#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a20 s GLU 84 N 0.00 2.97 0.06 -1.09 2.12 -1.26 -5.06 118.70 116.44 2a20 s GLU 84 Ca 0.00 -1.88 -0.07 0.00 0.36 0.00 0.00 54.97 53.38 2a20 s GLU 84 Cb 0.00 -4.22 -0.05 0.00 0.26 0.00 0.00 34.13 30.12 2a20 s GLU 84 CO 0.00 -1.29 0.32 -0.65 -0.54 0.00 0.00 175.26 173.10 2a20 s GLN 85 N 1.24 3.62 -0.36 4.30 -0.21 -1.26 -5.07 119.66 121.92 2a20 s GLN 85 Ca 0.07 -0.04 0.03 0.00 0.02 0.00 0.00 55.36 55.43 2a20 s GLN 85 Cb -0.25 -3.00 0.15 0.00 1.00 0.00 0.00 33.01 30.91 2a20 s GLN 85 CO -0.00 0.58 0.38 0.15 -2.12 0.00 0.00 175.29 174.28 2a20 s LYS 86 N -2.05 0.59 0.00 2.91 1.02 -1.26 -5.13 119.74 115.83 2a20 s LYS 86 Ca 0.32 -0.69 0.00 0.00 0.02 0.00 0.00 55.97 55.62 2a20 s LYS 86 Cb -0.13 -0.67 0.00 0.00 -0.52 0.00 0.00 37.83 36.51 2a20 s LYS 86 CO 0.19 -1.16 0.00 0.41 -0.92 0.00 0.00 175.35 173.87 2a20 n GLY 87 N 4.45 2.34 3.70 -3.33 0.00 -1.26 -5.11 105.19 105.98 2a20 n GLY 87 Ca 0.09 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 2a20 n GLY 87 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2a20 s ASP 88 N 0.00 6.54 0.92 1.61 -4.77 -1.26 -4.98 116.67 114.72 2a20 s ASP 88 Ca 0.00 2.61 -0.12 0.00 -3.30 0.00 0.00 52.55 51.74 2a20 s ASP 88 Cb 0.00 -2.57 0.14 0.00 -1.09 0.00 0.00 42.92 39.40 2a20 s ASP 88 CO 0.00 -0.92 1.09 0.00 0.70 0.00 0.00 175.17 176.05 2a20 s ALA 89 N 2.38 1.43 0.35 2.11 0.00 -1.26 -5.02 121.76 121.74 2a20 s ALA 89 Ca 0.75 -0.13 -0.22 0.00 0.00 0.00 0.00 51.96 52.36 2a20 s ALA 89 Cb -0.43 -3.17 -0.10 0.00 0.00 0.00 0.00 23.12 19.42 2a20 s ALA 89 CO 0.33 -2.45 0.90 -1.25 0.00 0.00 0.00 175.76 173.29 2a20 s PRO 90 N -4.94 4.36 0.04 0.00 0.05 -1.26 -5.00 135.00 128.25 2a20 s PRO 90 Ca 0.64 1.13 0.01 0.00 0.05 0.00 0.00 61.00 62.83 2a20 s PRO 90 Cb -0.18 -2.56 -0.03 0.00 0.05 0.00 0.00 34.50 31.78 2a20 s PRO 90 CO 0.57 0.18 -0.05 0.95 0.05 0.00 0.00 177.00 178.70 2a20 s THR 91 N -1.84 0.32 0.23 1.26 -4.23 -1.26 -2.50 115.64 107.64 2a20 s THR 91 Ca 0.54 -1.27 -0.30 0.00 -1.18 0.00 0.00 61.69 59.48 2a20 s THR 91 Cb -0.14 -0.79 -0.09 0.00 1.34 0.00 0.00 72.50 72.82 2a20 s THR 91 CO 0.19 -0.62 1.10 0.00 -0.54 0.00 0.00 174.62 174.76 2a20 n GLY 93 N 1.59 1.25 1.16 0.00 0.00 0.41 -2.06 105.19 107.54 2a20 n GLY 93 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2a20 n GLY 93 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2a20 n ILE 94 N 0.13 0.00 1.01 -0.61 -0.00 -1.26 -4.86 119.36 113.78 2a20 n ILE 94 Ca 0.07 0.00 0.12 0.00 -0.00 0.00 0.00 62.75 62.94 2a20 n ILE 94 Cb 0.39 -0.80 0.26 0.00 -0.00 0.00 0.00 39.64 39.50 2a20 n ILE 94 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2a20 n HIS 96 N -1.45 -1.16 -0.02 0.00 -0.00 -0.87 -4.74 115.22 106.97 2a20 n HIS 96 Ca 0.06 0.00 -0.04 0.00 0.46 0.00 0.00 57.72 58.19 2a20 n HIS 96 Cb 0.34 -2.13 -0.01 0.00 -0.12 0.00 0.00 29.99 28.06 2a20 n HIS 96 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 2a20 n LYS 97 N -2.22 0.26 -1.80 1.57 4.81 -1.26 -4.75 118.16 114.78 2a20 n LYS 97 Ca -0.09 0.10 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 2a20 n LYS 97 Cb 0.45 -0.94 -0.03 0.00 0.02 0.00 0.00 35.03 34.53 2a20 n LYS 97 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2a20 s THR 98 N -2.39 3.24 -0.15 3.15 2.01 -1.26 -4.83 115.64 115.41 2a20 s THR 98 Ca -0.14 0.27 -0.15 0.00 0.31 0.00 0.00 61.69 61.99 2a20 s THR 98 Cb 0.02 -3.22 -0.05 0.00 0.01 0.00 0.00 72.50 69.26 2a20 s THR 98 CO 0.21 -0.07 0.33 -0.54 -0.69 0.00 0.00 174.62 173.86 2a20 s LYS 99 N 4.89 4.26 0.91 4.92 1.02 -1.26 -2.07 119.74 132.41 2a20 s LYS 99 Ca 0.86 0.17 -0.11 0.00 0.02 0.00 0.00 55.97 56.91 2a20 s LYS 99 Cb -0.35 -3.42 0.14 0.00 -0.52 0.00 0.00 37.83 33.67 2a20 s LYS 99 CO 0.36 0.24 1.11 -0.06 -0.92 0.00 0.00 175.35 176.08 2a20 s PHE 100 N 0.45 1.91 0.35 3.18 0.08 -1.04 -4.95 117.98 117.96 2a20 s PHE 100 Ca 0.19 1.60 0.08 0.00 0.12 0.00 0.00 56.93 58.92 2a20 s PHE 100 Cb -0.13 -3.22 -0.04 0.00 -0.57 0.00 0.00 43.02 39.06 2a20 s PHE 100 CO 0.05 -2.64 0.18 0.00 -0.10 0.00 0.00 175.22 172.72 2a20 s ALA 101 N -2.72 3.58 0.00 5.36 0.00 -1.26 -4.46 121.76 122.26 2a20 s ALA 101 Ca 0.65 -1.83 0.00 0.00 0.00 0.00 0.00 51.96 50.78 2a20 s ALA 101 Cb -0.21 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.13 2a20 s ALA 101 CO 0.58 0.00 0.00 -3.47 0.00 0.00 0.00 175.76 172.87 2a20 n ASP 102 N -1.21 0.00 0.00 0.00 -0.08 -1.26 -3.10 116.55 110.90 2a20 n ASP 102 Ca -0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 2a20 n ASP 102 Cb 0.61 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.07 2a20 n ASP 102 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2a20 n GLY 103 N 0.00 0.09 2.95 0.27 0.00 -1.26 -5.12 105.19 102.11 2a20 n GLY 103 Ca 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 2a20 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a20 n GLY 105 N 2.90 1.04 3.73 0.00 0.00 -1.26 -4.59 105.19 107.00 2a20 n GLY 105 Ca -0.13 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.74 2a20 n GLY 105 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2a20 s HIS 106 N 2.13 3.45 -0.07 1.61 3.76 -0.97 -4.98 115.29 120.22 2a20 s HIS 106 Ca 0.00 0.57 0.05 0.00 -0.15 0.00 0.00 55.06 55.53 2a20 s HIS 106 Cb 0.00 -2.33 -0.01 0.00 1.11 0.00 0.00 32.58 31.35 2a20 s HIS 106 CO 0.00 0.24 -0.21 -0.80 -0.85 0.00 0.00 174.74 173.12 2a20 s ASN 107 N 0.47 