#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3knn n ARG 3 N 0.00 1.69 0.00 0.00 0.63 -1.26 -3.62 116.66 114.11 3knn n ARG 3 Ca 0.00 -0.94 0.00 0.00 -0.92 0.00 0.00 57.85 55.99 3knn n ARG 3 Cb 0.00 -1.27 0.00 0.00 0.45 0.00 0.00 32.46 31.64 3knn n ARG 3 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 3knn n LYS 4 N 0.24 0.00 0.21 -0.14 3.00 -1.26 -4.38 118.16 115.84 3knn n LYS 4 Ca 0.09 0.00 0.18 0.00 -0.00 0.00 0.00 58.31 58.58 3knn n LYS 4 Cb 0.26 -0.10 0.84 0.00 0.00 0.00 0.00 35.03 36.03 3knn n LYS 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3knn h ALA 5 N -0.50 1.72 -0.01 3.14 0.00 -2.00 0.31 119.26 121.92 3knn h ALA 5 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3knn h ALA 5 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3knn h ALA 5 CO 0.00 -0.37 0.00 1.28 0.00 0.00 0.00 179.25 180.16 3knn n LEU 6 N -3.54 0.67 -0.06 0.00 4.77 -1.24 -1.57 117.00 116.04 3knn n LEU 6 Ca 0.02 -0.23 -0.09 0.00 -0.03 0.00 0.00 56.01 55.68 3knn n LEU 6 Cb 0.39 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 3knn n LEU 6 CO 0.24 0.11 -0.91 2.30 -1.33 0.00 0.00 177.39 177.80 3knn n ILE 7 N -0.46 0.73 0.34 -0.08 -5.35 0.97 -4.23 119.36 111.29 3knn n ILE 7 Ca 0.21 -0.29 -0.13 0.00 -0.27 0.00 0.00 62.75 62.27 3knn n ILE 7 Cb 0.22 -0.94 -0.06 0.00 -1.74 0.00 0.00 39.64 37.12 3knn n ILE 7 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3knn h GLU 8 N 0.00 -0.84 0.00 6.28 4.57 -1.28 -1.26 114.58 122.06 3knn h GLU 8 Ca -0.29 0.06 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 3knn h GLU 8 Cb 1.46 0.19 0.00 0.00 -0.16 0.00 0.00 28.75 30.24 3knn h GLU 8 CO -0.04 -0.56 0.37 -0.22 -1.18 0.00 0.00 179.01 177.38 3knn h LYS 9 N -0.97 0.00 0.00 1.92 3.64 -1.53 1.27 116.57 120.91 3knn h LYS 9 Ca -0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3knn h LYS 9 Cb 0.67 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 3knn h LYS 9 CO 0.15 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.33 3knn n ALA 10 N -1.59 2.15 -0.10 5.00 0.00 -0.48 -3.80 120.51 121.69 3knn n ALA 10 Ca -0.01 -0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.16 3knn n ALA 10 Cb 0.39 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.40 3knn n ALA 10 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3knn n LYS 11 N -1.41 0.50 -1.52 0.00 5.02 0.44 -4.65 118.16 116.55 3knn n LYS 11 Ca 0.08 0.21 -0.13 0.00 -2.02 0.00 0.00 58.31 56.46 3knn n LYS 11 Cb 0.24 -1.37 -0.10 0.00 -0.02 0.00 0.00 35.03 33.78 3knn n LYS 11 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3knn n ARG 12 N -4.25 0.11 -0.34 1.97 3.00 -1.21 -4.76 116.66 111.18 3knn n ARG 12 Ca -0.30 -1.46 -0.02 0.00 -0.01 0.00 0.00 57.85 56.06 3knn n ARG 12 Cb 0.65 -3.61 0.10 0.00 0.00 0.00 0.00 32.46 29.61 3knn n ARG 12 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 3knn h THR 13 N 6.80 1.21 0.00 0.55 2.02 -1.88 -3.40 112.91 118.22 3knn h THR 13 Ca 0.00 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.76 