#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wg1 s SER 91 N 0.00 6.47 0.00 1.61 0.15 -1.26 -5.00 113.70 115.67 1wg1 s SER 91 Ca 0.00 0.84 0.00 0.00 0.70 0.00 0.00 55.95 57.49 1wg1 s SER 91 Cb 0.00 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 1wg1 s SER 91 CO 0.00 -0.25 0.00 -1.54 1.20 0.00 0.00 173.24 172.65 1wg1 n SER 92 N -1.03 4.27 0.00 5.45 3.41 -1.26 -5.07 113.62 119.38 1wg1 n SER 92 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1wg1 n SER 92 Cb 0.54 0.70 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 1wg1 n SER 92 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wg1 n GLY 93 N 2.32 -1.98 3.82 5.00 0.00 -1.26 -5.01 105.19 108.08 1wg1 n GLY 93 Ca 0.00 0.66 -0.30 0.00 0.00 0.00 0.00 46.02 46.38 1wg1 n GLY 93 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wg1 n SER 94 N 0.00 -3.63 -4.77 1.61 2.88 -1.26 -2.55 113.62 105.90 1wg1 n SER 94 Ca 0.00 -0.71 -0.38 0.00 -1.33 0.00 0.00 58.87 56.44 1wg1 n SER 94 Cb 0.00 -2.97 -0.06 0.00 -0.75 0.00 0.00 64.21 60.43 1wg1 n SER 94 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wg1 s SER 95 N -3.04 6.81 0.00 -3.46 1.04 -1.26 -4.48 113.70 109.31 1wg1 s SER 95 Ca 0.59 0.96 0.00 0.00 0.48 0.00 0.00 55.95 57.99 1wg1 s SER 95 Cb -0.32 -2.30 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1wg1 s SER 95 CO 0.73 0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.69 1wg1 n GLY 96 N 2.58 4.27 3.09 7.32 0.00 -1.26 -4.67 105.19 116.52 1wg1 n GLY 96 Ca -0.09 -1.39 -0.10 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.96 0.11 -0.19 -0.61 -4.36 -0.15 -3.48 121.20 110.54 1wg1 s ILE 97 Ca 0.00 -0.88 -0.06 0.00 -0.26 0.00 0.00 60.65 59.44 1wg1 s ILE 97 Cb 0.00 -0.60 -0.03 0.00 1.25 0.00 0.00 42.46 43.08 1wg1 s ILE 97 CO 0.00 -0.49 0.04 -0.76 0.24 0.00 0.00 174.94 173.97 1wg1 s LEU 98 N -1.70 3.54 -0.72 0.37 1.43 0.99 -2.12 118.68 120.48 1wg1 s LEU 98 Ca -0.11 -0.06 -0.17 0.00 -1.03 0.00 0.00 54.13 52.76 1wg1 s LEU 98 Cb -0.05 -1.90 0.15 0.00 0.03 0.00 0.00 46.19 44.42 1wg1 s LEU 98 CO -0.01 0.11 0.76 -0.69 0.23 0.00 0.00 176.35 176.75 1wg1 s VAL 99 N 0.72 5.15 0.26 -1.59 1.01 -0.28 -1.77 120.40 123.89 1wg1 s VAL 99 Ca 0.02 -1.69 0.06 0.00 0.00 0.00 0.00 61.98 60.36 1wg1 s VAL 99 Cb -0.14 -4.50 -0.03 0.00 0.00 0.00 0.00 36.38 31.71 1wg1 s VAL 99 CO 0.02 -1.11 0.35 -0.54 0.00 0.00 0.00 175.10 173.82 1wg1 s LYS 100 N 1.62 3.29 -0.62 2.72 1.02 -0.29 -1.74 119.74 125.75 1wg1 s LYS 100 Ca 0.16 -0.86 -0.01 0.00 0.02 0.00 0.00 55.97 55.28 1wg1 s LYS 100 Cb -0.17 -2.82 -0.01 0.00 -0.52 0.00 0.00 37.83 34.31 1wg1 s LYS 100 CO -0.02 0.37 0.52 -1.71 -0.92 0.00 0.00 175.35 173.59 1wg1 n ASN 101 N -1.40 -2.94 -4.90 2.83 5.15 -1.24 -1.25 115.26 111.51 1wg1 n ASN 101 Ca -0.07 -0.35 -0.29 0.00 -0.60 0.00 0.00 54.58 53.26 1wg1 n ASN 101 Cb 0.57 -3.01 -0.04 0.00 -0.53 