#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmo n LYS 2 N 0.00 3.63 -1.56 -1.58 5.02 -1.26 -5.06 118.16 117.35 2kmo n LYS 2 Ca 0.00 -4.56 -0.32 0.00 -2.02 0.00 0.00 58.31 51.41 2kmo n LYS 2 Cb 0.00 -2.45 0.06 0.00 -0.02 0.00 0.00 35.03 32.63 2kmo n LYS 2 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2kmo s VAL 3 N -2.29 3.49 0.16 -0.18 0.11 -1.26 -5.08 120.40 115.35 2kmo s VAL 3 Ca 0.32 0.57 -0.12 0.00 -2.93 0.00 0.00 61.98 59.82 2kmo s VAL 3 Cb 0.03 -3.11 -0.07 0.00 -1.53 0.00 0.00 36.38 31.70 2kmo s VAL 3 CO 0.02 -0.55 0.52 0.00 -3.33 0.00 0.00 175.10 171.75 2kmo s ALA 5 N -1.56 2.19 0.14 0.00 0.00 -1.26 -4.97 121.76 116.30 2kmo s ALA 5 Ca 0.40 -0.81 0.05 0.00 0.00 0.00 0.00 51.96 51.59 2kmo s ALA 5 Cb -0.14 -4.32 -0.04 0.00 0.00 0.00 0.00 23.12 18.62 2kmo s ALA 5 CO 0.20 -3.91 -0.11 0.00 0.00 0.00 0.00 175.76 171.94 2kmo s PRO 7 N -3.44 2.54 0.00 0.00 0.04 -1.26 -4.99 135.00 127.89 2kmo s PRO 7 Ca 0.14 0.77 0.27 0.00 0.04 0.00 0.00 61.00 62.22 2kmo s PRO 7 Cb 0.00 -1.96 1.20 0.00 0.04 0.00 0.00 34.50 33.79 2kmo s PRO 7 CO 0.01 -1.33 1.88 1.63 0.04 0.00 0.00 177.00 179.24 2kmo n LYS 8 N -3.26 0.08 -1.54 4.56 5.02 -1.26 -4.92 118.16 116.85 2kmo n LYS 8 Ca 0.07 0.03 -0.52 0.00 -2.02 0.00 0.00 58.31 55.87 2kmo n LYS 8 Cb 0.55 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.99 2kmo n LYS 8 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2kmo n ILE 9 N -1.46 0.27 -2.10 -0.18 -5.35 -1.26 -4.87 119.36 104.41 2kmo n ILE 9 Ca 0.08 -0.18 -0.30 0.00 -0.27 0.00 0.00 62.75 62.08 2kmo n ILE 9 Cb 0.30 -1.54 -0.05 0.00 -1.74 0.00 0.00 39.64 36.61 2kmo n ILE 9 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2kmo s LEU 10 N 5.90 3.21 -0.41 7.28 1.02 -1.26 -4.74 118.68 129.67 2kmo s LEU 10 Ca 1.05 -0.59 0.08 0.00 0.02 0.00 0.00 54.13 54.68 2kmo s LEU 10 Cb -0.91 -2.56 0.25 0.00 0.02 0.00 0.00 46.19 43.00 2kmo s LEU 10 CO 0.54 -2.57 0.62 1.17 0.02 0.00 0.00 176.35 176.13 2kmo n LYS 11 N 8.91 0.73 -0.80 1.70 3.00 -1.21 -5.11 118.16 125.39 2kmo n LYS 11 Ca 0.36 -2.85 -0.31 0.00 -0.00 0.00 0.00 58.31 55.52 2kmo n LYS 11 Cb 0.48 -1.28 0.16 0.00 0.00 0.00 0.00 35.03 34.39 2kmo n LYS 11 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2kmo s PRO 12 N -0.73 1.01 0.04 1.64 0.04 -1.04 -4.06 135.00 131.91 2kmo s PRO 12 Ca 0.34 1.37 -0.04 0.00 0.04 0.00 0.00 61.00 62.71 2kmo s PRO 12 Cb 0.19 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.97 