#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mvz n LYS 2 N 0.00 0.00 -2.30 -0.78 3.00 -1.26 -5.17 118.16 111.65 1mvz n LYS 2 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.27 1mvz n LYS 2 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.04 1mvz n LYS 2 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1mvz n SER 3 N -3.32 -0.99 -1.15 3.14 3.41 -1.26 -5.20 113.62 108.25 1mvz n SER 3 Ca 0.00 -1.66 -0.01 0.00 -0.26 0.00 0.00 58.87 56.94 1mvz n SER 3 Cb 0.00 1.64 0.00 0.00 -0.26 0.00 0.00 64.21 65.59 1mvz n SER 3 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1mvz n THR 4 N -0.26 0.00 -2.53 6.66 5.66 -1.26 -5.08 114.28 117.47 1mvz n THR 4 Ca -0.03 -0.11 -0.43 0.00 -3.05 0.00 0.00 64.05 60.43 1mvz n THR 4 Cb 0.27 0.08 0.00 0.00 -1.55 0.00 0.00 70.33 69.13 1mvz n THR 4 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1mvz n THR 5 N -0.05 3.93 -1.34 1.09 -2.24 -1.26 -4.97 114.28 109.44 1mvz n THR 5 Ca -0.00 -4.06 -0.24 0.00 -2.27 0.00 0.00 64.05 57.47 1mvz n THR 5 Cb 0.05 -2.38 0.18 0.00 -2.10 0.00 0.00 70.33 66.08 1mvz n THR 5 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1mvz n THR 6 N 6.11 0.00 -1.67 4.28 -2.24 -1.26 -4.66 114.28 114.85 1mvz n THR 6 Ca 0.48 -0.59 -0.43 0.00 -2.27 0.00 0.00 64.05 61.24 1mvz n THR 6 Cb 0.45 -1.40 -0.03 0.00 -2.10 0.00 0.00 70.33 67.26 1mvz n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mvz s ALA 7 N -3.49 2.78 0.00 6.98 0.00 -1.26 -4.35 121.76 122.42 1mvz s ALA 7 Ca 0.59 0.72 0.00 0.00 0.00 0.00 0.00 51.96 53.28 1mvz s ALA 7 Cb -0.04 -4.06 0.00 0.00 0.00 0.00 0.00 23.12 19.03 1mvz s ALA 7 CO 0.43 -2.72 0.00 0.00 0.00 0.00 0.00 175.76 173.48 1mvz n ASP 10 N -1.31 0.00 -4.58 0.00 2.03 -1.26 -0.79 116.55 110.64 1mvz n ASP 10 Ca -0.04 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.85 1mvz n ASP 10 Cb 0.59 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.93 1mvz n ASP 10 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1mvz s PHE 11 N -0.51 3.17 -0.66 -0.67 0.08 -1.26 -4.94 117.98 113.19 1mvz s PHE 11 Ca 0.00 0.46 0.06 0.00 0.12 0.00 0.00 56.93 57.57 1mvz s PHE 11 Cb 0.00 -3.10 0.23 0.00 -0.57 0.00 0.00 43.02 39.58 1mvz s PHE 11 CO 0.00 -0.57 0.69 0.00 -0.10 0.00 0.00 175.22 175.23 1mvz s PRO 13 N -2.24 2.78 0.05 0.00 0.04 -1.23 -4.78 135.00 129.64 1mvz s PRO 13 Ca 0.36 0.85 -0.00 0.00 0.04 0.00 0.00 61.00 62.24 1mvz s PRO 13 Cb 0.10 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1mvz s PRO 13 CO -0.05 -1.18 -0.04 0.00 0.04 0.00 0.00 177.00 175.77 1mvz s THR 15 N -3.50 4.34 -0.48 