#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a20 n GLU 84 N 0.00 2.09 -3.44 3.69 4.71 -1.26 -5.00 120.64 121.43 2a20 n GLU 84 Ca 0.00 -4.04 -0.43 0.00 -0.01 0.00 0.00 57.16 52.68 2a20 n GLU 84 Cb 0.00 -1.91 -0.03 0.00 -1.01 0.00 0.00 31.44 28.48 2a20 n GLU 84 CO 0.00 0.00 0.00 -1.14 0.09 0.00 0.00 177.13 176.08 2a20 s GLN 85 N -3.01 3.61 -0.09 3.49 2.00 -1.26 -5.04 119.66 119.36 2a20 s GLN 85 Ca 0.43 -2.89 -0.19 0.00 -2.00 0.00 0.00 55.36 50.71 2a20 s GLN 85 Cb 0.34 -4.29 -0.04 0.00 0.80 0.00 0.00 33.01 29.82 2a20 s GLN 85 CO -0.10 -1.25 0.52 0.15 -0.50 0.00 0.00 175.29 174.11 2a20 s LYS 86 N -0.64 4.33 0.00 1.67 -0.14 -1.26 -4.59 119.74 119.11 2a20 s LYS 86 Ca 0.24 0.54 0.00 0.00 -1.36 0.00 0.00 55.97 55.39 2a20 s LYS 86 Cb -0.11 -3.42 0.00 0.00 -1.68 0.00 0.00 37.83 32.62 2a20 s LYS 86 CO -0.09 0.19 0.00 0.41 -0.76 0.00 0.00 175.35 175.11 2a20 n GLY 87 N 3.09 0.30 3.62 -3.33 0.00 -1.26 -5.08 105.19 102.52 2a20 n GLY 87 Ca -0.06 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 2a20 n GLY 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a20 s ASP 88 N -1.77 5.88 0.78 1.61 1.11 -1.26 -5.09 116.67 117.93 2a20 s ASP 88 Ca 0.00 0.04 -0.11 0.00 0.18 0.00 0.00 52.55 52.67 2a20 s ASP 88 Cb 0.00 -2.06 0.06 0.00 1.07 0.00 0.00 42.92 42.00 2a20 s ASP 88 CO 0.00 0.06 1.09 0.00 1.18 0.00 0.00 175.17 177.49 2a20 s ALA 89 N 1.11 2.19 -0.17 5.23 0.00 -1.26 -4.99 121.76 123.86 2a20 s ALA 89 Ca 0.06 0.14 -0.25 0.00 0.00 0.00 0.00 51.96 51.91 2a20 s ALA 89 Cb -0.14 -3.23 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 2a20 s ALA 89 CO 0.04 -1.78 0.84 -1.25 0.00 0.00 0.00 175.76 173.61 2a20 s PRO 90 N -4.95 4.29 0.03 0.00 0.05 -1.26 -5.01 135.00 128.14 2a20 s PRO 90 Ca 0.61 1.02 0.01 0.00 0.05 0.00 0.00 61.00 62.70 2a20 s PRO 90 Cb -0.17 -3.58 -0.02 0.00 0.05 0.00 0.00 34.50 30.79 2a20 s PRO 90 CO 0.56 -0.34 -0.05 0.95 0.05 0.00 0.00 177.00 178.16 2a20 s THR 91 N 2.20 0.35 0.19 1.26 -4.23 -1.26 -2.19 115.64 111.95 2a20 s THR 91 Ca 0.38 -0.87 -0.30 0.00 -1.18 0.00 0.00 61.69 59.73 2a20 s THR 91 Cb -0.16 -0.43 -0.08 0.00 1.34 0.00 0.00 72.50 73.17 2a20 s THR 91 CO 0.12 -0.35 1.13 0.00 -0.54 0.00 0.00 174.62 174.99 2a20 n GLY 93 N 2.02 -0.28 0.89 0.00 0.00 0.42 -1.95 105.19 106.29 2a20 n GLY 93 Ca 0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.12 0.29 0.77 -0.61 -0.00 -1.26 -4.83 119.36 113.60 2a20 n ILE 94 Ca 0.04 0.13 0.12 0.00 -0.00 0.00 0.00 62.75 63.04 2a20 n ILE 94 Cb 0.12 -1.21 0.16 0.00 -0.00 0.00 0.00 39.64 38.72 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 -1.79 -0.91 -0.01 0.00 8.25 -0.82 -4.74 115.22 115.18 2a20 n HIS 96 Ca 0.04 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.46 2a20 n HIS 96 Cb 0.39 -2.43 -0.01 0.00 1.12 0.00 0.00 29.99 29.06 2a20 n HIS 96 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2a20 n LYS 97 N -2.19 0.21 -1.78 -0.41 0.00 -1.26 -4.77 118.16 107.95 2a20 n LYS 97 Ca -0.12 0.08 -0.43 0.00 0.00 0.00 0.00 58.31 57.85 2a20 n LYS 97 Cb 0.47 -0.82 -0.03 0.00 0.00 0.00 0.00 35.03 34.65 2a20 n LYS 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 2a20 s THR 98 N -2.16 3.22 -0.22 3.15 2.01 -1.26 -4.84 115.64 115.54 2a20 s THR 98 Ca -0.11 0.25 -0.18 0.00 0.31 0.00 0.00 61.69 61.96 2a20 s THR 98 Cb 0.02 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.27 2a20 s THR 98 CO 0.17 -0.10 0.49 -0.54 -0.69 0.00 0.00 174.62 173.95 2a20 s LYS 99 N 5.25 4.15 1.18 4.92 1.02 -1.26 -2.19 119.74 132.82 2a20 s LYS 99 Ca 0.88 0.33 -0.18 0.00 0.02 0.00 0.00 55.97 57.02 2a20 s LYS 99 Cb -0.33 -3.58 0.22 0.00 -0.52 0.00 0.00 37.83 33.61 2a20 s LYS 99 CO 0.35 -0.18 0.44 1.19 -0.92 0.00 0.00 175.35 176.23 2a20 n PHE 100 N 4.92 -2.15 -4.23 3.18 3.72 -0.93 -4.92 117.46 117.06 2a20 n PHE 100 Ca -0.06 -0.16 -0.33 0.00 -0.05 0.00 0.00 57.45 56.86 2a20 n PHE 100 Cb 0.50 -1.49 -0.08 0.00 -0.94 0.00 0.00 39.48 37.47 2a20 n PHE 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2a20 s ALA 101 N -2.19 3.40 -0.56 4.37 0.00 -1.26 -4.47 121.76 121.04 2a20 s ALA 101 Ca 0.55 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.62 2a20 s ALA 101 Cb -0.13 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.54 2a20 s ALA 101 CO 0.55 0.65 0.00 -0.40 0.00 0.00 0.00 175.76 176.57 2a20 n ASP 102 N 1.45 -2.24 -3.65 0.00 5.75 -1.26 -0.48 116.55 116.11 2a20 n ASP 102 Ca -0.15 0.30 -0.23 0.00 -0.01 0.00 0.00 54.79 54.70 2a20 n ASP 102 Cb 0.53 -2.06 0.06 0.00 -1.03 0.00 0.00 41.12 38.61 2a20 n ASP 102 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2a20 n GLY 103 N -0.51 -0.44 2.49 6.12 0.00 -1.26 -4.94 105.19 106.65 2a20 n GLY 103 Ca -0.07 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 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 0.10 -3.19 3.53 0.00 0.00 -1.26 -4.72 105.19 99.65 2a20 n GLY 105 Ca 0.13 -1.27 -0.40 0.00 0.00 0.00 0.00 46.02 44.48 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 -0.42 3.23 -0.13 1.61 3.76 -0.69 -4.95 115.29 117.69 2a20 s HIS 106 Ca 0.00 -0.18 -0.05 0.00 -0.15 0.00 0.00 55.06 54.67 2a20 s HIS 106 Cb 0.00 -2.50 -0.04 0.00 1.11 0.00 0.00 32.58 31.16 2a20 s HIS 106 CO 0.00 -0.36 0.06 -0.80 -0.85 0.00 0.00 174.74 172.79 2a20 s ASN 107 N 1.72 5.70 