#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2epu s SER 94 N 0.00 6.30 -0.16 1.61 0.15 -1.26 -4.96 113.70 115.38 2epu s SER 94 Ca 0.00 0.12 -0.05 0.00 0.70 0.00 0.00 55.95 56.72 2epu s SER 94 Cb 0.00 -2.55 0.08 0.00 -1.71 0.00 0.00 66.02 61.84 2epu s SER 94 CO 0.00 -1.60 0.30 -0.55 1.20 0.00 0.00 173.24 172.59 2epu s SER 95 N 3.57 0.36 0.00 5.45 0.15 -1.26 -5.14 113.70 116.83 2epu s SER 95 Ca 0.46 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.63 2epu s SER 95 Cb -0.09 0.82 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 2epu s SER 95 CO 0.24 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.04 2epu n GLY 96 N 5.36 1.49 3.55 9.45 0.00 -1.26 -5.16 105.19 118.61 2epu n GLY 96 Ca -0.06 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 2epu n GLY 96 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2epu s SER 97 N -0.10 -0.77 0.24 1.61 1.04 -1.26 -5.05 113.70 109.42 2epu s SER 97 Ca 0.00 1.34 -0.12 0.00 0.48 0.00 0.00 55.95 57.65 2epu s SER 97 Cb 0.00 1.27 0.34 0.00 0.10 0.00 0.00 66.02 67.73 2epu s SER 97 CO 0.00 -0.23 1.48 -1.54 0.98 0.00 0.00 173.24 173.93 2epu n SER 98 N 3.61 -0.47 0.00 7.02 3.41 -1.26 -4.91 113.62 121.02 2epu n SER 98 Ca -0.18 1.65 0.00 0.00 -0.26 0.00 0.00 58.87 60.08 2epu n SER 98 Cb 0.57 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2epu n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2epu n GLY 99 N -1.53 1.03 3.94 5.00 0.00 -1.26 -5.07 105.19 107.29 2epu n GLY 99 Ca 0.13 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 45.04 2epu n GLY 99 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2epu s THR 100 N 0.00 2.18 0.00 2.61 -4.23 -1.26 -5.00 115.64 109.94 2epu s THR 100 Ca 0.00 -0.26 0.00 0.00 -1.18 0.00 0.00 61.69 60.25 2epu s THR 100 Cb 0.00 -2.92 0.00 0.00 1.34 0.00 0.00 72.50 70.92 2epu s THR 100 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 2epu n GLY 101 N -3.11 -1.65 3.54 3.99 0.00 -1.26 -5.16 105.19 101.55 2epu n GLY 101 Ca 0.11 0.74 -0.24 0.00 0.00 0.00 0.00 46.02 46.63 2epu n GLY 101 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2epu s GLN 102 N 0.00 1.93 0.20 1.61 1.03 -1.26 -5.15 119.66 118.02 2epu s GLN 102 Ca 0.00 -1.63 0.08 0.00 0.04 0.00 0.00 55.36 53.85 2epu s GLN 102 Cb 0.00 -1.93 -0.05 0.00 0.03 0.00 0.00 33.01 31.07 2epu s GLN 102 CO 0.00 0.34 -0.15 0.15 -2.54 0.00 0.00 175.29 173.09 2epu s LYS 103 N -3.58 1.34 0.30 9.60 3.01 -1.26 -5.03 119.74 124.12 2epu s LYS 103 Ca 0.31 -1.56 0.25 0.00 -1.01 0.00 0.00 55.97 53.96 2epu s LYS 103 Cb -0.06 -1.20 1.05 0.00 -1.01 0.00 0.00 37.83 36.62 2epu s LYS 103 CO 0.17 0.21 1.75 -1.00 0.51 0.00 0.00 175.35 176.99 2epu h PRO 104 N 2.68 0.00 -2.48 -1.68 0.13 -1.86 -3.40 132.00 125.39 2epu h PRO 104 Ca -0.39 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.38 