#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1klv h GLU 19 N 0.00 0.90 -0.05 1.61 4.57 -2.03 -0.18 114.58 119.40 1klv h GLU 19 Ca 0.00 -0.05 -0.19 0.00 -1.18 0.00 0.00 59.36 57.93 1klv h GLU 19 Cb 0.00 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.38 1klv h GLU 19 CO 0.00 0.60 -0.78 -0.22 -1.18 0.00 0.00 179.01 177.43 1klv h LYS 20 N 0.93 0.37 0.00 1.92 3.64 -2.04 -2.91 116.57 118.48 1klv h LYS 20 Ca 0.52 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1klv h LYS 20 Cb 0.61 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1klv h LYS 20 CO -0.30 0.98 0.00 -0.89 -2.27 0.00 0.00 179.45 176.98 1klv n ILE 21 N -3.80 1.21 -0.05 2.00 2.08 -0.13 -3.01 119.36 117.66 1klv n ILE 21 Ca -0.05 0.42 -0.01 0.00 0.56 0.00 0.00 62.75 63.67 1klv n ILE 21 Cb 0.74 -1.34 -0.00 0.00 -0.75 0.00 0.00 39.64 38.29 1klv n ILE 21 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 1klv h ARG 22 N 0.00 0.00 -1.01 0.38 1.12 -1.21 -0.12 114.38 113.54 1klv h ARG 22 Ca 0.00 0.00 0.27 0.00 -1.11 0.00 0.00 59.98 59.14 1klv h ARG 22 Cb 0.16 0.00 -0.13 0.00 -0.01 0.00 0.00 29.97 29.99 1klv h ARG 22 CO 0.00 0.00 0.60 0.87 -3.11 0.00 0.00 179.97 178.33 1klv h LYS 23 N -0.93 0.48 0.10 0.20 1.79 -1.61 0.38 116.57 116.98 1klv h LYS 23 Ca 0.00 -0.03 -0.18 0.00 -2.18 0.00 0.00 60.65 58.26 1klv h LYS 23 Cb 0.15 -0.11 0.01 0.00 -1.58 0.00 0.00 32.23 30.70 1klv h LYS 23 CO 0.00 0.32 -0.88 0.87 -1.08 0.00 0.00 179.45 178.67 1klv h LYS 24 N 0.49 0.21 -2.33 3.15 1.57 -1.67 -3.38 116.57 114.61 1klv h LYS 24 Ca 0.67 -0.36 -0.66 0.00 -1.87 0.00 0.00 60.65 58.42 1klv h LYS 24 Cb 1.39 0.14 -0.37 0.00 0.08 0.00 0.00 32.23 33.46 1klv h LYS 24 CO -0.50 1.17 -0.12 0.66 -0.57 0.00 0.00 179.45 180.09 1klv n TYR 25 N -4.17 3.49 0.66 -1.35 4.01 -0.06 -4.79 117.16 114.95 1klv n TYR 25 Ca -0.18 -3.58 0.09 0.00 -0.16 0.00 0.00 57.90 54.07 1klv n TYR 25 Cb 0.78 -0.74 0.40 0.00 -0.31 0.00 0.00 39.34 39.47 1klv n TYR 25 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1klv n PRO 26 N 0.24 0.03 0.00 -0.72 -0.04 0.12 -2.39 135.00 132.24 1klv n PRO 26 Ca 0.33 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 64.08 1klv n PRO 26 Cb 0.36 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.35 1klv n PRO 26 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1klv n ASP 27 N -1.48 1.90 -2.92 3.54 -0.08 -1.26 -4.95 116.55 111.30 1klv n ASP 27 Ca 0.05 -1.44 -0.10 0.00 -1.51 0.00 0.00 54.79 51.79 1klv n ASP 27 Cb 0.21 0.46 0.06 0.00 2.34 0.00 0.00 41.12 44.19 1klv n ASP 27 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1klv n ARG 28 N -0.13 0.07 -3.72 -0.67 3.00 -1.01 -4.18 116.66 110.03 1klv n ARG 28 Ca 0.09 -0.99 -0.29 0.00 -0.01 0.00 0.00 57.85 56.66 1klv n ARG 28 Cb 0.45 -0.35 -0.16 0.00 0.00 0.00 0.00 32.46 32.41 1klv n ARG 28 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1klv s VAL 29 N -1.40 0.66 -1.11 1.55 1.01 0.20 -4.73 120.40 116.57 1klv s VAL 29 Ca 0.27 -1.01 -0.22 0.00 0.00 0.00 0.00 61.98 61.02 1klv s VAL 29 Cb -0.01 -1.36 0.01 0.00 0.00 0.00 0.00 36.38 35.02 1klv s VAL 29 CO 0.18 -0.49 1.73 -2.16 0.00 0.00 0.00 175.10 174.36 1klv s PRO 30 N 1.76 3.29 0.46 2.72 0.04 -1.26 -2.56 135.00 139.44 1klv s PRO 30 Ca 0.05 -1.22 -0.20 0.00 0.04 0.00 0.00 61.00 59.67 1klv s PRO 30 Cb -0.17 -5.33 -0.10 0.00 0.04 0.00 0.00 34.50 28.94 1klv s PRO 30 CO -0.20 -2.80 0.99 0.14 0.04 0.00 0.00 177.00 