#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 3.31 -0.10 -1.09 2.56 -1.26 -5.02 118.70 117.10 2a20 s GLU 84 Ca 0.00 -2.54 0.01 0.00 0.00 0.00 0.00 54.97 52.44 2a20 s GLU 84 Cb 0.00 -4.21 0.02 0.00 2.00 0.00 0.00 34.13 31.93 2a20 s GLU 84 CO 0.00 -1.25 -0.13 1.14 -0.56 0.00 0.00 175.26 174.46 2a20 s GLN 85 N -0.02 1.95 -0.05 4.30 -2.07 -1.26 -5.00 119.66 117.52 2a20 s GLN 85 Ca 0.18 -0.45 0.23 0.00 -1.82 0.00 0.00 55.36 53.50 2a20 s GLN 85 Cb -0.13 -1.73 0.43 0.00 -1.09 0.00 0.00 33.01 30.49 2a20 s GLN 85 CO -0.07 -0.11 1.18 1.63 -1.32 0.00 0.00 175.29 176.59 2a20 n LYS 86 N 4.36 0.37 0.00 9.60 4.76 -1.26 -5.10 118.16 130.89 2a20 n LYS 86 Ca -0.18 -2.30 0.00 0.00 -2.87 0.00 0.00 58.31 52.96 2a20 n LYS 86 Cb 0.51 -0.36 0.00 0.00 -1.84 0.00 0.00 35.03 33.34 2a20 n LYS 86 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2a20 n GLY 87 N 0.17 -0.49 2.81 0.72 0.00 -1.26 -5.11 105.19 102.03 2a20 n GLY 87 Ca 0.09 -0.32 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 2a20 n GLY 87 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2a20 s ASP 88 N -4.00 1.66 0.76 1.61 2.15 -1.26 -5.14 116.67 112.45 2a20 s ASP 88 Ca 0.00 -0.13 -0.11 0.00 0.43 0.00 0.00 52.55 52.74 2a20 s ASP 88 Cb 0.00 -0.52 0.05 0.00 -0.30 0.00 0.00 42.92 42.15 2a20 s ASP 88 CO 0.00 -0.17 1.09 0.00 -0.17 0.00 0.00 175.17 175.92 2a20 s ALA 89 N 1.84 2.33 -0.11 3.66 0.00 -1.26 -5.00 121.76 123.22 2a20 s ALA 89 Ca 0.04 0.23 -0.25 0.00 0.00 0.00 0.00 51.96 51.97 2a20 s ALA 89 Cb -0.12 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 2a20 s ALA 89 CO -0.05 -1.67 0.80 -1.25 0.00 0.00 0.00 175.76 173.59 2a20 s PRO 90 N -4.93 4.38 0.02 0.00 0.05 -1.26 -5.02 135.00 128.23 2a20 s PRO 90 Ca 0.61 1.02 0.02 0.00 0.05 0.00 0.00 61.00 62.70 2a20 s PRO 90 Cb -0.17 -3.51 -0.01 0.00 0.05 0.00 0.00 34.50 30.86 2a20 s PRO 90 CO 0.56 -0.15 -0.07 0.95 0.05 0.00 0.00 177.00 178.34 2a20 s THR 91 N 1.51 0.54 0.15 1.26 -4.23 -1.26 -2.22 115.64 111.38 2a20 s THR 91 Ca 0.40 -0.69 -0.31 0.00 -1.18 0.00 0.00 61.69 59.91 2a20 s THR 91 Cb -0.18 -0.53 -0.09 0.00 1.34 0.00 0.00 72.50 73.04 2a20 s THR 91 CO 0.17 -0.12 1.46 0.00 -0.54 0.00 0.00 174.62 175.59 2a20 n GLY 93 N 3.43 -0.79 0.31 0.00 0.00 0.46 -1.47 105.19 107.14 2a20 n GLY 93 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.94 0.00 0.78 -0.61 -0.00 -1.26 -4.80 119.36 112.53 2a20 n ILE 94 Ca 0.17 0.18 0.12 0.00 -0.00 0.00 0.00 62.75 63.22 2a20 n ILE 94 Cb 0.08 -1.11 0.28 0.00 -0.00 0.00 0.00 39.64 38.89 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 -1.83 -1.21 -0.02 0.00 -0.00 -0.54 -4.79 