2epu h PRO 104 Cb 1.22 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.99 2epu h PRO 104 CO 0.60 0.00 -0.66 -0.06 -0.23 0.00 0.00 178.00 177.65 2epu s PHE 105 N -3.38 -0.22 -0.01 1.56 0.08 -1.26 -4.97 117.98 109.79 2epu s PHE 105 Ca 0.04 -0.07 0.07 0.00 0.12 0.00 0.00 56.93 57.08 2epu s PHE 105 Cb 0.09 -0.48 -0.02 0.00 -0.57 0.00 0.00 43.02 42.04 2epu s PHE 105 CO 0.41 -0.72 -0.22 -2.00 -0.10 0.00 0.00 175.22 172.59 2epu s GLU 106 N 2.29 1.71 -1.30 0.44 2.12 -1.26 -0.23 118.70 122.47 2epu s GLU 106 Ca 0.08 -0.82 -0.12 0.00 0.36 0.00 0.00 54.97 54.47 2epu s GLU 106 Cb -0.15 -1.69 0.14 0.00 0.26 0.00 0.00 34.13 32.68 2epu s GLU 106 CO -0.21 0.46 1.85 0.00 -0.54 0.00 0.00 175.26 176.82 2epu n THR 108 N 4.11 -0.25 -0.30 0.00 5.66 -1.26 0.67 114.28 122.92 2epu n THR 108 Ca 0.42 1.37 -0.12 0.00 -3.05 0.00 0.00 64.05 62.67 2epu n THR 108 Cb 0.39 -2.23 -0.10 0.00 -1.55 0.00 0.00 70.33 66.83 2epu n THR 108 CO 0.00 0.00 0.00 0.45 -3.05 0.00 0.00 175.07 172.47 2epu h HIS 109 N 0.00 -1.81 0.00 1.09 3.86 -1.97 -3.34 115.15 112.97 2epu h HIS 109 Ca 0.61 0.11 -0.16 0.00 -1.16 0.00 0.00 60.37 59.77 2epu h HIS 109 Cb 1.77 0.89 -0.03 0.00 1.06 0.00 0.00 27.41 31.11 2epu h HIS 109 CO -0.01 -0.42 -1.58 0.00 0.86 0.00 0.00 177.93 176.79 2epu n GLY 111 N 2.75 0.94 3.63 0.00 0.00 0.21 -5.05 105.19 107.68 2epu n GLY 111 Ca -0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 2epu n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2epu s LYS 112 N 0.00 3.99 0.48 1.61 2.47 -1.24 -4.67 119.74 122.39 2epu s LYS 112 Ca 0.00 1.15 -0.03 0.00 -1.56 0.00 0.00 55.97 55.53 2epu s LYS 112 Cb 0.00 -3.81 -0.01 0.00 -1.46 0.00 0.00 37.83 32.55 2epu s LYS 112 CO 0.00 -1.01 0.75 -1.54 0.16 0.00 0.00 175.35 173.71 2epu s SER 113 N 2.19 5.93 0.31 1.43 1.04 -1.26 0.35 113.70 123.69 2epu s SER 113 Ca 0.51 0.59 -0.09 0.00 0.48 0.00 0.00 55.95 57.43 2epu s SER 113 Cb -0.14 -1.83 0.01 0.00 0.10 0.00 0.00 66.02 64.16 2epu s SER 113 CO 0.19 -0.72 0.53 -0.36 0.98 0.00 0.00 173.24 173.87 2epu s PHE 114 N -2.69 0.58 -0.20 5.02 0.40 0.68 -4.94 117.98 116.83 2epu s PHE 114 Ca 0.49 -0.95 -0.16 0.00 -0.60 0.00 0.00 56.93 55.70 2epu s PHE 114 Cb -0.10 0.20 -0.20 0.00 0.51 0.00 0.00 43.02 43.43 2epu s PHE 114 CO 0.41 -1.15 0.15 -2.13 0.70 0.00 0.00 175.22 173.21 2epu n ARG 115 N -0.48 0.61 -4.23 0.44 3.00 -1.26 -4.03 116.66 110.72 2epu n ARG 115 Ca -0.02 0.45 -0.27 0.00 -0.00 0.00 0.00 57.85 58.01 2epu n ARG 115 Cb 0.61 -1.69 -0.06 0.00 0.00 0.00 0.00 32.46 31.32 2epu n ARG 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2epu s ALA 116 N -2.43 3.90 -0.02 5.13 0.00 -1.26 -4.71 121.76 122.36 2epu s ALA 116 Ca -0.29 -1.52 -0.24 0.00 0.00 0.00 0.00 51.96 49.90 2epu s ALA 116 Cb 0.07 -0.35 -0.18 0.00 0.00 0.00 0.00 23.12 22.66 