#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wg1 n SER 91 N 0.00 -4.43 -4.76 1.61 3.41 -1.26 -4.84 113.62 103.36 1wg1 n SER 91 Ca 0.00 0.38 -0.38 0.00 -0.26 0.00 0.00 58.87 58.61 1wg1 n SER 91 Cb 0.00 -0.88 0.02 0.00 -0.26 0.00 0.00 64.21 63.09 1wg1 n SER 91 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1wg1 s SER 92 N -1.15 5.67 0.01 4.04 1.04 -1.26 -4.66 113.70 117.39 1wg1 s SER 92 Ca 0.49 2.69 0.00 0.00 0.48 0.00 0.00 55.95 59.61 1wg1 s SER 92 Cb -0.29 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.19 1wg1 s SER 92 CO 0.74 -1.29 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1wg1 n GLY 93 N 0.64 -3.25 3.56 7.32 0.00 -1.26 -4.73 105.19 107.46 1wg1 n GLY 93 Ca 0.08 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 1wg1 n GLY 93 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wg1 s SER 94 N -0.06 6.35 0.37 1.61 0.15 -1.26 -3.96 113.70 116.91 1wg1 s SER 94 Ca 0.00 -0.01 -0.25 0.00 0.70 0.00 0.00 55.95 56.39 1wg1 s SER 94 Cb 0.00 -2.29 -0.09 0.00 -1.71 0.00 0.00 66.02 61.93 1wg1 s SER 94 CO 0.00 -0.53 1.05 -0.94 1.20 0.00 0.00 173.24 174.01 1wg1 s SER 95 N 1.78 6.89 0.00 5.45 1.04 -1.26 -4.58 113.70 123.02 1wg1 s SER 95 Ca 0.20 2.06 0.00 0.00 0.48 0.00 0.00 55.95 58.70 1wg1 s SER 95 Cb -0.15 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.38 1wg1 s SER 95 CO 0.14 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.57 1wg1 n GLY 96 N 0.50 3.38 3.24 7.32 0.00 -1.26 -4.83 105.19 113.54 1wg1 n GLY 96 Ca 0.04 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 44.21 1wg1 n GLY 96 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wg1 s ILE 97 N -1.91 0.08 -0.16 -0.61 -4.36 -0.07 -3.98 121.20 110.18 1wg1 s ILE 97 Ca 0.00 -0.63 -0.05 0.00 -0.26 0.00 0.00 60.65 59.71 1wg1 s ILE 97 Cb 0.00 -0.83 -0.03 0.00 1.25 0.00 0.00 42.46 42.85 1wg1 s ILE 97 CO 0.00 -0.35 0.00 -0.76 0.24 0.00 0.00 174.94 174.07 1wg1 s LEU 98 N -1.82 3.48 -0.78 0.37 1.43 0.10 -2.18 118.68 119.28 1wg1 s LEU 98 Ca -0.08 -0.03 -0.07 0.00 -1.03 0.00 0.00 54.13 52.92 1wg1 s LEU 98 Cb -0.02 -1.85 0.20 0.00 0.03 0.00 0.00 46.19 44.55 1wg1 s LEU 98 CO -0.01 0.20 0.67 -0.69 0.23 0.00 0.00 176.35 176.75 1wg1 s VAL 99 N 0.22 4.72 0.31 -1.59 1.01 -0.47 -1.93 120.40 122.66 1wg1 s VAL 99 Ca 0.00 -2.96 0.02 0.00 0.00 0.00 0.00 61.98 59.05 1wg1 s VAL 99 Cb -0.13 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 1wg1 s VAL 99 CO 0.02 -0.99 0.47 -0.54 0.00 0.00 0.00 175.10 174.06 1wg1 s LYS 100 N -0.28 3.45 -0.38 2.72 1.02 -0.69 -1.72 119.74 123.86 1wg1 s LYS 100 Ca 0.20 -0.52 -0.01 0.00 0.02 0.00 0.00 55.97 55.66 1wg1 s LYS 100 Cb -0.14 -2.75 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 1wg1 s LYS 100 CO -0.07 0.25 0.32 -1.71 -0.92 0.00 0.00 175.35 173.22 1wg1 n ASN 101 N -1.64 -2.32 -4.91 2.83 5.15 -1.18 -1.17 115.26 112.02 1wg1 n ASN 101 Ca -0.06 -0.19 -0.27 0.00 -0.60 0.00 0.00 54.58 53.46 