#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rel n GLN 2 N 0.00 0.63 -3.19 0.00 0.00 -1.26 -5.04 117.38 108.51 2rel n GLN 2 Ca 0.00 -1.57 -0.22 0.00 -0.00 0.00 0.00 57.00 55.21 2rel n GLN 2 Cb 0.00 -1.22 -0.05 0.00 0.00 0.00 0.00 30.24 28.97 2rel n GLN 2 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 2rel n GLU 3 N 1.79 1.10 0.00 3.69 0.00 -1.26 -4.90 120.64 121.07 2rel n GLU 3 Ca 0.09 -3.49 0.07 0.00 0.00 0.00 0.00 57.16 53.83 2rel n GLU 3 Cb 0.64 -1.54 0.44 0.00 0.00 0.00 0.00 31.44 30.98 2rel n GLU 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2rel n PRO 4 N 0.83 0.92 -0.90 3.44 -0.04 -1.26 -4.91 135.00 133.08 2rel n PRO 4 Ca 0.24 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.33 2rel n PRO 4 Cb 0.56 -1.25 0.07 0.00 -0.04 0.00 0.00 33.50 32.84 2rel n PRO 4 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2rel n VAL 5 N -0.75 0.00 -1.08 0.52 3.14 -1.26 -5.01 118.33 113.89 2rel n VAL 5 Ca 0.11 -0.15 0.00 0.00 -2.96 0.00 0.00 64.34 61.35 2rel n VAL 5 Cb 0.05 -0.19 0.00 0.00 -1.06 0.00 0.00 33.84 32.64 2rel n VAL 5 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 2rel n LYS 6 N 1.05 3.81 0.00 1.45 2.85 -1.26 -5.07 118.16 120.99 2rel n LYS 6 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 2rel n LYS 6 Cb 0.69 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.07 2rel n LYS 6 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2rel n GLY 7 N 5.00 1.44 3.83 2.58 0.00 -1.26 -4.96 105.19 111.82 2rel n GLY 7 Ca 0.00 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 2rel n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rel s PRO 8 N -0.03 3.15 -1.24 1.61 0.04 -1.26 -4.03 135.00 133.23 2rel s PRO 8 Ca 0.00 0.94 -0.33 0.00 0.04 0.00 0.00 61.00 61.65 2rel s PRO 8 Cb 0.00 -2.02 0.04 0.00 0.04 0.00 0.00 34.50 32.57 2rel s PRO 8 CO 0.00 -0.93 0.64 1.55 0.04 0.00 0.00 177.00 178.30 2rel n VAL 9 N -2.89 -2.67 -2.56 -0.36 3.14 -1.26 -4.90 118.33 106.82 2rel n VAL 9 Ca 0.07 -0.60 0.00 0.00 -2.96 0.00 0.00 64.34 60.85 2rel n VAL 9 Cb 0.54 -2.25 0.00 0.00 -1.06 0.00 0.00 33.84 31.07 2rel n VAL 9 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2rel n SER 10 N -2.20 0.00 0.16 6.55 7.64 -1.26 -5.02 113.62 119.49 2rel n SER 10 Ca -0.12 -0.23 0.02 0.00 1.01 0.00 0.00 58.87 59.55 2rel n SER 10 Cb 0.57 0.00 0.23 0.00 -1.01 0.00 0.00 64.21 64.00 2rel n SER 10 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2rel h THR 11 N 0.23 1.19 -3.79 0.44 2.02 -1.90 -3.39 112.91 107.70 2rel h THR 11 Ca 0.00 -1.88 -0.68 0.00 0.77 0.00 0.00 66.41 64.62 2rel h THR 11 Cb 0.00 2.07 -0.34 0.00 -1.74 0.00 0.00 68.15 68.13 2rel h THR 11 CO 0.00 0.51 -0.73 -0.54 0.37 0.00 0.00 175.52 175.13 2rel s LYS 12 N -3.58 2.33 0.63 6.66 1.02 -1.26 -5.10 119.74 120.44 2rel s LYS 12 Ca -0.01 -1.32 -0.11 0.00 0.02 0.00 0.00 55.97 54.56 2rel s LYS 12 Cb 0.12 -3.10 0.15 0.00 -0.52 0.00 0.00 37.83 34.48 2rel s LYS 12 CO 0.73 -0.62 0.70 -0.35 -0.92 0.00 0.00 175.35 174.89 2rel n PRO 13 N 4.55 -1.46 0.00 -1.68 -0.04 -1.26 -4.19 135.00 130.92 2rel n PRO 13 Ca -0.13 -1.10 0.00 0.00 -0.04 0.00 0.00 63.50 62.24 2rel n PRO 13 Cb 0.43 -0.86 0.00 0.00 -0.04 0.00 0.00 33.50 33.03 2rel n PRO 