#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jyt s PRO 2 N 0.00 0.33 1.86 1.45 0.04 -1.26 -4.87 135.00 132.55 2jyt s PRO 2 Ca 0.00 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.56 2jyt s PRO 2 Cb 0.00 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.81 2jyt s PRO 2 CO 0.00 -2.80 0.00 0.00 0.04 0.00 0.00 177.00 174.24 2jyt n ASP 4 N -3.08 -7.34 0.00 0.00 9.92 -1.26 -4.98 116.55 109.81 2jyt n ASP 4 Ca 0.00 1.14 0.00 0.00 -0.53 0.00 0.00 54.79 55.40 2jyt n ASP 4 Cb 0.00 -3.24 0.00 0.00 -0.64 0.00 0.00 41.12 37.24 2jyt n ASP 4 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2jyt n ASN 5 N -4.08 0.00 0.00 -2.24 2.85 -1.26 -4.94 115.26 105.59 2jyt n ASN 5 Ca 0.01 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.48 2jyt n ASN 5 Cb 0.48 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.50 2jyt n ASN 5 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2jyt n VAL 6 N -0.21 0.00 -4.04 3.44 0.24 -1.26 -5.05 118.33 111.45 2jyt n VAL 6 Ca 0.00 -0.50 -0.26 0.00 -2.04 0.00 0.00 64.34 61.54 2jyt n VAL 6 Cb 0.00 1.00 -0.04 0.00 -1.47 0.00 0.00 33.84 33.33 2jyt n VAL 6 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2jyt s SER 7 N -0.77 4.55 -0.28 -1.34 1.04 -1.26 -5.05 113.70 110.60 2jyt s SER 7 Ca 0.00 -1.19 -0.01 0.00 0.48 0.00 0.00 55.95 55.23 2jyt s SER 7 Cb 0.00 0.04 0.13 0.00 0.10 0.00 0.00 66.02 66.29 2jyt s SER 7 CO 0.00 -0.85 0.28 -0.44 0.98 0.00 0.00 173.24 173.21 2jyt s SER 8 N -4.10 1.76 0.30 7.02 0.01 -1.26 -4.98 113.70 112.46 2jyt s SER 8 Ca 0.34 -0.72 0.10 0.00 1.31 0.00 0.00 55.95 56.98 2jyt s SER 8 Cb 0.00 0.44 -0.05 0.00 0.21 0.00 0.00 66.02 66.62 2jyt s SER 8 CO 0.20 -0.39 -0.04 0.00 0.41 0.00 0.00 173.24 173.43 2jyt n PRO 10 N -0.86 -0.38 0.11 0.00 -0.04 -1.26 -4.78 135.00 127.78 2jyt n PRO 10 Ca -0.05 -1.14 -0.11 0.00 -0.04 0.00 0.00 63.50 62.16 2jyt n PRO 10 Cb 0.61 -0.58 -0.07 0.00 -0.04 0.00 0.00 33.50 33.42 2jyt n PRO 10 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2jyt h SER 11 N -0.71 -1.02 -0.21 3.54 0.02 -2.00 -3.32 113.55 109.85 2jyt h SER 11 Ca -0.20 0.10 -0.10 0.00 -0.84 0.00 0.00 61.79 60.75 2jyt h SER 11 Cb 0.60 0.37 -0.01 0.00 0.14 0.00 0.00 62.40 63.50 2jyt h SER 11 CO 0.16 -0.39 0.31 -0.94 -1.14 0.00 0.00 176.83 174.83 2jyt s SER 12 N -3.83 3.82 0.00 3.07 1.04 -1.26 -4.73 113.70 111.81 2jyt s SER 12 Ca -0.11 -1.12 0.00 0.00 0.48 0.00 0.00 55.95 55.19 2jyt s SER 12 Cb 0.04 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.56 2jyt s SER 12 CO 0.40 -4.35 0.00 -0.90 0.98 0.00 0.00 173.24 169.37 2jyt n ASP 13 N 18.40 0.00 -4.22 7.02 5.68 -1.25 -4.69 116.55 137.50 2jyt n ASP 13 Ca 0.42 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 54.57 2jyt n ASP 13 Cb 0.47 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.34 2jyt