1wg1 n ASN 101 Cb 0.57 -1.94 -0.02 0.00 -0.53 0.00 0.00 39.78 37.86 1wg1 n ASN 101 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1wg1 s LEU 102 N -3.27 3.97 0.00 1.20 1.43 -1.20 -4.46 118.68 116.34 1wg1 s LEU 102 Ca 0.04 0.72 0.00 0.00 -1.03 0.00 0.00 54.13 53.86 1wg1 s LEU 102 Cb -0.02 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.63 1wg1 s LEU 102 CO 0.23 -0.29 0.00 -0.81 0.23 0.00 0.00 176.35 175.71 1wg1 n PRO 103 N -1.34 0.15 -0.03 1.29 -0.04 -1.26 -4.89 135.00 128.88 1wg1 n PRO 103 Ca -0.02 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.41 1wg1 n PRO 103 Cb 0.55 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.88 1wg1 n PRO 103 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1wg1 n GLN 104 N -0.64 0.65 -0.99 0.54 7.27 -1.26 -4.21 117.38 118.74 1wg1 n GLN 104 Ca 0.00 0.09 -0.12 0.00 0.07 0.00 0.00 57.00 57.04 1wg1 n GLN 104 Cb 0.00 -1.66 0.19 0.00 2.41 0.00 0.00 30.24 31.18 1wg1 n GLN 104 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1wg1 n ASP 105 N -2.76 2.99 -4.70 1.69 8.00 -1.26 -5.03 116.55 115.48 1wg1 n ASP 105 Ca -0.18 -3.73 -0.32 0.00 0.71 0.00 0.00 54.79 51.27 1wg1 n ASP 105 Cb 0.94 -0.71 0.13 0.00 -0.02 0.00 0.00 41.12 41.46 1wg1 n ASP 105 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1wg1 s SER 106 N -2.09 3.54 0.08 -2.24 0.15 -1.26 -5.05 113.70 106.82 1wg1 s SER 106 Ca 0.49 2.19 -0.26 0.00 0.70 0.00 0.00 55.95 59.08 1wg1 s SER 106 Cb 0.44 -2.57 0.08 0.00 -1.71 0.00 0.00 66.02 62.26 1wg1 s SER 106 CO 0.04 -2.69 0.71 0.20 1.20 0.00 0.00 173.24 172.69 1wg1 s ASN 107 N -2.58 -0.51 -0.00 5.45 0.01 -1.26 -5.01 114.94 111.04 1wg1 s ASN 107 Ca 0.68 0.10 -0.24 0.00 -0.71 0.00 0.00 52.86 52.69 1wg1 s ASN 107 Cb -0.24 0.52 -0.15 0.00 0.41 0.00 0.00 41.25 41.79 1wg1 s ASN 107 CO 0.54 -0.81 1.09 0.00 -1.51 0.00 0.00 177.10 176.41 1wg1 h GLN 109 N -0.97 0.06 -0.13 0.00 4.15 -1.99 0.82 115.11 117.04 1wg1 h GLN 109 Ca -0.06 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.30 1wg1 h GLN 109 Cb 0.57 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.24 1wg1 h GLN 109 CO 0.10 0.04 -0.13 1.49 -1.93 0.00 0.00 178.83 178.40 1wg1 h GLU 110 N 0.06 0.32 -0.49 1.69 4.57 -1.96 -3.18 114.58 115.58 1wg1 h GLU 110 Ca 0.84 -0.17 -0.07 0.00 -1.18 0.00 0.00 59.36 58.79 1wg1 h GLU 110 Cb 2.53 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 31.10 1wg1 h GLU 110 CO -0.53 0.71 0.01 0.28 -1.18 0.00 0.00 179.01 178.30 1wg1 h VAL 111 N -0.07 1.24 -0.07 0.32 2.07 0.70 -3.09 116.25 117.36 1wg1 h VAL 111 Ca 0.02 -0.99 0.02 0.00 0.82 0.00 0.00 66.70 66.57 1wg1 h VAL 111 Cb 0.65 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1wg1 h VAL 111 CO 0.03 0.35 -0.52 0.45 0.02 0.00 0.00 177.57 177.90 1wg1 h HIS 112 N 0.75 -1.54 -0.72 1.57 3.86 -0.54 -0.11 115.15 118.42 1wg1 h HIS 112 Ca 0.15 0.05 0.13 0.00 -1.16 0.00 0.00 60.37 59.54 1wg1 h HIS 112 Cb 0.44 0.68 -0.09 