#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 6.93 -0.75 1.61 0.15 -1.26 -4.88 113.70 115.50 1wg1 s SER 91 Ca 0.00 2.13 -0.24 0.00 0.70 0.00 0.00 55.95 58.54 1wg1 s SER 91 Cb 0.00 -2.58 -0.15 0.00 -1.71 0.00 0.00 66.02 61.59 1wg1 s SER 91 CO 0.00 -0.60 2.40 -1.20 1.20 0.00 0.00 173.24 175.04 1wg1 n SER 92 N 4.36 1.54 0.00 5.45 7.64 -1.26 -4.76 113.62 126.59 1wg1 n SER 92 Ca 0.11 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 58.89 1wg1 n SER 92 Cb 0.44 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.14 1wg1 n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wg1 n GLY 93 N 6.48 1.78 2.76 0.23 0.00 -1.26 -4.95 105.19 110.22 1wg1 n GLY 93 Ca 0.48 -0.11 -0.25 0.00 0.00 0.00 0.00 46.02 46.13 1wg1 n GLY 93 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wg1 s SER 94 N 0.00 2.23 1.09 1.61 0.01 -1.26 -4.72 113.70 112.66 1wg1 s SER 94 Ca 0.00 -0.44 -0.16 0.00 1.31 0.00 0.00 55.95 56.67 1wg1 s SER 94 Cb 0.00 -0.53 0.14 0.00 0.21 0.00 0.00 66.02 65.84 1wg1 s SER 94 CO 0.00 -0.24 0.41 -1.54 0.41 0.00 0.00 173.24 172.28 1wg1 n SER 95 N 5.09 -1.99 0.00 2.44 3.41 -1.26 -4.68 113.62 116.63 1wg1 n SER 95 Ca -0.08 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1wg1 n SER 95 Cb 0.49 -1.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1wg1 n SER 95 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wg1 n GLY 96 N 1.56 1.65 3.03 5.00 0.00 -1.26 -4.65 105.19 110.52 1wg1 n GLY 96 Ca 0.03 -1.39 -0.09 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.07 0.22 -0.13 -0.61 -4.36 -0.04 -3.24 121.20 112.98 1wg1 s ILE 97 Ca 0.00 -1.20 -0.03 0.00 -0.26 0.00 0.00 60.65 59.16 1wg1 s ILE 97 Cb 0.00 -0.68 -0.03 0.00 1.25 0.00 0.00 42.46 43.00 1wg1 s ILE 97 CO 0.00 -0.62 -0.03 -0.76 0.24 0.00 0.00 174.94 173.76 1wg1 s LEU 98 N -1.91 3.30 -0.77 0.37 1.43 0.93 -1.98 118.68 120.05 1wg1 s LEU 98 Ca -0.08 -0.06 -0.08 0.00 -1.03 0.00 0.00 54.13 52.88 1wg1 s LEU 98 Cb -0.05 -1.77 0.20 0.00 0.03 0.00 0.00 46.19 44.60 1wg1 s LEU 98 CO -0.03 0.24 0.66 -0.69 0.23 0.00 0.00 176.35 176.76 1wg1 s VAL 99 N -0.07 4.79 0.48 -1.59 1.01 -0.14 -1.79 120.40 123.09 1wg1 s VAL 99 Ca 0.02 -2.85 -0.03 0.00 0.00 0.00 0.00 61.98 59.12 1wg1 s VAL 99 Cb -0.13 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1wg1 s VAL 99 CO 0.02 -0.99 0.75 -0.54 0.00 0.00 0.00 175.10 174.35 1wg1 s LYS 100 N -0.15 3.23 -0.42 2.72 1.02 -0.19 -1.90 119.74 124.05 1wg1 s LYS 100 Ca 0.19 -0.13 -0.00 0.00 0.02 0.00 0.00 55.97 56.05 1wg1 s LYS 100 Cb -0.14 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 1wg1 s LYS 100 CO -0.07 -0.31 0.35 -1.71 -0.92 0.00 0.00 175.35 172.70 1wg1 n ASN 101 N -2.23 -2.09 -4.94 2.83 5.15 -1.18 -0.75 115.26 112.04 1wg1 n ASN 101 Ca 0.01 -0.22 -0.25 0.00 -0.60 0.00 0.00 54.58 53.53 1wg1 n ASN 101 Cb 0.57 -2.13 -0.02 0.00 -0.53 0.00 0.00 39.78 37.67 