#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m8b n ALA 2 N 0.00 -2.51 -2.68 -1.18 0.00 -1.26 -5.00 120.51 107.88 1m8b n ALA 2 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.49 1m8b n ALA 2 Cb 0.00 -3.15 0.01 0.00 0.00 0.00 0.00 19.45 16.31 1m8b n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m8b s ALA 3 N -3.16 -4.93 1.02 0.00 0.00 -1.26 -5.16 121.76 108.27 1m8b s ALA 3 Ca 0.19 1.54 -0.14 0.00 0.00 0.00 0.00 51.96 53.54 1m8b s ALA 3 Cb -0.03 -3.08 0.10 0.00 0.00 0.00 0.00 23.12 20.11 1m8b s ALA 3 CO 0.76 -2.55 0.47 1.55 0.00 0.00 0.00 175.76 175.98 1m8b n VAL 4 N 3.56 0.00 -3.49 0.00 3.14 -1.26 -5.03 118.33 115.24 1m8b n VAL 4 Ca 0.04 -0.22 -0.15 0.00 -2.96 0.00 0.00 64.34 61.05 1m8b n VAL 4 Cb 0.65 -0.71 -0.04 0.00 -1.06 0.00 0.00 33.84 32.67 1m8b n VAL 4 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1m8b s SER 5 N -2.10 -0.59 0.30 6.55 1.04 -1.26 -4.71 113.70 112.93 1m8b s SER 5 Ca 0.59 0.44 -0.01 0.00 0.48 0.00 0.00 55.95 57.45 1m8b s SER 5 Cb -0.19 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 1m8b s SER 5 CO 0.65 -0.70 0.51 -0.69 0.98 0.00 0.00 173.24 174.00 1m8b s VAL 6 N -2.06 5.11 -0.42 5.02 1.01 -1.26 -5.05 120.40 122.74 1m8b s VAL 6 Ca -0.06 -0.33 -0.23 0.00 0.00 0.00 0.00 61.98 61.36 1m8b s VAL 6 Cb -0.00 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.59 1m8b s VAL 6 CO 0.01 -0.42 0.80 -0.62 0.00 0.00 0.00 175.10 174.87 1m8b s ASP 7 N -3.64 6.46 0.00 3.32 2.15 -1.26 -4.81 116.67 118.90 1m8b s ASP 7 Ca 0.40 0.06 0.00 0.00 0.43 0.00 0.00 52.55 53.44 1m8b s ASP 7 Cb -0.10 -2.39 0.00 0.00 -0.30 0.00 0.00 42.92 40.12 1m8b s ASP 7 CO 0.33 -0.87 0.58 0.00 -0.17 0.00 0.00 175.17 175.04 1m8b n SER 9 N -0.09 4.71 0.00 0.00 7.64 -1.26 -2.21 113.62 122.41 1m8b n SER 9 Ca 0.00 -2.30 0.00 0.00 1.01 0.00 0.00 58.87 57.58 1m8b n SER 9 Cb 0.06 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 1m8b n SER 9 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1m8b n GLU 10 N 4.14 0.00 -0.94 1.43 0.00 -1.26 -5.15 120.64 118.86 1m8b n GLU 10 Ca 0.42 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 57.25 1m8b n GLU 10 Cb 0.15 0.00 0.03 0.00 0.00 0.00 0.00 31.44 31.62 1m8b n GLU 10 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1m8b n TYR 11 N -1.26 -4.47 -2.50 -1.84 4.02 -0.94 -4.60 117.16 105.56 1m8b n TYR 11 Ca 0.00 0.03 -0.40 0.00 -0.01 0.00 0.00 57.90 57.51 1m8b n TYR 11 Cb 0.00 -1.33 -0.04 0.00 -0.02 0.00 0.00 39.34 37.94 1m8b n TYR 11 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1m8b s PRO 12 N -1.69 4.65 -0.03 -0.72 0.04 -1.26 -5.09 135.00 130.90 1m8b s PRO 12 Ca 0.39 1.76 -0.09 0.00 0.04 0.00 0.00 61.00 63.10 1m8b s