0.00 1.06 0.00 0.00 27.41 29.51 1wg1 h HIS 112 CO 0.02 -0.54 0.30 -0.44 0.86 0.00 0.00 177.93 178.13 1wg1 h ASP 113 N -0.60 0.30 -0.51 2.45 5.19 -1.55 -1.09 116.42 120.61 1wg1 h ASP 113 Ca 0.02 0.10 0.07 0.00 -0.62 0.00 0.00 57.03 56.60 1wg1 h ASP 113 Cb 0.67 0.07 -0.06 0.00 0.18 0.00 0.00 39.33 40.19 1wg1 h ASP 113 CO -0.39 0.13 0.18 0.25 -3.12 0.00 0.00 179.24 176.30 1wg1 h LEU 114 N 0.46 0.19 -4.53 1.55 5.85 -1.20 -2.15 115.31 115.49 1wg1 h LEU 114 Ca 0.39 0.06 -0.72 0.00 0.84 0.00 0.00 57.88 58.44 1wg1 h LEU 114 Cb 0.54 0.04 -0.29 0.00 0.37 0.00 0.00 40.66 41.33 1wg1 h LEU 114 CO -0.37 0.14 0.90 0.18 -0.34 0.00 0.00 178.44 178.95 1wg1 n LEU 115 N -5.00 7.49 0.15 2.25 4.77 -0.16 -4.60 117.00 121.90 1wg1 n LEU 115 Ca 0.05 -4.61 -0.00 0.00 -0.03 0.00 0.00 56.01 51.42 1wg1 n LEU 115 Cb 0.20 -1.00 0.22 0.00 -2.33 0.00 0.00 43.42 40.51 1wg1 n LEU 115 CO 0.24 1.65 0.56 0.07 -1.33 0.00 0.00 177.39 178.58 1wg1 h LYS 116 N 2.54 0.00 -0.95 3.23 2.10 -0.66 -3.06 116.57 119.77 1wg1 h LYS 116 Ca 0.58 -0.00 0.06 0.00 -2.00 0.00 0.00 60.65 59.29 1wg1 h LYS 116 Cb 0.42 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.69 1wg1 h LYS 116 CO 1.48 0.55 0.62 0.22 -2.00 0.00 0.00 179.45 180.32 1wg1 h ASP 117 N 0.00 0.97 -2.23 7.07 3.58 -1.84 -3.42 116.42 120.54 1wg1 h ASP 117 Ca -0.01 0.01 -0.47 0.00 0.42 0.00 0.00 57.03 56.98 1wg1 h ASP 117 Cb 0.98 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.81 1wg1 h ASP 117 CO 0.07 0.62 -0.44 -0.31 -2.88 0.00 0.00 179.24 176.30 1wg1 s TYR 118 N -5.97 3.42 -0.32 0.28 1.51 -1.16 -5.08 117.35 110.04 1wg1 s TYR 118 Ca -0.12 -0.02 -0.20 0.00 -1.01 0.00 0.00 57.07 55.73 1wg1 s TYR 118 Cb 0.20 -1.56 -0.01 0.00 -0.11 0.00 0.00 41.96 40.48 1wg1 s TYR 118 CO 0.81 0.46 0.61 -0.51 -1.11 0.00 0.00 175.55 175.80 1wg1 s ASP 119 N -3.88 6.46 -0.17 2.29 1.01 -1.26 -4.95 116.67 116.16 1wg1 s ASP 119 Ca 0.34 0.33 -0.19 0.00 0.71 0.00 0.00 52.55 53.74 1wg1 s ASP 119 Cb -0.09 -2.32 -0.03 0.00 1.01 0.00 0.00 42.92 41.49 1wg1 s ASP 119 CO 0.28 -0.48 0.54 -0.76 0.21 0.00 0.00 175.17 174.97 1wg1 s LEU 120 N 2.58 4.20 -0.19 1.23 1.02 -1.26 -1.98 118.68 124.28 1wg1 s LEU 120 Ca 0.24 0.79 -0.15 0.00 0.02 0.00 0.00 54.13 55.03 1wg1 s LEU 120 Cb -0.15 -2.77 -0.10 0.00 0.02 0.00 0.00 46.19 43.19 1wg1 s LEU 120 CO 0.12 -0.14 -0.10 0.29 0.02 0.00 0.00 176.35 176.54 1wg1 n LYS 121 N 4.44 0.52 -4.34 1.70 5.02 0.23 -4.98 118.16 120.75 1wg1 n LYS 121 Ca -0.04 0.46 -0.20 0.00 -2.02 0.00 0.00 58.31 56.51 1wg1 n LYS 121 Cb 0.51 -1.65 -0.15 0.00 -0.02 0.00 0.00 35.03 33.72 1wg1 n LYS 121 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1wg1 s TYR 122 N -2.41 0.85 -0.05 2.13 5.04 -1.25 -5.00 117.35 116.66 1wg1 s TYR 122 Ca -0.25 -0.20 0.01 0.00 -2.44 0.00 0.00 57.07 54.19 1wg1 s TYR 122 Cb 0.05 -0.61 0.02 0.00 0.35 0.00 0.00 41.96 41.77 1wg1 s TYR 122 CO 0.41 -0.09 -0.06 0.00 -1.34 0.00 0.00 175.55 174.47 