3knn h THR 13 Cb 1.00 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 3knn h THR 13 CO 1.01 0.22 0.00 -2.65 0.37 0.00 0.00 175.52 174.47 3knn n PRO 14 N -4.46 0.00 -3.19 6.66 -0.02 -1.26 -4.32 135.00 128.41 3knn n PRO 14 Ca 0.11 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.20 3knn n PRO 14 Cb 0.03 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.46 3knn n PRO 14 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3knn s LYS 15 N 0.00 4.31 0.00 -0.52 -0.14 -1.26 -4.88 119.74 117.25 3knn s LYS 15 Ca 0.00 0.84 0.00 0.00 -1.36 0.00 0.00 55.97 55.45 3knn s LYS 15 Cb 0.00 -3.27 0.00 0.00 -1.68 0.00 0.00 37.83 32.88 3knn s LYS 15 CO 0.00 0.56 0.00 1.19 -0.76 0.00 0.00 175.35 176.34 3knn n PHE 16 N 1.93 0.00 0.16 3.18 3.72 -1.26 -4.54 117.46 120.65 3knn n PHE 16 Ca -0.08 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.39 3knn n PHE 16 Cb 0.50 0.00 0.39 0.00 -0.94 0.00 0.00 39.48 39.43 3knn n PHE 16 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 3knn n LYS 17 N 0.42 0.10 -0.03 -1.08 2.85 -1.26 -1.70 118.16 117.45 3knn n LYS 17 Ca 0.00 0.58 -0.08 0.00 -1.05 0.00 0.00 58.31 57.76 3knn n LYS 17 Cb 0.00 -2.07 -0.14 0.00 -0.65 0.00 0.00 35.03 32.17 3knn n LYS 17 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 3knn n VAL 18 N -2.08 1.56 0.33 0.58 0.24 -1.26 -3.78 118.33 113.92 3knn n VAL 18 Ca -0.01 -0.80 0.03 0.00 -2.04 0.00 0.00 64.34 61.52 3knn n VAL 18 Cb 0.28 -0.95 0.17 0.00 -1.47 0.00 0.00 33.84 31.86 3knn n VAL 18 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3knn n ARG 19 N -3.00 0.12 -2.36 7.34 1.74 -0.69 -4.59 116.66 115.22 3knn n ARG 19 Ca -0.18 0.18 -0.42 0.00 -0.77 0.00 0.00 57.85 56.65 3knn n ARG 19 Cb 1.05 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.96 3knn n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3knn s ALA 20 N -2.45 3.45 0.03 7.54 0.00 -1.25 -5.02 121.76 124.06 3knn s ALA 20 Ca 0.07 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.93 3knn s ALA 20 Cb 0.04 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 3knn s ALA 20 CO 0.09 -0.53 -0.05 1.52 0.00 0.00 0.00 175.76 176.79 3knn s TYR 21 N 1.27 0.43 1.24 0.00 1.13 -1.26 -5.12 117.35 115.05 3knn s TYR 21 Ca 0.60 -0.42 -0.19 0.00 -1.41 0.00 0.00 57.07 55.65 3knn s TYR 21 Cb -0.31 -0.27 0.28 0.00 -1.10 0.00 0.00 41.96 40.56 3knn s TYR 21 CO 0.29 -0.11 0.64 0.25 -2.51 0.00 0.00 175.55 174.10 3knn n THR 22 N 1.82 0.00 0.00 -3.49 -2.24 -1.26 -4.93 114.28 104.18 3knn n THR 22 Ca -0.21 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 3knn n THR 22 Cb 0.56 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 3knn n THR 22 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3knn n ARG 23 N -3.85 0.00 -1.45 -0.78 3.00 -1.26 -4.73 116.66 107.59 3knn n ARG 23 Ca 0.10 0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.53 3knn n ARG 23 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.93 3knn n ARG 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3knn