#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 7.09 0.17 1.61 0.01 -1.26 -4.84 113.70 116.48 1wg1 s SER 91 Ca 0.00 -3.09 -0.11 0.00 1.31 0.00 0.00 55.95 54.06 1wg1 s SER 91 Cb 0.00 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1wg1 s SER 91 CO 0.00 -0.58 0.34 -0.94 0.41 0.00 0.00 173.24 172.47 1wg1 s SER 92 N 2.24 -0.04 0.30 2.44 1.04 -1.26 -5.14 113.70 113.29 1wg1 s SER 92 Ca 0.34 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.01 1wg1 s SER 92 Cb -0.07 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1wg1 s SER 92 CO -0.05 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.85 1wg1 n GLY 93 N -0.24 -1.62 1.97 7.32 0.00 -1.26 -3.71 105.19 107.65 1wg1 n GLY 93 Ca -0.08 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 1wg1 n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wg1 n SER 94 N -4.31 5.54 -4.87 1.61 3.41 -1.26 -4.82 113.62 108.91 1wg1 n SER 94 Ca -0.01 -2.62 -0.31 0.00 -0.26 0.00 0.00 58.87 55.68 1wg1 n SER 94 Cb 0.63 -1.31 0.03 0.00 -0.26 0.00 0.00 64.21 63.30 1wg1 n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1wg1 s SER 95 N 1.62 5.83 0.00 4.04 1.04 -1.24 -4.50 113.70 120.49 1wg1 s SER 95 Ca 0.50 1.33 0.00 0.00 0.48 0.00 0.00 55.95 58.26 1wg1 s SER 95 Cb 0.26 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 64.11 1wg1 s SER 95 CO -0.04 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.68 1wg1 n GLY 96 N -2.75 2.55 3.01 7.32 0.00 -1.26 -4.77 105.19 109.29 1wg1 n GLY 96 Ca 0.06 -1.56 -0.09 0.00 0.00 0.00 0.00 46.02 44.43 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 -1.04 0.13 -0.17 -0.61 -4.36 0.24 -3.48 121.20 111.91 1wg1 s ILE 97 Ca 0.00 -1.09 -0.07 0.00 -0.26 0.00 0.00 60.65 59.23 1wg1 s ILE 97 Cb 0.00 -0.54 -0.04 0.00 1.25 0.00 0.00 42.46 43.13 1wg1 s ILE 97 CO 0.00 -0.60 0.07 -0.76 0.24 0.00 0.00 174.94 173.89 1wg1 s LEU 98 N -1.77 3.90 -0.52 0.37 1.43 0.04 -2.19 118.68 119.94 1wg1 s LEU 98 Ca -0.11 0.14 -0.14 0.00 -1.03 0.00 0.00 54.13 52.99 1wg1 s LEU 98 Cb -0.06 -1.98 0.12 0.00 0.03 0.00 0.00 46.19 44.31 1wg1 s LEU 98 CO -0.03 0.21 0.45 -0.69 0.23 0.00 0.00 176.35 176.52 1wg1 s VAL 99 N 0.14 4.89 0.20 -1.59 1.01 -0.49 -2.07 120.40 122.49 1wg1 s VAL 99 Ca 0.05 -1.58 0.06 0.00 0.00 0.00 0.00 61.98 60.52 1wg1 s VAL 99 Cb -0.12 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 1wg1 s VAL 99 CO 0.00 -0.83 0.13 -0.54 0.00 0.00 0.00 175.10 173.86 1wg1 s LYS 100 N 1.53 2.81 -0.31 2.72 1.02 -0.25 -1.73 119.74 125.52 1wg1 s LYS 100 Ca 0.04 -1.00 -0.01 0.00 0.02 0.00 0.00 55.97 55.02 1wg1 s LYS 100 Cb -0.29 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.47 1wg1 s LYS 100 CO 0.02 0.44 0.27 -1.71 -0.92 0.00 0.00 175.35 173.45 1wg1 n ASN 101 N -0.65 -2.32 -4.90 2.83 5.15 -1.25 -0.55 115.26 113.57 1wg1 n ASN 101 Ca -0.08 -0.15 -0.28 0.00 -0.60 0.00 0.00 54.58 53.47 1wg1 n ASN 101 Cb 0.56 -1.66 -0.02 0.00 -0.53 0.00 0.00 39.78 38.13 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 -2.96 3.81 0.00 1.20 1.43 -1.20 -4.37 118.68 116.59 1wg1 s LEU 102 Ca 0.04 0.