1wg1 s TYR 124 N 0.90 0.79 -0.14 0.00 5.04 -0.81 -4.98 117.35 118.16 1wg1 s TYR 124 Ca -0.11 -0.86 -0.19 0.00 -2.44 0.00 0.00 57.07 53.46 1wg1 s TYR 124 Cb -0.15 -1.03 -0.04 0.00 0.35 0.00 0.00 41.96 41.10 1wg1 s TYR 124 CO 0.01 -0.67 0.53 0.08 -1.34 0.00 0.00 175.55 174.15 1wg1 s VAL 125 N 1.94 5.13 -0.52 3.14 1.01 -1.26 -1.29 120.40 128.54 1wg1 s VAL 125 Ca 0.03 1.03 0.04 0.00 0.00 0.00 0.00 61.98 63.09 1wg1 s VAL 125 Cb -0.17 -3.86 0.13 0.00 0.00 0.00 0.00 36.38 32.48 1wg1 s VAL 125 CO -0.17 0.26 0.27 -1.81 0.00 0.00 0.00 175.10 173.65 1wg1 s ASP 126 N 0.84 4.34 0.25 3.32 1.01 0.81 -4.95 116.67 122.29 1wg1 s ASP 126 Ca 0.27 -3.02 -0.04 0.00 0.71 0.00 0.00 52.55 50.47 1wg1 s ASP 126 Cb -0.16 -1.65 0.40 0.00 1.01 0.00 0.00 42.92 42.52 1wg1 s ASP 126 CO 0.11 -0.23 1.83 0.03 0.21 0.00 0.00 175.17 177.12 1wg1 h ARG 127 N 6.50 0.86 -0.86 8.23 3.08 -1.94 0.66 114.38 130.91 1wg1 h ARG 127 Ca -0.08 -0.05 0.22 0.00 0.07 0.00 0.00 59.98 60.14 1wg1 h ARG 127 Cb 0.89 -0.19 -0.13 0.00 0.08 0.00 0.00 29.97 30.62 1wg1 h ARG 127 CO 0.69 0.57 0.31 -0.97 -1.07 0.00 0.00 179.97 179.50 1wg1 h ASN 128 N 0.89 0.17 -0.33 7.04 -0.73 -1.95 0.12 115.58 120.79 1wg1 h ASN 128 Ca 0.40 0.17 0.00 0.00 1.87 0.00 0.00 56.30 58.74 1wg1 h ASN 128 Cb 0.31 0.19 0.00 0.00 0.27 0.00 0.00 38.32 39.09 1wg1 h ASN 128 CO -0.22 -0.06 0.00 0.29 -0.37 0.00 0.00 177.43 177.07 1wg1 n LYS 129 N -5.12 2.94 -4.30 6.67 4.76 -0.68 -4.98 118.16 117.45 1wg1 n LYS 129 Ca 0.21 -2.40 -0.32 0.00 -2.87 0.00 0.00 58.31 52.92 1wg1 n LYS 129 Cb 0.63 -1.53 -0.09 0.00 -1.84 0.00 0.00 35.03 32.21 1wg1 n LYS 129 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1wg1 n ARG 130 N 0.14 -0.88 -3.79 1.97 1.74 0.22 -4.86 116.66 111.19 1wg1 n ARG 130 Ca 0.16 0.09 -0.14 0.00 -0.77 0.00 0.00 57.85 57.19 1wg1 n ARG 130 Cb 0.63 -3.48 -0.15 0.00 -1.02 0.00 0.00 32.46 28.45 1wg1 n ARG 130 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1wg1 s THR 131 N -4.32 -0.04 -0.12 0.55 2.01 -0.56 -3.11 115.64 110.05 1wg1 s THR 131 Ca 0.04 0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.19 1wg1 s THR 131 Cb -0.02 -0.13 0.01 0.00 0.01 0.00 0.00 72.50 72.37 1wg1 s THR 131 CO 1.00 0.05 -0.17 0.00 -0.69 0.00 0.00 174.62 174.81 1wg1 s ALA 132 N 0.73 1.87 -0.23 7.40 0.00 -0.70 -0.13 121.76 130.70 1wg1 s ALA 132 Ca -0.06 -0.86 -0.20 0.00 0.00 0.00 0.00 51.96 50.85 1wg1 s ALA 132 Cb -0.08 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 1wg1 s ALA 132 CO -0.03 -0.09 0.61 -0.06 0.00 0.00 0.00 175.76 176.19 1wg1 s PHE 133 N 0.99 3.32 -0.14 0.00 0.08 -0.41 -1.37 117.98 120.44 1wg1 s PHE 133 Ca -0.06 0.84 0.02 0.00 0.12 0.00 0.00 56.93 57.85 1wg1 s PHE 133 Cb -0.15 -2.80 0.00 0.00 -0.57 0.00 0.00 43.02 39.50 1wg1 s PHE 133 CO -0.03 -0.25 -0.21 0.08 -0.10 0.00 0.00 175.22 174.71 1wg1 s VAL 134 N 2.22 2.22 -0.45 -0.44 1.01 -0.93 -1.91 120.40 122.12 1wg1 s VAL 134 Ca 0.26 