#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h1z s SER 2 N 0.00 -0.19 0.22 1.61 0.01 -1.26 -5.17 113.70 108.92 2h1z s SER 2 Ca 0.00 0.26 -0.14 0.00 1.31 0.00 0.00 55.95 57.38 2h1z s SER 2 Cb 0.00 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.64 2h1z s SER 2 CO 0.00 -0.24 0.47 0.00 0.41 0.00 0.00 173.24 173.88 2h1z s VAL 4 N -3.97 5.06 0.28 0.00 1.01 0.15 -4.77 120.40 118.16 2h1z s VAL 4 Ca 0.18 1.18 -0.29 0.00 0.00 0.00 0.00 61.98 63.05 2h1z s VAL 4 Cb -0.00 -3.91 -0.10 0.00 0.00 0.00 0.00 36.38 32.36 2h1z s VAL 4 CO 0.05 0.34 1.36 -2.84 0.00 0.00 0.00 175.10 174.01 2h1z s PRO 5 N 0.40 4.32 0.62 2.72 0.02 -1.26 0.10 135.00 141.93 2h1z s PRO 5 Ca 0.31 2.23 -0.18 0.00 0.02 0.00 0.00 61.00 63.37 2h1z s PRO 5 Cb -0.17 -3.11 -0.03 0.00 0.02 0.00 0.00 34.50 31.22 2h1z s PRO 5 CO 0.15 -0.30 1.19 0.28 -0.33 0.00 0.00 177.00 177.99 2h1z n VAL 6 N 1.73 4.45 -0.94 3.83 0.31 -1.26 -1.46 118.33 125.00 2h1z n VAL 6 Ca 0.04 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 2h1z n VAL 6 Cb 0.41 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 2h1z n VAL 6 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2h1z n ASP 7 N -1.45 -2.52 -4.53 4.52 8.00 0.15 -4.96 116.55 115.77 2h1z n ASP 7 Ca 0.15 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.38 2h1z n ASP 7 Cb 0.47 -1.27 -0.10 0.00 -0.02 0.00 0.00 41.12 40.21 2h1z n ASP 7 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2h1z s GLN 8 N -0.55 1.91 0.38 -1.24 -1.52 -0.53 -4.84 119.66 113.27 2h1z s GLN 8 Ca 0.00 -1.38 -0.27 0.00 -1.95 0.00 0.00 55.36 51.76 2h1z s GLN 8 Cb 0.00 -2.05 -0.09 0.00 -0.22 0.00 0.00 33.01 30.64 2h1z s GLN 8 CO 0.00 0.41 1.32 -1.25 -0.25 0.00 0.00 175.29 175.52 2h1z s PRO 9 N -2.90 4.11 0.35 2.91 0.04 -1.26 -0.52 135.00 137.73 2h1z s PRO 9 Ca 0.25 2.21 0.03 0.00 0.04 0.00 0.00 61.00 63.52 2h1z s PRO 9 Cb -0.08 -2.88 -0.01 0.00 0.04 0.00 0.00 34.50 31.57 2h1z s PRO 9 CO 0.14 -0.39 0.10 0.00 0.04 0.00 0.00 177.00 176.89 2h1z s SER 11 N -3.13 0.47 0.27 0.00 0.15 -1.26 -4.39 113.70 105.80 2h1z s SER 11 Ca 0.14 -0.96 0.26 0.00 0.70 0.00 0.00 55.95 56.09 2h1z s SER 11 Cb 0.01 0.20 0.79 0.00 -1.71 0.00 0.00 66.02 65.31 2h1z s SER 11 CO 0.10 -0.59 1.75 0.17 1.20 0.00 0.00 173.24 175.88 2h1z h LEU 12 N 3.22 0.00 -2.89 3.45 8.10 -1.98 -3.16 115.31 122.05 2h1z h LEU 12 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.65 2h1z h LEU 12 Cb 1.15 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.37 2h1z h LEU 12 CO 0.64 0.00 0.00 -0.46 -4.11 0.00 0.00 178.44 174.51 2h1z n ASN 13 N -2.42 3.05 -3.78 0.17 6.94 -1.26 -5.01 115.26 112.95 2h1z n ASN 13 Ca 0.05 -2.05 -0.17 0.00 -0.02 0.00 0.00 54.58 52.39 2h1z n ASN 13 Cb 0.41 -0.27 -0.00 0.00 -2.36 0.00 0.00 39.78 37.56 2h1z n ASN 13 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2h1z n THR 14 N 0.56 0.00 -1.57 5.53 -2.24 -1.19 -5.11 114.28 110.24 2h1z n THR 14 Ca 0.13 -1.38 -0.33 0.00 -2.27 0.00 0.00 64.05 60.20 2h1z n THR 14 Cb 0.46 -0.17 0.07 0.00 -2.10 0.00 0.00 70.33 68.59 2h1z n THR 14 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2h1z s GLN 15 N -3.40 2.50 1.10 -0.78 -1.52 -1.26 -4.90 119.66 111.40 2h1z s GLN 15 Ca 0.18 1.46 -0.18 0.00 -1.95 0.00 0.00 55.36 54.87 2h1z s GLN 15 Cb -0.01 -1.91 0.28 0.00 -0.22 0.00 0.00 33.01 31.15 2h1z s GLN 15 CO 0.12 -1.50 0.74 -0.35 -0.25 0.00 0.00 175.29 174.05 2h1z n PRO 16 N -2.70 -3.82 -2.29 2.91 -0.04 -1.26 -4.42 135.00 123.38 2h1z n PRO 16 Ca 0.11 -1.22 -0.26 0.00 -0.04 0.00 0.00 63.50 62.09 2h1z n PRO 16 Cb 0.52 -1.43 0.13 0.00 -0.04 0.00 0.00 33.50 32.67 2h1z n PRO 16 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h1z n ASP 19 N -1.54 -4.67 -2.55 0.00 8.00 -1.26 -0.74 116.55 113.79 2h1z n ASP 19 Ca 0.01 0.04 -0.18 0.00 0.71 0.00 0.00 54.79 55.37 2h1z n ASP 19 Cb 0.60 -3.91 0.04 0.00 -0.02 0.00 0.00 41.12 37.82 2h1z n ASP 19 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2h1z n ASP 20 N -1.98 -5.20 -4.41 -2.24 9.92 -1.26 -4.87 116.55 106.51 2h1z n ASP 20 Ca -0.16 -0.29 -0.29 0.00 -0.53 0.00 0.00 54.79 53.53 2h1z n ASP 20 Cb 0.63 -3.97 0.15 0.00 -0.64 0.00 0.00 41.12 37.29 2h1z n ASP 20 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2h1z s ALA 21 N -3.10 2.53 0.00 2.24 0.00 0.08 -4.81 121.76 118.70 2h1z s ALA 21 Ca 0.31 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 51.17 2h1z s ALA 21 Cb -0.14 -2.73 -0.00 0.00 0.00 0.00 0.00 23.12 20.25 2h1z s ALA 21 CO 0.38 -2.09 -0.03 0.99 0.00 0.00 0.00 175.76 175.00 2h1z s THR 22 N -3.70 0.26 -0.41 0.00 2.01 0.00 -4.33 115.64 109.47 2h1z s THR 22 Ca 0.70 -0.20 -0.29 0.00 0.31 0.00 0.00 61.69 62.21 2h1z s THR 22 Cb -0.06 -0.23 0.02 0.00 0.01 0.00 0.00 72.50 72.24 2h1z s THR 22 CO 0.51 0.04 1.17 0.00 -0.69 0.00 0.00 174.62 175.64 2h1z s THR 24 N 4.32 2.22 0.05 0.00 2.01 0.15 -4.88 115.64 119.51 2h1z s THR 24 Ca 0.50 -2.12 -0.30 0.00 0.31 0.00 0.00 61.69 60.07 2h1z s THR 24 Cb -0.10 -2.10 -0.05 0.00 0.01 0.00 0.00 72.50 70.25 2h1z s THR 24 CO 0.26 -0.27 1.14 -1.58 -0.69 0.00 0.00 174.62 173.48 2h1z s GLN 25 N -3.00 4.47 0.27 4.92 0.74 -1.26 0.07 119.66 125.88 2h1z s GLN 25 Ca 0.22 1.68 0.03 0.00 0.05 0.00 0.00 55.36 57.34 2h1z s GLN 25 Cb -0.06 -3.37 -0.01 0.00 1.10 0.00 0.00 33.01 30.67 2h1z s GLN 25 CO 0.10 -0.19 0.30 0.39 -0.55 0.00 0.00 175.29 175.34 2h1z n GLU 26 N 3.87 0.44 -5.00 1.67 1.02 0.18 -4.91 120.64 117.91 2h1z n GLU 26 Ca 0.08 -2.48 -0.32 0.00 -0.02 0.00 0.00 57.16 54.42 2h1z n GLU 26 Cb 0.48 2.18 -0.14 0.00 -0.02 0.00 0.00 31.44 33.94 2h1z n GLU 26 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2h1z s ARG 27 N -2.88 2.38 0.34 3.49 0.52 -1.26 -0.49 118.95 121.05 2h1z s ARG 27 Ca 0.28 -0.77 0.04 0.00 -0.52 0.00 0.00 55.73 54.76 