#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zrp s LYS 2 N 0.00 2.88 0.44 0.00 -2.85 -1.26 -1.92 119.74 117.03 1zrp s LYS 2 Ca 0.00 -0.64 0.06 0.00 -1.00 0.00 0.00 55.97 54.40 1zrp s LYS 2 Cb 0.00 -2.54 -0.04 0.00 -2.06 0.00 0.00 37.83 33.19 1zrp s LYS 2 CO 0.00 0.50 0.17 -1.58 0.10 0.00 0.00 175.35 174.54 1zrp s TRP 3 N -0.40 2.43 0.03 1.78 0.52 0.19 -1.78 118.94 121.72 1zrp s TRP 3 Ca 0.05 -0.66 -0.06 0.00 0.02 0.00 0.00 56.10 55.45 1zrp s TRP 3 Cb -0.12 -1.91 -0.01 0.00 -1.15 0.00 0.00 33.47 30.28 1zrp s TRP 3 CO 0.02 0.15 0.11 0.54 0.02 0.00 0.00 176.95 177.79 1zrp s VAL 4 N -2.66 0.12 -0.30 4.03 0.11 0.35 -0.07 120.40 121.99 1zrp s VAL 4 Ca 0.36 -1.01 -0.24 0.00 -2.93 0.00 0.00 61.98 58.16 1zrp s VAL 4 Cb 0.04 -0.81 0.00 0.00 -1.53 0.00 0.00 36.38 34.08 1zrp s VAL 4 CO 0.20 -0.56 0.83 0.00 -3.33 0.00 0.00 175.10 172.25 1zrp n LYS 6 N 6.28 2.24 0.00 0.00 2.85 -0.90 -1.59 118.16 127.04 1zrp n LYS 6 Ca 0.05 -1.20 0.00 0.00 -1.05 0.00 0.00 58.31 56.11 1zrp n LYS 6 Cb 0.48 -1.59 0.00 0.00 -0.65 0.00 0.00 35.03 33.27 1zrp n LYS 6 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1zrp n ILE 7 N 0.30 0.00 0.06 0.58 -0.00 -1.26 -4.89 119.36 114.16 1zrp n ILE 7 Ca 0.11 0.05 -0.09 0.00 -0.00 0.00 0.00 62.75 62.81 1zrp n ILE 7 Cb 0.49 -1.04 -0.13 0.00 -0.00 0.00 0.00 39.64 38.96 1zrp n ILE 7 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1zrp n GLY 9 N 1.42 1.39 3.82 0.00 0.00 -0.62 -5.08 105.19 106.12 1zrp n GLY 9 Ca -0.04 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 1zrp n GLY 9 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1zrp s TYR 10 N -2.00 2.62 -0.01 1.61 5.04 -1.26 -4.82 117.35 118.53 1zrp s TYR 10 Ca 0.00 0.81 -0.05 0.00 -2.44 0.00 0.00 57.07 55.39 1zrp s TYR 10 Cb 0.00 -3.44 0.00 0.00 0.35 0.00 0.00 41.96 38.87 1zrp s TYR 10 CO 0.00 -2.20 0.10 0.42 -1.34 0.00 0.00 175.55 172.53 1zrp s ILE 11 N -3.38 0.06 -0.07 3.14 1.09 -1.26 0.58 121.20 121.36 1zrp s ILE 11 Ca 0.63 -0.49 0.01 0.00 -1.10 0.00 0.00 60.65 59.71 1zrp s ILE 11 Cb -0.13 -0.30 -0.03 0.00 -1.06 0.00 0.00 42.46 40.93 1zrp s ILE 11 CO 0.52 -0.27 -0.08 -0.47 -0.10 0.00 0.00 174.94 174.54 1zrp s TYR 12 N -0.89 2.89 -0.26 3.97 5.04 0.90 -4.95 117.35 124.06 1zrp s TYR 12 Ca -0.10 -0.05 0.01 0.00 -2.44 0.00 0.00 57.07 54.49 1zrp s TYR 12 Cb -0.06 -1.71 0.07 0.00 0.35 0.00 0.00 41.96 40.61 1zrp s TYR 12 CO 0.01 0.26 -0.02 0.34 -1.34 0.00 0.00 175.55 174.80 1zrp s ASP 13 N -0.69 4.09 0.62 4.32 2.15 -1.26 0.58 116.67 126.47 1zrp s ASP 13 Ca 0.10 -1.42 0.41 0.00 0.43 0.00 0.00 52.55 52.08 1zrp s ASP 13 Cb -0.11 -1.25 2.20 0.00 -0.30 0.00 0.00 42.92 43.45 1zrp s ASP 13 CO 0.01 -0.28 2.27 -0.33 -0.17 0.00 0.00 175.17 176.67 1zrp h GLU 14 N 7.89 0.00 0.00 4.34 5.08 -1.67 0.11 114.58 130.33 1zrp h GLU 14 Ca -0.15 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 1zrp h GLU 14 Cb 1.