PRO 12 Cb -0.20 -3.21 -0.05 0.00 0.04 0.00 0.00 34.50 31.08 1m8b s PRO 12 CO 0.73 0.22 0.28 -1.59 0.04 0.00 0.00 177.00 176.68 1m8b s LYS 13 N -1.25 3.65 -0.80 4.56 -2.85 -1.26 -5.00 119.74 116.78 1m8b s LYS 13 Ca 0.45 0.07 -0.01 0.00 -1.00 0.00 0.00 55.97 55.48 1m8b s LYS 13 Cb -0.31 -3.15 0.36 0.00 -2.06 0.00 0.00 37.83 32.66 1m8b s LYS 13 CO 0.39 0.70 1.92 -0.25 0.10 0.00 0.00 175.35 178.21 1m8b n ASP 14 N 1.60 7.21 -3.65 0.03 9.92 -1.26 -4.87 116.55 125.53 1m8b n ASP 14 Ca -0.15 -3.83 -0.00 0.00 -0.53 0.00 0.00 54.79 50.29 1m8b n ASP 14 Cb 0.53 -1.00 -0.06 0.00 -0.64 0.00 0.00 41.12 39.95 1m8b n ASP 14 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1m8b s ALA 15 N -4.02 -2.46 0.32 2.24 0.00 -1.26 -5.19 121.76 111.40 1m8b s ALA 15 Ca 0.51 1.85 0.04 0.00 0.00 0.00 0.00 51.96 54.36 1m8b s ALA 15 Cb 0.43 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 21.63 1m8b s ALA 15 CO -0.39 -0.22 0.16 0.00 0.00 0.00 0.00 175.76 175.31 1m8b s THR 17 N -3.52 3.19 -0.14 0.00 -4.23 -1.26 -5.03 115.64 104.65 1m8b s THR 17 Ca 0.34 -0.98 0.18 0.00 -1.18 0.00 0.00 61.69 60.05 1m8b s THR 17 Cb 0.04 -3.08 -0.25 0.00 1.34 0.00 0.00 72.50 70.56 1m8b s THR 17 CO 0.18 -0.03 0.31 0.18 -0.54 0.00 0.00 174.62 174.72 1m8b n LEU 18 N -1.83 0.20 -4.69 4.79 4.77 -1.26 -4.96 117.00 114.02 1m8b n LEU 18 Ca 0.07 0.09 -0.33 0.00 -0.03 0.00 0.00 56.01 55.81 1m8b n LEU 18 Cb 0.59 0.31 0.14 0.00 -2.33 0.00 0.00 43.42 42.13 1m8b n LEU 18 CO 0.40 0.34 0.74 -1.83 -1.33 0.00 0.00 177.39 175.71 1m8b s GLU 19 N -2.77 1.40 -0.26 3.23 1.03 -1.26 -4.99 118.70 115.08 1m8b s GLU 19 Ca -0.08 1.69 -0.05 0.00 0.03 0.00 0.00 54.97 56.55 1m8b s GLU 19 Cb 0.08 -1.76 -0.00 0.00 -0.80 0.00 0.00 34.13 31.65 1m8b s GLU 19 CO 0.84 -2.38 0.02 -0.47 -1.33 0.00 0.00 175.26 171.95 1m8b s TYR 20 N -2.32 3.06 -0.37 4.83 5.04 -1.26 -4.91 117.35 121.42 1m8b s TYR 20 Ca 0.71 -0.90 0.01 0.00 -2.44 0.00 0.00 57.07 54.45 1m8b s TYR 20 Cb -0.27 -2.18 0.11 0.00 0.35 0.00 0.00 41.96 39.98 1m8b s TYR 20 CO 0.53 -0.53 0.15 1.03 -1.34 0.00 0.00 175.55 175.39 1m8b s ARG 21 N 1.50 1.03 0.23 4.97 1.81 0.12 -5.03 118.95 123.58 1m8b s ARG 21 Ca 0.04 -1.55 -0.30 0.00 -1.72 0.00 0.00 55.73 52.21 1m8b s ARG 21 Cb -0.16 -2.27 -0.09 0.00 -0.45 0.00 0.00 34.95 31.99 1m8b s ARG 21 CO 0.00 -1.05 1.10 -1.25 -0.68 0.00 0.00 175.30 173.41 1m8b s PRO 22 N 1.01 4.62 -0.03 3.54 0.04 -1.09 -2.95 135.00 140.14 1m8b s PRO 22 Ca 0.13 1.75 -0.21 0.00 0.04 0.00 0.00 61.00 62.72 1m8b s PRO 22 Cb -0.20 -3.24 0.04 0.00 0.04 0.00 0.00 34.50 31.14 1m8b s PRO 22 CO -0.13 0.15 0.45 -0.48 0.04 0.00 0.00 177.00 177.03 1m8b s LEU 23 N -0.87 0.29 -0.01 -3.56 0.05 -0.56 0.18 118.68 