0.00 0.00 39.78 36.78 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 -4.32 4.06 0.00 1.20 1.43 -1.19 -4.40 118.68 115.46 1wg1 s LEU 102 Ca 0.09 0.78 0.00 0.00 -1.03 0.00 0.00 54.13 53.97 1wg1 s LEU 102 Cb -0.01 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.62 1wg1 s LEU 102 CO 0.39 -0.18 0.00 -0.81 0.23 0.00 0.00 176.35 175.98 1wg1 n PRO 103 N -0.79 0.03 0.04 1.29 -0.04 -1.26 -4.95 135.00 129.32 1wg1 n PRO 103 Ca -0.01 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.44 1wg1 n PRO 103 Cb 0.54 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.92 1wg1 n PRO 103 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1wg1 h GLN 104 N 0.00 0.00 -0.55 0.54 1.08 -1.99 -3.34 115.11 110.85 1wg1 h GLN 104 Ca 0.00 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 56.86 1wg1 h GLN 104 Cb 0.00 0.00 -0.21 0.00 -0.05 0.00 0.00 27.48 27.22 1wg1 h GLN 104 CO 0.00 0.39 -0.07 -3.47 -0.95 0.00 0.00 178.83 174.73 1wg1 n ASP 105 N -2.99 3.69 -4.77 1.46 2.03 -1.26 -5.04 116.55 109.68 1wg1 n ASP 105 Ca -0.08 -3.78 -0.38 0.00 0.52 0.00 0.00 54.79 51.07 1wg1 n ASP 105 Cb 0.86 -0.63 -0.01 0.00 -0.72 0.00 0.00 41.12 40.61 1wg1 n ASP 105 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1wg1 s SER 106 N -2.60 6.33 0.27 1.67 0.15 -1.26 -5.04 113.70 113.23 1wg1 s SER 106 Ca 0.49 2.33 -0.21 0.00 0.70 0.00 0.00 55.95 59.26 1wg1 s SER 106 Cb 0.43 -2.61 0.03 0.00 -1.71 0.00 0.00 66.02 62.15 1wg1 s SER 106 CO 0.01 -0.80 0.71 0.20 1.20 0.00 0.00 173.24 174.55 1wg1 s ASN 107 N -1.25 -0.29 0.04 5.45 0.01 -1.26 -4.99 114.94 112.65 1wg1 s ASN 107 Ca 0.61 -0.55 -0.22 0.00 -0.71 0.00 0.00 52.86 51.98 1wg1 s ASN 107 Cb -0.29 0.72 -0.12 0.00 0.41 0.00 0.00 41.25 41.96 1wg1 s ASN 107 CO 0.36 -1.31 1.34 0.00 -1.51 0.00 0.00 177.10 175.98 1wg1 n GLN 109 N -4.18 -0.05 0.18 0.00 1.13 -1.26 0.13 117.38 113.34 1wg1 n GLN 109 Ca -0.10 1.04 -0.14 0.00 -1.94 0.00 0.00 57.00 55.86 1wg1 n GLN 109 Cb 0.31 -1.85 -0.08 0.00 0.11 0.00 0.00 30.24 28.73 1wg1 n GLN 109 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1wg1 h GLU 110 N 0.00 -0.42 -0.28 -1.09 5.08 -1.90 -3.02 114.58 112.96 1wg1 h GLU 110 Ca 0.63 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.99 1wg1 h GLU 110 Cb 1.64 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.97 1wg1 h GLU 110 CO -0.58 -0.18 0.10 0.28 -1.00 0.00 0.00 179.01 177.62 1wg1 h VAL 111 N -0.58 1.19 -0.59 3.13 2.07 0.13 -3.02 116.25 118.57 1wg1 h VAL 111 Ca -0.04 -0.60 0.05 0.00 0.82 0.00 0.00 66.70 66.93 1wg1 h VAL 111 Cb 0.42 1.