#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vvv s LEU 88 N 0.00 2.18 0.41 -0.35 1.43 -1.26 -4.47 118.68 116.63 2vvv s LEU 88 Ca 0.00 -0.46 0.29 0.00 -1.03 0.00 0.00 54.13 52.93 2vvv s LEU 88 Cb 0.00 -0.48 1.20 0.00 0.03 0.00 0.00 46.19 46.93 2vvv s LEU 88 CO 0.00 -0.02 1.86 0.00 0.23 0.00 0.00 176.35 178.42 2vvv n SER 90 N -2.68 0.00 -4.05 0.00 3.41 -1.26 -2.80 113.62 106.24 2vvv n SER 90 Ca 0.01 0.03 -0.32 0.00 -0.26 0.00 0.00 58.87 58.34 2vvv n SER 90 Cb 0.27 -0.34 -0.15 0.00 -0.26 0.00 0.00 64.21 63.72 2vvv n SER 90 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2vvv s LEU 91 N -2.69 2.86 -1.25 1.04 1.43 -1.08 -4.71 118.68 114.29 2vvv s LEU 91 Ca 0.24 -1.12 -0.04 0.00 -1.03 0.00 0.00 54.13 52.18 2vvv s LEU 91 Cb 0.20 -1.44 0.02 0.00 0.03 0.00 0.00 46.19 45.01 2vvv s LEU 91 CO 0.47 -0.15 0.25 0.47 0.23 0.00 0.00 176.35 177.62 2vvv n ASP 92 N 4.54 -4.30 -3.12 2.29 8.00 -1.26 -1.86 116.55 120.84 2vvv n ASP 92 Ca -0.15 -0.08 -0.22 0.00 0.71 0.00 0.00 54.79 55.05 2vvv n ASP 92 Cb 0.45 -3.58 0.01 0.00 -0.02 0.00 0.00 41.12 37.98 2vvv n ASP 92 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2vvv n ASN 93 N -2.08 -4.82 -0.96 -2.24 5.15 -1.12 -0.74 115.26 108.45 2vvv n ASN 93 Ca -0.11 -0.29 -0.13 0.00 -0.60 0.00 0.00 54.58 53.46 2vvv n ASN 93 Cb 0.60 -3.95 -0.05 0.00 -0.53 0.00 0.00 39.78 35.84 2vvv n ASN 93 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2vvv n GLY 94 N -1.29 1.27 2.40 8.20 0.00 -0.78 -1.30 105.19 113.68 2vvv n GLY 94 Ca -0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 46.02 45.78 2vvv n GLY 94 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2vvv n ASP 95 N -0.82 -4.31 -4.78 1.61 8.00 0.08 -4.95 116.55 111.38 2vvv n ASP 95 Ca -0.13 0.09 -0.38 0.00 0.71 0.00 0.00 54.79 55.08 2vvv n ASP 95 Cb 0.53 -2.12 -0.06 0.00 -0.02 0.00 0.00 41.12 39.45 2vvv n ASP 95 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vvv h ASP 97 N 3.57 0.96 0.00 0.00 5.19 -1.54 -3.46 116.42 121.14 2vvv h ASP 97 Ca -0.47 -0.26 0.00 0.00 -0.62 0.00 0.00 57.03 55.68 2vvv h ASP 97 Cb 1.20 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 40.45 2vvv h ASP 97 CO 0.66 1.02 0.00 0.00 -3.12 0.00 0.00 179.24 177.80 2vvv n GLN 98 N -4.18 0.00 -2.42 3.56 6.02 -1.26 -4.99 117.38 114.10 2vvv n GLN 98 Ca 0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.61 2vvv n GLN 98 Cb 0.34 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.56 2vvv n GLN 98 