0.04 1.40 0.02 -1.26 0.30 114.94 122.85 2a20 s ASN 107 Ca 0.07 0.21 -0.35 0.00 -1.02 0.00 0.00 52.86 51.78 2a20 s ASN 107 Cb -0.17 -1.81 -0.13 0.00 0.02 0.00 0.00 41.25 39.15 2a20 s ASN 107 CO 0.11 0.32 1.68 0.00 0.02 0.00 0.00 177.10 179.22 2a20 h SER 109 N 7.09 0.00 0.00 0.00 0.87 0.01 0.84 113.55 122.36 2a20 h SER 109 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2a20 h SER 109 Cb 1.27 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 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 -2.65 0.00 0.23 2.24 4.02 -1.26 -4.71 117.16 115.03 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 0.09 0.00 0.85 0.00 -0.02 0.00 0.00 39.34 40.26 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 -3.77 -0.42 -2.12 0.00 1.13 0.29 -4.94 117.38 107.56 2a20 n GLN 112 Ca 0.01 0.10 -0.40 0.00 -1.94 0.00 0.00 57.00 54.77 2a20 n GLN 112 Cb 0.28 -3.63 -0.01 0.00 0.11 0.00 0.00 30.24 26.99 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 -2.14 2.75 -0.34 5.09 2.01 -1.26 -4.43 115.64 117.32 2a20 s THR 113 Ca 0.00 0.70 -0.25 0.00 0.31 0.00 0.00 61.69 62.44 2a20 s THR 113 Cb 0.00 -3.42 0.01 0.00 0.01 0.00 0.00 72.50 69.10 2a20 s THR 113 CO 0.00 0.12 0.90 -0.54 -0.69 0.00 0.00 174.62 174.41 2a20 s LYS 114 N -2.09 3.90 0.19 4.92 1.02 -1.26 -0.53 119.74 125.89 2a20 s LYS 114 Ca 0.54 0.63 0.03 0.00 0.02 0.00 0.00 55.97 57.20 2a20 s LYS 114 Cb -0.37 -3.77 -0.05 0.00 -0.52 0.00 0.00 37.83 33.12 2a20 s LYS 114 CO 0.48 -0.85 -0.03 -0.59 -0.92 0.00 0.00 175.35 173.44 2a20 s PHE 115 N 3.32 1.40 0.69 3.18 -0.12 0.15 0.16 117.98 126.75 2a20 s PHE 115 Ca 0.37 -0.89 -0.05 0.00 -0.05 0.00 0.00 56.93 56.30 2a20 s PHE 115 Cb -0.13 -0.78 0.06 0.00 -0.63 0.00 0.00 43.02 41.54 2a20 s PHE 115 CO 0.16 -0.04 0.98 0.00 -0.05 0.00 0.00 175.22 176.28 2a20 h ALA 117 N -0.52 1.00 0.00 0.00 0.00 -1.92 0.05 119.26 117.87 2a20 h ALA 117 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2a20 h ALA 117 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2a20 h ALA 117 CO 0.58 0.00 -1.16 0.54 0.00 0.00 0.00 179.25 179.21 2a20 n ARG 118 N -2.39 0.54 -0.99 0.00 1.74 -1.26 -4.04 116.66 110.26 2a20 n ARG 118 Ca -0.02 0.04 -0.13 0.00 -0.77 0.00 0.00 57.85 56.98 2a20 n ARG 118 Cb 0.04 -1.72 0.20 0.00 -1.02 0.00 0.00 32.46 29.96 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 -1.10 0.27 3.53 0.00 0.00 -1.17 -2.94 105.19 103.77 2a20 n GLY 120 Ca 0.45 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 45.29 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 1.72 -0.12 -0.02 0.00 0.27 -4.75 107.32 104.42 2a20 s GLY 121 Ca 0.00 -1.48 -0.21 