13 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rel n GLY 14 N -0.81 -0.12 2.88 0.55 0.00 -1.26 -4.68 105.19 101.75 2rel n GLY 14 Ca 0.09 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 2rel n GLY 14 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2rel n SER 15 N 0.00 4.93 -4.71 1.61 2.88 -1.26 -4.97 113.62 112.10 2rel n SER 15 Ca 0.00 -3.32 -0.35 0.00 -1.33 0.00 0.00 58.87 53.87 2rel n SER 15 Cb 0.00 -1.03 0.11 0.00 -0.75 0.00 0.00 64.21 62.53 2rel n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2rel n PRO 17 N -2.77 1.66 -2.87 0.00 -0.04 -1.26 -5.04 135.00 124.68 2rel n PRO 17 Ca 0.15 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.28 2rel n PRO 17 Cb 0.49 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.89 2rel n PRO 17 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2rel s ILE 18 N 0.21 4.47 -0.11 0.52 1.10 -1.26 -5.06 121.20 121.07 2rel s ILE 18 Ca 0.00 1.33 0.03 0.00 -0.51 0.00 0.00 60.65 61.51 2rel s ILE 18 Cb 0.00 -3.61 0.00 0.00 0.15 0.00 0.00 42.46 39.00 2rel s ILE 18 CO 0.00 -0.31 -0.23 -0.63 -2.11 0.00 0.00 174.94 171.66 2rel s ILE 19 N -2.16 2.01 0.60 2.00 -1.09 -1.26 -4.89 121.20 116.41 2rel s ILE 19 Ca 0.60 -0.98 0.29 0.00 -2.23 0.00 0.00 60.65 58.33 2rel s ILE 19 Cb -0.09 -1.75 0.36 0.00 -1.58 0.00 0.00 42.46 39.40 2rel s ILE 19 CO 0.15 0.55 1.95 0.25 -1.23 0.00 0.00 174.94 176.61 2rel h LEU 20 N 6.93 0.00 0.00 2.97 6.46 -1.95 -3.45 115.31 126.27 2rel h LEU 20 Ca -0.24 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.52 2rel h LEU 20 Cb 1.22 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.15 2rel h LEU 20 CO 0.50 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 178.32 2rel n ILE 21 N -3.59 0.00 -2.52 4.05 0.13 -1.26 -4.83 119.36 111.34 2rel n ILE 21 Ca 0.05 0.00 -0.15 0.00 -1.10 0.00 0.00 62.75 61.55 2rel n ILE 21 Cb 0.54 0.00 -0.03 0.00 -0.84 0.00 0.00 39.64 39.32 2rel n ILE 21 CO 0.00 0.00 0.00 -2.11 2.80 0.00 0.00 176.55 177.24 2rel n ARG 22 N 0.03 -0.95 -1.14 9.51 0.00 -1.26 -1.12 116.66 121.73 2rel n ARG 22 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 57.85 57.90 2rel n ARG 22 Cb 0.00 -1.72 0.00 0.00 -0.00 0.00 0.00 32.46 30.74 2rel n ARG 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2rel n ALA 24 N -1.13 0.00 0.00 0.00 0.00 -0.28 -4.72 120.51 114.38 2rel n ALA 24 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2rel n ALA 24 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2rel n ALA 24 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2rel n MET 25 N 0.00 0.00 -0.73 0.00 2.81 -1.26 -4.75 117.12 113.19 2rel n MET 25 Ca 0.00 0.00 -0.33 0.00 -1.81 0.00 0.00 57.70 55.56 2rel n MET 25 Cb 0.00 0.00 0.15 0.00 -0.71 0.00 0.00 33.22 32.66 2rel n MET 25 CO 0.00 0.00 0.00 1.47 1.51 0.00 0.00 175.97 178.95 2rel n LEU 26 N 0.00 -1.81 -2.89 4.03 -0.00 -1.26 -4.25 117.00 110.82 2rel n LEU 26 Ca 0.00 0.03 -0.10 0.00 -0.00 0.00 0.00 56.01 55.95 2rel n LEU 26 Cb 0.00 -1.01 0.01 0.00 -0.00 0.00 0.00 43.42 42.42 2rel n LEU 26 CO 0.00 -3.32 0.00 0.59 -0.00 0.00 0.00 177.39 174.66 2rel n ASN 27 N -1.18 -7.82 -4.72 1.45 3.02 -1.26 -4.93 115.26 99.81 2rel n ASN 27 Ca 0.02 0.54 -0.42 0.00 -0.03 0.00 0.00 