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.04 1wg1 s LEU 102 Cb -0.02 -3.79 0.00 0.00 0.03 0.00 0.00 46.19 42.41 1wg1 s LEU 102 CO 0.18 -0.42 0.00 -0.81 0.23 0.00 0.00 176.35 175.54 1wg1 n PRO 103 N -1.65 0.25 -0.02 1.29 -0.04 -1.26 -4.97 135.00 128.60 1wg1 n PRO 103 Ca 0.00 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 1wg1 n PRO 103 Cb 0.55 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.87 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 -0.56 0.72 -1.24 0.54 7.27 -1.26 -4.19 117.38 118.66 1wg1 n GLN 104 Ca 0.00 0.24 -0.26 0.00 0.07 0.00 0.00 57.00 57.06 1wg1 n GLN 104 Cb 0.00 -1.70 0.16 0.00 2.41 0.00 0.00 30.24 31.12 1wg1 n GLN 104 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1wg1 n ASP 105 N -3.33 4.40 -4.77 1.69 -0.08 -1.26 -5.00 116.55 108.21 1wg1 n ASP 105 Ca -0.30 -3.64 -0.35 0.00 -1.51 0.00 0.00 54.79 48.98 1wg1 n ASP 105 Cb 1.05 -0.86 0.02 0.00 2.34 0.00 0.00 41.12 43.67 1wg1 n ASP 105 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1wg1 s SER 106 N -1.41 5.43 0.20 1.67 0.15 -1.26 -5.04 113.70 113.44 1wg1 s SER 106 Ca 0.58 2.21 -0.23 0.00 0.70 0.00 0.00 55.95 59.21 1wg1 s SER 106 Cb 0.48 -2.58 0.05 0.00 -1.71 0.00 0.00 66.02 62.26 1wg1 s SER 106 CO 0.09 -1.42 0.79 0.20 1.20 0.00 0.00 173.24 174.10 1wg1 s ASN 107 N -1.87 -0.29 -0.03 5.45 0.01 -1.26 -5.00 114.94 111.95 1wg1 s ASN 107 Ca 0.73 -0.39 -0.18 0.00 -0.71 0.00 0.00 52.86 52.30 1wg1 s ASN 107 Cb -0.25 0.60 -0.11 0.00 0.41 0.00 0.00 41.25 41.90 1wg1 s ASN 107 CO 0.31 -1.09 0.78 0.00 -1.51 0.00 0.00 177.10 175.60 1wg1 n GLN 109 N -5.15 -0.02 -0.04 0.00 6.02 -1.26 0.21 117.38 117.14 1wg1 n GLN 109 Ca -0.08 0.86 -0.15 0.00 -0.01 0.00 0.00 57.00 57.63 1wg1 n GLN 109 Cb 0.25 -1.75 -0.12 0.00 1.02 0.00 0.00 30.24 29.65 1wg1 n GLN 109 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 1wg1 h GLU 110 N 0.00 0.08 -0.22 -1.09 4.57 -1.98 -3.32 114.58 112.62 1wg1 h GLU 110 Ca 0.63 -0.10 -0.01 0.00 -1.18 0.00 0.00 59.36 58.70 1wg1 h GLU 110 Cb 2.12 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 30.73 1wg1 h GLU 110 CO -0.27 0.89 0.09 0.28 -1.18 0.00 0.00 179.01 178.81 1wg1 h VAL 111 N -0.68 1.17 -0.89 0.32 2.07 0.26 -2.91 116.25 115.59 1wg1 h VAL 111 Ca -0.02 -0.50 0.08 0.00 0.82 0.00 0.00 66.70 67.08 1wg1 h VAL 111 Cb 0.94 1.09 -0.11 0.00 -1.52 0.00 0.00 31.29 31.69 1wg1 h VAL 111 CO 0.03 0.16 -0.53 1.57 0.02 0.00 0.00 177.57 178.82 1wg1 n HIS 112 N -4.81 -0.39 -0.28 1.57 -0.00 0.90 0.49 115.22 112.70 1wg1 n HIS 112 Ca -0.03 1.12 -0.02 0.00 -0.00 0.00 0.00 57.72 58.79 1wg1 n HIS 112 Cb 0.13 -0.57 0.10 0.00 -0.00 0.00 0.00 29.99 29.65 1wg1 n HIS 112 