#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kvn n LYS 2 N 0.00 2.81 -4.14 3.17 5.02 -1.25 -4.79 118.16 118.98 1kvn n LYS 2 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 1kvn n LYS 2 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 34.86 1kvn n LYS 2 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1kvn s GLU 3 N 4.94 0.50 -0.05 1.97 2.02 -1.26 -3.37 118.70 123.45 1kvn s GLU 3 Ca 0.00 -0.14 -0.04 0.00 0.02 0.00 0.00 54.97 54.82 1kvn s GLU 3 Cb 0.00 -0.52 0.02 0.00 0.10 0.00 0.00 34.13 33.73 1kvn s GLU 3 CO 0.00 0.04 0.13 0.45 0.02 0.00 0.00 175.26 175.90 1kvn s SER 4 N 0.25 -0.12 -0.38 -0.19 0.15 0.45 -3.79 113.70 110.07 1kvn s SER 4 Ca -0.03 0.26 -0.15 0.00 0.70 0.00 0.00 55.95 56.73 1kvn s SER 4 Cb -0.06 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 1kvn s SER 4 CO -0.00 -0.07 0.31 0.54 1.20 0.00 0.00 173.24 175.22 1kvn s VAL 5 N 0.35 5.23 -0.18 4.45 0.11 -1.26 0.17 120.40 129.27 1kvn s VAL 5 Ca -0.02 -0.36 -0.02 0.00 -2.93 0.00 0.00 61.98 58.64 1kvn s VAL 5 Cb -0.04 -3.86 -0.01 0.00 -1.53 0.00 0.00 36.38 30.94 1kvn s VAL 5 CO -0.01 -0.20 -0.09 -0.69 -3.33 0.00 0.00 175.10 170.77 1kvn s VAL 6 N 1.82 3.13 0.89 2.04 1.01 0.46 -4.93 120.40 124.82 1kvn s VAL 6 Ca 0.07 -0.60 -0.12 0.00 0.00 0.00 0.00 61.98 61.34 1kvn s VAL 6 Cb -0.18 -2.37 0.18 0.00 0.00 0.00 0.00 36.38 34.01 1kvn s VAL 6 CO 0.11 0.48 1.23 0.26 0.00 0.00 0.00 175.10 177.18 1kvn s TRP 7 N 0.99 1.65 0.11 5.22 0.52 -1.26 0.60 118.94 126.77 1kvn s TRP 7 Ca -0.01 0.18 -0.13 0.00 0.02 0.00 0.00 56.10 56.16 1kvn s TRP 7 Cb -0.15 -3.80 -0.09 0.00 -1.15 0.00 0.00 33.47 28.29 1kvn s TRP 7 CO -0.01 -2.37 1.41 1.79 0.02 0.00 0.00 176.95 177.79 1kvn h THR 8 N -1.32 1.29 0.00 2.01 1.35 -1.88 -3.23 112.91 111.13 1kvn h THR 8 Ca -0.42 -1.63 -0.07 0.00 -0.55 0.00 0.00 66.41 63.73 1kvn h THR 8 Cb 1.25 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 69.28 1kvn h THR 8 CO 0.40 0.53 -0.48 -0.37 -0.25 0.00 0.00 175.52 175.34 1kvn h VAL 9 N 0.58 0.50 -0.37 6.82 -1.51 -1.85 -3.31 116.25 117.11 1kvn h VAL 9 Ca 0.03 -1.73 0.01 0.00 -1.23 0.00 0.00 66.70 63.77 1kvn h VAL 9 Cb 1.04 2.18 -0.02 0.00 -2.13 0.00 0.00 31.29 32.37 1kvn h VAL 9 CO 0.10 0.28 0.24 0.78 -1.23 0.00 0.00 177.57 177.75 1kvn h ASN 10 N 0.00 0.41 -0.90 4.19 -0.26 -1.12 -1.03 115.58 116.87 1kvn h ASN 10 Ca -0.02 -0.01 -0.52 0.00 -0.56 0.00 0.00 56.30 55.19 1kvn h ASN 10 Cb 1.26 -0.10 -0.27 0.00 -1.06 0.00 0.00 38.32 38.15 1kvn h ASN 10 CO 0.04 0.30 0.67 -0.11 -1.06 0.00 0.00 177.43 177.27 1kvn n LEU 11 N -4.48 6.81 -4.05 1.61 7.94 -1.25 -0.91 117.00 122.68 1kvn n LEU 11 Ca 0.03 -3.68 -0.26 0.00 -1.11 0.00 0.00 56.01 50.99 1kvn n LEU 11 Cb 0.07 -0.88 -0.17 0.00 0.53 0.00 0.00 43.42 42.97 1kvn n LEU 11 CO 0.35 1.17 -0.48 -0.62 -1.11 0.00 0.00 177.39 176.69 1kvn s ASP 12 N -1.21 2.04 0.01 1.96 -1.08 -0.39 -3.62 116.67 114.38 1kvn s ASP 12 Ca 0.54 -0.35 0.13 0.00 -0.52 0.00 0.00 52.55 52.35 1kvn s ASP 12 Cb 0.44 -0.94 -0.19 0.00 -1.46 0.00 0.00 42.92 40.77 1kvn s ASP 12 CO 0.06 0.04 0.81 -1.28 0.52 0.00 0.00 175.17 175.32 1kvn h SER 13 N 7.03 0.00 -0.04 -0.34 0.87 -1.85 -3.32 113.55 115.90 1kvn h SER 13 Ca -0.29 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.28 1kvn h SER 13 Cb 1.19 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.15 1kvn h SER 13 CO 0.47 0.88 0.04 0.50 -0.53 0.00 0.00 176.83 178.19 1kvn h LYS 14 N 0.00 0.00 -6.71 2.24 1.63 -1.91 -3.41 116.57 108.40 1kvn h LYS 14 Ca -0.21 0.00 -0.50 0.00 -0.85 0.00 0.00 60.65 59.09 1kvn h LYS 14 Cb 1.85 