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2vvv s PHE 99 N 2.17 3.50 -0.03 1.08 0.08 -0.62 -4.90 117.98 119.26 2vvv s PHE 99 Ca 0.00 1.58 0.05 0.00 0.12 0.00 0.00 56.93 58.68 2vvv s PHE 99 Cb 0.00 -3.36 -0.01 0.00 -0.57 0.00 0.00 43.02 39.08 2vvv s PHE 99 CO 0.00 -0.86 -0.19 0.00 -0.10 0.00 0.00 175.22 174.07 2vvv s HIS 101 N -0.24 0.26 -0.61 0.00 3.76 -0.49 -4.99 115.29 112.99 2vvv s HIS 101 Ca 0.02 -0.45 -0.17 0.00 -0.15 0.00 0.00 55.06 54.32 2vvv s HIS 101 Cb -0.10 -0.18 0.14 0.00 1.11 0.00 0.00 32.58 33.55 2vvv s HIS 101 CO 0.01 -0.15 0.61 -1.21 -0.85 0.00 0.00 174.74 173.15 2vvv s GLU 102 N -1.25 3.11 -0.00 1.40 2.02 -1.26 0.55 118.70 123.27 2vvv s GLU 102 Ca -0.13 -1.71 0.06 0.00 0.02 0.00 0.00 54.97 53.20 2vvv s GLU 102 Cb -0.09 -4.33 -0.03 0.00 0.10 0.00 0.00 34.13 29.79 2vvv s GLU 102 CO -0.01 -1.39 -0.17 -2.00 0.02 0.00 0.00 175.26 171.71 2vvv s GLU 103 N 1.72 2.27 -1.56 1.61 2.12 0.55 -4.42 118.70 120.99 2vvv s GLU 103 Ca 0.08 -0.85 -0.02 0.00 0.36 0.00 0.00 54.97 54.54 2vvv s GLU 103 Cb -0.25 -2.27 0.02 0.00 0.26 0.00 0.00 34.13 31.90 2vvv s GLU 103 CO 0.02 0.58 0.12 1.04 -0.54 0.00 0.00 175.26 176.47 2vvv n GLN 104 N 1.93 -1.28 -3.29 4.30 6.02 -1.26 -0.07 117.38 123.74 2vvv n GLN 104 Ca -0.16 0.14 -0.23 0.00 -0.01 0.00 0.00 57.00 56.73 2vvv n GLN 104 Cb 0.52 -3.82 0.01 0.00 1.02 0.00 0.00 30.24 27.97 2vvv n GLN 104 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2vvv n ASN 105 N -2.86 -4.73 -3.76 1.08 4.13 -1.26 -4.98 115.26 102.88 2vvv n ASN 105 Ca -0.28 -0.39 -0.13 0.00 1.68 0.00 0.00 54.58 55.46 2vvv n ASN 105 Cb 0.67 -3.85 -0.11 0.00 -1.54 0.00 0.00 39.78 34.96 2vvv n ASN 105 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2vvv s SER 106 N -2.77 -0.34 0.10 6.41 0.15 0.90 -5.06 113.70 113.10 2vvv s SER 106 Ca 0.39 0.63 -0.31 0.00 0.70 0.00 0.00 55.95 57.36 2vvv s SER 106 Cb -0.19 0.65 -0.08 0.00 -1.71 0.00 0.00 66.02 64.69 2vvv s SER 106 CO 0.48 -0.14 1.42 -0.69 1.20 0.00 0.00 173.24 175.51 2vvv s VAL 107 N 0.06 3.30 -0.08 4.45 1.01 -1.26 0.21 120.40 128.09 2vvv s VAL 107 Ca -0.01 0.90 0.02 0.00 0.00 0.00 0.00 61.98 62.89 2vvv s VAL 107 Cb -0.03 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.79 2vvv s VAL 107 CO 0.01 0.06 -0.13 -0.69 0.00 0.00 0.00 175.10 174.34 2vvv s VAL 108 N 1.35 1.26 0.33 2.92 1.01 0.19 -4.88 120.40 122.59 2vvv s VAL 108 Ca 0.65 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 62.06 2vvv s VAL 108 Cb -0.37 -1.16 -0.05 0.00 0.00 0.00 