175.17 1klv s VAL 31 N 6.96 4.15 0.26 -0.36 -7.23 -0.81 -2.60 120.40 120.77 1klv s VAL 31 Ca 0.57 1.32 0.07 0.00 -1.81 0.00 0.00 61.98 62.13 1klv s VAL 31 Cb -0.00 -3.54 -0.04 0.00 0.56 0.00 0.00 36.38 33.36 1klv s VAL 31 CO 0.02 -0.31 0.19 -0.63 -0.31 0.00 0.00 175.10 174.06 1klv s ILE 32 N -2.13 4.24 0.00 -0.62 -1.09 0.55 -2.31 121.20 119.85 1klv s ILE 32 Ca 0.64 -1.45 0.02 0.00 -2.23 0.00 0.00 60.65 57.64 1klv s ILE 32 Cb -0.12 -3.33 -0.01 0.00 -1.58 0.00 0.00 42.46 37.42 1klv s ILE 32 CO 0.17 -0.33 -0.08 -0.69 -1.23 0.00 0.00 174.94 172.79 1klv s VAL 33 N -2.17 0.59 0.33 2.92 1.01 0.07 -1.99 120.40 121.15 1klv s VAL 33 Ca 0.34 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 61.76 1klv s VAL 33 Cb -0.07 -0.52 0.03 0.00 0.00 0.00 0.00 36.38 35.81 1klv s VAL 33 CO 0.25 0.10 0.67 -0.70 0.00 0.00 0.00 175.10 175.42 1klv s GLU 34 N -0.35 1.95 0.27 2.72 2.12 -0.81 -4.75 118.70 119.85 1klv s GLU 34 Ca 0.02 -1.34 0.11 0.00 0.36 0.00 0.00 54.97 54.11 1klv s GLU 34 Cb -0.04 0.57 -0.05 0.00 0.26 0.00 0.00 34.13 34.87 1klv s GLU 34 CO -0.00 -0.88 -0.09 0.21 -0.54 0.00 0.00 175.26 173.96 1klv s LYS 35 N -3.14 2.04 0.59 4.30 2.47 -1.26 -2.00 119.74 122.74 1klv s LYS 35 Ca 0.18 -1.56 -0.10 0.00 -1.56 0.00 0.00 55.97 52.93 1klv s LYS 35 Cb -0.04 -2.00 0.15 0.00 -1.46 0.00 0.00 37.83 34.48 1klv s LYS 35 CO 0.11 0.35 0.43 0.00 0.16 0.00 0.00 175.35 176.41 1klv n ALA 36 N -0.76 -1.90 -2.17 3.13 0.00 -0.99 -4.79 120.51 113.04 1klv n ALA 36 Ca -0.06 -0.69 -0.43 0.00 0.00 0.00 0.00 53.44 52.26 1klv n ALA 36 Cb 0.59 -0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 1klv n ALA 36 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1klv s PRO 37 N -4.00 3.48 -1.04 0.00 0.04 -1.26 -3.00 135.00 129.23 1klv s PRO 37 Ca 0.30 1.22 -0.05 0.00 0.04 0.00 0.00 61.00 62.52 1klv s PRO 37 Cb -0.04 -4.11 0.01 0.00 0.04 0.00 0.00 34.50 30.40 1klv s PRO 37 CO 0.24 -1.68 0.90 1.63 0.04 0.00 0.00 177.00 178.13 1klv n LYS 38 N 8.21 -6.01 -0.28 4.56 4.76 -1.26 -4.98 118.16 123.16 1klv n LYS 38 Ca 0.20 0.66 -0.27 0.00 -2.87 0.00 0.00 58.31 56.03 1klv n LYS 38 Cb 0.47 -5.17 0.26 0.00 -1.84 0.00 0.00 35.03 28.75 1klv n LYS 38 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1klv n ALA 39 N -4.19 -4.60 -2.51 7.82 0.00 -1.16 -4.99 120.51 110.88 1klv n ALA 39 Ca -0.06 -1.34 -0.01 0.00 0.00 0.00 0.00 53.44 52.03 1klv n ALA 39 Cb 0.57 -0.12 0.03 0.00 0.00 0.00 0.00 19.45 19.94 1klv n ALA 39 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1klv n ARG 40 N -4.72 0.79 -2.76 0.00 1.85 -1.26 -5.02 116.66 105.55 1klv n ARG 40 Ca 0.12 -1.93 -0.22 0.00 -1.00 0.00 0.00 57.85 54.82 1klv n ARG 40 Cb 0.52 -0.18 0.08 0.00 -1.05 0.00 0.00 32.46 31.83 1klv n ARG 40 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 1klv s ILE 41 N -0.93 2.29 0.73 8.89 -5.25 -1.26 -4.87 121.20 120.80 1klv s ILE 41 Ca 0.17 -0.75 -0.09 0.00 -0.99 0.00 0.00 60.65 58.99 1klv s ILE 41 Cb 0.29 -2.53 0.14 0.00 2.95 0.00 0.00 42.46 43.31 1klv s ILE 41 CO -0.08 0.00 0.31 0.61 -1.79 0.00 0.00 174.94 173.98 1klv n GLY 42 N -2.51 -1.79 3.55 6.27 0.00 -0.28 -4.97 105.19 105.46 1klv n GLY 42 Ca 0.14 -0.58 -0.27 0.00 0.00 0.00 0.00 46.02 45.30 1klv n GLY 42 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1klv n ASP 43 N -1.12 0.05 -3.89 1.61 2.03 -1.26 -4.81 116.55 109.16 1klv n ASP 43 Ca 0.05 -1.44 -0.18 0.00 0.52 0.00 0.00 54.79 