#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wg6 s SER 2 N 0.00 -0.10 -0.30 1.61 0.01 -1.26 -5.17 113.70 108.50 1wg6 s SER 2 Ca 0.00 0.18 -0.16 0.00 1.31 0.00 0.00 55.95 57.28 1wg6 s SER 2 Cb 0.00 0.18 0.17 0.00 0.21 0.00 0.00 66.02 66.58 1wg6 s SER 2 CO 0.00 -0.04 1.08 -0.94 0.41 0.00 0.00 173.24 173.75 1wg6 s SER 3 N -0.05 -0.38 0.00 2.44 1.04 -1.26 -5.18 113.70 110.32 1wg6 s SER 3 Ca 0.07 0.57 0.00 0.00 0.48 0.00 0.00 55.95 57.07 1wg6 s SER 3 Cb -0.05 1.26 0.00 0.00 0.10 0.00 0.00 66.02 67.34 1wg6 s SER 3 CO -0.14 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.60 1wg6 n GLY 4 N 3.97 1.41 3.23 7.32 0.00 -1.26 -5.14 105.19 114.71 1wg6 n GLY 4 Ca -0.15 -1.78 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 1wg6 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wg6 s SER 5 N -1.00 -0.05 -0.30 1.61 0.15 -1.26 -5.16 113.70 107.70 1wg6 s SER 5 Ca 0.00 -0.35 -0.11 0.00 0.70 0.00 0.00 55.95 56.19 1wg6 s SER 5 Cb 0.00 0.35 0.13 0.00 -1.71 0.00 0.00 66.02 64.80 1wg6 s SER 5 CO 0.00 -0.66 0.70 -0.44 1.20 0.00 0.00 173.24 174.04 1wg6 s SER 6 N -2.35 -1.06 -0.07 5.45 0.01 -1.26 -5.16 113.70 109.26 1wg6 s SER 6 Ca -0.02 1.47 0.04 0.00 1.31 0.00 0.00 55.95 58.75 1wg6 s SER 6 Cb 0.01 2.19 0.00 0.00 0.21 0.00 0.00 66.02 68.43 1wg6 s SER 6 CO -0.06 -0.21 -0.19 -0.83 0.41 0.00 0.00 173.24 172.36 1wg6 s GLY 7 N 2.80 1.08 -0.33 3.44 0.00 -1.26 -5.05 107.32 108.00 1wg6 s GLY 7 Ca -0.06 -0.75 -0.08 0.00 0.00 0.00 0.00 44.72 43.83 1wg6 s GLY 7 CO -0.19 -0.23 1.07 -2.27 0.00 0.00 0.00 173.10 171.48 1wg6 s LEU 8 N 0.32 -0.31 0.34 0.66 0.20 -1.26 -5.17 118.68 113.46 1wg6 s LEU 8 Ca -0.13 -0.25 0.04 0.00 0.69 0.00 0.00 54.13 54.48 1wg6 s LEU 8 Cb -0.16 0.40 -0.03 0.00 -0.43 0.00 0.00 46.19 45.97 1wg6 s LEU 8 CO 0.05 -0.02 0.17 -0.75 -0.29 0.00 0.00 176.35 175.51 1wg6 s LYS 9 N 1.50 1.72 0.00 1.98 2.20 -1.26 -5.13 119.74 120.75 1wg6 s LYS 9 Ca 0.19 -2.01 0.00 0.00 -0.36 0.00 0.00 55.97 53.79 1wg6 s LYS 9 Cb 0.08 -0.17 0.00 0.00 -1.51 0.00 0.00 37.83 36.22 1wg6 s LYS 9 CO -0.13 -0.49 0.00 0.41 -0.36 0.00 0.00 175.35 174.78 1wg6 n GLY 10 N -0.68 0.67 3.66 5.54 0.00 -1.26 -5.08 105.19 108.04 1wg6 n GLY 10 Ca 0.00 -1.99 -0.31 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.01 2.55 -0.07 1.61 2.02 -1.26 -5.05 118.70 117.49 1wg6 s GLU 11 Ca 0.00 -0.80 -0.18 0.00 0.02 0.00 0.00 54.97 54.01 1wg6 s GLU 11 Cb 0.00 -2.54 -0.14 0.00 0.10 0.00 0.00 34.13 31.55 1wg6 s GLU 11 CO 0.00 0.56 0.70 -1.00 0.02 0.00 0.00 175.26 175.54 1wg6 h PRO 12 N 3.78 -0.17 -5.64 0.39 0.13 -2.05 -3.49 132.00 124.95 1wg6 h PRO 12 Ca -0.48 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1wg6 h PRO 12 Cb 1.17 0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1wg6 h PRO 12 CO 0.58 0.26 -0.95 -3.47 -0.23 0.00 0.00 178.00 174.19 1wg6 n ASP 13 N -4.87 -5.89 -4.44 1.44 -0.08 -1.26 -4.85 116.55 96.61 1wg6 n ASP 13 Ca -0.07 1.05 -0.44 0.00 -1.51 0.00 0.00 54.79 53.82 1wg6 n ASP 13 Cb 0.25 -3.60 -0.05 0.00 2.34 0.00 0.00 41.12 40.07 1wg6 n ASP 13 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wg6 s TYR 15 N 3.24 -0.12 -0.45 0.00 1.13 -1.26 -5.09 117.35 114.80 1wg6 s TYR 15 Ca 0.18 0.09 0.07 0.00 -1.41 0.00 0.00 57.07 56.00 1wg6 s TYR 15 Cb -0.19 0.51 0.23 0.00 -1.10 0.00 0.00 41.96 41.41 1wg6 s TYR 15 CO 0.11 -0.17 0.53 0.00 -2.51 0.00 0.00 175.55 173.51 1wg6 n ALA 16 N 0.02 2.83 -1.21 9.51 0.00 -1.26 -5.10 120.51 125.29 1wg6 n ALA 16 Ca 0.01 -3.64 0.16 0.00 0.00 0.00 0.00 53.44 49.96 1wg6 n ALA 16 Cb 0.58 -0.83 -0.05 0.00 0.00 0.00 0.00 19.45 19.16 1wg6 n ALA 16 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wg6 n LEU 17 N 1.56 -0.63 -4.10 0.00 4.77 -1.26 -4.65 117.00 112.70 1wg6 n LEU 17 Ca 0.24 1.41 -0.35 0.00 -0.03 0.00 0.00 56.01 57.28 1wg6 n LEU 17 Cb 0.49 -3.83 0.06 0.00 -2.33 0.00 0.00 43.42 37.82 1wg6 n LEU 17 CO 0.21 -2.86 -1.06 -0.24 -1.33 0.00 0.00 177.39 172.11 1wg6 n SER 18 N -4.32 -5.05 -4.71 -1.43 2.88 -1.26 -4.58 113.62 95.15 1wg6 n SER 18 Ca -0.01 0.21 -0.64 0.00 -1.33 0.00 0.00 58.87 57.10 1wg6 n SER 18 Cb 0.64 -0.86 -0.09 0.00 -0.75 0.00 0.00 64.21 63.15 1wg6 n