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 1wg1 h VAL 111 CO 0.07 0.20 -0.37 0.45 0.02 0.00 0.00 177.57 177.95 1wg1 h HIS 112 N 0.30 -1.18 -0.66 1.57 3.86 -0.62 0.33 115.15 118.76 1wg1 h HIS 112 Ca 0.09 0.08 0.13 0.00 -1.16 0.00 0.00 60.37 59.51 1wg1 h HIS 112 Cb 0.22 0.59 -0.09 0.00 1.06 0.00 0.00 27.41 29.19 1wg1 h HIS 112 CO 0.00 -0.24 0.18 -0.44 0.86 0.00 0.00 177.93 178.29 1wg1 h ASP 113 N -0.02 0.07 -0.58 2.45 3.32 -1.55 0.35 116.42 120.46 1wg1 h ASP 113 Ca 0.10 0.12 0.06 0.00 0.02 0.00 0.00 57.03 57.33 1wg1 h ASP 113 Cb 0.27 0.14 -0.06 0.00 0.22 0.00 0.00 39.33 39.90 1wg1 h ASP 113 CO -0.57 0.03 0.28 0.25 -1.72 0.00 0.00 179.24 177.51 1wg1 h LEU 114 N 0.31 0.37 -4.09 1.55 5.85 -0.52 -2.13 115.31 116.66 1wg1 h LEU 114 Ca 0.35 0.04 -0.67 0.00 0.84 0.00 0.00 57.88 58.45 1wg1 h LEU 114 Cb 0.54 -0.02 -0.31 0.00 0.37 0.00 0.00 40.66 41.23 1wg1 h LEU 114 CO -0.42 0.24 0.61 0.18 -0.34 0.00 0.00 178.44 178.72 1wg1 n LEU 115 N -4.89 7.21 -0.16 2.25 4.77 0.85 -4.66 117.00 122.37 1wg1 n LEU 115 Ca 0.07 -4.44 -0.09 0.00 -0.03 0.00 0.00 56.01 51.52 1wg1 n LEU 115 Cb 0.19 -0.88 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 1wg1 n LEU 115 CO 0.27 1.62 0.90 0.07 -1.33 0.00 0.00 177.39 178.92 1wg1 h LYS 116 N 2.15 0.72 -0.78 3.23 2.10 -0.28 -2.94 116.57 120.78 1wg1 h LYS 116 Ca 0.56 -0.16 0.18 0.00 -2.00 0.00 0.00 60.65 59.23 1wg1 h LYS 116 Cb 0.83 -0.10 -0.12 0.00 -0.90 0.00 0.00 32.23 31.94 1wg1 h LYS 116 CO 1.44 0.70 0.18 0.22 -2.00 0.00 0.00 179.45 179.98 1wg1 h ASP 117 N 0.61 -0.02 -3.42 7.07 3.58 -1.84 -3.40 116.42 119.00 1wg1 h ASP 117 Ca 0.15 0.16 -0.54 0.00 0.42 0.00 0.00 57.03 57.22 1wg1 h ASP 117 Cb 0.28 0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.52 1wg1 h ASP 117 CO -0.00 -0.08 -0.09 -0.31 -2.88 0.00 0.00 179.24 175.88 1wg1 s TYR 118 N -6.03 3.48 -0.09 0.28 2.02 -1.11 -5.06 117.35 110.85 1wg1 s TYR 118 Ca -0.13 0.96 -0.26 0.00 -0.37 0.00 0.00 57.07 57.28 1wg1 s TYR 118 Cb 0.22 -2.32 -0.03 0.00 -0.40 0.00 0.00 41.96 39.44 1wg1 s TYR 118 CO 0.76 0.31 0.84 -0.51 -1.57 0.00 0.00 175.55 175.38 1wg1 s ASP 119 N -2.14 7.10 -0.24 2.29 1.11 -1.26 -4.93 116.67 118.60 1wg1 s ASP 119 Ca 0.45 1.33 -0.10 0.00 0.18 0.00 0.00 52.55 54.41 1wg1 s ASP 119 Cb -0.12 -2.48 -0.05 0.00 1.07 0.00 0.00 42.92 41.34 1wg1 s ASP 119 CO 0.20 -0.27 0.16 -0.76 1.18 0.00 0.00 175.17 175.68 1wg1 s LEU 120 N 1.40 4.11 -0.10 1.23 1.02 -1.26 -2.55 118.68 122.53 1wg1 s LEU 120 Ca 0.42 0.11 -0.09 0.00 0.02 0.00 0.00 54.13 54.59 1wg1 s LEU 120 Cb -0.18 -2.10 -0.27 0.00 0.02 0.00 0.00 46.19 43.65 1wg1 s LEU 120 CO 0.19 0.07 0.46 0.11 0.02 0.00 0.00 176.35 177.19 1wg1 h LYS 121 N 7.51 0.29 -2.91 1.70 1.57 -1.08 -3.48 116.57 120.17 1wg1 h LYS 121 Ca -0.38 -0.49 -0.15 0.00 -1.87 0.00 0.00 60.65 57.75 1wg1 h LYS 121 Cb 1.17 0.18 -0.27 0.00 0.08 0.00 0.00 32.23 33.40 1wg1 h LYS 121 CO 0.66 1.24 -0.38 -0.47 -0.57 0.00 0.00 179.45 179.93 1wg1 s TYR 122 N -2.55 -0.40 -0.12 -1.35 5.04 -1.25 -5.00 117.35 111.72 1wg1 s TYR 122 Ca -0.21 0.93 -0.01 0.00 -2.44 0.00 0.00 57.07 55.35 1wg1 s TYR 122 Cb 0.06 0.13 0.03 0.00 0.35 0.00 0.00 41.96 