53.74 1klv n ASP 43 Cb 0.21 -0.94 -0.16 0.00 -0.72 0.00 0.00 41.12 39.52 1klv n ASP 43 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1klv s LEU 44 N 0.00 1.43 0.05 -2.67 2.01 -1.26 -4.33 118.68 113.91 1klv s LEU 44 Ca 0.69 -0.09 0.12 0.00 0.01 0.00 0.00 54.13 54.86 1klv s LEU 44 Cb -0.02 -0.35 -0.18 0.00 0.01 0.00 0.00 46.19 45.65 1klv s LEU 44 CO 0.49 -0.04 0.91 0.44 1.01 0.00 0.00 176.35 179.16 1klv h ASP 45 N 6.95 0.00 -5.06 2.29 5.19 -1.98 -3.48 116.42 120.33 1klv h ASP 45 Ca -0.38 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 55.96 1klv h ASP 45 Cb 1.15 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.51 1klv h ASP 45 CO 0.48 0.87 -0.12 -0.54 -3.12 0.00 0.00 179.24 176.81 1klv s LYS 46 N -2.72 0.96 -0.33 3.56 3.01 -1.26 -5.07 119.74 117.90 1klv s LYS 46 Ca -0.02 -0.54 0.09 0.00 -1.01 0.00 0.00 55.97 54.49 1klv s LYS 46 Cb 0.09 0.42 0.46 0.00 -1.01 0.00 0.00 37.83 37.79 1klv s LYS 46 CO 0.81 -0.35 1.14 0.36 0.51 0.00 0.00 175.35 177.83 1klv n LYS 47 N 0.20 3.17 -3.16 1.68 0.00 -1.26 -4.96 118.16 113.84 1klv n LYS 47 Ca -0.17 -4.11 0.03 0.00 -0.00 0.00 0.00 58.31 54.06 1klv n LYS 47 Cb 0.61 -2.12 -0.01 0.00 -0.00 0.00 0.00 35.03 33.51 1klv n LYS 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1klv s LYS 48 N -3.58 0.56 -0.06 -1.58 -2.85 -1.26 -0.75 119.74 110.21 1klv s LYS 48 Ca 0.46 0.88 -0.03 0.00 -1.00 0.00 0.00 55.97 56.28 1klv s LYS 48 Cb 0.40 0.45 -0.04 0.00 -2.06 0.00 0.00 37.83 36.58 1klv s LYS 48 CO -0.03 -0.72 0.08 0.71 0.10 0.00 0.00 175.35 175.48 1klv s TYR 49 N 2.84 3.34 -0.64 1.78 1.51 -0.98 -4.97 117.35 120.24 1klv s TYR 49 Ca 0.18 0.30 -0.13 0.00 -1.01 0.00 0.00 57.07 56.41 1klv s TYR 49 Cb -0.14 -1.81 0.16 0.00 -0.11 0.00 0.00 41.96 40.06 1klv s TYR 49 CO -0.22 0.58 0.57 -1.17 -1.11 0.00 0.00 175.55 174.19 1klv s LEU 50 N -1.27 6.24 0.05 -1.29 2.96 -1.26 -1.93 118.68 122.18 1klv s LEU 50 Ca 0.18 -2.22 0.09 0.00 -0.22 0.00 0.00 54.13 51.95 1klv s LEU 50 Cb -0.12 -2.15 -0.03 0.00 0.50 0.00 0.00 46.19 44.39 1klv s LEU 50 CO 0.08 -0.69 -0.23 0.68 -1.32 0.00 0.00 176.35 174.86 1klv s VAL 51 N 0.91 2.40 0.48 1.68 -7.23 -1.06 -4.93 120.40 112.65 1klv s VAL 51 Ca 0.10 -1.35 -0.22 0.00 -1.81 0.00 0.00 61.98 58.70 1klv s VAL 51 Cb -0.21 -1.98 -0.07 0.00 0.56 0.00 0.00 36.38 34.68 1klv s VAL 51 CO -0.02 0.33 1.14 -2.16 -0.31 0.00 0.00 175.10 174.08 1klv s PRO 52 N -1.40 3.66 0.38 4.82 0.04 -1.26 -0.63 135.00 140.61 1klv s PRO 52 Ca 0.13 1.70 0.27 0.00 0.04 0.00 0.00 61.00 63.14 1klv s PRO 52 Cb -0.10 -2.28 1.37 0.00 0.04 0.00 0.00 34.50 33.52 1klv s PRO 52 CO 0.04 -0.62 1.82 1.03 0.04 0.00 0.00 177.00 179.31 1klv h SER 53 N 1.80 0.00 1.13 6.66 0.87 -1.85 -1.80 113.55 120.35 1klv h SER 53 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 1klv h SER 53 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1klv h SER 53 CO 0.59 0.00 -0.24 -0.67 -0.53 0.00 0.00 176.83 175.98 1klv n ASP 54 N -2.46 0.63 -4.76 6.23 2.03 -1.26 -0.72 116.55 116.24 1klv n ASP 54 Ca -0.01 0.35 -0.39 0.00 0.52 0.00 0.00 54.79 55.26 1klv n ASP 54 Cb 0.10 -0.35 0.01 0.00 -0.72 0.00 0.00 41.12 40.16 1klv n ASP 54 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1klv s LEU 55 N -4.08 4.09 0.46 -2.67 1.43 -0.68 -4.86 118.68 112.37 1klv s LEU 55 Ca 0.10 2.79 -0.02 0.00 -1.03 0.00 0.00 54.13 55.97 1klv s LEU 55 Cb 0.14 -4.01 -0.01 0.00 0.03 0.00 0.00 46.19 42.34 