#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 6.07 0.25 1.96 1.04 -1.26 0.12 113.70 121.87 2ike s SER 72 Ca 0.00 0.14 0.08 0.00 0.48 0.00 0.00 55.95 56.65 2ike s SER 72 Cb 0.00 -2.08 -0.05 0.00 0.10 0.00 0.00 66.02 63.99 2ike s SER 72 CO 0.00 0.11 -0.12 0.00 0.98 0.00 0.00 173.24 174.22 2ike s LEU 74 N -3.40 3.79 0.99 0.00 1.02 -1.26 -1.05 118.68 118.77 2ike s LEU 74 Ca 0.26 -0.04 -0.12 0.00 0.02 0.00 0.00 54.13 54.26 2ike s LEU 74 Cb 0.00 -2.01 0.18 0.00 0.02 0.00 0.00 46.19 44.38 2ike s LEU 74 CO 0.10 0.02 1.08 0.42 0.02 0.00 0.00 176.35 178.00 2ike s THR 75 N 1.30 2.32 0.60 5.49 -4.23 -0.87 -4.73 115.64 115.52 2ike s THR 75 Ca 0.06 0.10 0.28 0.00 -1.18 0.00 0.00 61.69 60.95 2ike s THR 75 Cb -0.15 -2.35 0.37 0.00 1.34 0.00 0.00 72.50 71.71 2ike s THR 75 CO 0.05 -0.13 1.81 1.55 -0.54 0.00 0.00 174.62 177.36 2ike h PRO 76 N -1.97 0.00 -0.61 3.99 0.13 -1.92 1.09 132.00 132.72 2ike h PRO 76 Ca -0.52 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2ike h PRO 76 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2ike h PRO 76 CO 0.50 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.02 2ike n ASP 77 N -3.54 3.43 -2.42 1.44 9.92 -1.26 -4.93 116.55 119.19 2ike n ASP 77 Ca 0.09 -1.99 -0.15 0.00 -0.53 0.00 0.00 54.79 52.21 2ike n ASP 77 Cb 0.74 -0.40 0.05 0.00 -0.64 0.00 0.00 41.12 40.87 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 1.39 -4.55 -4.61 -2.24 4.13 0.38 -5.02 115.26 104.74 2ike n ASN 78 Ca 0.21 -0.34 -0.35 0.00 1.68 0.00 0.00 54.58 55.79 2ike n ASN 78 Cb 0.55 -3.31 -0.10 0.00 -1.54 0.00 0.00 39.78 35.38 2ike n ASN 78 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 2ike s LYS 79 N -5.75 3.94 -0.06 3.52 2.47 -1.25 -4.80 119.74 117.81 2ike s LYS 79 Ca 0.34 -0.36 -0.36 0.00 -1.56 0.00 0.00 55.97 54.03 2ike s LYS 79 Cb -0.15 -3.21 -0.14 0.00 -1.46 0.00 0.00 37.83 32.87 2ike s LYS 79 CO 0.45 0.24 1.70 -2.30 0.16 0.00 0.00 175.35 175.60 2ike n PRO 80 N 3.64 1.73 0.00 4.03 -0.02 -1.26 -2.05 135.00 141.07 2ike n PRO 80 Ca -0.17 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2ike n PRO 80 Cb 0.52 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 3.85 4.61 3.07 -1.23 0.00 -0.21 -4.89 105.19 110.40 2ike n GLY 81 Ca 0.22 -1.22 -0.16 0.00 0.00 0.00 0.00 46.02 44.86 2ike n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ike s LYS 82 N 1.08 0.66 -0.18 1.61 -0.14 0.19 -2.34 119.74 120.62 2ike s LYS 82 Ca 0.00 -0.65 -0.04 0.00 -1.36 0.00 0.00 55.97 53.92 2ike s LYS 82 Cb 0.00 -0.56 -0.02 0.00 -1.68 0.00 0.00 37.83 35.57 2ike s LYS 82 CO 0.00 0.13 -0.04 0.00 -0.76 0.00 0.00 175.35 174.68 2ike s VAL 84 N 0.72 0.18 1.06 0.00 -7.23 -0.46 -3.39 120.40 111.27 2ike s VAL 84 Ca -0.02 -1.45 -0.16 0.00 -1.81 0.00 0.00 61.98 58.54 2ike s VAL 84 Cb -0.14 -1.14 0.16 0.00 0.56 0.00 0.00 36.38 35.81 2ike s VAL 84 CO 0.02 -0.80 0.23 0.59 -0.31 0.00 0.00 175.10 174.83 2ike n ASN 85 N 0.51 -2.93 -0.16 4.85 4.13 -1.26 -2.08 115.26 118.32 2ike n ASN 85 Ca -0.17 -0.35 0.14 0.00 1.68 0.00 0.00 54.58 55.89 2ike n ASN 85 Cb 0.59 -0.82 0.76 0.00 -1.54 0.00 0.00 39.78 38.78 2ike n ASN 85 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 2ike n ILE 