0.16 0.16 0.00 0.84 0.00 0.00 57.88 58.54 3ktk h LEU 161 Cb 1.25 0.24 -0.08 0.00 0.37 0.00 0.00 40.66 42.44 3ktk h LEU 161 CO 0.57 -0.08 0.59 -0.08 -0.34 0.00 0.00 178.44 179.09 3ktk h GLU 162 N 0.21 0.66 -0.27 1.25 4.57 -1.98 0.80 114.58 119.82 3ktk h GLU 162 Ca 0.41 -0.04 -0.14 0.00 -1.18 0.00 0.00 59.36 58.40 3ktk h GLU 162 Cb 0.71 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 3ktk h GLU 162 CO -0.55 0.44 -0.39 0.28 -1.18 0.00 0.00 179.01 177.61 3ktk h VAL 163 N 0.68 1.30 -0.26 0.32 2.07 -1.30 -2.27 116.25 116.80 3ktk h VAL 163 Ca 0.47 -1.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.40 3ktk h VAL 163 Cb 0.79 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 3ktk h VAL 163 CO -0.23 0.51 0.11 0.40 0.02 0.00 0.00 177.57 178.38 3ktk h ILE 164 N 0.49 1.16 -0.56 4.57 1.08 -0.66 -0.13 117.51 123.46 3ktk h ILE 164 Ca 0.03 -0.47 0.07 0.00 -0.39 0.00 0.00 64.86 64.10 3ktk h ILE 164 Cb 0.98 0.99 -0.06 0.00 -3.07 0.00 0.00 36.82 35.66 3ktk h ILE 164 CO 0.09 0.16 0.25 -0.33 -0.69 0.00 0.00 178.15 177.63 3ktk h GLU 165 N 0.28 0.46 -0.01 2.37 5.08 -0.89 -1.25 114.58 120.62 3ktk h GLU 165 Ca 0.09 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3ktk h GLU 165 Cb 0.15 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 3ktk h GLU 165 CO -0.01 0.30 -0.00 -0.09 -1.00 0.00 0.00 179.01 178.21 3ktk h ARG 166 N 0.47 0.02 0.00 2.33 2.43 -1.25 -3.14 114.38 115.24 3ktk h ARG 166 Ca 0.27 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 3ktk h ARG 166 Cb 0.24 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3ktk h ARG 166 CO -0.22 0.41 0.00 -0.44 -1.51 0.00 0.00 179.97 178.20 3ktk h ASP 167 N -0.37 0.00 -0.33 -3.80 5.19 -0.77 -2.75 116.42 113.58 3ktk h ASP 167 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3ktk h ASP 167 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 3ktk h ASP 167 CO 0.00 0.00 0.00 0.35 -3.12 0.00 0.00 179.24 176.47 3ktk n THR 168 N -2.69 0.54 -0.29 0.35 -2.24 -0.49 -4.53 114.28 104.93 3ktk n THR 168 Ca 0.00 -0.77 0.04 0.00 -2.27 0.00 0.00 64.05 61.06 3ktk n THR 168 Cb 0.21 0.91 0.25 0.00 -2.10 0.00 0.00 70.33 69.60 3ktk n THR 168 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 3ktk h ASP 169 N 3.60 0.89 -4.26 3.42 -0.00 -1.43 -1.35 116.42 117.29 3ktk h ASP 169 Ca 0.00 0.01 -0.33 0.00 -0.00 0.00 0.00 57.03 56.70 3ktk h ASP 169 Cb 0.85 -0.18 -0.14 0.00 -0.00 0.00 0.00 39.33 39.85 3ktk h ASP 169 CO 0.00 0.57 -0.65 -0.13 -0.00 0.00 0.00 179.24 179.03 3ktk s ARG 170 N -5.88 1.25 -0.17 0.28 0.52 -1.26 -4.69 118.95 109.00 3ktk s ARG 170 Ca -0.11 -1.63 -0.38 0.00 -0.52 0.00 0.00 55.73 53.09 3ktk s ARG 170 Cb 0.20 -0.40 -0.14 0.00 0.52 0.00 0.00 34.95 35.12 3ktk s ARG 170 CO 0.80 -0.15 1.75 -0.25 0.02 0.00 0.00 175.30 177.46 3ktk n ASP 171 N -0.35 2.69 -4.03 0.23 8.00 -1.26 -4.68 116.55 117.14 3ktk n ASP 171 Ca -0.05 1.05 -0.33 0.00 0.71 0.00 0.00 54.79 56.17 3ktk n ASP 171 Cb 0.64 -1.23 -0.13 0.00 -0.02 0.00 0.00 41.12 40.38 3ktk n ASP 171 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3ktk s ASN 172 N 3.33 4.82 0.03 -2.24 3.04 -0.81 -5.01 114.94 118.10 3ktk s ASN 172 Ca 0.95 -2.44 -0.27 0.00 0.04 0.00 0.00 52.86 51.14 3ktk s ASN 172 Cb -0.93 -1.71 -0.05 0.00 -1.54 0.00 0.00 41.25 37.03 3ktk s ASN 172 CO 0.58 -0.38 0.84 -0.36 -3.04 0.00 0.00 177.10 174.75 3ktk s PHE 173 N 0.52 3.71 0.01 0.43 0.08 -1.26 -2.18 117.98 119.28 3ktk s PHE 173 Ca 0.13 1.55 0.04 0.00 0.12 0.00 0.00 56.93 58.77 3ktk s PHE 173 Cb -0.22 -2.93 -0.01 0.00 -0.57 0.00 0.00 43.02 39.29 3ktk s PHE 173 CO -0.05 0.17 -0.13 0.15 -0.10 0.00 0.00 175.22 175.27 3ktk s LYS 174 N 0.31 0.95 0.83 0.44 1.02 0.21 -4.98 119.74 118.52 3ktk s LYS 174 Ca 0.43 -0.54 -0.12 0.00 0.02 0.00 0.00 55.97 55.75 3ktk s LYS 174 Cb -0.21 -0.92 0.09 0.00 -0.52 0.00 0.00 37.83 36.27 3ktk s LYS 174 CO 0.25 0.24 1.17 -1.54 -0.92 0.00 0.00 175.35 174.55 3ktk s SER 175 N -0.59 4.26 0.26 2.83 1.04 -1.26 -0.74 113.70 119.50 3ktk s SER 175 Ca 0.03 0.82 -0.04 0.00 0.48 0.00 0.00 55.95 57.24 3ktk s SER 175 Cb -0.06 -1.32 0.32 0.00 0.10 0.00 0.00 66.02 65.06 3ktk s SER 175 CO 0.00 -2.06 1.86 0.00 0.98 0.00 0.00 173.24 174.01 3ktk h ALA 176 N -1.17 1.21 -0.42 5.32 0.00 -1.77 0.26 119.26 122.71 3ktk h ALA 176 Ca -0.47 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 3ktk h ALA 176 Cb 1.33 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 3ktk h ALA 176 CO 0.65 0.59 0.23 0.93 0.00 0.00 0.00 179.25 181.65 3ktk h GLU 177 N 1.05 0.58 -0.22 0.00 3.07 -1.92 -0.81 114.58 116.33 3ktk h GLU 177 Ca 0.25 -0.07 -0.10 0.00 -0.50 0.00 0.00 59.36 58.95 3ktk h GLU 177 Cb 0.12 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 3ktk h GLU 177 CO -0.03 0.47 -0.29 0.93 -1.40 0.00 0.00 179.01 178.68 3ktk h GLU 178 N 0.54 0.43 -0.56 2.33 5.08 -1.72 -1.67 114.58 119.00 3ktk h GLU 178 Ca 0.15 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 3ktk h GLU 178 Cb 0.06 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3ktk h GLU 178 CO -0.02 0.68 -0.07 0.00 -1.00 0.00 0.00 179.01 178.60 3ktk h ALA 179 N 1.32 0.80 -0.10 3.43 0.00 -0.16 -1.54 119.26 123.01 3ktk h ALA 179 Ca 0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3ktk h ALA 179 Cb 0.71 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3ktk h ALA 179 CO 0.05 0.67 0.04 1.25 0.00 0.00 0.00 179.25 181.27 3ktk h LEU 180 N 0.93 0.14 -2.03 0.00 5.85 -0.82 -1.44 115.31 117.94 3ktk h LEU 180 Ca 0.15 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 3ktk h LEU 180 Cb 0.63 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 3ktk h LEU 180 CO 0.04 0.27 -0.07 -0.33 -0.34 0.00 0.00 178.44 178.01 