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1zrp h GLU 14 CO 0.44 0.00 -0.60 0.22 -1.00 0.00 0.00 179.01 178.07 1zrp h ASP 15 N 0.00 0.00 0.00 1.42 3.58 -1.88 -1.83 116.42 117.71 1zrp h ASP 15 Ca 0.00 0.00 -0.23 0.00 0.42 0.00 0.00 57.03 57.22 1zrp h ASP 15 Cb 0.07 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.08 1zrp h ASP 15 CO 0.00 0.15 -2.19 0.00 -2.88 0.00 0.00 179.24 174.32 1zrp n ALA 16 N -2.18 1.96 0.00 -0.78 0.00 -0.56 -4.53 120.51 114.42 1zrp n ALA 16 Ca 0.01 -1.00 0.00 0.00 0.00 0.00 0.00 53.44 52.45 1zrp n ALA 16 Cb 0.61 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.70 1zrp n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zrp n GLY 17 N 1.64 -2.74 2.38 0.00 0.00 -0.08 -4.23 105.19 102.15 1zrp n GLY 17 Ca -0.22 -1.73 -0.19 0.00 0.00 0.00 0.00 46.02 43.88 1zrp n GLY 17 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zrp n ASP 18 N -0.24 1.65 0.20 1.61 2.03 -0.83 -4.53 116.55 116.44 1zrp n ASP 18 Ca 0.00 -3.12 0.18 0.00 0.52 0.00 0.00 54.79 52.37 1zrp n ASP 18 Cb 0.00 -0.60 0.83 0.00 -0.72 0.00 0.00 41.12 40.63 1zrp n ASP 18 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1zrp h PRO 19 N 2.99 0.00 0.00 -0.67 0.13 -1.77 0.15 132.00 132.83 1zrp h PRO 19 Ca 0.09 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 1zrp h PRO 19 Cb 0.90 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 1zrp h PRO 19 CO 0.57 0.00 -0.06 -0.44 -0.23 0.00 0.00 178.00 177.84 1zrp h ASP 20 N 0.00 0.00 0.00 1.44 5.19 -1.93 -1.42 116.42 119.69 1zrp h ASP 20 Ca 0.10 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 1zrp h ASP 20 Cb 0.63 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.14 1zrp h ASP 20 CO -0.00 0.06 -0.06 0.59 -3.12 0.00 0.00 179.24 176.71 1zrp n ASN 21 N -4.30 1.97 -1.00 6.45 3.02 0.43 -4.97 115.26 116.84 1zrp n ASN 21 Ca -0.03 -2.75 -0.01 0.00 -0.03 0.00 0.00 54.58 51.76 1zrp n ASN 21 Cb 0.14 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 1zrp n ASN 21 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zrp n GLY 22 N -1.10 0.50 3.30 7.41 0.00 -0.54 -5.07 105.19 109.70 1zrp n GLY 22 Ca 0.11 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 1zrp