86 N -4.48 0.01 -1.35 2.41 -5.35 -1.26 -3.33 119.36 106.01 2ike n ILE 86 Ca 0.05 -0.09 0.08 0.00 -0.27 0.00 0.00 62.75 62.52 2ike n ILE 86 Cb 0.44 -0.16 0.13 0.00 -1.74 0.00 0.00 39.64 38.31 2ike n ILE 86 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2ike n LYS 87 N -0.59 1.15 0.00 6.28 5.02 -1.26 -4.70 118.16 124.05 2ike n LYS 87 Ca 0.21 -2.53 0.00 0.00 -2.02 0.00 0.00 58.31 53.97 2ike n LYS 87 Cb 0.18 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 2ike n LYS 87 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2ike n LYS 88 N -1.12 0.47 -2.28 1.97 3.00 -1.21 -5.01 118.16 113.98 2ike n LYS 88 Ca 0.14 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 58.03 2ike n LYS 88 Cb 0.68 -0.88 -0.02 0.00 0.00 0.00 0.00 35.03 34.81 2ike n LYS 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ike h THR 90 N 6.03 0.94 -0.81 0.00 1.35 -1.96 -1.16 112.91 117.30 2ike h THR 90 Ca -0.30 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2ike h THR 90 Cb 1.12 0.48 -0.04 0.00 -1.73 0.00 0.00 68.15 67.99 2ike h THR 90 CO 1.02 0.08 0.53 -0.74 -0.25 0.00 0.00 175.52 176.15 2ike h HIS 91 N 0.42 1.04 -0.32 4.73 2.76 -2.00 -1.52 115.15 120.26 2ike h HIS 91 Ca 0.24 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.28 2ike h HIS 91 Cb 0.40 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 2ike h HIS 91 CO -0.00 0.66 -0.40 -0.07 -1.30 0.00 0.00 177.93 176.82 2ike h LEU 92 N 1.11 0.82 -1.25 0.26 -0.00 -1.58 -2.83 115.31 111.84 2ike h LEU 92 Ca 0.30 -0.37 -0.06 0.00 -0.00 0.00 0.00 57.88 57.74 2ike h LEU 92 Cb -0.10 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 40.31 2ike h LEU 92 CO -0.06 1.12 -0.16 0.00 -0.00 0.00 0.00 178.44 179.34 2ike h ALA 93 N 0.92 1.38 -0.27 1.53 0.00 -1.11 -0.97 119.26 120.73 2ike h ALA 93 Ca 0.05 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 2ike h ALA 93 Cb 0.95 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2ike h ALA 93 CO 0.09 0.42 -0.21 1.49 0.00 0.00 0.00 179.25 181.05 2ike h GLU 94 N 0.29 0.62 -0.19 0.00 4.57 -1.14 -1.68 114.58 117.06 2ike h GLU 94 Ca 0.06 -0.30 -0.13 0.00 -1.18 0.00 0.00 59.36 57.80 2ike h GLU 94 Cb 0.46 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 2ike h GLU 94 CO 0.03 0.90 -0.44 0.97 -1.18 0.00 0.00 179.01 179.29 2ike h ILE 95 N 0.36 1.31 -0.12 2.32 6.09 -1.31 -2.90 117.51 123.26 2ike h ILE 95 Ca 0.05 -1.62 -0.11 0.00 -1.37 0.00 0.00 64.86 61.81 2ike h ILE 95 Cb 0.75 1.65 -0.01 0.00 0.47 0.00 0.00 36.82 39.68 2ike h ILE 95 CO 0.05 0.50 -0.41 -0.08 -3.07 0.00 0.00 178.15 175.14 2ike h GLU 96 N 0.37 0.28 -0.10 2.19 4.81 -1.12 -2.82 114.58 118.20 2ike h GLU 96 Ca 0.03 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 59.04 2ike h GLU 96 Cb 0.92 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2ike h GLU 96 CO 0.08 0.65 -0.31 0.93 -0.73 0.00 0.00 179.01 179.63 2ike h GLU 97 N 0.23 0.18 -6.27 1.92 4.39 -1.11 -3.44 114.58 110.48 2ike h GLU 97 Ca 0.02 -0.07 -0.46 0.00 0.34 0.00 0.00 59.36 59.19 2ike h GLU 97 Cb 0.83 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 2ike h GLU 97 CO 0.07 0.48 -0.38 -0.51 -1.16 0.00 0.00 179.01 177.51 2ike s ASP 98 N -6.89 5.62 0.58 1.42 