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.20 1wg1 s VAL 134 Cb -0.16 -1.89 0.09 0.00 0.00 0.00 0.00 36.38 34.43 1wg1 s VAL 134 CO 0.09 0.54 0.33 -0.89 0.00 0.00 0.00 175.10 175.17 1wg1 s THR 135 N 0.71 4.48 1.16 3.92 2.01 -0.68 -0.90 115.64 126.33 1wg1 s THR 135 Ca -0.09 -1.45 -0.19 0.00 0.31 0.00 0.00 61.69 60.27 1wg1 s THR 135 Cb -0.16 -3.79 0.27 0.00 0.01 0.00 0.00 72.50 68.83 1wg1 s THR 135 CO 0.01 -0.62 1.15 -0.76 -0.69 0.00 0.00 174.62 173.71 1wg1 s LEU 136 N 1.46 1.08 -0.00 4.42 1.43 -1.26 -0.60 118.68 125.21 1wg1 s LEU 136 Ca 0.04 0.56 -0.20 0.00 -1.03 0.00 0.00 54.13 53.50 1wg1 s LEU 136 Cb -0.25 -2.35 -0.11 0.00 0.03 0.00 0.00 46.19 43.52 1wg1 s LEU 136 CO 0.02 -3.86 0.90 0.25 0.23 0.00 0.00 176.35 173.89 1wg1 h LEU 137 N -2.40 -0.60 -9.79 1.79 5.85 -1.79 -3.43 115.31 104.94 1wg1 h LEU 137 Ca -0.45 0.02 -0.63 0.00 0.84 0.00 0.00 57.88 57.66 1wg1 h LEU 137 Cb 1.28 0.15 -0.13 0.00 0.37 0.00 0.00 40.66 42.34 1wg1 h LEU 137 CO 0.35 -0.26 -0.52 0.20 -0.34 0.00 0.00 178.44 177.86 1wg1 s ASN 138 N -4.25 3.62 -0.09 1.25 0.01 -1.26 -4.97 114.94 109.25 1wg1 s ASN 138 Ca -0.10 -1.63 -0.11 0.00 -0.71 0.00 0.00 52.86 50.30 1wg1 s ASN 138 Cb 0.01 0.43 -0.09 0.00 0.41 0.00 0.00 41.25 42.01 1wg1 s ASN 138 CO 0.31 -0.84 0.38 1.23 -1.51 0.00 0.00 177.10 176.67 1wg1 h GLY 139 N 1.55 -0.13 -0.86 0.66 0.00 -1.81 -3.27 103.07 99.22 1wg1 h GLY 139 Ca -0.41 0.05 0.33 0.00 0.00 0.00 0.00 47.33 47.30 1wg1 h GLY 139 CO 0.69 -0.05 0.35 1.18 0.00 0.00 0.00 176.54 178.71 1wg1 n GLU 140 N -4.83 -0.06 -0.17 4.80 1.02 -1.26 0.21 120.64 120.35 1wg1 n GLU 140 Ca -0.04 1.21 -0.08 0.00 -0.02 0.00 0.00 57.16 58.23 1wg1 n GLU 140 Cb 0.16 -2.11 0.01 0.00 -0.02 0.00 0.00 31.44 29.49 1wg1 n GLU 140 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1wg1 h GLN 141 N 0.00 0.71 0.10 3.49 4.20 -1.97 -3.17 115.11 118.48 1wg1 h GLN 141 Ca 0.68 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 59.26 1wg1 h GLN 141 Cb 1.71 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.38 1wg1 h GLN 141 CO -0.70 0.63 -0.05 0.00 -0.67 0.00 0.00 178.83 178.04 1wg1 h ALA 142 N 1.05 -0.14 -1.29 3.87 0.00 0.23 -0.44 119.26 122.54 1wg1 h ALA 142 Ca 0.16 -0.19 0.41 0.00 0.00 0.00 0.00 54.91 55.29 1wg1 h ALA 142 Cb 0.18 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.93 1wg1 h ALA 142 CO -0.01 -0.38 0.88 1.04 0.00 0.00 0.00 179.25 180.77 1wg1 n GLN 143 N -4.97 -0.02 -0.09 0.00 1.13 0.07 -0.28 117.38 113.21 1wg1 n GLN 143 Ca -0.09 0.96 -0.10 0.00 -1.94 0.00 0.00 57.00 55.83 1wg1 n GLN 143 Cb 0.23 -2.00 -0.04 0.00 0.11 0.00 0.00 30.24 28.54 1wg1 n GLN 143 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1wg1 n ASN 144 N -4.02 1.90 -0.38 1.08 3.02 -1.16 -4.34 115.26 111.36 1wg1 n ASN 144 Ca 0.34 0.42 0.37 0.00 -0.03 0.00 0.00 54.58 55.68 1wg1 n ASN 144 Cb 1.40 -0.79 0.62 0.00 -0.61 0.00 0.00 39.78 40.39 1wg1 n ASN 144 