0.00 0.00 0.00 0.00 44.72 43.04 2a20 s GLY 121 CO 0.00 -1.49 0.59 1.09 0.00 0.00 0.00 173.10 173.28 2a20 s ARG 122 N -2.66 4.34 -0.35 2.90 1.70 -1.26 -1.34 118.95 122.28 2a20 s ARG 122 Ca 0.23 0.63 -0.00 0.00 -0.47 0.00 0.00 55.73 56.11 2a20 s ARG 122 Cb -0.09 -3.47 0.12 0.00 -0.57 0.00 0.00 34.95 30.94 2a20 s ARG 122 CO 0.13 0.03 0.18 0.08 -1.08 0.00 0.00 175.30 174.65 2a20 s VAL 123 N 0.99 0.47 -0.40 4.99 1.01 0.91 -4.97 120.40 123.41 2a20 s VAL 123 Ca 0.30 -1.65 -0.19 0.00 0.00 0.00 0.00 61.98 60.45 2a20 s VAL 123 Cb -0.16 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 34.88 2a20 s VAL 123 CO 0.13 -0.87 0.56 -0.94 0.00 0.00 0.00 175.10 173.98 2a20 s SER 124 N 1.21 6.31 0.01 3.32 1.04 -1.26 -1.07 113.70 123.27 2a20 s SER 124 Ca 0.15 -0.24 -0.15 0.00 0.48 0.00 0.00 55.95 56.19 2a20 s SER 124 Cb -0.21 -2.29 -0.06 0.00 0.10 0.00 0.00 66.02 63.57 2a20 s SER 124 CO -0.11 -0.62 0.42 -0.76 0.98 0.00 0.00 173.24 173.16 2a20 s LEU 125 N 2.54 4.47 0.00 2.42 1.43 0.26 -4.73 118.68 125.07 2a20 s LEU 125 Ca 0.20 0.98 0.00 0.00 -1.03 0.00 0.00 54.13 54.28 2a20 s LEU 125 Cb -0.15 -2.65 0.00 0.00 0.03 0.00 0.00 46.19 43.42 2a20 s LEU 125 CO 0.16 0.31 0.00 0.54 0.23 0.00 0.00 176.35 177.58 2a20 n ARG 126 N 1.73 0.00 0.05 1.70 1.74 -1.26 -2.66 116.66 117.96 2a20 n ARG 126 Ca -0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 2a20 n ARG 126 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 2a20 n ARG 126 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2a20 n SER 127 N 2.15 -0.88 0.07 0.55 7.64 -1.26 -4.95 113.62 116.94 2a20 n SER 127 Ca 0.00 0.28 0.12 0.00 1.01 0.00 0.00 58.87 60.28 2a20 n SER 127 Cb 0.00 1.07 0.05 0.00 -1.01 0.00 0.00 64.21 64.32 2a20 n SER 127 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2a20 n ASN 128 N -2.64 0.73 -4.51 6.43 5.15 -1.26 -4.70 115.26 114.47 2a20 n ASN 128 Ca 0.00 0.15 -0.42 0.00 -0.60 0.00 0.00 54.58 53.70 2a20 n ASN 128 Cb 0.00 0.47 -0.03 0.00 -0.53 0.00 0.00 39.78 39.69 2a20 n ASN 128 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2a20 s LYS 129 N -3.27 3.52 -0.23 1.20 -0.14 -1.09 -4.99 119.74 114.74 2a20 s LYS 129 Ca 0.02 -1.28 -0.12 0.00 -1.36 0.00 0.00 55.97 53.23 2a20 s LYS 129 Cb 0.12 -4.99 -0.05 0.00 -1.68 0.00 0.00 37.83 31.23 2a20 s LYS 129 CO 0.77 -2.00 0.22 0.08 -0.76 0.00 0.00 175.35 173.66 2a20 s VAL 130 N 4.05 5.32 0.03 3.17 1.01 -1.26 0.92 120.40 133.64 2a20 s VAL 130 Ca 0.38 0.30 -0.00 0.00 0.00 0.00 0.00 61.98 62.66 2a20 s VAL 130 Cb -0.04 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 2a20 s VAL 130 CO -0.06 0.32 -0.03 0.00 0.00 0.00 