#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w47 s SER 3 N 0.00 5.26 0.57 0.00 0.01 -1.26 -4.87 113.70 113.41 2w47 s SER 3 Ca 0.00 2.21 -0.20 0.00 1.31 0.00 0.00 55.95 59.26 2w47 s SER 3 Cb 0.00 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 2w47 s SER 3 CO 0.00 -1.54 1.24 -2.65 0.41 0.00 0.00 173.24 170.70 2w47 n PRO 4 N -1.82 1.38 -4.07 12.44 -0.02 -1.26 -4.97 135.00 136.68 2w47 n PRO 4 Ca 0.12 0.52 -0.35 0.00 -2.02 0.00 0.00 63.50 61.77 2w47 n PRO 4 Cb 0.51 -2.44 -0.11 0.00 -0.02 0.00 0.00 33.50 31.43 2w47 n PRO 4 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2w47 s VAL 5 N -1.35 4.40 -0.24 -1.45 1.01 -0.12 -4.94 120.40 117.70 2w47 s VAL 5 Ca 0.74 -0.17 -0.14 0.00 0.00 0.00 0.00 61.98 62.42 2w47 s VAL 5 Cb -0.42 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2w47 s VAL 5 CO 0.47 0.44 0.31 -0.63 0.00 0.00 0.00 175.10 175.70 2w47 s ILE 6 N 0.67 5.24 -0.49 2.22 -1.09 -1.26 -0.89 121.20 125.60 2w47 s ILE 6 Ca 0.02 0.47 -0.16 0.00 -2.23 0.00 0.00 60.65 58.75 2w47 s ILE 6 Cb -0.14 -3.64 0.09 0.00 -1.58 0.00 0.00 42.46 37.19 2w47 s ILE 6 CO 0.02 0.24 0.42 -0.31 -1.23 0.00 0.00 174.94 174.08 2w47 s TYR 7 N 1.59 3.25 0.65 3.97 2.02 0.14 -4.99 117.35 123.98 2w47 s TYR 7 Ca 0.13 -1.04 -0.12 0.00 -0.37 0.00 0.00 57.07 55.67 2w47 s TYR 7 Cb -0.15 -3.35 -0.01 0.00 -0.40 0.00 0.00 41.96 38.04 2w47 s TYR 7 CO 0.08 -0.86 1.05 -0.65 -1.57 0.00 0.00 175.55 173.60 2w47 s GLN 8 N 1.63 3.17 0.25 -0.62 -1.52 -1.26 -1.35 119.66 119.95 2w47 s GLN 8 Ca 0.04 1.00 -0.03 0.00 -1.95 0.00 0.00 55.36 54.42 2w47 s GLN 8 Cb -0.26 -2.02 0.50 0.00 -0.22 0.00 0.00 33.01 31.01 2w47 s GLN 8 CO 0.05 -0.92 1.73 0.00 -0.25 0.00 0.00 175.29 175.90 2w47 h ALA 9 N -0.28 1.13 0.00 6.09 0.00 -1.77 -1.38 119.26 123.05 2w47 h ALA 9 Ca -0.45 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2w47 h ALA 9 Cb 1.21 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2w47 h ALA 9 CO 0.58 -0.22 0.00 1.05 0.00 0.00 0.00 179.25 180.66 2w47 h GLU 10 N 0.45 0.00 -0.02 0.00 4.11 -1.90 -2.17 114.58 115.05 2w47 h GLU 10 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.87 2w47 h GLU 10 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2w47 h GLU 10 CO -0.42 0.00 -0.15 -0.25 0.07 0.00 0.00 179.01 178.26 2w47 n ASP 11 N -2.62 2.22 -4.85 3.06 8.00 -0.52 -4.93 116.55 116.92 2w47 n ASP 11 Ca -0.00 -1.65 -0.31 0.00 0.71 0.00 0.00 54.79 53.53 2w47 n ASP 11 Cb 0.17 0.13 0.01 0.00 -0.02 0.00 0.00 41.12 41.41 