0.00 -4.23 -0.05 -4.98 115.64 106.74 1mvz s THR 15 Ca 0.04 0.95 0.03 0.00 -1.18 0.00 0.00 61.69 61.53 1mvz s THR 15 Cb 0.05 -3.63 0.50 0.00 1.34 0.00 0.00 72.50 70.76 1mvz s THR 15 CO -0.08 -0.81 1.72 0.54 -0.54 0.00 0.00 174.62 175.46 1mvz n ARG 16 N -2.28 2.66 -2.30 3.99 1.74 -1.26 -4.21 116.66 115.00 1mvz n ARG 16 Ca 0.07 -3.42 -0.27 0.00 -0.77 0.00 0.00 57.85 53.46 1mvz n ARG 16 Cb 0.54 -2.18 0.16 0.00 -1.02 0.00 0.00 32.46 29.95 1mvz n ARG 16 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1mvz s SER 17 N -2.27 3.57 -0.28 0.55 1.04 -1.26 -4.96 113.70 110.09 1mvz s SER 17 Ca 0.57 -0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.83 1mvz s SER 17 Cb 0.46 0.04 0.08 0.00 0.10 0.00 0.00 66.02 66.70 1mvz s SER 17 CO 0.02 -2.40 0.02 -0.51 0.98 0.00 0.00 173.24 171.35 1mvz s ILE 18 N -3.54 1.52 0.70 -1.02 -1.16 -1.26 -1.89 121.20 114.55 1mvz s ILE 18 Ca 0.72 -1.54 -0.12 0.00 -0.51 0.00 0.00 60.65 59.20 1mvz s ILE 18 Cb -0.03 -1.97 0.01 0.00 0.61 0.00 0.00 42.46 41.08 1mvz s ILE 18 CO 0.49 -0.39 1.07 -2.16 -2.81 0.00 0.00 174.94 171.14 1mvz s PRO 19 N 1.34 2.81 0.31 3.50 0.04 -1.26 -5.12 135.00 136.62 1mvz s PRO 19 Ca 0.03 1.06 -0.28 0.00 0.04 0.00 0.00 61.00 61.85 1mvz s PRO 19 Cb -0.18 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 1mvz s PRO 19 CO -0.12 -1.21 1.05 -1.25 0.04 0.00 0.00 177.00 175.52 1mvz s PRO 20 N -4.84 4.52 -0.16 0.56 0.04 -0.79 -4.99 135.00 129.33 1mvz s PRO 20 Ca 0.60 1.64 -0.02 0.00 0.04 0.00 0.00 61.00 63.26 1mvz s PRO 20 Cb -0.15 -2.98 -0.02 0.00 0.04 0.00 0.00 34.50 31.39 1mvz s PRO 20 CO 0.52 0.15 -0.08 -0.65 0.04 0.00 0.00 177.00 176.99 1mvz s GLN 21 N -1.77 3.47 0.10 4.56 1.11 -1.26 -4.74 119.66 121.14 1mvz s GLN 21 Ca 0.48 -0.62 0.03 0.00 0.01 0.00 0.00 55.36 55.27 1mvz s GLN 21 Cb -0.27 -2.83 -0.04 0.00 -1.01 0.00 0.00 33.01 28.86 1mvz s GLN 21 CO 0.35 0.10 0.11 0.00 0.01 0.00 0.00 175.29 175.86 1mvz n GLN 23 N 0.22 0.47 -4.58 0.00 10.64 -0.61 -1.27 117.38 122.25 1mvz n GLN 23 Ca -0.08 -3.17 -0.33 0.00 -1.83 0.00 0.00 57.00 51.58 1mvz n GLN 23 Cb 0.52 2.69 -0.11 0.00 -0.86 0.00 0.00 30.24 32.49 1mvz n GLN 23 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1mvz n THR 25 N 1.97 2.47 -2.91 0.00 -2.24 -0.64 -4.23 114.28 108.70 1mvz n THR 25 Ca -0.17 -3.51 -0.33 0.00 -2.27 0.00 0.00 64.05 57.77 1mvz n THR 25 Cb 0.53 -0.64 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 1mvz n THR 25 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1mvz s ASP 26 N -3.17 6.91 -0.07 3.42 3.68 -1.26 -4.82 116.67 121.35 1mvz s ASP 26 