1.01 -1.06 -5.08 116.67 112.27 2ike s ASP 98 Ca -0.04 -0.37 -0.18 0.00 0.71 0.00 0.00 52.55 52.66 2ike s ASP 98 Cb 0.14 -1.03 -0.07 0.00 1.01 0.00 0.00 42.92 42.98 2ike s ASP 98 CO 0.75 -0.45 0.77 -0.81 0.21 0.00 0.00 175.17 175.64 2ike n PRO 99 N -1.55 0.73 -4.13 8.23 -0.04 -1.26 -4.88 135.00 132.10 2ike n PRO 99 Ca 0.00 0.29 -0.35 0.00 -0.04 0.00 0.00 63.50 63.40 2ike n PRO 99 Cb 0.59 -1.96 -0.07 0.00 -0.04 0.00 0.00 33.50 32.02 2ike n PRO 99 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2ike s ILE 100 N -1.59 4.82 0.00 0.52 1.09 -1.26 -4.95 121.20 119.83 2ike s ILE 100 Ca 0.72 -0.19 0.00 0.00 -1.10 0.00 0.00 60.65 60.09 2ike s ILE 100 Cb -0.44 -3.12 0.00 0.00 -1.06 0.00 0.00 42.46 37.84 2ike s ILE 100 CO 0.50 0.50 0.00 0.61 -0.10 0.00 0.00 174.94 176.46 2ike n GLY 101 N 1.69 4.58 0.21 6.18 0.00 -1.26 -5.02 105.19 111.57 2ike n GLY 101 Ca -0.17 -1.75 0.01 0.00 0.00 0.00 0.00 46.02 44.11 2ike n GLY 101 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ike h GLU 102 N 0.00 0.18 0.00 1.61 4.39 -2.00 -2.59 114.58 116.17 2ike h GLU 102 Ca 0.00 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.59 2ike h GLU 102 Cb 0.00 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2ike h GLU 102 CO 0.00 0.48 -0.21 -0.44 -1.16 0.00 0.00 179.01 177.67 2ike h ASP 103 N 0.16 0.00 -0.05 1.42 3.32 -1.99 -1.82 116.42 117.46 2ike h ASP 103 Ca 0.02 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.89 2ike h ASP 103 Cb 0.63 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.18 2ike h ASP 103 CO 0.05 0.21 -0.62 -0.08 -1.72 0.00 0.00 179.24 177.08 2ike h GLU 104 N 0.00 0.66 -0.28 3.56 4.22 -1.86 -1.95 114.58 118.93 2ike h GLU 104 Ca -0.00 -0.45 -0.17 0.00 0.08 0.00 0.00 59.36 58.82 2ike h GLU 104 Cb 0.38 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 2ike h GLU 104 CO 0.03 1.07 -0.49 1.15 -2.18 0.00 0.00 179.01 178.59 2ike h THR 105 N 0.49 1.29 -0.17 0.32 2.02 -1.42 -2.14 112.91 113.31 2ike h THR 105 Ca -0.01 -1.68 -0.12 0.00 0.77 0.00 0.00 66.41 65.37 2ike h THR 105 Cb 1.20 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 69.18 2ike h THR 105 CO 0.12 0.54 -0.41 0.74 0.37 0.00 0.00 175.52 176.89 2ike h THR 106 N 0.61 1.31 -0.30 3.16 2.02 -1.33 -2.34 112.91 116.03 2ike h THR 106 Ca 0.03 -1.55 -0.14 0.00 0.77 0.00 0.00 66.41 65.52 2ike h THR 106 Cb 1.07 1.63 -0.00 0.00 -1.74 0.00 0.00 68.15 69.10 2ike h THR 106 CO 0.11 0.48 -0.35 1.88 0.37 0.00 0.00 175.52 178.00 2ike h TYR 107 N 0.32 0.94 -0.48 3.16 0.05 -1.25 -2.88 116.97 116.82 2ike h TYR 107 Ca 0.03 -0.29 -0.06 0.00 0.05 0.00 0.00 58.73 58.46 2ike h TYR 107 Cb 0.86 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.38 2ike h TYR 107 CO 0.02 1.07 0.07 1.25 -1.05 0.00 0.00 178.16 179.52 2ike h LEU 108 N 0.53 0.71 -0.85 3.88 7.12 -1.29 0.61 115.31 126.01 2ike h LEU 108 Ca 0.04 -0.14 -0.05 0.00 0.13 0.00 0.00 57.88 57.86 2ike h LEU 108 Cb 0.94 -0.19 -0.03 0.00 -0.53 0.00 0.00 40.66 40.85 2ike h LEU 108 CO 0.09 0.74 0.25 0.11 -0.13 0.00 0.00 178.44 179.49 2ike h LYS 109 N 0.72 1.10 0.00 1.25 1.57 -1.34 -2.01 116.57 117.86 2ike h LYS 109 Ca 0.15 -0.21 -0.21 0.00 -1.87 0.00 0.00 60.65 58.51 2ike h LYS 109 