#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 3.58 0.21 -1.09 -1.05 -1.26 -4.96 118.70 114.13 2a20 s GLU 84 Ca 0.00 -0.18 0.00 0.00 -0.15 0.00 0.00 54.97 54.64 2a20 s GLU 84 Cb 0.00 -2.88 0.00 0.00 -0.44 0.00 0.00 34.13 30.81 2a20 s GLU 84 CO 0.00 0.49 0.00 1.04 0.95 0.00 0.00 175.26 177.74 2a20 n GLN 85 N 0.05 0.00 0.01 -4.83 6.02 -1.26 -4.97 117.38 112.40 2a20 n GLN 85 Ca -0.03 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.74 2a20 n GLN 85 Cb 0.52 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.64 2a20 n GLN 85 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 2a20 h LYS 86 N 0.00 0.26 0.00 -1.09 1.79 -2.09 -3.50 116.57 111.93 2a20 h LYS 86 Ca 0.00 -0.44 0.31 0.00 -2.18 0.00 0.00 60.65 58.34 2a20 h LYS 86 Cb 0.00 0.16 -0.06 0.00 -1.58 0.00 0.00 32.23 30.75 2a20 h LYS 86 CO 0.00 1.21 0.78 0.41 -1.08 0.00 0.00 179.45 180.77 2a20 n GLY 87 N 1.82 0.19 3.77 3.86 0.00 -1.26 -5.15 105.19 108.42 2a20 n GLY 87 Ca -0.28 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 44.38 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 -3.31 6.93 0.89 1.61 2.15 -1.26 -4.90 116.67 118.77 2a20 s ASP 88 Ca 0.25 1.10 -0.12 0.00 0.43 0.00 0.00 52.55 54.22 2a20 s ASP 88 Cb -0.00 -2.34 0.13 0.00 -0.30 0.00 0.00 42.92 40.40 2a20 s ASP 88 CO -0.02 0.13 1.09 0.00 -0.17 0.00 0.00 175.17 176.20 2a20 s ALA 89 N -0.25 1.58 0.20 3.66 0.00 -1.26 -5.02 121.76 120.67 2a20 s ALA 89 Ca 0.29 -0.11 -0.24 0.00 0.00 0.00 0.00 51.96 51.90 2a20 s ALA 89 Cb -0.18 -3.17 -0.08 0.00 0.00 0.00 0.00 23.12 19.69 2a20 s ALA 89 CO 0.16 -2.32 0.79 -1.25 0.00 0.00 0.00 175.76 173.14 2a20 s PRO 90 N -4.97 4.49 0.03 0.00 0.05 -1.26 -5.01 135.00 128.33 2a20 s PRO 90 Ca 0.63 1.10 0.00 0.00 0.05 0.00 0.00 61.00 62.79 2a20 s PRO 90 Cb -0.18 -3.10 -0.03 0.00 0.05 0.00 0.00 34.50 31.25 2a20 s PRO 90 CO 0.57 0.48 -0.04 0.95 0.05 0.00 0.00 177.00 179.01 2a20 s THR 91 N -1.31 0.20 0.16 1.26 -4.23 -1.26 -2.47 115.64 107.99 2a20 s THR 91 Ca 0.40 -1.15 -0.30 0.00 -1.18 0.00 0.00 61.69 59.46 2a20 s THR 91 Cb -0.21 -0.61 -0.07 0.00 1.34 0.00 0.00 72.50 72.95 2a20 s THR 91 CO 0.25 -0.60 1.15 0.00 -0.54 0.00 0.00 174.62 174.87 2a20 n GLY 93 N 2.29 -0.62 0.89 0.00 0.00 0.38 -1.38 105.19 106.75 2a20 n GLY 93 Ca 0.04 -0.12 -0.03 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.31 0.86 0.09 -0.61 -0.00 -1.26 -4.78 119.36 113.35 2a20 n ILE 94 Ca 0.06 0.20 0.01 0.00 -0.00 0.00 0.00 62.75 63.02 2a20 n ILE 94 Cb 0.09 -1.65 -0.03 0.00 -0.00 0.00 0.00 39.64 38.05 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 -3.06 