114.20 1m8b s LEU 23 Ca 0.47 0.33 -0.02 0.00 0.05 0.00 0.00 54.13 54.96 1m8b s LEU 23 Cb -0.30 1.74 -0.04 0.00 -2.05 0.00 0.00 46.19 45.53 1m8b s LEU 23 CO 0.37 -0.50 0.15 0.00 -0.55 0.00 0.00 176.35 175.83 1m8b n GLY 25 N 1.05 1.56 0.19 0.00 0.00 0.48 -1.39 105.19 107.07 1m8b n GLY 25 Ca -0.12 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 43.87 1m8b n GLY 25 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1m8b h SER 26 N -0.11 0.00 -0.16 1.61 0.87 -0.54 -2.50 113.55 112.72 1m8b h SER 26 Ca -0.28 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 1m8b h SER 26 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1m8b h SER 26 CO 0.37 0.00 0.00 -0.90 -0.53 0.00 0.00 176.83 175.77 1m8b n ASP 27 N -2.75 2.31 -0.66 6.23 5.75 -1.26 -4.91 116.55 121.26 1m8b n ASP 27 Ca 0.03 -1.79 -0.02 0.00 -0.01 0.00 0.00 54.79 53.01 1m8b n ASP 27 Cb 0.41 -0.10 0.01 0.00 -1.03 0.00 0.00 41.12 40.41 1m8b n ASP 27 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1m8b n ASN 28 N 0.76 -2.19 -4.31 -1.12 2.85 -0.94 -5.03 115.26 105.28 1m8b n ASN 28 Ca 0.17 -0.04 -0.37 0.00 -0.11 0.00 0.00 54.58 54.23 1m8b n ASN 28 Cb 0.45 -0.94 -0.13 0.00 1.24 0.00 0.00 39.78 40.41 1m8b n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1m8b s LYS 29 N -4.87 2.89 -0.47 1.20 2.20 -1.26 -4.82 119.74 114.61 1m8b s LYS 29 Ca 0.04 -0.99 -0.23 0.00 -0.36 0.00 0.00 55.97 54.43 1m8b s LYS 29 Cb -0.02 -3.41 0.03 0.00 -1.51 0.00 0.00 37.83 32.93 1m8b s LYS 29 CO 0.05 -0.54 0.81 0.99 -0.36 0.00 0.00 175.35 176.31 1m8b s THR 30 N 1.46 4.61 0.39 3.43 2.01 -1.26 -0.39 115.64 125.89 1m8b s THR 30 Ca 0.01 0.37 0.04 0.00 0.31 0.00 0.00 61.69 62.41 1m8b s THR 30 Cb -0.18 -4.36 -0.01 0.00 0.01 0.00 0.00 72.50 67.96 1m8b s THR 30 CO 0.02 -0.80 0.56 -0.31 -0.69 0.00 0.00 174.62 173.41 1m8b s TYR 31 N 3.39 3.16 -0.07 4.92 2.02 0.13 -4.90 117.35 126.01 1m8b s TYR 31 Ca 0.29 -0.01 0.08 0.00 -0.37 0.00 0.00 57.07 57.06 1m8b s TYR 31 Cb -0.12 -2.15 -0.24 0.00 -0.40 0.00 0.00 41.96 39.05 1m8b s TYR 31 CO 0.22 -0.18 0.56 0.41 -1.57 0.00 0.00 175.55 174.99 1m8b n GLY 32 N -1.85 -0.88 3.33 0.71 0.00 -1.26 -1.50 105.19 103.74 1m8b n GLY 32 Ca 0.01 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.81 1m8b n GLY 32 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m8b s ASN 33 N -6.31 0.07 0.40 1.61 -0.87 -1.15 0.15 114.94 108.84 1m8b s ASN 33 Ca -0.09 -1.19 0.29 0.00 -1.57 0.00 0.00 52.86 50.29 1m8b s ASN 33 Cb 0.08 0.45 1.21 0.00 -0.02 0.00 0.00 41.25 42.96 1m8b s ASN 33 CO 0.81 -0.93 1.85 0.07 -2.57 0.00 0.00 177.10 176.33 1m8b h LYS 34 N 2.51 0.00 0.01 -0.60 -0.00 -1.94 -1.97 116.57 114.58 1m8b h LYS 34 Ca -0.32 0.00 -0.00 