42.53 1wg1 s TYR 122 CO 0.78 -0.23 -0.06 0.00 -1.34 0.00 0.00 175.55 174.71 1wg1 s TYR 124 N 1.73 1.65 -0.12 0.00 6.14 -0.88 -4.99 117.35 120.88 1wg1 s TYR 124 Ca 0.04 -0.91 -0.14 0.00 0.64 0.00 0.00 57.07 56.69 1wg1 s TYR 124 Cb -0.13 -1.31 -0.05 0.00 0.42 0.00 0.00 41.96 40.89 1wg1 s TYR 124 CO -0.08 -0.57 0.34 0.08 0.64 0.00 0.00 175.55 175.97 1wg1 s VAL 125 N 1.65 5.25 -0.54 3.14 1.01 -1.26 -0.67 120.40 128.98 1wg1 s VAL 125 Ca 0.04 0.66 0.03 0.00 0.00 0.00 0.00 61.98 62.71 1wg1 s VAL 125 Cb -0.13 -3.67 0.14 0.00 0.00 0.00 0.00 36.38 32.71 1wg1 s VAL 125 CO -0.08 0.42 0.29 -0.62 0.00 0.00 0.00 175.10 175.11 1wg1 s ASP 126 N 0.14 4.45 0.23 3.32 -1.08 0.61 -4.95 116.67 119.40 1wg1 s ASP 126 Ca 0.20 -3.02 -0.07 0.00 -0.52 0.00 0.00 52.55 49.13 1wg1 s ASP 126 Cb -0.14 -1.67 0.25 0.00 -1.46 0.00 0.00 42.92 39.90 1wg1 s ASP 126 CO 0.07 -0.24 1.89 0.03 0.52 0.00 0.00 175.17 177.43 1wg1 h ARG 127 N 6.53 1.08 -0.89 4.34 2.47 -1.94 0.93 114.38 126.90 1wg1 h ARG 127 Ca -0.07 -0.06 0.22 0.00 -1.26 0.00 0.00 59.98 58.81 1wg1 h ARG 127 Cb 0.89 -0.24 -0.13 0.00 -1.65 0.00 0.00 29.97 28.85 1wg1 h ARG 127 CO 0.69 0.71 0.38 -0.91 0.56 0.00 0.00 179.97 181.41 1wg1 h ASN 128 N 1.11 0.31 -0.27 7.04 4.21 -1.95 0.56 115.58 126.59 1wg1 h ASN 128 Ca 0.34 0.16 0.00 0.00 1.21 0.00 0.00 56.30 58.01 1wg1 h ASN 128 Cb -0.03 0.14 0.00 0.00 -1.12 0.00 0.00 38.32 37.31 1wg1 h ASN 128 CO -0.10 -0.01 0.00 0.29 -1.29 0.00 0.00 177.43 176.31 1wg1 n LYS 129 N -5.06 2.83 -4.16 0.81 4.76 -0.86 -4.99 118.16 111.49 1wg1 n LYS 129 Ca 0.22 -2.22 -0.36 0.00 -2.87 0.00 0.00 58.31 53.08 1wg1 n LYS 129 Cb 0.66 -1.40 -0.04 0.00 -1.84 0.00 0.00 35.03 32.41 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 0.04 -0.98 -3.73 1.97 1.74 0.31 -4.88 116.66 111.12 1wg1 n ARG 130 Ca 0.13 0.14 -0.12 0.00 -0.77 0.00 0.00 57.85 57.23 1wg1 n ARG 130 Cb 0.54 -3.34 -0.12 0.00 -1.02 0.00 0.00 32.46 28.51 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 -4.00 -0.03 -0.13 0.55 2.01 -0.21 -3.18 115.64 110.67 1wg1 s THR 131 Ca 0.20 0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.30 1wg1 s THR 131 Cb -0.10 -0.44 -0.01 0.00 0.01 0.00 0.00 72.50 71.96 1wg1 s THR 131 CO 0.97 0.04 -0.17 0.00 -0.69 0.00 0.00 174.62 174.77 1wg1 s ALA 132 N 0.99 2.45 -0.23 7.40 0.00 -0.71 -0.28 121.76 131.38 1wg1 s ALA 132 Ca -0.07 -0.95 -0.18 0.00 0.00 0.00 0.00 51.96 50.76 1wg1 s ALA 132 Cb -0.08 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 1wg1 s ALA 132 CO -0.07 0.19 0.50 -0.06 0.00 0.00 0.00 175.76 176.32 1wg1 s PHE 133 N 0.46 3.32 -0.14 0.00 0.08 0.15 -1.13 117.98 120.73 1wg1 s PHE 133 Ca -0.12 0.69 0.02 0.00 0.12 0.00 0.00 56.93 57.64 1wg1 s PHE 133 Cb -0.16 -2.67 0.00 0.00 -0.57 0.00 0.00 43.02 39.62 1wg1 s PHE 133 CO 0.05 -0.17 -0.20 0.08 -0.10 0.00 0.00 175.22 174.88 1wg1 s VAL 134 