#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wg6 n SER 2 N 0.00 -7.20 0.00 1.61 7.64 -1.26 -5.06 113.62 109.35 1wg6 n SER 2 Ca 0.00 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1wg6 n SER 2 Cb 0.00 -4.40 0.00 0.00 -1.01 0.00 0.00 64.21 58.80 1wg6 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wg6 n SER 3 N -4.26 0.00 -3.23 6.43 2.88 -1.26 -5.19 113.62 108.99 1wg6 n SER 3 Ca -0.06 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.43 1wg6 n SER 3 Cb 0.63 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.11 1wg6 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wg6 s GLY 4 N 0.00 0.18 -0.01 0.46 0.00 -1.26 -5.19 107.32 101.51 1wg6 s GLY 4 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 44.72 43.95 1wg6 s GLY 4 CO 0.00 1.03 1.20 -0.45 0.00 0.00 0.00 173.10 174.89 1wg6 s SER 5 N -3.22 -0.10 0.09 1.64 0.15 -1.26 -5.19 113.70 105.81 1wg6 s SER 5 Ca 0.18 -0.16 -0.26 0.00 0.70 0.00 0.00 55.95 56.40 1wg6 s SER 5 Cb -0.04 0.23 0.08 0.00 -1.71 0.00 0.00 66.02 64.58 1wg6 s SER 5 CO 0.08 -0.41 0.90 -0.94 1.20 0.00 0.00 173.24 174.07 1wg6 s SER 6 N -2.86 -0.28 0.00 5.45 1.04 -1.26 -5.14 113.70 110.66 1wg6 s SER 6 Ca 0.13 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.35 1wg6 s SER 6 Cb 0.03 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.60 1wg6 s SER 6 CO -0.03 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1wg6 n GLY 7 N -0.37 0.85 1.29 7.32 0.00 -1.26 -5.08 105.19 107.94 1wg6 n GLY 7 Ca -0.08 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.51 1wg6 n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wg6 n LEU 8 N 0.00 -4.67 -0.98 0.99 7.99 -1.26 -4.99 117.00 114.07 1wg6 n LEU 8 Ca 0.00 2.29 0.11 0.00 -0.01 0.00 0.00 56.01 58.40 1wg6 n LEU 8 Cb 0.00 -1.92 -0.06 0.00 -0.11 0.00 0.00 43.42 41.33 1wg6 n LEU 8 CO 0.00 -0.34 -0.43 0.29 -1.51 0.00 0.00 177.39 175.40 1wg6 n LYS 9 N 0.05 -2.29 0.00 3.23 4.76 -1.26 -5.09 118.16 117.56 1wg6 n LYS 9 Ca 0.00 1.87 0.00 0.00 -2.87 0.00 0.00 58.31 57.31 1wg6 n LYS 9 Cb 0.00 -2.64 0.00 0.00 -1.84 0.00 0.00 35.03 30.55 1wg6 n LYS 9 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wg6 n GLY 10 N -3.50 3.51 2.53 0.72 0.00 -1.26 -5.10 105.19 102.08 1wg6 n GLY 10 Ca -0.06 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.32 1wg6 n GLY 10 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wg6 s GLU 11 N -2.64 1.19 -1.15 1.61 0.41 -1.26 -5.02 118.70 111.83 1wg6 s GLU 11 Ca 0.00 -2.23 -0.14 0.00 -0.41 0.00 0.00 54.97 52.20 1wg6 s GLU 11 Cb 0.00 -1.87 -0.07 0.00 -1.78 0.00 0.00 34.13 30.41 1wg6 s GLU 11 CO 0.00 -1.32 2.24 -0.35 -0.49 0.00 0.00 175.26 175.34 1wg6 n PRO 12 N 2.92 2.41 -3.53 0.39 -0.04 -1.26 -4.82 135.00 131.07 1wg6 n PRO 12 Ca 0.23 -2.03 -0.41 0.00 -0.04 0.00 0.00 63.50 61.25 1wg6 n PRO 12 Cb 0.43 -2.89 -0.07 0.00 -0.04 0.00 0.00 33.50 30.92 1wg6 n PRO 12 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1wg6 s ASP 13 N 3.62 5.83 0.21 3.54 -4.77 -1.26 -5.05 116.67 118.79 1wg6 s ASP 13 Ca 0.53 -2.26 0.10 0.00 -3.30 0.00 0.00 52.55 47.62 1wg6 s ASP 13 Cb 0.14 -2.03 -0.05 0.00 -1.09 0.00 0.00 42.92 39.90 1wg6 s ASP 13 CO -0.01 -0.61 -0.20 0.00 0.70 0.00 0.00 175.17 175.05 1wg6 s TYR 15 N -2.16 1.23 -0.15 0.00 5.04 -1.26 -5.14 117.35 114.90 1wg6 s TYR 15 Ca 0.22 -0.66 -0.06 0.00 -2.44 0.00 0.00 57.07 54.14 1wg6 s TYR 15 Cb -0.06 -0.65 -0.04 0.00 0.35 0.00 0.00 41.96 41.57 1wg6 s TYR 15 CO 0.10 0.07 0.05 0.00 -1.34 0.00 0.00 175.55 174.44 1wg6 s ALA 16 N -2.63 3.40 0.65 3.97 0.00 -1.26 -5.10 121.76 120.80 1wg6 s ALA 16 Ca 0.10 -0.75 -0.11 0.00 0.00 0.00 0.00 51.96 51.20 1wg6 s ALA 16 Cb -0.02 -1.81 -0.02 0.00 0.00 0.00 0.00 23.12 21.28 1wg6 s ALA 16 CO 0.01 0.31 1.05 -0.51 0.00 0.00 0.00 175.76 176.63 1wg6 s LEU 17 N -0.04 3.10 -0.09 0.00 1.43 -1.26 -5.07 118.68 116.75 1wg6 s LEU 17 Ca 0.06 1.29 -0.01 0.00 -1.03 0.00 0.00 54.13 54.44 1wg6 s LEU 17 Cb -0.12 -4.23 0.03 0.00 0.03 0.00 0.00 46.19 41.89 1wg6 s LEU 17 CO 0.01 -1.06 -0.04 -0.44 0.23 0.00 0.00 176.35 175.05 1wg6 s SER 18 N -4.25 1.85 1.00 2.29 0.01 -1.26 -5.13 113.70 108.21 1wg6 s SER 18 Ca 0.56 -0.20 -0.13 0.00 1.31 0.00 0.00 55.95 57.49 1wg6 s SER 18 Cb -0.11 -0.65 0.11 0.00 0.21 0.00 0.00 