Ca 0.46 1.58 -0.03 0.00 2.13 0.00 0.00 52.55 56.69 1mvz s ASP 26 Cb 0.40 -2.49 0.04 0.00 -1.45 0.00 0.00 42.92 39.42 1mvz s ASP 26 CO -0.01 -0.30 0.14 -0.69 0.13 0.00 0.00 175.17 174.43 1mvz s VAL 27 N -2.10 -0.19 0.00 1.11 1.01 -1.26 -3.51 120.40 115.45 1mvz s VAL 27 Ca 0.59 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.91 1mvz s VAL 27 Cb -0.10 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 36.03 1mvz s VAL 27 CO 0.15 0.14 0.00 0.54 0.00 0.00 0.00 175.10 175.93 1mvz n ARG 28 N 5.08 0.00 0.00 2.72 1.74 -0.68 -4.99 116.66 120.53 1mvz n ARG 28 Ca -0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1mvz n ARG 28 Cb 0.50 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.94 1mvz n ARG 28 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1mvz n GLU 29 N 0.00 3.14 -1.28 5.56 2.13 -1.26 -1.71 120.64 127.22 1mvz n GLU 29 Ca 0.00 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.50 1mvz n GLU 29 Cb 0.00 0.00 0.10 0.00 0.27 0.00 0.00 31.44 31.81 1mvz n GLU 29 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1mvz s LYS 30 N 0.00 2.15 0.69 5.31 1.02 -1.26 -3.39 119.74 124.26 1mvz s LYS 30 Ca 0.00 1.34 -0.11 0.00 0.02 0.00 0.00 55.97 57.21 1mvz s LYS 30 Cb 0.00 -1.87 0.01 0.00 -0.52 0.00 0.00 37.83 35.45 1mvz s LYS 30 CO 0.00 -1.75 1.06 0.00 -0.92 0.00 0.00 175.35 173.74 1mvz s HIS 32 N -2.93 1.70 -0.84 0.00 -3.43 -1.26 -4.94 115.29 103.59 1mvz s HIS 32 Ca 0.59 0.32 0.00 0.00 -0.80 0.00 0.00 55.06 55.17 1mvz s HIS 32 Cb -0.15 -4.02 0.00 0.00 -1.43 0.00 0.00 32.58 26.99 1mvz s HIS 32 CO 0.52 -2.54 0.54 0.45 -2.00 0.00 0.00 174.74 171.71 1mvz n SER 33 N -3.68 1.22 -2.84 7.38 2.88 -1.26 -3.63 113.62 113.67 1mvz n SER 33 Ca 0.15 -1.85 -0.11 0.00 -1.33 0.00 0.00 58.87 55.72 1mvz n SER 33 Cb 0.60 -0.46 0.04 0.00 -0.75 0.00 0.00 64.21 63.64 1mvz n SER 33 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1mvz n ALA 34 N 0.12 -0.30 -3.47 -1.46 0.00 -1.26 -4.70 120.51 109.43 1mvz n ALA 34 Ca 0.00 -1.90 -0.29 0.00 0.00 0.00 0.00 53.44 51.25 1mvz n ALA 34 Cb 0.27 -1.15 -0.17 0.00 0.00 0.00 0.00 19.45 18.40 1mvz n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mvz n LYS 36 N 3.87 0.77 -3.70 0.00 4.76 -1.26 -4.74 118.16 117.87 1mvz n LYS 36 Ca -0.20 0.08 -0.38 0.00 -2.87 0.00 0.00 58.31 54.94 1mvz n LYS 36 Cb 0.52 -1.45 -0.12 0.00 -1.84 0.00 0.00 35.03 32.14 1mvz n LYS 36 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1mvz s SER 37 N -5.80 5.38 -0.03 4.39 0.15 -1.26 -5.03 113.70 111.49 1mvz s SER 37 Ca -0.23 -0.64 0.01 0.00 0.70 0.00 0.00 55.95 55.80 