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.34 176.56 1wg1 h ASP 113 N 0.00 0.76 -0.26 0.26 1.82 -1.65 -2.34 116.42 115.02 1wg1 h ASP 113 Ca 0.14 0.01 0.04 0.00 -0.39 0.00 0.00 57.03 56.84 1wg1 h ASP 113 Cb 0.37 -0.15 -0.04 0.00 0.68 0.00 0.00 39.33 40.18 1wg1 h ASP 113 CO -0.84 0.51 -0.01 0.25 -1.61 0.00 0.00 179.24 177.54 1wg1 h LEU 114 N 0.90 -0.12 -3.93 2.28 5.85 0.25 -2.07 115.31 118.47 1wg1 h LEU 114 Ca 0.32 0.06 -0.54 0.00 0.84 0.00 0.00 57.88 58.56 1wg1 h LEU 114 Cb 0.09 0.11 -0.22 0.00 0.37 0.00 0.00 40.66 41.00 1wg1 h LEU 114 CO -0.14 -0.03 0.68 0.18 -0.34 0.00 0.00 178.44 178.79 1wg1 n LEU 115 N -5.16 7.14 -0.11 2.25 4.77 0.82 -4.54 117.00 122.17 1wg1 n LEU 115 Ca -0.01 -3.95 -0.12 0.00 -0.03 0.00 0.00 56.01 51.90 1wg1 n LEU 115 Cb 0.14 -1.04 -0.03 0.00 -2.33 0.00 0.00 43.42 40.16 1wg1 n LEU 115 CO 0.24 1.42 0.64 0.07 -1.33 0.00 0.00 177.39 178.44 1wg1 h LYS 116 N 1.96 0.71 -0.66 3.23 2.10 -0.86 -3.17 116.57 119.89 1wg1 h LYS 116 Ca 0.47 -0.32 0.14 0.00 -2.00 0.00 0.00 60.65 58.94 1wg1 h LYS 116 Cb 0.78 -0.01 -0.11 0.00 -0.90 0.00 0.00 32.23 31.98 1wg1 h LYS 116 CO 1.21 0.92 0.01 -0.44 -2.00 0.00 0.00 179.45 179.16 1wg1 h ASP 117 N 0.48 -0.28 -3.21 7.07 3.32 -1.83 -3.41 116.42 118.55 1wg1 h ASP 117 Ca 0.07 0.16 -0.46 0.00 0.02 0.00 0.00 57.03 56.82 1wg1 h ASP 117 Cb 0.73 0.29 0.05 0.00 0.22 0.00 0.00 39.33 40.61 1wg1 h ASP 117 CO 0.05 -0.13 0.07 -0.31 -1.72 0.00 0.00 179.24 177.21 1wg1 s TYR 118 N -6.14 3.11 0.01 4.55 2.02 -1.20 -5.07 117.35 114.63 1wg1 s TYR 118 Ca -0.13 0.37 -0.19 0.00 -0.37 0.00 0.00 57.07 56.75 1wg1 s TYR 118 Cb 0.20 -2.71 -0.06 0.00 -0.40 0.00 0.00 41.96 38.99 1wg1 s TYR 118 CO 0.74 -0.81 0.54 0.34 -1.57 0.00 0.00 175.55 174.79 1wg1 s ASP 119 N -4.34 6.94 -0.19 2.29 -1.08 -1.26 -4.96 116.67 114.06 1wg1 s ASP 119 Ca 0.54 1.12 -0.02 0.00 -0.52 0.00 0.00 52.55 53.67 1wg1 s ASP 119 Cb -0.10 -2.33 -0.01 0.00 -1.46 0.00 0.00 42.92 39.02 1wg1 s ASP 119 CO 0.42 0.19 -0.08 -0.76 0.52 0.00 0.00 175.17 175.45 1wg1 s LEU 120 N -0.55 2.75 -0.19 -1.34 1.02 -1.26 -3.40 118.68 115.70 1wg1 s LEU 120 Ca 0.28 -0.41 -0.08 0.00 0.02 0.00 0.00 54.13 53.94 1wg1 s LEU 120 Cb -0.18 -1.68 -0.21 0.00 0.02 0.00 0.00 46.19 44.15 1wg1 s LEU 120 CO 0.16 0.02 0.09 0.29 0.02 0.00 0.00 176.35 176.93 1wg1 n LYS 121 N 4.49 0.67 -3.75 1.70 4.76 0.75 -4.98 118.16 121.81 1wg1 n LYS 121 Ca -0.19 0.29 -0.12 0.00 -2.87 0.00 0.00 58.31 55.42 1wg1 n LYS 121 Cb 0.51 -1.64 -0.12 0.00 -1.84 0.00 0.00 35.03 31.94 1wg1 n LYS 121 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1wg1 s TYR 122 N -2.51 -0.34 -0.25 2.13 5.04 -1.25 -4.97 117.35 115.21 1wg1 s TYR 122 Ca -0.29 0.80 -0.02 0.00 -2.44 0.00 0.00 57.07 55.12 1wg1 s TYR 122 Cb 0.08 0.10 0.08 0.00 0.35 0.00 0.00 41.96 42.57 1wg1 s TYR 122 CO 0.66 -0.20 0.05 0.00 -1.34 0.00 0.00 175.55 174.72 1wg1 s TYR 124 