66.02 65.58 1wg6 s SER 18 CO 0.53 -0.14 0.59 0.18 0.41 0.00 0.00 173.24 174.81 1wg6 n LEU 19 N 4.96 0.12 -4.70 2.44 4.77 -1.26 -4.91 117.00 118.41 1wg6 n LEU 19 Ca -0.11 0.21 -0.42 0.00 -0.03 0.00 0.00 56.01 55.66 1wg6 n LEU 19 Cb 0.50 -1.24 -0.03 0.00 -2.33 0.00 0.00 43.42 40.32 1wg6 n LEU 19 CO 0.14 -3.13 0.64 -0.70 -1.33 0.00 0.00 177.39 173.01 1wg6 s GLU 20 N -3.95 4.45 0.29 3.23 2.12 -1.26 -5.02 118.70 118.56 1wg6 s GLU 20 Ca 0.61 1.23 0.01 0.00 0.36 0.00 0.00 54.97 57.17 1wg6 s GLU 20 Cb -0.20 -3.50 -0.00 0.00 0.26 0.00 0.00 34.13 30.68 1wg6 s GLU 20 CO 0.65 -0.15 0.36 0.45 -0.54 0.00 0.00 175.26 176.03 1wg6 n SER 21 N 4.42 -0.99 -4.14 -1.70 2.88 -1.26 -5.19 113.62 107.64 1wg6 n SER 21 Ca 0.05 -2.65 -0.14 0.00 -1.33 0.00 0.00 58.87 54.80 1wg6 n SER 21 Cb 0.50 1.93 -0.10 0.00 -0.75 0.00 0.00 64.21 65.79 1wg6 n SER 21 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wg6 s SER 22 N -2.85 0.56 -0.18 -3.46 1.04 -1.26 -4.61 113.70 102.93 1wg6 s SER 22 Ca 0.27 -1.43 -0.03 0.00 0.48 0.00 0.00 55.95 55.24 1wg6 s SER 22 Cb -0.00 0.35 -0.01 0.00 0.10 0.00 0.00 66.02 66.46 1wg6 s SER 22 CO 0.19 -0.84 -0.07 -1.61 0.98 0.00 0.00 173.24 171.89 1wg6 s GLU 23 N -4.06 3.41 -0.00 4.02 0.41 -0.64 -5.00 118.70 116.84 1wg6 s GLU 23 Ca 0.39 -0.63 0.07 0.00 -0.41 0.00 0.00 54.97 54.39 1wg6 s GLU 23 Cb 0.07 -2.88 -0.02 0.00 -1.78 0.00 0.00 34.13 29.52 1wg6 s GLU 23 CO 0.14 -0.02 -0.22 -1.14 -0.49 0.00 0.00 175.26 173.53 1wg6 s GLN 24 N 0.99 1.75 -0.08 1.61 -0.44 -1.26 0.24 119.66 122.48 1wg6 s GLN 24 Ca -0.00 -0.84 -0.01 0.00 -2.50 0.00 0.00 55.36 52.00 1wg6 s GLN 24 Cb -0.15 -1.74 0.03 0.00 -1.64 0.00 0.00 33.01 29.51 1wg6 s GLN 24 CO -0.00 0.47 0.01 -0.51 0.50 0.00 0.00 175.29 175.76 1wg6 s LEU 25 N -0.67 0.59 -0.44 3.68 1.43 -0.86 -4.99 118.68 117.43 1wg6 s LEU 25 Ca 0.09 -0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 52.93 1wg6 s LEU 25 Cb -0.09 -0.43 0.05 0.00 0.03 0.00 0.00 46.19 45.75 1wg6 s LEU 25 CO -0.00 -0.20 0.33 -0.89 0.23 0.00 0.00 176.35 175.82 1wg6 s THR 26 N 1.98 5.08 -0.16 5.49 2.01 -1.26 -2.36 115.64 126.41 1wg6 s THR 26 Ca 0.05 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.08 1wg6 s THR 26 Cb -0.12 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.41 1wg6 s THR 26 CO -0.05 -0.45 -0.05 -0.76 -0.69 0.00 0.00 174.62 172.62 1wg6 s LEU 27 N 1.62 3.15 -0.04 4.42 2.01 -0.83 -4.94 118.68 124.08 1wg6 s LEU 27 Ca 0.04 -0.19 -0.01 0.00 0.01 0.00 0.00 54.13 53.99 1wg6 s LEU 27 Cb -0.22 -1.76 -0.04 0.00 0.01 0.00 0.00 46.19 44.19 1wg6 s LEU 27 CO 0.07 0.14 0.03 -1.61 1.01 0.00 0.00 176.35 176.00 1wg6 s GLU 28 N 0.51 2.97 -0.03 1.70 8.01 -1.26 -1.16 118.70 129.44 1wg6 s GLU 28 Ca -0.04 -0.48 0.01 0.00 0.01 0.00 0.00 54.97 54.47 1wg6 s GLU 28 Cb -0.14 -2.79 0.01 0.00 -4.31 0.00 0.00 34.13 26.90 1wg6 s GLU 28 CO 0.03 0.67 -0.04 0.42 0.01 0.00 0.00 175.26 176.35 1wg6 s ILE 29 N -1.05 0.40 0.48 -1.63 -1.09 -0.03 -4.96 121.20 113.31 1wg6 s ILE 29 Ca 0.18 -0.10 -0.21 0.00 -2.23 0.00 0.00 60.65 58.29 1wg6 s ILE 29 Cb -0.12 -0.41 -0.09 0.00 -1.58 0.00 0.00 42.46 40.27 1wg6 s ILE 29 CO 0.08 0.17 1.04 -2.16 -1.23 0.00 0.00 174.94 172.84 1wg6 s PRO 30 N 0.57 3.84 -0.41 2.79 0.04 -1.26 0.65 135.00 141.23 1wg6 s PRO 30 Ca -0.07 1.38 0.11 0.00 0.04 0.00 0.00 61.00 62.46 1wg6 s PRO 30 Cb -0.10 -2.14 0.41 0.00 0.04 0.00 0.00 34.50 32.71 1wg6 s PRO 30 CO -0.00 -0.40 0.95 1.28 0.04 0.00 0.00 177.00 178.87 1wg6 n LEU 31 N -0.87 2.81 -0.07 -3.56 4.77 0.39 -4.74 117.00 115.73 1wg6 n LEU 31 Ca 0.09 -4.75 -0.07 0.00 -0.03 0.00 0.00 56.01 51.25 1wg6 n LEU 31 Cb 0.52 0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.63 1wg6 n LEU 31 CO 0.40 2.04 -0.25 0.78 -1.33 0.00 0.00 177.39 179.03 1wg6 h ASN 32 N 2.87 0.00 0.12 -1.43 2.35 -1.88 -2.94 115.58 114.67 1wg6 h ASN 32 Ca 0.10 -0.15 -0.36 0.00 -0.55 0.00 0.00 56.30 55.33 1wg6 h ASN 32 Cb 0.95 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.30 1wg6 h ASN 32 CO 0.66 0.84 -1.99 -0.67 -1.65 0.00 0.00 177.43 174.62 1wg6 n ASP 33 N -4.62 2.12 0.13 5.81 -0.08 -1.26 -4.08 116.55 114.57 1wg6 n ASP 33 Ca -0.10 0.21 -0.01 0.00 -1.51 0.00 0.00 54.79 53.38 1wg6 n ASP 33 Cb 0.29 -0.86 0.11 0.00 2.34 0.00 0.00 41.12 43.00 