1klv s LEU 55 CO 0.64 -1.15 0.71 0.42 0.23 0.00 0.00 176.35 177.19 1klv s THR 56 N -1.25 4.32 0.61 5.49 -4.23 -1.26 -1.22 115.64 118.09 1klv s THR 56 Ca 0.62 -0.27 0.34 0.00 -1.18 0.00 0.00 61.69 61.20 1klv s THR 56 Cb -0.41 -3.62 0.38 0.00 1.34 0.00 0.00 72.50 70.20 1klv s THR 56 CO 0.52 -0.50 2.29 0.58 -0.54 0.00 0.00 174.62 176.97 1klv h VAL 57 N 0.33 0.37 -0.14 2.29 2.07 -1.42 -0.93 116.25 118.82 1klv h VAL 57 Ca -0.47 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 66.92 1klv h VAL 57 Cb 1.24 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1klv h VAL 57 CO 0.59 0.00 -0.49 1.23 0.02 0.00 0.00 177.57 178.93 1klv h GLY 58 N 0.00 0.40 0.59 2.17 0.00 -1.85 -1.82 103.07 102.56 1klv h GLY 58 Ca 0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 1klv h GLY 58 CO -0.00 0.39 -0.23 1.46 0.00 0.00 0.00 176.54 178.16 1klv h GLN 59 N 0.30 0.24 -0.30 4.80 1.08 -1.55 -3.19 115.11 116.49 1klv h GLN 59 Ca 0.02 -0.20 -0.00 0.00 -1.45 0.00 0.00 58.65 57.02 1klv h GLN 59 Cb 0.97 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.42 1klv h GLN 59 CO 0.08 0.85 0.18 0.35 -0.95 0.00 0.00 178.83 179.34 1klv h PHE 60 N -0.30 0.40 -0.16 2.96 3.57 -1.51 -0.52 116.94 121.38 1klv h PHE 60 Ca -0.02 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.53 1klv h PHE 60 Cb 0.89 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 1klv h PHE 60 CO 0.14 0.30 0.50 -0.92 -2.23 0.00 0.00 178.31 176.10 1klv h TYR 61 N 0.39 0.00 0.00 0.41 5.03 -1.38 -1.19 116.97 120.23 1klv h TYR 61 Ca 0.11 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.41 1klv h TYR 61 Cb 0.01 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.29 1klv h TYR 61 CO -0.04 0.00 -0.06 0.35 -1.32 0.00 0.00 178.16 177.09 1klv h PHE 62 N 0.00 0.00 0.00 -3.82 3.57 -1.08 -2.54 116.94 113.07 1klv h PHE 62 Ca 0.08 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.58 1klv h PHE 62 Cb 1.08 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.82 1klv h PHE 62 CO 0.00 0.54 0.00 1.37 -2.23 0.00 0.00 178.31 177.99 1klv h LEU 63 N -1.00 0.00 0.08 0.59 8.10 -1.00 -2.50 115.31 119.59 1klv h LEU 63 Ca -0.01 0.00 -0.37 0.00 0.11 0.00 0.00 57.88 57.61 1klv h LEU 63 Cb 0.54 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.73 1klv h LEU 63 CO -0.01 0.00 -2.09 -0.38 -4.11 0.00 0.00 178.44 171.85 1klv n ILE 64 N -3.07 1.69 -0.31 0.15 5.41 -0.95 -3.89 119.36 118.39 1klv n ILE 64 Ca -0.03 -0.66 -0.08 0.00 1.00 0.00 0.00 62.75 62.98 1klv n ILE 64 Cb 0.07 -1.57 -0.07 0.00 -0.71 0.00 0.00 39.64 37.36 1klv n ILE 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1klv n ARG 65 N -3.38 -0.32 0.10 0.38 1.74 -0.94 0.15 116.66 114.39 1klv n ARG 65 Ca -0.34 1.22 0.01 0.00 -0.77 0.00 0.00 57.85 57.98 1klv n ARG 65 Cb 1.04 -1.80 0.35 0.00 -1.02 0.00 0.00 32.46 31.03 1klv n ARG 65 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1klv h LYS 66 N 0.00 0.26 0.00 5.56 1.79 -1.77 -1.28 116.57 121.13 1klv h LYS 66 Ca 0.12 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1klv h LYS 66 Cb 0.30 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 1klv h LYS 66 CO -0.69 0.44 0.00 0.54 -1.08 0.00 0.00 179.45 178.66 1klv n ARG 67 N -4.23 0.19 -0.39 3.15 5.12 0.39 -1.57 116.66 119.33 1klv n ARG 67 Ca -0.01 0.47 0.12 0.00 -1.93 0.00 0.00 57.85 56.50 1klv n ARG 67 Cb 0.31 -1.90 0.33 0.00 -1.16 0.00 0.00 32.46 30.04 1klv n ARG 67 