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.47 1kvn h LYS 14 CO 0.08 0.00 0.06 0.15 -3.45 0.00 0.00 179.45 176.28 1kvn s LYS 15 N -4.80 3.86 0.54 1.90 1.02 -1.25 -5.05 119.74 115.96 1kvn s LYS 15 Ca -0.05 0.49 0.09 0.00 0.02 0.00 0.00 55.97 56.52 1kvn s LYS 15 Cb 0.16 -2.46 0.07 0.00 -0.52 0.00 0.00 37.83 35.08 1kvn s LYS 15 CO 0.60 0.11 0.74 -1.12 -0.92 0.00 0.00 175.35 174.76 1kvn s SER 16 N -2.68 5.21 0.29 2.83 0.01 -1.26 -4.57 113.70 113.52 1kvn s SER 16 Ca 0.51 -0.77 0.03 0.00 1.31 0.00 0.00 55.95 57.03 1kvn s SER 16 Cb -0.10 0.11 0.63 0.00 0.21 0.00 0.00 66.02 66.87 1kvn s SER 16 CO 0.24 -1.22 1.79 -0.09 0.41 0.00 0.00 173.24 174.37 1kvn h ARG 17 N 0.28 0.78 -0.77 12.44 2.43 -1.94 0.18 114.38 127.78 1kvn h ARG 17 Ca -0.32 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 58.78 1kvn h ARG 17 Cb 1.29 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 30.63 1kvn h ARG 17 CO 0.42 0.52 0.38 0.00 -1.51 0.00 0.00 179.97 179.77 1kvn h ALA 18 N 1.59 1.00 -0.11 2.80 0.00 -1.95 -1.72 119.26 120.87 1kvn h ALA 18 Ca 0.53 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.20 1kvn h ALA 18 Cb 0.71 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1kvn h ALA 18 CO -0.34 0.56 -0.31 0.93 0.00 0.00 0.00 179.25 180.09 1kvn h GLU 19 N 1.09 0.21 0.00 0.00 5.08 -1.12 -3.46 114.58 116.37 1kvn h GLU 19 Ca 0.27 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1kvn h GLU 19 Cb 0.11 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1kvn h GLU 19 CO -0.03 0.50 0.00 0.41 -1.00 0.00 0.00 179.01 178.89 1kvn n GLY 20 N -0.45 0.93 3.81 -3.84 0.00 0.28 -4.90 105.19 101.01 1kvn n GLY 20 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1kvn n GLY 20 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1kvn s ARG 21 N 0.14 3.94 -0.00 1.61 1.70 -1.06 -1.09 118.95 124.19 1kvn s ARG 21 Ca 0.00 0.24 0.01 0.00 -0.47 0.00 0.00 55.73 55.51 1kvn s ARG 21 Cb 0.00 -3.28 0.01 0.00 -0.57 0.00 0.00 34.95 31.11 1kvn s ARG 21 CO 0.00 0.56 0.69 0.54 -1.08 0.00 0.00 175.30 176.01 1kvn n ARG 22 N 2.41 0.31 -4.78 3.89 1.74 -0.09 -4.72 116.66 115.43 1kvn n ARG 22 Ca -0.14 -0.78 -0.29 0.00 -0.77 0.00 0.00 57.85 55.86 1kvn n ARG 22 Cb 0.53 -0.58 -0.14 0.00 -1.02 0.00 0.00 32.46 31.25 1kvn n ARG 22 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1kvn s ILE 23 N -0.19 2.11 0.28 0.55 1.10 -0.74 -4.66 121.20 119.66 1kvn s ILE 23 Ca 0.01 -1.44 -0.30 0.00 -0.51 0.00 0.00 60.65 58.41 1kvn s ILE 23 Cb 0.01 -1.82 -0.10 0.00 0.15 0.00 0.00 42.46 40.70 1kvn s ILE 23 CO 0.00 0.29 1.44 -2.16 -2.11 0.00 0.00 174.94 172.40 1kvn s PRO 24 N -1.40 4.25 0.54 3.50 0.04 -1.26 -4.83 135.00 135.84 1kvn s PRO 24 Ca 0.12 2.34 0.23 0.00 0.04 0.00 0.00 61.00 63.73 1kvn s PRO 24 Cb -0.10 -3.08 1.40 0.00 0.04 0.00 0.00 34.50 32.76 1kvn s PRO 24 CO 0.03 -0.41 2.06 -0.09 0.04 0.00 0.00 177.00 178.62 1kvn h ARG 25 N 4.55 0.00 -0.66 4.56 2.43 -1.97 -1.28 114.38 122.02 1kvn h ARG 25 Ca -0.47 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 58.74 1kvn h ARG 25 Cb 1.22 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.73 1kvn h ARG 25 CO 0.75 0.00 0.43 0.00 -1.51 0.00 0.00 179.97 179.64 1kvn h ARG 26 N 0.00 0.71 -0.36 0.20 3.08 -2.05 -3.13 114.38 112.84 1kvn h ARG 26 Ca 0.15 -0.04 -0.27 0.00 0.07 0.00 0.00 59.98 59.89 1kvn h ARG 26 Cb 0.63 -0.16 -0.35 0.00 0.08 0.00 0.00 29.97 30.16 1kvn h ARG 26 CO -0.00 0.47 -0.95 0.34 -1.07 0.00 0.00 179.97 178.76 1kvn n PHE 27 N -4.47 1.17 -4.51 3.04 -0.00 -0.76 -5.07 117.46 106.87 1kvn n PHE 27 Ca 0.09 -1.71 -0.32 0.00 -0.00 0.00 0.00 57.45 55.50 1kvn