N 1.72 3.16 -0.12 0.00 5.04 -0.87 -4.94 117.35 121.34 1wg1 s TYR 124 Ca 0.03 -1.92 -0.06 0.00 -2.44 0.00 0.00 57.07 52.68 1wg1 s TYR 124 Cb -0.17 -2.01 -0.04 0.00 0.35 0.00 0.00 41.96 40.09 1wg1 s TYR 124 CO -0.16 -0.81 0.11 0.08 -1.34 0.00 0.00 175.55 173.43 1wg1 s VAL 125 N 1.22 5.24 -0.04 3.14 1.01 -1.26 -1.15 120.40 128.56 1wg1 s VAL 125 Ca -0.04 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.12 1wg1 s VAL 125 Cb -0.18 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 1wg1 s VAL 125 CO -0.05 0.61 -0.25 -0.62 0.00 0.00 0.00 175.10 174.80 1wg1 s ASP 126 N -0.92 3.14 0.00 3.32 -1.08 -0.33 -4.98 116.67 115.81 1wg1 s ASP 126 Ca 0.14 -0.47 0.13 0.00 -0.52 0.00 0.00 52.55 51.83 1wg1 s ASP 126 Cb -0.12 -0.66 -0.20 0.00 -1.46 0.00 0.00 42.92 40.48 1wg1 s ASP 126 CO 0.03 0.28 0.78 0.08 0.52 0.00 0.00 175.17 176.86 1wg1 h ARG 127 N 5.80 0.00 0.08 4.34 -0.00 -1.95 -0.75 114.38 121.91 1wg1 h ARG 127 Ca -0.37 0.00 -0.27 0.00 -0.00 0.00 0.00 59.98 59.35 1wg1 h ARG 127 Cb 1.15 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.11 1wg1 h ARG 127 CO 0.47 0.51 -1.29 -0.97 -0.00 0.00 0.00 179.97 178.70 1wg1 h ASN 128 N 0.00 0.25 -0.01 0.08 -0.73 -1.98 -3.31 115.58 109.88 1wg1 h ASN 128 Ca -0.23 -0.30 0.00 0.00 1.87 0.00 0.00 56.30 57.64 1wg1 h ASN 128 Cb 1.90 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 40.40 1wg1 h ASN 128 CO 0.08 1.24 -0.47 0.29 -0.37 0.00 0.00 177.43 178.20 1wg1 n LYS 129 N -3.41 1.37 -4.26 6.67 5.02 -1.26 -4.98 118.16 117.30 1wg1 n LYS 129 Ca -0.09 -0.80 -0.33 0.00 -2.02 0.00 0.00 58.31 55.07 1wg1 n LYS 129 Cb 1.01 -1.38 -0.06 0.00 -0.02 0.00 0.00 35.03 34.57 1wg1 n LYS 129 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1wg1 n ARG 130 N -0.23 -1.90 -4.25 1.97 1.74 -0.30 -4.91 116.66 108.78 1wg1 n ARG 130 Ca 0.07 0.23 -0.17 0.00 -0.77 0.00 0.00 57.85 57.21 1wg1 n ARG 130 Cb 0.39 -4.35 -0.15 0.00 -1.02 0.00 0.00 32.46 27.33 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 -3.82 0.55 -0.19 0.55 2.01 -1.16 -3.27 115.64 110.30 1wg1 s THR 131 Ca 0.33 -0.28 0.01 0.00 0.31 0.00 0.00 61.69 62.06 1wg1 s THR 131 Cb -0.19 -0.47 0.03 0.00 0.01 0.00 0.00 72.50 71.88 1wg1 s THR 131 CO 0.97 0.16 -0.18 0.00 -0.69 0.00 0.00 174.62 174.88 1wg1 s ALA 132 N -0.08 2.31 -0.29 7.40 0.00 -0.70 -1.18 121.76 129.21 1wg1 s ALA 132 Ca 0.02 -1.28 -0.21 0.00 0.00 0.00 0.00 51.96 50.48 1wg1 s ALA 132 Cb -0.04 -1.24 -0.01 0.00 0.00 0.00 0.00 23.12 21.84 1wg1 s ALA 132 CO -0.00 -0.51 0.67 -0.06 0.00 0.00 0.00 175.76 175.86 1wg1 s PHE 133 N 1.28 3.23 -0.19 0.00 0.08 -0.30 -1.40 117.98 120.68 1wg1 s PHE 133 Ca 0.02 0.70 0.01 0.00 0.12 0.00 0.00 56.93 57.78 1wg1 s PHE 133 Cb -0.14 -3.01 0.02 0.00 -0.57 0.00 0.00 43.02 39.32 1wg1 s PHE 133 CO -0.11 -0.46 -0.17 0.08 -0.10 0.00 0.00 175.22 174.46 1wg1 s VAL 134 N 2.66 2.25 -0.46 -0.44 1.01 -0.93 -2.06 120.40 122.43 1wg1 s VAL 134 Ca 0.27 -0.96 -0.17 0.00 0.00 0.00 0.00 61.98 61.12 1wg1 s VAL 134 Cb -0.15 -2.00 0.05 0.00 0.00 0.00 0.00 36.38 34.29 1wg1 s VAL 134 CO 0.11 0.46 0.45 -0.89 0.00 0.00 0.00 175.10 175.23 1wg1 s THR 135 N 1.29 5.12 0.96 3.92 2.01 -0.79 -0.60 115.64 127.55 1wg1 s THR 135 Ca 0.04 -0.72 -0.15 0.00 0.31 0.00 0.00 61.69 61.16 1wg1 s THR 135 Cb -0.14 -4.13 0.18 0.00 0.01 0.00 0.00 72.50 68.42 1wg1 s THR 135 CO -0.11 -0.57 1.22 -0.76 -0.69 0.00 0.00 174.62 173.71 1wg1 s LEU 136 N 1.99 2.19 -0.04 4.42 1.43 -1.26 -0.18 118.68 127.24 1wg1 s LEU 136 Ca 0.09 0.58 -0.16 0.00 -1.03 0.00 0.00 54.13 53.60 1wg1 s LEU 136 Cb -0.21 -2.71 -0.10 0.00 0.03 0.00 0.00 46.19 43.20 1wg1 s LEU 136 CO 0.10 -2.76 0.68 0.25 0.23 0.00 0.00 176.35 174.84 1wg1 h LEU 137 N -1.65 -0.40 -9.67 1.79 5.85 -1.88 -3.40 115.31 105.95 1wg1 h LEU 137 Ca -0.46 -0.06 -0.62 0.00 0.84 0.00 0.00 57.88 57.59 1wg1 h LEU 137 Cb 1.28 0.10 -0.12 0.00 0.37 0.00 0.00 40.66 42.30 1wg1 h LEU 137 CO 0.48 0.05 -0.59 0.20 -0.34 0.00 0.00 178.44 178.24 1wg1 s ASN 138 N -5.04 3.97 -0.09 1.25 0.01 -1.26 -4.68 114.94 109.10 1wg1 s ASN 138 Ca -0.09 -1.28 -0.27 0.00 -0.71 0.00 0.00 52.86 50.52 1wg1 s ASN 138 Cb 0.01 -0.41 -0.23 0.00 0.41 0.00 0.00 41.25 41.03 1wg1 s ASN 138 CO 0.29 -0.42 0.94 1.23 -1.51 0.00 0.00 177.10 177.63 1wg1 h GLY 139 N 1.75 -0.01 -0.79 0.66 0.00 -1.83 -3.27 103.07 99.57 1wg1 h GLY 139 Ca -0.43 0.01 0.38 0.00 0.00 0.00 0.00 47.33 47.29 1wg1 h GLY 139 CO 0.77 -0.01 0.85 0.83 0.00 0.00 0.00 176.54 178.99 1wg1 h GLU 140 N -0.80 0.15 -0.45 4.80 5.08 -1.98 0.59 114.58 121.97 1wg1 h GLU 140 Ca -0.00 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1wg1 h GLU 140 Cb 0.76 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1wg1 h GLU 140 CO 0.00 0.10 0.18 1.96 -1.00 0.00 0.00 179.01 180.25 1wg1 h GLN 141 N 0.15 0.67 -0.03 2.33 4.20 -1.98 -3.18 115.11 117.27 1wg1 h GLN 141 Ca 0.73 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 59.30 1wg1 h GLN 141 Cb 2.33 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 30.00 1wg1 h GLN 141 CO -0.28 0.60 -0.05 0.00 -0.67 0.00 0.00 178.83 178.44 1wg1 h ALA 142 N 1.03 0.04 -0.98 3.87 0.00 0.01 -2.24 119.26 120.98 1wg1 h ALA 142 Ca 0.15 -0.30 0.37 0.00 0.00 0.00 0.00 54.91 55.13 1wg1 h ALA 142 Cb 0.18 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 17.83 1wg1 h ALA 142 CO -0.01 -0.14 0.59 1.04 0.00 0.00 0.00 179.25 180.72 1wg1 n GLN 143 N -4.75 -0.04 -0.06 0.00 1.13 -0.24 -0.21 117.38 113.22 1wg1 n GLN 143 Ca -0.08 1.09 -0.03 0.00 -1.94 0.00 0.00 57.00 56.03 1wg1 n GLN 143 Cb 0.31 -2.05 -0.01 0.00 0.11 0.00 0.00 30.24 28.61 1wg1 n GLN 143 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 1wg1 h ASN 144 N 0.00 0.00 -0.92 1.08 2.35 -1.55 -3.39 115.58 113.15 1wg1 h ASN 144 Ca 0.72 0.00 0.28 0.00 -0.55 0.00 0.00 56.30 