3.42 0.08 1.40 0.02 -1.26 0.23 114.94 119.31 2a20 s ASN 107 Ca 0.16 -0.42 -0.34 0.00 -1.02 0.00 0.00 52.86 51.24 2a20 s ASN 107 Cb -0.13 -0.97 -0.13 0.00 0.02 0.00 0.00 41.25 40.03 2a20 s ASN 107 CO 0.03 0.25 1.65 0.00 0.02 0.00 0.00 177.10 179.06 2a20 h SER 109 N 6.77 0.00 0.00 0.00 0.87 -0.52 0.51 113.55 121.18 2a20 h SER 109 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 2a20 h SER 109 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2a20 h SER 109 CO 0.90 0.00 0.00 -1.22 -0.53 0.00 0.00 176.83 175.98 2a20 n TYR 110 N -2.77 0.00 0.26 2.24 4.02 -1.26 -4.72 117.16 114.93 2a20 n TYR 110 Ca -0.02 0.00 0.17 0.00 -0.01 0.00 0.00 57.90 58.04 2a20 n TYR 110 Cb 0.12 0.00 0.90 0.00 -0.02 0.00 0.00 39.34 40.34 2a20 n TYR 110 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2a20 n GLN 112 N -3.71 -0.76 -2.09 0.00 1.13 0.17 -4.93 117.38 107.19 2a20 n GLN 112 Ca -0.01 0.19 -0.38 0.00 -1.94 0.00 0.00 57.00 54.87 2a20 n GLN 112 Cb 0.21 -3.94 0.01 0.00 0.11 0.00 0.00 30.24 26.63 2a20 n GLN 112 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2a20 s THR 113 N -1.73 2.73 -0.44 5.09 2.01 -1.26 -4.43 115.64 117.61 2a20 s THR 113 Ca 0.00 0.56 -0.24 0.00 0.31 0.00 0.00 61.69 62.31 2a20 s THR 113 Cb 0.00 -3.28 0.02 0.00 0.01 0.00 0.00 72.50 69.25 2a20 s THR 113 CO 0.00 -0.00 0.85 -0.54 -0.69 0.00 0.00 174.62 174.24 2a20 s LYS 114 N -2.74 3.52 0.23 4.92 1.02 -1.26 -1.16 119.74 124.27 2a20 s LYS 114 Ca 0.66 0.08 0.05 0.00 0.02 0.00 0.00 55.97 56.79 2a20 s LYS 114 Cb -0.33 -3.91 -0.05 0.00 -0.52 0.00 0.00 37.83 33.01 2a20 s LYS 114 CO 0.40 -1.12 -0.06 -0.59 -0.92 0.00 0.00 175.35 173.05 2a20 s PHE 115 N 3.47 1.67 0.71 3.18 -0.12 0.14 0.15 117.98 127.17 2a20 s PHE 115 Ca 0.33 -0.76 -0.06 0.00 -0.05 0.00 0.00 56.93 56.40 2a20 s PHE 115 Cb -0.11 -0.91 0.08 0.00 -0.63 0.00 0.00 43.02 41.44 2a20 s PHE 115 CO 0.23 0.15 1.01 0.00 -0.05 0.00 0.00 175.22 176.56 2a20 h ALA 117 N -0.59 1.00 0.00 0.00 0.00 -1.93 -0.40 119.26 117.34 2a20 h ALA 117 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2a20 h ALA 117 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2a20 h ALA 117 CO 0.55 0.00 -1.21 0.54 0.00 0.00 0.00 179.25 179.13 2a20 n ARG 118 N -2.35 0.42 -1.25 0.00 1.74 -1.26 -4.16 116.66 109.79 2a20 n ARG 118 Ca -0.01 -0.01 -0.20 0.00 -0.77 0.00 0.00 57.85 56.85 2a20 n ARG 118 Cb 0.05 -1.63 0.13 0.00 -1.02 0.00 0.00 32.46 30.00 2a20 n ARG 118 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2a20 n GLY 120 N -1.00 0.56 3.21 0.00 0.00 -1.21 -2.93 105.19 103.83 2a20 n GLY 120 Ca 0.48 -0.89 -0.17 0.00 0.00 0.00 0.00 46.02 45.45 2a20 n GLY 120 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a20 