N 1.90 2.30 -0.46 -0.44 1.01 -0.90 -2.08 120.40 121.73 1wg1 s VAL 134 Ca 0.22 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 1wg1 s VAL 134 Cb -0.15 -1.93 0.10 0.00 0.00 0.00 0.00 36.38 34.40 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 0.73 4.34 1.21 3.92 2.01 -0.83 -0.98 115.64 126.04 1wg1 s THR 135 Ca -0.08 -1.60 -0.20 0.00 0.31 0.00 0.00 61.69 60.11 1wg1 s THR 135 Cb -0.16 -3.78 0.30 0.00 0.01 0.00 0.00 72.50 68.88 1wg1 s THR 135 CO 0.00 -0.69 1.12 0.18 -0.69 0.00 0.00 174.62 174.55 1wg1 n LEU 136 N 4.95 0.00 0.13 4.42 4.77 -1.26 -0.54 117.00 129.46 1wg1 n LEU 136 Ca -0.09 -1.19 -0.06 0.00 -0.03 0.00 0.00 56.01 54.63 1wg1 n LEU 136 Cb 0.42 -1.01 -0.03 0.00 -2.33 0.00 0.00 43.42 40.47 1wg1 n LEU 136 CO 0.43 -2.10 0.18 0.25 -1.33 0.00 0.00 177.39 174.81 1wg1 h LEU 137 N 0.00 -0.34 -9.81 2.23 5.85 -1.89 -3.43 115.31 107.92 1wg1 h LEU 137 Ca -0.41 0.01 -0.64 0.00 0.84 0.00 0.00 57.88 57.68 1wg1 h LEU 137 Cb 1.25 0.09 -0.13 0.00 0.37 0.00 0.00 40.66 42.24 1wg1 h LEU 137 CO 0.27 0.06 -0.54 0.20 -0.34 0.00 0.00 178.44 178.09 1wg1 s ASN 138 N -4.78 3.79 -0.08 1.25 0.01 -1.26 -4.91 114.94 108.96 1wg1 s ASN 138 Ca -0.06 -1.56 -0.13 0.00 -0.71 0.00 0.00 52.86 50.40 1wg1 s ASN 138 Cb 0.01 0.24 -0.10 0.00 0.41 0.00 0.00 41.25 41.80 1wg1 s ASN 138 CO 0.17 -0.74 0.46 1.23 -1.51 0.00 0.00 177.10 176.71 1wg1 h GLY 139 N 1.56 -0.16 -1.09 0.66 0.00 -1.72 -3.26 103.07 99.07 1wg1 h GLY 139 Ca -0.43 0.06 0.40 0.00 0.00 0.00 0.00 47.33 47.37 1wg1 h GLY 139 CO 0.74 -0.06 0.66 -2.21 0.00 0.00 0.00 176.54 175.67 1wg1 n GLU 140 N -4.85 -0.04 -0.08 4.80 2.13 -1.26 0.18 120.64 121.52 1wg1 n GLU 140 Ca -0.05 1.16 -0.11 0.00 0.66 0.00 0.00 57.16 58.82 1wg1 n GLU 140 Cb 0.18 -2.20 -0.04 0.00 0.27 0.00 0.00 31.44 29.65 1wg1 n GLU 140 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1wg1 h GLN 141 N 0.00 0.43 0.09 5.31 4.20 -1.97 -3.24 115.11 119.93 1wg1 h GLN 141 Ca 0.77 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 59.34 1wg1 h GLN 141 Cb 2.31 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 30.05 1wg1 h GLN 141 CO -0.53 0.62 -0.05 0.00 -0.67 0.00 0.00 178.83 178.20 1wg1 h ALA 142 N 0.80 -0.13 -1.14 3.87 0.00 0.19 -1.27 119.26 121.58 1wg1 h ALA 142 Ca 0.07 -0.25 0.38 0.00 0.00 0.00 0.00 54.91 55.10 1wg1 h ALA 142 Cb 0.43 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.17 1wg1 h ALA 142 CO 0.01 -0.28 0.76 1.04 0.00 0.00 0.00 179.25 180.78 1wg1 n GLN 143 N -4.89 -0.02 -0.10 0.00 1.13 0.82 -0.12 117.38 114.20 1wg1 n GLN 143 Ca -0.08 0.93 -0.17 0.00 -1.94 0.00 0.00 57.00 55.74 1wg1 n GLN 143 Cb 0.28 -1.89 -0.07 0.00 0.11 0.00 0.00 30.24 28.67 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 -4.07 1.89 -0.48 1.08 3.02 -1.21 -4.29 115.26 111.20 1wg1 n ASN 144 Ca 0.31 0.44 0.42 0.00 -0.03 0.00 0.00 54.58 55.72 1wg1 n ASN 