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wg1 h ALA 145 N -0.98 3.26 0.33 5.41 0.00 0.35 0.16 119.26 127.79 1wg1 h ALA 145 Ca -0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1wg1 h ALA 145 Cb 0.94 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1wg1 h ALA 145 CO -0.05 -1.92 -0.16 0.82 0.00 0.00 0.00 179.25 177.94 1wg1 h ILE 146 N 0.00 0.00 -0.02 0.00 2.04 -0.84 -2.57 117.51 116.12 1wg1 h ILE 146 Ca 0.64 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 66.46 1wg1 h ILE 146 Cb 3.09 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 39.16 1wg1 h ILE 146 CO -0.01 0.00 -0.00 1.56 0.00 0.00 0.00 178.15 179.70 1wg1 h GLN 147 N -0.48 0.04 -1.00 2.37 7.50 -1.28 0.71 115.11 122.98 1wg1 h GLN 147 Ca -0.05 -0.01 0.38 0.00 0.50 0.00 0.00 58.65 59.47 1wg1 h GLN 147 Cb 0.34 -0.00 -0.17 0.00 0.05 0.00 0.00 27.48 27.70 1wg1 h GLN 147 CO 0.07 0.37 0.50 0.52 -1.50 0.00 0.00 178.83 178.79 1wg1 h MET 148 N -0.30 0.09 0.00 1.46 2.86 -1.16 0.23 114.93 118.12 1wg1 h MET 148 Ca 0.01 -0.01 -0.34 0.00 -2.06 0.00 0.00 59.70 57.30 1wg1 h MET 148 Cb 0.35 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 31.93 1wg1 h MET 148 CO 0.00 0.06 -2.10 1.19 1.06 0.00 0.00 176.91 177.12 1wg1 n PHE 149 N -5.22 0.45 -1.55 -0.22 3.01 -0.97 -4.94 117.46 108.03 1wg1 n PHE 149 Ca 0.35 0.16 -0.61 0.00 1.01 0.00 0.00 57.45 58.36 1wg1 n PHE 149 Cb 1.15 -1.08 -0.08 0.00 -0.01 0.00 0.00 39.48 39.45 1wg1 n PHE 149 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 1wg1 n HIS 150 N -2.92 0.97 -3.02 1.38 -0.00 0.25 -0.69 115.22 111.20 1wg1 n HIS 150 Ca -0.27 1.07 -0.12 0.00 0.46 0.00 0.00 57.72 58.86 1wg1 n HIS 150 Cb 1.10 -2.10 0.05 0.00 -0.12 0.00 0.00 29.99 28.92 1wg1 n HIS 150 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1wg1 n GLN 151 N 2.23 -4.22 -3.51 1.57 6.02 0.06 -4.91 117.38 114.62 1wg1 n GLN 151 Ca 0.23 0.46 -0.33 0.00 -0.01 0.00 0.00 57.00 57.36 1wg1 n GLN 151 Cb 0.04 -4.38 -0.05 0.00 1.02 0.00 0.00 30.24 26.86 1wg1 n GLN 151 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1wg1 s TYR 152 N -3.18 3.50 -0.18 1.08 5.04 0.14 -4.82 117.35 118.93 1wg1 s TYR 152 Ca 0.23 0.80 -0.29 0.00 -2.44 0.00 0.00 57.07 55.37 1wg1 s TYR 152 Cb -0.10 -2.19 -0.01 0.00 0.35 0.00 0.00 41.96 40.02 1wg1 s TYR 152 CO 0.41 0.39 1.16 0.45 -1.34 0.00 0.00 175.55 176.62 1wg1 s SER 153 N -2.14 7.03 -0.17 4.32 0.15 -1.26 -0.79 113.70 120.83 1wg1 s SER 153 Ca 0.41 1.57 -0.06 0.00 0.70 0.00 0.00 55.95 58.57 1wg1 s SER 153 Cb -0.13 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 61.72 1wg1 s SER 153 CO 0.21 -0.70 0.35 0.12 1.20 0.00 0.00 173.24 174.42 1wg1 s PHE 154 N 3.24 -0.63 -0.95 3.44 5.36 0.23 -4.87 117.98 123.79 1wg1 s PHE 154 Ca 0.50 1.26 0.00 0.00 -0.96 0.00 0.00 56.93 57.73 1wg1 s PHE 154 Cb -0.19 0.14 0.00 0.00 -0.34 0.00 0.00 43.02 42.63 1wg1 s PHE 154 CO 0.12 -0.43 0.00 0.54 -1.46 0.00 0.00 175.22 173.98 1wg1 n ARG 155 