n PHE 27 Cb 0.17 -0.24 -0.11 0.00 -0.00 0.00 0.00 39.48 39.30 1kvn n PHE 27 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1kvn s ALA 28 N -2.84 2.93 -0.37 3.13 0.00 -0.56 -4.74 121.76 119.31 1kvn s ALA 28 Ca 0.36 -1.04 -0.15 0.00 0.00 0.00 0.00 51.96 51.12 1kvn s ALA 28 Cb 0.36 -1.06 0.00 0.00 0.00 0.00 0.00 23.12 22.42 1kvn s ALA 28 CO -0.05 0.60 0.34 0.14 0.00 0.00 0.00 175.76 176.79 1kvn s VAL 29 N -0.97 5.20 0.64 0.00 -7.23 -1.24 -4.72 120.40 112.09 1kvn s VAL 29 Ca 0.16 -0.26 -0.16 0.00 -1.81 0.00 0.00 61.98 59.91 1kvn s VAL 29 Cb -0.11 -3.87 -0.01 0.00 0.56 0.00 0.00 36.38 32.95 1kvn s VAL 29 CO 0.07 -0.19 1.15 -2.16 -0.31 0.00 0.00 175.10 173.66 1kvn s PRO 30 N 1.90 2.78 -0.90 4.82 0.04 -1.26 -3.89 135.00 138.48 1kvn s PRO 30 Ca 0.09 1.59 -0.04 0.00 0.04 0.00 0.00 61.00 62.68 1kvn s PRO 30 Cb -0.17 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 1kvn s PRO 30 CO 0.11 -1.30 0.80 -1.71 0.04 0.00 0.00 177.00 174.94 1kvn n ASN 31 N -2.13 -6.42 -4.62 6.66 2.85 -1.26 -4.82 115.26 105.52 1kvn n ASN 31 Ca 0.12 -0.54 -0.45 0.00 -0.11 0.00 0.00 54.58 53.60 1kvn n ASN 31 Cb 0.51 -4.82 -0.04 0.00 1.24 0.00 0.00 39.78 36.68 1kvn n ASN 31 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 1kvn n VAL 32 N -2.83 0.50 -4.28 3.44 0.24 -1.25 -4.95 118.33 109.20 1kvn n VAL 32 Ca -0.05 -0.28 -0.35 0.00 -2.04 0.00 0.00 64.34 61.62 1kvn n VAL 32 Cb 0.59 -2.26 -0.09 0.00 -1.47 0.00 0.00 33.84 30.60 1kvn n VAL 32 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1kvn s LYS 33 N 5.36 3.21 0.23 7.34 -2.85 -1.26 -5.01 119.74 126.76 1kvn s LYS 33 Ca 0.97 -0.38 -0.07 0.00 -1.00 0.00 0.00 55.97 55.49 1kvn s LYS 33 Cb -0.49 -2.90 0.21 0.00 -2.06 0.00 0.00 37.83 32.60 1kvn s LYS 33 CO 0.42 0.62 1.83 1.25 0.10 0.00 0.00 175.35 179.57 1kvn h LEU 34 N 5.46 1.10 -0.74 2.77 5.85 -1.94 -1.14 115.31 126.67 1kvn h LEU 34 Ca -0.48 -0.13 0.13 0.00 0.84 0.00 0.00 57.88 58.24 1kvn h LEU 34 Cb 1.19 -0.28 -0.09 0.00 0.37 0.00 0.00 40.66 41.85 1kvn h LEU 34 CO 0.57 0.92 0.31 0.45 -0.34 0.00 0.00 178.44 180.36 1kvn h HIS 35 N 1.19 0.54 -0.09 1.25 3.86 -1.98 0.74 115.15 120.66 1kvn h HIS 35 Ca 0.29 0.03 -0.24 0.00 -1.16 0.00 0.00 60.37 59.30 1kvn h HIS 35 Cb 0.12 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 28.47 1kvn h HIS 35 CO 0.01 0.11 -0.87 0.93 0.86 0.00 0.00 177.93 178.97 1kvn h GLU 36 N 0.49 0.73 0.16 2.45 3.07 -1.84 -1.97 114.58 117.66 1kvn h GLU 36 Ca 0.39 -0.66 -0.01 0.00 -0.50 0.00 0.00 59.36 58.59 1kvn h GLU 36 Cb 0.55 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 1kvn h GLU 36 CO -0.36 1.26 -0.08 1.25 -1.40 0.00 0.00 179.01 179.67 1kvn h LEU 37 N 0.47 -0.19 -0.21 1.33 6.46 0.14 -2.74 115.31 120.58 1kvn h LEU 37 Ca -0.08 -0.29 -0.12 0.00 -0.12 0.00 0.00 57.88 57.28 1kvn h LEU 37 Cb 1.50 0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 41.48 1kvn h LEU 37 CO 0.17 0.21 -0.34 0.58 -0.62 0.00 0.00 178.44 178.45 1kvn h VAL 38 N -0.62 1.33 -0.13 1.05 2.07 0.29 -3.17 116.25 117.07 1kvn h VAL 38 Ca -0.02 -1.55 0.04 0.00 0.82 0.00 0.00 66.70 65.98 1kvn h VAL 38 Cb 0.46 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1kvn h VAL 38 CO 0.04 0.48 0.10 -0.08 0.02 0.00 0.00 177.57 178.13 1kvn h GLU 39 N 0.28 0.00 -0.72 1.57 4.81 -1.44 -2.21 114.58 116.86 1kvn h GLU 39 Ca 0.02 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1kvn h GLU 39 Cb 0.93 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 1kvn h GLU 39 CO 0.08 0.00 0.48 0.00 -0.73 0.00 0.00 179.01 178.83 1kvn h ALA 40 N 1.92 1.50 -0.60 2.92 0.00 -1.45 -2.12 