2kmo s PRO 12 CO -0.14 -2.58 0.07 0.14 0.04 0.00 0.00 177.00 174.53 2kmo s VAL 13 N -2.69 0.15 -0.35 -0.36 -7.23 -1.22 -0.77 120.40 107.93 2kmo s VAL 13 Ca 0.66 -1.22 -0.13 0.00 -1.81 0.00 0.00 61.98 59.47 2kmo s VAL 13 Cb -0.22 -0.99 -0.01 0.00 0.56 0.00 0.00 36.38 35.72 2kmo s VAL 13 CO 0.58 -0.67 0.27 0.00 -0.31 0.00 0.00 175.10 174.97 2kmo s GLY 15 N 1.72 1.60 0.52 0.00 0.00 0.01 -0.36 107.32 110.81 2kmo s GLY 15 Ca 0.07 -0.08 0.24 0.00 0.00 0.00 0.00 44.72 44.94 2kmo s GLY 15 CO 0.11 0.48 2.01 0.23 0.00 0.00 0.00 173.10 175.92 2kmo h SER 16 N -1.90 0.02 1.81 1.64 0.87 -1.26 -0.93 113.55 113.79 2kmo h SER 16 Ca -0.53 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.03 2kmo h SER 16 Cb 1.30 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 2kmo h SER 16 CO 0.53 0.01 -0.03 -0.78 -0.53 0.00 0.00 176.83 176.03 2kmo h ASP 17 N 0.02 0.00 0.00 6.23 3.58 -1.93 -3.48 116.42 120.85 2kmo h ASP 17 Ca 0.23 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2kmo h ASP 17 Cb 0.89 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2kmo h ASP 17 CO -0.01 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.96 2kmo n GLY 18 N 1.17 0.43 3.78 -0.78 0.00 -0.35 -5.10 105.19 104.33 2kmo n GLY 18 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2kmo n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kmo s ARG 19 N -0.86 2.58 -0.04 1.61 3.52 -1.26 -4.69 118.95 119.82 2kmo s ARG 19 Ca 0.00 1.23 0.02 0.00 -0.13 0.00 0.00 55.73 56.85 2kmo s ARG 19 Cb 0.00 -1.93 -0.03 0.00 -1.56 0.00 0.00 34.95 31.43 2kmo s ARG 19 CO 0.00 -1.40 -0.09 0.99 -0.81 0.00 0.00 175.30 173.99 2kmo s THR 20 N -2.69 3.51 0.36 4.11 2.01 -1.26 -0.81 115.64 120.87 2kmo s THR 20 Ca 0.63 -0.65 0.03 0.00 0.31 0.00 0.00 61.69 62.01 2kmo s THR 20 Cb -0.18 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.83 2kmo s THR 20 CO 0.50 0.52 0.09 -0.31 -0.69 0.00 0.00 174.62 174.73 2kmo s TYR 21 N -0.86 1.85 0.14 4.92 1.51 -1.23 -5.03 117.35 118.66 2kmo s TYR 21 Ca 0.14 -1.11 -0.18 0.00 -1.01 0.00 0.00 57.07 54.91 2kmo s TYR 21 Cb -0.11 -1.21 -0.01 0.00 -0.11 0.00 0.00 41.96 40.52 2kmo s TYR 21 CO 0.03 -0.14 1.76 0.00 -1.11 0.00 0.00 175.55 176.09 2kmo h ALA 22 N 1.97 0.32 -2.53 3.71 0.00 -1.92 -3.30 119.26 117.51 2kmo h ALA 22 Ca -0.38 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.55 2kmo h ALA 22 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2kmo h ALA 22 CO 0.64 -0.28 0.23 0.27 0.00 0.00 0.00 179.25 180.11 2kmo n ASN 23 N -4.99 -1.40 -0.09 0.00 6.94 -1.26 -2.49 115.26 111.97 2kmo n ASN 23 Ca -0.01 -1.92 0.02 0.00 -0.02 0.00 0.00 54.58 52.64 2kmo n ASN 23 Cb 0.08 2.32 0.32 0.00 -2.36 0.00 0.00 39.78 40.14 2kmo n ASN 23 CO 0.00 0.00 0.00 -1.28 -1.03 0.00 0.00 177.26 174.95 2kmo h SER 24 N 1.28 0.64 -0.77 0.53 0.87 -1.92 -1.87 113.55 112.30 2kmo h SER 24 Ca -0.21 -0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.28 2kmo h SER 24 Cb 0.79 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 62.55 2kmo h SER 24 CO 0.27 0.51 0.35 0.00 -0.53 0.00 0.00 176.83 177.43 2kmo h ILE 26 N 1.12 1.40 -0.24 0.00 6.09 -1.91 -3.26 117.51 120.70 2kmo h ILE 26 Ca 0.27 -2.58 0.05 0.00 -1.37 0.00 0.00 64.86 61.22 2kmo h ILE 26 Cb 0.14 3.09 -0.05 0.00 0.47 0.00 0.00 36.82 40.47 2kmo h ILE 26 CO -0.03 0.76 -0.07 0.00 -3.07 0.00 0.00 178.15 175.74 2kmo h ALA 27 N 0.13 0.15 -0.86 0.18 0.00 -1.19 0.26 119.26 117.93 2kmo h ALA 27 Ca -0.19 0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2kmo h ALA 27 Cb 1.88 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 19.80 2kmo h ALA 27 CO 0.21 -0.48 0.54 0.07 0.00 0.00 0.00 179.25 179.59 2kmo h ARG 28 N -0.01 0.98 0.00 0.00 0.11 -1.39 -2.82 114.38 111.25 2kmo h ARG 28 Ca 0.12 -0.06 -0.07 0.00 0.10 0.00 0.00 59.98 60.06 2kmo h ARG 28 Cb 0.19 -0.22 -0.01 0.00 1.11 0.00 0.00 29.97 31.04 2kmo h ARG 28 CO -0.25 0.65 -0.36 0.00 0.10 0.00 0.00 179.97 180.11 2kmo n ASN 30 N -3.26 0.21 0.00 0.00 2.85 0.01 -4.91 115.26 110.16 2kmo n ASN 30 Ca 0.02 0.56 0.00 0.00 -0.11 0.00 0.00 54.58 55.04 2kmo n ASN 30 Cb 0.62 -0.60 0.00 0.00 1.24 0.00 0.00 39.78 41.04 2kmo n ASN 30 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2kmo n GLY 31 N -0.15 0.82 3.12 8.20 0.00 -1.07 -5.09 105.19 111.01 2kmo n GLY 31 Ca 0.03 -0.27 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 2kmo n GLY 31 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kmo s VAL 32 N -2.00 1.01 0.35 1.61 -7.23 -1.21 -5.08 120.40 107.83 2kmo s VAL 32 Ca 0.00 -0.98 -0.21 0.00 -1.81 0.00 0.00 61.98 58.98 2kmo s VAL 32 Cb 0.00 -0.93 -0.10 0.00 0.56 0.00 0.00 36.38 35.91 2kmo s VAL 32 CO 0.00 -0.04 0.87 -0.94 -0.31 0.00 0.00 175.10 174.67 2kmo s SER 33 N -1.16 7.03 0.04 4.85 1.04 -1.26 -3.91 113.70 120.34 2kmo s SER 33 Ca 0.00 1.60 -0.30 0.00 0.48 0.00 0.00 55.95 57.73 2kmo s SER 33 Cb -0.08 -2.50 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 