115.22 106.83 2a20 n HIS 96 Ca 0.05 0.00 -0.04 0.00 0.46 0.00 0.00 57.72 58.19 2a20 n HIS 96 Cb 0.39 -2.62 -0.01 0.00 -0.12 0.00 0.00 29.99 27.63 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 -2.56 0.21 -1.80 1.57 0.00 -1.26 -4.75 118.16 109.56 2a20 n LYS 97 Ca -0.14 0.08 -0.43 0.00 0.00 0.00 0.00 58.31 57.83 2a20 n LYS 97 Cb 0.56 -0.80 -0.03 0.00 0.00 0.00 0.00 35.03 34.76 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 -2.06 3.25 -0.23 3.15 2.01 -1.26 -4.84 115.64 115.65 2a20 s THR 98 Ca -0.11 0.28 -0.14 0.00 0.31 0.00 0.00 61.69 62.02 2a20 s THR 98 Cb 0.02 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 2a20 s THR 98 CO 0.17 -0.11 0.34 -0.54 -0.69 0.00 0.00 174.62 173.79 2a20 s LYS 99 N 5.20 4.10 0.75 4.92 1.02 -1.26 -2.39 119.74 132.08 2a20 s LYS 99 Ca 0.87 0.05 -0.12 0.00 0.02 0.00 0.00 55.97 56.79 2a20 s LYS 99 Cb -0.33 -3.58 0.19 0.00 -0.52 0.00 0.00 37.83 33.59 2a20 s LYS 99 CO 0.35 -0.11 0.42 1.19 -0.92 0.00 0.00 175.35 176.29 2a20 n PHE 100 N 4.75 -2.73 -0.90 3.18 3.72 -0.94 -4.95 117.46 119.58 2a20 n PHE 100 Ca -0.10 -0.35 -0.06 0.00 -0.05 0.00 0.00 57.45 56.89 2a20 n PHE 100 Cb 0.51 -0.69 0.05 0.00 -0.94 0.00 0.00 39.48 38.41 2a20 n PHE 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2a20 n ALA 101 N -4.23 -0.52 -0.31 4.37 0.00 -1.26 -4.66 120.51 113.89 2a20 n ALA 101 Ca -0.10 -0.35 0.12 0.00 0.00 0.00 0.00 53.44 53.11 2a20 n ALA 101 Cb 0.29 -0.02 0.35 0.00 0.00 0.00 0.00 19.45 20.07 2a20 n ALA 101 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2a20 h ASP 102 N -0.88 0.72 0.00 0.00 1.82 -2.00 -3.38 116.42 112.70 2a20 h ASP 102 Ca -0.09 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.61 2a20 h ASP 102 Cb 0.26 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 40.19 2a20 h ASP 102 CO 0.06 0.32 0.00 0.61 -1.61 0.00 0.00 179.24 178.62 2a20 n GLY 103 N -1.39 1.60 3.02 -0.78 0.00 -1.26 -4.90 105.19 101.48 2a20 n GLY 103 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 2.44 0.87 3.67 0.00 0.00 -1.26 -4.69 105.19 106.22 2a20 n GLY 105 Ca -0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 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 0.13 3.33 -0.14 1.61 3.76 -1.00 -5.00 115.29 117.98 2a20 s HIS 106 Ca 0.00 0.24 -0.00 0.00 -0.15 0.00 0.00 55.06 55.15 2a20 s HIS 106 Cb 0.00 -2.26 -0.01 0.00 1.11 0.00 0.00 32.58 31.41 2a20 s HIS 106 CO 0.00 0.09 -0.12 -0.80 -0.85 0.00 0.00 174.74 173.05 2a20 s ASN 107 N 0.98 4.03 0.04 1.40 0.02 -1.26 0.41 114.94 120.57 2a20 s ASN 107 Ca 0.08 -0.33 -0.35 0.00 -1.02 0.00 0.00 52.86 51.24 2a20 s ASN 107 Cb -0.13 -1.62 -0.14 