119.26 121.43 1kvn h ALA 40 Ca 0.06 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1kvn h ALA 40 Cb 0.27 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1kvn h ALA 40 CO -0.00 0.46 0.40 1.03 0.00 0.00 0.00 179.25 181.14 1kvn h SER 41 N 0.96 0.45 -0.32 0.00 0.87 -1.54 -1.09 113.55 112.89 1kvn h SER 41 Ca 0.27 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.85 1kvn h SER 41 Cb -0.09 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 1kvn h SER 41 CO -0.06 0.29 0.21 0.07 -0.53 0.00 0.00 176.83 176.81 1kvn h LYS 42 N 0.51 0.34 -0.67 2.24 5.09 -1.52 1.36 116.57 123.92 1kvn h LYS 42 Ca 0.26 -0.02 0.04 0.00 0.09 0.00 0.00 60.65 61.03 1kvn h LYS 42 Cb 0.38 -0.08 -0.05 0.00 0.10 0.00 0.00 32.23 32.59 1kvn h LYS 42 CO -0.08 0.22 0.40 0.93 -2.09 0.00 0.00 179.45 178.83 1kvn h GLU 43 N 0.35 0.73 -0.00 0.07 4.39 -1.30 -2.91 114.58 115.91 1kvn h GLU 43 Ca 0.13 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.78 1kvn h GLU 43 Cb 0.08 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 1kvn h GLU 43 CO -0.03 0.48 -0.72 1.28 -1.16 0.00 0.00 179.01 178.87 1kvn n LEU 44 N -4.73 0.96 0.00 1.33 4.77 -0.81 -4.96 117.00 113.56 1kvn n LEU 44 Ca 0.08 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 1kvn n LEU 44 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1kvn n LEU 44 CO 0.31 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1kvn n GLY 45 N 1.37 0.26 3.35 -0.72 0.00 0.46 -4.88 105.19 105.04 1kvn n GLY 45 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.09 1kvn n GLY 45 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1kvn s LEU 46 N 0.00 -0.18 0.00 0.99 0.20 -1.21 -4.97 118.68 113.51 1kvn s LEU 46 Ca 0.00 0.26 0.00 0.00 0.69 0.00 0.00 54.13 55.08 1kvn s LEU 46 Cb 0.00 1.22 0.00 0.00 -0.43 0.00 0.00 46.19 46.98 1kvn s LEU 46 CO 0.00 -0.04 0.00 0.29 -0.29 0.00 0.00 176.35 176.31 1kvn n LYS 47 N 4.26 0.00 -4.05 1.98 5.02 -1.26 -5.05 118.16 119.06 1kvn n LYS 47 Ca -0.10 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.06 1kvn n LYS 47 Cb 0.55 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.52 1kvn n LYS 47 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1kvn s PHE 48 N -1.44 0.83 0.02 2.13 -0.12 -1.26 0.47 117.98 118.62 1kvn s PHE 48 Ca 0.00 -1.13 0.01 0.00 -0.05 0.00 0.00 56.93 55.76 1kvn s PHE 48 Cb 0.00 0.04 -0.02 0.00 -0.63 0.00 0.00 43.02 42.41 1kvn s PHE 48 CO 0.00 -1.12 -0.05 1.03 -0.05 0.00 0.00 175.22 175.03 1kvn s ARG 49 N -3.25 0.36 -0.01 1.99 1.81 0.53 -4.91 118.95 115.48 1kvn s ARG 49 Ca 0.28 -0.52 -0.01 0.00 -1.72 0.00 0.00 55.73 53.75 1kvn s ARG 49 Cb -0.01 -0.12 -0.04 0.00 -0.45 0.00 0.00 34.95 34.34 1kvn s ARG 49 CO 0.17 0.01 0.11 0.00 -0.68 0.00 0.00 175.30 174.91 1kvn s ALA 50 N -1.05 3.69 0.09 2.13 0.00 -1.26 0.17 121.76 125.52 1kvn s ALA 50 Ca -0.09 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 51.10 1kvn s ALA 50 Cb -0.08 -1.68 -0.03 0.00 0.00 0.00 0.00 23.12 21.34 1kvn s ALA 50 CO -0.00 0.70 -0.17 -2.00 0.00 0.00 0.00 175.76 174.29 1kvn s GLU 51 N -1.74 0.95 -0.01 0.00 2.12 0.82 -4.93 118.70 115.91 1kvn s GLU 51 Ca 0.23 -1.06 0.02 0.00 0.36 0.00 0.00 54.97 54.53 1kvn s GLU 51 Cb -0.12 -1.06 -0.00 0.00 0.26 0.00 0.00 34.13 33.21 1kvn s GLU 51 CO 0.15 0.24 -0.05 -1.21 -0.54 0.00 0.00 175.26 173.84 1kvn s GLU 52 N -1.86 0.45 -0.02 4.30 0.41 -1.26 -2.45 118.70 118.27 1kvn s GLU 52 Ca 0.02 -0.18 -0.01 0.00 -0.41 0.00 0.00 54.97 54.38 1kvn s GLU 52 Cb -0.10 -0.45 -0.00 0.00 -1.78 0.00 0.00 34.13 31.80 1kvn s GLU 52 CO 0.03 0.10 -0.03 1.63 -0.49 0.00 0.00 175.26 