0.00 -0.00 0.00 0.00 60.65 60.33 1m8b h LYS 34 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.48 1m8b h LYS 34 CO 0.47 0.00 -0.01 0.00 -0.00 0.00 0.00 179.45 179.92 1m8b h ASN 36 N -0.58 0.47 0.79 0.00 2.35 -1.89 0.40 115.58 117.11 1m8b h ASN 36 Ca -0.00 -0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.57 1m8b h ASN 36 Cb 0.56 -0.12 0.01 0.00 0.05 0.00 0.00 38.32 38.82 1m8b h ASN 36 CO 0.00 0.48 -0.38 0.15 -1.65 0.00 0.00 177.43 176.03 1m8b h PHE 37 N 0.42 -0.98 -0.74 1.19 3.04 -1.39 -1.58 116.94 116.90 1m8b h PHE 37 Ca 0.12 -0.02 0.10 0.00 3.98 0.00 0.00 57.97 62.15 1m8b h PHE 37 Cb 0.14 0.32 -0.05 0.00 2.56 0.00 0.00 35.95 38.92 1m8b h PHE 37 CO -0.01 -0.60 0.49 0.00 -2.02 0.00 0.00 178.31 176.17 1m8b h ASN 39 N 0.63 1.00 1.04 0.00 2.35 0.26 1.12 115.58 121.98 1m8b h ASN 39 Ca 0.34 0.02 -0.19 0.00 -0.55 0.00 0.00 56.30 55.92 1m8b h ASN 39 Cb 0.49 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.64 1m8b h ASN 39 CO -0.12 0.62 -0.99 0.00 -1.65 0.00 0.00 177.43 175.28 1m8b h ALA 40 N 1.48 0.49 0.53 -0.83 0.00 0.39 -2.36 119.26 118.96 1m8b h ALA 40 Ca 0.44 -0.87 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1m8b h ALA 40 Cb 0.24 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1m8b h ALA 40 CO -0.19 1.13 -0.26 0.28 0.00 0.00 0.00 179.25 180.22 1m8b h VAL 41 N 0.00 0.00 -0.44 0.00 2.07 0.17 -0.69 116.25 117.36 1m8b h VAL 41 Ca -0.05 -0.47 0.06 0.00 0.82 0.00 0.00 66.70 67.06 1m8b h VAL 41 Cb 1.70 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1m8b h VAL 41 CO 0.11 0.00 0.29 1.62 0.02 0.00 0.00 177.57 179.61 1m8b h VAL 42 N -1.19 0.97 0.00 2.57 3.04 0.11 1.64 116.25 123.39 1m8b h VAL 42 Ca -0.07 -0.12 -0.09 0.00 -1.01 0.00 0.00 66.70 65.40 1m8b h VAL 42 Cb 0.55 0.58 -0.01 0.00 -2.01 0.00 0.00 31.29 30.39 1m8b h VAL 42 CO 0.12 0.07 -0.42 -0.33 -1.01 0.00 0.00 177.57 176.00 1m8b h GLU 43 N 0.36 0.00 -0.99 4.17 4.39 -1.38 -2.34 114.58 118.79 1m8b h GLU 43 Ca 0.19 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.51 1m8b h GLU 43 Cb 0.29 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 28.71 1m8b h GLU 43 CO -0.04 0.42 0.49 0.45 -1.16 0.00 0.00 179.01 179.16 1m8b n SER 44 N -4.03 3.62 -0.30 1.42 2.88 0.61 -4.80 113.62 113.01 1m8b n SER 44 Ca -0.02 -3.22 -0.04 0.00 -1.33 0.00 0.00 58.87 54.27 1m8b n SER 44 Cb 0.45 -0.76 -0.02 0.00 -0.75 0.00 0.00 64.21 63.13 1m8b n SER 44 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1m8b n ASN 45 N -0.72 -5.01 -0.03 -3.46 5.15 -0.88 -1.35 115.26 108.96 1m8b n ASN 45 Ca 0.45 0.10 -0.00 0.00 -0.60 0.00 0.00 54.58 54.53 1m8b n ASN 45 Cb 1.39 -2.85 -0.00 0.00 -0.53 0.00 0.00 39.78 37.79 1m8b n ASN 45 