0.00 36.38 34.80 2vvv s VAL 108 CO 0.30 0.39 0.60 0.00 0.00 0.00 0.00 175.10 176.39 2vvv s SER 110 N -3.45 0.43 0.05 0.00 1.04 -0.20 -4.99 113.70 106.58 2vvv s SER 110 Ca 0.44 -1.28 -0.00 0.00 0.48 0.00 0.00 55.95 55.59 2vvv s SER 110 Cb -0.10 0.75 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 2vvv s SER 110 CO 0.33 -1.47 -0.04 0.00 0.98 0.00 0.00 173.24 173.04 2vvv s ALA 112 N -3.50 1.69 0.24 0.00 0.00 -1.26 -4.92 121.76 114.01 2vvv s ALA 112 Ca 0.04 0.12 -0.31 0.00 0.00 0.00 0.00 51.96 51.81 2vvv s ALA 112 Cb 0.05 -3.25 -0.13 0.00 0.00 0.00 0.00 23.12 19.79 2vvv s ALA 112 CO -0.08 -2.27 1.45 -2.13 0.00 0.00 0.00 175.76 172.73 2vvv n ARG 113 N -3.85 2.15 -0.02 0.00 0.63 -1.26 -2.23 116.66 112.08 2vvv n ARG 113 Ca 0.08 0.77 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 2vvv n ARG 113 Cb 0.54 -2.45 0.00 0.00 0.45 0.00 0.00 32.46 31.00 2vvv n ARG 113 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2vvv n GLY 114 N 2.24 0.65 3.12 5.14 0.00 -1.26 -4.62 105.19 110.47 2vvv n GLY 114 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 2vvv n GLY 114 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vvv s TYR 115 N -2.03 0.89 -0.05 1.61 1.51 -0.95 -1.23 117.35 117.11 2vvv s TYR 115 Ca 0.00 -0.55 0.07 0.00 -1.01 0.00 0.00 57.07 55.58 2vvv s TYR 115 Cb 0.00 -0.51 -0.01 0.00 -0.11 0.00 0.00 41.96 41.32 2vvv s TYR 115 CO 0.00 -0.04 -0.25 0.99 -1.11 0.00 0.00 175.55 175.15 2vvv s THR 116 N -1.72 2.12 0.13 -0.71 2.01 0.57 -4.79 115.64 113.25 2vvv s THR 116 Ca -0.04 -1.06 -0.31 0.00 0.31 0.00 0.00 61.69 60.59 2vvv s THR 116 Cb -0.08 -1.76 -0.08 0.00 0.01 0.00 0.00 72.50 70.59 2vvv s THR 116 CO 0.00 0.57 1.43 -0.22 -0.69 0.00 0.00 174.62 175.72 2vvv s LEU 117 N -0.33 4.37 1.01 4.42 2.96 -1.26 -0.83 118.68 129.01 2vvv s LEU 117 Ca 0.02 2.40 -0.12 0.00 -0.22 0.00 0.00 54.13 56.21 2vvv s LEU 117 Cb -0.12 -3.59 0.20 0.00 0.50 0.00 0.00 46.19 43.17 2vvv s LEU 117 CO 0.02 -0.69 1.08 0.00 -1.32 0.00 0.00 176.35 175.44 2vvv s ALA 118 N 1.06 0.72 0.47 5.97 0.00 0.01 -4.88 121.76 125.11 2vvv s ALA 118 Ca 0.65 0.06 0.13 0.00 0.00 0.00 0.00 51.96 52.80 2vvv s ALA 118 Cb -0.38 -3.27 1.10 0.00 0.00 0.00 0.00 23.12 20.56 2vvv s ALA 118 CO 0.31 -3.05 2.11 -0.44 0.00 0.00 0.00 175.76 174.68 2vvv h ASP 119 N -2.06 0.18 0.37 0.00 3.32 -1.93 -1.10 116.42 115.20 2vvv h ASP 119 Ca -0.53 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.52 2vvv h ASP 119 Cb 1.30 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2vvv