N 5.37 -1.96 0.00 10.12 1.74 -1.26 0.81 116.66 131.48 1wg1 n ARG 155 Ca -0.07 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 1wg1 n ARG 155 Cb 0.50 -4.98 0.00 0.00 -1.02 0.00 0.00 32.46 26.96 1wg1 n ARG 155 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wg1 n GLY 156 N -0.55 3.10 3.88 -0.13 0.00 -1.26 -5.03 105.19 105.19 1wg1 n GLY 156 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1wg1 n GLY 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wg1 s LYS 157 N -0.35 3.78 -0.63 1.61 -0.14 0.24 -5.04 119.74 119.20 1wg1 s LYS 157 Ca 0.00 0.28 -0.19 0.00 -1.36 0.00 0.00 55.97 54.69 1wg1 s LYS 157 Cb 0.00 -2.60 0.10 0.00 -1.68 0.00 0.00 37.83 33.66 1wg1 s LYS 157 CO 0.00 0.24 0.78 0.16 -0.76 0.00 0.00 175.35 175.77 1wg1 s ASP 158 N -2.61 6.23 -0.05 2.83 -4.77 -1.26 -0.60 116.67 116.45 1wg1 s ASP 158 Ca 0.48 -1.44 -0.34 0.00 -3.30 0.00 0.00 52.55 47.95 1wg1 s ASP 158 Cb -0.11 -2.33 -0.12 0.00 -1.09 0.00 0.00 42.92 39.28 1wg1 s ASP 158 CO 0.24 -1.15 1.87 0.18 0.70 0.00 0.00 175.17 177.00 1wg1 n LEU 159 N 6.51 3.52 -4.39 2.11 4.77 0.03 -4.68 117.00 124.87 1wg1 n LEU 159 Ca -0.06 0.97 -0.44 0.00 -0.03 0.00 0.00 56.01 56.45 1wg1 n LEU 159 Cb 0.44 -1.40 -0.06 0.00 -2.33 0.00 0.00 43.42 40.07 1wg1 n LEU 159 CO 0.58 -0.04 0.30 -0.63 -1.33 0.00 0.00 177.39 176.27 1wg1 s ILE 160 N 3.82 4.95 -0.23 -0.08 1.01 -0.31 -0.76 121.20 129.60 1wg1 s ILE 160 Ca 0.91 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 60.50 1wg1 s ILE 160 Cb -0.66 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 37.42 1wg1 s ILE 160 CO 0.49 -0.91 0.36 -0.69 0.00 0.00 0.00 174.94 174.19 1wg1 s VAL 161 N 2.38 5.21 0.37 2.92 1.01 -1.25 -1.70 120.40 129.34 1wg1 s VAL 161 Ca 0.10 0.61 0.05 0.00 0.00 0.00 0.00 61.98 62.75 1wg1 s VAL 161 Cb -0.23 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1wg1 s VAL 161 CO 0.08 0.23 0.20 -1.10 0.00 0.00 0.00 175.10 174.51 1wg1 s GLN 162 N 1.51 1.85 0.39 2.72 -0.21 -0.81 -4.55 119.66 120.55 1wg1 s GLN 162 Ca 0.17 -2.11 0.01 0.00 0.02 0.00 0.00 55.36 53.45 1wg1 s GLN 162 Cb -0.15 -0.15 -0.02 0.00 1.00 0.00 0.00 33.01 33.70 1wg1 s GLN 162 CO 0.08 -0.57 0.58 -1.17 -2.12 0.00 0.00 175.29 172.09 1wg1 s LEU 163 N -3.49 3.86 -0.03 2.90 2.96 -1.26 0.01 118.68 123.62 1wg1 s LEU 163 Ca 0.32 0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.52 1wg1 s LEU 163 Cb 0.02 -3.15 -0.03 0.00 0.50 0.00 0.00 46.19 43.53 1wg1 s LEU 163 CO 0.21 -0.48 -0.04 -1.10 -1.32 0.00 0.00 176.35 173.61 1wg1 s GLN 164 N -4.39 2.73 -0.67 1.98 -0.21 -1.26 -4.62 119.66 113.22 1wg1 s GLN 164 Ca 0.44 -0.60 -0.26 0.00 0.02 0.00 0.00 55.36 54.96 1wg1 s GLN 164 Cb -0.10 -2.61 -0.03 0.00 1.00 0.00 0.00 33.01 31.28 1wg1 s GLN 164 CO 0.36 0.64 1.88 -1.25 -2.12 0.00 0.00 175.29 174.80 1wg1 s PRO 165 N -1.19 2.61 -0.27 2.91 0.04 -1.26 -4.79 135.00 133.05 1wg1 s PRO 165 Ca 0.16 0.43 0.13 0.00 0.04 0.00 0.00 61.00 61.76 1wg1 