h VAL 25 N 0.83 0.10 -0.09 0.00 2.07 -0.23 -2.64 116.25 116.28 3knn h VAL 25 Ca -0.40 -0.58 -0.08 0.00 0.82 0.00 0.00 66.70 66.46 3knn h VAL 25 Cb 1.40 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3knn h VAL 25 CO 0.52 0.02 -0.25 0.08 0.02 0.00 0.00 177.57 177.96 3knn h ARG 26 N -1.13 0.33 -0.54 1.57 0.11 -1.90 -3.36 114.38 109.46 3knn h ARG 26 Ca -0.06 -0.23 -0.04 0.00 0.10 0.00 0.00 59.98 59.75 3knn h ARG 26 Cb 0.49 0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.59 3knn h ARG 26 CO 0.10 0.85 0.04 0.00 0.10 0.00 0.00 179.97 181.06 3knn n GLY 28 N 0.27 -0.28 3.21 0.00 0.00 -1.00 -4.76 105.19 102.63 3knn n GLY 28 Ca 0.29 0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 3knn n GLY 28 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3knn n ARG 29 N -2.53 2.82 -0.12 1.61 3.00 -1.26 -4.62 116.66 115.56 3knn n ARG 29 Ca 0.06 -2.84 -0.03 0.00 -0.00 0.00 0.00 57.85 55.03 3knn n ARG 29 Cb 0.30 -3.39 -0.03 0.00 0.00 0.00 0.00 32.46 29.34 3knn n ARG 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3knn n ALA 30 N 7.87 -0.18 -1.42 5.13 0.00 -1.26 -3.51 120.51 127.14 3knn n ALA 30 Ca 0.50 0.24 -0.31 0.00 0.00 0.00 0.00 53.44 53.87 3knn n ALA 30 Cb 0.43 0.06 0.07 0.00 0.00 0.00 0.00 19.45 20.01 3knn n ALA 30 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3knn s ARG 31 N -4.31 2.61 -1.29 0.00 0.52 -1.26 -4.32 118.95 110.91 3knn s ARG 31 Ca -0.03 1.07 -0.20 0.00 -0.52 0.00 0.00 55.73 56.05 3knn s ARG 31 Cb 0.03 -1.94 0.03 0.00 0.52 0.00 0.00 34.95 33.58 3knn s ARG 31 CO 0.18 -1.36 0.37 0.45 0.02 0.00 0.00 175.30 174.96 3knn n SER 32 N -3.30 -1.87 -4.26 0.23 2.88 -1.26 -4.80 113.62 101.24 3knn n SER 32 Ca 0.08 -1.24 -0.36 0.00 -1.33 0.00 0.00 58.87 56.03 3knn n SER 32 Cb 0.53 -1.50 -0.13 0.00 -0.75 0.00 0.00 64.21 62.36 3knn n SER 32 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3knn s VAL 33 N -3.90 3.39 0.23 2.46 -7.23 -1.26 -1.06 120.40 113.02 3knn s VAL 33 Ca 0.28 -0.90 -0.30 0.00 -1.81 0.00 0.00 61.98 59.24 3knn s VAL 33 Cb -0.15 -2.76 -0.09 0.00 0.56 0.00 0.00 36.38 33.94 3knn s VAL 33 CO 0.94 0.12 1.38 -0.31 -0.31 0.00 0.00 175.10 176.91 3knn s TYR 34 N 1.40 3.13 0.05 2.82 1.51 -1.05 -4.88 117.35 120.33 3knn s TYR 34 Ca 0.01 1.12 -0.14 0.00 -1.01 0.00 0.00 57.07 57.05 3knn s TYR 34 Cb -0.17 -3.72 -0.30 0.00 -0.11 0.00 0.00 41.96 37.66 3knn s TYR 34 CO -0.01 -2.29 1.08 0.07 -1.11 0.00 0.00 175.55 173.29 3knn h ARG 35 N 5.18 0.57 -0.97 -0.62 0.11 -1.95 0.40 114.38 117.10 3knn h ARG 35 Ca -0.45 -0.83 0.18 0.00 0.10 0.00 0.00 59.98 58.98 3knn h ARG 35 Cb 1.22 0.29 -0.09 0.00 1.11 0.00 0.00 29.97 32.49 3knn h ARG 35 CO 0.77 1.38 0.61 0.35 0.10 0.00 0.00 179.97 183.19 3knn h PHE 36 N 0.23 0.91 0.00 4.08 3.04 -1.99 -3.21 116.94 120.00 3knn h PHE 36 Ca -0.20 0.03 -0.39 0.00 3.98 0.00 0.00 57.97 61.38 3knn h PHE 36 Cb 1.99 -0.28 -0.06 0.00 2.56 0.00 0.00 35.95 40.16 3knn h PHE 36 CO 0.11 0.25 -2.23 1.19 -2.02 0.00 0.00 178.31 175.62 3knn n