SER 18 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1wg6 n LEU 19 N 2.34 1.46 -4.96 2.46 4.77 -1.26 -4.91 117.00 116.90 1wg6 n LEU 19 Ca 0.00 1.15 -0.23 0.00 -0.03 0.00 0.00 56.01 56.91 1wg6 n LEU 19 Cb 0.56 -0.97 0.02 0.00 -2.33 0.00 0.00 43.42 40.70 1wg6 n LEU 19 CO 0.52 -0.82 0.32 -1.61 -1.33 0.00 0.00 177.39 174.48 1wg6 s GLU 20 N 2.84 2.91 -0.02 3.23 2.02 -1.26 -5.11 118.70 123.30 1wg6 s GLU 20 Ca 1.01 -0.54 -0.01 0.00 0.02 0.00 0.00 54.97 55.46 1wg6 s GLU 20 Cb -1.34 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 30.38 1wg6 s GLU 20 CO 0.74 -0.43 0.03 -1.54 0.02 0.00 0.00 175.26 174.09 1wg6 s SER 21 N -4.28 -0.00 0.51 -0.19 1.04 -1.26 -5.16 113.70 104.36 1wg6 s SER 21 Ca 0.51 0.06 0.03 0.00 0.48 0.00 0.00 55.95 57.04 1wg6 s SER 21 Cb -0.10 0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.07 1wg6 s SER 21 CO 0.38 -0.06 0.72 -0.44 0.98 0.00 0.00 173.24 174.83 1wg6 s SER 22 N 0.43 5.38 0.15 7.02 0.01 -1.26 -4.69 113.70 120.74 1wg6 s SER 22 Ca -0.03 -0.13 0.04 0.00 1.31 0.00 0.00 55.95 57.13 1wg6 s SER 22 Cb -0.05 -0.81 -0.04 0.00 0.21 0.00 0.00 66.02 65.33 1wg6 s SER 22 CO -0.01 -1.03 0.20 -1.61 0.41 0.00 0.00 173.24 171.19 1wg6 s GLU 23 N -4.65 3.15 0.01 12.44 2.02 -0.48 -4.95 118.70 126.25 1wg6 s GLU 23 Ca 0.57 -0.72 0.02 0.00 0.02 0.00 0.00 54.97 54.85 1wg6 s GLU 23 Cb -0.10 -2.81 -0.01 0.00 0.10 0.00 0.00 34.13 31.31 1wg6 s GLU 23 CO 0.37 0.51 -0.06 -1.14 0.02 0.00 0.00 175.26 174.96 1wg6 s GLN 24 N -3.09 0.46 -0.12 1.61 -0.44 -1.26 0.04 119.66 116.86 1wg6 s GLN 24 Ca 0.33 -0.32 0.02 0.00 -2.50 0.00 0.00 55.36 52.88 1wg6 s GLN 24 Cb -0.11 -0.39 0.01 0.00 -1.64 0.00 0.00 33.01 30.89 1wg6 s GLN 24 CO 0.26 0.10 -0.18 -0.51 0.50 0.00 0.00 175.29 175.46 1wg6 s LEU 25 N -0.47 1.85 -0.45 3.68 1.43 -1.03 -4.99 118.68 118.70 1wg6 s LEU 25 Ca -0.01 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 52.50 1wg6 s LEU 25 Cb -0.04 -1.20 0.08 0.00 0.03 0.00 0.00 46.19 45.06 1wg6 s LEU 25 CO -0.00 0.04 0.32 -0.89 0.23 0.00 0.00 176.35 176.05 1wg6 s THR 26 N 0.90 4.59 -0.25 5.49 2.01 -1.26 -2.75 115.64 124.37 1wg6 s THR 26 Ca -0.08 -1.34 -0.08 0.00 0.31 0.00 0.00 61.69 60.51 1wg6 s THR 26 Cb -0.15 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 1wg6 s THR 26 CO -0.01 -0.58 0.08 -0.76 -0.69 0.00 0.00 174.62 172.67 1wg6 s LEU 27 N 1.49 3.52 0.09 4.42 2.01 -0.92 -4.95 118.68 124.35 1wg6 s LEU 27 Ca 0.04 -0.16 -0.11 0.00 0.01 0.00 0.00 54.13 53.90 1wg6 s LEU 27 Cb -0.24 -1.95 -0.06 0.00 0.01 0.00 0.00 46.19 43.95 1wg6 s LEU 27 CO 0.03 -0.02 0.44 -1.61 1.01 0.00 0.00 176.35 176.20 1wg6 s GLU 28 N 1.53 3.82 -0.06 1.70 8.01 -1.26 -1.35 118.70 131.08 1wg6 s GLU 28 Ca 0.06 0.26 -0.02 0.00 0.01 0.00 0.00 54.97 55.28 1wg6 s GLU 28 Cb -0.15 -2.99 0.03 0.00 -4.31 0.00 0.00 34.13 26.71 1wg6 s GLU 28 CO 0.04 0.54 0.03 0.42 0.01 0.00 0.00 175.26 176.30 1wg6 s ILE 29 N -1.41 0.16 0.43 -1.63 1.01 0.17 -4.95 121.20 114.98 1wg6 s ILE 29 Ca 0.34 0.26 -0.23 0.00 0.00 0.00 0.00 60.65 61.02 1wg6 s ILE 29 Cb -0.14 -0.36 -0.09 0.00 0.01 0.00 0.00 42.46 41.88 1wg6 s ILE 29 CO 0.18 0.22 1.05 -2.16 0.00 0.00 0.00 174.94 174.23 1wg6 s PRO 30 N 2.02 4.03 -0.39 2.79 0.04 -1.26 0.81 135.00 143.04 1wg6 s PRO 30 Ca 0.04 1.47 0.11 0.00 0.04 0.00 0.00 61.00 62.66 1wg6 s PRO 30 Cb -0.12 -2.38 0.44 0.00 0.04 0.00 0.00 34.50 32.47 1wg6 s PRO 30 CO -0.04 -0.25 1.04 1.28 0.04 0.00 0.00 177.00 179.07 1wg6 n LEU 31 N -0.39 3.33 -0.04 -3.56 4.77 0.18 -4.74 117.00 116.54 1wg6 n LEU 31 Ca 0.07 -4.57 -0.01 0.00 -0.03 0.00 0.00 56.01 51.47 1wg6 n LEU 31 Cb 0.51 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1wg6 n LEU 31 CO 0.43 1.95 -0.06 0.78 -1.33 0.00 0.00 177.39 179.16 1wg6 h ASN 32 N 2.75 0.00 0.27 -1.43 2.35 -1.92 -2.59 115.58 115.02 1wg6 h ASN 32 Ca 0.13 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.54 1wg6 h ASN 32 Cb 1.04 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.40 1wg6 h ASN 32 CO 0.70 0.43 -1.77 -0.78 -1.65 0.00 0.00 177.43 174.36 1wg6 h ASP 33 N -0.77 0.43 0.83 5.81 3.58 -1.93 -3.34 116.42 121.03 1wg6 h ASP 33 Ca 0.00 -0.73 -0.14 0.00 0.42 0.00 0.00 