s GLY 121 N 0.00 0.98 0.12 -0.02 0.00 0.24 -4.82 107.32 103.82 2a20 s GLY 121 Ca 0.00 -1.22 -0.18 0.00 0.00 0.00 0.00 44.72 43.33 2a20 s GLY 121 CO 0.00 -1.27 0.59 -1.60 0.00 0.00 0.00 173.10 170.81 2a20 s ARG 122 N -2.56 4.13 -0.19 2.90 3.52 -1.26 0.10 118.95 125.59 2a20 s ARG 122 Ca 0.06 0.67 -0.02 0.00 -0.13 0.00 0.00 55.73 56.31 2a20 s ARG 122 Cb -0.05 -3.08 0.06 0.00 -1.56 0.00 0.00 34.95 30.32 2a20 s ARG 122 CO 0.02 0.55 0.02 0.08 -0.81 0.00 0.00 175.30 175.15 2a20 s VAL 123 N -1.30 0.68 -0.12 7.11 1.01 0.57 -4.92 120.40 123.44 2a20 s VAL 123 Ca 0.34 -0.63 -0.18 0.00 0.00 0.00 0.00 61.98 61.51 2a20 s VAL 123 Cb -0.18 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2a20 s VAL 123 CO 0.19 -0.16 0.47 -0.94 0.00 0.00 0.00 175.10 174.67 2a20 s SER 124 N 1.79 6.68 0.68 3.32 1.04 -1.26 -2.76 113.70 123.18 2a20 s SER 124 Ca -0.01 0.81 0.01 0.00 0.48 0.00 0.00 55.95 57.24 2a20 s SER 124 Cb -0.17 -2.28 0.11 0.00 0.10 0.00 0.00 66.02 63.78 2a20 s SER 124 CO -0.08 0.00 0.94 -0.76 0.98 0.00 0.00 173.24 174.32 2a20 s LEU 125 N 0.63 3.03 0.00 2.42 1.43 -1.09 -5.00 118.68 120.09 2a20 s LEU 125 Ca 0.26 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 2a20 s LEU 125 Cb -0.15 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.09 2a20 s LEU 125 CO 0.10 -1.70 0.93 0.54 0.23 0.00 0.00 176.35 176.45 2a20 n ARG 126 N -2.68 0.00 0.00 1.70 3.00 -1.26 -4.03 116.66 113.39 2a20 n ARG 126 Ca 0.15 0.62 0.00 0.00 -0.01 0.00 0.00 57.85 58.61 2a20 n ARG 126 Cb 0.61 -1.43 0.00 0.00 0.00 0.00 0.00 32.46 31.64 2a20 n ARG 126 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2a20 n SER 127 N -2.15 0.00 -0.96 0.55 2.88 -1.26 -4.86 113.62 107.82 2a20 n SER 127 Ca 0.00 0.31 -0.00 0.00 -1.33 0.00 0.00 58.87 57.85 2a20 n SER 127 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2a20 n SER 127 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2a20 n ASN 128 N -0.48 -0.11 -4.57 -3.46 6.94 -1.26 -5.12 115.26 107.20 2a20 n ASN 128 Ca 0.00 -0.55 -0.43 0.00 -0.02 0.00 0.00 54.58 53.58 2a20 n ASN 128 Cb 0.00 0.04 -0.05 0.00 -2.36 0.00 0.00 39.78 37.42 2a20 n ASN 128 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2a20 s LYS 129 N 0.00 3.59 -0.36 -3.83 3.01 -1.26 -4.92 119.74 115.97 2a20 s LYS 129 Ca 0.00 0.17 -0.17 0.00 -1.01 0.00 0.00 55.97 54.96 2a20 s LYS 129 Cb 0.02 -3.89 -0.00 0.00 -1.01 0.00 0.00 37.83 32.95 2a20 s LYS 129 CO -0.00 -1.07 0.47 0.08 0.51 0.00 0.00 175.35 175.34 2a20 s VAL 130 N 3.42 5.06 0.00 3.17 1.01 -1.26 -2.68 120.40 129.12 2a20 s VAL 130 Ca 0.34 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.49 2a20 s VAL 130 Cb -0.12 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 