2w47 n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w47 s ALA 12 N -2.17 2.97 -0.20 2.24 0.00 -0.82 -4.81 121.76 118.96 2w47 s ALA 12 Ca 0.27 0.06 -0.15 0.00 0.00 0.00 0.00 51.96 52.14 2w47 s ALA 12 Cb 0.20 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.15 2w47 s ALA 12 CO 0.40 -0.72 0.36 0.42 0.00 0.00 0.00 175.76 176.23 2w47 s ILE 13 N -2.95 5.23 0.10 0.00 1.01 0.67 -4.93 121.20 120.33 2w47 s ILE 13 Ca 0.57 0.64 0.09 0.00 0.00 0.00 0.00 60.65 61.95 2w47 s ILE 13 Cb -0.12 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 2w47 s ILE 13 CO 0.47 0.28 -0.23 0.27 0.00 0.00 0.00 174.94 175.73 2w47 s ILE 14 N 1.19 1.88 -0.04 2.92 -4.36 -1.26 -0.32 121.20 121.21 2w47 s ILE 14 Ca 0.18 -1.58 0.00 0.00 -0.26 0.00 0.00 60.65 58.99 2w47 s ILE 14 Cb -0.14 -1.68 0.03 0.00 1.25 0.00 0.00 42.46 41.91 2w47 s ILE 14 CO 0.07 0.01 0.00 -0.47 0.24 0.00 0.00 174.94 174.80 2w47 s TYR 15 N -1.10 0.36 -1.43 1.37 5.04 -0.40 -4.81 117.35 116.39 2w47 s TYR 15 Ca 0.09 -0.01 -0.04 0.00 -2.44 0.00 0.00 57.07 54.67 2w47 s TYR 15 Cb -0.10 -0.47 0.03 0.00 0.35 0.00 0.00 41.96 41.77 2w47 s TYR 15 CO 0.05 -0.16 0.59 0.09 -1.34 0.00 0.00 175.55 174.78 2w47 n ASN 16 N 4.31 -1.35 -3.50 4.32 3.02 -1.26 -1.05 115.26 119.75 2w47 n ASN 16 Ca -0.23 -0.94 -0.12 0.00 -0.03 0.00 0.00 54.58 53.26 2w47 n ASN 16 Cb 0.50 -3.35 -0.03 0.00 -0.61 0.00 0.00 39.78 36.30 2w47 n ASN 16 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w47 s ALA 17 N -3.74 -1.39 0.28 5.41 0.00 -1.26 -0.76 121.76 120.29 2w47 s ALA 17 Ca 0.16 0.38 0.05 0.00 0.00 0.00 0.00 51.96 52.55 2w47 s ALA 17 Cb -0.09 0.75 -0.06 0.00 0.00 0.00 0.00 23.12 23.73 2w47 s ALA 17 CO 0.87 -0.69 -0.00 0.96 0.00 0.00 0.00 175.76 176.89 2w47 s ILE 18 N -3.54 1.30 -0.19 0.00 -4.36 0.12 -4.88 121.20 109.65 2w47 s ILE 18 Ca 0.00 -2.05 -0.11 0.00 -0.26 0.00 0.00 60.65 58.23 2w47 s ILE 18 Cb -0.00 -2.52 -0.05 0.00 1.25 0.00 0.00 42.46 41.14 2w47 s ILE 18 CO -0.11 -0.21 0.19 -0.76 0.24 0.00 0.00 174.94 174.28 2w47 s LEU 19 N -3.41 4.21 0.27 0.37 1.43 -1.26 -0.75 118.68 119.54 2w47 s LEU 19 Ca 0.31 0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 53.71 2w47 s LEU 19 Cb 0.06 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 2w47 s LEU 19 CO 0.12 0.14 0.29 -1.83 0.23 0.00 0.00 176.35 175.30 2w47 s GLU 20 N 0.48 1.54 -0.01 1.70 -1.05 -0.15 -4.95 118.70 116.26 2w47 s GLU 20 Ca 0.11 -1.70 0.02 0.00 -0.15 0.00 0.00 54.97 53.25 2w47 s GLU 20 Cb -0.12 0.35 0.03 