176.51 1kvn n LYS 53 N 3.02 0.07 -3.98 1.61 4.76 -1.26 -4.91 118.16 117.47 1kvn n LYS 53 Ca -0.14 0.26 -0.29 0.00 -2.87 0.00 0.00 58.31 55.27 1kvn n LYS 53 Cb 0.58 -0.85 -0.04 0.00 -1.84 0.00 0.00 35.03 32.87 1kvn n LYS 53 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1kvn s LYS 54 N -1.19 3.25 -0.84 1.97 1.02 -1.26 -4.68 119.74 118.02 1kvn s LYS 54 Ca -0.02 -0.60 -0.03 0.00 0.02 0.00 0.00 55.97 55.33 1kvn s LYS 54 Cb 0.00 -2.90 -0.01 0.00 -0.52 0.00 0.00 37.83 34.41 1kvn s LYS 54 CO 0.03 0.55 0.71 0.66 -0.92 0.00 0.00 175.35 176.39 1kvn n TYR 55 N -0.04 -2.59 0.17 3.18 4.01 -1.26 -4.82 117.16 115.80 1kvn n TYR 55 Ca -0.07 0.96 0.03 0.00 -0.16 0.00 0.00 57.90 58.66 1kvn n TYR 55 Cb 0.53 -3.73 0.26 0.00 -0.31 0.00 0.00 39.34 36.09 1kvn n TYR 55 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1kvn h PRO 56 N -0.15 0.00 -4.20 -0.72 0.13 -1.84 -3.40 132.00 121.82 1kvn h PRO 56 Ca -0.29 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.70 1kvn h PRO 56 Cb 1.17 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.15 1kvn h PRO 56 CO 0.35 0.47 -0.55 0.21 -0.23 0.00 0.00 178.00 178.25 1kvn s LYS 57 N -3.58 0.90 0.00 0.86 2.20 -1.26 -4.96 119.74 113.90 1kvn s LYS 57 Ca -0.00 -1.28 0.00 0.00 -0.36 0.00 0.00 55.97 54.33 1kvn s LYS 57 Cb 0.11 0.28 0.00 0.00 -1.51 0.00 0.00 37.83 36.71 1kvn s LYS 57 CO 0.72 -0.27 0.00 0.45 -0.36 0.00 0.00 175.35 175.89 1kvn n SER 58 N -0.08 0.00 -4.76 1.43 2.88 -1.26 -4.80 113.62 107.04 1kvn n SER 58 Ca -0.09 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.05 1kvn n SER 58 Cb 0.63 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.06 1kvn n SER 58 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1kvn s TRP 59 N 0.00 3.20 0.19 0.66 0.51 -1.26 -4.96 118.94 117.28 1kvn s TRP 59 Ca 0.00 1.42 -0.30 0.00 -2.12 0.00 0.00 56.10 55.10 1kvn s TRP 59 Cb 0.00 -3.59 -0.08 0.00 -0.81 0.00 0.00 33.47 28.99 1kvn s TRP 59 CO 0.00 -1.62 1.20 1.67 -0.51 0.00 0.00 176.95 177.69 1kvn s TRP 60 N -0.83 3.42 0.33 -1.98 -2.14 -1.26 -4.72 118.94 111.76 1kvn s TRP 60 Ca 0.50 1.43 -0.24 0.00 2.66 0.00 0.00 56.10 60.45 1kvn s TRP 60 Cb -0.37 -3.43 -0.10 0.00 -3.10 0.00 0.00 33.47 26.46 1kvn s TRP 60 CO 0.47 -1.20 0.92 -1.83 -2.66 0.00 0.00 176.95 172.64 1kvn s GLU 61 N -0.35 4.48 0.45 3.25 -1.05 -1.26 -4.94 118.70 119.28 1kvn s GLU 61 Ca 0.52 1.23 0.23 0.00 -0.15 0.00 0.00 54.97 56.81 1kvn s GLU 61 Cb -0.33 -2.70 1.06 0.00 -0.44 0.00 0.00 34.13 31.72 1kvn s GLU 61 CO 0.37 0.24 1.90 0.93 0.95 0.00 0.00 175.26 179.66 1kvn h GLU 62 N 2.97 0.00 0.00 -4.83 5.08 -1.94 -3.45 114.58 112.41 1kvn h GLU 62 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1kvn h GLU 62 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1kvn h GLU 62 CO 0.64 0.23 0.00 0.41 -1.00 0.00 0.00 179.01 179.29 1kvn n GLY 63 N -0.24 -1.97 3.58 -3.84 0.00 -1.26 -5.16 105.19 96.29 1kvn n GLY 63 Ca -0.01 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.70 1kvn n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kvn n GLY 64 N -1.38 -2.03 3.26 -0.02 0.00 -1.26 -4.92 105.19 98.84 1kvn n GLY 64 Ca 0.00 -1.72 -0.09 0.00 0.00 0.00 0.00 46.02 44.21 1kvn n GLY 64 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1kvn s ARG 65 N -0.09 1.02 0.18 1.61 1.70 -1.03 -3.04 118.95 119.31 1kvn s ARG 65 Ca 0.00 -1.19 0.06 0.00 -0.47 0.00 0.00 55.73 54.13 1kvn s ARG 65 Cb 0.00 0.33 -0.05 0.00 -0.57 0.00 0.00 34.95 34.67 1kvn s ARG 65 CO 0.00 -0.34 -0.13 0.14 -1.08 0.00 0.00 175.30 173.89 1kvn s VAL 66 N -3.96 1.50 -0.10 4.99 -7.23 0.20 -0.12 120.40 