h ASP 119 CO 0.50 0.14 0.00 -0.46 -1.72 0.00 0.00 179.24 177.70 2vvv n ASN 120 N -4.50 0.00 -0.14 6.45 6.94 -1.26 -4.87 115.26 117.87 2vvv n ASN 120 Ca -0.01 -0.08 -0.02 0.00 -0.02 0.00 0.00 54.58 54.46 2vvv n ASN 120 Cb 0.09 -0.26 -0.01 0.00 -2.36 0.00 0.00 39.78 37.24 2vvv n ASN 120 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2vvv n GLY 121 N 0.54 0.49 1.05 4.83 0.00 -0.42 -4.82 105.19 106.87 2vvv n GLY 121 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2vvv n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2vvv n LYS 122 N -2.00 0.00 -2.22 1.61 4.76 -1.26 -4.24 118.16 114.82 2vvv n LYS 122 Ca -0.02 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.10 2vvv n LYS 122 Cb 0.18 -0.47 -0.02 0.00 -1.84 0.00 0.00 35.03 32.88 2vvv n LYS 122 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2vvv s ALA 123 N -2.00 2.99 -0.19 7.82 0.00 -1.26 -1.37 121.76 127.75 2vvv s ALA 123 Ca 0.00 0.18 -0.02 0.00 0.00 0.00 0.00 51.96 52.13 2vvv s ALA 123 Cb 0.00 -3.14 -0.00 0.00 0.00 0.00 0.00 23.12 19.98 2vvv s ALA 123 CO 0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 175.76 175.20 2vvv s ILE 125 N 1.13 4.01 0.43 0.00 -1.09 -0.01 -4.88 121.20 120.79 2vvv s ILE 125 Ca 0.01 -0.27 -0.26 0.00 -2.23 0.00 0.00 60.65 57.90 2vvv s ILE 125 Cb -0.14 -2.86 -0.09 0.00 -1.58 0.00 0.00 42.46 37.79 2vvv s ILE 125 CO -0.03 0.37 1.40 -2.84 -1.23 0.00 0.00 174.94 172.61 2vvv s PRO 126 N 1.55 3.81 0.00 2.79 0.02 -1.26 -0.32 135.00 141.60 2vvv s PRO 126 Ca 0.06 2.36 0.23 0.00 0.02 0.00 0.00 61.00 63.67 2vvv s PRO 126 Cb -0.15 -2.72 0.09 0.00 0.02 0.00 0.00 34.50 31.74 2vvv s PRO 126 CO 0.01 -0.69 1.17 0.25 -0.33 0.00 0.00 177.00 177.41 2vvv n THR 127 N -0.03 0.00 -4.11 0.99 -2.24 -0.36 -4.83 114.28 103.69 2vvv n THR 127 Ca 0.04 -0.38 -0.12 0.00 -2.27 0.00 0.00 64.05 61.32 2vvv n THR 127 Cb 0.42 1.38 -0.07 0.00 -2.10 0.00 0.00 70.33 69.96 2vvv n THR 127 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2vvv s GLY 128 N -2.22 1.14 0.32 3.38 0.00 -1.26 -5.06 107.32 103.62 2vvv s GLY 128 Ca 0.23 -1.38 0.26 0.00 0.00 0.00 0.00 44.72 43.83 2vvv s GLY 128 CO 0.43 -1.06 1.74 -0.56 0.00 0.00 0.00 173.10 173.65 2vvv h PRO 129 N 2.40 0.00 -2.16 2.90 0.13 -1.98 -3.35 132.00 129.95 2vvv h PRO 129 Ca -0.31 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.28 2vvv h PRO 129 Cb 1.25 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.97 2vvv h PRO 129 CO 0.44 0.00 -0.88 