#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rdv n LYS 2 N 0.00 2.29 -3.77 0.03 4.81 -1.26 -4.47 118.16 115.79 1rdv n LYS 2 Ca 0.00 0.82 -0.31 0.00 -0.87 0.00 0.00 58.31 57.95 1rdv n LYS 2 Cb 0.00 -2.58 -0.04 0.00 0.02 0.00 0.00 35.03 32.42 1rdv n LYS 2 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 1rdv s LYS 3 N 0.54 3.55 -0.02 1.64 0.00 -1.26 -4.57 119.74 119.63 1rdv s LYS 3 Ca 0.74 -0.22 0.06 0.00 0.00 0.00 0.00 55.97 56.56 1rdv s LYS 3 Cb -0.63 -2.92 -0.02 0.00 0.00 0.00 0.00 37.83 34.26 1rdv s LYS 3 CO 0.40 0.52 -0.21 0.71 0.00 0.00 0.00 175.35 176.78 1rdv s TYR 4 N -1.60 2.49 -0.14 1.78 1.51 -1.06 -0.93 117.35 119.40 1rdv s TYR 4 Ca 0.39 -0.31 -0.07 0.00 -1.01 0.00 0.00 57.07 56.07 1rdv s TYR 4 Cb -0.12 -1.53 -0.04 0.00 -0.11 0.00 0.00 41.96 40.15 1rdv s TYR 4 CO 0.26 0.09 0.09 0.08 -1.11 0.00 0.00 175.55 174.96 1rdv s VAL 5 N -0.71 5.10 -0.51 0.71 1.01 0.06 -0.15 120.40 125.91 1rdv s VAL 5 Ca 0.11 0.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.87 1rdv s VAL 5 Cb -0.10 -3.25 0.03 0.00 0.00 0.00 0.00 36.38 33.06 1rdv s VAL 5 CO 0.01 0.55 1.20 0.00 0.00 0.00 0.00 175.10 176.85 1rdv h THR 7 N 6.24 0.53 -0.01 0.00 2.02 -1.70 1.03 112.91 121.02 1rdv h THR 7 Ca -0.24 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.77 1rdv h THR 7 Cb 1.06 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1rdv h THR 7 CO 1.15 0.08 -0.06 0.58 0.37 0.00 0.00 175.52 177.64 1rdv h VAL 8 N 0.45 1.51 -0.00 3.16 2.07 -1.91 -3.41 116.25 118.11 1rdv h VAL 8 Ca 0.60 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1rdv h VAL 8 Cb 1.43 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 33.72 1rdv h VAL 8 CO -0.34 0.42 -0.01 0.00 0.02 0.00 0.00 177.57 177.66 1rdv n GLY 10 N 0.84 0.91 3.76 0.00 0.00 0.35 -5.01 105.19 106.05 1rdv n GLY 10 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1rdv n GLY 10 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1rdv n TYR 11 N -2.00 2.89 -3.80 1.61 4.19 -1.25 -4.47 117.16 114.33 1rdv n TYR 11 Ca 0.00 0.40 -0.37 0.00 3.31 0.00 0.00 57.90 61.24 1rdv n TYR 11 Cb 0.00 -2.54 -0.13 0.00 0.49 0.00 0.00 39.34 37.16 1rdv n TYR 11 CO 0.00 0.00 0.00 -2.00 0.91 0.00 0.00 176.86 175.77 1rdv s GLU 12 N -1.58 2.96 0.08 2.98 2.12 -1.26 0.01 118.70 124.01 1rdv s GLU 12 Ca 0.57 -0.94 -0.31 0.00 0.36 0.00 0.00 54.97 54.65 1rdv s GLU 12 Cb -0.49 -3.31 -0.07 0.00 0.26 0.00 0.00 34.13 30.51 1rdv s GLU 12 CO 0.59 -0.47 1.44 -0.47 -0.54 0.00 0.00 175.26 175.80 1rdv s TYR 13 N 1.45 3.02 -0.25 5.30 5.04 0.79 -4.90 117.35 127.81 1rdv s TYR 13 Ca 0.01 0.81 -0.02 0.00 -2.44 0.00 0.00 57.07 55.43 1rdv s TYR 13 Cb -0.17 -3.73 0.02 0.00 0.35 0.00 0.00 41.96 38.43 1rdv s TYR 13 CO 0.01 -2.66 -0.05 0.34 -1.34 0.00 0.00 175.55 171.85 1rdv s ASP 14 N 1.48 4.36 0.25 4.32 -1.08 -1.26 -2.55 116.67 122.18 1rdv s ASP 14 Ca 0.66 -0.80 -0.04 0.00 -0.52 0.00 0.00 52.55 51.85 1rdv s ASP 14 Cb -0.36 -1.69 0.42 0.00 -1.46 0.00 0.00 42.92 39.83 1rdv s ASP 14 CO 0.30 -0.12 1.80 -0.65 0.52 0.00 0.00 175.17 177.01 1rdv h PRO 15 N 8.04 0.72 0.00 4.34 0.11 -1.78 0.36 132.00 143.79 1rdv h PRO 15 Ca -0.34 