57.03 56.58 1wg6 h ASP 33 Cb 0.09 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1wg6 h ASP 33 CO 0.00 1.63 -0.66 0.28 -2.88 0.00 0.00 179.24 177.61 1wg6 h SER 34 N 0.07 0.00 -0.99 2.28 0.02 -1.85 -3.21 113.55 109.87 1wg6 h SER 34 Ca -0.34 0.00 0.34 0.00 -0.84 0.00 0.00 61.79 60.96 1wg6 h SER 34 Cb 2.05 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 64.43 1wg6 h SER 34 CO 0.13 0.66 0.52 1.23 -1.14 0.00 0.00 176.83 178.24 1wg6 h GLY 35 N 2.32 2.06 -0.94 -3.77 0.00 -1.57 1.40 103.07 102.57 1wg6 h GLY 35 Ca -0.01 -0.19 0.10 0.00 0.00 0.00 0.00 47.33 47.24 1wg6 h GLY 35 CO 0.09 -0.57 -0.50 -1.26 0.00 0.00 0.00 176.54 174.29 1wg6 n SER 36 N -5.13 -0.89 -0.03 0.19 2.88 -1.21 -2.09 113.62 107.33 1wg6 n SER 36 Ca 0.33 1.66 -0.19 0.00 -1.33 0.00 0.00 58.87 59.34 1wg6 n SER 36 Cb 1.04 -0.26 -0.14 0.00 -0.75 0.00 0.00 64.21 64.11 1wg6 n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wg6 n ALA 37 N -3.35 1.11 0.00 -1.46 0.00 0.04 -5.10 120.51 111.75 1wg6 n ALA 37 Ca 0.04 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.71 1wg6 n ALA 37 Cb 0.28 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.19 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 2.00 0.65 0.02 0.00 0.00 0.46 -4.87 105.19 103.45 1wg6 n GLY 38 Ca -0.34 -2.24 -0.00 0.00 0.00 0.00 0.00 46.02 43.44 1wg6 n GLY 38 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wg6 h LEU 39 N 0.00 -0.08 -0.02 0.99 3.38 -1.89 -3.41 115.31 114.28 1wg6 h LEU 39 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1wg6 h LEU 39 Cb 0.00 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1wg6 h LEU 39 CO 0.00 -0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.13 1wg6 n GLY 40 N -1.01 0.64 3.09 0.83 0.00 -1.26 -3.99 105.19 103.50 1wg6 n GLY 40 Ca 0.00 -0.29 -0.09 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.37 0.15 -0.08 1.61 -7.23 -1.26 -4.20 120.40 108.03 1wg6 s VAL 41 Ca 0.00 -1.26 0.03 0.00 -1.81 0.00 0.00 61.98 58.94 1wg6 s VAL 41 Cb 0.00 -0.99 -0.02 0.00 0.56 0.00 0.00 36.38 35.94 1wg6 s VAL 41 CO 0.00 -0.70 -0.17 -0.55 -0.31 0.00 0.00 175.10 173.38 1wg6 s SER 42 N -2.28 3.77 0.53 4.85 0.15 -1.25 -5.06 113.70 114.41 1wg6 s SER 42 Ca -0.03 -0.32 0.02 0.00 0.70 0.00 0.00 55.95 56.32 1wg6 s SER 42 Cb 0.00 -1.09 0.01 0.00 -1.71 0.00 0.00 66.02 63.23 1wg6 s SER 42 CO -0.06 0.26 0.12 -0.76 1.20 0.00 0.00 173.24 174.01 1wg6 s LEU 43 N -0.24 2.37 -0.00 3.45 1.43 -1.26 -0.03 118.68 124.40 1wg6 s LEU 43 Ca 0.00 -1.56 0.00 0.00 -1.03 0.00 0.00 54.13 51.55 1wg6 s LEU 43 Cb -0.13 -0.85 -0.00 0.00 0.03 0.00 0.00 46.19 45.24 1wg6 s LEU 43 CO 0.03 -0.96 -0.01 -1.59 0.23 0.00 0.00 176.35 174.05 1wg6 s LYS 44 N -4.01 0.10 -0.22 1.70 -2.85 0.43 -4.64 119.74 110.24 1wg6 s LYS 44 Ca 0.12 -0.04 -0.10 0.00 -1.00 0.00 0.00 55.97 54.95 1wg6 s LYS 44 Cb -0.00 -0.09 -0.05 0.00 -2.06 0.00 0.00 37.83 35.63 1wg6 s LYS 44 CO 0.07 0.02 0.13 0.20 0.10 0.00 0.00 175.35 175.88 1wg6 s GLY 45 N -0.03 1.98 -0.09 0.59 0.00 -1.26 -0.64 107.32 107.86 1wg6 s GLY 45 Ca 0.00 -0.81 0.01 0.00 0.00 0.00 0.00 44.72 43.92 1wg6 s GLY 45 CO -0.00 0.27 -0.13 0.21 0.00 0.00 0.00 173.10 173.45 1wg6 s ASN 46 N 0.75 4.09 0.09 1.64 3.84 -1.19 -5.02 114.94 119.14 1wg6 s ASN 46 Ca 0.07 -0.25 0.10 0.00 0.21 0.00 0.00 52.86 52.99 1wg6 s ASN 46 Cb -0.13 -1.28 -0.04 0.00 -0.55 0.00 0.00 41.25 39.26 1wg6 s ASN 46 CO 0.02 0.25 -0.24 -0.75 -2.79 0.00 0.00 177.10 173.59 1wg6 s LYS 47 N -0.16 1.68 -0.07 0.43 2.20 -1.26 -1.98 119.74 120.58 1wg6 s LYS 47 Ca -0.00 -1.20 0.04 0.00 -0.36 0.00 0.00 55.97 54.45 1wg6 s LYS 47 Cb -0.13 -2.00 -0.02 0.00 -1.51 0.00 0.00 37.83 34.17 1wg6 s LYS 47 CO 0.03 0.49 -0.18 -1.12 -0.36 0.00 0.00 175.35 174.20 1wg6 s SER 48 N -1.74 3.63 -0.14 1.43 0.01 -0.47 -4.77 113.70 111.66 1wg6 s SER 48 Ca 0.14 -0.35 -0.05 0.00 1.31 0.00 0.00 55.95 57.00 1wg6 s SER 48 Cb -0.10 -0.98 -0.25 0.00 0.21 0.00 0.00 66.02 64.90 1wg6 s SER 48 CO 0.05 0.27 0.29 -1.14 0.41 0.00 0.00 173.24 173.12 1wg6 n ARG 49 N 2.80 0.74 -0.05 12.44 0.00 -1.26 -2.29 116.66 129.04 1wg6 n ARG 49 Ca -0.17 0.25 -0.05 0.00 -0.00 0.00 0.00 57.85 57.87 1wg6 n ARG 