144 Cb 1.27 -0.86 0.77 0.00 -0.61 0.00 0.00 39.78 40.34 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 -0.85 3.36 -0.35 5.41 0.00 0.41 0.33 119.26 127.57 1wg1 h ALA 145 Ca -0.28 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1wg1 h ALA 145 Cb 1.12 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1wg1 h ALA 145 CO -0.17 -1.81 0.00 -0.89 0.00 0.00 0.00 179.25 176.38 1wg1 n ILE 146 N -4.13 0.00 -0.14 0.00 5.41 0.84 -1.62 119.36 119.71 1wg1 n ILE 146 Ca 0.34 1.44 -0.10 0.00 1.00 0.00 0.00 62.75 65.43 1wg1 n ILE 146 Cb 1.54 -2.44 -0.01 0.00 -0.71 0.00 0.00 39.64 38.03 1wg1 n ILE 146 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1wg1 h GLN 147 N 0.00 0.68 -1.02 0.38 4.20 -1.56 1.53 115.11 119.33 1wg1 h GLN 147 Ca 0.00 -0.17 0.26 0.00 0.06 0.00 0.00 58.65 58.80 1wg1 h GLN 147 Cb 0.00 -0.09 -0.07 0.00 0.30 0.00 0.00 27.48 27.62 1wg1 h GLN 147 CO 0.00 0.70 0.68 0.52 -0.67 0.00 0.00 178.83 180.07 1wg1 h MET 148 N 0.54 0.28 0.00 1.46 2.86 -0.46 -0.30 114.93 119.30 1wg1 h MET 148 Ca 0.13 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1wg1 h MET 148 Cb 0.34 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1wg1 h MET 148 CO 0.00 0.18 -1.51 1.19 1.06 0.00 0.00 176.91 177.83 1wg1 n PHE 149 N -4.48 0.00 -1.61 -0.22 3.01 -0.64 -4.96 117.46 108.56 1wg1 n PHE 149 Ca 0.23 0.00 -0.52 0.00 1.01 0.00 0.00 57.45 58.17 1wg1 n PHE 149 Cb 0.91 -0.29 -0.06 0.00 -0.01 0.00 0.00 39.48 40.03 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 -1.91 1.60 -3.24 1.38 -0.00 0.52 -1.14 115.22 112.44 1wg1 n HIS 150 Ca -0.02 0.61 -0.16 0.00 0.46 0.00 0.00 57.72 58.61 1wg1 n HIS 150 Cb 0.37 -2.36 0.06 0.00 -0.12 0.00 0.00 29.99 27.95 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 2.88 -5.64 -3.52 1.57 6.02 0.85 -4.93 117.38 114.61 1wg1 n GLN 151 Ca 0.19 0.62 -0.31 0.00 -0.01 0.00 0.00 57.00 57.49 1wg1 n GLN 151 Cb 0.19 -5.00 -0.05 0.00 1.02 0.00 0.00 30.24 26.40 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 -3.25 3.45 -0.08 1.08 5.04 -0.29 -4.79 117.35 118.51 1wg1 s TYR 152 Ca 0.31 0.72 -0.30 0.00 -2.44 0.00 0.00 57.07 55.37 1wg1 s TYR 152 Cb -0.14 -2.14 -0.03 0.00 0.35 0.00 0.00 41.96 40.01 1wg1 s TYR 152 CO 0.54 0.34 1.16 0.45 -1.34 0.00 0.00 175.55 176.69 1wg1 s SER 153 N -2.44 7.09 -0.28 4.32 0.15 -1.26 -0.78 113.70 120.50 1wg1 s SER 153 Ca 0.44 1.73 0.00 0.00 0.70 0.00 0.00 55.95 58.83 1wg1 s SER 153 Cb -0.12 -2.56 0.17 0.00 -1.71 0.00 0.00 66.02 61.81 1wg1 s SER 153 CO 0.23 -0.57 0.50 0.12 1.20 0.00 0.00 173.24 174.72 1wg1 s PHE 154 N 2.30 -1.32 -1.48 3.44 5.36 -0.25 -4.90 117.98 121.13 1wg1 s PHE 154 Ca 0.54 1.10 0.00 0.00 -0.96 0.00 0.00 56.93 57.61 1wg1 s PHE 154 Cb -0.23 0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.69 1wg1 s PHE 154 CO 0.20 -0.89 0.00 0.54 -1.46 0.00 0.00 175.22 173.61 1wg1 n ARG 