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 -3.52 4.21 0.00 1.20 1.43 -0.99 -4.43 118.68 116.58 1wg1 s LEU 102 Ca 0.01 0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.41 1wg1 s LEU 102 Cb -0.00 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 43.12 1wg1 s LEU 102 CO 0.26 -0.10 0.00 -0.81 0.23 0.00 0.00 176.35 175.93 1wg1 n PRO 103 N -1.12 -0.05 0.02 1.29 -0.04 -1.26 -4.69 135.00 129.16 1wg1 n PRO 103 Ca -0.06 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.46 1wg1 n PRO 103 Cb 0.55 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.91 1wg1 n PRO 103 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wg1 n GLN 104 N -0.78 0.64 -1.27 0.54 10.64 -1.26 -4.22 117.38 121.66 1wg1 n GLN 104 Ca 0.00 0.02 -0.14 0.00 -1.83 0.00 0.00 57.00 55.04 1wg1 n GLN 104 Cb 0.00 -1.68 0.12 0.00 -0.86 0.00 0.00 30.24 27.83 1wg1 n GLN 104 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1wg1 n ASP 105 N -2.59 3.91 -4.76 2.61 2.03 -1.26 -4.81 116.55 111.68 1wg1 n ASP 105 Ca -0.07 -3.79 -0.35 0.00 0.52 0.00 0.00 54.79 51.09 1wg1 n ASP 105 Cb 0.69 -0.57 0.03 0.00 -0.72 0.00 0.00 41.12 40.55 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 -2.88 5.26 0.16 1.67 0.15 -1.26 -5.05 113.70 111.76 1wg1 s SER 106 Ca 0.49 2.28 -0.19 0.00 0.70 0.00 0.00 55.95 59.23 1wg1 s SER 106 Cb 0.42 -2.59 0.05 0.00 -1.71 0.00 0.00 66.02 62.19 1wg1 s SER 106 CO 0.00 -1.54 0.53 0.20 1.20 0.00 0.00 173.24 173.63 1wg1 s ASN 107 N -1.79 -0.37 -0.00 5.45 0.01 -1.26 -4.76 114.94 112.21 1wg1 s ASN 107 Ca 0.75 -0.25 -0.25 0.00 -0.71 0.00 0.00 52.86 52.40 1wg1 s ASN 107 Cb -0.27 0.56 -0.19 0.00 0.41 0.00 0.00 41.25 41.76 1wg1 s ASN 107 CO 0.33 -0.97 1.33 0.00 -1.51 0.00 0.00 177.10 176.28 1wg1 n GLN 109 N -4.90 -0.01 -0.07 0.00 7.27 -1.26 0.61 117.38 119.01 1wg1 n GLN 109 Ca -0.08 1.07 -0.12 0.00 0.07 0.00 0.00 57.00 57.94 1wg1 n GLN 109 Cb 0.22 -2.32 -0.11 0.00 2.41 0.00 0.00 30.24 30.45 1wg1 n GLN 109 CO 0.00 0.00 0.00 1.49 0.07 0.00 0.00 177.06 178.62 1wg1 h GLU 110 N 0.00 0.00 0.49 3.69 4.57 -1.96 -3.34 114.58 118.03 1wg1 h GLU 110 Ca 0.85 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 59.01 1wg1 h GLU 110 Cb 3.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 31.76 1wg1 h GLU 110 CO -0.18 0.83 -0.24 0.28 -1.18 0.00 0.00 179.01 178.52 1wg1 h VAL 111 N -1.00 0.51 -0.73 0.32 2.07 0.28 -2.96 116.25 114.74 1wg1 h VAL 111 Ca -0.02 -0.07 0.15 0.00 0.82 0.00 0.00 66.70 67.59 1wg1 h VAL 111 Cb 0.85 0.55 -0.14 0.00 -1.52 0.00 0.00 31.29 31.03 1wg1 h VAL 111 CO -0.01 0.01 -0.16 1.57 0.02 0.00 0.00 177.57 179.00 1wg1 n HIS 112 N -5.36 0.29 -0.03 1.57 -0.00 0.13 0.16 115.22 111.98 1wg1 n HIS 112 Ca -0.12 0.89 -0.11 0.00 -0.00 0.00 0.00 57.72 58.39 1wg1 n HIS 112 Cb 0.29 -0.94 -0.05 0.00 -0.00 0.00 0.00 29.99 29.29 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 