s PRO 165 Cb -0.11 -4.52 0.48 0.00 0.04 0.00 0.00 34.50 30.38 1wg1 s PRO 165 CO 0.06 -2.86 1.16 2.41 0.04 0.00 0.00 177.00 177.80 1wg1 n THR 166 N 7.34 2.01 0.27 1.26 -1.04 -1.26 -4.87 114.28 117.99 1wg1 n THR 166 Ca 0.24 -3.66 -0.14 0.00 -2.04 0.00 0.00 64.05 58.45 1wg1 n THR 166 Cb 0.51 -0.15 -0.07 0.00 -1.82 0.00 0.00 70.33 68.80 1wg1 n THR 166 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1wg1 h ASP 167 N 2.31 -0.60 -4.40 8.00 3.58 -2.02 -3.42 116.42 119.87 1wg1 h ASP 167 Ca 0.16 -0.06 -0.32 0.00 0.42 0.00 0.00 57.03 57.24 1wg1 h ASP 167 Cb 1.43 0.15 -0.24 0.00 1.72 0.00 0.00 39.33 42.39 1wg1 h ASP 167 CO 0.51 -0.23 -0.75 0.00 -2.88 0.00 0.00 179.24 175.89 1wg1 s ALA 168 N -4.92 0.61 -0.35 -0.78 0.00 -1.26 -3.81 121.76 111.26 1wg1 s ALA 168 Ca -0.14 -0.58 -0.29 0.00 0.00 0.00 0.00 51.96 50.95 1wg1 s ALA 168 Cb 0.02 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.11 1wg1 s ALA 168 CO 0.48 0.06 1.13 -1.17 0.00 0.00 0.00 175.76 176.26 1wg1 s LEU 169 N -1.00 3.86 -0.03 0.00 0.20 -1.26 -4.95 118.68 115.49 1wg1 s LEU 169 Ca -0.04 0.95 -0.40 0.00 0.69 0.00 0.00 54.13 55.33 1wg1 s LEU 169 Cb -0.07 -3.54 -0.19 0.00 -0.43 0.00 0.00 46.19 41.96 1wg1 s LEU 169 CO 0.00 -1.00 1.19 0.18 -0.29 0.00 0.00 176.35 176.43 1wg1 n LEU 170 N 7.22 0.50 -3.67 -0.68 4.32 -1.26 -4.95 117.00 118.48 1wg1 n LEU 170 Ca 0.13 1.15 -0.26 0.00 -0.02 0.00 0.00 56.01 57.01 1wg1 n LEU 170 Cb 0.47 -0.98 -0.17 0.00 -1.62 0.00 0.00 43.42 41.12 1wg1 n LEU 170 CO 0.63 -1.61 -0.35 0.00 -1.22 0.00 0.00 177.39 174.84 1wg1 h SER 172 N 8.36 -0.27 -3.71 0.00 0.87 -2.06 -3.50 113.55 113.24 1wg1 h SER 172 Ca -0.15 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 1wg1 h SER 172 Cb 1.14 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 1wg1 h SER 172 CO 0.29 0.20 -0.20 0.61 -0.53 0.00 0.00 176.83 177.20 1wg1 n GLY 173 N 0.94 -1.47 3.65 5.77 0.00 -1.26 -5.05 105.19 107.78 1wg1 n GLY 173 Ca -0.04 0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1wg1 n GLY 173 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wg1 s PRO 174 N -1.27 -0.06 -0.35 1.61 0.04 -1.26 -5.00 135.00 128.71 1wg1 s PRO 174 Ca 0.06 0.35 0.08 0.00 0.04 0.00 0.00 61.00 61.53 1wg1 s PRO 174 Cb -0.02 -1.69 0.45 0.00 0.04 0.00 0.00 34.50 33.28 1wg1 s PRO 174 CO 0.25 -3.02 1.14 0.45 0.04 0.00 0.00 177.00 175.86 1wg1 n SER 175 N -4.35 4.48 -3.67 6.66 2.88 -1.26 -4.99 113.62 113.37 1wg1 n SER 175 Ca 0.07 -3.59 -0.09 0.00 -1.33 0.00 0.00 58.87 53.93 1wg1 n SER 175 Cb 0.58 -0.40 -0.10 0.00 -0.75 0.00 0.00 64.21 63.54 1wg1 n SER 175 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wg1 s SER 176 N -3.57 -0.29 0.00 -3.46 0.15 -1.26 -5.38 113.70 99.89 1wg1 s SER 176 Ca 0.47 0.96 0.00 0.00 0.70 0.00 0.00 55.95 58.09 1wg1 s SER 176 Cb 0.40 1.21 0.00 0.00 -1.71 0.00 0.00 66.02 65.92 1wg1 s SER 176 CO -0.05 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.77