Cb 0.35 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 2ike h LYS 109 CO 0.01 0.92 -1.38 -2.95 -0.57 0.00 0.00 179.45 175.47 2ike h ASN 110 N 1.06 0.00 -0.85 0.86 7.08 -1.26 -3.33 115.58 119.14 2ike h ASN 110 Ca 0.24 0.00 -0.47 0.00 -3.08 0.00 0.00 56.30 52.99 2ike h ASN 110 Cb 0.26 0.00 -0.26 0.00 -2.08 0.00 0.00 38.32 36.24 2ike h ASN 110 CO -0.01 0.75 0.60 -0.24 -2.08 0.00 0.00 177.43 176.45 2ike n SER 111 N -3.02 4.44 -4.89 6.14 2.88 0.21 -4.36 113.62 115.02 2ike n SER 111 Ca -0.10 -3.42 -0.35 0.00 -1.33 0.00 0.00 58.87 53.67 2ike n SER 111 Cb 0.91 -0.83 -0.05 0.00 -0.75 0.00 0.00 64.21 63.48 2ike n SER 111 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2ike s VAL 112 N -3.09 5.41 -0.47 2.46 0.11 -0.77 -0.02 120.40 124.03 2ike s VAL 112 Ca 0.50 0.09 0.01 0.00 -2.93 0.00 0.00 61.98 59.64 2ike s VAL 112 Cb 0.41 -3.50 0.46 0.00 -1.53 0.00 0.00 36.38 32.22 2ike s VAL 112 CO 0.07 0.45 1.91 0.00 -3.33 0.00 0.00 175.10 174.20 2ike n ALA 114 N -0.68 -0.30 -0.72 0.00 0.00 -1.26 -5.00 120.51 112.55 2ike n ALA 114 Ca 0.51 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2ike n ALA 114 Cb 1.02 -0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.37 2ike n ALA 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ike n GLY 115 N -0.32 -1.72 0.41 0.00 0.00 -1.26 -4.82 105.19 97.49 2ike n GLY 115 Ca 0.00 -0.69 -0.14 0.00 0.00 0.00 0.00 46.02 45.19 2ike n GLY 115 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ike h PRO 116 N 0.00 -0.60 -5.00 1.61 0.11 -2.05 -3.40 132.00 122.68 2ike h PRO 116 Ca 0.00 0.04 -0.67 0.00 0.11 0.00 0.00 66.00 65.48 2ike h PRO 116 Cb 0.00 0.14 -0.35 0.00 0.11 0.00 0.00 31.00 30.90 2ike h PRO 116 CO 0.00 -0.40 -0.82 -1.83 -0.21 0.00 0.00 178.00 174.74 2ike s GLU 117 N -5.35 2.84 0.00 1.05 1.03 -1.26 -4.78 118.70 112.23 2ike s GLU 117 Ca -0.14 -0.94 0.00 0.00 0.03 0.00 0.00 54.97 53.92 2ike s GLU 117 Cb 0.05 -2.72 0.00 0.00 -0.80 0.00 0.00 34.13 30.67 2ike s GLU 117 CO 0.52 -0.31 0.00 -3.47 -1.33 0.00 0.00 175.26 170.67 2ike n ASP 118 N 4.60 0.00 -2.21 0.83 -0.08 -1.26 -5.09 116.55 113.34 2ike n ASP 118 Ca -0.19 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.08 2ike n ASP 118 Cb 0.48 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.94 2ike n ASP 118 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2ike n ASN 119 N 0.00 -5.37 -4.08 1.67 4.13 -1.26 -5.04 115.26 105.30 2ike n ASN 119 Ca 0.00 0.64 -0.09 0.00 1.68 0.00 0.00 54.58 56.81 2ike n ASN 119 Cb 0.00 -3.45 -0.09 0.00 -1.54 0.00 0.00 39.78 34.70 2ike n ASN 119 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2ike s SER 120 N -1.25 0.28 0.07 6.41 0.01 -1.26 -4.28 113.70 113.67 2ike s SER 120 Ca 0.05 -1.06 -0.07 0.00 1.31 0.00 0.00 55.95 56.18 2ike s SER 120 Cb -0.01 0.31 -0.01 0.00 0.21 0.00 0.00 66.02 66.51 2ike s SER 120 CO 0.44 -0.73 0.13 -0.69 0.41 0.00 0.00 173.24 172.79 2ike s VAL 121 N -3.99 0.15 -0.19 3.43 1.01 -0.88 -4.12 120.40 115.80 2ike s VAL 121 Ca 0.18 -1.25 -0.03 0.00 0.00 0.00 0.00 61.98 60.87 2ike s VAL 121 Cb 0.07 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 2ike s VAL 121 CO -0.02 -0.69 -0.06 0.00 0.00 0.00 0.00 175.10 174.33