0.18 -0.32 0.26 1.82 -1.64 -0.87 116.42 115.86 1wg1 h ASP 113 Ca 0.36 -0.06 0.07 0.00 -0.39 0.00 0.00 57.03 57.01 1wg1 h ASP 113 Cb 0.58 -0.05 -0.08 0.00 0.68 0.00 0.00 39.33 40.46 1wg1 h ASP 113 CO -0.74 0.19 -0.25 0.25 -1.61 0.00 0.00 179.24 177.08 1wg1 h LEU 114 N 0.16 -0.83 -3.40 2.28 5.85 0.17 0.30 115.31 119.84 1wg1 h LEU 114 Ca 0.05 0.16 -0.37 0.00 0.84 0.00 0.00 57.88 58.56 1wg1 h LEU 114 Cb 0.05 0.40 -0.21 0.00 0.37 0.00 0.00 40.66 41.27 1wg1 h LEU 114 CO -0.01 -0.28 0.47 0.18 -0.34 0.00 0.00 178.44 178.46 1wg1 n LEU 115 N -5.39 5.71 -0.23 2.25 4.77 -0.58 -4.54 117.00 118.99 1wg1 n LEU 115 Ca 0.00 -3.02 0.02 0.00 -0.03 0.00 0.00 56.01 52.98 1wg1 n LEU 115 Cb 0.30 -0.76 0.14 0.00 -2.33 0.00 0.00 43.42 40.77 1wg1 n LEU 115 CO 0.12 0.92 1.01 0.07 -1.33 0.00 0.00 177.39 178.18 1wg1 h LYS 116 N 0.78 0.44 -0.51 3.23 2.10 0.56 -1.61 116.57 121.55 1wg1 h LYS 116 Ca 0.44 -0.03 0.10 0.00 -2.00 0.00 0.00 60.65 59.16 1wg1 h LYS 116 Cb 2.15 -0.10 -0.08 0.00 -0.90 0.00 0.00 32.23 33.30 1wg1 h LYS 116 CO 0.79 0.29 0.00 0.22 -2.00 0.00 0.00 179.45 178.75 1wg1 h ASP 117 N 0.45 -0.22 -3.76 7.07 3.58 -1.81 -3.41 116.42 118.32 1wg1 h ASP 117 Ca 0.36 0.12 -0.49 0.00 0.42 0.00 0.00 57.03 57.44 1wg1 h ASP 117 Cb 0.47 0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.71 1wg1 h ASP 117 CO -0.34 -0.08 0.15 -0.31 -2.88 0.00 0.00 179.24 175.78 1wg1 s TYR 118 N -6.17 3.42 0.31 0.28 1.51 -0.61 -5.05 117.35 111.05 1wg1 s TYR 118 Ca -0.13 1.34 -0.28 0.00 -1.01 0.00 0.00 57.07 56.98 1wg1 s TYR 118 Cb 0.16 -2.62 -0.09 0.00 -0.11 0.00 0.00 41.96 39.30 1wg1 s TYR 118 CO 0.72 0.10 1.03 0.34 -1.11 0.00 0.00 175.55 176.64 1wg1 s ASP 119 N -2.13 7.23 -0.24 2.29 -1.08 -1.26 -4.91 116.67 116.57 1wg1 s ASP 119 Ca 0.53 2.08 -0.03 0.00 -0.52 0.00 0.00 52.55 54.62 1wg1 s ASP 119 Cb -0.11 -2.61 0.01 0.00 -1.46 0.00 0.00 42.92 38.75 1wg1 s ASP 119 CO 0.17 -0.16 -0.05 -0.76 0.52 0.00 0.00 175.17 174.90 1wg1 s LEU 120 N -1.78 3.11 -0.07 -1.34 1.02 -1.26 -3.57 118.68 114.79 1wg1 s LEU 120 Ca 0.48 -0.70 0.02 0.00 0.02 0.00 0.00 54.13 53.95 1wg1 s LEU 120 Cb -0.26 -1.70 -0.25 0.00 0.02 0.00 0.00 46.19 44.00 1wg1 s LEU 120 CO 0.33 -0.10 0.54 0.11 0.02 0.00 0.00 176.35 177.26 1wg1 h LYS 121 N 8.06 0.15 -2.16 1.70 1.57 -1.44 -3.48 116.57 120.98 1wg1 h LYS 121 Ca -0.36 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.12 1wg1 h LYS 121 Cb 1.13 0.10 -0.22 0.00 0.08 0.00 0.00 32.23 33.31 1wg1 h LYS 121 CO 0.59 0.90 0.02 -0.47 -0.57 0.00 0.00 179.45 179.92 1wg1 s TYR 122 N -2.58 -0.78 -0.02 -1.35 6.14 -1.25 -5.00 117.35 112.50 1wg1 s TYR 122 Ca -0.13 1.80 -0.00 0.00 0.64 0.00 0.00 57.07 59.37 1wg1 s TYR 122 Cb 0.07 0.33 0.03 0.00 0.42 0.00 0.00 41.96 42.81 1wg1 s TYR 122 CO 0.80 -0.38 0.03 0.00 0.64 0.00 0.00 175.55 176.64 1wg1 s TYR 124 N 1.19 0.92 -0.20 0.00 6.14 -0.79 -4.97 117.35 119.63 1wg1 s TYR 124 Ca -0.08 -0.71 -0.12 0.00 0.64 0.00 0.00 57.07 56.81 1wg1 s TYR 124 Cb -0.13 -0.97 -0.05 0.00 0.42 0.00 0.00 41.96 41.23 1wg1 s TYR 124 CO -0.03 -0.56 0.21 0.08 0.64 0.00 0.00 175.55 175.89 1wg1 s VAL 125 N 1.89 5.34 -0.56 3.14 1.01 -1.26 -1.27 120.40 128.70 1wg1 s VAL 125 Ca 0.00 0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.35 1wg1 s VAL 125 Cb -0.16 -3.55 0.14 0.00 0.00 0.00 0.00 36.38 32.81 1wg1 s VAL 125 CO -0.08 0.38 0.31 -1.81 0.00 0.00 0.00 175.10 173.90 1wg1 s ASP 126 N 0.68 4.50 0.60 3.32 1.01 -0.76 -4.93 116.67 121.09 1wg1 s ASP 126 Ca 0.11 -3.08 0.30 0.00 0.71 0.00 0.00 52.55 50.59 1wg1 s ASP 126 Cb -0.13 -1.67 1.65 0.00 1.01 0.00 0.00 42.92 43.78 1wg1 s ASP 126 CO 0.02 -0.24 2.04 0.08 0.21 0.00 0.00 175.17 177.28 1wg1 h ARG 127 N 6.46 0.00 -0.16 8.23 0.11 -1.86 0.48 114.38 127.65 1wg1 h ARG 127 Ca -0.05 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.92 1wg1 h ARG 127 Cb 0.89 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.95 1wg1 h ARG 127 CO 0.70 0.00 -0.40 -0.97 0.10 0.00 0.00 179.97 179.40 1wg1 h ASN 128 N 0.00 0.38 -0.09 0.08 -0.73 -1.91 -3.12 115.58 110.19 1wg1 h ASN 128 Ca 0.10 -0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.11 1wg1 h ASN 128 Cb 0.67 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.15 1wg1 h ASN 128 CO -0.00 0.74 0.00 0.29 -0.37 0.00 0.00 177.43 178.09 1wg1 n LYS 129 N -4.03 2.10 -3.85 6.67 5.02 0.41 -5.00 118.16 119.48 1wg1 n LYS 129 Ca -0.01 -2.42 -0.26 0.00 -2.02 0.00 0.00 58.31 53.59 1wg1 n LYS 129 Cb 0.48 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 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 -0.90 -0.72 -3.70 1.97 3.00 0.14 -4.88 116.66 111.57 1wg1 n ARG 130 Ca 0.14 -0.04 -0.11 0.00 -0.01 0.00 0.00 57.85 57.83 1wg1 n ARG 130 Cb 0.62 -1.87 -0.12 0.00 0.00 0.00 0.00 32.46 31.10 1wg1 n ARG 130 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1wg1 s THR 131 N -3.97 -0.13 -0.13 0.55 2.01 -1.13 -2.36 115.64 110.49 1wg1 s THR 131 Ca 0.17 0.13 0.01 0.00 0.31 0.00 0.00 61.69 62.31 1wg1 s THR 131 Cb -0.09 -0.53 -0.00 0.00 0.01 0.00 0.00 72.50 71.88 1wg1 s THR 131 CO 0.66 0.06 -0.18 0.00 -0.69 0.00 0.00 174.62 174.47 1wg1 s ALA 132 N 1.57 2.42 -0.31 7.40 0.00 -0.80 -1.83 121.76 130.21 1wg1 s ALA 132 Ca -0.08 -0.99 -0.16 0.00 0.00 0.00 0.00 51.96 50.74 1wg1 s ALA 132 Cb -0.10 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 1wg1 s ALA 132 CO -0.11 0.13 0.40 -0.06 0.00 0.00 0.00 175.76 176.11 1wg1 s PHE 133 N 0.57 3.22 -0.06 0.00 0.40 -0.39 -0.97 117.98 120.74 1wg1 s PHE 133 Ca -0.11 0.21 0.04 0.00 -0.60 0.00 0.00 56.93 56.48 1wg1 s PHE 133 Cb -0.16 -2.68 -0.02 0.00 0.51 0.00 0.00 43.02 40.67 1wg1 s PHE 133 CO 0.04 -0.36 -0.18 0.08 0.70 0.00 0.00 175.22 175.50 1wg1 s VAL 134 N 2.12 2.75 -0.36 -0.44 1.01 -0.84 -1.89 