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1rdv h PRO 15 Cb 1.12 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1rdv h PRO 15 CO 0.58 0.47 0.00 0.00 -0.21 0.00 0.00 178.00 178.85 1rdv n ALA 16 N -2.39 1.54 0.00 -0.75 0.00 -1.26 -0.37 120.51 117.28 1rdv n ALA 16 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1rdv n ALA 16 Cb 0.31 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1rdv n ALA 16 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1rdv n GLU 17 N -1.03 0.00 0.00 0.00 1.02 -0.70 -4.52 120.64 115.40 1rdv n GLU 17 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1rdv n GLU 17 Cb 0.01 -0.41 0.00 0.00 -0.02 0.00 0.00 31.44 31.02 1rdv n GLU 17 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rdv n GLY 18 N 1.77 0.60 2.50 0.62 0.00 0.12 -3.46 105.19 107.35 1rdv n GLY 18 Ca 0.00 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 1rdv n GLY 18 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rdv n ASP 19 N 4.57 -1.39 -0.23 1.61 2.03 -0.57 -4.58 116.55 117.99 1rdv n ASP 19 Ca 0.00 -3.16 -0.06 0.00 0.52 0.00 0.00 54.79 52.09 1rdv n ASP 19 Cb 0.00 0.79 -0.06 0.00 -0.72 0.00 0.00 41.12 41.13 1rdv n ASP 19 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1rdv n PRO 20 N 1.16 -0.24 0.00 -0.67 -0.02 -1.11 -1.60 135.00 132.52 1rdv n PRO 20 Ca 0.14 1.07 0.00 0.00 -2.02 0.00 0.00 63.50 62.70 1rdv n PRO 20 Cb 0.62 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 1rdv n PRO 20 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1rdv n ASP 21 N -4.33 1.12 -1.81 2.55 5.75 -1.26 -1.57 116.55 117.00 1rdv n ASP 21 Ca 0.01 -1.31 0.01 0.00 -0.01 0.00 0.00 54.79 53.49 1rdv n ASP 21 Cb 0.14 -0.33 0.02 0.00 -1.03 0.00 0.00 41.12 39.93 1rdv n ASP 21 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1rdv n ASN 22 N 0.35 0.65 0.00 -1.12 3.02 -0.62 -5.02 115.26 112.52 1rdv n ASN 22 Ca 0.00 -2.02 0.00 0.00 -0.03 0.00 0.00 54.58 52.53 1rdv n ASN 22 Cb 0.22 -0.18 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 1rdv n ASN 22 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rdv n GLY 23 N 0.03 2.60 3.54 7.41 0.00 -0.61 -4.95 105.19 113.22 1rdv n GLY 23 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1rdv n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rdv s VAL 24 N -0.84 4.04 0.86 1.61 1.01 -1.16 -4.96 120.40 120.96 1rdv s VAL 24 Ca 0.00 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.06 1rdv s VAL 24 Cb 0.00 -5.00 0.12 0.00 0.00 0.00 0.00 36.38 31.49 1rdv s VAL 24 CO 0.00 -1.86 1.17 -0.54 0.00 0.00 0.00 175.10 173.87 1rdv s LYS 25 N 4.66 1.31 1.04 2.72 1.02 -1.26 -1.51 119.74 127.71 1rdv s LYS 25 Ca 0.43 1.64 -0.11 0.00 0.02 0.00 0.00 55.97 57.95 1rdv s LYS 25 Cb -0.02 -1.75 0.21 0.00 -0.52 0.00 0.00 37.83 35.76 1rdv s LYS 25 CO -0.08 -2.44 1.09 -1.25 -0.92 0.00 0.00 175.35 171.75 1rdv s PRO 26 N -4.42 0.07 0.00 -1.68 0.04 -1.22 -3.91 135.00 123.88 1rdv s PRO 26 Ca 0.70 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.95 1rdv s PRO 26 Cb -0.25 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1rdv s PRO 26 CO 0.55 -3.17 0.00 0.41 0.04 0.00 0.00 177.00 