0.00 -0.44 0.00 0.00 34.13 33.95 2w47 s GLU 20 CO 0.00 -0.58 0.80 0.25 0.95 0.00 0.00 175.26 176.68 2w47 n THR 21 N -0.44 0.40 0.05 1.83 -2.24 -1.26 -1.71 114.28 110.90 2w47 n THR 21 Ca 0.03 -0.44 -0.11 0.00 -2.27 0.00 0.00 64.05 61.26 2w47 n THR 21 Cb 0.63 0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 69.45 2w47 n THR 21 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2w47 h VAL 22 N 3.14 0.72 -3.50 2.28 2.07 -1.97 -3.42 116.25 115.58 2w47 h VAL 22 Ca 0.00 0.00 -0.61 0.00 0.82 0.00 0.00 66.70 66.91 2w47 h VAL 22 Cb 1.01 0.72 -0.13 0.00 -1.52 0.00 0.00 31.29 31.37 2w47 h VAL 22 CO 0.00 0.00 -0.40 0.20 0.02 0.00 0.00 177.57 177.39 2w47 s ASN 23 N -5.05 6.25 0.79 0.57 -0.87 -1.26 -5.06 114.94 110.31 2w47 s ASN 23 Ca -0.14 0.27 -0.13 0.00 -1.57 0.00 0.00 52.86 51.29 2w47 s ASN 23 Cb 0.08 -2.15 0.08 0.00 -0.02 0.00 0.00 41.25 39.24 2w47 s ASN 23 CO 0.67 0.04 1.20 0.00 -2.57 0.00 0.00 177.10 176.43 2w47 s ALA 24 N 1.02 1.90 0.00 0.60 0.00 -1.26 -4.15 121.76 119.86 2w47 s ALA 24 Ca 0.12 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.88 2w47 s ALA 24 Cb -0.14 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2w47 s ALA 24 CO 0.05 -2.20 0.00 0.41 0.00 0.00 0.00 175.76 174.01 2w47 n GLY 25 N 0.36 0.56 3.70 0.00 0.00 -1.26 -4.47 105.19 104.07 2w47 n GLY 25 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2w47 n GLY 25 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2w47 s TYR 26 N -2.00 2.20 0.32 1.61 -0.85 -1.26 -4.94 117.35 112.43 2w47 s TYR 26 Ca 0.00 1.06 0.10 0.00 -0.52 0.00 0.00 57.07 57.72 2w47 s TYR 26 Cb 0.00 -3.24 -0.06 0.00 0.38 0.00 0.00 41.96 39.05 2w47 s TYR 26 CO 0.00 -2.70 -0.13 0.95 -1.52 0.00 0.00 175.55 172.16 2w47 s THR 27 N -2.98 2.38 0.00 -3.49 -4.23 -1.26 -5.03 115.64 101.03 2w47 s THR 27 Ca 0.65 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 2w47 s THR 27 Cb -0.18 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.13 2w47 s THR 27 CO 0.57 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.98 2w47 n GLY 28 N -0.74 1.02 0.14 3.99 0.00 -1.26 -3.95 105.19 104.39 2w47 n GLY 28 Ca -0.05 -0.64 0.04 0.00 0.00 0.00 0.00 46.02 45.37 2w47 n GLY 28 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2w47 h SER 29 N 8.96 0.00 -1.58 1.61 4.64 -1.97 -3.49 113.55 121.73 2w47 h SER 29 Ca 0.00 0.00 0.22 0.00 -0.47 0.00 0.00 61.79 61.54 2w47 h SER 29 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 2w47 h SER 29 CO 0.00 0.39 0.59 0.00 -0.87 0.00 0.00 176.83 176.93 2w47 s TYR 31 N -2.51 0.99 -0.10 0.00 -0.85 -0.70 -4.55 117.35 109.63 2w47 s TYR 31 Ca 0.20 -1.27 -0.17 0.00 -0.52 0.00 0.00 57.07 55.31 2w47 s TYR 31 Cb -0.01 -0.46 -0.05 0.00 0.38 0.00 0.00 41.96 41.82 2w47 s TYR 31 CO 0.00 -0.64 0.46 0.08 -1.52 0.00 0.00 175.55 173.93 2w47 s VAL 32 N -4.11 5.16 -0.27 -3.49 1.01 0.57 -0.97 120.40 118.30 2w47 s VAL 32 Ca 0.33 0.92 -0.01 0.00 0.00 0.00 0.00 61.98 63.22 2w47 s VAL 32 Cb 0.06 -3.79 0.04 0.00 0.00 0.00 0.00 36.38 32.69 2w47 s VAL 32 CO 0.09 0.37 -0.06 0.21 0.00 0.00 0.00 175.10 175.71 2w47 s ASN 33 N 0.33 4.48 0.47 3.32 2.47 0.07 -1.08 114.94 125.00 2w47 s ASN 33 Ca 0.25 -1.11 -0.23 0.00 0.42 0.00 0.00 52.86 52.19 2w47 s ASN 33 Cb -0.15 -1.65 -0.07 0.00 -1.45 0.00 0.00 41.25 37.93 2w47 s ASN 33 CO 0.11 -0.18 1.24 -0.31 -3.72 0.00 0.00 177.10 174.24 2w47 s TYR 34 N 1.25 2.72 0.50 0.43 1.51 -1.26 -0.70 117.35 121.80 2w47 s TYR 34 Ca -0.03 1.47 -0.22 0.00 -1.01 0.00 0.00 57.07 57.27 2w47 s TYR 34 Cb -0.18 -3.55 -0.07 0.00 -0.11 0.00 0.00 41.96 38.05 2w47 s TYR 34 CO -0.04 -1.97 1.20 0.72 -1.11 0.00 0.00 175.55 174.35 2w47 n HIS 35 N -0.48 1.78 -2.34 2.71 8.25 0.06 -4.80 115.22 120.40 2w47 n HIS 35 Ca 0.07 0.47 -0.43 0.00 -0.26 0.00 0.00 57.72 57.57 2w47 n HIS 35 Cb 0.46 -2.30 0.00 0.00 1.12 0.00 0.00 29.99 29.27 2w47 n HIS 35 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2w47 n ASN 36 N -0.38 4.66 -3.59 0.41 4.13 -1.26 -4.20 115.26 115.03 2w47 n ASN 36 Ca 0.10 -2.93 -0.09 0.00 1.68 0.00 0.00 54.58 53.34 2w47 n ASN 36 Cb 0.43 -1.67 -0.02 0.00 -1.54 0.00 0.00 39.78 36.98 2w47 n ASN 36 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 2w47 s GLU 37 N 3.08 1.36 0.31 3.52 -1.05 -0.98 -4.64 118.70 120.31 2w47 s GLU 37 Ca 0.49 -0.62 -0.29 0.00 -0.15 0.00 0.00 54.97 54.40 2w47 s GLU 37 Cb 0.07 0.55 -0.10 0.00 -0.44 0.00 0.00 34.13 34.21 2w47 s GLU 37 CO 0.01 -0.61 1.36 0.08 0.95 0.00 0.00 175.26 177.05 2w47 s VAL 38 N -3.67 2.62 0.00 1.83 1.01 -1.24 -3.47 120.40 117.48 2w47 s VAL 38 Ca 0.05 0.60 0.00 0.00 0.00 0.00 0.00 61.98 62.63 2w47 s VAL 38 Cb -0.02 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.97 2w47 s VAL 38 CO -0.05 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.79 2w47 n GLY 39 N 1.12 0.47 3.70 4.51 0.00 -0.22 -5.01 105.19 109.77 2w47 n GLY 39 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 2w47 n GLY 39 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2w47 s GLY 40 N -1.56 