1mvz s SER 37 Cb 0.07 -1.95 0.01 0.00 -1.71 0.00 0.00 66.02 62.44 1mvz s SER 37 CO 0.58 -0.21 -0.06 0.00 1.20 0.00 0.00 173.24 174.76 1mvz s LEU 39 N 0.59 -0.19 0.34 0.00 2.96 -0.56 -5.01 118.68 116.79 1mvz s LEU 39 Ca -0.08 0.05 0.08 0.00 -0.22 0.00 0.00 54.13 53.96 1mvz s LEU 39 Cb -0.11 2.26 -0.07 0.00 0.50 0.00 0.00 46.19 48.77 1mvz s LEU 39 CO 0.00 -0.83 -0.05 0.00 -1.32 0.00 0.00 176.35 174.15 1mvz s THR 41 N -2.79 4.88 -2.13 0.00 -1.32 -0.42 -4.99 115.64 108.87 1mvz s THR 41 Ca 0.32 0.56 0.28 0.00 -1.21 0.00 0.00 61.69 61.65 1mvz s THR 41 Cb 0.05 -3.62 0.74 0.00 -1.51 0.00 0.00 72.50 68.16 1mvz s THR 41 CO 0.15 -0.11 2.00 -2.11 -2.21 0.00 0.00 174.62 172.34 1mvz n ARG 42 N -0.24 1.20 -0.83 7.08 1.85 -1.26 -4.01 116.66 120.46 1mvz n ARG 42 Ca 0.01 -0.29 -0.25 0.00 -1.00 0.00 0.00 57.85 56.33 1mvz n ARG 42 Cb 0.53 -1.46 0.21 0.00 -1.05 0.00 0.00 32.46 30.69 1mvz n ARG 42 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1mvz n SER 43 N -0.62 -2.00 -4.07 2.89 7.64 -1.26 -4.83 113.62 111.37 1mvz n SER 43 Ca 0.21 -1.04 -0.32 0.00 1.01 0.00 0.00 58.87 58.73 1mvz n SER 43 Cb 0.17 -0.83 -0.15 0.00 -1.01 0.00 0.00 64.21 62.39 1mvz n SER 43 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1mvz s PHE 44 N -2.60 3.17 0.49 1.43 5.36 -1.26 -1.31 117.98 123.27 1mvz s PHE 44 Ca 0.58 -2.23 -0.20 0.00 -0.96 0.00 0.00 56.93 54.12 1mvz s PHE 44 Cb -0.06 -1.91 -0.08 0.00 -0.34 0.00 0.00 43.02 40.63 1mvz s PHE 44 CO 0.45 -0.87 1.05 -1.25 -1.46 0.00 0.00 175.22 173.14 1mvz s PRO 45 N 1.14 3.76 -0.46 10.12 0.04 -1.26 -5.09 135.00 143.25 1mvz s PRO 45 Ca -0.07 1.40 -0.29 0.00 0.04 0.00 0.00 61.00 62.08 1mvz s PRO 45 Cb -0.19 -2.10 0.01 0.00 0.04 0.00 0.00 34.50 32.26 1mvz s PRO 45 CO -0.06 -0.47 1.38 -1.25 0.04 0.00 0.00 177.00 176.65 1mvz s PRO 46 N -3.21 3.51 -0.10 0.56 0.04 -0.42 -4.96 135.00 130.41 1mvz s PRO 46 Ca 0.68 0.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.43 1mvz s PRO 46 Cb -0.17 -4.04 -0.04 0.00 0.04 0.00 0.00 34.50 30.29 1mvz s PRO 46 CO 0.21 -1.66 0.05 -0.65 0.04 0.00 0.00 177.00 174.99 1mvz s GLN 47 N 5.06 3.14 0.10 4.56 -0.21 -1.26 -4.90 119.66 126.16 1mvz s GLN 47 Ca 0.57 -0.31 0.04 0.00 0.02 0.00 0.00 55.36 55.68 1mvz s GLN 47 Cb -0.12 -2.93 -0.04 0.00 1.00 0.00 0.00 33.01 30.92 1mvz s GLN 47 CO 0.30 0.73 0.05 0.00 -2.12 0.00 0.00 175.29 174.26 1mvz s ARG 49 N -2.50 0.30 -0.12 0.00 0.52 -0.24 -1.69 118.95 115.21 1mvz s ARG 49 Ca 0.28 0.03 -0.01 0.00 -0.52 0.00 0.00 55.73 55.51 1mvz s ARG 49 Cb -0.11 0.13 -0.02 0.00 0.52 0.00 0.00 34.95 35.47 1mvz