115.68 1kvn s VAL 66 Ca 0.16 -2.12 0.03 0.00 -1.81 0.00 0.00 61.98 58.24 1kvn s VAL 66 Cb 0.05 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 35.06 1kvn s VAL 66 CO -0.02 -0.64 -0.21 -0.69 -0.31 0.00 0.00 175.10 173.23 1kvn s VAL 67 N -3.05 1.81 -0.07 1.32 1.01 0.45 0.18 120.40 122.05 1kvn s VAL 67 Ca 0.19 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1kvn s VAL 67 Cb 0.00 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1kvn s VAL 67 CO 0.04 0.50 -0.08 -0.69 0.00 0.00 0.00 175.10 174.88 1kvn s VAL 68 N 0.50 3.59 -0.53 2.92 1.01 0.46 0.20 120.40 128.55 1kvn s VAL 68 Ca -0.16 -0.52 -0.22 0.00 0.00 0.00 0.00 61.98 61.08 1kvn s VAL 68 Cb -0.17 -2.47 0.05 0.00 0.00 0.00 0.00 36.38 33.79 1kvn s VAL 68 CO 0.06 0.59 0.82 -1.61 0.00 0.00 0.00 175.10 174.97 1kvn s GLU 69 N -0.71 3.26 0.12 2.72 2.02 0.18 0.17 118.70 126.45 1kvn s GLU 69 Ca 0.11 -0.48 0.00 0.00 0.02 0.00 0.00 54.97 54.62 1kvn s GLU 69 Cb -0.11 -4.06 0.00 0.00 0.10 0.00 0.00 34.13 30.05 1kvn s GLU 69 CO 0.01 -1.38 0.00 1.63 0.02 0.00 0.00 175.26 175.55 1kvn n LYS 70 N 6.98 0.00 -1.37 1.61 5.02 -1.22 -3.82 118.16 125.37 1kvn n LYS 70 Ca -0.01 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.38 1kvn n LYS 70 Cb 0.47 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.42 1kvn n LYS 70 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1kvn n ARG 71 N -2.74 -3.03 0.00 1.97 0.63 -1.25 -4.01 116.66 108.22 1kvn n ARG 71 Ca 0.00 2.44 0.00 0.00 -0.92 0.00 0.00 57.85 59.37 1kvn n ARG 71 Cb 0.00 -3.42 0.00 0.00 0.45 0.00 0.00 32.46 29.49 1kvn n ARG 71 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1kvn n GLY 72 N -3.65 1.98 3.94 5.14 0.00 -1.26 -4.94 105.19 106.39 1kvn n GLY 72 Ca -0.06 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 1kvn n GLY 72 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kvn s THR 73 N -0.05 4.82 0.00 2.61 -4.23 -1.26 -5.05 115.64 112.47 1kvn s THR 73 Ca 0.00 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.05 1kvn s THR 73 Cb 0.00 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 70.08 1kvn s THR 73 CO 0.00 -0.51 0.00 1.17 -0.54 0.00 0.00 174.62 174.74 1kvn n LYS 74 N -1.87 0.00 -0.12 3.99 3.00 -1.26 -4.75 118.16 117.15 1kvn n LYS 74 Ca -0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.17 1kvn n LYS 74 Cb 0.57 0.00 0.03 0.00 0.00 0.00 0.00 35.03 35.62 1kvn n LYS 74 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1kvn h THR 75 N 0.00 1.27 -0.84 3.15 2.02 -1.97 -2.96 112.91 113.58 1kvn h THR 75 Ca 0.00 -1.44 0.15 0.00 0.77 0.00 0.00 66.41 65.90 1kvn h THR 75 Cb 0.00 1.25 -0.10 0.00 -1.74 0.00 0.00 68.15 67.56 1kvn h THR 75 CO 0.00 0.48 0.41 0.11 0.37 0.00 0.00 175.52 176.90 1kvn h LYS 76 N 0.76 0.55 -0.58 6.66 1.57 -1.93 0.64 116.57 124.23 1kvn h LYS 76 Ca 0.09 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1kvn h LYS 76 Cb 0.84 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 1kvn h LYS 76 CO 0.07 0.37 0.28 1.25 -0.57 0.00 0.00 179.45 180.85 1kvn h LEU 77 N 0.57 0.76 -0.82 2.94 6.46 -1.82 -0.44 115.31 122.97 1kvn h LEU 77 Ca 0.47 -0.13 -0.00 0.00 -0.12 0.00 0.00 57.88 58.10 1kvn h LEU 77 Cb 0.70 -0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 40.39 1kvn h LEU 77 CO -0.39 0.68 0.50 0.24 -0.62 0.00 0.00 178.44 178.85 1kvn h MET 78 N 0.80 1.11 -0.40 1.25 2.86 -0.05 1.11 114.93 121.61 1kvn h MET 78 Ca 0.20 -0.10 0.01 0.00 -2.06 0.00 0.00 59.70 57.75 1kvn h MET 78 Cb 0.11 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 1kvn h MET 78 CO -0.03 0.78 0.26 0.97 1.06 0.00 0.00 176.91 