2kmo s SER 33 CO 0.01 -0.19 0.98 0.27 0.98 0.00 0.00 173.24 175.29 2kmo s ILE 34 N -1.88 4.70 -0.12 -1.02 -5.25 -1.26 -0.77 121.20 115.61 2kmo s ILE 34 Ca 0.54 2.05 -0.08 0.00 -0.99 0.00 0.00 60.65 62.17 2kmo s ILE 34 Cb -0.13 -4.31 -0.26 0.00 2.95 0.00 0.00 42.46 40.70 2kmo s ILE 34 CO 0.18 0.22 0.39 0.11 -1.79 0.00 0.00 174.94 174.05 2kmo h LYS 35 N 6.32 0.27 -3.92 0.37 1.79 -0.91 -3.45 116.57 117.04 2kmo h LYS 35 Ca -0.42 -0.46 -0.10 0.00 -2.18 0.00 0.00 60.65 57.50 2kmo h LYS 35 Cb 1.22 0.17 -0.14 0.00 -1.58 0.00 0.00 32.23 31.90 2kmo h LYS 35 CO 0.74 1.22 -0.44 -1.12 -1.08 0.00 0.00 179.45 178.77 2kmo s SER 36 N -7.06 0.20 0.55 0.86 0.01 -1.03 -5.03 113.70 102.21 2kmo s SER 36 Ca -0.22 -0.75 -0.16 0.00 1.31 0.00 0.00 55.95 56.13 2kmo s SER 36 Cb 0.06 0.31 -0.06 0.00 0.21 0.00 0.00 66.02 66.55 2kmo s SER 36 CO 0.77 -0.71 1.03 -1.83 0.41 0.00 0.00 173.24 172.91 2kmo s GLU 37 N -3.88 3.59 0.00 12.44 -1.05 -1.26 -0.77 118.70 127.76 2kmo s GLU 37 Ca 0.06 1.13 0.00 0.00 -0.15 0.00 0.00 54.97 56.01 2kmo s GLU 37 Cb 0.06 -2.08 0.00 0.00 -0.44 0.00 0.00 34.13 31.67 2kmo s GLU 37 CO -0.10 -0.58 0.00 0.41 0.95 0.00 0.00 175.26 175.94 2kmo n GLY 38 N -1.12 -2.19 3.76 -3.83 0.00 0.05 -4.62 105.19 97.24 2kmo n GLY 38 Ca 0.08 -1.49 -0.37 0.00 0.00 0.00 0.00 46.02 44.24 2kmo n GLY 38 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kmo s SER 39 N -3.99 5.49 0.16 1.61 0.15 -1.26 -1.79 113.70 114.07 2kmo s SER 39 Ca 0.00 2.56 -0.19 0.00 0.70 0.00 0.00 55.95 59.02 2kmo s SER 39 Cb 0.00 -2.62 -0.07 0.00 -1.71 0.00 0.00 66.02 61.62 2kmo s SER 39 CO 0.00 -1.40 0.64 0.00 1.20 0.00 0.00 173.24 173.68 2kmo s PRO 41 N -1.68 2.96 0.18 0.00 0.04 -1.26 -4.93 135.00 130.31 2kmo s PRO 41 Ca 0.37 1.11 0.26 0.00 0.04 0.00 0.00 61.00 62.78 2kmo s PRO 41 Cb -0.18 -1.99 0.89 0.00 0.04 0.00 0.00 34.50 33.27 2kmo s PRO 41 CO 0.20 -1.09 1.78 -2.37 0.04 0.00 0.00 177.00 175.57 2kmo n THR 42 N -2.75 0.56 0.00 1.26 5.66 -1.26 -4.89 114.28 112.86 2kmo n THR 42 Ca 0.08 -0.15 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 2kmo n THR 42 Cb 0.53 -0.67 0.00 0.00 -1.55 0.00 0.00 70.33 68.64 2kmo n THR 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kmo n GLY 43 N 1.11 0.83 0.15 1.09 0.00 -1.26 -5.27 105.19 101.83 2kmo n GLY 43 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.09 2kmo n GLY 43 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71