n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zrp s ILE 23 N -3.01 2.16 0.15 -0.61 1.09 -0.54 -4.94 121.20 115.49 1zrp s ILE 23 Ca 0.00 -1.04 -0.09 0.00 -1.10 0.00 0.00 60.65 58.43 1zrp s ILE 23 Cb -0.00 -1.78 -0.06 0.00 -1.06 0.00 0.00 42.46 39.56 1zrp s ILE 23 CO 0.03 0.57 0.45 -0.44 -0.10 0.00 0.00 174.94 175.45 1zrp s SER 24 N -0.31 6.61 -0.81 3.58 0.01 -1.26 -1.96 113.70 119.56 1zrp s SER 24 Ca 0.01 0.79 -0.23 0.00 1.31 0.00 0.00 55.95 57.83 1zrp s SER 24 Cb -0.13 -2.17 -0.17 0.00 0.21 0.00 0.00 66.02 63.76 1zrp s SER 24 CO 0.02 0.06 2.38 -2.65 0.41 0.00 0.00 173.24 173.46 1zrp n PRO 25 N 0.36 0.48 0.00 12.44 -0.02 -1.26 -0.98 135.00 146.02 1zrp n PRO 25 Ca -0.04 -0.58 0.00 0.00 -2.02 0.00 0.00 63.50 60.86 1zrp n PRO 25 Cb 0.52 -3.09 0.00 0.00 -0.02 0.00 0.00 33.50 30.91 1zrp n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zrp n GLY 26 N 6.47 0.87 3.89 -1.23 0.00 -0.69 -4.90 105.19 109.60 1zrp n GLY 26 Ca 0.51 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.22 1zrp n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zrp s THR 27 N -0.95 4.95 0.26 2.61 2.01 -0.16 -5.08 115.64 119.29 1zrp s THR 27 Ca 0.00 0.32 0.02 0.00 0.31 0.00 0.00 61.69 62.35 1zrp s THR 27 Cb 0.00 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 1zrp s THR 27 CO 0.00 -0.23 0.42 -0.54 -0.69 0.00 0.00 174.62 173.58 1zrp s LYS 28 N -3.25 3.47 0.02 4.92 3.01 -1.26 -4.72 119.74 121.93 1zrp s LYS 28 Ca 0.46 -0.55 -0.17 0.00 -1.01 0.00 0.00 55.97 54.71 1zrp s LYS 28 Cb -0.11 -2.82 -0.09 0.00 -1.01 0.00 0.00 37.83 33.80 1zrp s LYS 28 CO 0.26 0.35 1.17 0.35 0.51 0.00 0.00 175.35 177.98 1zrp h PHE 29 N 1.26 -0.55 0.00 3.18 3.57 -1.97 0.57 116.94 122.99 1zrp h PHE 29 Ca -0.50 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 60.98 1zrp h PHE 29 Cb 1.22 0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.14 1zrp h PHE 29 CO 0.49 -0.34 0.00 -1.91 -2.23 0.00 0.00 178.31 174.32 1zrp n GLU 30 N -3.70 0.95 -0.76 1.11 0.00 -1.26 0.59 120.64 117.56 1zrp n GLU 30 Ca -0.07 0.00 0.06 0.00 0.00 0.00 0.00 57.16 57.14 1zrp n GLU 30 Cb 0.23 -1.19 0.34 0.00 0.00 0.00 0.00 31.44 30.82 1zrp n GLU 30 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1zrp n GLU 31 N -0.69 3.99 -2.44 5.31 0.00 -0.27 -4.94 120.64 121.59 1zrp n GLU 31 Ca 0.09 -3.05 -0.24 0.00 0.00 0.00 0.00 57.16 53.95 1zrp n GLU 31 Cb 0.04 -2.11 0.09 0.00 0.00 0.00 0.00 31.44 29.46 1zrp n GLU 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1zrp s LEU 32 N -2.84 2.98 0.70 4.31 1.43 0.20 -4.54 118.68 120.92 1zrp