2h1z s ARG 27 Cb 0.00 -2.28 0.06 0.00 0.52 0.00 0.00 34.95 33.26 2h1z s ARG 27 CO 0.20 0.60 0.46 0.27 0.02 0.00 0.00 175.30 176.86 2h1z n ASN 28 N 2.32 1.05 0.14 0.23 6.94 -1.17 -4.95 115.26 119.82 2h1z n ASN 28 Ca -0.17 -1.78 0.02 0.00 -0.02 0.00 0.00 54.58 52.63 2h1z n ASN 28 Cb 0.52 -0.26 0.38 0.00 -2.36 0.00 0.00 39.78 38.06 2h1z n ASN 28 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2h1z h GLU 29 N 0.00 0.16 0.00 -3.83 4.22 -2.01 -2.37 114.58 110.75 2h1z h GLU 29 Ca -0.16 -0.04 -0.13 0.00 0.08 0.00 0.00 59.36 59.11 2h1z h GLU 29 Cb 0.68 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2h1z h GLU 29 CO 0.21 0.37 -0.62 -0.91 -2.18 0.00 0.00 179.01 175.88 2h1z h ASN 30 N 0.15 0.00 0.00 1.04 4.21 -2.04 -3.47 115.58 115.47 2h1z h ASN 30 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 2h1z h ASN 30 Cb 0.47 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.67 2h1z h ASN 30 CO 0.03 0.62 0.00 0.61 -1.29 0.00 0.00 177.43 177.40 2h1z n GLY 31 N 0.36 0.84 3.89 2.83 0.00 -0.89 -5.10 105.19 107.11 2h1z n GLY 31 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2h1z n GLY 31 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2h1z s HIS 32 N -2.00 3.45 0.16 1.61 4.02 -1.26 -4.80 115.29 116.47 2h1z s HIS 32 Ca 0.00 0.78 -0.31 0.00 1.02 0.00 0.00 55.06 56.55 2h1z s HIS 32 Cb 0.00 -2.20 -0.09 0.00 -1.02 0.00 0.00 32.58 29.28 2h1z s HIS 32 CO 0.00 0.21 1.41 0.99 1.02 0.00 0.00 174.74 178.37 2h1z s THR 33 N -1.96 3.10 0.26 1.30 2.01 -1.26 -3.03 115.64 116.05 2h1z s THR 33 Ca 0.46 0.82 0.02 0.00 0.31 0.00 0.00 61.69 63.30 2h1z s THR 33 Cb -0.11 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 2h1z s THR 33 CO 0.26 0.08 0.15 0.68 -0.69 0.00 0.00 174.62 175.10 2h1z s VAL 34 N 0.78 0.19 -0.16 3.82 -7.23 0.36 -4.97 120.40 113.20 2h1z s VAL 34 Ca 0.63 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.81 2h1z s VAL 34 Cb -0.38 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.03 2h1z s VAL 34 CO 0.33 0.00 -0.17 -0.31 -0.31 0.00 0.00 175.10 174.64 2h1z s TYR 35 N -3.83 2.76 0.32 2.82 2.02 -1.26 0.51 117.35 120.69 2h1z s TYR 35 Ca 0.38 -1.19 0.07 0.00 -0.37 0.00 0.00 57.07 55.96 2h1z s TYR 35 Cb 0.06 -1.88 -0.06 0.00 -0.40 0.00 0.00 41.96 39.67 2h1z s TYR 35 CO 0.16 -0.55 -0.04 0.71 -1.57 0.00 0.00 175.55 174.26 2h1z s TYR 36 N 0.90 2.11 -0.17 2.71 1.51 0.11 0.31 117.35 124.83 2h1z s TYR 36 Ca -0.04 -0.70 -0.08 0.00 -1.01 0.00 0.00 57.07 55.23 2h1z s TYR 36 Cb -0.15 -1.28 -0.04 0.00 -0.11 0.00 0.00 41.96 40.38 2h1z s TYR 36 CO -0.02 0.31 0.12 0.00 -1.11 0.00 0.00 175.55 174.85 2h1z s ARG 38 N -0.18 1.32 0.00 0.00 1.81 -0.58 0.32 118.95 121.65 2h1z s ARG 38 Ca 0.10 -0.26 0.18 0.00 -1.72 0.00 0.00 55.73 54.03 2h1z s ARG 38 Cb -0.11 -1.21 1.08 0.00 -0.45 0.00 0.00 34.95 34.25 2h1z s ARG 38 CO 0.00 -0.06 1.48 0.00 -0.68 0.00 0.00 175.30 176.04