0.00 0.02 0.00 0.00 41.25 39.38 2a20 s ASN 107 CO 0.04 0.15 1.66 0.00 0.02 0.00 0.00 177.10 178.97 2a20 n SER 109 N 4.51 0.28 0.00 0.00 2.88 0.45 -0.98 113.62 120.76 2a20 n SER 109 Ca 0.20 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.34 2a20 n SER 109 Cb 0.27 -0.65 0.00 0.00 -0.75 0.00 0.00 64.21 63.08 2a20 n SER 109 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2a20 n TYR 110 N -1.85 0.00 1.97 0.66 4.01 -1.26 -4.71 117.16 115.98 2a20 n TYR 110 Ca 0.01 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.82 2a20 n TYR 110 Cb 0.09 0.00 0.44 0.00 -0.31 0.00 0.00 39.34 39.55 2a20 n TYR 110 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2a20 n GLN 112 N -0.69 -1.65 -1.93 0.00 3.00 -0.15 -4.90 117.38 111.05 2a20 n GLN 112 Ca 0.11 0.88 -0.42 0.00 -0.01 0.00 0.00 57.00 57.57 2a20 n GLN 112 Cb 0.06 -5.24 -0.03 0.00 0.00 0.00 0.00 30.24 25.03 2a20 n GLN 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 2a20 s THR 113 N -1.98 2.67 -0.49 5.09 2.01 -1.26 -4.39 115.64 117.30 2a20 s THR 113 Ca 0.00 0.45 -0.27 0.00 0.31 0.00 0.00 61.69 62.18 2a20 s THR 113 Cb 0.00 -3.29 0.03 0.00 0.01 0.00 0.00 72.50 69.25 2a20 s THR 113 CO 0.00 0.03 1.05 -0.54 -0.69 0.00 0.00 174.62 174.47 2a20 s LYS 114 N 1.32 3.60 0.25 4.92 1.02 -1.26 -0.07 119.74 129.51 2a20 s LYS 114 Ca 0.70 0.31 0.06 0.00 0.02 0.00 0.00 55.97 57.06 2a20 s LYS 114 Cb -0.43 -3.94 -0.05 0.00 -0.52 0.00 0.00 37.83 32.89 2a20 s LYS 114 CO 0.31 -1.36 -0.05 -0.59 -0.92 0.00 0.00 175.35 172.75 2a20 s PHE 115 N 4.20 1.78 0.62 3.18 -0.12 0.17 0.17 117.98 127.98 2a20 s PHE 115 Ca 0.42 -0.77 -0.06 0.00 -0.05 0.00 0.00 56.93 56.47 2a20 s PHE 115 Cb -0.09 -1.01 0.03 0.00 -0.63 0.00 0.00 43.02 41.32 2a20 s PHE 115 CO 0.28 0.17 0.93 0.00 -0.05 0.00 0.00 175.22 176.55 2a20 h ALA 117 N -0.29 1.08 0.00 0.00 0.00 -1.93 0.81 119.26 118.93 2a20 h ALA 117 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2a20 h ALA 117 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2a20 h ALA 117 CO 0.60 -0.08 -0.94 0.54 0.00 0.00 0.00 179.25 179.37 2a20 n ARG 118 N -2.61 0.16 -0.83 0.00 1.74 -1.26 -4.15 116.66 109.71 2a20 n ARG 118 Ca -0.02 -0.01 -0.05 0.00 -0.77 0.00 0.00 57.85 57.00 2a20 n ARG 118 Cb 0.14 -1.54 0.20 0.00 -1.02 0.00 0.00 32.46 30.24 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 -1.13 1.68 3.10 0.00 0.00 -1.18 -3.03 105.19 104.64 2a20 n GLY 120 Ca 0.34 -0.98 -0.15 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.40 0.64 -0.18 -0.02 0.00 0.51 -4.71 107.32 102.17 2a20 s GLY 121 Ca 0.00 -0.86 -0.21 0.00 0.00 0.00 0.00 44.72 43.65 2a20 s GLY 