2epu s ALA 116 CO 0.62 -0.20 1.14 -0.22 0.00 0.00 0.00 175.76 177.10 2epu h LYS 117 N 1.25 -0.16 -0.16 0.00 1.63 -1.94 -3.24 116.57 113.95 2epu h LYS 117 Ca -0.42 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 59.43 2epu h LYS 117 Cb 1.28 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.88 2epu h LYS 117 CO 0.68 0.28 -0.54 0.78 -3.45 0.00 0.00 179.45 177.20 2epu h GLY 118 N -0.66 -1.09 -0.98 5.01 0.00 -1.98 0.19 103.07 103.56 2epu h GLY 118 Ca -0.02 0.69 0.19 0.00 0.00 0.00 0.00 47.33 48.19 2epu h GLY 118 CO 0.03 -0.19 -0.28 -0.57 0.00 0.00 0.00 176.54 175.53 2epu h ASN 119 N -0.56 -1.02 0.10 0.19 -0.73 -1.99 0.15 115.58 111.72 2epu h ASN 119 Ca 0.04 0.30 -0.01 0.00 1.87 0.00 0.00 56.30 58.50 2epu h ASN 119 Cb 0.67 0.64 0.00 0.00 0.27 0.00 0.00 38.32 39.90 2epu h ASN 119 CO -0.45 -0.32 -0.05 0.25 -0.37 0.00 0.00 177.43 176.49 2epu h LEU 120 N -0.00 -0.12 -0.80 0.34 5.85 -1.34 -2.96 115.31 116.29 2epu h LEU 120 Ca 0.45 -0.25 0.19 0.00 0.84 0.00 0.00 57.88 59.11 2epu h LEU 120 Cb 0.70 0.03 -0.14 0.00 0.37 0.00 0.00 40.66 41.62 2epu h LEU 120 CO -1.01 0.19 -0.01 0.58 -0.34 0.00 0.00 178.44 177.85 2epu h VAL 121 N -0.44 0.28 -0.26 1.05 2.07 0.20 0.70 116.25 119.85 2epu h VAL 121 Ca -0.01 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2epu h VAL 121 Cb 0.36 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2epu h VAL 121 CO 0.02 0.02 0.12 0.74 0.02 0.00 0.00 177.57 178.49 2epu h THR 122 N 0.09 1.10 -0.07 2.57 2.02 -0.95 -2.69 112.91 114.98 2epu h THR 122 Ca 0.44 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 67.29 2epu h THR 122 Cb 0.79 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.97 2epu h THR 122 CO -0.72 0.11 -0.11 -0.74 0.37 0.00 0.00 175.52 174.44 2epu h HIS 123 N 0.36 0.24 -0.98 3.16 -0.00 0.50 -3.14 115.15 115.29 2epu h HIS 123 Ca 0.09 -0.08 0.24 0.00 -0.00 0.00 0.00 60.37 60.62 2epu h HIS 123 Cb 0.06 -0.05 -0.08 0.00 -0.00 0.00 0.00 27.41 27.34 2epu h HIS 123 CO 0.00 0.69 0.64 1.96 -0.00 0.00 0.00 177.93 181.22 2epu h GLN 124 N -0.28 0.36 -0.13 5.26 4.20 -0.76 0.26 115.11 124.02 2epu h GLN 124 Ca 0.01 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.73 2epu h GLN 124 Cb 0.66 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 2epu h GLN 124 CO 0.02 0.24 0.52 0.00 -0.67 0.00 0.00 178.83 178.95 2epu h ARG 125 N 0.37 0.00 -0.07 1.46 3.08 -1.46 0.64 114.38 118.40 2epu h ARG 125 Ca 0.53 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.42 2epu h ARG 125 Cb 1.39 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.43 2epu h ARG 125 CO -0.21 0.00 -0.64 -0.84 -1.07 0.00 0.00 179.97 177.21 2epu h ILE 126 N 0.00 1.39 0.10 2.04 3.07 -0.65 -3.30 117.51 120.17 2epu h ILE 126 Ca 0.06 -2.04 -0.01 0.00 1.55 0.00 0.00 64.86 64.42 2epu h ILE 126 Cb 1.11 2.04 0.00 