s LEU 32 Ca 0.50 -0.02 -0.16 0.00 -1.03 0.00 0.00 54.13 53.42 1zrp s LEU 32 Cb 0.40 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 1zrp s LEU 32 CO 0.13 -1.72 0.58 -2.65 0.23 0.00 0.00 176.35 172.92 1zrp n PRO 33 N -2.83 0.36 0.13 1.29 -0.02 -1.26 -4.89 135.00 127.77 1zrp n PRO 33 Ca 0.12 0.16 -0.01 0.00 -2.02 0.00 0.00 63.50 61.74 1zrp n PRO 33 Cb 0.60 -1.86 0.13 0.00 -0.02 0.00 0.00 33.50 32.36 1zrp n PRO 33 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1zrp h ASP 34 N -0.27 0.00 -0.59 2.55 3.32 -1.97 -2.01 116.42 117.45 1zrp h ASP 34 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1zrp h ASP 34 Cb 1.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.90 1zrp h ASP 34 CO 0.44 0.66 0.00 -0.67 -1.72 0.00 0.00 179.24 177.94 1zrp n ASP 35 N -3.66 4.71 -4.56 6.45 -0.08 -1.26 -4.77 116.55 113.38 1zrp n ASP 35 Ca -0.01 -2.53 -0.39 0.00 -1.51 0.00 0.00 54.79 50.35 1zrp n ASP 35 Cb 0.67 -0.59 -0.03 0.00 2.34 0.00 0.00 41.12 43.51 1zrp n ASP 35 CO 0.00 0.00 0.00 0.86 0.12 0.00 0.00 177.20 178.18 1zrp s TRP 36 N -2.03 1.72 0.37 -0.67 -0.00 -0.76 -4.96 118.94 112.60 1zrp s TRP 36 Ca 0.48 0.75 0.02 0.00 -0.00 0.00 0.00 56.10 57.36 1zrp s TRP 36 Cb 0.33 -4.11 0.02 0.00 -0.00 0.00 0.00 33.47 29.71 1zrp s TRP 36 CO 0.21 -2.39 0.18 1.33 -0.00 0.00 0.00 176.95 176.29 1zrp n VAL 37 N 7.23 0.00 -1.82 5.86 0.24 -1.26 -1.99 118.33 126.59 1zrp n VAL 37 Ca 0.20 -1.54 -0.42 0.00 -2.04 0.00 0.00 64.34 60.55 1zrp n VAL 37 Cb 0.51 -0.01 -0.03 0.00 -1.47 0.00 0.00 33.84 32.84 1zrp n VAL 37 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1zrp h PRO 39 N 9.13 0.00 0.00 0.00 0.11 -1.94 -1.81 132.00 137.50 1zrp h PRO 39 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1zrp h PRO 39 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1zrp h PRO 39 CO 0.94 0.00 0.00 -0.89 -0.21 0.00 0.00 178.00 177.84 1zrp n ILE 40 N -3.42 0.00 0.21 4.15 -0.00 -1.26 -4.84 119.36 114.19 1zrp n ILE 40 Ca 0.06 0.00 0.11 0.00 -0.00 0.00 0.00 62.75 62.92 1zrp n ILE 40 Cb 0.65 -0.85 0.15 0.00 -0.00 0.00 0.00 39.64 39.58 1zrp n ILE 40 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1zrp n GLY 42 N 1.11 1.75 3.64 0.00 0.00 -0.68 -4.99 105.19 106.02 1zrp n GLY 42 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1zrp n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zrp s ALA 43 N -2.41 3.35 1.02 4.61 0.00 -1.26 -3.95 121.76 123.12 1zrp s ALA 43 Ca 0.00 1.09 -0.17 0.00 0.00 0.00 0.00 51.96 52.88 1zrp s ALA 43 Cb 0.00 -3.90 0.02 0.00 0.00 0.00 0.00 23.12 19.24 