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 1klv n ILE 68 N -2.26 1.04 -2.86 0.55 2.08 0.10 -4.31 119.36 113.70 1klv n ILE 68 Ca 0.01 -1.01 -0.18 0.00 0.56 0.00 0.00 62.75 62.13 1klv n ILE 68 Cb 0.19 0.48 0.00 0.00 -0.75 0.00 0.00 39.64 39.57 1klv n ILE 68 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 1klv n HIS 69 N 1.64 -1.62 -4.33 1.39 -0.00 -0.61 -1.13 115.22 110.57 1klv n HIS 69 Ca 0.25 0.25 -0.27 0.00 0.46 0.00 0.00 57.72 58.41 1klv n HIS 69 Cb 0.64 -3.18 -0.10 0.00 -0.12 0.00 0.00 29.99 27.23 1klv n HIS 69 CO 0.00 0.00 0.00 -0.48 0.46 0.00 0.00 176.34 176.32 1klv s LEU 70 N -6.13 2.81 0.00 0.27 0.05 -1.20 -4.64 118.68 109.85 1klv s LEU 70 Ca 0.19 -0.65 -0.07 0.00 0.05 0.00 0.00 54.13 53.65 1klv s LEU 70 Cb -0.10 -1.52 0.03 0.00 -2.05 0.00 0.00 46.19 42.55 1klv s LEU 70 CO 0.24 0.11 0.35 -2.11 -0.55 0.00 0.00 176.35 174.39 1klv n ARG 71 N 0.17 0.28 0.00 1.48 1.85 -1.26 -4.52 116.66 114.65 1klv n ARG 71 Ca -0.12 -0.60 0.00 0.00 -1.00 0.00 0.00 57.85 56.13 1klv n ARG 71 Cb 0.55 0.79 0.00 0.00 -1.05 0.00 0.00 32.46 32.76 1klv n ARG 71 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1klv n ALA 72 N -2.18 0.00 -2.15 2.89 0.00 -1.26 -1.62 120.51 116.20 1klv n ALA 72 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1klv n ALA 72 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.66 1klv n ALA 72 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1klv n GLU 73 N 0.00 0.00 -0.58 0.00 0.28 -1.26 -5.12 120.64 113.96 1klv n GLU 73 Ca 0.00 -1.12 -0.20 0.00 -0.16 0.00 0.00 57.16 55.68 1klv n GLU 73 Cb 0.00 -0.14 0.14 0.00 1.43 0.00 0.00 31.44 32.87 1klv n GLU 73 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1klv n ASP 74 N 0.15 -2.87 -4.55 -1.84 -0.08 -0.64 -4.97 116.55 101.75 1klv n ASP 74 Ca -0.02 -0.31 -0.34 0.00 -1.51 0.00 0.00 54.79 52.62 1klv n ASP 74 Cb 0.80 -0.76 -0.12 0.00 2.34 0.00 0.00 41.12 43.37 1klv n ASP 74 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1klv s ALA 75 N -2.09 2.91 -0.05 -1.67 0.00 -1.26 -4.98 121.76 114.62 1klv s ALA 75 Ca 0.37 -0.91 -0.29 0.00 0.00 0.00 0.00 51.96 51.13 1klv s ALA 75 Cb -0.06 -1.18 0.10 0.00 0.00 0.00 0.00 23.12 21.98 1klv s ALA 75 CO 0.38 0.56 0.83 -1.17 0.00 0.00 0.00 175.76 176.36 1klv s LEU 76 N -0.74 -0.48 -0.27 0.00 2.96 -1.26 -4.48 118.68 114.41 1klv s LEU 76 Ca 0.11 0.35 -0.09 0.00 -0.22 0.00 0.00 54.13 54.28 1klv s LEU 76 Cb -0.11 2.19 0.11 0.00 0.50 0.00 0.00 46.19 48.88 1klv s LEU 76 CO 0.01 -0.57 0.58 -0.36 -1.32 0.00 0.00 176.35 174.70 1klv s PHE 77 N -1.95 -1.17 0.05 5.38 0.08 -0.75 -4.97 117.98 114.65 1klv s PHE 77 Ca -0.02 2.08 -0.27 0.00 0.12 0.00 0.00 56.93 58.84 1klv s PHE 77 Cb -0.01 0.65 -0.05 0.00 -0.57 0.00 0.00 43.02 43.04 1klv s PHE 77 CO -0.00 -0.60 0.85 -0.06 -0.10 0.00 0.00 175.22 175.30 1klv s PHE 78 N 2.72 3.74 -0.18 0.36 0.08 -1.26 -2.50 117.98 120.93 1klv s PHE 78 Ca -0.05 1.58 0.01 0.00 0.12 0.00 0.00 56.93 58.59 1klv s PHE 78 Cb -0.12 -2.93 0.02 0.00 -0.57 0.00 0.00 43.02 39.43 1klv s PHE 78 CO -0.17 0.20 -0.19 -0.06 -0.10 0.00 0.00 175.22 174.90 1klv s PHE 79 N 0.17 2.72 -0.11 0.36 0.08 -0.38 -4.60 117.98 116.23 1klv s PHE 79 Ca 0.43 -1.63 0.03 0.00 0.12 0.00 0.00 56.93 55.88 1klv s PHE 79 Cb -0.21 -1.87 0.00 0.00 -0.57 0.00 0.00 43.02 40.37 1klv s PHE 79 CO 0.25 -0.79 -0.22 0.08 -0.10 0.00 0.00 175.22 174.43 1klv s VAL 80 N 1.31 1.99 -1.35 -0.44 1.01 -0.78 -2.61 120.40 119.53 1klv s VAL 80 Ca 0.04 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 1klv s VAL 80 Cb -0.13 -1.74 0.10 0.00 0.00 0.00 0.00 36.38 34.61 1klv s VAL 80 CO -0.12 0.54 0.55 -3.20 0.00 0.00 0.00 175.10 172.87 1klv n ASN 81 N 3.72 -3.46 -2.43 3.32 5.15 -1.26 0.12 115.26 120.42 1klv n ASN 81 Ca -0.19 -0.54 -0.16 0.00 -0.60 0.00 0.00 54.58 53.09 1klv n ASN 81 Cb 0.52 -2.86 0.05 0.00 -0.53 0.00 0.00 39.78 36.96 1klv n ASN 81 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1klv n ASN 82 N -2.36 -4.85 -4.25 1.20 3.02 -1.26 -5.02 115.26 101.74 1klv n ASN 82 Ca 0.02 -0.31 -0.14 0.00 -0.03 0.00 0.00 54.58 54.11 1klv n ASN 82 Cb 0.52 -3.51 -0.10 0.00 -0.61 0.00 0.00 39.78 36.08 1klv n ASN 82 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1klv s VAL 83 N -3.14 0.52 -0.46 2.41 1.01 0.12 -5.10 120.40 115.75 1klv s VAL 83 Ca 0.34 -1.98 0.07 0.00 0.00 0.00 0.00 61.98 60.40 1klv s VAL 83 Cb -0.15 -2.33 0.26 0.00 0.00 0.00 0.00 36.38 34.16 1klv s VAL 83 CO 0.42 -0.27 0.85 -0.38 0.00 0.00 0.00 175.10 175.73 1klv n ILE 84 N -0.31 -0.14 -1.46 2.22 -0.00 -1.26 -1.86 119.36 116.56 1klv n ILE 84 Ca -0.03 -2.14 -0.30 0.00 -0.00 0.00 0.00 62.75 60.28 1klv n ILE 84 Cb 0.65 0.76 0.10 0.00 -0.00 0.00 0.00 39.64 41.15 1klv n ILE 84 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 1klv s PRO 85 N 0.10 1.89 0.99 0.38 0.04 -1.26 -5.05 135.00 132.09 1klv s PRO 85 Ca 0.31 0.71 -0.17 0.00 0.04 0.00 0.00 61.00 61.89 1klv s PRO 85 Cb 0.24 -1.89 0.24 0.00 0.04 0.00 0.00 34.50 33.13 1klv s PRO 85 CO -0.18 -1.77 0.99 -0.35 0.04 0.00 0.00 177.00 175.73 1klv n PRO 86 N -3.54 -2.35 -0.21 0.56 -0.04 -1.26 -4.90 135.00 123.26 1klv n PRO 86 Ca 0.07 -1.56 0.01 0.00 -0.04 0.00 0.00 63.50 61.98 1klv n PRO 86 Cb 0.56 -1.33 0.08 0.00 -0.04 0.00 0.00 33.50 32.77 1klv n PRO 86 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1klv n THR 87 N -4.25 0.73 -1.39 0.52 -2.24 -1.26 -4.19 114.28 102.20 1klv n THR 87 Ca 0.13 -0.32 -0.32 0.00 -2.27 0.00 0.00 64.05 61.27 1klv n THR 87 Cb 0.50 -0.51 0.05 0.00 -2.10 0.00 0.00 70.33 68.26 1klv n THR 87 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1klv n SER 88 N 0.14 7.31 -1.46 3.42 2.88 -1.26 -4.29 113.62 120.36 1klv n SER 88 Ca 0.07 -3.60 -0.04 0.00 -1.33 0.00 0.00 58.87 53.98 1klv n SER 88 Cb 0.50 -1.04 -0.01 0.00 -0.75 0.00 0.00 64.21 62.91 1klv n SER 88 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1klv n ALA 89 N -0.41 0.02 -2.91 -1.46 0.00 -1.26 -5.03 120.51 109.46 1klv n ALA 89 Ca 0.53 -0.38 -0.11 0.00 0.00 0.00 0.00 53.44 53.48 1klv n ALA 89 Cb 0.54 0.31 -0.12 0.00 0.00 0.00 0.00 19.45 20.18 1klv n ALA 89 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1klv s THR 90 N -2.42 0.13 0.18 0.00 -4.23 -1.26 -1.42 115.64 106.62 1klv s THR 90 Ca 0.07 -0.55 -0.13 0.00 -1.18 0.00 0.00 61.69 59.90 1klv s THR 90 Cb 0.00 -0.21 0.07 0.00 1.34 0.00 0.00 72.50 73.70 1klv s THR 90 CO 0.05 -0.27 1.82 0.24 -0.54 0.00 0.00 174.62 175.93 1klv h MET 91 N 5.27 0.62 -0.69 3.99 2.86 -1.34 -2.36 114.93 123.29 1klv h MET 91 Ca -0.29 -0.04 0.15 0.00 -2.06 0.00 0.00 59.70 57.46 1klv h MET 91 Cb 1.21 -0.14 -0.12 0.00 0.06 0.00 0.00 31.60 32.61 1klv h MET 91 CO 0.45 0.41 0.03 0.78 1.06 0.00 0.00 176.91 179.64 1klv h GLY 92 N 0.64 0.78 1.73 8.32 0.00 -1.10 0.42 103.07 113.86 1klv h GLY 92 Ca 0.21 0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.57 