#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 0.56 -4.12 -1.58 0.00 -1.26 -5.20 118.16 106.56 2kmo n LYS 2 Ca 0.00 -2.64 -0.13 0.00 -0.00 0.00 0.00 58.31 55.54 2kmo n LYS 2 Cb 0.00 2.43 -0.11 0.00 -0.00 0.00 0.00 35.03 37.36 2kmo n LYS 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2kmo s VAL 3 N -2.89 0.68 -0.83 0.58 0.11 -1.26 -5.11 120.40 111.68 2kmo s VAL 3 Ca 0.29 -1.48 -0.25 0.00 -2.93 0.00 0.00 61.98 57.60 2kmo s VAL 3 Cb -0.00 -1.13 -0.02 0.00 -1.53 0.00 0.00 36.38 33.70 2kmo s VAL 3 CO 0.20 -0.58 1.80 0.00 -3.33 0.00 0.00 175.10 173.20 2kmo s ALA 5 N 8.75 2.14 0.22 0.00 0.00 -1.26 -4.97 121.76 126.64 2kmo s ALA 5 Ca 0.63 -0.94 0.10 0.00 0.00 0.00 0.00 51.96 51.76 2kmo s ALA 5 Cb -0.07 -4.36 -0.05 0.00 0.00 0.00 0.00 23.12 18.64 2kmo s ALA 5 CO 0.04 -4.02 -0.19 0.00 0.00 0.00 0.00 175.76 171.59 2kmo s PRO 7 N -3.22 1.89 0.00 0.00 0.04 -1.26 -4.99 135.00 127.46 2kmo s PRO 7 Ca 0.24 0.35 0.23 0.00 0.04 0.00 0.00 61.00 61.86 2kmo s PRO 7 Cb -0.05 -1.92 1.01 0.00 0.04 0.00 0.00 34.50 33.58 2kmo s PRO 7 CO 0.11 -1.70 1.75 1.63 0.04 0.00 0.00 177.00 178.83 2kmo n LYS 8 N -3.43 0.01 -1.61 4.56 4.76 -1.26 -4.92 118.16 116.27 2kmo n LYS 8 Ca 0.07 0.10 -0.45 0.00 -2.87 0.00 0.00 58.31 55.16 2kmo n LYS 8 Cb 0.59 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.24 2kmo n LYS 8 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 2kmo n ILE 9 N -1.49 0.47 -2.07 -0.18 -5.35 -1.26 -4.91 119.36 104.57 2kmo n ILE 9 Ca 0.06 -0.30 -0.28 0.00 -0.27 0.00 0.00 62.75 61.96 2kmo n ILE 9 Cb 0.27 -2.29 -0.05 0.00 -1.74 0.00 0.00 39.64 35.83 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 6.57 3.13 -0.44 7.28 2.01 -1.26 -4.69 118.68 131.28 2kmo s LEU 10 Ca 0.98 -1.13 0.07 0.00 0.01 0.00 0.00 54.13 54.05 2kmo s LEU 10 Cb -0.48 -2.57 0.23 0.00 0.01 0.00 0.00 46.19 43.38 2kmo s LEU 10 CO 0.41 -2.86 0.51 0.29 1.01 0.00 0.00 176.35 175.71 2kmo n LYS 11 N 8.60 0.86 -0.89 1.70 5.02 -1.20 -5.11 118.16 127.15 2kmo n LYS 11 Ca 0.42 -3.44 -0.31 0.00 -2.02 0.00 0.00 58.31 52.96 2kmo n LYS 11 Cb 0.47 -1.48 0.15 0.00 -0.02 0.00 0.00 35.03 34.14 2kmo n LYS 11 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2kmo s PRO 12 N -1.08 1.32 0.06 1.97 0.04 -1.06 -4.00 135.00 132.25 2kmo s PRO 12 Ca 0.35 1.37 -0.08 0.00 0.04 0.00 0.00 61.00 62.67 2kmo s PRO 12 Cb 0.13 -1.78 -0.00 0.00 0.04 0.00 0.00 34.50 32.89 2kmo s PRO 12 CO -0.12 -2.36 0.17 0.14 0.04 0.00 0.00 177.00 174.87 2kmo s VAL 13 N -2.73 0.13 -0.34 -0.36 -7.23 -1.22 -0.62 120.40 108.03 2kmo s VAL 13 Ca 0.65 -1.07 -0.11 0.00 -1.81 0.00 0.00 61.98 59.64 2kmo s VAL 13 Cb -0.21 -1.10 -0.00 0.00 0.56 0.00 0.00 36.38 35.63 2kmo s VAL 13 CO 0.58 -0.59 0.20 0.00 -0.31 0.00 0.00 175.10 174.98 2kmo s GLY 15 N 1.64 1.64 0.51 0.00 0.00 -0.25 -0.82 107.32 110.04 2kmo s GLY 15 Ca 0.05 0.08 0.19 0.00 0.00 0.00 0.00 44.72 45.04 2kmo s GLY 15 CO 0.08 0.52 2.10 0.23 0.00 0.00 0.00 173.10 176.03 2kmo h SER 16 N -1.42 0.00 0.99 1.64 0.87 -1.13 -0.70 113.55 113.80 2kmo h SER 16 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2kmo h SER 16 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2kmo h SER 16 CO 0.53 0.08 