120.40 122.75 1wg1 s VAL 134 Ca 0.15 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.31 1wg1 s VAL 134 Cb -0.16 -2.06 0.10 0.00 0.00 0.00 0.00 36.38 34.25 1wg1 s VAL 134 CO 0.11 0.58 0.09 -0.89 0.00 0.00 0.00 175.10 174.99 1wg1 s THR 135 N -0.48 2.71 1.05 3.92 2.01 -0.64 -0.86 115.64 123.36 1wg1 s THR 135 Ca 0.06 -2.10 -0.18 0.00 0.31 0.00 0.00 61.69 59.78 1wg1 s THR 135 Cb -0.12 -2.88 0.25 0.00 0.01 0.00 0.00 72.50 69.77 1wg1 s THR 135 CO 0.01 -0.55 1.16 0.18 -0.69 0.00 0.00 174.62 174.73 1wg1 n LEU 136 N 4.42 0.00 0.09 4.42 4.77 -1.26 -1.17 117.00 128.27 1wg1 n LEU 136 Ca -0.01 -1.26 -0.03 0.00 -0.03 0.00 0.00 56.01 54.68 1wg1 n LEU 136 Cb 0.42 -0.97 -0.02 0.00 -2.33 0.00 0.00 43.42 40.53 1wg1 n LEU 136 CO 0.26 -1.75 0.34 0.25 -1.33 0.00 0.00 177.39 175.17 1wg1 h LEU 137 N 0.00 -0.19 -9.84 2.23 5.85 -1.96 -3.42 115.31 107.98 1wg1 h LEU 137 Ca -0.40 0.01 -0.64 0.00 0.84 0.00 0.00 57.88 57.68 1wg1 h LEU 137 Cb 1.16 0.05 -0.13 0.00 0.37 0.00 0.00 40.66 42.11 1wg1 h LEU 137 CO 0.27 -0.10 -0.50 0.54 -0.34 0.00 0.00 178.44 178.32 1wg1 s ASN 138 N -2.86 3.65 -0.11 1.25 2.20 -1.26 -4.86 114.94 112.95 1wg1 s ASN 138 Ca -0.03 -1.71 -0.23 0.00 -0.94 0.00 0.00 52.86 49.95 1wg1 s ASN 138 Cb 0.00 0.63 -0.20 0.00 -2.00 0.00 0.00 41.25 39.69 1wg1 s ASN 138 CO 0.10 -0.94 0.72 1.23 -2.94 0.00 0.00 177.10 175.27 1wg1 h GLY 139 N 1.47 -0.04 -0.98 0.45 0.00 -1.84 -3.25 103.07 98.87 1wg1 h GLY 139 Ca -0.40 0.01 0.41 0.00 0.00 0.00 0.00 47.33 47.35 1wg1 h GLY 139 CO 0.65 -0.01 0.54 -2.21 0.00 0.00 0.00 176.54 175.51 1wg1 n GLU 140 N -4.72 -0.06 -0.09 4.80 0.00 -1.26 0.14 120.64 119.45 1wg1 n GLU 140 Ca -0.08 1.33 -0.12 0.00 0.00 0.00 0.00 57.16 58.29 1wg1 n GLU 140 Cb 0.34 -2.40 -0.04 0.00 0.00 0.00 0.00 31.44 29.34 1wg1 n GLU 140 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 1wg1 h GLN 141 N 0.00 0.49 0.01 5.31 4.20 -2.00 -3.26 115.11 119.87 1wg1 h GLN 141 Ca 0.82 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 59.34 1wg1 h GLN 141 Cb 2.20 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.95 1wg1 h GLN 141 CO -0.73 0.71 -0.00 0.00 -0.67 0.00 0.00 178.83 178.13 1wg1 h ALA 142 N 0.77 -0.01 -1.41 3.87 0.00 0.11 -1.67 119.26 120.92 1wg1 h ALA 142 Ca 0.06 -0.16 0.45 0.00 0.00 0.00 0.00 54.91 55.27 1wg1 h ALA 142 Cb 0.53 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.22 1wg1 h ALA 142 CO 0.03 -0.35 0.96 1.04 0.00 0.00 0.00 179.25 180.92 1wg1 n GLN 143 N -4.95 -0.02 -0.08 0.00 1.13 0.72 -0.30 117.38 113.89 1wg1 n GLN 143 Ca -0.08 1.03 -0.06 0.00 -1.94 0.00 0.00 57.00 55.95 1wg1 n GLN 143 Cb 0.17 -2.16 -0.02 0.00 0.11 0.00 0.00 30.24 28.35 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 -4.13 1.84 -0.33 1.08 3.02 -1.13 -4.38 115.26 111.23 1wg1 n ASN 144 Ca 0.37 0.56 0.24 0.00 -0.03 0.00 0.00 54.58 55.71 1wg1 n ASN 144 Cb 1.52 -0.84 