0.00 0.00 0.00 -0.00 -0.48 -4.69 115.22 106.99 2a20 n HIS 96 Ca -0.03 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.15 2a20 n HIS 96 Cb 0.78 -3.05 0.00 0.00 -0.12 0.00 0.00 29.99 27.60 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 -2.01 0.00 -1.72 1.57 4.81 -1.26 -4.83 118.16 114.72 2a20 n LYS 97 Ca -0.17 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 56.85 2a20 n LYS 97 Cb 0.61 -0.50 -0.03 0.00 0.02 0.00 0.00 35.03 35.13 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 -1.60 3.15 -0.11 3.15 2.01 -1.26 -4.78 115.64 116.19 2a20 s THR 98 Ca 0.00 0.14 -0.15 0.00 0.31 0.00 0.00 61.69 61.99 2a20 s THR 98 Cb 0.00 -3.22 -0.05 0.00 0.01 0.00 0.00 72.50 69.25 2a20 s THR 98 CO 0.00 -0.15 0.37 -0.54 -0.69 0.00 0.00 174.62 173.61 2a20 s LYS 99 N 6.43 4.16 -0.95 4.92 1.02 -1.26 -0.34 119.74 133.71 2a20 s LYS 99 Ca 0.93 0.27 -0.06 0.00 0.02 0.00 0.00 55.97 57.14 2a20 s LYS 99 Cb -0.27 -3.37 -0.06 0.00 -0.52 0.00 0.00 37.83 33.61 2a20 s LYS 99 CO 0.33 0.35 2.15 1.19 -0.92 0.00 0.00 175.35 178.45 2a20 n PHE 100 N 3.09 1.44 -1.21 3.18 3.72 -1.03 -4.91 117.46 121.75 2a20 n PHE 100 Ca -0.11 -2.03 0.00 0.00 -0.05 0.00 0.00 57.45 55.26 2a20 n PHE 100 Cb 0.52 -1.72 0.00 0.00 -0.94 0.00 0.00 39.48 37.34 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 4.25 0.00 -1.38 4.37 0.00 -1.26 -2.50 120.51 123.99 2a20 n ALA 101 Ca 0.47 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.67 2a20 n ALA 101 Cb 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.52 2a20 n ALA 101 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2a20 n ASP 102 N -3.76 6.26 0.00 0.00 8.00 -1.26 -4.35 116.55 121.44 2a20 n ASP 102 Ca 0.00 -3.08 0.00 0.00 0.71 0.00 0.00 54.79 52.42 2a20 n ASP 102 Cb 0.00 -1.26 0.00 0.00 -0.02 0.00 0.00 41.12 39.84 2a20 n ASP 102 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a20 n GLY 103 N 1.12 1.25 3.00 0.44 0.00 -1.04 -5.09 105.19 104.88 2a20 n GLY 103 Ca 0.47 0.35 -0.12 0.00 0.00 0.00 0.00 46.02 46.72 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 3.06 1.26 3.76 0.00 0.00 -1.26 -4.95 105.19 107.07 2a20 n GLY 105 Ca -0.13 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 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 3.05 3.46 -0.14 1.61 3.76 -0.95 -5.00 115.29 121.08 2a20 s HIS 106 Ca 0.00 0.39 0.01 0.00 -0.15 0.00 0.00 55.06 55.31 2a20 s HIS 106 Cb 0.00 -2.12 -0.00 0.00 1.11 0.00 0.00 32.58 31.57 2a20 s HIS 106 CO 0.00 0.39 -0.17 -0.80 -0.85 0.00 0.00 174.74 173.32 2a20 s ASN 107 N 0.04 3.59 0.05 1.40 0.02 -1.26 0.13 114.94 118.90 2a20 