155 N 5.40 -1.21 0.00 10.12 5.12 -1.26 -1.94 116.66 132.88 1wg1 n ARG 155 Ca -0.00 0.87 0.00 0.00 -1.93 0.00 0.00 57.85 56.79 1wg1 n ARG 155 Cb 0.51 -5.19 0.00 0.00 -1.16 0.00 0.00 32.46 26.62 1wg1 n ARG 155 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1wg1 n GLY 156 N -1.02 3.02 3.90 -0.13 0.00 -1.26 -5.02 105.19 104.68 1wg1 n GLY 156 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.27 3.64 -0.68 1.61 -0.14 -0.82 -5.04 119.74 118.05 1wg1 s LYS 157 Ca 0.00 0.19 -0.16 0.00 -1.36 0.00 0.00 55.97 54.64 1wg1 s LYS 157 Cb 0.00 -2.49 0.15 0.00 -1.68 0.00 0.00 37.83 33.82 1wg1 s LYS 157 CO 0.00 0.01 0.69 -0.51 -0.76 0.00 0.00 175.35 174.77 1wg1 s ASP 158 N -3.50 6.41 0.03 2.83 1.11 -1.26 -1.09 116.67 121.21 1wg1 s ASP 158 Ca 0.47 -2.03 -0.34 0.00 0.18 0.00 0.00 52.55 50.82 1wg1 s ASP 158 Cb -0.10 -2.25 -0.13 0.00 1.07 0.00 0.00 42.92 41.51 1wg1 s ASP 158 CO 0.35 -0.84 1.70 0.18 1.18 0.00 0.00 175.17 177.74 1wg1 n LEU 159 N 5.17 3.13 -4.34 1.23 4.77 0.04 -4.66 117.00 122.33 1wg1 n LEU 159 Ca -0.01 1.04 -0.42 0.00 -0.03 0.00 0.00 56.01 56.59 1wg1 n LEU 159 Cb 0.44 -1.38 -0.09 0.00 -2.33 0.00 0.00 43.42 40.06 1wg1 n LEU 159 CO 0.48 -0.24 -0.05 -0.63 -1.33 0.00 0.00 177.39 175.61 1wg1 s ILE 160 N 2.36 4.75 -0.20 -0.08 1.01 -0.38 -0.10 121.20 128.56 1wg1 s ILE 160 Ca 0.86 -1.14 -0.14 0.00 0.00 0.00 0.00 60.65 60.23 1wg1 s ILE 160 Cb -0.72 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 37.88 1wg1 s ILE 160 CO 0.46 -0.49 0.29 -0.69 0.00 0.00 0.00 174.94 174.51 1wg1 s VAL 161 N 1.55 5.28 0.35 2.92 1.01 -1.26 -1.13 120.40 129.12 1wg1 s VAL 161 Ca 0.03 0.49 0.03 0.00 0.00 0.00 0.00 61.98 62.54 1wg1 s VAL 161 Cb -0.23 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1wg1 s VAL 161 CO 0.05 0.32 0.12 -1.10 0.00 0.00 0.00 175.10 174.49 1wg1 s GLN 162 N 0.98 1.74 0.34 2.72 -1.52 -0.73 -4.58 119.66 118.61 1wg1 s GLN 162 Ca 0.15 -2.01 -0.01 0.00 -1.95 0.00 0.00 55.36 51.53 1wg1 s GLN 162 Cb -0.14 -0.50 -0.04 0.00 -0.22 0.00 0.00 33.01 32.12 1wg1 s GLN 162 CO 0.05 -0.39 0.57 -1.17 -0.25 0.00 0.00 175.29 174.10 1wg1 s LEU 163 N -3.49 3.99 0.24 2.90 2.96 -1.26 -0.01 118.68 124.01 1wg1 s LEU 163 Ca 0.31 0.55 -0.22 0.00 -0.22 0.00 0.00 54.13 54.55 1wg1 s LEU 163 Cb 0.05 -3.41 -0.09 0.00 0.50 0.00 0.00 46.19 43.25 1wg1 s LEU 163 CO 0.16 -0.29 0.79 -1.10 -1.32 0.00 0.00 176.35 174.58 1wg1 s GLN 164 N -4.16 4.36 -0.57 1.98 -0.21 -1.23 -4.64 119.66 115.19 1wg1 s GLN 164 Ca 0.41 1.01 -0.27 0.00 0.02 0.00 0.00 55.36 56.54 1wg1 s GLN 164 Cb -0.10 -2.89 -0.02 0.00 1.00 0.00 0.00 33.01 31.00 1wg1 s GLN 164 CO 0.35 0.38 1.84 -1.25 -2.12 0.00 0.00 175.29 174.49 1wg1 s PRO 165 N -1.93 2.74 -0.34 2.91 0.04 -1.26 -4.88 135.00 132.28 1wg1 s PRO 165 Ca 0.44 0.71 -0.32 0.00 0.04 0.00 0.00 61.00 61.87 1wg1 s PRO 165 Cb -0.18 -4.35 -0.14 0.00 0.04 0.00 