0.45 0.00 -0.61 0.00 0.00 39.78 40.30 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 -1.00 1.71 -0.42 5.41 0.00 -0.19 0.87 119.26 125.65 1wg1 h ALA 145 Ca -0.00 0.30 0.05 0.00 0.00 0.00 0.00 54.91 55.25 1wg1 h ALA 145 Cb 0.64 0.44 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 1wg1 h ALA 145 CO -0.00 -0.77 -0.45 0.82 0.00 0.00 0.00 179.25 178.85 1wg1 h ILE 146 N 0.02 0.00 -0.02 0.00 2.04 -0.86 0.36 117.51 119.05 1wg1 h ILE 146 Ca 0.73 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.58 1wg1 h ILE 146 Cb 1.77 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1wg1 h ILE 146 CO -0.83 0.00 -0.04 1.56 0.00 0.00 0.00 178.15 178.84 1wg1 h GLN 147 N -0.26 0.06 -0.04 2.37 7.50 -1.22 1.89 115.11 125.41 1wg1 h GLN 147 Ca 0.07 -0.04 0.01 0.00 0.50 0.00 0.00 58.65 59.19 1wg1 h GLN 147 Cb 0.45 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.98 1wg1 h GLN 147 CO -0.53 0.61 0.50 0.52 -1.50 0.00 0.00 178.83 178.43 1wg1 h MET 148 N -0.47 0.00 0.00 1.46 2.86 -0.62 0.18 114.93 118.34 1wg1 h MET 148 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1wg1 h MET 148 Cb 0.61 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.27 1wg1 h MET 148 CO 0.01 0.00 -0.09 1.19 1.06 0.00 0.00 176.91 179.08 1wg1 n PHE 149 N -2.85 0.00 -1.61 -0.22 3.01 0.13 -5.01 117.46 110.90 1wg1 n PHE 149 Ca -0.01 0.00 -0.45 0.00 1.01 0.00 0.00 57.45 58.01 1wg1 n PHE 149 Cb 0.55 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.01 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 -0.92 1.50 -4.10 1.38 -0.00 0.64 -1.92 115.22 111.79 1wg1 n HIS 150 Ca 0.00 0.66 -0.31 0.00 0.46 0.00 0.00 57.72 58.53 1wg1 n HIS 150 Cb 0.00 -2.29 -0.04 0.00 -0.12 0.00 0.00 29.99 27.53 1wg1 n HIS 150 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1wg1 n GLN 151 N 0.89 -1.78 -2.57 1.57 10.64 0.38 -4.92 117.38 121.60 1wg1 n GLN 151 Ca 0.09 0.23 -0.28 0.00 -1.83 0.00 0.00 57.00 55.22 1wg1 n GLN 151 Cb 0.32 -3.85 -0.01 0.00 -0.86 0.00 0.00 30.24 25.84 1wg1 n GLN 151 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.06 174.76 1wg1 s TYR 152 N -4.05 3.56 -0.47 2.61 5.04 -0.81 -4.71 117.35 118.51 1wg1 s TYR 152 Ca 0.10 0.92 -0.28 0.00 -2.44 0.00 0.00 57.07 55.37 1wg1 s TYR 152 Cb -0.05 -2.39 0.01 0.00 0.35 0.00 0.00 41.96 39.88 1wg1 s TYR 152 CO 0.94 -0.30 1.48 0.45 -1.34 0.00 0.00 175.55 176.78 1wg1 s SER 153 N -3.94 6.15 -0.28 4.32 0.15 -1.26 -2.49 113.70 116.35 1wg1 s SER 153 Ca 0.49 0.65 -0.02 0.00 0.70 0.00 0.00 55.95 57.77 1wg1 s SER 153 Cb -0.10 -2.54 0.09 0.00 -1.71 0.00 0.00 66.02 61.75 1wg1 s SER 153 CO 0.44 -1.62 0.08 0.12 1.20 0.00 0.00 173.24 173.46 1wg1 s PHE 154 N 6.04 1.37 -1.20 3.44 5.36 0.23 -4.84 117.98 128.37 1wg1 s PHE 154 Ca 0.60 -1.40 -0.09 0.00 -0.96 0.00 0.00 56.93 55.08 1wg1 s PHE 154 Cb -0.13 -1.42 0.08 0.00 -0.34 0.00 0.00 43.02 41.20 1wg1 s