s ASN 107 Ca 0.10 -0.47 -0.34 0.00 -1.02 0.00 0.00 52.86 51.12 2a20 s ASN 107 Cb -0.11 -1.54 -0.13 0.00 0.02 0.00 0.00 41.25 39.48 2a20 s ASN 107 CO -0.00 0.11 1.68 0.00 0.02 0.00 0.00 177.10 178.90 2a20 n SER 109 N 4.61 0.38 0.00 0.00 2.88 0.42 -1.44 113.62 120.47 2a20 n SER 109 Ca 0.20 0.64 0.00 0.00 -1.33 0.00 0.00 58.87 58.38 2a20 n SER 109 Cb 0.28 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.03 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 -1.97 0.00 0.84 0.66 4.02 -1.26 -4.72 117.16 114.72 2a20 n TYR 110 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.98 2a20 n TYR 110 Cb 0.09 0.00 0.44 0.00 -0.02 0.00 0.00 39.34 39.85 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 -1.23 -1.28 -1.99 0.00 1.13 -0.52 -4.95 117.38 108.54 2a20 n GLN 112 Ca 0.09 0.33 -0.42 0.00 -1.94 0.00 0.00 57.00 55.06 2a20 n GLN 112 Cb 0.12 -4.29 -0.02 0.00 0.11 0.00 0.00 30.24 26.15 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 -1.37 2.64 -0.28 5.09 2.01 -1.26 -4.37 115.64 118.10 2a20 s THR 113 Ca 0.00 0.52 -0.26 0.00 0.31 0.00 0.00 61.69 62.26 2a20 s THR 113 Cb 0.00 -3.33 0.01 0.00 0.01 0.00 0.00 72.50 69.18 2a20 s THR 113 CO 0.00 0.07 0.93 -0.54 -0.69 0.00 0.00 174.62 174.39 2a20 s LYS 114 N -0.05 4.09 0.23 4.92 1.02 -1.26 -0.60 119.74 128.08 2a20 s LYS 114 Ca 0.62 0.93 0.06 0.00 0.02 0.00 0.00 55.97 57.60 2a20 s LYS 114 Cb -0.42 -3.70 -0.05 0.00 -0.52 0.00 0.00 37.83 33.14 2a20 s LYS 114 CO 0.41 -0.71 -0.07 -0.59 -0.92 0.00 0.00 175.35 173.48 2a20 s PHE 115 N 3.19 1.70 0.71 3.18 -0.12 0.12 0.14 117.98 126.89 2a20 s PHE 115 Ca 0.39 -0.75 -0.06 0.00 -0.05 0.00 0.00 56.93 56.47 2a20 s PHE 115 Cb -0.14 -0.92 0.08 0.00 -0.63 0.00 0.00 43.02 41.41 2a20 s PHE 115 CO 0.11 0.18 1.01 0.00 -0.05 0.00 0.00 175.22 176.47 2a20 h ALA 117 N -0.60 1.16 0.00 0.00 0.00 -1.95 0.97 119.26 118.84 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 0.54 -0.16 -1.18 0.54 0.00 0.00 0.00 179.25 178.99 2a20 n ARG 118 N -2.90 0.39 -0.94 0.00 1.74 -1.26 -4.14 116.66 109.55 2a20 n ARG 118 Ca -0.02 -0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 56.94 2a20 n ARG 118 Cb 0.22 -1.61 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 -1.05 0.53 3.43 0.00 0.00 -1.14 -2.94 105.19 104.02 2a20 n GLY 120 Ca 0.42 -0.71 -0.21 0.00 0.00 0.00 0.00 46.02 45.52 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 1.84 -0.04 -0.02 0.00 -0.66 -4.77 107.32 103.67 2a20 s GLY 121 Ca 0.00 -1.91 -0.21 0.00 0.00 0.00 0.00 44.72 42.60 2a20 s GLY 121 CO 0.00 -1.83 0.60 -1.60 0.00 0.00 0.00 173.10 170.26 