179.95 1kvn h ILE 79 N 1.13 1.09 -0.16 -1.22 6.09 0.66 0.94 117.51 126.04 1kvn h ILE 79 Ca 0.30 -0.18 -0.02 0.00 -1.37 0.00 0.00 64.86 63.59 1kvn h ILE 79 Cb -0.05 0.51 -0.01 0.00 0.47 0.00 0.00 36.82 37.74 1kvn h ILE 79 CO -0.06 0.10 0.04 -0.33 -3.07 0.00 0.00 178.15 174.83 1kvn h GLU 80 N 0.53 0.26 -0.82 2.19 4.39 0.11 0.75 114.58 121.99 1kvn h GLU 80 Ca 0.15 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1kvn h GLU 80 Cb -0.05 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.53 1kvn h GLU 80 CO -0.04 0.41 0.49 1.25 -1.16 0.00 0.00 179.01 179.96 1kvn h LEU 81 N 0.06 0.99 -1.24 1.33 5.85 0.17 0.00 115.31 122.47 1kvn h LEU 81 Ca 0.05 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 1kvn h LEU 81 Cb 0.27 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1kvn h LEU 81 CO 0.00 0.77 -0.28 0.00 -0.34 0.00 0.00 178.44 178.59 1kvn h ALA 82 N 1.26 1.37 -0.37 1.25 0.00 0.12 0.91 119.26 123.80 1kvn h ALA 82 Ca 0.29 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1kvn h ALA 82 Cb -0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1kvn h ALA 82 CO -0.05 0.45 0.14 -0.09 0.00 0.00 0.00 179.25 179.69 1kvn h ARG 83 N 0.15 0.29 0.01 0.00 2.43 0.25 1.30 114.38 118.81 1kvn h ARG 83 Ca 0.02 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 1kvn h ARG 83 Cb 0.58 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1kvn h ARG 83 CO 0.04 0.19 -0.34 -0.22 -1.51 0.00 0.00 179.97 178.14 1kvn h LYS 84 N 0.30 0.20 -0.62 0.20 1.63 -1.03 -3.29 116.57 113.96 1kvn h LYS 84 Ca 0.17 -0.24 -0.08 0.00 -0.85 0.00 0.00 60.65 59.65 1kvn h LYS 84 Cb 0.14 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.82 1kvn h LYS 84 CO -0.17 0.99 0.07 0.82 -3.45 0.00 0.00 179.45 177.71 1kvn h ILE 85 N -0.47 1.26 -0.30 2.00 2.04 -0.64 -2.71 117.51 118.68 1kvn h ILE 85 Ca -0.05 -1.05 0.07 0.00 1.00 0.00 0.00 64.86 64.83 1kvn h ILE 85 Cb 1.11 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 1kvn h ILE 85 CO 0.07 0.39 0.21 0.00 0.00 0.00 0.00 178.15 178.82 1kvn h ALA 86 N 1.02 2.19 0.20 1.87 0.00 0.16 -0.58 119.26 124.11 1kvn h ALA 86 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1kvn h ALA 86 Cb 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1kvn h ALA 86 CO 0.02 -0.26 -0.10 1.49 0.00 0.00 0.00 179.25 180.40 1kvn h GLU 87 N 0.07 -0.26 -0.17 0.00 4.81 -1.56 -1.32 114.58 116.15 1kvn h GLU 87 Ca 0.14 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.44 1kvn h GLU 87 Cb 0.46 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.83 1kvn h GLU 87 CO -0.01 0.12 -0.29 0.82 -0.73 0.00 0.00 179.01 178.92 1kvn h ILE 88 N -0.71 0.33 -0.80 2.32 1.08 -0.97 1.52 117.51 120.27 1kvn h ILE 88 Ca -0.03 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.49 1kvn h ILE 88 Cb 0.49 0.33 -0.05 0.00 -3.07 0.00 0.00 36.82 34.52 1kvn h ILE 88 CO 0.05 0.00 0.49 0.08 -0.69 0.00 0.00 178.15 178.08 1kvn h ARG 89 N -0.34 0.90 -0.25 2.37 0.11 -1.43 0.14 114.38 115.88 1kvn h ARG 89 Ca 0.11 -0.05 0.03 0.00 0.10 0.00 0.00 59.98 60.17 1kvn h ARG 89 Cb 0.51 -0.20 -0.01 0.00 1.11 0.00 0.00 29.97 31.37 1kvn h ARG 89 CO -0.36 0.60 0.17 1.49 0.10 0.00 0.00 179.97 181.96 1kvn h GLU 90 N 0.93 0.19 -0.10 0.08 4.57 0.45 0.30 114.58 121.00 1kvn h GLU 90 Ca 0.34 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.37 1kvn h GLU 90 Cb 0.11 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 1kvn h GLU 90 CO -0.15 0.13 -0.55 1.96 -1.18 0.00 0.00 179.01 179.22 1kvn h GLN 91 N 0.20 0.30 -0.62 1.92 4.20 0.48 -2.99 115.11 118.60 1kvn h GLN 91 Ca 0.11 