PHE 154 CO 0.29 -0.80 0.42 0.54 -1.46 0.00 0.00 175.22 174.22 1wg1 n ARG 155 N 4.95 -3.01 0.00 10.12 1.74 -1.26 0.11 116.66 129.31 1wg1 n ARG 155 Ca -0.05 0.40 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 1wg1 n ARG 155 Cb 0.43 -5.06 0.00 0.00 -1.02 0.00 0.00 32.46 26.81 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 -1.07 2.98 3.83 -0.13 0.00 -1.26 -5.02 105.19 104.52 1wg1 n GLY 156 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.22 4.14 -0.53 1.61 -0.14 0.29 -5.04 119.74 119.85 1wg1 s LYS 157 Ca 0.00 0.76 -0.17 0.00 -1.36 0.00 0.00 55.97 55.20 1wg1 s LYS 157 Cb 0.00 -2.72 0.10 0.00 -1.68 0.00 0.00 37.83 33.52 1wg1 s LYS 157 CO 0.00 0.32 0.54 -0.51 -0.76 0.00 0.00 175.35 174.94 1wg1 s ASP 158 N -1.88 6.18 0.18 2.83 1.01 -1.26 -0.60 116.67 123.12 1wg1 s ASP 158 Ca 0.46 -1.46 -0.33 0.00 0.71 0.00 0.00 52.55 51.94 1wg1 s ASP 158 Cb -0.14 -2.24 -0.12 0.00 1.01 0.00 0.00 42.92 41.43 1wg1 s ASP 158 CO 0.20 -0.87 1.69 0.18 0.21 0.00 0.00 175.17 176.58 1wg1 n LEU 159 N 5.63 3.69 -4.31 1.23 4.77 -1.04 -4.64 117.00 122.34 1wg1 n LEU 159 Ca -0.11 1.06 -0.42 0.00 -0.03 0.00 0.00 56.01 56.50 1wg1 n LEU 159 Cb 0.42 -1.52 -0.09 0.00 -2.33 0.00 0.00 43.42 39.91 1wg1 n LEU 159 CO 0.53 0.02 -0.04 -0.63 -1.33 0.00 0.00 177.39 175.95 1wg1 s ILE 160 N 1.32 4.63 -0.19 -0.08 1.01 0.07 0.15 121.20 128.11 1wg1 s ILE 160 Ca 0.77 -1.33 -0.16 0.00 0.00 0.00 0.00 60.65 59.94 1wg1 s ILE 160 Cb -0.56 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 1wg1 s ILE 160 CO 0.35 -0.58 0.39 -0.69 0.00 0.00 0.00 174.94 174.42 1wg1 s VAL 161 N 1.50 5.21 0.18 2.92 1.01 -1.25 -1.02 120.40 128.96 1wg1 s VAL 161 Ca 0.04 0.72 -0.01 0.00 0.00 0.00 0.00 61.98 62.72 1wg1 s VAL 161 Cb -0.24 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1wg1 s VAL 161 CO 0.03 0.28 0.11 0.00 0.00 0.00 0.00 175.10 175.52 1wg1 s GLN 162 N 1.13 1.12 0.55 2.72 -2.07 -0.74 -4.79 119.66 117.58 1wg1 s GLN 162 Ca 0.19 -1.57 -0.14 0.00 -1.82 0.00 0.00 55.36 52.02 1wg1 s GLN 162 Cb -0.15 0.26 -0.06 0.00 -1.09 0.00 0.00 33.01 31.97 1wg1 s GLN 162 CO 0.08 -0.35 0.99 -0.51 -1.32 0.00 0.00 175.29 174.18 1wg1 s LEU 163 N -3.13 3.47 0.08 2.60 1.43 -1.26 -0.05 118.68 121.82 1wg1 s LEU 163 Ca 0.34 1.48 0.02 0.00 -1.03 0.00 0.00 54.13 54.95 1wg1 s LEU 163 Cb 0.07 -4.47 -0.03 0.00 0.03 0.00 0.00 46.19 41.79 1wg1 s LEU 163 CO 0.09 -0.70 -0.08 0.00 0.23 0.00 0.00 176.35 175.89 1wg1 s GLN 164 N -4.53 0.73 -0.35 1.70 1.03 -1.20 -4.67 119.66 112.37 1wg1 s GLN 164 Ca 0.57 -1.09 -0.28 0.00 0.04 0.00 0.00 55.36 54.60 1wg1 s GLN 164 Cb -0.10 -0.31 -0.01 0.00 0.03 0.00 0.00 33.01 32.62 1wg1 s GLN 164 CO 0.41 0.03 1.70 -1.25 -2.54 0.00 0.00 175.29 173.64 1wg1 s PRO 165 N -2.79 3.40 -0.11 9.60 0.04 -1.26 -4.86 135.00 139.02 1wg1 s PRO 165 Ca 0.03 1.31 -0.20 0.00 0.04 0.00 0.00 61.00 62.17 1wg1 s PRO 165 Cb -0.02 -4.15 -0.27 0.00 0.04 0.00 0.00 34.50 30.10 1wg1 s PRO 165 CO -0.02 -1.77 0.61 0.00 0.04 0.00 0.00 177.00 175.85 1wg1 h THR 166 N 6.72 1.22 -3.99 1.26 1.03 -1.91 -3.47 112.91 113.77 1wg1 h THR 166 Ca -0.32 -2.39 -0.53 0.00 -0.01 0.00 0.00 66.41 63.15 1wg1 h THR 166 Cb 1.15 2.84 0.10 0.00 -1.07 0.00 0.00 68.15 71.18 1wg1 h THR 166 CO 1.04 0.64 0.62 1.51 -0.01 0.00 0.00 175.52 179.32 1wg1 s ASP 167 N -6.87 5.89 -1.12 0.00 1.47 -1.26 -4.88 116.67 109.89 1wg1 s ASP 167 Ca -0.20 2.72 -0.22 0.00 1.18 0.00 0.00 52.55 56.03 1wg1 s ASP 167 Cb 0.03 -2.64 -0.02 0.00 -0.34 0.00 0.00 42.92 39.95 1wg1 s ASP 167 CO 0.74 -1.15 1.81 0.00 0.68 0.00 0.00 175.17 177.26 1wg1 s ALA 168 N -1.29 2.29 -0.11 2.11 0.00 -1.26 -4.89 121.76 118.61 1wg1 s ALA 168 Ca 0.63 -2.21 -0.02 0.00 0.00 0.00 0.00 51.96 50.36 1wg1 s ALA 168 Cb -0.39 -4.62 0.04 0.00 0.00 0.00 0.00 23.12 18.15 1wg1 s ALA 168 CO 0.49 -4.40 -0.00 -1.17 0.00 0.00 0.00 175.76 170.67 1wg1 s LEU 169 N 8.17 0.83 -0.18 0.00 2.96 -1.26 -5.03 118.68 124.17 1wg1 s LEU 169 Ca 0.62 -0.30 -0.15 0.00 -0.22 0.00 0.00 54.13 54.08 1wg1 s LEU 169 Cb -0.01 -0.54 -0.10 0.00 0.50 0.00 0.00 46.19 46.04 1wg1 s LEU 169 CO 0.05 -0.21 -0.04 0.18 -1.32 0.00 0.00 176.35 175.01 1wg1 n LEU 170 N 5.09 1.84 -3.99 -0.68 7.99 -1.26 -4.91 117.00 121.08 1wg1 n LEU 170 Ca -0.08 0.53 -0.30 0.00 -0.01 0.00 0.00 56.01 56.15 1wg1 n LEU 170 Cb 0.49 -0.90 -0.16 0.00 -0.11 0.00 0.00 43.42 42.74 1wg1 n LEU 170 CO 0.12 -0.12 -0.47 0.00 -1.51 0.00 0.00 177.39 175.40 1wg1 n SER 172 N 4.79 0.32 -3.67 0.00 2.88 -1.26 -4.91 113.62 111.77 1wg1 n SER 172 Ca -0.16 0.90 -0.03 0.00 -1.33 0.00 0.00 58.87 58.25 1wg1 n SER 172 Cb 0.49 -0.69 -0.01 0.00 -0.75 0.00 0.00 64.21 63.25 1wg1 n SER 172 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wg1 s GLY 173 N 0.81 -0.18 0.34 0.46 0.00 -1.26 -5.03 107.32 102.46 1wg1 s GLY 173 Ca 0.74 0.07 0.13 0.00 0.00 0.00 0.00 44.72 45.65 1wg1 s GLY 173 CO 0.50 0.37 1.74 -0.56 0.00 0.00 0.00 173.10 175.15 1wg1 h PRO 174 N 2.00 0.00 -1.00 2.90 0.13 -2.02 -3.23 132.00 130.78 1wg1 h PRO 174 Ca -0.25 0.00 0.36 0.00 -0.87 0.00 0.00 66.00 65.24 1wg1 h PRO 174 Cb 1.23 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.25 1wg1 h PRO 174 CO 0.27 0.47 0.63 -1.13 -0.23 0.00 0.00 178.00 178.01 1wg1 n SER 175 N -3.91 0.18 -3.73 1.44 3.41 -1.26 -2.96 113.62 106.79 1wg1 n SER 175 Ca -0.01 1.09 -0.30 0.00 -0.26 0.00 0.00 58.87 59.39 1wg1 n SER 175 Cb 0.50 -0.54 -0.15 0.00 -0.26 0.00 0.00 64.21 63.76 1wg1 n SER 175 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wg1 s SER 176 N -4.40 4.02 0.00 4.04 0.15 -1.22 -5.24 113.70 111.05 1wg1 s SER 176 Ca -0.06 -1.66 0.00 0.00 0.70 0.00 0.00 55.95 54.93 1wg1 s SER 176 Cb 0.24 -0.86 0.00 0.00 -1.71 0.00 0.00 66.02 63.69 1wg1 s SER 176 CO 0.62 -0.41 0.02 0.61 1.20 0.00 0.00 173.24 175.27