121 CO 0.00 -0.90 0.66 -1.60 0.00 0.00 0.00 173.10 171.26 2a20 s ARG 122 N -1.65 4.24 -0.34 2.90 3.52 -1.26 -2.29 118.95 124.07 2a20 s ARG 122 Ca -0.07 0.68 -0.01 0.00 -0.13 0.00 0.00 55.73 56.20 2a20 s ARG 122 Cb -0.10 -3.57 0.12 0.00 -1.56 0.00 0.00 34.95 29.84 2a20 s ARG 122 CO 0.01 -0.23 0.17 0.08 -0.81 0.00 0.00 175.30 174.53 2a20 s VAL 123 N 1.85 0.39 0.14 7.11 1.01 0.24 -5.01 120.40 126.13 2a20 s VAL 123 Ca 0.30 -1.50 -0.08 0.00 0.00 0.00 0.00 61.98 60.70 2a20 s VAL 123 Cb -0.16 -1.30 -0.06 0.00 0.00 0.00 0.00 36.38 34.86 2a20 s VAL 123 CO 0.11 -0.85 0.44 -0.44 0.00 0.00 0.00 175.10 174.37 2a20 s SER 124 N 1.36 6.60 -0.46 3.32 0.01 -1.26 -1.63 113.70 121.64 2a20 s SER 124 Ca 0.14 0.78 -0.02 0.00 1.31 0.00 0.00 55.95 58.16 2a20 s SER 124 Cb -0.20 -2.17 0.23 0.00 0.21 0.00 0.00 66.02 64.08 2a20 s SER 124 CO -0.15 0.06 2.24 0.18 0.41 0.00 0.00 173.24 175.98 2a20 n LEU 125 N 0.36 6.79 -3.28 2.44 4.32 -0.99 -4.79 117.00 121.85 2a20 n LEU 125 Ca -0.04 -3.82 -0.23 0.00 -0.02 0.00 0.00 56.01 51.91 2a20 n LEU 125 Cb 0.52 -1.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.23 2a20 n LEU 125 CO 0.45 1.46 -0.03 0.54 -1.22 0.00 0.00 177.39 178.58 2a20 n ARG 126 N 0.19 -3.69 -0.65 3.23 1.74 -1.26 -4.87 116.66 111.35 2a20 n ARG 126 Ca 0.43 0.56 0.00 0.00 -0.77 0.00 0.00 57.85 58.08 2a20 n ARG 126 Cb 0.56 -5.30 0.00 0.00 -1.02 0.00 0.00 32.46 26.70 2a20 n ARG 126 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2a20 n SER 127 N -2.33 0.00 0.00 0.55 2.88 -1.26 -5.01 113.62 108.45 2a20 n SER 127 Ca -0.04 -0.58 0.08 0.00 -1.33 0.00 0.00 58.87 57.01 2a20 n SER 127 Cb 0.56 0.00 0.37 0.00 -0.75 0.00 0.00 64.21 64.39 2a20 n SER 127 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2a20 n ASN 128 N -0.51 0.00 -4.50 -3.46 4.13 -1.26 -4.56 115.26 105.10 2a20 n ASN 128 Ca 0.00 0.45 -0.42 0.00 1.68 0.00 0.00 54.58 56.29 2a20 n ASN 128 Cb 0.00 -0.48 -0.03 0.00 -1.54 0.00 0.00 39.78 37.73 2a20 n ASN 128 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2a20 s LYS 129 N -2.96 3.18 -0.09 3.52 1.02 -1.26 -5.01 119.74 118.14 2a20 s LYS 129 Ca 0.09 -0.61 -0.12 0.00 0.02 0.00 0.00 55.97 55.36 2a20 s LYS 129 Cb 0.11 -4.27 -0.05 0.00 -0.52 0.00 0.00 37.83 33.11 2a20 s LYS 129 CO 0.31 -1.98 0.28 0.08 -0.92 0.00 0.00 175.35 173.12 2a20 s VAL 130 N 4.80 5.27 0.02 3.17 1.01 -1.26 -2.35 120.40 131.06 2a20 s VAL 130 Ca 0.29 0.53 0.03 0.00 0.00 0.00 0.00 61.98 62.83 2a20 s VAL 130 Cb -0.12 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 2a20 s VAL 130 CO 0.11 0.54 -0.09 -0.04 0.00 0.00 0.00 175.10 175.63 2a20 s MET 131 N -0.63 