3ktk h GLU 181 N 0.01 0.00 0.00 1.25 4.39 -1.16 -2.41 114.58 116.65 3ktk h GLU 181 Ca 0.03 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.68 3ktk h GLU 181 Cb 0.17 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 3ktk h GLU 181 CO -0.00 0.07 -0.49 -0.92 -1.16 0.00 0.00 179.01 176.51 3ktk h TYR 182 N 0.00 0.00 0.00 4.33 3.20 -0.93 -3.48 116.97 120.10 3ktk h TYR 182 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3ktk h TYR 182 Cb 0.16 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.43 3ktk h TYR 182 CO 0.00 0.25 0.00 0.41 -1.64 0.00 0.00 178.16 177.18 3ktk n GLY 183 N 1.19 0.93 0.09 1.82 0.00 -0.80 -4.71 105.19 103.71 3ktk n GLY 183 Ca 0.01 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 3ktk n GLY 183 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ktk h LEU 184 N 0.00 0.28 -9.04 0.99 3.38 -1.52 -3.36 115.31 106.03 3ktk h LEU 184 Ca 0.00 -0.31 -0.43 0.00 0.09 0.00 0.00 57.88 57.23 3ktk h LEU 184 Cb 0.00 -0.09 -0.14 0.00 0.09 0.00 0.00 40.66 40.52 3ktk h LEU 184 CO 0.00 1.25 -0.64 0.27 0.09 0.00 0.00 178.44 179.40 3ktk s ILE 185 N -2.67 1.18 -0.07 1.22 -4.36 -1.22 -4.08 121.20 111.20 3ktk s ILE 185 Ca -0.03 -2.04 0.11 0.00 -0.26 0.00 0.00 60.65 58.43 3ktk s ILE 185 Cb 0.08 -2.52 -0.16 0.00 1.25 0.00 0.00 42.46 41.11 3ktk s ILE 185 CO 0.86 -0.21 0.13 0.47 0.24 0.00 0.00 174.94 176.44 3ktk n ASP 186 N -0.53 2.20 -3.67 4.36 8.00 0.85 -4.53 116.55 123.23 3ktk n ASP 186 Ca -0.04 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.31 3ktk n ASP 186 Cb 0.65 1.10 -0.08 0.00 -0.02 0.00 0.00 41.12 42.76 3ktk n ASP 186 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3ktk s LYS 187 N -2.51 0.76 -0.25 -1.24 2.20 -0.98 -5.00 119.74 112.72 3ktk s LYS 187 Ca -0.05 0.25 -0.09 0.00 -0.36 0.00 0.00 55.97 55.73 3ktk s LYS 187 Cb 0.05 0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 36.69 3ktk s LYS 187 CO 0.48 -0.19 0.11 0.42 -0.36 0.00 0.00 175.35 175.81 3ktk s ILE 188 N -0.74 4.72 0.09 5.43 1.01 -1.26 -2.65 121.20 127.79 3ktk s ILE 188 Ca -0.08 -0.04 -0.31 0.00 0.00 0.00 0.00 60.65 60.23 3ktk s ILE 188 Cb -0.03 -3.21 -0.06 0.00 0.01 0.00 0.00 42.46 39.17 3ktk s ILE 188 CO 0.05 0.33 1.22 -0.76 0.00 0.00 0.00 174.94 175.78 3ktk s LEU 189 N 1.48 4.38 0.00 2.97 1.43 -0.53 -4.94 118.68 123.47 3ktk s LEU 189 Ca 0.06 2.08 0.00 0.00 -1.03 0.00 0.00 54.13 55.24 3ktk s LEU 189 Cb -0.15 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.49 3ktk s LEU 189 CO 0.06 -0.48 0.00 0.35 0.23 0.00 0.00 176.35 176.51 3ktk n THR 190 N 3.73 0.00 -0.23 5.49 -2.24 -1.26 -3.75 114.28 116.02 3ktk n THR 190 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 3ktk n THR 190 Cb 0.46 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 3ktk n THR 190 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50