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 1kvn h GLN 91 Cb 0.18 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 1kvn h GLN 91 CO -0.02 0.77 0.15 -0.22 -0.67 0.00 0.00 178.83 178.84 1kvn h LYS 92 N 0.23 0.97 -0.70 1.46 3.64 -0.11 -2.33 116.57 119.73 1kvn h LYS 92 Ca 0.00 -0.22 -0.04 0.00 -1.27 0.00 0.00 60.65 59.13 1kvn h LYS 92 Cb 1.04 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.69 1kvn h LYS 92 CO 0.09 0.87 0.29 0.00 -2.27 0.00 0.00 179.45 178.43 1kvn h ARG 93 N 0.93 1.05 -0.12 1.90 3.08 -1.32 -3.12 114.38 116.77 1kvn h ARG 93 Ca 0.20 -0.18 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 1kvn h ARG 93 Cb 0.34 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1kvn h ARG 93 CO 0.00 0.86 -0.13 1.49 -1.07 0.00 0.00 179.97 181.12 1kvn h GLU 94 N 1.00 0.29 -1.13 0.04 4.57 -1.47 -3.48 114.58 114.40 1kvn h GLU 94 Ca 0.24 -0.16 0.22 0.00 -1.18 0.00 0.00 59.36 58.47 1kvn h GLU 94 Cb 0.19 0.01 -0.27 0.00 -0.16 0.00 0.00 28.75 28.52 1kvn h GLU 94 CO -0.02 0.71 0.89 1.14 -1.18 0.00 0.00 179.01 180.55 1kvn s GLN 95 N -4.25 0.14 -0.38 1.92 -2.07 -0.90 -4.86 119.66 109.27 1kvn s GLN 95 Ca -0.14 0.04 -0.04 0.00 -1.82 0.00 0.00 55.36 53.40 1kvn s GLN 95 Cb 0.04 0.07 0.21 0.00 -1.09 0.00 0.00 33.01 32.24 1kvn s GLN 95 CO 0.74 -0.04 1.01 0.21 -1.32 0.00 0.00 175.29 175.89 1kvn s LYS 96 N -1.00 0.41 -0.89 9.60 2.20 -1.26 -4.35 119.74 124.45 1kvn s LYS 96 Ca 0.07 -0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.29 1kvn s LYS 96 Cb -0.01 -0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.29 1kvn s LYS 96 CO -0.07 -0.50 0.00 1.17 -0.36 0.00 0.00 175.35 175.59 1kvn n LYS 97 N 2.73 -1.86 0.10 4.03 4.81 -1.26 -4.47 118.16 122.24 1kvn n LYS 97 Ca 0.13 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 1kvn n LYS 97 Cb 0.63 -4.89 0.00 0.00 0.02 0.00 0.00 35.03 30.79 1kvn n LYS 97 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1kvn n ASP 98 N -0.97 -0.97 -0.60 3.14 2.03 -1.26 -4.87 116.55 113.05 1kvn n ASP 98 Ca -0.10 0.36 0.08 0.00 0.52 0.00 0.00 54.79 55.65 1kvn n ASP 98 Cb 0.46 1.06 0.27 0.00 -0.72 0.00 0.00 41.12 42.19 1kvn n ASP 98 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1kvn n LYS 99 N -3.03 1.77 -0.19 -0.67 4.76 -1.26 -4.09 118.16 115.44 1kvn n LYS 99 Ca 0.00 -1.18 0.01 0.00 -2.87 0.00 0.00 58.31 54.26 1kvn n LYS 99 Cb 0.00 -1.34 0.25 0.00 -1.84 0.00 0.00 35.03 32.11 1kvn n LYS 99 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1kvn h LYS 100 N 2.13 0.94 -5.87 1.97 1.63 -1.89 -3.47 116.57 112.02 1kvn h LYS 100 Ca 0.00 -0.07 -0.37 0.00 -0.85 0.00 0.00 60.65 59.37 1kvn h LYS 100 Cb 0.48 -0.21 0.11 0.00 -0.60 0.00 0.00 32.23 32.01 1kvn h LYS 100 CO 0.00 0.64 -0.82 1.17 -3.45 0.00 0.00 179.45 176.99 1kvn n LYS 101 N -4.41 -4.98 -4.90 1.90 4.81 -1.26 -4.99 118.16 104.34 1kvn n LYS 101 Ca 0.07 0.72 -0.33 0.00 -0.87 0.00 0.00 58.31 57.91 1kvn n LYS 101 Cb 0.05 -5.43 -0.15 0.00 0.02 0.00 0.00 35.03 29.52 1kvn n LYS 101 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1kvn s LYS 102 N -5.58 3.14 0.06 1.64 2.20 -1.26 -5.11 119.74 114.83 1kvn s LYS 102 Ca 0.08 -0.73 -0.18 0.00 -0.36 0.00 0.00 55.97 54.78 1kvn s LYS 102 Cb -0.02 -2.51 -0.06 0.00 -1.51 0.00 0.00 37.83 33.73 1kvn s LYS 102 CO 0.78 0.29 0.53 0.15 -0.36 0.00 0.00 175.35 176.73 1kvn s LYS 103 N 0.14 4.11 0.00 4.03 1.02 -1.26 -5.21 119.74 122.57 1kvn s LYS 103 Ca -0.08 0.64 0.00 0.00 0.02 0.00 0.00 55.97 56.54 1kvn s LYS 103 Cb -0.15 -3.21 0.00 0.00 -0.52 0.00 0.00 37.83 33.95 1kvn s LYS 103 CO 0.05 0.64 0.00 0.36 -0.92 0.00 0.00 175.35 175.48