49 Cb 0.52 -1.68 -0.04 0.00 0.00 0.00 0.00 32.46 31.26 1wg6 n ARG 49 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1wg6 h GLU 50 N 0.06 -0.15 0.00 -0.14 5.08 -1.95 -0.35 114.58 117.13 1wg6 h GLU 50 Ca -0.44 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 57.88 1wg6 h GLU 50 Cb 2.02 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 31.29 1wg6 h GLU 50 CO 0.06 -0.10 -0.24 1.79 -1.00 0.00 0.00 179.01 179.52 1wg6 h THR 51 N -0.15 0.66 0.00 1.13 1.35 -2.02 -3.46 112.91 110.42 1wg6 h THR 51 Ca 0.03 -1.10 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1wg6 h THR 51 Cb 0.22 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 1wg6 h THR 51 CO -0.22 0.24 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 1wg6 n GLY 52 N -0.03 0.38 0.00 5.82 0.00 -0.14 -5.03 105.19 106.19 1wg6 n GLY 52 Ca -0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1wg6 n GLY 52 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1wg6 n THR 53 N -3.24 0.00 -4.24 2.61 5.66 -0.97 -4.98 114.28 109.13 1wg6 n THR 53 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 1wg6 n THR 53 Cb 0.12 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 68.77 1wg6 n THR 53 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 1wg6 s ASP 54 N 0.51 4.33 0.19 1.09 -4.77 -1.26 -1.37 116.67 115.39 1wg6 s ASP 54 Ca 0.00 -0.32 -0.12 0.00 -3.30 0.00 0.00 52.55 48.81 1wg6 s ASP 54 Cb 0.00 -1.71 0.20 0.00 -1.09 0.00 0.00 42.92 40.32 1wg6 s ASP 54 CO 0.00 0.07 1.73 -0.07 0.70 0.00 0.00 175.17 177.60 1wg6 h LEU 55 N 7.45 0.10 0.00 2.11 3.38 -1.70 -3.46 115.31 123.19 1wg6 h LEU 55 Ca -0.35 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1wg6 h LEU 55 Cb 1.18 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1wg6 h LEU 55 CO 0.60 0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.81 1wg6 n GLY 56 N -1.28 0.22 3.18 0.83 0.00 -1.18 -5.02 105.19 101.95 1wg6 n GLY 56 Ca 0.06 -1.07 -0.22 0.00 0.00 0.00 0.00 46.02 44.79 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 -4.00 1.32 -0.00 -0.61 -1.09 -1.26 -3.18 121.20 112.37 1wg6 s ILE 57 Ca 0.00 -1.07 0.01 0.00 -2.23 0.00 0.00 60.65 57.36 1wg6 s ILE 57 Cb 0.00 -1.17 -0.00 0.00 -1.58 0.00 0.00 42.46 39.71 1wg6 s ILE 57 CO 0.00 0.08 -0.04 -0.36 -1.23 0.00 0.00 174.94 173.39 1wg6 s PHE 58 N -0.83 0.38 0.50 3.97 0.40 0.19 -0.39 117.98 122.20 1wg6 s PHE 58 Ca 0.04 -0.07 -0.22 0.00 -0.60 0.00 0.00 56.93 56.07 1wg6 s PHE 58 Cb -0.08 -0.25 -0.06 0.00 0.51 0.00 0.00 43.02 43.14 1wg6 s PHE 58 CO 0.01 -0.01 1.25 0.42 0.70 0.00 0.00 175.22 177.60 1wg6 s ILE 59 N -0.10 2.63 -0.22 0.64 1.01 -0.59 0.16 121.20 124.73 1wg6 s ILE 59 Ca 0.02 0.47 -0.16 0.00 0.00 0.00 0.00 60.65 60.98 1wg6 s ILE 59 Cb -0.02 -3.24 -0.11 0.00 0.01 0.00 0.00 42.46 39.11 1wg6 s ILE 59 CO -0.00 -0.01 -0.19 1.17 0.00 0.00 0.00 174.94 175.91 1wg6 n LYS 60 N -0.77 0.55 -3.63 2.79 4.81 0.96 0.18 118.16 123.05 1wg6 n LYS 60 Ca 0.09 0.37 -0.03 0.00 -0.87 0.00 0.00 58.31 57.87 1wg6 n LYS 60 Cb 0.47 -1.57 -0.03 0.00 0.02 0.00 0.00 35.03 33.92 1wg6 n LYS 60 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1wg6 s SER 61 N -6.71 -0.06 -0.03 3.14 0.15 -1.14 -4.56 113.70 104.49 1wg6 s SER 61 Ca -0.30 0.03 -0.14 0.00 0.70 0.00 0.00 55.95 56.24 1wg6 s SER 61 Cb 0.08 0.05 -0.05 0.00 -1.71 0.00 0.00 66.02 64.39 1wg6 s SER 61 CO 0.46 -0.07 0.36 -0.63 1.20 0.00 0.00 173.24 174.56 1wg6 s ILE 62 N -1.64 5.12 -0.04 6.45 1.09 -1.26 -3.74 121.20 127.18 1wg6 s ILE 62 Ca 0.10 0.73 -0.15 0.00 -1.10 0.00 0.00 60.65 60.23 1wg6 s ILE 62 Cb -0.01 -3.67 -0.05 0.00 -1.06 0.00 0.00 42.46 37.67 1wg6 s ILE 62 CO -0.05 0.56 0.40 -0.63 -0.10 0.00 0.00 174.94 175.12 1wg6 s ILE 63 N -0.89 5.10 0.28 2.92 1.09 -1.26 -4.95 121.20 123.50 1wg6 s ILE 63 Ca 0.22 0.81 -0.10 0.00 -1.10 0.00 0.00 60.65 60.48 1wg6 s ILE 63 Cb -0.16 -3.71 -0.07 0.00 -1.06 0.00 0.00 42.46 37.46 1wg6 s ILE 63 CO 0.11 0.51 0.62 -2.28 -0.10 0.00 0.00 174.94 173.80 1wg6 s HIS 64 N -0.59 3.42 0.00 3.97 2.46 -1.26 -2.69 115.29 120.61 1wg6 s HIS 64 Ca 0.23 0.94 0.00 0.00 0.47 0.00 0.00 55.06 56.70 1wg6 s HIS 64 Cb -0.16 -2.32 0.00 0.00 -0.13 0.00 