2a20 s ARG 122 N -3.75 4.34 -0.41 2.90 3.52 -1.26 -2.28 118.95 122.01 2a20 s ARG 122 Ca 0.30 0.71 0.02 0.00 -0.13 0.00 0.00 55.73 56.63 2a20 s ARG 122 Cb 0.04 -3.38 0.13 0.00 -1.56 0.00 0.00 34.95 30.18 2a20 s ARG 122 CO 0.12 0.28 0.20 0.08 -0.81 0.00 0.00 175.30 175.16 2a20 s VAL 123 N 0.13 1.33 -0.37 7.11 1.01 0.86 -4.99 120.40 125.48 2a20 s VAL 123 Ca 0.31 -2.29 -0.20 0.00 0.00 0.00 0.00 61.98 59.81 2a20 s VAL 123 Cb -0.18 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.26 2a20 s VAL 123 CO 0.16 -0.83 0.62 -0.94 0.00 0.00 0.00 175.10 174.11 2a20 s SER 124 N 0.66 6.39 -0.21 3.32 1.04 -1.26 -1.55 113.70 122.10 2a20 s SER 124 Ca 0.16 0.01 -0.17 0.00 0.48 0.00 0.00 55.95 56.43 2a20 s SER 124 Cb -0.23 -2.32 -0.04 0.00 0.10 0.00 0.00 66.02 63.54 2a20 s SER 124 CO -0.05 -0.62 0.45 -0.76 0.98 0.00 0.00 173.24 173.24 2a20 s LEU 125 N 2.68 4.14 -0.53 2.42 1.43 0.31 -3.99 118.68 125.14 2a20 s LEU 125 Ca 0.23 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 53.89 2a20 s LEU 125 Cb -0.15 -2.59 0.00 0.00 0.03 0.00 0.00 46.19 43.49 2a20 s LEU 125 CO 0.15 -0.13 0.00 -1.14 0.23 0.00 0.00 176.35 175.46 2a20 n ARG 126 N 4.69 -0.91 -1.27 1.70 3.00 -1.26 -1.02 116.66 121.60 2a20 n ARG 126 Ca -0.07 0.55 -0.09 0.00 -0.00 0.00 0.00 57.85 58.24 2a20 n ARG 126 Cb 0.51 -4.41 -0.04 0.00 0.00 0.00 0.00 32.46 28.52 2a20 n ARG 126 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2a20 n SER 127 N -0.17 -5.00 0.00 6.15 7.64 -1.26 -4.70 113.62 116.28 2a20 n SER 127 Ca -0.05 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.06 2a20 n SER 127 Cb 0.30 -3.31 0.00 0.00 -1.01 0.00 0.00 64.21 60.20 2a20 n SER 127 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2a20 n ASN 128 N -0.59 0.86 -4.48 6.43 3.02 -1.09 -4.99 115.26 114.43 2a20 n ASN 128 Ca -0.09 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.03 2a20 n ASN 128 Cb 0.45 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.59 2a20 n ASN 128 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2a20 s LYS 129 N -1.56 3.28 -0.24 3.52 3.01 -0.19 -4.91 119.74 122.67 2a20 s LYS 129 Ca 0.00 -0.98 -0.17 0.00 -1.01 0.00 0.00 55.97 53.81 2a20 s LYS 129 Cb 0.00 -4.50 -0.03 0.00 -1.01 0.00 0.00 37.83 32.29 2a20 s LYS 129 CO 0.00 -1.90 0.46 0.08 0.51 0.00 0.00 175.35 174.50 2a20 s VAL 130 N 4.11 5.13 -0.01 3.17 1.01 -1.26 0.11 120.40 132.66 2a20 s VAL 130 Ca 0.29 0.80 -0.01 0.00 0.00 0.00 0.00 61.98 63.06 2a20 s VAL 130 Cb -0.11 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 2a20 s VAL 130 CO 0.04 0.16 0.03 0.00 0.00 0.00 0.00 175.10 