2.27 0.10 -0.02 0.00 -1.26 -4.65 107.32 102.19 2w47 s GLY 40 Ca 0.00 0.89 -0.13 0.00 0.00 0.00 0.00 44.72 45.49 2w47 s GLY 40 CO 0.00 1.31 0.30 -2.52 0.00 0.00 0.00 173.10 172.19 2w47 s TYR 41 N -2.04 -0.04 0.00 1.90 -0.85 -0.21 -0.64 117.35 115.47 2w47 s TYR 41 Ca 0.74 -0.32 0.08 0.00 -0.52 0.00 0.00 57.07 57.06 2w47 s TYR 41 Cb -0.30 0.11 -0.02 0.00 0.38 0.00 0.00 41.96 42.13 2w47 s TYR 41 CO 0.49 -0.62 -0.25 0.42 -1.52 0.00 0.00 175.55 174.07 2w47 s ILE 42 N -3.75 2.20 -0.01 -3.49 1.01 -0.85 -1.27 121.20 115.03 2w47 s ILE 42 Ca 0.03 -1.18 0.00 0.00 0.00 0.00 0.00 60.65 59.50 2w47 s ILE 42 Cb 0.03 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.71 2w47 s ILE 42 CO -0.11 0.49 0.02 -0.70 0.00 0.00 0.00 174.94 174.64 2w47 s GLU 43 N -0.88 -0.01 0.08 2.79 2.12 0.56 -1.02 118.70 122.34 2w47 s GLU 43 Ca 0.11 0.12 0.09 0.00 0.36 0.00 0.00 54.97 55.65 2w47 s GLU 43 Cb -0.10 -0.17 -0.03 0.00 0.26 0.00 0.00 34.13 34.08 2w47 s GLU 43 CO 0.00 -0.11 -0.24 -1.58 -0.54 0.00 0.00 175.26 172.80 2w47 s TRP 44 N 0.70 2.08 -0.54 5.30 0.51 0.06 -0.24 118.94 126.82 2w47 s TRP 44 Ca -0.06 -0.40 -0.21 0.00 -2.12 0.00 0.00 56.10 53.31 2w47 s TRP 44 Cb -0.08 -1.19 0.05 0.00 -0.81 0.00 0.00 33.47 31.44 2w47 s TRP 44 CO -0.02 0.20 0.77 -0.80 -0.51 0.00 0.00 176.95 176.59 2w47 s ASN 45 N -1.60 6.26 -0.20 2.95 0.01 -1.26 -0.95 114.94 120.14 2w47 s ASN 45 Ca 0.10 -0.73 -0.06 0.00 -0.71 0.00 0.00 52.86 51.46 2w47 s ASN 45 Cb -0.10 -2.35 -0.03 0.00 0.41 0.00 0.00 41.25 39.18 2w47 s ASN 45 CO 0.04 -1.06 0.04 -0.69 -1.51 0.00 0.00 177.10 173.91 2w47 s VAL 46 N 3.22 4.39 0.11 1.60 1.01 0.22 -4.89 120.40 126.06 2w47 s VAL 46 Ca 0.21 -0.17 -0.27 0.00 0.00 0.00 0.00 61.98 61.75 2w47 s VAL 46 Cb -0.17 -2.99 -0.06 0.00 0.00 0.00 0.00 36.38 33.16 2w47 s VAL 46 CO 0.14 0.43 0.85 0.21 0.00 0.00 0.00 175.10 176.73 2w47 s ASN 47 N 0.81 7.39 -0.23 3.32 3.84 -1.26 -0.24 114.94 128.57 2w47 s ASN 47 Ca 0.02 1.66 0.01 0.00 0.21 0.00 0.00 52.86 54.76 2w47 s ASN 47 Cb -0.14 -2.53 0.04 0.00 -0.55 0.00 0.00 41.25 38.07 2w47 s ASN 47 CO 0.02 0.04 -0.13 0.00 -2.79 0.00 0.00 177.10 174.25 2w47 s ALA 48 N -0.38 2.53 0.49 1.71 0.00 0.27 -4.97 121.76 121.41 2w47 s ALA 48 Ca 0.41 -1.48 0.15 0.00 0.00 0.00 0.00 51.96 51.04 2w47 s ALA 48 Cb -0.23 -1.48 1.18 0.00 0.00 0.00 0.00 23.12 22.60 2w47 s ALA 48 CO 0.27 -0.78 2.11 -1.35 0.00 0.00 0.00 175.76 176.01 2w47 h PRO 49 N 7.91 0.14 -3.74 0.00 0.11 -1.90 -0.35 132.00 134.16 2w47 h PRO 