s ARG 49 CO 0.21 -0.05 -0.09 0.00 0.02 0.00 0.00 175.30 175.38 1mvz n TYR 51 N 3.28 1.61 -1.19 0.00 9.36 -0.08 -4.25 117.16 125.89 1mvz n TYR 51 Ca -0.18 -1.91 -0.35 0.00 3.32 0.00 0.00 57.90 58.79 1mvz n TYR 51 Cb 0.53 -0.28 0.10 0.00 -0.63 0.00 0.00 39.34 39.06 1mvz n TYR 51 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1mvz n ASP 52 N -0.63 0.11 -4.17 2.98 5.75 -1.21 -4.53 116.55 114.84 1mvz n ASP 52 Ca 0.26 0.59 -0.35 0.00 -0.01 0.00 0.00 54.79 55.28 1mvz n ASP 52 Cb 0.89 -1.39 -0.14 0.00 -1.03 0.00 0.00 41.12 39.46 1mvz n ASP 52 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1mvz s ILE 53 N -2.01 2.89 0.21 2.12 -1.09 -1.26 -3.94 121.20 118.12 1mvz s ILE 53 Ca 0.70 -1.28 0.04 0.00 -2.23 0.00 0.00 60.65 57.88 1mvz s ILE 53 Cb -0.31 -2.60 -0.05 0.00 -1.58 0.00 0.00 42.46 37.92 1mvz s ILE 53 CO 0.54 0.00 -0.05 0.42 -1.23 0.00 0.00 174.94 174.62 1mvz s THR 54 N 1.27 1.17 0.14 2.92 -4.23 -0.39 -5.00 115.64 111.52 1mvz s THR 54 Ca -0.04 -2.06 0.31 0.00 -1.18 0.00 0.00 61.69 58.72 1mvz s THR 54 Cb -0.19 -2.19 0.35 0.00 1.34 0.00 0.00 72.50 71.81 1mvz s THR 54 CO -0.02 -0.46 1.96 -0.78 -0.54 0.00 0.00 174.62 174.77 1mvz h ASP 55 N 2.55 0.00 -4.83 3.99 1.82 -1.85 0.16 116.42 118.25 1mvz h ASP 55 Ca -0.38 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 55.72 1mvz h ASP 55 Cb 1.21 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 41.10 1mvz h ASP 55 CO 0.64 0.06 -0.45 2.22 -1.61 0.00 0.00 179.24 180.10 1mvz n PHE 56 N -3.20 0.14 -4.34 0.28 1.16 -1.26 -4.36 117.46 105.87 1mvz n PHE 56 Ca 0.00 -2.56 -0.30 0.00 -1.87 0.00 0.00 57.45 52.72 1mvz n PHE 56 Cb 0.33 -0.01 -0.10 0.00 -1.61 0.00 0.00 39.48 38.09 1mvz n PHE 56 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1mvz s TYR 58 N -1.12 3.47 0.98 0.00 2.02 -1.26 -5.09 117.35 116.35 1mvz s TYR 58 Ca 0.20 0.16 -0.11 0.00 -0.37 0.00 0.00 57.07 56.94 1mvz s TYR 58 Cb -0.11 -1.72 0.18 0.00 -0.40 0.00 0.00 41.96 39.91 1mvz s TYR 58 CO 0.11 0.32 1.09 -1.25 -1.57 0.00 0.00 175.55 174.25 1mvz s PRO 59 N -4.03 0.56 0.40 -1.71 0.04 -1.26 -4.24 135.00 124.76 1mvz s PRO 59 Ca 0.37 1.07 -0.27 0.00 0.04 0.00 0.00 61.00 62.21 1mvz s PRO 59 Cb -0.09 -1.71 -0.09 0.00 0.04 0.00 0.00 34.50 32.64 1mvz s PRO 59 CO 0.32 -2.79 1.38 -1.54 0.04 0.00 0.00 177.00 174.41 1mvz s SER 60 N -2.91 6.27 0.62 6.66 1.04 -1.26 -1.67 113.70 122.46 1mvz s SER 60 Ca 0.66 2.83 0.00 0.00 0.48 0.00 0.00 55.95 59.92 1mvz s SER 60 Cb -0.22 -2.65 0.10 0.00 0.10 0.00 0.00 66.02 63.35 1mvz s SER 60 CO 0.60 -0.90 0.71 0.00 0.98 0.00 0.00 173.24 174.63