#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ike s SER 72 N 0.00 6.28 0.22 1.96 1.04 -1.26 0.12 113.70 122.06 2ike s SER 72 Ca 0.00 0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.76 2ike s SER 72 Cb 0.00 -2.13 -0.05 0.00 0.10 0.00 0.00 66.02 63.94 2ike s SER 72 CO 0.00 0.12 0.04 0.00 0.98 0.00 0.00 173.24 174.38 2ike s LEU 74 N -3.26 4.09 1.00 0.00 1.02 -1.26 -1.46 118.68 118.80 2ike s LEU 74 Ca 0.31 0.20 -0.12 0.00 0.02 0.00 0.00 54.13 54.53 2ike s LEU 74 Cb 0.07 -2.25 0.19 0.00 0.02 0.00 0.00 46.19 44.21 2ike s LEU 74 CO 0.09 -0.04 1.08 0.42 0.02 0.00 0.00 176.35 177.92 2ike s THR 75 N 1.46 2.29 0.59 5.49 -4.23 -0.89 -4.73 115.64 115.63 2ike s THR 75 Ca 0.11 0.09 0.29 0.00 -1.18 0.00 0.00 61.69 61.00 2ike s THR 75 Cb -0.15 -2.41 0.39 0.00 1.34 0.00 0.00 72.50 71.67 2ike s THR 75 CO 0.08 -0.12 1.80 1.55 -0.54 0.00 0.00 174.62 177.39 2ike h PRO 76 N -1.96 0.00 -0.37 3.99 0.13 -1.91 1.24 132.00 133.11 2ike h PRO 76 Ca -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2ike h PRO 76 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2ike h PRO 76 CO 0.53 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.05 2ike n ASP 77 N -3.62 2.56 -2.69 1.44 9.92 -1.26 -4.93 116.55 117.96 2ike n ASP 77 Ca 0.11 -1.91 -0.17 0.00 -0.53 0.00 0.00 54.79 52.29 2ike n ASP 77 Cb 0.81 -0.25 0.06 0.00 -0.64 0.00 0.00 41.12 41.10 2ike n ASP 77 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2ike n ASN 78 N 0.90 -5.15 -4.58 -2.24 4.13 0.43 -5.02 115.26 103.72 2ike n ASN 78 Ca 0.17 -0.38 -0.34 0.00 1.68 0.00 0.00 54.58 55.72 2ike n ASN 78 Cb 0.44 -3.76 -0.11 0.00 -1.54 0.00 0.00 39.78 34.80 2ike n ASN 78 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2ike s LYS 79 N -5.91 3.22 -0.06 3.52 -0.14 -1.25 -4.81 119.74 114.31 2ike s LYS 79 Ca 0.41 -0.49 -0.36 0.00 -1.36 0.00 0.00 55.97 54.17 2ike s LYS 79 Cb -0.18 -2.79 -0.14 0.00 -1.68 0.00 0.00 37.83 33.04 2ike s LYS 79 CO 0.51 0.50 1.73 -2.30 -0.76 0.00 0.00 175.35 175.02 2ike n PRO 80 N 2.75 1.84 0.00 -1.68 -0.02 -1.26 -2.10 135.00 134.53 2ike n PRO 80 Ca -0.18 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2ike n PRO 80 Cb 0.53 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2ike n PRO 80 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ike n GLY 81 N 3.94 4.43 3.09 -1.23 0.00 -0.53 -4.87 105.19 110.02 2ike n GLY 81 Ca 0.22 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.05 2ike n GLY 81 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ike s LYS 82 N 1.43 0.63 -0.18 1.61 -2.85 0.19 -2.52 119.74 118.04 2ike s LYS 82 Ca 0.00 -0.78 -0.04 0.00 -1.00 0.00 0.00 55.97 54.15 2ike s LYS 82 Cb 0.00 -0.50 -0.02 0.00 -2.06 0.00 0.00 37.83 35.25 2ike s LYS 82 CO 0.00 0.10 -0.03 0.00 0.10 0.00 0.00 175.35 175.52 2ike s VAL 84 N 0.82 0.17 1.00 0.00 -7.23 -0.52 -3.45 120.40 111.20 2ike s VAL 84 Ca -0.01 -1.43 -0.14 0.00 -1.81 0.00 0.00 61.98 58.59 2ike s VAL 84 Cb -0.14 -1.15 0.22 0.00 0.56 0.00 0.00 36.38 35.87 2ike s VAL 84 CO 0.02 -0.79 0.50 -3.20 -0.31 0.00 0.00 175.10 171.31 2ike n ASN 85 N 0.49 -3.18 -0.43 4.85 5.15 -1.26 -1.77 115.26 119.11 2ike n ASN 85 Ca -0.17 -0.50 0.09 0.00 -0.60 0.00 0.00 54.58 53.40 2ike n ASN 85 Cb 0.60 -0.73 0.38 0.00 -0.53 0.00 0.00 39.78 39.50 2ike n ASN 85 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 2ike n ILE 86 N -4.59 0.19 -1.59 -1.44 -6.64 -1.26 -3.60 119.36 100.42 2ike n ILE 86 Ca 0.08 -0.28 0.06 0.00 -1.77 0.00 0.00 62.75 60.84 2ike n ILE 86 Cb 0.34 0.21 0.10 0.00 -1.44 0.00 0.00 39.64 38.85 2ike n ILE 86 CO 0.00 0.00 0.00 2.29 -1.77 0.00 0.00 176.55 177.07 2ike n LYS 87 N 0.08 0.84 0.00 6.28 2.85 -1.26 -4.73 118.16 122.22 2ike n LYS 87 Ca 0.15 -2.21 0.00 0.00 -1.05 0.00 0.00 58.31 55.19 2ike n LYS 87 Cb 0.26 -1.07 0.00 0.00 -0.65 0.00 0.00 35.03 33.57 2ike n LYS 87 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2ike n LYS 88 N -0.76 0.68 -2.41 -1.58 4.81 -1.24 -4.99 118.16 112.68 2ike n LYS 88 Ca 0.11 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.12 2ike n LYS 88 Cb 0.73 -0.95 -0.02 0.00 0.02 0.00 0.00 35.03 34.80 2ike n LYS 88 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ike h THR 90 N 6.13 1.07 -0.64 0.00 2.02 -1.97 -1.15 112.91 118.37 2ike h THR 90 Ca -0.26 -0.38 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 2ike h THR 90 Cb 1.10 -0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 2ike h THR 90 CO 1.05 0.20 0.32 0.45 0.37 0.00 0.00 175.52 177.91 2ike h HIS 91 N 1.11 0.89 -0.63 3.16 3.86 -2.00 -2.29 115.15 119.25 2ike h HIS 91 Ca 0.42 -0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.52 2ike h HIS 91 Cb 0.21 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.37 2ike h HIS 91 CO -0.00 0.65 0.06 1.25 0.86 0.00 0.00 177.93 180.74 2ike h LEU 92 N 0.90 1.02 -1.19 2.43 5.85 -1.61 -2.65 115.31 120.07 2ike h LEU 92 Ca 0.22 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 2ike h LEU 92 Cb 0.08 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 2ike h LEU 92 CO -0.03 1.04 -0.09 0.00 -0.34 0.00 0.00 178.44 179.02 2ike h ALA 93 N 1.07 1.33 -0.40 1.25 0.00 -0.95 -2.19 119.26 119.36 2ike h ALA 93 Ca 0.19 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2ike h ALA 93 Cb 0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2ike h ALA 93 CO 0.02 0.45 0.01 0.93 0.00 0.00 0.00 179.25 180.66 2ike h GLU 94 N 0.43 0.71 -0.42 0.00 5.08 -1.10 -1.75 114.58 117.53 2ike h GLU 94 Ca 0.09 -0.22 -0.08 0.00 -1.00 0.00 0.00 59.36 58.14 2ike h GLU 94 Cb 0.42 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 2ike h GLU 94 CO 0.02 0.79 -0.07 0.82 -1.00 0.00 0.00 179.01 179.57 2ike h ILE 95 N 0.54 1.24 -0.04 3.13 1.08 -1.24 0.25 117.51 122.47 2ike h ILE 95 Ca 0.12 -1.06 -0.11 0.00 -0.39 0.00 0.00 64.86 63.41 2ike h ILE 95 Cb 0.47 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 2ike h ILE 95 CO 0.02 0.36 -0.50 -0.08 -0.69 0.00 0.00 178.15 177.27 2ike h GLU 96 N 0.66 0.10 0.04 2.37 4.57 -1.24 -2.63 114.58 118.45 2ike h GLU 96 Ca 0.12 -0.05 -0.28 0.00 -1.18 0.00 0.00 59.36 57.97 2ike h GLU 96 Cb 0.51 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.07 2ike h GLU 96 CO 0.03 0.58 -1.50 1.49 -1.18 0.00 0.00 179.01 178.42 2ike h GLU 97 N 0.08 0.09 -2.34 1.92 4.81 -0.95 -3.40 114.58 114.79 2ike h GLU 97 Ca 0.00 -0.15 -0.60 0.00 -0.13 0.00 0.00 59.36 58.48 2ike h GLU 97 Cb 0.91 0.06 -0.41 0.00 0.63 0.00 0.00 28.75 29.93 2ike h GLU 97 CO 0.07 0.85 -0.69 -0.25 -0.73 0.00 0.00 