0.62 0.00 2.72 -1.94 -0.65 -5.00 119.30 114.41 2a20 s MET 131 Ca 0.18 -0.51 0.07 0.00 -1.71 0.00 0.00 55.69 53.72 2a20 s MET 131 Cb -0.14 -0.54 -0.02 0.00 2.01 0.00 0.00 34.83 36.14 2a20 s MET 131 CO 0.07 0.13 -0.21 -1.58 -0.01 0.00 0.00 175.02 173.42 2a20 s TRP 132 N -0.69 1.88 -0.08 -0.03 0.52 -1.26 -0.60 118.94 118.69 2a20 s TRP 132 Ca -0.02 -0.36 0.01 0.00 0.02 0.00 0.00 56.10 55.75 2a20 s TRP 132 Cb -0.06 -1.19 0.02 0.00 -1.15 0.00 0.00 33.47 31.09 2a20 s TRP 132 CO 0.00 0.00 -0.09 0.08 0.02 0.00 0.00 176.95 176.97 2a20 s VAL 133 N -0.58 0.96 0.67 4.03 1.01 -0.97 0.17 120.40 125.69 2a20 s VAL 133 Ca 0.08 -0.33 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 2a20 s VAL 133 Cb -0.08 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 2a20 s VAL 133 CO -0.00 0.33 1.15 0.00 0.00 0.00 0.00 175.10 176.58 2a20 h ASN 135 N 0.22 0.00 0.43 0.00 2.35 -1.82 0.27 115.58 117.03 2a20 h ASN 135 Ca -0.49 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 54.95 2a20 h ASN 135 Cb 1.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.71 2a20 h ASN 135 CO 0.51 0.00 -1.51 -0.07 -1.65 0.00 0.00 177.43 174.71 2a20 h LEU 136 N 0.00 0.47 0.15 1.61 3.38 -1.88 -2.92 115.31 116.12 2a20 h LEU 136 Ca 0.00 -0.62 -0.33 0.00 0.09 0.00 0.00 57.88 57.02 2a20 h LEU 136 Cb 0.51 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2a20 h LEU 136 CO 0.00 1.50 -1.69 0.00 0.09 0.00 0.00 178.44 178.34 2a20 h ARG 138 N 0.09 1.05 0.39 0.00 2.43 -0.72 0.25 114.38 117.87 2a20 h ARG 138 Ca -0.31 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 58.65 2a20 h ARG 138 Cb 2.06 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 31.44 2a20 h ARG 138 CO 0.16 0.86 -0.19 -0.22 -1.51 0.00 0.00 179.97 179.08 2a20 h LYS 139 N 1.03 -0.51 0.00 0.20 3.64 -1.64 0.55 116.57 119.85 2a20 h LYS 139 Ca 0.24 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 2a20 h LYS 139 Cb 0.21 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2a20 h LYS 139 CO -0.02 -0.22 -0.08 1.96 -2.27 0.00 0.00 179.45 178.83 2a20 h GLN 140 N -0.78 0.00 -0.01 1.90 4.20 -1.51 -1.52 115.11 117.38 2a20 h GLN 140 Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2a20 h GLN 140 Cb 0.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.31 2a20 h GLN 140 CO 0.09 0.08 -0.38 0.94 -0.67 0.00 0.00 178.83 178.88 2a20 n GLN 141 N -3.46 1.06 -0.34 1.46 -0.06 0.87 -5.09 117.38 111.83 2a20 n GLN 141 Ca -0.02 -0.79 0.00 0.00 -2.00 0.00 0.00 57.00 54.19 2a20 n GLN 141 Cb 0.22 -1.48 0.00 0.00 -4.06 0.00 0.00 30.24 24.91 2a20 n GLN 141 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25