56.75 1wg1 h ASN 144 Cb 2.10 0.00 -0.17 0.00 0.05 0.00 0.00 38.32 40.30 1wg1 h ASN 144 CO -0.51 0.60 0.12 0.00 -1.65 0.00 0.00 177.43 175.99 1wg1 n ALA 145 N -3.29 0.57 -0.22 -0.83 0.00 -0.49 -0.34 120.51 115.91 1wg1 n ALA 145 Ca -0.05 0.98 -0.12 0.00 0.00 0.00 0.00 53.44 54.25 1wg1 n ALA 145 Cb 0.19 -0.77 -0.08 0.00 0.00 0.00 0.00 19.45 18.79 1wg1 n ALA 145 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1wg1 h ILE 146 N 0.00 0.02 0.49 0.00 2.04 -0.78 0.26 117.51 119.54 1wg1 h ILE 146 Ca 0.61 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.44 1wg1 h ILE 146 Cb 1.35 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1wg1 h ILE 146 CO -0.83 0.00 -0.24 -0.61 0.00 0.00 0.00 178.15 176.47 1wg1 h GLN 147 N -0.26 -0.64 -1.07 2.37 4.15 -0.88 0.67 115.11 119.44 1wg1 h GLN 147 Ca 0.12 0.04 0.41 0.00 0.77 0.00 0.00 58.65 59.99 1wg1 h GLN 147 Cb 0.55 0.15 -0.14 0.00 0.21 0.00 0.00 27.48 28.24 1wg1 h GLN 147 CO -0.70 -0.43 0.64 -1.33 -1.93 0.00 0.00 178.83 175.08 1wg1 n MET 148 N -5.09 -0.04 -0.00 1.69 2.81 -0.46 0.56 117.12 116.58 1wg1 n MET 148 Ca -0.08 1.19 -0.21 0.00 -1.81 0.00 0.00 57.70 56.79 1wg1 n MET 148 Cb 0.26 -2.24 -0.14 0.00 -0.71 0.00 0.00 33.22 30.39 1wg1 n MET 148 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1wg1 n PHE 149 N -4.79 1.19 -1.44 2.03 3.01 0.88 -4.85 117.46 113.50 1wg1 n PHE 149 Ca 0.35 0.25 -0.56 0.00 1.01 0.00 0.00 57.45 58.51 1wg1 n PHE 149 Cb 1.29 -1.15 -0.08 0.00 -0.01 0.00 0.00 39.48 39.53 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 -3.47 1.10 -3.21 1.38 -0.00 0.23 0.13 115.22 111.38 1wg1 n HIS 150 Ca -0.33 0.97 -0.16 0.00 0.46 0.00 0.00 57.72 58.67 1wg1 n HIS 150 Cb 1.04 -1.90 0.06 0.00 -0.12 0.00 0.00 29.99 29.07 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 2.52 -5.35 -2.81 1.57 6.02 -0.53 -4.93 117.38 113.86 1wg1 n GLN 151 Ca 0.23 0.57 -0.25 0.00 -0.01 0.00 0.00 57.00 57.54 1wg1 n GLN 151 Cb 0.00 -4.83 0.01 0.00 1.02 0.00 0.00 30.24 26.44 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 -3.23 3.38 -0.63 1.08 5.04 0.12 -4.90 117.35 118.21 1wg1 s TYR 152 Ca 0.34 0.52 -0.26 0.00 -2.44 0.00 0.00 57.07 55.23 1wg1 s TYR 152 Cb -0.15 -2.34 0.04 0.00 0.35 0.00 0.00 41.96 39.86 1wg1 s TYR 152 CO 0.50 -0.36 1.12 0.45 -1.34 0.00 0.00 175.55 175.92 1wg1 s SER 153 N -4.17 6.30 -0.21 4.32 0.15 -1.26 -3.90 113.70 114.92 1wg1 s SER 153 Ca 0.48 -0.33 -0.04 0.00 0.70 0.00 0.00 55.95 56.75 1wg1 s SER 153 Cb -0.10 -2.51 0.08 0.00 -1.71 0.00 0.00 66.02 61.79 1wg1 s SER 153 CO 0.41 -1.52 0.16 0.12 1.20 0.00 0.00 173.24 173.62 1wg1 s PHE 154 N 4.80 -0.02 -1.43 3.44 5.36 -1.24 -4.88 117.98 124.01 1wg1 s PHE 154 Ca 0.34 -0.18 -0.09 0.00 -0.96 0.00 0.00 56.93 56.04 1wg1 s PHE 154 Cb -0.10 -0.58 0.05 0.00 -0.34 0.00 0.00 43.02 42.05 1wg1 s PHE 154 CO 0.19 -0.62 0.97 0.54 -1.46 0.00 0.00 175.22 174.83 1wg1 