0.00 0.47 -0.53 0.00 0.00 176.83 177.38 2kmo n ASP 17 N -4.23 0.13 0.00 6.23 8.00 -1.26 -4.92 116.55 120.50 2kmo n ASP 17 Ca -0.03 0.52 0.00 0.00 0.71 0.00 0.00 54.79 55.99 2kmo n ASP 17 Cb 0.16 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 2kmo n ASP 17 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kmo n GLY 18 N 1.23 0.41 3.77 0.44 0.00 -0.27 -5.08 105.19 105.70 2kmo n GLY 18 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.90 2.64 -0.06 1.61 3.52 -1.26 -4.68 118.95 119.82 2kmo s ARG 19 Ca 0.00 1.28 0.03 0.00 -0.13 0.00 0.00 55.73 56.91 2kmo s ARG 19 Cb 0.00 -1.94 -0.02 0.00 -1.56 0.00 0.00 34.95 31.43 2kmo s ARG 19 CO 0.00 -1.36 -0.16 0.99 -0.81 0.00 0.00 175.30 173.96 2kmo s THR 20 N -2.58 2.88 0.34 4.11 2.01 -1.26 -1.09 115.64 120.05 2kmo s THR 20 Ca 0.64 -0.78 0.03 0.00 0.31 0.00 0.00 61.69 61.90 2kmo s THR 20 Cb -0.19 -2.13 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 2kmo s THR 20 CO 0.47 0.58 0.10 -0.31 -0.69 0.00 0.00 174.62 174.76 2kmo s TYR 21 N -0.46 1.79 0.14 4.92 1.51 -1.23 -5.02 117.35 119.00 2kmo s TYR 21 Ca 0.05 -1.15 -0.17 0.00 -1.01 0.00 0.00 57.07 54.79 2kmo s TYR 21 Cb -0.12 -1.13 -0.01 0.00 -0.11 0.00 0.00 41.96 40.59 2kmo s TYR 21 CO 0.02 -0.21 1.79 0.00 -1.11 0.00 0.00 175.55 176.04 2kmo h ALA 22 N 2.07 0.39 -2.46 3.71 0.00 -1.92 -3.27 119.26 117.77 2kmo h ALA 22 Ca -0.38 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 2kmo h ALA 22 Cb 1.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2kmo h ALA 22 CO 0.62 -0.18 0.13 0.27 0.00 0.00 0.00 179.25 180.09 2kmo n ASN 23 N -4.91 -1.09 -0.32 0.00 6.94 -1.26 -2.56 115.26 112.06 2kmo n ASN 23 Ca -0.01 -1.75 -0.03 0.00 -0.02 0.00 0.00 54.58 52.77 2kmo n ASN 23 Cb 0.05 1.82 0.09 0.00 -2.36 0.00 0.00 39.78 39.37 2kmo n ASN 23 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 2kmo h SER 24 N 0.94 1.00 -0.38 0.53 4.64 -1.92 -2.50 113.55 115.85 2kmo h SER 24 Ca -0.16 -0.03 0.04 0.00 -0.47 0.00 0.00 61.79 61.18 2kmo h SER 24 Cb 0.59 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.39 2kmo h SER 24 CO 0.20 0.72 0.14 0.00 -0.87 0.00 0.00 176.83 177.02 2kmo h ILE 26 N 0.30 1.35 -0.16 0.00 6.09 -1.93 -2.81 117.51 120.35 2kmo h ILE 26 Ca 0.17 -1.65 0.03 0.00 -1.37 0.00 0.00 64.86 62.03 2kmo h ILE 26 Cb 0.15 1.99 -0.02 0.00 0.47 0.00 0.00 36.82 39.40 2kmo h ILE 26 CO -0.17 0.50 0.00 0.00 -3.07 0.00 0.00 178.15 175.41 2kmo h ALA 27 N 0.55 0.14 -0.83 0.18 0.00 -1.07 -0.15 119.26 118.08 2kmo h ALA 27 Ca -0.00 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2kmo h ALA 27 Cb 1.00 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 2kmo h ALA 27 CO 0.08 -0.44 0.55 0.00 0.00 0.00 0.00 179.25 179.44 2kmo h ARG 28 N 0.05 1.08 0.00 0.00 2.47 -1.10 -2.88 114.38 114.01 2kmo h ARG 28 Ca 0.07 -0.07 -0.08 0.00 -1.26 0.00 0.00 59.98 58.65 2kmo h ARG 28 Cb 0.09 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.15 2kmo h ARG 28 CO -0.12 0.72 -0.36 0.00 0.56 0.00 0.00 179.97 180.76 2kmo n ASN 30 N -3.40 0.15 0.00 0.00 2.85 -0.12 -4.90 115.26 109.84 2kmo n ASN 30 Ca 0.01 0.54 0.00 0.00 -0.11 0.00 0.00 54.58 55.02 2kmo n ASN 30 Cb 0.55 -0.57 0.00 0.00 1.24 0.00 