0.00 32.58 29.97 1wg6 s HIS 64 CO 0.11 0.17 0.00 0.41 -2.47 0.00 0.00 174.74 172.97 1wg6 n GLY 65 N -0.44 0.62 0.00 1.59 0.00 -1.26 -4.99 105.19 100.71 1wg6 n GLY 65 Ca 0.01 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.67 5.93 0.10 -0.02 0.00 -1.26 -5.05 105.19 102.22 1wg6 n GLY 66 Ca 0.00 -1.68 -0.19 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.01 -0.79 4.61 0.00 -1.86 -3.32 119.26 118.89 1wg6 h ALA 67 Ca 0.00 -0.72 0.16 0.00 0.00 0.00 0.00 54.91 54.35 1wg6 h ALA 67 Cb 0.00 0.16 -0.11 0.00 0.00 0.00 0.00 17.79 17.84 1wg6 h ALA 67 CO 0.00 0.35 0.30 0.00 0.00 0.00 0.00 179.25 179.90 1wg6 h ALA 68 N 0.01 1.13 -0.82 0.00 0.00 -1.82 0.04 119.26 117.81 1wg6 h ALA 68 Ca -0.14 0.14 0.27 0.00 0.00 0.00 0.00 54.91 55.18 1wg6 h ALA 68 Cb 1.46 0.13 -0.15 0.00 0.00 0.00 0.00 17.79 19.23 1wg6 h ALA 68 CO 0.08 -0.26 0.18 0.34 0.00 0.00 0.00 179.25 179.58 1wg6 n PHE 69 N -5.04 0.68 0.11 0.00 7.35 -1.10 0.20 117.46 119.66 1wg6 n PHE 69 Ca 0.16 0.98 -0.12 0.00 -0.76 0.00 0.00 57.45 57.71 1wg6 n PHE 69 Cb 0.48 -1.21 -0.06 0.00 0.35 0.00 0.00 39.48 39.04 1wg6 n PHE 69 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1wg6 h LYS 70 N 0.00 -0.39 0.00 -4.13 1.57 -1.17 0.16 116.57 112.62 1wg6 h LYS 70 Ca 0.57 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.38 1wg6 h LYS 70 Cb 1.33 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.72 1wg6 h LYS 70 CO -0.72 -0.26 0.00 -3.47 -0.57 0.00 0.00 179.45 174.44 1wg6 n ASP 71 N -5.34 0.49 -0.58 0.86 2.03 0.48 -3.61 116.55 110.88 1wg6 n ASP 71 Ca -0.07 0.58 0.44 0.00 0.52 0.00 0.00 54.79 56.26 1wg6 n ASP 71 Cb 0.25 -0.70 0.69 0.00 -0.72 0.00 0.00 41.12 40.64 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 0.70 -0.83 0.67 0.27 0.00 0.52 0.38 105.19 106.91 1wg6 n GLY 72 Ca 0.04 0.61 0.50 0.00 0.00 0.00 0.00 46.02 47.17 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 -3.78 0.00 -0.49 1.61 1.85 -1.24 -4.34 116.66 110.27 1wg6 n ARG 73 Ca 0.38 1.02 -0.31 0.00 -1.00 0.00 0.00 57.85 57.94 1wg6 n ARG 73 Cb 1.67 -2.36 0.29 0.00 -1.05 0.00 0.00 32.46 31.00 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 -7.57 -1.00 -0.11 2.89 1.43 0.16 -5.04 118.68 109.44 1wg6 s LEU 74 Ca -0.05 0.71 -0.00 0.00 -1.03 0.00 0.00 54.13 53.76 1wg6 s LEU 74 Cb 0.25 -2.13 0.02 0.00 0.03 0.00 0.00 46.19 44.37 1wg6 s LEU 74 CO 0.83 -5.31 -0.08 -0.13 0.23 0.00 0.00 176.35 171.90 1wg6 s ARG 75 N -5.24 1.51 1.02 1.70 1.81 -1.26 -5.01 118.95 113.48 1wg6 s ARG 75 Ca 0.69 -0.25 -0.22 0.00 -1.72 0.00 0.00 55.73 54.23 1wg6 s ARG 75 Cb -0.11 -1.57 -0.12 0.00 -0.45 0.00 0.00 34.95 32.70 1wg6 s ARG 75 CO 0.57 -0.26 -0.96 0.00 -0.68 0.00 0.00 175.30 173.96 1wg6 n MET 76 N 4.93 -0.27 -0.72 3.54 0.00 -1.26 -2.94 117.12 120.39 1wg6 n MET 76 Ca -0.13 -0.07 0.00 0.00 0.00 0.00 0.00 57.70 57.50 1wg6 n MET 76 Cb 0.50 -1.18 0.00 0.00 0.00 0.00 0.00 33.22 32.54 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 2.31 0.00 -4.68 3.17 5.03 0.49 -4.87 115.26 116.71 1wg6 n ASN 77 Ca -0.01 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.02 1wg6 n ASN 77 Cb 0.67 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.40 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 -3.16 6.59 0.12 6.41 1.01 -1.15 -4.48 116.67 122.01 1wg6 s ASP 78 Ca 0.00 2.47 -0.30 0.00 0.71 0.00 0.00 52.55 55.43 1wg6 s ASP 78 Cb 0.00 -2.56 -0.07 0.00 1.01 0.00 0.00 42.92 41.31 1wg6 s ASP 78 CO 0.00 -0.91 1.17 -1.58 0.21 0.00 0.00 175.17 174.06 1wg6 s GLN 79 N 2.98 4.49 -0.22 8.23 0.74 -1.26 -1.55 119.66 133.08 1wg6 s GLN 79 Ca 0.75 1.77 -0.17 0.00 0.05 0.00 0.00 55.36 57.76 1wg6 s GLN 79 Cb -0.39 -3.31 -0.03 0.00 1.10 0.00 0.00 33.01 30.37 1wg6 s GLN 79 CO 0.33 -0.13 0.48 -0.51 -0.55 0.00 0.00 175.29 174.90 1wg6 s LEU 80 N 0.42 4.12 0.00 3.68 1.02 0.48 -3.65 118.68 124.75 1wg6 s LEU 80 Ca 0.55 0.57 0.08 0.00 0.02 0.00 0.00 54.13 55.35 1wg6 s LEU 80 Cb -0.30 -2.63 0.18 0.00 0.02 0.00 0.00 46.19 43.47 1wg6 s LEU 80 CO 0.32 -0.17 1.08 2.30 0.02 0.00 0.00 176.35 179.90 1wg6 n ILE 81 N 4.65 0.76 0.00 -0.59 -5.35 -0.35 -4.39 119.36 114.10 1wg6 n ILE 81 Ca -0.06 -0.88 0.00 0.00 -0.27 