n ARG 155 N 5.29 -5.96 -2.17 10.12 1.74 -1.26 -0.88 116.66 123.55 1wg1 n ARG 155 Ca -0.06 0.66 -0.17 0.00 -0.77 0.00 0.00 57.85 57.52 1wg1 n ARG 155 Cb 0.48 -5.52 -0.03 0.00 -1.02 0.00 0.00 32.46 26.37 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 -1.70 0.07 3.72 -0.13 0.00 -1.26 -4.95 105.19 100.93 1wg1 n GLY 156 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 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 -4.60 2.12 -0.78 1.61 -0.14 -0.06 -5.09 119.74 112.81 1wg1 s LYS 157 Ca 0.00 -2.24 0.03 0.00 -1.36 0.00 0.00 55.97 52.40 1wg1 s LYS 157 Cb 0.00 -1.63 0.22 0.00 -1.68 0.00 0.00 37.83 34.73 1wg1 s LYS 157 CO 0.00 -0.25 0.73 -0.25 -0.76 0.00 0.00 175.35 174.81 1wg1 n ASP 158 N -1.19 3.84 -4.64 2.83 8.00 -1.26 -3.60 116.55 120.53 1wg1 n ASP 158 Ca -0.12 -3.27 -0.57 0.00 0.71 0.00 0.00 54.79 51.54 1wg1 n ASP 158 Cb 0.67 -0.86 -0.07 0.00 -0.02 0.00 0.00 41.12 40.83 1wg1 n ASP 158 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1wg1 n LEU 159 N 1.72 1.66 -4.34 0.64 4.77 -1.25 -4.66 117.00 115.55 1wg1 n LEU 159 Ca 0.24 1.12 -0.42 0.00 -0.03 0.00 0.00 56.01 56.91 1wg1 n LEU 159 Cb 0.37 -1.10 -0.09 0.00 -2.33 0.00 0.00 43.42 40.27 1wg1 n LEU 159 CO 0.37 -0.90 -0.06 -0.63 -1.33 0.00 0.00 177.39 174.83 1wg1 s ILE 160 N 1.87 4.68 -0.19 -0.08 1.01 0.29 -1.46 121.20 127.33 1wg1 s ILE 160 Ca 0.93 -1.17 -0.13 0.00 0.00 0.00 0.00 60.65 60.28 1wg1 s ILE 160 Cb -1.10 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 37.53 1wg1 s ILE 160 CO 0.59 -0.48 0.25 -0.69 0.00 0.00 0.00 174.94 174.60 1wg1 s VAL 161 N 1.53 5.33 0.31 2.92 1.01 -1.26 -1.09 120.40 129.14 1wg1 s VAL 161 Ca 0.03 0.43 0.04 0.00 0.00 0.00 0.00 61.98 62.48 1wg1 s VAL 161 Cb -0.23 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1wg1 s VAL 161 CO 0.05 0.38 0.18 -1.10 0.00 0.00 0.00 175.10 174.61 1wg1 s GLN 162 N 0.61 1.61 0.72 2.72 -1.52 -0.88 -4.81 119.66 118.12 1wg1 s GLN 162 Ca 0.13 -1.92 -0.10 0.00 -1.95 0.00 0.00 55.36 51.52 1wg1 s GLN 162 Cb -0.13 -0.01 0.04 0.00 -0.22 0.00 0.00 33.01 32.69 1wg1 s GLN 162 CO 0.03 -0.48 1.09 -0.51 -0.25 0.00 0.00 175.29 175.16 1wg1 s LEU 163 N -3.37 2.81 0.32 2.90 1.43 -1.26 -0.78 118.68 120.72 1wg1 s LEU 163 Ca 0.36 0.88 -0.27 0.00 -1.03 0.00 0.00 54.13 54.08 1wg1 s LEU 163 Cb 0.05 -3.57 -0.10 0.00 0.03 0.00 0.00 46.19 42.60 1wg1 s LEU 163 CO 0.19 -1.51 0.97 -1.10 0.23 0.00 0.00 176.35 175.12 1wg1 s GLN 164 N -5.37 4.58 -1.00 1.70 -0.21 -1.23 -4.36 119.66 113.78 1wg1 s GLN 164 Ca 0.59 1.41 -0.24 0.00 0.02 0.00 0.00 55.36 57.14 1wg1 s GLN 164 Cb -0.11 -2.88 -0.06 0.00 1.00 0.00 0.00 33.01 30.96 1wg1 s GLN 164 CO 0.49 0.26 1.94 -1.25 -2.12 0.00 0.00 175.29 174.62 1wg1 s PRO 165 N -1.92 2.53 -0.37 2.91 0.04 -1.26 -4.89 135.00 132.04 1wg1 s PRO 165 Ca 0.49 -0.60 0.04 0.00 0.04 0.00 0.00 61.00 60.97 1wg1 s PRO 165 Cb -0.21 -5.13 0.11 