1zrp s ALA 43 CO 0.00 -1.89 -0.04 -2.30 0.00 0.00 0.00 175.76 171.52 1zrp n PRO 44 N 7.82 -0.70 0.00 0.00 -0.02 -1.26 -0.33 135.00 140.51 1zrp n PRO 44 Ca 0.22 -0.18 0.01 0.00 -2.02 0.00 0.00 63.50 61.53 1zrp n PRO 44 Cb 0.43 -1.63 0.04 0.00 -0.02 0.00 0.00 33.50 32.32 1zrp n PRO 44 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1zrp n LYS 45 N -1.00 0.01 -0.49 -0.52 -0.00 -0.84 0.58 118.16 115.90 1zrp n LYS 45 Ca 0.03 0.42 0.04 0.00 -0.00 0.00 0.00 58.31 58.80 1zrp n LYS 45 Cb 0.59 -1.50 0.23 0.00 -0.00 0.00 0.00 35.03 34.35 1zrp n LYS 45 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1zrp n SER 46 N -1.45 3.62 -0.04 -5.58 3.41 -1.26 -1.71 113.62 110.61 1zrp n SER 46 Ca 0.01 -2.48 0.06 0.00 -0.26 0.00 0.00 58.87 56.20 1zrp n SER 46 Cb 0.02 -0.57 0.08 0.00 -0.26 0.00 0.00 64.21 63.48 1zrp n SER 46 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1zrp n GLU 47 N 0.42 1.94 -3.83 4.33 -0.58 0.20 -5.01 120.64 118.10 1zrp n GLU 47 Ca 0.16 -2.15 -0.36 0.00 -0.42 0.00 0.00 57.16 54.39 1zrp n GLU 47 Cb 0.76 -1.30 -0.13 0.00 -0.57 0.00 0.00 31.44 30.19 1zrp n GLU 47 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1zrp s PHE 48 N -2.13 3.05 0.85 -0.32 0.40 -0.69 -2.11 117.98 117.03 1zrp s PHE 48 Ca 0.19 -0.89 -0.12 0.00 -0.60 0.00 0.00 56.93 55.51 1zrp s PHE 48 Cb 0.17 -2.18 0.13 0.00 0.51 0.00 0.00 43.02 41.65 1zrp s PHE 48 CO 0.02 -0.53 1.21 -2.00 0.70 0.00 0.00 175.22 174.61 1zrp s GLU 49 N 1.50 1.48 0.29 0.44 2.56 0.20 -4.83 118.70 120.34 1zrp s GLU 49 Ca 0.04 -0.18 0.10 0.00 0.00 0.00 0.00 54.97 54.93 1zrp s GLU 49 Cb -0.16 -1.95 -0.06 0.00 2.00 0.00 0.00 34.13 33.97 1zrp s GLU 49 CO -0.00 -1.86 -0.14 0.21 -0.56 0.00 0.00 175.26 172.91 1zrp s LYS 50 N -5.64 1.66 -0.42 4.30 2.20 -1.26 -0.49 119.74 120.08 1zrp s LYS 50 Ca 0.66 -1.81 -0.15 0.00 -0.36 0.00 0.00 55.97 54.32 1zrp s LYS 50 Cb -0.08 -1.57 0.02 0.00 -1.51 0.00 0.00 37.83 34.69 1zrp s LYS 50 CO 0.50 0.20 0.56 -0.11 -0.36 0.00 0.00 175.35 176.14 1zrp n LEU 51 N -0.64 -7.98 -3.62 5.43 -0.00 -0.73 -4.90 117.00 104.56 1zrp n LEU 51 Ca -0.05 0.60 -0.08 0.00 -0.00 0.00 0.00 56.01 56.48 1zrp n LEU 51 Cb 0.62 -3.41 -0.06 0.00 -0.00 0.00 0.00 43.42 40.57 1zrp n LEU 51 CO 0.40 -2.43 0.87 -1.61 -0.00 0.00 0.00 177.39 174.62 1zrp s GLU 52 N -2.55 0.40 0.00 1.96 2.02 -1.26 -5.07 118.70 114.20 1zrp s GLU 52 Ca 0.23 0.30 0.00 0.00 0.02 0.00 0.00 54.97 55.52 1zrp s GLU 52 Cb -0.07 0.19 0.00 0.00 0.10 0.00 0.00 34.13 34.36 1zrp s GLU 52 CO 0.77 -0.08 0.00 -0.25 0.02 0.00 0.00 175.26 175.72