0.00 34.50 29.87 1wg1 s PRO 165 CO 0.22 -2.59 1.20 0.25 0.04 0.00 0.00 177.00 176.12 1wg1 n THR 166 N 7.23 0.00 0.02 1.26 -2.24 -1.26 -4.80 114.28 114.49 1wg1 n THR 166 Ca 0.20 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.85 1wg1 n THR 166 Cb 0.51 -0.34 -0.08 0.00 -2.10 0.00 0.00 70.33 68.32 1wg1 n THR 166 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1wg1 h ASP 167 N 4.19 -1.47 -2.88 3.42 1.82 -2.03 -3.41 116.42 116.06 1wg1 h ASP 167 Ca -0.24 0.18 -0.63 0.00 -0.39 0.00 0.00 57.03 55.96 1wg1 h ASP 167 Cb 0.95 0.58 -0.05 0.00 0.68 0.00 0.00 39.33 41.49 1wg1 h ASP 167 CO 0.69 -0.47 -0.47 0.00 -1.61 0.00 0.00 179.24 177.38 1wg1 s ALA 168 N -5.82 3.96 -0.18 -0.78 0.00 -1.26 -5.01 121.76 112.66 1wg1 s ALA 168 Ca -0.16 -0.76 0.18 0.00 0.00 0.00 0.00 51.96 51.22 1wg1 s ALA 168 Cb 0.08 -1.90 -0.01 0.00 0.00 0.00 0.00 23.12 21.30 1wg1 s ALA 168 CO 0.63 0.77 1.12 -0.07 0.00 0.00 0.00 175.76 178.20 1wg1 h LEU 169 N 3.47 0.00 -7.84 0.00 4.07 -2.00 -3.48 115.31 109.52 1wg1 h LEU 169 Ca -0.47 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.41 1wg1 h LEU 169 Cb 1.18 0.00 -0.13 0.00 1.08 0.00 0.00 40.66 42.79 1wg1 h LEU 169 CO 0.72 0.38 -0.25 -0.76 -1.08 0.00 0.00 178.44 177.45 1wg1 s LEU 170 N -5.93 0.89 -0.63 1.67 1.43 -1.26 -5.08 118.68 109.76 1wg1 s LEU 170 Ca 0.00 -0.67 -0.29 0.00 -1.03 0.00 0.00 54.13 52.14 1wg1 s LEU 170 Cb 0.08 1.37 -0.13 0.00 0.03 0.00 0.00 46.19 47.55 1wg1 s LEU 170 CO 0.78 -0.86 2.47 0.00 0.23 0.00 0.00 176.35 178.97 1wg1 s SER 172 N 10.32 3.48 -0.37 0.00 1.04 -1.26 -4.86 113.70 122.06 1wg1 s SER 172 Ca 1.13 -0.52 -0.13 0.00 0.48 0.00 0.00 55.95 56.90 1wg1 s SER 172 Cb -0.65 -1.53 0.02 0.00 0.10 0.00 0.00 66.02 63.96 1wg1 s SER 172 CO 0.38 0.07 0.40 0.61 0.98 0.00 0.00 173.24 175.68 1wg1 n GLY 173 N 4.14 -1.94 3.77 7.32 0.00 -1.26 -4.95 105.19 112.26 1wg1 n GLY 173 Ca -0.19 0.96 -0.34 0.00 0.00 0.00 0.00 46.02 46.44 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 -2.22 3.17 0.89 1.61 0.04 -1.26 -5.05 135.00 132.17 1wg1 s PRO 174 Ca 0.18 1.53 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 1wg1 s PRO 174 Cb -0.04 -1.99 0.17 0.00 0.04 0.00 0.00 34.50 32.68 1wg1 s PRO 174 CO 0.74 -0.98 1.23 -1.12 0.04 0.00 0.00 177.00 176.91 1wg1 s SER 175 N -2.06 3.56 0.04 6.66 0.01 -1.26 -5.11 113.70 115.53 1wg1 s SER 175 Ca 0.71 0.19 -0.05 0.00 1.31 0.00 0.00 55.95 58.11 1wg1 s SER 175 Cb -0.23 -0.37 -0.01 0.00 0.21 0.00 0.00 66.02 65.62 1wg1 s SER 175 CO 0.32 -2.44 0.08 -0.44 0.41 0.00 0.00 173.24 171.17 1wg1 s SER 176 N -4.82 0.20 0.00 2.44 0.01 -1.26 -5.28 113.70 104.99 1wg1 s SER 176 Ca 0.71 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 57.41 1wg1 s SER 176 Cb -0.05 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.40 1wg1 s SER 176 CO 0.51 -0.50 0.00 0.61 0.41 0.00 0.00 173.24 174.27