0.00 39.78 41.00 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 -0.19 0.76 3.32 8.20 0.00 -1.09 -5.09 105.19 111.10 2kmo n GLY 31 Ca 0.03 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 2kmo n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kmo s VAL 32 N -2.00 1.76 -0.01 1.61 1.01 -1.22 -5.09 120.40 116.46 2kmo s VAL 32 Ca 0.00 -1.86 -0.05 0.00 0.00 0.00 0.00 61.98 60.07 2kmo s VAL 32 Cb 0.00 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2kmo s VAL 32 CO 0.00 -0.30 0.22 -0.44 0.00 0.00 0.00 175.10 174.58 2kmo s SER 33 N -2.56 6.43 -0.05 3.32 0.01 -1.26 -4.07 113.70 115.53 2kmo s SER 33 Ca 0.14 0.47 -0.17 0.00 1.31 0.00 0.00 55.95 57.69 2kmo s SER 33 Cb -0.06 -2.05 -0.05 0.00 0.21 0.00 0.00 66.02 64.06 2kmo s SER 33 CO 0.06 0.28 0.47 0.27 0.41 0.00 0.00 173.24 174.73 2kmo s ILE 34 N -1.27 5.06 -0.00 1.44 -4.36 -1.26 -0.53 121.20 120.27 2kmo s ILE 34 Ca 0.26 0.97 -0.01 0.00 -0.26 0.00 0.00 60.65 61.61 2kmo s ILE 34 Cb -0.13 -3.80 -0.27 0.00 1.25 0.00 0.00 42.46 39.52 2kmo s ILE 34 CO 0.16 0.45 0.83 0.11 0.24 0.00 0.00 174.94 176.72 2kmo h LYS 35 N 5.70 0.20 -2.95 0.37 6.56 -1.23 -3.47 116.57 121.76 2kmo h LYS 35 Ca -0.46 -0.35 0.05 0.00 -1.06 0.00 0.00 60.65 58.83 2kmo h LYS 35 Cb 1.20 0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 32.96 2kmo h LYS 35 CO 0.69 1.04 0.27 0.45 -2.06 0.00 0.00 179.45 179.84 2kmo s SER 36 N -6.86 -0.15 0.62 0.86 0.15 -1.23 -5.05 113.70 102.04 2kmo s SER 36 Ca -0.09 -0.81 -0.10 0.00 0.70 0.00 0.00 55.95 55.66 2kmo s SER 36 Cb 0.07 0.76 -0.02 0.00 -1.71 0.00 0.00 66.02 65.12 2kmo s SER 36 CO 0.84 -1.45 1.00 -1.83 1.20 0.00 0.00 173.24 173.00 2kmo s GLU 37 N -3.21 3.36 0.00 5.44 -1.05 -1.26 -1.14 118.70 120.84 2kmo s GLU 37 Ca 0.13 0.53 0.00 0.00 -0.15 0.00 0.00 54.97 55.48 2kmo s GLU 37 Cb -0.05 -2.13 0.00 0.00 -0.44 0.00 0.00 34.13 31.51 2kmo s GLU 37 CO 0.08 -0.63 0.00 0.41 0.95 0.00 0.00 175.26 176.07 2kmo n GLY 38 N -2.72 -2.47 3.77 -3.83 0.00 0.21 -4.63 105.19 95.52 2kmo n GLY 38 Ca 0.05 -1.42 -0.40 0.00 0.00 0.00 0.00 46.02 44.25 2kmo n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kmo s SER 39 N -3.55 6.22 0.44 1.61 1.04 -1.26 -2.06 113.70 116.15 2kmo s SER 39 Ca 0.00 2.76 -0.20 0.00 0.48 0.00 0.00 55.95 58.99 2kmo s SER 39 Cb 0.00 -2.65 -0.10 0.00 0.10 0.00 0.00 66.02 63.37 2kmo s SER 39 CO 0.00 -0.92 0.95 0.00 0.98 0.00 0.00 173.24 174.25 2kmo s PRO 41 N -3.31 3.40 0.04 0.00 0.04 -1.26 -4.96 135.00 128.95 2kmo s PRO 41 Ca 0.61 1.47 0.26 0.00 0.04 0.00 0.00 61.00 63.39 2kmo s PRO 41 Cb -0.09 -2.03 1.09 0.00 0.04 0.00 0.00 34.50 33.51 2kmo s PRO 41 CO 0.16 -0.78 1.84 2.41 0.04 0.00 0.00 177.00 180.66 2kmo n THR 42 N -1.43 0.24 0.00 1.26 -1.04 -1.26 -4.91 114.28 107.14 2kmo n THR 42 Ca 0.11 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 2kmo n THR 42 Cb 0.52 -0.60 0.00 0.00 -1.82 0.00 0.00 70.33 68.43 2kmo n THR 42 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kmo n GLY 43 N 1.23 3.38 0.00 3.41 0.00 -1.26 -5.27 105.19 106.68 2kmo n GLY 43 Ca 0.06 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2kmo n GLY 43 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83