0.66 -0.23 0.00 0.00 178.00 177.99 2vvv n TYR 130 N -2.58 2.33 -2.02 1.56 4.01 -1.26 -5.10 117.16 114.10 2vvv n TYR 130 Ca 0.04 -3.92 -0.37 0.00 -0.16 0.00 0.00 57.90 53.49 2vvv n TYR 130 Cb 0.42 -0.46 0.02 0.00 -0.31 0.00 0.00 39.34 39.01 2vvv n TYR 130 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2vvv s PRO 131 N -2.94 3.29 0.50 -0.72 0.04 -1.26 -4.92 135.00 128.99 2vvv s PRO 131 Ca 0.45 1.94 -0.22 0.00 0.04 0.00 0.00 61.00 63.21 2vvv s PRO 131 Cb 0.30 -2.19 -0.08 0.00 0.04 0.00 0.00 34.50 32.57 2vvv s PRO 131 CO -0.11 -0.98 1.00 0.00 0.04 0.00 0.00 177.00 176.95 2vvv n GLY 133 N 1.20 0.81 3.77 0.00 0.00 -1.26 -5.00 105.19 104.71 2vvv n GLY 133 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2vvv n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vvv s LYS 134 N -0.14 4.04 0.58 1.61 -0.14 -1.16 -5.09 119.74 119.44 2vvv s LYS 134 Ca 0.00 -0.08 -0.19 0.00 -1.36 0.00 0.00 55.97 54.34 2vvv s LYS 134 Cb 0.00 -3.36 -0.04 0.00 -1.68 0.00 0.00 37.83 32.75 2vvv s LYS 134 CO 0.00 0.40 1.22 -0.65 -0.76 0.00 0.00 175.35 175.57 2vvv s GLN 135 N 0.02 3.05 -1.11 1.68 -0.21 -1.26 -4.92 119.66 116.91 2vvv s GLN 135 Ca 0.13 1.88 -0.14 0.00 0.02 0.00 0.00 55.36 57.25 2vvv s GLN 135 Cb -0.12 -2.01 0.19 0.00 1.00 0.00 0.00 33.01 32.07 2vvv s GLN 135 CO 0.02 -1.16 1.26 0.95 -2.12 0.00 0.00 175.29 174.24 2vvv s THR 136 N -1.55 5.20 -0.19 -0.19 -4.23 -1.26 -4.76 115.64 108.66 2vvv s THR 136 Ca 0.76 -2.57 0.10 0.00 -1.18 0.00 0.00 61.69 58.80 2vvv s THR 136 Cb -0.32 -4.80 -0.19 0.00 1.34 0.00 0.00 72.50 68.54 2vvv s THR 136 CO 0.35 -1.47 -0.04 0.18 -0.54 0.00 0.00 174.62 173.10 2vvv n LEU 137 N 5.14 1.10 -4.60 4.79 4.77 -1.26 -4.79 117.00 122.15 2vvv n LEU 137 Ca 0.30 -0.04 -0.43 0.00 -0.03 0.00 0.00 56.01 55.81 2vvv n LEU 137 Cb 0.44 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 2vvv n LEU 137 CO 0.55 0.60 0.79 -0.70 -1.33 0.00 0.00 177.39 177.29 2vvv s GLU 138 N -2.44 3.82 0.25 3.23 2.12 -1.26 -5.03 118.70 119.40 2vvv s GLU 138 Ca -0.17 0.57 -0.30 0.00 0.36 0.00 0.00 54.97 55.44 2vvv s GLU 138 Cb 0.06 -3.81 -0.10 0.00 0.26 0.00 0.00 34.13 30.54 2vvv s GLU 138 CO 0.65 -0.99 1.40 -0.98 -0.54 0.00 0.00 175.26 174.80 2vvv s ARG 139 N 3.56 4.29 0.00 4.30 1.70 -1.26 -5.20 118.95 126.34 2vvv s ARG 139 Ca 0.39 2.26 0.25 0.00 -0.47 0.00 0.00 55.73 58.15 2vvv s ARG 139 Cb -0.12 -3.12 0.35 0.00 -0.57 0.00 0.00 34.95 31.50 2vvv s ARG 139 CO 0.20 -0.37 1.35 0.54 -1.08 0.00 0.00 175.30 175.94