179.01 178.26 2ike n ASP 98 N -3.27 2.86 -4.59 1.04 8.00 0.85 -5.07 116.55 116.37 2ike n ASP 98 Ca -0.14 -3.23 -0.43 0.00 0.71 0.00 0.00 54.79 51.70 2ike n ASP 98 Cb 1.02 -0.68 -0.02 0.00 -0.02 0.00 0.00 41.12 41.42 2ike n ASP 98 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2ike s PRO 99 N -1.97 3.55 -0.14 -0.24 0.04 -1.00 -4.65 135.00 130.59 2ike s PRO 99 Ca 0.36 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.06 2ike s PRO 99 Cb 0.11 -4.01 0.03 0.00 0.04 0.00 0.00 34.50 30.66 2ike s PRO 99 CO -0.07 -1.61 -0.11 0.96 0.04 0.00 0.00 177.00 176.21 2ike s ILE 100 N 5.27 1.35 0.09 0.56 -4.36 -1.26 -5.02 121.20 117.82 2ike s ILE 100 Ca 0.54 -0.55 0.00 0.00 -0.26 0.00 0.00 60.65 60.38 2ike s ILE 100 Cb -0.10 -1.33 0.00 0.00 1.25 0.00 0.00 42.46 42.27 2ike s ILE 100 CO 0.30 0.37 0.00 0.61 0.24 0.00 0.00 174.94 176.46 2ike n GLY 101 N 4.83 -3.92 0.34 6.27 0.00 -1.26 -4.33 105.19 107.12 2ike n GLY 101 Ca -0.15 -0.75 0.18 0.00 0.00 0.00 0.00 46.02 45.30 2ike n GLY 101 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2ike h GLU 102 N 0.97 0.00 -0.30 1.61 4.57 -2.01 -0.78 114.58 118.64 2ike h GLU 102 Ca 0.00 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.25 2ike h GLU 102 Cb 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 2ike h GLU 102 CO 0.00 0.00 0.21 0.22 -1.18 0.00 0.00 179.01 178.26 2ike h ASP 103 N 0.00 0.06 0.53 1.04 1.82 -2.00 -0.32 116.42 117.55 2ike h ASP 103 Ca 0.07 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.55 2ike h ASP 103 Cb 0.48 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.47 2ike h ASP 103 CO -0.00 0.04 -0.70 1.05 -1.61 0.00 0.00 179.24 178.02 2ike h GLU 104 N 0.06 0.14 -0.17 0.28 4.11 -1.33 -2.55 114.58 115.13 2ike h GLU 104 Ca 0.14 -0.12 -0.18 0.00 0.07 0.00 0.00 59.36 59.27 2ike h GLU 104 Cb 0.47 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2ike h GLU 104 CO -0.01 0.78 -0.64 1.15 0.07 0.00 0.00 179.01 180.36 2ike h THR 105 N 0.10 1.32 -0.14 -1.06 2.02 -1.19 -2.81 112.91 111.14 2ike h THR 105 Ca -0.02 -1.91 -0.13 0.00 0.77 0.00 0.00 66.41 65.12 2ike h THR 105 Cb 1.24 1.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.52 2ike h THR 105 CO 0.10 0.60 -0.48 0.74 0.37 0.00 0.00 175.52 176.84 2ike h THR 106 N 0.44 1.33 -0.27 3.16 2.02 -1.36 -2.74 112.91 115.49 2ike h THR 106 Ca -0.01 -1.70 -0.10 0.00 0.77 0.00 0.00 66.41 65.37 2ike h THR 106 Cb 1.22 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 69.36 2ike h THR 106 CO 0.12 0.52 -0.24 1.88 0.37 0.00 0.00 175.52 178.17 2ike h TYR 107 N 0.30 0.58 -0.32 3.16 -1.99 -1.40 -1.57 116.97 115.73 2ike h TYR 107 Ca 0.02 -0.12 -0.16 0.00 2.00 0.00 0.00 58.73 60.47 2ike h TYR 107 Cb 0.96 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 39.54 2ike h TYR 107 CO 0.03 0.72 -0.42 1.25 -0.00 0.00 0.00 178.16 179.73 2ike h LEU 108 N 0.46 0.86 -0.80 3.88 6.46 -1.34 -2.68 115.31 122.15 2ike h LEU 108 Ca 0.07 -0.40 -0.13 0.00 -0.12 0.00 0.00 57.88 57.30 2ike h LEU 108 Cb 0.66 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.34 2ike h LEU 108 CO 0.05 1.16 -0.53 0.11 -0.62 0.00 0.00 178.44 178.61 2ike h LYS 109 N 0.65 0.18 0.00 1.25 1.79 -1.30 -2.91 116.57 116.23 2ike h LYS 109 Ca 0.05 -0.11 -0.10 0.00 -2.18 