1wg6 n ASP 33 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 1wg6 h SER 34 N 0.05 0.00 -1.02 1.67 0.87 -1.86 -3.20 113.55 110.07 1wg6 h SER 34 Ca -0.43 0.00 0.29 0.00 -1.23 0.00 0.00 61.79 60.42 1wg6 h SER 34 Cb 2.02 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 63.85 1wg6 h SER 34 CO 0.08 0.65 0.61 1.23 -0.53 0.00 0.00 176.83 178.87 1wg6 h GLY 35 N 2.45 1.86 -0.94 5.77 0.00 -1.66 1.21 103.07 111.76 1wg6 h GLY 35 Ca -0.01 -0.26 0.12 0.00 0.00 0.00 0.00 47.33 47.18 1wg6 h GLY 35 CO 0.08 -0.33 -0.45 1.44 0.00 0.00 0.00 176.54 177.28 1wg6 n SER 36 N -4.91 -0.79 -0.01 0.19 7.64 -1.21 -0.89 113.62 113.65 1wg6 n SER 36 Ca 0.29 1.65 -0.00 0.00 1.01 0.00 0.00 58.87 61.82 1wg6 n SER 36 Cb 0.88 -0.30 -0.11 0.00 -1.01 0.00 0.00 64.21 63.67 1wg6 n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wg6 n ALA 37 N -3.41 1.98 0.00 -0.43 0.00 -0.31 -5.09 120.51 113.26 1wg6 n ALA 37 Ca 0.06 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1wg6 n ALA 37 Cb 0.31 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.02 1wg6 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wg6 n GLY 38 N 1.45 0.01 0.07 0.00 0.00 0.40 -4.81 105.19 102.32 1wg6 n GLY 38 Ca -0.14 -2.28 -0.02 0.00 0.00 0.00 0.00 46.02 43.58 1wg6 n GLY 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wg6 n LEU 39 N 0.00 -0.18 0.00 0.99 4.77 -1.26 -4.19 117.00 117.12 1wg6 n LEU 39 Ca 0.00 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.07 1wg6 n LEU 39 Cb 0.00 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 1wg6 n LEU 39 CO 0.00 -0.64 0.00 0.61 -1.33 0.00 0.00 177.39 176.03 1wg6 n GLY 40 N -1.04 0.86 3.13 -0.72 0.00 -1.26 -4.12 105.19 102.04 1wg6 n GLY 40 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1wg6 n GLY 40 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wg6 s VAL 41 N -1.45 0.16 -0.06 1.61 -7.23 -1.26 -4.24 120.40 107.93 1wg6 s VAL 41 Ca 0.00 -1.31 0.02 0.00 -1.81 0.00 0.00 61.98 58.88 1wg6 s VAL 41 Cb 0.00 -1.17 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 1wg6 s VAL 41 CO 0.00 -0.72 -0.10 -0.55 -0.31 0.00 0.00 175.10 173.42 1wg6 s SER 42 N -2.52 4.38 0.48 4.85 0.15 -1.25 -5.05 113.70 114.74 1wg6 s SER 42 Ca 0.01 -0.10 0.03 0.00 0.70 0.00 0.00 55.95 56.59 1wg6 s SER 42 Cb 0.03 -1.03 -0.03 0.00 -1.71 0.00 0.00 66.02 63.28 1wg6 s SER 42 CO -0.08 0.35 0.04 -0.76 1.20 0.00 0.00 173.24 174.00 1wg6 s LEU 43 N -0.79 2.54 -0.01 3.45 1.43 -1.26 -0.07 118.68 123.96 1wg6 s LEU 43 Ca 0.12 -1.51 0.02 0.00 -1.03 0.00 0.00 54.13 51.72 1wg6 s LEU 43 Cb -0.11 -0.85 -0.00 0.00 0.03 0.00 0.00 46.19 45.26 1wg6 s LEU 43 CO 0.01 -0.74 -0.05 -1.59 0.23 0.00 0.00 176.35 174.21 1wg6 s LYS 44 N -3.86 0.44 -0.30 1.70 -2.85 0.50 -4.67 119.74 110.69 1wg6 s LYS 44 Ca 0.18 -0.18 -0.12 0.00 -1.00 0.00 0.00 55.97 54.86 1wg6 s LYS 44 Cb 0.04 -0.43 -0.03 0.00 -2.06 0.00 0.00 37.83 35.35 1wg6 s LYS 44 CO 0.10 0.10 0.20 0.20 0.10 0.00 0.00 175.35 176.05 1wg6 s GLY 45 N -0.05 1.94 -0.15 0.59 0.00 -1.26 -0.60 107.32 107.79 1wg6 s GLY 45 Ca 0.01 -1.22 -0.07 0.00 0.00 0.00 0.00 44.72 43.43 1wg6 s GLY 45 CO -0.00 0.70 0.10 0.21 0.00 0.00 0.00 173.10 174.11 1wg6 s ASN 46 N 1.73 6.00 0.05 1.64 3.84 -1.11 -5.03 114.94 122.06 1wg6 s ASN 46 Ca 0.06 0.27 0.04 0.00 0.21 0.00 0.00 52.86 53.44 1wg6 s ASN 46 Cb -0.17 -1.97 -0.02 0.00 -0.55 0.00 0.00 41.25 38.54 1wg6 s ASN 46 CO 0.10 0.29 -0.12 -0.75 -2.79 0.00 0.00 177.10 173.83 1wg6 s LYS 47 N -0.31 0.74 -0.08 0.43 2.20 -1.26 -2.17 119.74 119.30 1wg6 s LYS 47 Ca 0.10 -0.80 0.02 0.00 -0.36 0.00 0.00 55.97 54.93 1wg6 s LYS 47 Cb -0.12 -0.68 -0.02 0.00 -1.51 0.00 0.00 37.83 35.50 1wg6 s LYS 47 CO 0.01 0.15 -0.12 -1.12 -0.36 0.00 0.00 175.35 173.92 1wg6 s SER 48 N -1.44 4.22 -0.09 1.43 0.01 -0.84 -4.89 113.70 112.10 1wg6 s SER 48 Ca -0.03 -0.17 -0.00 0.00 1.31 0.00 0.00 55.95 57.05 1wg6 s SER 48 Cb -0.09 -1.14 -0.25 0.00 0.21 0.00 0.00 66.02 64.75 1wg6 s SER 48 CO 0.01 0.30 0.49 -0.09 0.41 0.00 0.00 173.24 174.37 1wg6 h ARG 49 N 5.67 0.18 0.58 12.44 2.43 -1.95 -2.06 114.38 131.68 1wg6 h ARG 49 Ca -0.42 -0.31 -0.02 0.00 -0.81 0.00 0.00 59.98 58.42 1wg6 h ARG 49 Cb 1.17 0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1wg6 h ARG 49 CO 0.53 0.97 -0.33 0.93 -1.51 0.00 0.00 179.97 180.56 1wg6 h GLU 50 N 0.05 -0.82 0.00 0.20 4.39 -1.97 -2.82 114.58 113.62 1wg6 h GLU 50 Ca -0.37 0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.32 1wg6 h GLU 50 Cb 2.03 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 30.86 1wg6 h GLU 50 CO 0.09 -0.54 -0.31 1.79 -1.16 0.00 0.00 179.01 178.88 1wg6 h THR 51 N -0.85 0.56 -4.96 1.13 1.35 -2.01 -3.47 112.91 104.66 1wg6 h THR 51 Ca -0.07 -1.67 -0.32 0.00 -0.55 0.00 0.00 66.41 63.80 1wg6 h THR 51 Cb 0.68 2.18 0.12 0.00 -1.73 0.00 0.00 68.15 69.40 1wg6 h THR 51 CO 0.09 0.30 -0.57 0.61 -0.25 0.00 0.00 175.52 175.71 1wg6 n GLY 52 N 0.99 -0.26 3.11 5.82 0.00 -0.80 -5.01 105.19 109.04 1wg6 n GLY 52 Ca 0.02 0.07 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 1wg6 n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wg6 s THR 53 N -3.27 0.20 -0.38 2.61 2.01 -1.08 -5.00 115.64 110.73 1wg6 s THR 53 Ca 0.40 -1.65 -0.29 0.00 0.31 0.00 0.00 61.69 60.46 1wg6 s THR 53 Cb -0.18 -1.44 0.02 0.00 0.01 0.00 0.00 72.50 70.91 1wg6 s THR 53 CO 0.60 -0.91 1.08 1.51 -0.69 0.00 0.00 174.62 176.21 1wg6 s ASP 54 N -2.86 6.80 0.34 3.53 1.47 -1.26 -1.99 116.67 122.71 1wg6 s ASP 54 Ca 0.06 0.80 0.03 0.00 1.18 0.00 0.00 52.55 54.62 1wg6 s ASP 54 Cb 0.07 -2.54 0.66 0.00 -0.34 0.00 0.00 42.92 40.77 1wg6 s ASP 54 CO -0.10 -1.01 1.97 -0.07 0.68 0.00 0.00 175.17 176.64 1wg6 h LEU 55 N 10.48 0.74 0.00 2.11 3.38 -1.78 -3.48 115.31 126.76 1wg6 h LEU 55 Ca -0.22 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1wg6 h LEU 55 Cb 1.06 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1wg6 h LEU 55 CO 1.06 0.50 0.00 0.61 0.09 0.00 0.00 178.44 180.70 1wg6 n GLY 56 N -1.44 0.86 3.77 0.83 0.00 -1.21 -5.03 105.19 102.97 1wg6 n GLY 56 Ca 0.10 -1.98 -0.32 0.00 0.00 0.00 0.00 46.02 43.81 1wg6 n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wg6 s ILE 57 N -1.91 4.65 -0.00 -0.61 -1.09 -1.26 -2.75 121.20 118.24 1wg6 s ILE 57 Ca 0.00 -0.49 0.01 0.00 -2.23 0.00 0.00 60.65 57.94 1wg6 s ILE 57 Cb 0.00 -3.15 -0.00 0.00 -1.58 0.00 0.00 42.46 37.73 1wg6 s ILE 57 CO 0.00 0.31 -0.04 -0.36 -1.23 0.00 0.00 174.94 173.62 1wg6 s PHE 58 N -1.23 0.33 0.51 3.97 0.40 0.23 -2.08 117.98 120.12 1wg6 s PHE 58 Ca 0.24 -0.08 -0.22 0.00 -0.60 0.00 0.00 56.93 56.27 1wg6 s PHE 58 Cb -0.12 -0.21 -0.06 0.00 0.51 0.00 0.00 43.02 43.14 1wg6 s PHE 58 CO 0.15 -0.01 1.25 0.42 0.70 0.00 0.00 175.22 177.73 1wg6 s ILE 59 N -0.16 2.62 -0.20 0.64 1.01 -0.61 0.19 121.20 124.69 1wg6 s ILE 59 Ca 0.01 0.45 -0.16 0.00 0.00 0.00 0.00 60.65 60.95 1wg6 s ILE 59 Cb -0.02 -3.22 -0.08 0.00 0.01 0.00 0.00 42.46 39.14 1wg6 s ILE 59 CO -0.00 -0.02 -0.26 1.17 0.00 0.00 0.00 174.94 175.83 1wg6 n LYS 60 N -0.86 0.53 -3.64 2.79 4.81 0.89 0.18 118.16 122.87 1wg6 n LYS 60 Ca 0.09 0.32 -0.03 0.00 -0.87 0.00 0.00 58.31 57.83 1wg6 n LYS 60 Cb 0.47 -1.53 -0.05 0.00 0.02 0.00 0.00 35.03 33.94 1wg6 n LYS 60 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1wg6 s SER 61 N -6.40 -0.08 0.08 3.14 1.04 -1.18 -4.53 113.70 105.77 1wg6 s SER 61 Ca -0.29 0.10 -0.23 0.00 0.48 0.00 0.00 55.95 56.01 1wg6 s SER 61 Cb 0.07 0.08 -0.06 0.00 0.10 0.00 0.00 66.02 66.21 1wg6 s SER 61 CO 0.42 -0.06 0.69 -0.63 0.98 0.00 0.00 173.24 174.64 1wg6 s ILE 62 N -0.78 4.66 -0.61 -1.02 1.09 -1.26 -3.82 121.20 119.45 1wg6 s ILE 62 Ca 0.08 1.47 -0.22 0.00 -1.10 0.00 0.00 60.65 60.88 1wg6 s ILE 62 Cb -0.02 -4.03 0.07 0.00 -1.06 0.00 0.00 42.46 37.42 1wg6 s ILE 62 CO -0.09 0.47 0.88 -0.63 -0.10 0.00 0.00 174.94 175.47 1wg6 s ILE 63 N -0.67 4.48 0.73 2.92 1.09 -1.26 -4.95 121.20 123.53 1wg6 s ILE 63 Ca 0.34 -0.34 -0.14 0.00 -1.10 0.00 0.00 60.65 59.40 1wg6 s ILE 63 Cb -0.21 -4.58 0.04 0.00 -1.06 0.00 0.00 42.46 36.65 1wg6 s ILE 63 CO 0.22 -1.26 1.16 -2.28 -0.10 0.00 0.00 174.94 172.68 1wg6 s HIS 64 N 3.66 2.22 0.00 3.97 5.65 -1.26 -3.13 115.29 126.40 1wg6 s HIS 64 Ca 0.21 1.60 0.00 0.00 0.25 0.00 0.00 55.06 57.12 1wg6 s HIS 64 Cb -0.17 -3.34 0.00 0.00 -1.18 0.00 0.00 32.58 27.89 1wg6 s HIS 64 CO 0.12 -2.29 0.00 0.41 -0.65 0.00 0.00 174.74 172.32 1wg6 n GLY 65 N -0.01 0.52 0.00 1.59 0.00 -1.26 -4.96 105.19 101.07 1wg6 n GLY 65 Ca 0.12 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1wg6 