0.00 0.04 0.00 0.00 34.50 29.31 1wg1 s PRO 165 CO 0.27 -3.59 0.09 0.99 0.04 0.00 0.00 177.00 174.80 1wg1 s THR 166 N 10.42 2.23 0.51 1.26 2.01 -1.26 -5.11 115.64 125.71 1wg1 s THR 166 Ca 0.69 -2.47 -0.19 0.00 0.31 0.00 0.00 61.69 60.03 1wg1 s THR 166 Cb -0.05 -2.63 -0.07 0.00 0.01 0.00 0.00 72.50 69.76 1wg1 s THR 166 CO 0.04 -0.65 1.05 1.51 -0.69 0.00 0.00 174.62 175.88 1wg1 s ASP 167 N 0.72 6.19 -0.28 3.53 1.47 -1.26 -5.06 116.67 121.98 1wg1 s ASP 167 Ca 0.12 1.90 -0.21 0.00 1.18 0.00 0.00 52.55 55.54 1wg1 s ASP 167 Cb -0.20 -2.55 0.13 0.00 -0.34 0.00 0.00 42.92 39.95 1wg1 s ASP 167 CO -0.07 -0.88 0.98 0.00 0.68 0.00 0.00 175.17 175.87 1wg1 s ALA 168 N -2.10 -2.06 0.20 2.11 0.00 -1.26 -5.03 121.76 113.62 1wg1 s ALA 168 Ca 0.66 2.03 0.17 0.00 0.00 0.00 0.00 51.96 54.83 1wg1 s ALA 168 Cb -0.16 -1.52 0.63 0.00 0.00 0.00 0.00 23.12 22.06 1wg1 s ALA 168 CO 0.24 -0.29 1.72 -0.07 0.00 0.00 0.00 175.76 177.37 1wg1 h LEU 169 N 5.05 0.00 -8.52 0.00 3.38 -2.09 -3.42 115.31 109.71 1wg1 h LEU 169 Ca -0.28 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.01 1wg1 h LEU 169 Cb 1.19 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.64 1wg1 h LEU 169 CO 0.14 0.42 -0.83 -0.76 0.09 0.00 0.00 178.44 177.50 1wg1 s LEU 170 N -7.22 2.38 -0.01 1.67 1.43 -1.26 -5.12 118.68 110.54 1wg1 s LEU 170 Ca -0.00 -0.43 0.07 0.00 -1.03 0.00 0.00 54.13 52.73 1wg1 s LEU 170 Cb 0.11 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1wg1 s LEU 170 CO 0.70 0.19 -0.21 0.00 0.23 0.00 0.00 176.35 177.26 1wg1 s SER 172 N -0.84 0.08 0.47 0.00 1.04 -1.26 -5.18 113.70 108.00 1wg1 s SER 172 Ca 0.11 -0.73 0.08 0.00 0.48 0.00 0.00 55.95 55.90 1wg1 s SER 172 Cb -0.10 0.38 0.02 0.00 0.10 0.00 0.00 66.02 66.42 1wg1 s SER 172 CO 0.01 -0.80 0.56 -0.83 0.98 0.00 0.00 173.24 173.16 1wg1 s GLY 173 N -2.90 1.98 -0.14 7.32 0.00 -1.26 -5.06 107.32 107.27 1wg1 s GLY 173 Ca 0.10 -1.80 -0.29 0.00 0.00 0.00 0.00 44.72 42.72 1wg1 s GLY 173 CO -0.07 -1.63 1.55 2.56 0.00 0.00 0.00 173.10 175.52 1wg1 s PRO 174 N -4.36 4.06 0.08 2.90 0.04 -1.26 -4.98 135.00 131.47 1wg1 s PRO 174 Ca 0.53 1.89 -0.30 0.00 0.04 0.00 0.00 61.00 63.16 1wg1 s PRO 174 Cb -0.07 -3.95 -0.06 0.00 0.04 0.00 0.00 34.50 30.46 1wg1 s PRO 174 CO 0.32 -0.97 1.17 -1.12 0.04 0.00 0.00 177.00 176.44 1wg1 s SER 175 N 3.35 7.13 -0.06 6.66 0.01 -1.26 -5.03 113.70 124.50 1wg1 s SER 175 Ca 0.69 2.01 -0.22 0.00 1.31 0.00 0.00 55.95 59.73 1wg1 s SER 175 Cb -0.28 -2.58 0.05 0.00 0.21 0.00 0.00 66.02 63.42 1wg1 s SER 175 CO 0.26 -0.41 0.50 -0.44 0.41 0.00 0.00 173.24 173.56 1wg1 s SER 176 N 0.85 -0.44 0.00 2.44 0.01 -1.26 -5.29 113.70 110.00 1wg1 s SER 176 Ca 0.57 0.51 0.00 0.00 1.31 0.00 0.00 55.95 58.34 1wg1 s SER 176 Cb -0.29 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.48 1wg1 s SER 176 CO 0.30 -0.47 0.00 0.61 0.41 0.00 0.00 173.24 174.10