0.00 0.00 60.65 58.31 2ike h LYS 109 Cb 0.99 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.63 2ike h LYS 109 CO 0.09 0.67 -0.45 -0.91 -1.08 0.00 0.00 179.45 177.77 2ike h ASN 110 N 0.14 0.00 -0.85 0.86 2.35 -1.16 -2.95 115.58 113.97 2ike h ASN 110 Ca 0.00 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.21 2ike h ASN 110 Cb 0.99 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 39.11 2ike h ASN 110 CO 0.08 0.45 0.69 -1.54 -1.65 0.00 0.00 177.43 175.47 2ike n SER 111 N -3.88 6.36 -4.71 5.81 3.41 -1.02 -4.80 113.62 114.79 2ike n SER 111 Ca -0.01 -3.52 -0.40 0.00 -0.26 0.00 0.00 58.87 54.68 2ike n SER 111 Cb 0.49 -0.95 -0.05 0.00 -0.26 0.00 0.00 64.21 63.45 2ike n SER 111 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2ike s VAL 112 N -3.74 5.04 -1.00 -3.33 0.11 -1.12 -0.48 120.40 115.89 2ike s VAL 112 Ca 0.53 1.38 -0.12 0.00 -2.93 0.00 0.00 61.98 60.84 2ike s VAL 112 Cb 0.42 -4.01 -0.08 0.00 -1.53 0.00 0.00 36.38 31.18 2ike s VAL 112 CO 0.02 0.22 2.15 0.00 -3.33 0.00 0.00 175.10 174.16 2ike s ALA 114 N 3.75 2.41 0.00 0.00 0.00 -1.26 -4.07 121.76 122.59 2ike s ALA 114 Ca 0.49 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.43 2ike s ALA 114 Cb 0.13 -4.30 0.00 0.00 0.00 0.00 0.00 23.12 18.95 2ike s ALA 114 CO 0.01 -3.66 0.00 0.41 0.00 0.00 0.00 175.76 172.51 2ike n GLY 115 N 5.62 -1.59 0.18 0.00 0.00 -1.26 -4.96 105.19 103.18 2ike n GLY 115 Ca 0.14 0.55 0.04 0.00 0.00 0.00 0.00 46.02 46.75 2ike n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ike h PRO 116 N 0.00 0.00 -2.76 1.61 0.13 -2.02 -3.46 132.00 125.50 2ike h PRO 116 Ca 0.00 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.22 2ike h PRO 116 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 2ike h PRO 116 CO 0.00 0.40 0.32 -1.21 -0.23 0.00 0.00 178.00 177.28 2ike s GLU 117 N -3.85 1.48 -0.06 0.86 2.02 -1.26 -5.10 118.70 112.80 2ike s GLU 117 Ca -0.01 -0.77 -0.01 0.00 0.02 0.00 0.00 54.97 54.19 2ike s GLU 117 Cb 0.13 0.53 -0.00 0.00 0.10 0.00 0.00 34.13 34.89 2ike s GLU 117 CO 0.70 -0.67 -0.01 0.22 0.02 0.00 0.00 175.26 175.52 2ike h ASP 118 N 2.00 0.00 -0.31 -0.19 1.82 -1.90 -3.40 116.42 114.44 2ike h ASP 118 Ca -0.23 0.00 -0.59 0.00 -0.39 0.00 0.00 57.03 55.82 2ike h ASP 118 Cb 1.25 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.24 2ike h ASP 118 CO 0.26 0.28 2.15 -3.20 -1.61 0.00 0.00 179.24 177.13 2ike n ASN 119 N -3.47 3.50 -3.87 2.28 2.85 -1.26 -4.77 115.26 110.52 2ike n ASN 119 Ca -0.01 -2.77 -0.11 0.00 -0.11 0.00 0.00 54.58 51.58 2ike n ASN 119 Cb 0.02 -1.54 -0.11 0.00 1.24 0.00 0.00 39.78 39.40 2ike n ASN 119 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2ike s SER 120 N 4.81 0.01 0.18 1.20 0.01 -1.26 -4.44 113.70 114.21 2ike s SER 120 Ca 0.57 -0.13 0.04 0.00 1.31 0.00 0.00 55.95 57.74 2ike s SER 120 Cb 0.08 0.21 -0.05 0.00 0.21 0.00 0.00 66.02 66.48 2ike s SER 120 CO 0.07 -0.29 -0.07 -0.69 0.41 0.00 0.00 173.24 172.68 2ike s VAL 121 N -1.05 1.11 -0.19 3.43 1.01 -0.73 -0.94 120.40 123.04 2ike s VAL 121 Ca -0.11 -2.05 -0.03 0.00 0.00 0.00 0.00 61.98 59.78 2ike s VAL 121 Cb -0.06 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 2ike s VAL 121 CO 0.01 -0.59 -0.06 0.00 0.00 0.00 0.00 175.10 174.46