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wg6 n GLY 66 N -2.93 5.30 0.03 -0.02 0.00 -1.18 -5.05 105.19 101.34 1wg6 n GLY 66 Ca 0.00 -1.53 -0.01 0.00 0.00 0.00 0.00 46.02 44.48 1wg6 n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wg6 h ALA 67 N 1.00 0.00 -1.43 4.61 0.00 -1.83 -3.33 119.26 118.27 1wg6 h ALA 67 Ca 0.00 -0.09 0.45 0.00 0.00 0.00 0.00 54.91 55.27 1wg6 h ALA 67 Cb 0.00 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 17.74 1wg6 h ALA 67 CO 0.00 0.07 0.96 0.00 0.00 0.00 0.00 179.25 180.27 1wg6 h ALA 68 N -1.47 2.97 -0.91 0.00 0.00 -1.83 0.26 119.26 118.29 1wg6 h ALA 68 Ca 0.00 0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.19 1wg6 h ALA 68 Cb 0.07 0.19 -0.17 0.00 0.00 0.00 0.00 17.79 17.87 1wg6 h ALA 68 CO 0.00 -1.57 -0.12 0.34 0.00 0.00 0.00 179.25 177.90 1wg6 n PHE 69 N -4.52 0.44 0.00 0.00 7.35 -1.24 0.19 117.46 119.68 1wg6 n PHE 69 Ca 0.38 1.10 0.00 0.00 -0.76 0.00 0.00 57.45 58.17 1wg6 n PHE 69 Cb 1.53 -1.09 0.00 0.00 0.35 0.00 0.00 39.48 40.26 1wg6 n PHE 69 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1wg6 n LYS 70 N -5.41 0.00 0.09 -4.13 5.02 0.91 0.01 118.16 114.66 1wg6 n LYS 70 Ca 0.18 0.74 0.08 0.00 -2.02 0.00 0.00 58.31 57.28 1wg6 n LYS 70 Cb 0.56 -1.43 0.38 0.00 -0.02 0.00 0.00 35.03 34.52 1wg6 n LYS 70 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1wg6 n ASP 71 N -2.37 0.37 -0.59 4.39 2.03 -0.11 -2.98 116.55 117.28 1wg6 n ASP 71 Ca 0.00 0.64 0.45 0.00 0.52 0.00 0.00 54.79 56.40 1wg6 n ASP 71 Cb 0.00 -0.70 0.70 0.00 -0.72 0.00 0.00 41.12 40.40 1wg6 n ASP 71 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wg6 n GLY 72 N -0.92 -0.85 0.64 0.27 0.00 0.50 0.30 105.19 105.13 1wg6 n GLY 72 Ca 0.00 0.59 0.45 0.00 0.00 0.00 0.00 46.02 47.06 1wg6 n GLY 72 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1wg6 n ARG 73 N -3.63 0.00 -0.80 1.61 1.85 -1.16 -4.36 116.66 110.17 1wg6 n ARG 73 Ca 0.38 1.04 -0.29 0.00 -1.00 0.00 0.00 57.85 57.98 1wg6 n ARG 73 Cb 1.74 -2.46 0.23 0.00 -1.05 0.00 0.00 32.46 30.92 1wg6 n ARG 73 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1wg6 s LEU 74 N -7.32 0.85 -0.11 2.89 1.43 0.15 -5.03 118.68 111.53 1wg6 s LEU 74 Ca -0.04 1.23 0.02 0.00 -1.03 0.00 0.00 54.13 54.31 1wg6 s LEU 74 Cb 0.22 -3.16 -0.00 0.00 0.03 0.00 0.00 46.19 43.28 1wg6 s LEU 74 CO 0.74 -3.96 -0.20 -0.13 0.23 0.00 0.00 176.35 173.03 1wg6 s ARG 75 N -4.78 3.17 0.54 1.70 1.81 -1.26 -4.97 118.95 115.16 1wg6 s ARG 75 Ca 0.68 -0.81 -0.07 0.00 -1.72 0.00 0.00 55.73 53.81 1wg6 s ARG 75 Cb -0.20 -2.43 0.11 0.00 -0.45 0.00 0.00 34.95 31.98 1wg6 s ARG 75 CO 0.61 0.18 0.25 0.00 -0.68 0.00 0.00 175.30 175.66 1wg6 n MET 76 N 3.56 -1.04 -1.26 3.54 0.00 -1.26 -3.42 117.12 117.24 1wg6 n MET 76 Ca -0.19 -0.42 -0.09 0.00 0.00 0.00 0.00 57.70 57.01 1wg6 n MET 76 Cb 0.53 -0.77 -0.04 0.00 0.00 0.00 0.00 33.22 32.94 1wg6 n MET 76 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1wg6 n ASN 77 N -1.77 -5.65 -4.70 3.17 5.03 0.48 -4.81 115.26 107.01 1wg6 n ASN 77 Ca 0.04 0.22 -0.42 0.00 0.87 0.00 0.00 54.58 55.30 1wg6 n ASN 77 Cb 0.17 -3.95 -0.03 0.00 -1.02 0.00 0.00 39.78 34.95 1wg6 n ASN 77 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1wg6 s ASP 78 N -2.36 7.22 0.02 6.41 1.01 -1.22 -4.61 116.67 123.14 1wg6 s ASP 78 Ca 0.00 1.49 -0.30 0.00 0.71 0.00 0.00 52.55 54.45 1wg6 s ASP 78 Cb 0.00 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.36 1wg6 s ASP 78 CO 0.00 -0.34 0.98 -1.58 0.21 0.00 0.00 175.17 174.45 1wg6 s GLN 79 N 1.54 4.58 -0.75 8.23 0.74 -1.26 -1.58 119.66 131.16 1wg6 s GLN 79 Ca 0.47 1.44 -0.22 0.00 0.05 0.00 0.00 55.36 57.09 1wg6 s GLN 79 Cb -0.19 -3.44 0.08 0.00 1.10 0.00 0.00 33.01 30.56 1wg6 s GLN 79 CO 0.21 -0.00 1.06 -0.51 -0.55 0.00 0.00 175.29 175.49 1wg6 s LEU 80 N 0.81 4.37 0.00 3.68 1.02 -0.88 -3.49 118.68 124.20 1wg6 s LEU 80 Ca 0.51 -1.22 0.26 0.00 0.02 0.00 0.00 54.13 53.70 1wg6 s LEU 80 Cb -0.22 -2.44 1.35 0.00 0.02 0.00 0.00 46.19 44.91 1wg6 s LEU 80 CO 0.28 -1.39 1.89 2.30 0.02 0.00 0.00 176.35 179.45 1wg6 n ILE 81 N 5.93 0.14 0.00 -0.59 -5.35 -0.73 -4.24 119.36 114.52 1wg6 n ILE 81 Ca 0.06 0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 1wg6 n ILE 81 Cb 0.47 -0.61 0.00 0.00 -1.74 0.00 0.00 39.64 37.76 1wg6 n ILE 81 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wg6 n ALA 82 N -1.25 0.00 -3.62 -1.28 0.00 -1.25 -4.20 120.51 108.92 1wg6 n ALA 82 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.46 1wg6 n ALA 82 Cb 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.57 1wg6 n ALA 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wg6 s VAL 83 N -2.00 -0.00 -1.41 0.00 0.11 0.30 -2.18 120.40 115.22 1wg6 s VAL 83 Ca 0.00 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 58.97 1wg6 s VAL 83 Cb 0.00 -0.96 0.01 0.00 -1.53 0.00 0.00 36.38 33.90 1wg6 s VAL 83 CO 0.00 0.00 0.33 -0.46 -3.33 0.00 0.00 175.10 171.64 1wg6 n ASN 84 N 3.29 -0.94 -1.80 3.54 0.23 -1.10 0.27 115.26 118.76 1wg6 n ASN 84 Ca -0.16 -1.17 -0.18 0.00 -0.53 0.00 0.00 54.58 52.54 1wg6 n ASN 84 Cb 0.56 -2.25 -0.06 0.00 -2.08 0.00 0.00 39.78 35.96 1wg6 n ASN 84 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1wg6 n GLY 85 N -2.22 1.04 3.52 4.83 0.00 -1.26 -4.95 105.19 106.16 1wg6 n GLY 85 Ca -0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 1wg6 n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wg6 s GLU 86 N -3.99 2.24 0.36 1.61 2.12 0.78 -5.12 118.70 116.69 1wg6 s GLU 86 Ca 0.00 -0.90 -0.18 0.00 0.36 0.00 0.00 54.97 54.25 1wg6 s GLU 86 Cb 0.00 -2.31 -0.10 0.00 0.26 0.00 0.00 34.13 31.98 1wg6 s GLU 86 CO 0.00 0.56 0.82 -0.08 -0.54 0.00 0.00 175.26 176.02 1wg6 s THR 87 N -0.99 4.56 0.00 -1.70 -1.32 -1.26 0.11 115.64 115.03 1wg6 s THR 87 Ca 0.16 1.18 0.00 0.00 -1.21 0.00 0.00 61.69 61.82 1wg6 s THR 87 Cb -0.11 -3.62 0.00 0.00 -1.51 0.00 0.00 72.50 67.26 1wg6 s THR 87 CO 0.07 -0.22 0.00 0.18 -2.21 0.00 0.00 174.62 172.44 1wg6 n LEU 88 N -0.43 0.19 -0.30 9.08 4.77 -1.26 -4.74 117.00 124.30 1wg6 n LEU 88 Ca 0.05 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.21 1wg6 n LEU 88 Cb 0.53 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 42.08 1wg6 n LEU 88 CO 0.40 -0.13 1.21 -0.07 -1.33 0.00 0.00 177.39 177.47 1wg6 h LEU 89 N 0.00 0.53 -2.06 2.23 3.38 -1.79 0.83 115.31 118.43 1wg6 h LEU 89 Ca 0.00 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.08 1wg6 h LEU 89 Cb 0.64 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1wg6 h LEU 89 CO 0.00 0.17 0.10 1.23 0.09 0.00 0.00 178.44 180.03 1wg6 h GLY 90 N 0.51 0.00 0.00 0.83 0.00 -1.93 -3.42 103.07 99.05 1wg6 h GLY 90 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.88 1wg6 h GLY 90 CO -0.28 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.54 1wg6 n LYS 91 N -4.38 1.49 -3.60 4.80 5.02 0.29 -5.10 118.16 116.69 1wg6 n LYS 91 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 1wg6 n LYS 91 Cb 0.22 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.24 1wg6 n LYS 91 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1wg6 n SER 92 N -2.22 2.58 -0.12 4.39 3.41 -1.26 -4.81 113.62 115.59 1wg6 n SER 92 Ca 0.00 -2.73 -0.04 0.00 -0.26 0.00 0.00 58.87 55.83 1wg6 n SER 92 Cb 0.00 -0.07 0.03 0.00 -0.26 0.00 0.00 64.21 63.91 1wg6 n SER 92 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1wg6 h ASN 93 N 0.56 -0.06 0.00 4.04 2.35 -1.92 0.57 115.58 121.13 1wg6 h ASN 93 Ca -0.32 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1wg6 h ASN 93 Cb 1.18 0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.67 1wg6 h ASN 93 CO 0.50 0.01 0.00 1.57 -1.65 0.00 0.00 177.43 177.85 1wg6 n HIS 94 N -5.14 0.00 -0.29 1.19 -0.00 -1.26 -1.61 115.22 108.11 1wg6 n HIS 94 Ca 0.03 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.13 1wg6 n HIS 94 Cb 0.20 -0.27 -0.07 0.00 -0.12 0.00 0.00 29.99 29.73 1wg6 n HIS 94 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1wg6 n GLU 95 N -1.31 -0.30 -0.04 1.57 1.02 -1.21 -0.23 120.64 120.14 1wg6 n GLU 95 Ca 0.00 1.34 -0.01 0.00 -0.02 0.00 0.00 57.16 58.47 1wg6 n GLU 95 Cb 0.00 -1.98 -0.01 0.00 -0.02 0.00 0.00 31.44 29.43 1wg6 n GLU 95 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wg6 n ALA 96 N -3.18 -0.07 -0.38 0.62 0.00 0.20 0.18 120.51 117.89 1wg6 n ALA 96 Ca 0.01 0.09 0.32 0.00 0.00 0.00 0.00 53.44 53.86 1wg6 n ALA 96 Cb 0.18 0.40 0.64 0.00 0.00 0.00 0.00 19.45 20.67 1wg6 n ALA 96 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1wg6 