54.58 54.69 2rel n ASN 27 Cb 0.60 -5.17 -0.04 0.00 -0.61 0.00 0.00 39.78 34.57 2rel n ASN 27 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2rel s PRO 28 N -2.55 4.61 0.00 3.52 0.04 -1.26 -5.02 135.00 134.33 2rel s PRO 28 Ca 0.25 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2rel s PRO 28 Cb -0.06 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 31.08 2rel s PRO 28 CO 0.78 0.05 0.00 -0.35 0.04 0.00 0.00 177.00 177.51 2rel n PRO 29 N 3.31 0.60 -3.40 0.56 -0.04 -1.26 -4.63 135.00 130.13 2rel n PRO 29 Ca 0.04 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.40 2rel n PRO 29 Cb 0.49 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.87 2rel n PRO 29 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2rel s ASN 30 N -1.00 0.34 -0.00 3.54 -0.87 -1.26 -3.68 114.94 112.00 2rel s ASN 30 Ca 0.00 0.25 0.21 0.00 -1.57 0.00 0.00 52.86 51.74 2rel s ASN 30 Cb 0.00 1.04 -0.23 0.00 -0.02 0.00 0.00 41.25 42.03 2rel s ASN 30 CO 0.00 -0.30 0.85 -1.14 -2.57 0.00 0.00 177.10 173.94 2rel n ARG 31 N 5.36 0.20 -3.51 -0.60 0.63 -0.86 -4.98 116.66 112.90 2rel n ARG 31 Ca -0.04 -0.02 -0.14 0.00 -0.92 0.00 0.00 57.85 56.73 2rel n ARG 31 Cb 0.50 -1.48 -0.04 0.00 0.45 0.00 0.00 32.46 31.89 2rel n ARG 31 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2rel n LEU 33 N 0.21 0.00 0.00 0.00 4.77 -1.26 -4.54 117.00 116.18 2rel n LEU 33 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 2rel n LEU 33 Cb 0.61 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 2rel n LEU 33 CO 0.18 -0.07 0.00 2.29 -1.33 0.00 0.00 177.39 178.46 2rel n LYS 34 N -1.64 0.00 0.00 3.23 2.85 -1.26 -4.68 118.16 116.67 2rel n LYS 34 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2rel n LYS 34 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2rel n LYS 34 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2rel n ASP 35 N 0.00 0.00 0.00 -5.58 2.03 -1.26 -4.89 116.55 106.85 2rel n ASP 35 Ca 0.00 0.64 0.00 0.00 0.52 0.00 0.00 54.79 55.95 2rel n ASP 35 Cb 0.00 -0.14 0.00 0.00 -0.72 0.00 0.00 41.12 40.26 2rel n ASP 35 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2rel n THR 36 N -1.53 0.00 -1.51 5.18 5.66 -1.26 -5.07 114.28 115.75 2rel n THR 36 Ca 0.00 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.70 2rel n THR 36 Cb 0.00 0.00 -0.18 0.00 -1.55 0.00 0.00 70.33 68.60 2rel n THR 36 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2rel n ASP 37 N 0.00 -0.36 -2.69 1.09 -0.08 -1.26 -4.58 116.55 108.66 2rel n ASP 37 Ca 0.00 -0.32 -0.06 0.00 -1.51 0.00 0.00 54.79 52.91 2rel n ASP 37 Cb 0.00 -0.81 0.08 0.00 2.34 0.00 0.00 41.12 42.73 2rel n ASP 37 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2rel s PRO 39 N 0.24 3.87 0.00 0.00 0.04 -1.26 -4.35 135.00 133.54 2rel s PRO 39 Ca 0.25 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.26 2rel s PRO 39 Cb 0.25 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.67 2rel s PRO 39 CO -0.14 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 176.97 2rel n GLY 40 N -1.58 2.04 0.00 0.56 0.00 -1.26 -4.92 105.19 100.03 2rel n GLY 40 Ca 0.07 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2rel n GLY 40 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2rel