174.83 1rdv n GLY 27 N 0.49 2.09 3.75 0.56 0.00 0.50 -4.92 105.19 107.67 1rdv n GLY 27 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1rdv n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rdv s THR 28 N -3.12 3.19 0.66 2.61 2.01 -1.22 -4.84 115.64 114.93 1rdv s THR 28 Ca 0.00 1.10 -0.07 0.00 0.31 0.00 0.00 61.69 63.02 1rdv s THR 28 Cb 0.00 -3.70 0.03 0.00 0.01 0.00 0.00 72.50 68.84 1rdv s THR 28 CO 0.00 0.22 0.98 0.00 -0.69 0.00 0.00 174.62 175.13 1rdv s ALA 29 N -0.59 3.16 0.18 7.40 0.00 -1.26 -4.32 121.76 126.33 1rdv s ALA 29 Ca 0.51 -0.72 0.22 0.00 0.00 0.00 0.00 51.96 51.97 1rdv s ALA 29 Cb -0.36 -2.68 0.85 0.00 0.00 0.00 0.00 23.12 20.93 1rdv s ALA 29 CO 0.43 -1.06 1.80 0.35 0.00 0.00 0.00 175.76 177.28 1rdv h PHE 30 N -0.43 0.00 -0.02 0.00 3.57 -1.97 -1.67 116.94 116.41 1rdv h PHE 30 Ca -0.45 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 60.88 1rdv h PHE 30 Cb 1.28 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.01 1rdv h PHE 30 CO 0.42 0.29 -0.74 1.49 -2.23 0.00 0.00 178.31 177.53 1rdv h GLU 31 N 0.00 0.17 0.00 1.11 4.81 -1.98 -3.23 114.58 115.46 1rdv h GLU 31 Ca -0.00 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1rdv h GLU 31 Cb 0.78 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1rdv h GLU 31 CO 0.04 0.83 0.00 -0.25 -0.73 0.00 0.00 179.01 178.90 1rdv n ASP 32 N -3.74 0.00 -4.74 1.04 8.00 -0.66 -4.86 116.55 111.59 1rdv n ASP 32 Ca -0.03 0.39 -0.41 0.00 0.71 0.00 0.00 54.79 55.46 1rdv n ASP 32 Cb 0.72 -0.46 -0.04 0.00 -0.02 0.00 0.00 41.12 41.31 1rdv n ASP 32 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1rdv s VAL 33 N -2.92 3.87 -0.45 2.53 1.01 -1.02 -4.88 120.40 118.54 1rdv s VAL 33 Ca 0.15 1.65 -0.44 0.00 0.00 0.00 0.00 61.98 63.33 1rdv s VAL 33 Cb 0.17 -4.05 -0.18 0.00 0.00 0.00 0.00 36.38 32.32 1rdv s VAL 33 CO 0.46 0.30 1.75 -2.65 0.00 0.00 0.00 175.10 174.96 1rdv n PRO 34 N 2.23 0.30 -0.60 2.72 -0.02 -1.26 -4.79 135.00 133.57 1rdv n PRO 34 Ca 0.02 0.10 0.48 0.00 -2.02 0.00 0.00 63.50 62.09 1rdv n PRO 34 Cb 0.46 -1.67 0.80 0.00 -0.02 0.00 0.00 33.50 33.07 1rdv n PRO 34 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rdv h ALA 35 N 6.51 3.65 0.00 3.55 0.00 -1.92 0.38 119.26 131.43 1rdv h ALA 35 Ca -0.38 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1rdv h ALA 35 Cb 1.37 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1rdv h ALA 35 CO 1.00 -2.15 -0.04 -0.40 0.00 0.00 0.00 179.25 177.65 1rdv n ASP 36 N -4.02 0.78 -4.59 0.00 5.75 -1.26 -4.78 116.55 108.44 1rdv n ASP 36 Ca 0.39 0.54 -0.43 0.00 -0.01 0.00 0.00 54.79 55.28 1rdv n ASP 36 Cb 1.80 -0.72 -0.01 0.00 -1.03 0.00 0.00 41.12 41.16 1rdv n ASP 36 CO 0.00 0.00 0.00 1.87 -0.11 0.00 0.00 177.20 178.96 1rdv n TRP 37 N -2.23 1.14 -4.37 2.11 -0.00 0.13 -4.98 117.44 109.25 1rdv n TRP 37 Ca 0.05 0.65 -0.19 0.00 -0.00 0.00 0.00 57.50 58.01 1rdv n TRP 37 Cb 0.43 -2.23 -0.10 0.00 -0.00 0.00 0.00 31.31 29.41 1rdv n TRP 37 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 177.69 177.83 1rdv s VAL 38 N -1.16 1.42 0.14 5.87 -7.23 -1.26 -3.78 120.40 114.40 1rdv s VAL 38 Ca 0.60 -2.10 -0.31 0.00 -1.81 0.00 0.00 61.98 58.36 1rdv s VAL 38 Cb -0.65 -2.32 -0.09 0.00 0.56 0.00 0.00 36.38 33.88 1rdv s VAL 38 CO 0.59 -0.38 1.50 0.00 -0.31 0.00 0.00 175.10 176.50 1rdv h PRO 40 N 6.88 0.00 0.00 0.00 0.11 -1.94 0.12 132.00 137.16 1rdv h PRO 40 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1rdv h PRO 40 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1rdv h PRO 40 CO 0.90 0.06 -1.03 0.44 -0.21 0.00 0.00 178.00 178.16 1rdv n ILE 41 N -3.32 0.00 -1.18 4.15 -6.64 -1.26 -4.66 119.36 106.45 1rdv n ILE 41 Ca -0.01 -0.17 0.00 0.00 -1.77 0.00 0.00 62.75 60.79 1rdv n ILE 41 Cb 0.23 0.79 0.00 0.00 -1.44 0.00 0.00 39.64 39.22 1rdv n ILE 41 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1rdv n GLY 43 N 0.00 2.58 3.34 0.00 0.00 0.39 -4.93 105.19 106.57 1rdv n GLY 43 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1rdv n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rdv n ALA 44 N 0.05 -2.32 -1.90 4.61 0.00 -1.26 -3.92 120.51 115.77 1rdv n ALA 44 Ca 0.00 -0.06 -0.14 0.00 0.00 0.00 0.00 53.44 53.25 1rdv n ALA 44 Cb 0.00 -1.58 0.11 0.00 0.00 0.00 0.00 19.45 17.98 1rdv n ALA 44 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1rdv n PRO 45 N 0.84 -0.46 0.17 0.00 -0.04 -1.26 0.32 135.00 134.57 1rdv n PRO 45 Ca 0.09 -1.44 0.04 0.00 -0.04 0.00 0.00 63.50 62.15 1rdv n PRO 45 Cb 0.48 -0.70 0.44 0.00 -0.04 0.00 0.00 33.50 33.68 1rdv n PRO 45 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1rdv h LYS 46 N 0.00 0.11 0.00 0.54 1.57 -1.86 -2.84 116.57 114.09 1rdv h LYS 46 Ca -0.25 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.50 1rdv h LYS 46 Cb 0.75 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.04 1rdv h LYS 46 CO 0.20 0.28 -0.05 0.66 -0.57 0.00 0.00 179.45 179.97 1rdv h SER 47 N 0.11 0.00 -0.35 0.86 4.64 -1.93 -2.72 113.55 114.16 1rdv h SER 47 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1rdv h SER 47 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1rdv h SER 47 CO 0.02 0.05 0.00 -0.62 -0.87 0.00 0.00 176.83 175.41 1rdv n GLU 48 N -3.82 2.51 -3.14 4.77 -0.58 -1.07 -4.90 120.64 114.40 1rdv n GLU 48 Ca -0.03 -1.54 -0.18 0.00 -0.42 0.00 0.00 57.16 54.99 1rdv n GLU 48 Cb 0.14 -1.62 0.01 0.00 -0.57 0.00 0.00 31.44 29.41 1rdv n GLU 48 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1rdv s PHE 49 N -1.71 2.50 0.01 -0.32 0.40 -1.03 -1.90 117.98 115.94 1rdv s PHE 49 Ca 0.28 -0.49 -0.12 0.00 -0.60 0.00 0.00 56.93 55.99 1rdv s PHE 49 Cb 0.18 -2.30 0.01 0.00 0.51 0.00 0.00 43.02 41.43 1rdv s PHE 49 CO 0.13 -0.50 0.26 -1.21 0.70 0.00 0.00 175.22 174.59 1rdv s GLU 50 N -4.37 0.68 0.28 0.44 0.41 -0.75 -4.87 118.70 110.52 1rdv s GLU 50 Ca 0.54 -0.40 -0.30 0.00 -0.41 0.00 0.00 54.97 54.41 1rdv s GLU 50 Cb -0.08 0.29 -0.11 0.00 -1.78 0.00 0.00 34.13 32.46 1rdv s GLU 50 CO 0.33 -0.20 1.53 -2.14 -0.49 0.00 0.00 175.26 174.29 1rdv s PRO 51 N -1.92 4.18 0.00 0.39 0.02 -1.26 -0.77 135.00 135.65 1rdv s PRO 51 Ca -0.10 2.46 0.31 0.00 0.02 0.00 0.00 61.00 63.70 1rdv s PRO 51 Cb -0.04 -3.06 1.67 0.00 0.02 0.00 0.00 34.50 33.09 1rdv s PRO 51 CO 0.00 -0.54 2.09 0.00 -0.33 0.00 0.00 177.00 178.22