0.00 175.10 175.32 2a20 s MET 131 N 1.16 0.40 0.13 2.72 0.23 -0.23 -4.97 119.30 118.73 2a20 s MET 131 Ca 0.10 -0.76 0.09 0.00 -1.03 0.00 0.00 55.69 54.09 2a20 s MET 131 Cb -0.14 0.09 -0.04 0.00 -1.53 0.00 0.00 34.83 33.22 2a20 s MET 131 CO 0.06 -0.05 -0.21 -1.58 -2.03 0.00 0.00 175.02 171.20 2a20 s TRP 132 N -2.00 1.91 -0.14 3.16 0.52 -1.26 -0.06 118.94 121.06 2a20 s TRP 132 Ca -0.10 -0.42 0.01 0.00 0.02 0.00 0.00 56.10 55.60 2a20 s TRP 132 Cb -0.06 -1.01 0.02 0.00 -1.15 0.00 0.00 33.47 31.27 2a20 s TRP 132 CO -0.03 0.28 -0.15 0.08 0.02 0.00 0.00 176.95 177.16 2a20 s VAL 133 N -1.42 1.58 0.75 4.03 1.01 -0.45 0.78 120.40 126.68 2a20 s VAL 133 Ca 0.11 -0.65 -0.13 0.00 0.00 0.00 0.00 61.98 61.32 2a20 s VAL 133 Cb -0.09 -1.48 0.05 0.00 0.00 0.00 0.00 36.38 34.86 2a20 s VAL 133 CO 0.06 0.46 1.12 0.00 0.00 0.00 0.00 175.10 176.74 2a20 h ASN 135 N -0.71 0.00 0.41 0.00 4.21 -1.87 0.36 115.58 117.97 2a20 h ASN 135 Ca -0.45 0.00 -0.31 0.00 1.21 0.00 0.00 56.30 56.74 2a20 h ASN 135 Cb 1.25 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.46 2a20 h ASN 135 CO 0.50 0.00 -1.48 -0.07 -1.29 0.00 0.00 177.43 175.09 2a20 h LEU 136 N 0.00 0.56 0.05 1.61 3.38 -1.89 -3.05 115.31 115.97 2a20 h LEU 136 Ca 0.00 -0.68 -0.29 0.00 0.09 0.00 0.00 57.88 57.00 2a20 h LEU 136 Cb 0.56 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 2a20 h LEU 136 CO 0.00 1.55 -1.56 0.00 0.09 0.00 0.00 178.44 178.52 2a20 h ARG 138 N 0.03 1.16 0.13 0.00 2.43 -0.51 0.40 114.38 118.01 2a20 h ARG 138 Ca -0.24 -0.18 -0.28 0.00 -0.81 0.00 0.00 59.98 58.47 2a20 h ARG 138 Cb 1.97 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 31.32 2a20 h ARG 138 CO 0.11 0.90 -1.44 0.87 -1.51 0.00 0.00 179.97 178.91 2a20 h LYS 139 N 1.13 0.27 0.00 0.20 1.57 -1.66 -2.04 116.57 116.06 2a20 h LYS 139 Ca 0.27 -0.47 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 2a20 h LYS 139 Cb 0.14 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 2a20 h LYS 139 CO -0.03 1.22 -0.15 0.37 -0.57 0.00 0.00 179.45 180.29 2a20 h GLN 140 N -0.24 0.00 -0.28 3.15 4.15 -1.29 -2.43 115.11 118.18 2a20 h GLN 140 Ca -0.30 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.12 2a20 h GLN 140 Cb 1.81 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.50 2a20 h GLN 140 CO 0.08 0.15 0.00 0.94 -1.93 0.00 0.00 178.83 178.08 2a20 n GLN 141 N -3.64 2.87 -0.18 1.69 7.27 0.14 -5.03 117.38 120.50 2a20 n GLN 141 Ca -0.01 -2.09 0.00 0.00 0.07 0.00 0.00 57.00 54.96 2a20 n GLN 141 Cb 0.28 -1.31 0.00 0.00 2.41 0.00 0.00 30.24 31.62 2a20 n GLN 141 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52