0.00 0.00 62.75 61.54 1wg6 n ILE 81 Cb 0.50 0.66 0.00 0.00 -1.74 0.00 0.00 39.64 39.06 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 0.28 0.00 -3.54 -1.28 0.00 -1.25 -4.41 120.51 110.31 1wg6 n ALA 82 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1wg6 n ALA 82 Cb 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 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 -0.79 -1.93 0.00 0.11 -0.17 -3.09 120.40 112.54 1wg6 s VAL 83 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1wg6 s VAL 83 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1wg6 s VAL 83 CO 0.00 0.00 0.00 0.59 -3.33 0.00 0.00 175.10 172.36 1wg6 n ASN 84 N 5.25 -5.78 0.00 3.54 3.02 -0.82 0.26 115.26 120.74 1wg6 n ASN 84 Ca -0.11 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 1wg6 n ASN 84 Cb 0.51 -4.89 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 1wg6 n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wg6 n GLY 85 N -0.81 0.94 3.90 7.41 0.00 -1.26 -4.95 105.19 110.42 1wg6 n GLY 85 Ca -0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 1wg6 n GLY 85 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wg6 s GLU 86 N -0.47 3.20 -0.09 1.61 0.41 0.14 -5.08 118.70 118.43 1wg6 s GLU 86 Ca 0.00 0.29 -0.01 0.00 -0.41 0.00 0.00 54.97 54.83 1wg6 s GLU 86 Cb 0.00 -2.21 -0.03 0.00 -1.78 0.00 0.00 34.13 30.11 1wg6 s GLU 86 CO 0.00 -0.61 -0.01 -0.08 -0.49 0.00 0.00 175.26 174.07 1wg6 s THR 87 N -3.04 4.20 -0.05 3.63 -1.32 -1.26 -0.99 115.64 116.81 1wg6 s THR 87 Ca 0.53 -0.29 0.01 0.00 -1.21 0.00 0.00 61.69 60.73 1wg6 s THR 87 Cb -0.11 -2.76 -0.04 0.00 -1.51 0.00 0.00 72.50 68.09 1wg6 s THR 87 CO 0.48 0.60 -0.04 0.18 -2.21 0.00 0.00 174.62 173.63 1wg6 n LEU 88 N 2.21 2.51 -0.28 9.08 4.77 -1.26 -4.49 117.00 129.54 1wg6 n LEU 88 Ca -0.18 -0.02 0.08 0.00 -0.03 0.00 0.00 56.01 55.85 1wg6 n LEU 88 Cb 0.53 -0.14 0.30 0.00 -2.33 0.00 0.00 43.42 41.79 1wg6 n LEU 88 CO 0.28 0.51 1.23 -0.07 -1.33 0.00 0.00 177.39 178.01 1wg6 h LEU 89 N 0.00 0.79 -1.54 2.23 3.38 -1.83 0.34 115.31 118.68 1wg6 h LEU 89 Ca -0.12 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1wg6 h LEU 89 Cb 1.19 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1wg6 h LEU 89 CO -0.01 0.46 -0.15 1.23 0.09 0.00 0.00 178.44 180.06 1wg6 h GLY 90 N 0.87 0.00 -0.49 0.83 0.00 -1.96 -3.44 103.07 98.88 1wg6 h GLY 90 Ca 0.41 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.59 1wg6 h GLY 90 CO -0.18 0.00 0.01 0.28 0.00 0.00 0.00 176.54 176.65 1wg6 n LYS 91 N -3.43 0.60 -2.93 4.80 5.02 0.12 -5.09 118.16 117.25 1wg6 n LYS 91 Ca -0.01 -0.98 -0.18 0.00 -2.02 0.00 0.00 58.31 55.12 1wg6 n LYS 91 Cb 0.33 -0.16 0.05 0.00 -0.02 0.00 0.00 35.03 35.22 1wg6 n LYS 91 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1wg6 n SER 92 N -2.88 2.02 -0.28 4.39 7.64 -1.26 -4.80 113.62 118.45 1wg6 n SER 92 Ca 0.06 -2.43 -0.01 0.00 1.01 0.00 0.00 58.87 57.50 1wg6 n SER 92 Cb 0.20 -0.30 0.19 0.00 -1.01 0.00 0.00 64.21 63.29 1wg6 n SER 92 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1wg6 h ASN 93 N 0.20 0.98 0.00 6.43 4.21 -1.91 0.95 115.58 126.44 1wg6 h ASN 93 Ca -0.25 -0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.22 1wg6 h ASN 93 Cb 1.11 -0.25 0.00 0.00 -1.12 0.00 0.00 38.32 38.06 1wg6 h ASN 93 CO 0.37 0.72 0.00 0.00 -1.29 0.00 0.00 177.43 177.23 1wg6 n HIS 94 N -4.40 0.00 -0.35 1.19 1.44 -1.26 -3.14 115.22 108.69 1wg6 n HIS 94 Ca 0.10 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.73 1wg6 n HIS 94 Cb 0.03 -0.34 -0.06 0.00 0.12 0.00 0.00 29.99 29.74 1wg6 n HIS 94 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1wg6 n GLU 95 N -1.51 -0.34 0.00 -1.40 1.02 -1.24 -1.12 120.64 116.05 1wg6 n GLU 95 Ca 0.00 1.30 0.00 0.00 -0.02 0.00 0.00 57.16 58.44 1wg6 n GLU 95 Cb 0.00 -1.91 0.00 0.00 -0.02 0.00 0.00 31.44 29.51 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 -3.39 0.00 -0.30 0.62 0.00 0.33 -0.22 120.51 117.54 1wg6 n ALA 96 Ca 0.03 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.52 1wg6 n ALA 96 Cb 0.25 0.44 0.11 0.00 0.00 0.00 0.00 19.45 20.25 1wg6 n ALA 96 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1wg6 