PHE 37 N -4.65 0.14 0.00 0.41 3.72 -1.24 -5.03 117.46 110.80 3knn n PHE 37 Ca 0.21 0.06 0.00 0.00 -0.05 0.00 0.00 57.45 57.67 3knn n PHE 37 Cb 0.57 -0.96 0.00 0.00 -0.94 0.00 0.00 39.48 38.15 3knn n PHE 37 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3knn n GLY 38 N 1.30 1.08 3.26 1.37 0.00 0.14 -4.98 105.19 107.35 3knn n GLY 38 Ca -0.48 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 3knn n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3knn s LEU 39 N 0.00 2.13 0.47 0.99 1.43 -1.19 0.59 118.68 123.10 3knn s LEU 39 Ca 0.00 -0.50 -0.24 0.00 -1.03 0.00 0.00 54.13 52.36 3knn s LEU 39 Cb 0.00 -1.06 -0.07 0.00 0.03 0.00 0.00 46.19 45.08 3knn s LEU 39 CO 0.00 0.20 1.37 0.00 0.23 0.00 0.00 176.35 178.16 3knn n ARG 41 N -0.39 -0.05 0.31 0.00 1.85 -0.23 -0.30 116.66 117.85 3knn n ARG 41 Ca 0.06 1.17 -0.12 0.00 -1.00 0.00 0.00 57.85 57.97 3knn n ARG 41 Cb 0.43 -2.03 -0.06 0.00 -1.05 0.00 0.00 32.46 29.75 3knn n ARG 41 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 3knn h ILE 42 N 0.00 0.00 -0.76 8.89 2.04 -1.88 -2.55 117.51 123.25 3knn h ILE 42 Ca 0.65 -0.01 0.14 0.00 1.00 0.00 0.00 64.86 66.63 3knn h ILE 42 Cb 1.62 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 37.56 3knn h ILE 42 CO -0.68 0.00 -0.28 0.00 0.00 0.00 0.00 178.15 177.18 3knn n LEU 44 N -5.48 0.00 0.01 0.00 -0.00 -0.98 -1.95 117.00 108.60 3knn n LEU 44 Ca 0.09 0.08 -0.10 0.00 -0.00 0.00 0.00 56.01 56.08 3knn n LEU 44 Cb 0.39 -0.08 -0.14 0.00 -0.00 0.00 0.00 43.42 43.59 3knn n LEU 44 CO -0.04 -0.03 -0.37 -0.09 -0.00 0.00 0.00 177.39 176.87 3knn h ARG 45 N 0.00 0.04 0.00 1.47 2.43 0.59 -3.22 114.38 115.69 3knn h ARG 45 Ca 0.00 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3knn h ARG 45 Cb 0.06 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3knn h ARG 45 CO 0.00 0.72 -0.02 0.93 -1.51 0.00 0.00 179.97 180.09 3knn h GLU 46 N 0.01 0.00 -1.13 0.20 5.08 -1.09 -3.33 114.58 114.32 3knn h GLU 46 Ca -0.23 0.00 0.31 0.00 -1.00 0.00 0.00 59.36 58.45 3knn h GLU 46 Cb 1.96 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 31.13 3knn h GLU 46 CO 0.10 0.25 0.76 -0.07 -1.00 0.00 0.00 179.01 179.05 3knn h LEU 47 N -1.00 0.28 -0.33 1.33 3.38 -1.63 -0.69 115.31 116.65 3knn h LEU 47 Ca -0.00 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.05 3knn h LEU 47 Cb 0.26 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3knn h LEU 47 CO -0.00 0.02 0.18 0.00 0.09 0.00 0.00 178.44 178.73 3knn h ALA 48 N 1.55 0.41 0.00 1.53 0.00 -1.66 0.26 119.26 121.34 3knn h ALA 48 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 3knn h ALA 48 Cb 1.90 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.61 3knn h ALA 48 CO -0.22 -0.19 0.00 0.72 0.00 0.00 0.00 179.25 179.57 3knn n HIS 49 N -4.92 0.00 0.04 0.00 8.25 -0.32 -3.26 115.22 115.01 3knn n HIS 49 Ca -0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.24 3knn n HIS 49 Cb 0.06 -0.48 -0.14 0.00 1.12 0.00 0.00 29.99 30.55 3knn n HIS 49 