0.00 -0.27 0.00 0.00 36.82 39.70 2epu h ILE 126 CO -0.00 0.61 -0.05 0.45 -1.05 0.00 0.00 178.15 178.11 2epu h HIS 127 N 0.19 -0.13 -0.42 0.16 3.86 0.13 -3.45 115.15 115.50 2epu h HIS 127 Ca -0.01 -0.00 -0.64 0.00 -1.16 0.00 0.00 60.37 58.56 2epu h HIS 127 Cb 1.16 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.66 2epu h HIS 127 CO 0.03 0.38 0.76 0.25 0.86 0.00 0.00 177.93 180.21 2epu n THR 128 N -4.85 0.00 0.00 2.45 -2.24 -1.11 -4.87 114.28 103.65 2epu n THR 128 Ca -0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2epu n THR 128 Cb 0.28 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 2epu n THR 128 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2epu n GLY 129 N 4.33 -2.16 3.85 3.38 0.00 -1.26 -4.85 105.19 108.47 2epu n GLY 129 Ca 0.32 0.02 -0.28 0.00 0.00 0.00 0.00 46.02 46.08 2epu n GLY 129 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2epu n GLU 130 N -0.06 -5.71 -3.15 1.61 -0.58 -1.26 -4.95 120.64 106.53 2epu n GLU 130 Ca 0.00 0.63 0.04 0.00 -0.42 0.00 0.00 57.16 57.41 2epu n GLU 130 Cb 0.00 -5.49 -0.01 0.00 -0.57 0.00 0.00 31.44 25.37 2epu n GLU 130 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2epu s LYS 131 N -6.49 0.44 -0.48 3.49 2.20 -1.26 -5.12 119.74 112.52 2epu s LYS 131 Ca 0.56 0.75 -0.15 0.00 -0.36 0.00 0.00 55.97 56.76 2epu s LYS 131 Cb -0.28 0.41 0.08 0.00 -1.51 0.00 0.00 37.83 36.53 2epu s LYS 131 CO 0.82 -0.52 0.40 -1.54 -0.36 0.00 0.00 175.35 174.15 2epu s SER 132 N 2.89 6.15 0.00 1.43 1.04 -1.26 -4.93 113.70 119.02 2epu s SER 132 Ca 0.14 -1.36 0.00 0.00 0.48 0.00 0.00 55.95 55.21 2epu s SER 132 Cb -0.13 -2.18 0.00 0.00 0.10 0.00 0.00 66.02 63.81 2epu s SER 132 CO -0.19 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 173.98 2epu n GLY 133 N 5.20 0.74 3.73 7.32 0.00 -1.26 -4.99 105.19 115.95 2epu n GLY 133 Ca -0.13 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 2epu n GLY 133 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2epu s PRO 134 N -4.57 4.38 -1.26 1.61 0.04 -1.26 -4.94 135.00 129.00 2epu s PRO 134 Ca 0.00 2.04 -0.17 0.00 0.04 0.00 0.00 61.00 62.92 2epu s PRO 134 Cb 0.00 -3.21 0.11 0.00 0.04 0.00 0.00 34.50 31.44 2epu s PRO 134 CO 0.00 -0.27 1.62 -1.12 0.04 0.00 0.00 177.00 177.28 2epu s SER 135 N 0.43 6.92 -1.60 6.66 0.01 -1.26 -4.51 113.70 120.35 2epu s SER 135 Ca 0.57 -2.63 -0.18 0.00 1.31 0.00 0.00 55.95 55.03 2epu s SER 135 Cb -0.36 -2.52 0.18 0.00 0.21 0.00 0.00 66.02 63.53 2epu s SER 135 CO 0.37 -1.02 0.45 -0.24 0.41 0.00 0.00 173.24 173.21 2epu n SER 136 N 7.42 -1.26 0.00 2.44 2.88 -1.26 -5.30 113.62 118.53 2epu n SER 136 Ca 0.44 -1.09 0.02 0.00 -1.33 0.00 0.00 58.87 56.91 2epu n SER 136 Cb 0.45 -1.39 0.10 0.00 -0.75 0.00 0.00 64.21 62.62 2epu n SER 136 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42