2a20 s VAL 130 CO 0.22 -0.23 -0.05 -0.04 0.00 0.00 0.00 175.10 175.00 2a20 s MET 131 N 2.27 0.42 0.09 2.72 -1.94 -1.11 -5.01 119.30 116.74 2a20 s MET 131 Ca 0.16 -0.25 0.00 0.00 -1.71 0.00 0.00 55.69 53.89 2a20 s MET 131 Cb -0.16 -0.37 -0.04 0.00 2.01 0.00 0.00 34.83 36.27 2a20 s MET 131 CO 0.13 0.10 0.24 -1.58 -0.01 0.00 0.00 175.02 173.90 2a20 s TRP 132 N -0.29 3.51 -0.13 -0.03 0.52 -1.26 -0.31 118.94 120.95 2a20 s TRP 132 Ca 0.00 0.23 0.00 0.00 0.02 0.00 0.00 56.10 56.35 2a20 s TRP 132 Cb -0.03 -1.75 0.02 0.00 -1.15 0.00 0.00 33.47 30.57 2a20 s TRP 132 CO -0.00 0.56 -0.11 0.08 0.02 0.00 0.00 176.95 177.51 2a20 s VAL 133 N -1.58 1.26 0.77 4.03 1.01 0.28 0.30 120.40 126.47 2a20 s VAL 133 Ca 0.35 -0.44 -0.14 0.00 0.00 0.00 0.00 61.98 61.75 2a20 s VAL 133 Cb -0.12 -1.23 0.06 0.00 0.00 0.00 0.00 36.38 35.09 2a20 s VAL 133 CO 0.28 0.41 1.20 0.00 0.00 0.00 0.00 175.10 176.99 2a20 h ASN 135 N -0.60 0.00 0.63 0.00 2.35 -1.87 0.55 115.58 116.64 2a20 h ASN 135 Ca -0.47 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.01 2a20 h ASN 135 Cb 1.29 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.65 2a20 h ASN 135 CO 0.48 0.00 -1.36 -0.07 -1.65 0.00 0.00 177.43 174.84 2a20 h LEU 136 N 0.00 0.27 0.06 1.61 3.38 -1.88 -3.05 115.31 115.70 2a20 h LEU 136 Ca 0.00 -0.34 -0.32 0.00 0.09 0.00 0.00 57.88 57.31 2a20 h LEU 136 Cb 0.64 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2a20 h LEU 136 CO 0.00 1.28 -1.77 0.00 0.09 0.00 0.00 178.44 178.04 2a20 h ARG 138 N 0.03 1.02 0.00 0.00 2.43 -0.20 0.12 114.38 117.79 2a20 h ARG 138 Ca -0.32 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 58.70 2a20 h ARG 138 Cb 2.02 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 31.37 2a20 h ARG 138 CO 0.09 0.78 -0.09 -0.22 -1.51 0.00 0.00 179.97 179.03 2a20 h LYS 139 N 1.00 0.00 -0.55 0.20 3.11 -1.68 -2.41 116.57 116.24 2a20 h LYS 139 Ca 0.25 0.00 0.16 0.00 -2.81 0.00 0.00 60.65 58.25 2a20 h LYS 139 Cb 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.28 2a20 h LYS 139 CO -0.04 0.31 0.59 0.37 -2.81 0.00 0.00 179.45 177.87 2a20 h GLN 140 N -1.00 0.00 -0.27 1.90 5.75 -1.50 0.85 115.11 120.84 2a20 h GLN 140 Ca -0.01 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2a20 h GLN 140 Cb 0.36 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.91 2a20 h GLN 140 CO -0.01 0.00 0.00 0.94 -2.65 0.00 0.00 178.83 177.11 2a20 n GLN 141 N -3.66 2.89 -0.28 1.69 7.27 0.03 -5.04 117.38 120.27 2a20 n GLN 141 Ca 0.11 -2.71 0.00 0.00 0.07 0.00 0.00 57.00 54.47 2a20 n GLN 141 Cb 0.79 -1.75 0.00 0.00 2.41 0.00 0.00 30.24 31.70 2a20 n GLN 141 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52