h MET 97 N 0.00 0.17 -0.14 0.00 2.86 -0.23 1.52 114.93 119.11 1wg6 h MET 97 Ca 0.02 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1wg6 h MET 97 Cb 0.04 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1wg6 h MET 97 CO -0.10 0.11 -0.16 1.05 1.06 0.00 0.00 176.91 178.88 1wg6 h GLU 98 N 0.18 0.23 -0.03 1.72 4.11 0.52 -2.59 114.58 118.72 1wg6 h GLU 98 Ca 0.66 -0.06 -0.09 0.00 0.07 0.00 0.00 59.36 59.95 1wg6 h GLU 98 Cb 2.14 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 31.37 1wg6 h GLU 98 CO -0.22 0.39 -0.34 1.15 0.07 0.00 0.00 179.01 180.06 1wg6 h THR 99 N 0.22 1.47 -0.02 -1.06 2.02 0.43 -2.28 112.91 113.69 1wg6 h THR 99 Ca 0.04 -1.87 0.01 0.00 0.77 0.00 0.00 66.41 65.36 1wg6 h THR 99 Cb 0.41 2.55 -0.01 0.00 -1.74 0.00 0.00 68.15 69.36 1wg6 h THR 99 CO 0.03 0.53 -0.11 0.25 0.37 0.00 0.00 175.52 176.58 1wg6 h LEU 100 N -0.29 -0.36 0.02 2.58 5.85 -1.10 1.20 115.31 123.21 1wg6 h LEU 100 Ca -0.03 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1wg6 h LEU 100 Cb 1.04 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 1wg6 h LEU 100 CO 0.07 -0.10 -0.46 -0.09 -0.34 0.00 0.00 178.44 177.51 1wg6 h ARG 101 N -0.13 -0.57 -1.15 1.25 2.43 -1.60 0.13 114.38 114.74 1wg6 h ARG 101 Ca 0.01 0.04 0.33 0.00 -0.81 0.00 0.00 59.98 59.54 1wg6 h ARG 101 Cb 0.15 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 29.72 1wg6 h ARG 101 CO -0.09 -0.38 0.74 -0.09 -1.51 0.00 0.00 179.97 178.65 1wg6 h ARG 102 N -0.59 0.25 -0.23 0.20 2.43 -1.19 1.52 114.38 116.78 1wg6 h ARG 102 Ca 0.01 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 1wg6 h ARG 102 Cb 0.62 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 1wg6 h ARG 102 CO -0.30 0.17 -0.32 0.77 -1.51 0.00 0.00 179.97 178.78 1wg6 h SER 103 N 0.26 0.48 0.21 -3.80 0.02 0.40 0.22 113.55 111.33 1wg6 h SER 103 Ca 0.67 -0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 61.39 1wg6 h SER 103 Cb 1.93 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 64.33 1wg6 h SER 103 CO -0.32 0.78 -0.23 0.24 -1.14 0.00 0.00 176.83 176.15 1wg6 h MET 104 N 0.40 0.04 0.00 3.45 2.86 0.41 1.52 114.93 123.62 1wg6 h MET 104 Ca 0.05 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1wg6 h MET 104 Cb 0.76 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.41 1wg6 h MET 104 CO 0.06 0.27 -1.02 0.43 1.06 0.00 0.00 176.91 177.72 1wg6 n SER 105 N -4.25 0.65 -0.11 1.22 7.64 -0.82 -2.78 113.62 115.17 1wg6 n SER 105 Ca -0.02 -0.40 -0.21 0.00 1.01 0.00 0.00 58.87 59.25 1wg6 n SER 105 Cb 0.30 0.86 -0.08 0.00 -1.01 0.00 0.00 64.21 64.27 1wg6 n SER 105 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1wg6 n MET 106 N -1.81 0.56 -0.02 1.43 2.81 0.72 -3.80 117.12 117.01 1wg6 n MET 106 Ca 0.02 0.38 -0.16 0.00 -1.81 0.00 0.00 57.70 56.13 1wg6 n MET 106 Cb 0.41 -1.58 -0.09 0.00 -0.71 0.00 0.00 33.22 31.24 1wg6 n MET 106 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1wg6 h GLU 107 N -1.00 0.47 0.00 0.03 4.39 0.19 -2.96 114.58 115.70 1wg6 h GLU 107 Ca -0.41 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 58.88 1wg6 h GLU 107 Cb 1.30 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 30.05 1wg6 h GLU 107 CO -0.25 1.05 0.00 0.41 -1.16 0.00 0.00 179.01 179.06 1wg6 n GLY 108 N 0.81 -0.78 0.06 -3.84 0.00 -1.12 0.28 105.19 100.60 1wg6 n GLY 108 Ca -0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 1wg6 n GLY 108 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1wg6 h ASN 109 N 0.00 0.00 0.05 1.61 -1.24 -1.62 -3.09 115.58 111.29 1wg6 h ASN 109 Ca 0.00 -0.19 -0.38 0.00 0.71 0.00 0.00 56.30 56.44 1wg6 h ASN 109 Cb 0.15 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.15 1wg6 h ASN 109 CO 0.00 0.67 -2.24 2.30 -1.29 0.00 0.00 177.43 176.88 1wg6 n ILE 110 N -4.71 1.60 -0.03 2.57 -0.00 -1.14 -4.51 119.36 113.15 1wg6 n ILE 110 Ca -0.04 -0.55 -0.15 0.00 -0.00 0.00 0.00 62.75 62.01 1wg6 n ILE 110 Cb 0.16 -1.62 -0.12 0.00 -0.00 0.00 0.00 39.64 38.06 1wg6 n ILE 110 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.55 176.46 1wg6 h ARG 111 N -0.13 0.11 0.00 6.28 2.43 0.38 -3.48 114.38 119.97 1wg6 h ARG 111 Ca -0.52 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 58.52 1wg6 h ARG 111 Cb 1.88 