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1m8b n GLY 46 N -0.46 0.36 0.14 8.20 0.00 0.53 -4.92 105.19 109.03 1m8b n GLY 46 Ca -0.04 -0.88 -0.21 0.00 0.00 0.00 0.00 46.02 44.89 1m8b n GLY 46 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1m8b h THR 47 N 0.00 1.06 -2.74 2.61 1.35 -1.27 -3.45 112.91 110.48 1m8b h THR 47 Ca -0.01 -2.63 -0.56 0.00 -0.55 0.00 0.00 66.41 62.66 1m8b h THR 47 Cb 1.00 2.81 -0.02 0.00 -1.73 0.00 0.00 68.15 70.21 1m8b h THR 47 CO 0.01 0.84 1.01 -0.22 -0.25 0.00 0.00 175.52 176.91 1m8b s LEU 48 N -7.25 4.26 0.11 3.87 1.98 -1.26 -5.00 118.68 115.39 1m8b s LEU 48 Ca -0.13 2.01 0.06 0.00 -2.89 0.00 0.00 54.13 53.19 1m8b s LEU 48 Cb 0.06 -3.54 -0.04 0.00 0.66 0.00 0.00 46.19 43.33 1m8b s LEU 48 CO 0.87 -0.86 -0.03 0.42 -1.89 0.00 0.00 176.35 174.87 1m8b s THR 49 N 3.79 3.79 0.02 3.68 -4.23 -1.26 -4.64 115.64 116.79 1m8b s THR 49 Ca 0.66 -1.14 -0.30 0.00 -1.18 0.00 0.00 61.69 59.73 1m8b s THR 49 Cb -0.29 -2.82 -0.06 0.00 1.34 0.00 0.00 72.50 70.68 1m8b s THR 49 CO 0.23 0.08 1.48 -0.22 -0.54 0.00 0.00 174.62 175.65 1m8b s LEU 50 N -2.39 4.33 -0.15 4.79 0.20 -1.26 0.21 118.68 124.41 1m8b s LEU 50 Ca 0.25 2.22 -0.25 0.00 0.69 0.00 0.00 54.13 57.04 1m8b s LEU 50 Cb -0.11 -3.56 -0.22 0.00 -0.43 0.00 0.00 46.19 41.87 1m8b s LEU 50 CO 0.17 -0.77 0.58 -1.28 -0.29 0.00 0.00 176.35 174.76 1m8b h SER 51 N 8.02 0.00 -5.44 3.68 0.87 -1.40 -3.43 113.55 115.84 1m8b h SER 51 Ca -0.39 -0.80 0.24 0.00 -1.23 0.00 0.00 61.79 59.61 1m8b h SER 51 Cb 1.18 0.00 -0.11 0.00 -0.44 0.00 0.00 62.40 63.04 1m8b h SER 51 CO 0.91 1.04 0.65 -1.38 -0.53 0.00 0.00 176.83 177.53 1m8b s HIS 52 N -2.19 -0.10 0.34 2.24 0.00 -1.00 -4.76 115.29 109.82 1m8b s HIS 52 Ca -0.19 -0.09 -0.05 0.00 -3.00 0.00 0.00 55.06 51.72 1m8b s HIS 52 Cb -0.01 0.59 -0.05 0.00 -4.00 0.00 0.00 32.58 29.11 1m8b s HIS 52 CO 0.60 -0.54 0.61 -0.06 -1.00 0.00 0.00 174.74 174.36 1m8b s PHE 53 N -2.86 3.49 0.00 0.38 0.08 -1.26 -1.21 117.98 116.60 1m8b s PHE 53 Ca 0.13 0.69 0.00 0.00 0.12 0.00 0.00 56.93 57.87 1m8b s PHE 53 Cb 0.01 -2.16 0.00 0.00 -0.57 0.00 0.00 43.02 40.31 1m8b s PHE 53 CO -0.01 0.07 0.00 0.41 -0.10 0.00 0.00 175.22 175.59 1m8b n GLY 54 N -1.25 -2.08 3.44 4.36 0.00 0.48 -4.76 105.19 105.38 1m8b n GLY 54 Ca -0.01 -1.35 -0.50 0.00 0.00 0.00 0.00 46.02 44.17 1m8b n GLY 54 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1m8b n LYS 55 N -0.92 0.12 0.00 1.61 4.76 -1.25 -3.66 118.16 118.82 1m8b n LYS 55 Ca 0.00 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1m8b n LYS 55 Cb 0.00 -1.17 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 1m8b n LYS 55 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03