49 Ca -0.33 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.65 2w47 h PRO 49 Cb 1.10 -0.03 -0.18 0.00 0.11 0.00 0.00 31.00 31.99 2w47 h PRO 49 CO 0.56 0.09 -0.51 -1.54 -0.21 0.00 0.00 178.00 176.39 2w47 s SER 50 N -6.87 0.14 0.38 -2.05 1.04 -1.26 -4.76 113.70 100.33 2w47 s SER 50 Ca -0.06 -0.47 -0.27 0.00 0.48 0.00 0.00 55.95 55.64 2w47 s SER 50 Cb 0.17 0.23 -0.09 0.00 0.10 0.00 0.00 66.02 66.43 2w47 s SER 50 CO 0.69 -0.49 1.29 -0.44 0.98 0.00 0.00 173.24 175.28 2w47 s SER 51 N -2.00 6.45 0.00 7.02 0.01 -1.26 -4.40 113.70 119.53 2w47 s SER 51 Ca -0.07 2.64 0.00 0.00 1.31 0.00 0.00 55.95 59.83 2w47 s SER 51 Cb -0.02 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.57 2w47 s SER 51 CO -0.03 -0.75 0.00 0.61 0.41 0.00 0.00 173.24 173.48 2w47 n GLY 52 N 0.70 -0.24 3.73 3.44 0.00 -0.64 -4.92 105.19 107.26 2w47 n GLY 52 Ca 0.03 -1.42 -0.38 0.00 0.00 0.00 0.00 46.02 44.25 2w47 n GLY 52 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2w47 s SER 53 N -4.00 6.75 0.01 1.61 0.15 -1.26 -0.62 113.70 116.35 2w47 s SER 53 Ca 0.00 0.89 0.04 0.00 0.70 0.00 0.00 55.95 57.59 2w47 s SER 53 Cb 0.00 -2.31 -0.01 0.00 -1.71 0.00 0.00 66.02 61.99 2w47 s SER 53 CO 0.00 0.01 -0.13 -0.31 1.20 0.00 0.00 173.24 174.01 2w47 s TYR 54 N 0.49 1.15 0.09 3.44 2.02 0.02 -0.72 117.35 123.85 2w47 s TYR 54 Ca 0.28 -0.28 -0.30 0.00 -0.37 0.00 0.00 57.07 56.40 2w47 s TYR 54 Cb -0.16 -0.72 -0.05 0.00 -0.40 0.00 0.00 41.96 40.63 2w47 s TYR 54 CO 0.12 0.00 0.99 0.00 -1.57 0.00 0.00 175.55 175.09 2w47 s ALA 55 N -0.55 3.24 -0.29 3.71 0.00 0.31 -1.03 121.76 127.16 2w47 s ALA 55 Ca 0.03 0.60 0.02 0.00 0.00 0.00 0.00 51.96 52.61 2w47 s ALA 55 Cb -0.06 -3.31 0.07 0.00 0.00 0.00 0.00 23.12 19.82 2w47 s ALA 55 CO 0.00 -0.11 -0.04 -0.51 0.00 0.00 0.00 175.76 175.10 2w47 s LEU 56 N 0.26 3.85 -0.19 0.00 1.43 0.38 -2.26 118.68 122.14 2w47 s LEU 56 Ca 0.49 -1.51 -0.01 0.00 -1.03 0.00 0.00 54.13 52.06 2w47 s LEU 56 Cb -0.24 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.37 2w47 s LEU 56 CO 0.30 -0.25 -0.11 -0.63 0.23 0.00 0.00 176.35 175.88 2w47 s ILE 57 N 1.11 2.83 -0.18 -0.59 1.01 0.08 -1.41 121.20 124.05 2w47 s ILE 57 Ca -0.04 -0.69 -0.16 0.00 0.00 0.00 0.00 60.65 59.76 2w47 s ILE 57 Cb -0.20 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.99 2w47 s ILE 57 CO -0.04 0.48 0.39 -0.36 0.00 0.00 0.00 174.94 175.40 2w47 s PHE 58 N 1.26 3.41 -0.19 3.97 0.08 0.34 -0.13 117.98 126.72 2w47 s PHE 58 Ca 0.03 0.65 -0.19 