n ASP 13 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2jyt s THR 14 N -2.00 1.04 -0.47 2.12 -1.32 0.19 -4.84 115.64 110.36 2jyt s THR 14 Ca 0.00 -1.91 -0.26 0.00 -1.21 0.00 0.00 61.69 58.31 2jyt s THR 14 Cb 0.00 -1.67 0.03 0.00 -1.51 0.00 0.00 72.50 69.35 2jyt s THR 14 CO 0.00 -0.70 0.98 0.00 -2.21 0.00 0.00 174.62 172.69 2jyt s GLN 17 N 0.01 4.48 0.00 0.00 0.74 -1.26 -1.22 119.66 122.41 2jyt s GLN 17 Ca 0.15 1.85 0.00 0.00 0.05 0.00 0.00 55.36 57.41 2jyt s GLN 17 Cb -0.24 -3.27 0.00 0.00 1.10 0.00 0.00 33.01 30.60 2jyt s GLN 17 CO -0.02 -0.12 0.00 1.28 -0.55 0.00 0.00 175.29 175.87 2jyt n LEU 18 N 2.85 0.00 0.07 3.68 4.77 -0.89 -4.95 117.00 122.54 2jyt n LEU 18 Ca 0.05 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.15 2jyt n LEU 18 Cb 0.45 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 2jyt n LEU 18 CO 0.56 -0.24 -0.02 0.35 -1.33 0.00 0.00 177.39 176.71 2jyt n THR 19 N -0.67 0.43 0.13 -5.08 -2.24 -1.26 -3.96 114.28 101.64 2jyt n THR 19 Ca 0.00 -0.44 0.01 0.00 -2.27 0.00 0.00 64.05 61.34 2jyt n THR 19 Cb 0.00 -0.17 0.10 0.00 -2.10 0.00 0.00 70.33 68.16 2jyt n THR 19 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2jyt h SER 20 N 0.00 0.00 0.00 3.42 0.02 -2.03 -3.47 113.55 111.49 2jyt h SER 20 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jyt h SER 20 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2jyt h SER 20 CO 0.00 0.59 0.00 0.61 -1.14 0.00 0.00 176.83 176.89 2jyt n GLY 21 N 0.85 1.81 3.31 -3.77 0.00 -1.25 -5.12 105.19 101.02 2jyt n GLY 21 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2jyt n GLY 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jyt s GLU 22 N -0.27 2.80 -0.39 1.61 2.02 -1.26 -4.96 118.70 118.24 2jyt s GLU 22 Ca 0.00 -0.82 -0.25 0.00 0.02 0.00 0.00 54.97 53.91 2jyt s GLU 22 Cb 0.00 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.93 2jyt s GLU 22 CO 0.00 0.35 0.90 -1.58 0.02 0.00 0.00 175.26 174.95 2jyt s TRP 23 N -0.06 3.04 0.47 1.61 0.52 -1.26 -2.09 118.94 121.17 2jyt s TRP 23 Ca -0.05 0.63 -0.01 0.00 0.02 0.00 0.00 56.10 56.69 2jyt s TRP 23 Cb -0.14 -3.69 -0.01 0.00 -1.15 0.00 0.00 33.47 28.48 2jyt s TRP 23 CO 0.04 -0.88 0.72 0.20 0.02 0.00 0.00 176.95 177.05 2jyt s GLY 24 N 1.98 1.55 -0.43 0.98 0.00 -0.36 -4.72 107.32 106.31 2jyt s GLY 24 Ca 0.37 -0.92 -0.07 0.00 0.00 0.00 0.00 44.72 44.10 2jyt s GLY 24 CO 0.20 -0.74 0.27 0.00 0.00 0.00 0.00 173.10 172.83 2jyt n PRO 27 N 0.46 -0.61 -4.22 0.00 -0.02 -1.26 0.56 135.00 129.91 2jyt n PRO 27 Ca -0.06 -0.14 -0.13 0.00 -2.02 0.00 0.00 63.50 61.15 2jyt n PRO 27 Cb 0.52 -1.81 -0.10 0.00 -0.02 0.00 0.00 33.50 32.09 2jyt n PRO 27 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2jyt s ILE 28 N -2.35 0.05 -1.11 4.25 -4.36 -1.26 -4.44 121.20 111.98 2jyt s ILE 28 Ca 0.56 -2.00 -0.21 0.00 -0.26 0.00 0.00 60.65 58.74 2jyt s ILE 28 Cb -0.19 -2.51 0.06 0.00 1.25 0.00 0.00 42.46 41.07 2jyt s ILE 28 CO 0.67 0.00 1.53 -2.84 0.24 0.00 0.00 174.94 174.55 2jyt s PRO 29 N -4.06 3.73 4.99 0.37 0.02 -1.26 -4.84 135.00 133.94 2jyt s PRO 29 Ca 0.39 -1.44 0.00 0.00 0.02 0.00 0.00 61.00 59.97 2jyt s PRO 29 Cb 0.06 -5.40 0.00 0.00 0.02 0.00 0.00 34.50 29.18 2jyt s PRO 29 CO 0.14 -2.21 0.00 -1.91 -0.33 0.00 0.00 177.00 172.69 2jyt n GLU 30 N 8.62 0.00 -3.32 5.54 4.07 -1.26 -4.83 120.64 129.47 2jyt n GLU 30 Ca 0.38 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.48 2jyt n GLU 30 Cb 0.49 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.87 2jyt n GLU 30 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2jyt n ALA 31 N 9.28 0.00 -3.63 4.31 0.00 -1.26 -4.71 120.51 124.50 2jyt n ALA 31 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 2jyt n ALA 31 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 2jyt n ALA 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jyt s VAL 32 N -2.51 4.09 0.36 0.00 0.11 -1.26 -5.06 120.40 116.13 2jyt s VAL 32 Ca 0.00 -2.55 0.05 0.00 -2.93 0.00 0.00 61.98 56.56 2jyt s VAL 32 Cb 0.00 -3.65 -0.07 0.00 -1.53 0.00 0.00 36.38 31.13 2jyt s VAL 32 CO 0.00 -0.86 0.04 0.00 -3.33 0.00 0.00 175.10 170.94 2jyt s SER 35 N -3.37 5.43 0.00 0.00 1.04 -1.26 -4.80 113.70 110.74 2jyt s SER 35 Ca 0.27 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.50 2jyt s SER 35 Cb 0.02 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2jyt s SER 35 CO 0.09 -2.55 0.00 -0.67 0.98 0.00 0.00 173.24 171.09 2jyt n ASP 36 N 12.97 0.00 0.00 7.02 2.03 -1.26 -5.19 116.55 132.12 2jyt n ASP 36 Ca 0.41 -0.45 0.00 0.00 0.52 0.00 0.00 54.79 55.27 2jyt n ASP 36 Cb 0.47 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.87 2jyt n ASP 36 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2jyt n HIS 37 N 0.00 0.00 0.00 -0.67 -0.00 -1.26 -4.91 115.22 108.38 2jyt n HIS 37 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2jyt n HIS 37 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2jyt n HIS 37 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2jyt n GLN 38 N 0.00 0.00 -1.40 1.57 6.02 -1.26 -4.77 117.38 117.54 2jyt n GLN 38 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.98 2jyt n GLN 38 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2jyt n GLN 38 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 2jyt n HIS 39 N 0.00 -0.81 -2.36 1.08 -0.00 -1.26 -5.19 115.22 106.68 2jyt n HIS 39 Ca 0.00 -0.11 0.00 0.00 0.46 0.00 0.00 57.72 58.07 2jyt n HIS 39 Cb 0.00 0.04 0.00 0.00 -0.12 0.00 0.00 29.99 29.91 2jyt n HIS 39 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2jyt n PRO 42 N 2.48 -2.29 -1.71 0.00 -0.02 -1.26 -4.38 135.00 127.82 2jyt n PRO 42 Ca -0.16 -0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 60.25 2jyt n PRO 42 Cb 0.51 -1.98 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 2jyt n PRO 42 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2jyt n GLN 43 N -3.92 2.79 -0.04 -0.52 0.00 -1.26 -1.76 117.38 112.67 2jyt n GLN 43 Ca 0.01 1.01 0.00 0.00 -0.00 0.00 0.00 57.00 58.02 2jyt n GLN 43 Cb 0.57 -2.87 0.00 0.00 0.00 0.00 0.00 30.24 27.94 2jyt n GLN 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jyt n GLY 44 N 4.05 0.43 3.74 1.69 0.00 -1.26 -4.81 105.19 109.03 2jyt n GLY 44 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2jyt n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jyt s TYR 45 N -2.09 2.70 0.28 1.61 1.51 -0.72 -4.66 117.35 115.97 2jyt s TYR 45 Ca 0.00 -0.41 -0.05 0.00 -1.01 0.00 0.00 57.07 55.60 2jyt s TYR 45 Cb 0.00 -1.71 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 2jyt s TYR 45 CO 0.00 0.29 0.38 -0.08 -1.11 0.00 0.00 175.55 175.03 2jyt s THR 46 N -2.45 0.00 0.21 -0.71 -1.32 0.11 -4.87 115.64 106.62 2jyt s THR 46 Ca 0.39 -1.67 -0.02 0.00 -1.21 0.00 0.00 61.69 59.17 2jyt s THR 46 Cb -0.02 -2.46 -0.05 0.00 -1.51 0.00 0.00 72.50 68.47 2jyt s THR 46 CO 0.23 0.00 0.42 0.00 -2.21 0.00 0.00 174.62 173.06 2jyt n VAL 48 N -0.60 0.00 -0.27 0.00 0.24 -1.26 -4.90 118.33 111.55 2jyt n VAL 48 Ca -0.04 -1.10 0.08 0.00 -2.04 0.00 0.00 64.34 61.25 2jyt n VAL 48 Cb 0.53 0.46 0.22 0.00 -1.47 0.00 0.00 33.84 33.58 2jyt n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jyt h ALA 49 N 1.38 1.06 -2.38 2.33 0.00 -1.99 -3.41 119.26 116.25 2jyt h ALA 49 Ca -0.13 0.20 -0.50 0.00 0.00 0.00 0.00 54.91 54.48 2jyt h ALA 49 Cb 0.55 0.28 0.10 0.00 0.00 0.00 0.00 17.79 18.72 2jyt h ALA 49 CO 0.20 -0.39 0.36 -1.21 0.00 0.00 0.00 179.25 178.21 2jyt s GLU 50 N -6.01 2.58 -0.01 0.00 0.41 -1.26 -4.92 118.70 109.50 2jyt s GLU 50 Ca -0.13 0.79 0.00 0.00 -0.41 0.00 0.00 54.97 55.22 2jyt s GLU 50 Cb 0.23 -1.96 0.01 0.00 -1.78 0.00 0.00 34.13 30.63 2jyt s GLU 50 CO 0.76 -1.31 0.83 0.41 -0.49 0.00 0.00 175.26 175.46 2jyt n GLY 51 N -2.11 1.84 3.42 -1.39 0.00 -1.26 -4.82 105.19 100.86 2jyt n GLY 51 Ca 0.07 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 2jyt n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jyt n GLN 52 N 0.30 0.76 -4.57 1.61 0.00 -1.26 -5.01 117.38 109.22 2jyt n GLN 52 Ca 0.01 -3.10 -0.33 0.00 0.00 0.00 0.00 57.00 53.57 2jyt n GLN 52 Cb 0.42 0.36 -0.15 0.00 0.00 0.00 0.00 30.24 30.87 2jyt n GLN 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jyt n GLN 54 N 3.92 1.05 0.00 0.00 7.27 -0.07 -4.93 117.38 124.62 2jyt n GLN 54 Ca -0.19 -2.07 0.16 0.00 0.07 0.00 0.00 57.00 54.98 2jyt n GLN 54 Cb 0.52 0.27 0.91 0.00 2.41 0.00 0.00 30.24 34.35 2jyt n GLN 54 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76