175.33 2a20 s MET 131 N 1.89 0.11 -0.12 2.72 0.23 -0.59 -4.97 119.30 118.56 2a20 s MET 131 Ca 0.20 -0.07 -0.06 0.00 -1.03 0.00 0.00 55.69 54.73 2a20 s MET 131 Cb -0.15 0.04 -0.04 0.00 -1.53 0.00 0.00 34.83 33.15 2a20 s MET 131 CO 0.09 -0.02 0.08 -1.58 -2.03 0.00 0.00 175.02 171.57 2a20 s TRP 132 N -0.28 3.39 -0.03 3.16 0.52 -1.26 -0.10 118.94 124.34 2a20 s TRP 132 Ca -0.03 0.34 0.02 0.00 0.02 0.00 0.00 56.10 56.45 2a20 s TRP 132 Cb -0.02 -1.93 0.01 0.00 -1.15 0.00 0.00 33.47 30.38 2a20 s TRP 132 CO -0.00 0.53 -0.09 0.08 0.02 0.00 0.00 176.95 177.49 2a20 s VAL 133 N -0.68 0.82 0.70 4.03 1.01 -0.97 0.16 120.40 125.48 2a20 s VAL 133 Ca 0.12 -0.36 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 2a20 s VAL 133 Cb -0.12 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.53 2a20 s VAL 133 CO 0.02 0.27 1.26 0.00 0.00 0.00 0.00 175.10 176.65 2a20 h ASN 135 N 0.06 0.00 0.40 0.00 7.08 -1.87 0.73 115.58 121.99 2a20 h ASN 135 Ca -0.49 0.00 -0.31 0.00 -3.08 0.00 0.00 56.30 52.41 2a20 h ASN 135 Cb 1.33 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 37.58 2a20 h ASN 135 CO 0.51 0.00 -1.45 -0.07 -2.08 0.00 0.00 177.43 174.33 2a20 h LEU 136 N 0.00 0.61 0.07 6.14 3.38 -1.88 -2.83 115.31 120.79 2a20 h LEU 136 Ca 0.00 -0.71 -0.32 0.00 0.09 0.00 0.00 57.88 56.95 2a20 h LEU 136 Cb 0.47 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 2a20 h LEU 136 CO 0.00 1.56 -1.74 0.00 0.09 0.00 0.00 178.44 178.35 2a20 h ARG 138 N 0.04 0.15 0.19 0.00 2.43 0.25 0.37 114.38 117.81 2a20 h ARG 138 Ca -0.31 -0.03 -0.34 0.00 -0.81 0.00 0.00 59.98 58.49 2a20 h ARG 138 Cb 2.02 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 31.56 2a20 h ARG 138 CO 0.10 0.27 -1.66 -0.22 -1.51 0.00 0.00 179.97 176.95 2a20 h LYS 139 N 0.15 0.41 -0.29 0.20 1.63 -1.61 -2.65 116.57 114.40 2a20 h LYS 139 Ca 0.03 -0.70 -0.08 0.00 -0.85 0.00 0.00 60.65 59.05 2a20 h LYS 139 Cb 0.29 0.26 -0.02 0.00 -0.60 0.00 0.00 32.23 32.16 2a20 h LYS 139 CO 0.02 1.33 -0.17 0.37 -3.45 0.00 0.00 179.45 177.55 2a20 h GLN 140 N 0.07 0.52 -0.59 1.90 -0.00 -1.22 -2.28 115.11 113.51 2a20 h GLN 140 Ca -0.32 -0.17 0.00 0.00 -0.00 0.00 0.00 58.65 58.16 2a20 h GLN 140 Cb 2.07 -0.05 0.00 0.00 0.00 0.00 0.00 27.48 29.51 2a20 h GLN 140 CO 0.18 0.67 0.00 1.04 0.00 0.00 0.00 178.83 180.72 2a20 n GLN 141 N -4.17 2.51 -0.58 1.69 3.00 0.13 -5.07 117.38 114.88 2a20 n GLN 141 Ca 0.00 -2.10 0.00 0.00 -0.01 0.00 0.00 57.00 54.89 2a20 n GLN 141 Cb 0.35 -1.51 0.00 0.00 0.00 0.00 0.00 30.24 29.08 2a20 n GLN 141 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45