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.47 1wg6 h ARG 111 CO -0.06 0.90 0.00 0.41 -1.51 0.00 0.00 179.97 179.71 1wg6 n GLY 112 N 1.12 0.75 3.81 2.80 0.00 0.39 -4.88 105.19 109.19 1wg6 n GLY 112 Ca -0.10 -0.19 -0.08 0.00 0.00 0.00 0.00 46.02 45.65 1wg6 n GLY 112 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1wg6 s MET 113 N -0.68 1.94 -0.00 1.61 0.23 -1.24 0.15 119.30 121.31 1wg6 s MET 113 Ca 0.00 -1.20 0.01 0.00 -1.03 0.00 0.00 55.69 53.47 1wg6 s MET 113 Cb 0.00 0.60 -0.00 0.00 -1.53 0.00 0.00 34.83 33.90 1wg6 s MET 113 CO 0.00 -0.89 -0.02 -1.50 -2.03 0.00 0.00 175.02 170.58 1wg6 s ILE 114 N -3.30 0.14 0.13 3.16 2.07 0.21 -2.93 121.20 120.67 1wg6 s ILE 114 Ca 0.14 -0.08 0.01 0.00 -1.41 0.00 0.00 60.65 59.31 1wg6 s ILE 114 Cb -0.05 -0.13 -0.04 0.00 0.13 0.00 0.00 42.46 42.37 1wg6 s ILE 114 CO 0.09 0.04 0.28 -1.58 -1.91 0.00 0.00 174.94 171.85 1wg6 s GLN 115 N -0.05 3.46 -0.07 3.50 0.74 -1.26 -0.86 119.66 125.11 1wg6 s GLN 115 Ca 0.01 -0.49 -0.02 0.00 0.05 0.00 0.00 55.36 54.90 1wg6 s GLN 115 Cb -0.01 -2.97 0.03 0.00 1.10 0.00 0.00 33.01 31.17 1wg6 s GLN 115 CO -0.00 0.53 0.03 -0.51 -0.55 0.00 0.00 175.29 174.80 1wg6 s LEU 116 N -2.98 0.43 -0.24 3.68 1.43 -0.31 -2.72 118.68 117.96 1wg6 s LEU 116 Ca 0.35 -0.11 -0.10 0.00 -1.03 0.00 0.00 54.13 53.25 1wg6 s LEU 116 Cb -0.12 -0.31 -0.05 0.00 0.03 0.00 0.00 46.19 45.74 1wg6 s LEU 116 CO 0.28 -0.24 0.14 -0.69 0.23 0.00 0.00 176.35 176.08 1wg6 s VAL 117 N 2.06 5.16 0.15 -1.59 1.01 -0.93 -1.96 120.40 124.29 1wg6 s VAL 117 Ca 0.04 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.24 1wg6 s VAL 117 Cb -0.13 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1wg6 s VAL 117 CO -0.05 0.34 -0.21 0.27 0.00 0.00 0.00 175.10 175.44 1wg6 s ILE 118 N 1.20 2.57 -0.14 2.22 -5.25 -1.00 -1.78 121.20 119.04 1wg6 s ILE 118 Ca 0.07 -1.73 -0.01 0.00 -0.99 0.00 0.00 60.65 57.99 1wg6 s ILE 118 Cb -0.14 -2.19 0.04 0.00 2.95 0.00 0.00 42.46 43.11 1wg6 s ILE 118 CO 0.05 0.02 -0.03 -0.22 -1.79 0.00 0.00 174.94 172.98 1wg6 s LEU 119 N -2.31 1.23 -0.09 0.37 1.98 -1.23 -2.02 118.68 116.61 1wg6 s LEU 119 Ca 0.18 -0.49 0.02 0.00 -2.89 0.00 0.00 54.13 50.95 1wg6 s LEU 119 Cb -0.10 -0.74 -0.02 0.00 0.66 0.00 0.00 46.19 45.99 1wg6 s LEU 119 CO 0.09 -0.19 -0.15 -0.60 -1.89 0.00 0.00 176.35 173.61 1wg6 s ARG 120 N 1.76 2.99 0.98 1.98 3.52 0.14 -4.63 118.95 125.69 1wg6 s ARG 120 Ca 0.02 -0.71 -0.11 0.00 -0.13 0.00 0.00 55.73 54.80 1wg6 s ARG 120 Cb -0.14 -2.49 0.18 0.00 -1.56 0.00 0.00 34.95 30.93 1wg6 s ARG 120 CO -0.07 0.38 1.11 1.03 -0.81 0.00 0.00 175.30 176.94 1wg6 s ARG 121 N -0.09 0.55 0.13 5.12 0.52 -1.26 -1.63 118.95 122.30 1wg6 s ARG 121 Ca -0.02 1.33 -0.26 0.00 -0.52 0.00 0.00 55.73 56.25 1wg6 s ARG 121 Cb -0.14 -1.69 -0.03 0.00 0.52 0.00 0.00 34.95 33.62 1wg6 s ARG 121 CO 0.04 -2.88 1.62 0.66 0.02 0.00 0.00 175.30 174.75 1wg6 h SER 122 N -2.04 -0.94 0.00 0.23 4.64 -1.95 -3.44 113.55 110.05 1wg6 h SER 122 Ca -0.48 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1wg6 h SER 122 Cb 1.28 0.40 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 1wg6 h SER 122 CO 0.45 -0.35 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 1wg6 n GLY 123 N -1.40 5.47 0.11 -0.77 0.00 -1.26 -5.03 105.19 102.30 1wg6 n GLY 123 Ca -0.03 -1.19 -0.03 0.00 0.00 0.00 0.00 46.02 44.77 1wg6 n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wg6 h PRO 124 N 0.00 0.00 -5.80 1.61 0.13 -2.03 -3.49 132.00 122.42 1wg6 h PRO 124 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1wg6 h PRO 124 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 1wg6 h PRO 124 CO 0.00 0.74 -0.76 0.43 -0.23 0.00 0.00 178.00 178.18 1wg6 n SER 125 N -3.63 -5.73 -3.15 1.44 7.64 -1.26 -5.02 113.62 103.91 1wg6 n SER 125 Ca -0.01 0.99 0.04 0.00 1.01 0.00 0.00 58.87 60.91 1wg6 n SER 125 Cb 0.72 -2.96 -0.00 0.00 -1.01 0.00 0.00 64.21 60.96 1wg6 n SER 125 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wg6 s SER 126 N -0.62 -1.20 0.00 6.43 0.01 -1.26 -5.19 113.70 111.86 1wg6 s SER 126 Ca -0.07 0.24 0.26 0.00 1.31 0.00 0.00 55.95 57.68 1wg6 s SER 126 Cb 0.00 1.80 1.54 0.00 0.21 0.00 0.00 66.02 69.58 1wg6 s SER 126 CO 0.30 -0.22 1.90 0.61 0.41 0.00 0.00 173.24 176.24