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 3knn h LYS 50 N 0.00 0.32 0.00 -0.41 1.57 -0.73 -3.49 116.57 113.83 3knn h LYS 50 Ca 0.00 -0.54 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 3knn h LYS 50 Cb 0.47 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.98 3knn h LYS 50 CO 0.00 1.26 0.00 0.41 -0.57 0.00 0.00 179.45 180.55 3knn n GLY 51 N 1.82 0.98 0.24 3.86 0.00 0.80 -5.01 105.19 107.89 3knn n GLY 51 Ca -0.26 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.86 3knn n GLY 51 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3knn n GLN 52 N 0.00 1.55 -3.64 1.61 6.02 -0.92 -4.80 117.38 117.20 3knn n GLN 52 Ca 0.00 -2.68 -0.29 0.00 -0.01 0.00 0.00 57.00 54.02 3knn n GLN 52 Cb 0.00 -1.56 -0.14 0.00 1.02 0.00 0.00 30.24 29.55 3knn n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3knn s LEU 53 N -2.90 1.74 0.09 1.08 1.43 -1.26 -4.97 118.68 113.89 3knn s LEU 53 Ca 0.34 -1.83 -0.36 0.00 -1.03 0.00 0.00 54.13 51.25 3knn s LEU 53 Cb 0.30 -0.71 -0.17 0.00 0.03 0.00 0.00 46.19 45.64 3knn s LEU 53 CO 0.03 -0.38 1.15 -2.65 0.23 0.00 0.00 176.35 174.74 3knn n PRO 54 N 4.57 0.72 -0.43 1.29 -0.02 -1.26 -1.71 135.00 138.16 3knn n PRO 54 Ca 0.01 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3knn n PRO 54 Cb 0.40 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 3knn n PRO 54 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3knn n GLY 55 N 2.04 0.00 3.13 -1.23 0.00 -1.26 -4.80 105.19 103.08 3knn n GLY 55 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3knn n GLY 55 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3knn n VAL 56 N -0.88 3.78 -1.26 1.61 0.31 -0.69 -4.96 118.33 116.24 3knn n VAL 56 Ca 0.00 -3.69 -0.29 0.00 -0.01 0.00 0.00 64.34 60.35 3knn n VAL 56 Cb 0.17 -2.47 0.20 0.00 -0.91 0.00 0.00 33.84 30.83 3knn n VAL 56 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3knn s ARG 57 N 3.25 -0.30 -0.72 5.55 3.52 -1.26 -4.94 118.95 124.04 3knn s ARG 57 Ca 0.49 0.08 -0.25 0.00 -0.13 0.00 0.00 55.73 55.91 3knn s ARG 57 Cb 0.08 -1.69 0.05 0.00 -1.56 0.00 0.00 34.95 31.83 3knn s ARG 57 CO -0.01 -3.13 1.17 0.21 -0.81 0.00 0.00 175.30 172.74 3knn s LYS 58 N -5.34 3.17 0.97 5.12 2.36 -1.26 -5.01 119.74 119.76 3knn s LYS 58 Ca 0.69 -0.47 -0.15 0.00 -2.55 0.00 0.00 55.97 53.49 3knn s LYS 58 Cb -0.12 -4.22 -0.06 0.00 -1.05 0.00 0.00 37.83 32.38 3knn s LYS 58 CO 0.56 -2.03 -0.21 0.00 1.55 0.00 0.00 175.35 175.22 3knn n ALA 59 N 8.78 -4.07 0.00 3.13 0.00 -1.26 -5.02 120.51 122.07 3knn n ALA 59 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.81 3knn n ALA 59 Cb 0.48 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3knn n ALA 59 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3knn n SER 60 N 1.12 0.00 0.00 0.00 2.88 -1.26 -5.32 113.62 111.04 3knn n SER 60 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 3knn n SER 60 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 3knn n SER 60 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14