n ILE 41 N 0.00 0.00 0.00 -0.61 -6.64 -1.26 -5.06 119.36 105.78 2rel n ILE 41 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 2rel n ILE 41 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 2rel n ILE 41 CO 0.00 0.00 0.00 1.17 -1.77 0.00 0.00 176.55 175.95 2rel n LYS 42 N 0.00 0.00 -0.41 6.28 4.81 -1.13 -4.98 118.16 122.73 2rel n LYS 42 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2rel n LYS 42 Cb 0.00 -0.44 0.00 0.00 0.02 0.00 0.00 35.03 34.61 2rel n LYS 42 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2rel n LYS 43 N -0.96 0.00 -4.26 1.64 4.81 -1.20 -4.98 118.16 113.22 2rel n LYS 43 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.11 2rel n LYS 43 Cb 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 34.96 2rel n LYS 43 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2rel s GLU 46 N -1.04 2.56 0.00 0.00 8.01 -1.26 -2.35 118.70 124.61 2rel s GLU 46 Ca 0.00 -0.68 0.00 0.00 0.01 0.00 0.00 54.97 54.30 2rel s GLU 46 Cb 0.00 -2.13 0.00 0.00 -4.31 0.00 0.00 34.13 27.69 2rel s GLU 46 CO 0.00 -0.06 0.00 0.41 0.01 0.00 0.00 175.26 175.62 2rel n GLY 47 N 4.20 4.60 3.64 -1.39 0.00 -1.07 -4.89 105.19 110.28 2rel n GLY 47 Ca -0.19 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 2rel n GLY 47 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rel s SER 48 N 1.48 6.38 -0.02 1.61 0.15 -1.26 -4.14 113.70 117.90 2rel s SER 48 Ca 0.00 2.05 -0.00 0.00 0.70 0.00 0.00 55.95 58.70 2rel s SER 48 Cb 0.00 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2rel s SER 48 CO 0.00 -1.19 0.00 0.00 1.20 0.00 0.00 173.24 173.25 2rel n GLY 50 N 0.05 2.04 3.45 0.00 0.00 -1.24 -4.58 105.19 104.91 2rel n GLY 50 Ca -0.00 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 2rel n GLY 50 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2rel s MET 51 N 0.00 1.68 0.11 1.61 0.00 -1.26 -2.61 119.30 118.84 2rel s MET 51 Ca 0.00 -1.21 -0.06 0.00 0.00 0.00 0.00 55.69 54.41 2rel s MET 51 Cb 0.00 -2.04 -0.02 0.00 0.00 0.00 0.00 34.83 32.77 2rel s MET 51 CO 0.00 0.48 0.17 0.00 0.00 0.00 0.00 175.02 175.66 2rel s ALA 52 N -1.08 0.11 -0.22 3.16 0.00 -0.99 -2.02 121.76 120.72 2rel s ALA 52 Ca 0.16 -0.91 -0.29 0.00 0.00 0.00 0.00 51.96 50.92 2rel s ALA 52 Cb -0.10 0.62 -0.03 0.00 0.00 0.00 0.00 23.12 23.61 2rel s ALA 52 CO 0.08 -0.53 1.80 0.00 0.00 0.00 0.00 175.76 177.12 2rel n PHE 54 N 9.37 -0.94 -3.61 0.00 3.72 -0.86 -4.82 117.46 120.33 2rel n PHE 54 Ca 0.22 -0.54 -0.37 0.00 -0.05 0.00 0.00 57.45 56.70 2rel n PHE 54 Cb 0.45 -0.10 -0.06 0.00 -0.94 0.00 0.00 39.48 38.83 2rel n PHE 54 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2rel s VAL 55 N -0.80 4.46 1.11 -4.37 1.01 -1.26 -2.85 120.40 117.70 2rel s VAL 55 Ca 0.05 -3.67 -0.18 0.00 0.00 0.00 0.00 61.98 58.18 2rel s VAL 55 Cb -0.00 -3.77 0.25 0.00 0.00 0.00 0.00 36.38 32.86 2rel s VAL 55 CO 0.03 -1.07 1.19 -2.16 0.00 0.00 0.00 175.10 173.10 2rel s PRO 56 N -1.13 -0.53 0.00 2.72 0.04 -1.26 -4.83 135.00 130.01 2rel s PRO 56 Ca 0.26 -0.21 0.24 0.00 0.04 0.00 0.00 61.00 61.33 2rel s PRO 56 Cb -0.09 -1.69 0.21 0.00 0.04 0.00 0.00 34.50 32.97 2rel s PRO 56 CO -0.11 -3.23 1.27 1.04 0.04 0.00 0.00 177.00 176.02