n MET 97 N -2.53 -0.08 0.00 0.00 2.81 -0.27 0.11 117.12 117.16 1wg6 n MET 97 Ca 0.00 1.30 -0.09 0.00 -1.81 0.00 0.00 57.70 57.09 1wg6 n MET 97 Cb 0.00 -1.93 -0.03 0.00 -0.71 0.00 0.00 33.22 30.55 1wg6 n MET 97 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1wg6 h GLU 98 N 0.00 -0.26 -0.30 0.03 4.39 0.40 0.25 114.58 119.09 1wg6 h GLU 98 Ca 0.39 0.02 0.09 0.00 0.34 0.00 0.00 59.36 60.20 1wg6 h GLU 98 Cb 0.60 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1wg6 h GLU 98 CO -0.85 -0.17 0.56 1.15 -1.16 0.00 0.00 179.01 178.54 1wg6 h THR 99 N -0.27 0.15 0.00 1.13 2.02 0.34 0.32 112.91 116.60 1wg6 h THR 99 Ca 0.10 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.28 1wg6 h THR 99 Cb 0.41 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1wg6 h THR 99 CO -0.28 0.00 0.00 -0.11 0.37 0.00 0.00 175.52 175.50 1wg6 n LEU 100 N -3.23 0.43 0.27 2.58 7.94 0.86 -1.57 117.00 124.28 1wg6 n LEU 100 Ca 0.05 0.62 0.15 0.00 -1.11 0.00 0.00 56.01 55.72 1wg6 n LEU 100 Cb 0.69 -0.34 0.72 0.00 0.53 0.00 0.00 43.42 45.02 1wg6 n LEU 100 CO 0.19 -0.34 1.13 0.08 -1.11 0.00 0.00 177.39 177.34 1wg6 h ARG 101 N 0.00 0.00 0.14 1.96 0.11 -1.25 -1.80 114.38 113.55 1wg6 h ARG 101 Ca 0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 1wg6 h ARG 101 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1wg6 h ARG 101 CO 0.00 0.00 -0.07 0.00 0.10 0.00 0.00 179.97 180.00 1wg6 h ARG 102 N 0.00 -0.19 -1.02 0.08 2.47 -0.92 -2.96 114.38 111.84 1wg6 h ARG 102 Ca 0.05 0.01 0.29 0.00 -1.26 0.00 0.00 59.98 59.08 1wg6 h ARG 102 Cb 0.94 0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 29.26 1wg6 h ARG 102 CO -0.00 -0.12 0.77 0.77 0.56 0.00 0.00 179.97 181.94 1wg6 h SER 103 N -0.33 0.00 -0.58 7.04 0.02 -0.49 0.92 113.55 120.14 1wg6 h SER 103 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1wg6 h SER 103 Cb 0.15 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1wg6 h SER 103 CO 0.03 0.00 0.37 0.24 -1.14 0.00 0.00 176.83 176.33 1wg6 h MET 104 N 0.00 0.77 0.00 3.45 2.86 -1.34 1.38 114.93 122.05 1wg6 h MET 104 Ca 0.48 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 58.07 1wg6 h MET 104 Cb 2.01 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 33.50 1wg6 h MET 104 CO -0.01 0.52 -1.02 0.43 1.06 0.00 0.00 176.91 177.89 1wg6 n SER 105 N -4.67 0.63 -0.07 1.22 7.64 0.14 -2.40 113.62 116.12 1wg6 n SER 105 Ca 0.04 -0.03 -0.05 0.00 1.01 0.00 0.00 58.87 59.84 1wg6 n SER 105 Cb 0.03 0.70 -0.03 0.00 -1.01 0.00 0.00 64.21 63.91 1wg6 n SER 105 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1wg6 h MET 106 N 0.00 0.00 0.00 1.43 -1.53 0.10 -3.31 114.93 111.62 1wg6 h MET 106 Ca 0.00 0.00 -0.14 0.00 -3.44 0.00 0.00 59.70 56.12 1wg6 h MET 106 Cb 0.80 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.83 1wg6 h MET 106 CO 0.00 0.15 -0.68 0.93 0.14 0.00 0.00 176.91 177.45 1wg6 h GLU 107 N -1.00 0.00 0.00 0.39 4.39 0.17 -2.79 114.58 115.74 1wg6 h GLU 107 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1wg6 h GLU 107 Cb 0.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1wg6 h GLU 107 CO -0.02 0.68 0.00 0.41 -1.16 0.00 0.00 179.01 178.92 1wg6 n GLY 108 N 0.55 -0.79 0.02 -3.84 0.00 -1.01 0.17 105.19 100.29 1wg6 n GLY 108 Ca -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 46.02 45.94 1wg6 n GLY 108 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1wg6 h ASN 109 N 0.00 0.00 0.01 1.61 2.35 -1.58 -3.14 115.58 114.83 1wg6 h ASN 109 Ca 0.00 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.48 1wg6 h ASN 109 Cb 0.15 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.54 1wg6 h ASN 109 CO 0.00 0.21 -1.05 0.16 -1.65 0.00 0.00 177.43 175.10 1wg6 h ILE 110 N -0.29 1.28 0.00 2.81 -2.65 -1.60 -3.39 117.51 113.66 1wg6 h ILE 110 Ca 0.00 -2.25 0.00 0.00 1.03 0.00 0.00 64.86 63.64 1wg6 h ILE 110 Cb 0.13 2.39 0.00 0.00 -2.05 0.00 0.00 36.82 37.29 1wg6 h ILE 110 CO 0.00 0.70 0.00 -1.14 0.03 0.00 0.00 178.15 177.74 1wg6 n ARG 111 N -3.85 0.00 0.00 0.16 3.00 0.45 -5.03 116.66 111.39 1wg6 n ARG 111 Ca -0.11 0.32 0.00 0.00 -0.00 0.00 0.00 57.85 58.06 1wg6 n ARG 