1klv h GLY 92 CO -0.09 -0.24 -0.11 0.06 0.00 0.00 0.00 176.54 176.17 1klv h GLN 93 N 0.13 0.33 0.00 4.80 3.07 -1.57 -1.54 115.11 120.33 1klv h GLN 93 Ca 0.37 -0.08 -0.01 0.00 0.09 0.00 0.00 58.65 59.02 1klv h GLN 93 Cb 0.63 -0.04 -0.00 0.00 0.08 0.00 0.00 27.48 28.14 1klv h GLN 93 CO -0.58 0.45 -0.07 1.37 0.09 0.00 0.00 178.83 180.09 1klv h LEU 94 N 0.31 0.00 -0.30 0.06 8.10 0.16 -3.13 115.31 120.52 1klv h LEU 94 Ca 0.06 0.00 0.07 0.00 0.11 0.00 0.00 57.88 58.12 1klv h LEU 94 Cb 0.39 0.00 -0.08 0.00 -0.44 0.00 0.00 40.66 40.52 1klv h LEU 94 CO 0.02 0.07 -0.34 0.22 -4.11 0.00 0.00 178.44 174.30 1klv h TYR 95 N 0.00 -0.96 0.00 0.17 3.20 -0.48 0.32 116.97 119.23 1klv h TYR 95 Ca -0.00 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1klv h TYR 95 Cb 0.36 0.46 0.00 0.00 1.54 0.00 0.00 36.73 39.09 1klv h TYR 95 CO 0.00 -0.40 0.00 0.37 -1.64 0.00 0.00 178.16 176.49 1klv h GLN 96 N -0.32 0.00 0.00 1.82 5.75 -1.72 -2.74 115.11 117.90 1klv h GLN 96 Ca 0.14 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 1klv h GLN 96 Cb 0.55 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.10 1klv h GLN 96 CO -0.48 0.00 -0.05 0.93 -2.65 0.00 0.00 178.83 176.59 1klv h GLU 97 N 0.00 0.00 -1.02 1.69 4.39 -0.57 -3.41 114.58 115.66 1klv h GLU 97 Ca 0.00 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 59.07 1klv h GLU 97 Cb 0.44 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 28.80 1klv h GLU 97 CO 0.00 0.00 0.82 0.72 -1.16 0.00 0.00 179.01 179.39 1klv n HIS 98 N -2.51 3.12 0.29 4.33 8.25 0.40 -4.58 115.22 124.52 1klv n HIS 98 Ca -0.01 -2.78 0.18 0.00 -0.26 0.00 0.00 57.72 54.86 1klv n HIS 98 Cb 0.02 -1.34 0.95 0.00 1.12 0.00 0.00 29.99 30.74 1klv n HIS 98 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 1klv h HIS 99 N 1.80 0.00 0.00 4.41 2.07 -1.59 -2.83 115.15 119.00 1klv h HIS 99 Ca 0.60 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.12 1klv h HIS 99 Cb 1.17 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.15 1klv h HIS 99 CO 1.43 0.00 0.00 0.39 -3.07 0.00 0.00 177.93 176.68 1klv n GLU 100 N -3.29 0.00 -1.32 5.12 1.02 -1.26 -3.91 120.64 117.01 1klv n GLU 100 Ca -0.01 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.83 1klv n GLU 100 Cb 0.27 0.00 0.11 0.00 -0.02 0.00 0.00 31.44 31.80 1klv n GLU 100 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1klv s GLU 101 N 0.00 1.78 -1.46 3.49 2.56 -1.24 -4.90 118.70 118.92 1klv s GLU 101 Ca 0.00 0.86 -0.08 0.00 0.00 0.00 0.00 54.97 55.76 1klv s GLU 101 Cb 0.00 -1.87 0.03 0.00 2.00 0.00 0.00 34.13 34.29 1klv s GLU 101 CO 0.00 -1.89 2.62 -0.40 -0.56 0.00 0.00 175.26 175.03 1klv n ASP 102 N -3.65 8.13 0.01 -1.70 5.68 -1.26 -4.09 116.55 119.66 1klv n ASP 102 Ca 0.07 -2.88 0.00 0.00 -0.50 0.00 0.00 54.79 51.49 1klv n ASP 102 Cb 0.55 -1.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.07 1klv n ASP 102 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 1klv n PHE 103 N 2.77 -1.89 -4.60 2.11 -0.00 -1.26 -5.15 117.46 109.43 1klv n PHE 103 Ca 0.69 0.04 -0.28 0.00 -0.00 0.00 0.00 57.45 57.89 1klv n PHE 103 Cb 0.25 0.45 -0.05 0.00 -0.00 0.00 0.00 39.48 40.13 1klv n PHE 103 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1klv n PHE 104 N -2.74 0.90 -3.97 -5.13 3.72 -1.26 -4.89 117.46 104.10 1klv n PHE 104 Ca 0.00 -2.17 -0.22 0.00 -0.05 0.00 0.00 57.45 55.01 1klv n PHE 104 Cb 0.00 -0.30 -0.05 0.00 -0.94 0.00 0.00 39.48 38.19 1klv n PHE 104 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 176.76 176.23 1klv s LEU 105 N 0.00 3.37 -0.10 4.37 0.05 -1.07 -3.72 118.68 121.59 1klv s LEU 105 Ca 0.02 -0.69 0.03 0.00 0.05 0.00 0.00 54.13 53.54 1klv s LEU 105 Cb -0.00 -1.90 0.01 0.00 -2.05 0.00 0.00 46.19 42.24 1klv s LEU 105 CO 0.01 -0.35 -0.20 -0.31 -0.55 0.00 0.00 176.35 174.95 1klv s TYR 106 N -2.40 2.22 -0.02 3.48 1.51 -1.07 -0.33 117.35 120.74 1klv s TYR 106 Ca 0.40 -0.94 -0.00 0.00 -1.01 0.00 0.00 57.07 55.52 1klv s TYR 106 Cb -0.03 -1.52 0.03 0.00 -0.11 0.00 0.00 41.96 40.32 1klv s TYR 106 CO 0.24 -0.41 0.03 0.42 -1.11 0.00 0.00 175.55 174.73 1klv s ILE 107 N 0.55 -0.07 0.41 2.71 1.01 -0.84 -4.36 121.20 120.61 1klv s ILE 107 Ca -0.15 0.25 0.04 0.00 0.00 0.00 0.00 60.65 60.79 1klv s ILE 107 Cb -0.17 -0.09 -0.05 0.00 0.01 0.00 0.00 42.46 42.16 1klv s ILE 107 CO 0.05 0.10 0.04 0.00 0.00 0.00 0.00 174.94 175.13 1klv s ALA 108 N 1.24 3.10 0.15 9.38 0.00 -1.07 -1.93 121.76 132.62 1klv s ALA 108 Ca -0.07 -1.69 -0.12 0.00 0.00 0.00 0.00 51.96 50.09 1klv s ALA 108 Cb -0.13 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.36 1klv s ALA 108 CO -0.03 -0.18 0.33 1.52 0.00 0.00 0.00 175.76 177.39 1klv s TYR 109 N -2.98 0.15 0.35 0.00 1.13 -0.84 -1.25 117.35 113.90 1klv s TYR 109 Ca 0.28 -0.51 0.00 0.00 -1.41 0.00 0.00 57.07 55.42 1klv s TYR 109 Cb 0.07 0.08 -0.00 0.00 -1.10 0.00 0.00 41.96 41.00 1klv s TYR 109 CO 0.14 -0.71 0.45 0.45 -2.51 0.00 0.00 175.55 173.36 1klv s SER 110 N -2.90 1.17 -0.26 -0.18 0.15 -1.04 -2.33 113.70 108.31 1klv s SER 110 Ca 0.10 -1.58 0.09 0.00 0.70 0.00 0.00 55.95 55.27 1klv s SER 110 Cb 0.03 0.66 0.45 0.00 -1.71 0.00 0.00 66.02 65.44 1klv s SER 110 CO -0.05 -1.28 1.20 -0.67 1.20 0.00 0.00 173.24 173.64 1klv n ASP 111 N -1.55 3.68 -4.39 5.45 -0.08 -1.26 -1.82 116.55 116.59 1klv n ASP 111 Ca 0.02 -3.69 -0.27 0.00 -1.51 0.00 0.00 54.79 49.34 1klv n ASP 111 Cb 0.61 -0.41 -0.12 0.00 2.34 0.00 0.00 41.12 43.55 1klv n ASP 111 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1klv s GLU 112 N -3.42 1.41 -0.16 -0.67 2.02 -1.26 -4.79 118.70 111.83 1klv s GLU 112 Ca 0.45 -1.40 0.08 0.00 0.02 0.00 0.00 54.97 54.12 1klv s GLU 112 Cb 0.39 -1.78 0.22 0.00 0.10 0.00 0.00 34.13 33.07 1klv s GLU 112 CO -0.00 0.40 1.25 0.45 0.02 0.00 0.00 175.26 177.38 1klv n SER 113 N 0.64 -0.98 -4.09 -0.19 2.88 -1.26 -4.83 113.62 105.79 1klv n SER 113 Ca -0.16 -2.10 -0.37 0.00 -1.33 0.00 0.00 58.87 54.92 1klv n SER 113 Cb 0.54 0.40 0.07 0.00 -0.75 0.00 0.00 64.21 64.48 1klv n SER 113 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 1klv n VAL 114 N -0.68 0.00 -3.56 2.46 3.14 -1.26 -4.89 118.33 113.53 1klv n VAL 114 Ca -0.20 -0.16 -0.41 0.00 -2.96 0.00 0.00 64.34 60.60 1klv n VAL 114 Cb 0.81 -0.18 -0.11 0.00 -1.06 0.00 0.00 33.84 33.30 1klv n VAL 114 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 1klv s TYR 115 N -2.08 3.24 0.92 1.45 6.14 -1.26 -5.07 117.35 120.69 1klv s TYR 115 Ca 0.43 -0.87 -0.13 0.00 0.64 0.00 0.00 57.07 57.13 1klv s TYR 115 Cb -0.01 -2.48 0.03 0.00 0.42 0.00 0.00 41.96 39.92 1klv s TYR 115 CO 0.69 -0.63 0.45 0.41 0.64 0.00 0.00 175.55 177.11 1klv n GLY 116 N 5.04 -1.88 0.66 8.97 0.00 -1.26 -5.37 105.19 111.34 1klv n GLY 116 Ca -0.12 -0.69 0.13 0.00 0.00 0.00 0.00 46.02 45.34 1klv n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36