111 Cb 0.89 -0.81 0.00 0.00 0.00 0.00 0.00 32.46 32.54 1wg6 n ARG 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wg6 n GLY 112 N 1.88 1.53 3.82 5.14 0.00 0.44 -4.89 105.19 113.11 1wg6 n GLY 112 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.06 1.60 0.07 1.61 0.23 -1.25 0.50 119.30 122.00 1wg6 s MET 113 Ca 0.00 -0.98 0.00 0.00 -1.03 0.00 0.00 55.69 53.69 1wg6 s MET 113 Cb 0.00 0.49 -0.04 0.00 -1.53 0.00 0.00 34.83 33.75 1wg6 s MET 113 CO 0.00 -0.75 -0.05 -1.50 -2.03 0.00 0.00 175.02 170.70 1wg6 s ILE 114 N -2.80 0.43 0.13 3.16 2.07 0.24 -3.90 121.20 120.53 1wg6 s ILE 114 Ca 0.16 -1.70 0.09 0.00 -1.41 0.00 0.00 60.65 57.79 1wg6 s ILE 114 Cb -0.03 -1.37 -0.04 0.00 0.13 0.00 0.00 42.46 41.15 1wg6 s ILE 114 CO 0.06 -0.84 -0.21 -1.58 -1.91 0.00 0.00 174.94 170.47 1wg6 s GLN 115 N -3.41 1.24 -0.07 3.50 0.74 -1.26 0.41 119.66 120.80 1wg6 s GLN 115 Ca 0.05 -1.30 0.03 0.00 0.05 0.00 0.00 55.36 54.19 1wg6 s GLN 115 Cb 0.03 -1.46 0.01 0.00 1.10 0.00 0.00 33.01 32.70 1wg6 s GLN 115 CO -0.06 0.32 -0.15 -0.51 -0.55 0.00 0.00 175.29 174.34 1wg6 s LEU 116 N -2.25 1.76 -0.28 3.68 1.43 -0.46 -1.94 118.68 120.63 1wg6 s LEU 116 Ca 0.12 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1wg6 s LEU 116 Cb -0.08 -0.95 0.04 0.00 0.03 0.00 0.00 46.19 45.23 1wg6 s LEU 116 CO 0.06 0.07 -0.03 -0.69 0.23 0.00 0.00 176.35 175.99 1wg6 s VAL 117 N 0.53 2.94 0.21 -1.59 1.01 -1.18 -2.17 120.40 120.15 1wg6 s VAL 117 Ca -0.14 -1.22 0.08 0.00 0.00 0.00 0.00 61.98 60.70 1wg6 s VAL 117 Cb -0.16 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1wg6 s VAL 117 CO 0.05 0.03 0.01 0.27 0.00 0.00 0.00 175.10 175.46 1wg6 s ILE 118 N 1.29 3.67 -0.09 2.22 -5.25 -1.11 -1.21 121.20 120.72 1wg6 s ILE 118 Ca -0.03 -1.58 0.03 0.00 -0.99 0.00 0.00 60.65 58.08 1wg6 s ILE 118 Cb -0.18 -2.89 0.01 0.00 2.95 0.00 0.00 42.46 42.34 1wg6 s ILE 118 CO -0.03 -0.21 -0.20 -0.22 -1.79 0.00 0.00 174.94 172.50 1wg6 s LEU 119 N -3.23 1.93 -0.25 0.37 1.98 -1.24 -2.47 118.68 115.77 1wg6 s LEU 119 Ca 0.29 -0.48 0.00 0.00 -2.89 0.00 0.00 54.13 51.05 1wg6 s LEU 119 Cb -0.08 -1.22 0.07 0.00 0.66 0.00 0.00 46.19 45.62 1wg6 s LEU 119 CO 0.19 0.11 0.00 -0.60 -1.89 0.00 0.00 176.35 174.16 1wg6 s ARG 120 N 0.51 1.24 1.27 1.98 3.52 0.11 -4.70 118.95 122.88 1wg6 s ARG 120 Ca -0.16 -0.99 -0.16 0.00 -0.13 0.00 0.00 55.73 54.29 1wg6 s ARG 120 Cb -0.17 -2.44 0.32 0.00 -1.56 0.00 0.00 34.95 31.10 1wg6 s ARG 120 CO 0.06 -0.72 0.99 -0.98 -0.81 0.00 0.00 175.30 173.83 1wg6 s ARG 121 N 1.48 -1.77 0.09 5.12 1.70 -1.26 -1.39 118.95 122.92 1wg6 s ARG 121 Ca -0.00 0.58 -0.33 0.00 -0.47 0.00 0.00 55.73 55.50 1wg6 s ARG 121 Cb -0.18 -1.47 -0.15 0.00 -0.57 0.00 0.00 34.95 32.58 1wg6 s ARG 121 CO -0.11 -4.22 1.59 1.03 -1.08 0.00 0.00 175.30 172.51 1wg6 h SER 122 N -2.97 -1.20 -3.84 -2.89 0.87 -1.96 -3.43 113.55 98.13 1wg6 h SER 122 Ca -0.56 0.10 -0.47 0.00 -1.23 0.00 0.00 61.79 59.62 1wg6 h SER 122 Cb 1.34 0.40 -0.31 0.00 -0.44 0.00 0.00 62.40 63.39 1wg6 h SER 122 CO 0.43 -0.58 -0.80 -0.83 -0.53 0.00 0.00 176.83 174.52 1wg6 s GLY 123 N -2.21 0.66 -1.15 5.77 0.00 -1.26 -5.04 107.32 104.08 1wg6 s GLY 123 Ca -0.17 -0.45 -0.13 0.00 0.00 0.00 0.00 44.72 43.96 1wg6 s GLY 123 CO 0.62 -0.17 2.25 -1.55 0.00 0.00 0.00 173.10 174.25 1wg6 n PRO 124 N 3.25 2.43 -2.30 2.90 -0.04 -1.26 -4.92 135.00 135.06 1wg6 n PRO 124 Ca -0.18 -2.01 -0.42 0.00 -0.04 0.00 0.00 63.50 60.85 1wg6 n PRO 124 Cb 0.54 -2.87 -0.03 0.00 -0.04 0.00 0.00 33.50 31.09 1wg6 n PRO 124 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1wg6 s SER 125 N 3.58 6.97 0.24 3.54 0.01 -1.26 -4.53 113.70 122.24 1wg6 s SER 125 Ca 0.53 2.22 0.00 0.00 1.31 0.00 0.00 55.95 60.01 1wg6 s SER 125 Cb 0.14 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.78 1wg6 s SER 125 CO -0.01 -0.51 0.00 -1.20 0.41 0.00 0.00 173.24 171.93 1wg6 n SER 126 N 3.39 0.00 0.00 2.44 7.64 -1.26 -5.23 113.62 120.60 1wg6 n SER 126 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1wg6 n SER 126 Cb 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 1wg6 n SER 126 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64