0.00 0.12 0.00 0.00 56.93 57.54 2w47 s PHE 58 Cb -0.14 -2.49 -0.03 0.00 -0.57 0.00 0.00 43.02 39.79 2w47 s PHE 58 CO -0.06 0.07 0.56 0.50 -0.10 0.00 0.00 175.22 176.19 2w47 s ARG 59 N 1.04 4.22 0.09 0.44 3.52 -0.83 -1.38 118.95 126.05 2w47 s ARG 59 Ca 0.20 0.49 -0.07 0.00 -0.13 0.00 0.00 55.73 56.22 2w47 s ARG 59 Cb -0.14 -3.55 -0.01 0.00 -1.56 0.00 0.00 34.95 29.68 2w47 s ARG 59 CO 0.07 -0.15 0.16 1.52 -0.81 0.00 0.00 175.30 176.10 2w47 s TYR 60 N 1.63 0.27 0.04 5.12 -0.85 0.11 -0.42 117.35 123.25 2w47 s TYR 60 Ca 0.26 -0.71 0.06 0.00 -0.52 0.00 0.00 57.07 56.16 2w47 s TYR 60 Cb -0.16 -0.12 -0.02 0.00 0.38 0.00 0.00 41.96 42.04 2w47 s TYR 60 CO 0.10 -0.54 -0.16 0.00 -1.52 0.00 0.00 175.55 173.43 2w47 s ALA 61 N -3.89 1.35 -0.30 9.51 0.00 0.02 -0.69 121.76 127.76 2w47 s ALA 61 Ca 0.08 -0.90 -0.01 0.00 0.00 0.00 0.00 51.96 51.13 2w47 s ALA 61 Cb 0.05 -0.23 0.13 0.00 0.00 0.00 0.00 23.12 23.07 2w47 s ALA 61 CO -0.09 0.27 0.24 1.21 0.00 0.00 0.00 175.76 177.40 2w47 s ASN 62 N -1.15 2.33 -0.04 0.00 3.84 -1.26 -1.50 114.94 117.15 2w47 s ASN 62 Ca 0.03 -1.14 0.09 0.00 0.21 0.00 0.00 52.86 52.05 2w47 s ASN 62 Cb -0.08 0.16 0.32 0.00 -0.55 0.00 0.00 41.25 41.10 2w47 s ASN 62 CO 0.01 -0.38 1.17 0.61 -2.79 0.00 0.00 177.10 175.72 2w47 n GLY 63 N 5.07 1.17 3.93 1.21 0.00 -1.26 -0.67 105.19 114.63 2w47 n GLY 63 Ca -0.01 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 2w47 n GLY 63 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2w47 s THR 64 N -1.65 3.22 -0.43 2.61 -4.23 -1.26 -4.75 115.64 109.17 2w47 s THR 64 Ca 0.23 -1.20 0.24 0.00 -1.18 0.00 0.00 61.69 59.78 2w47 s THR 64 Cb 0.14 -3.12 0.34 0.00 1.34 0.00 0.00 72.50 71.20 2w47 s THR 64 CO 0.12 -0.07 1.66 0.00 -0.54 0.00 0.00 174.62 175.79 2w47 h THR 65 N 0.96 0.00 -2.96 3.99 1.03 -1.95 -3.39 112.91 110.58 2w47 h THR 65 Ca -0.43 -0.88 -0.62 0.00 -0.01 0.00 0.00 66.41 64.47 2w47 h THR 65 Cb 1.26 1.88 -0.06 0.00 -1.07 0.00 0.00 68.15 70.17 2w47 h THR 65 CO 0.54 0.00 -0.26 0.00 -0.01 0.00 0.00 175.52 175.79 2w47 s ALA 66 N -3.24 3.72 0.30 0.00 0.00 -1.26 -4.49 121.76 116.79 2w47 s ALA 66 Ca 0.07 -0.31 -0.29 0.00 0.00 0.00 0.00 51.96 51.42 2w47 s ALA 66 Cb 0.06 -2.31 -0.13 0.00 0.00 0.00 0.00 23.12 20.74 2w47 s ALA 66 CO 0.65 0.47 1.35 -1.71 0.00 0.00 0.00 175.76 176.52 2w47 n ASN 67 N 1.99 2.82 -3.98 0.00 5.15 -1.26 -4.51 115.26 115.47 2w47 n ASN 67 Ca -0.15 1.18 -0.31 0.00 -0.60 0.00 0.00 54.58 54.70 2w47 n ASN 67 Cb 0.53 -1.47 -0.10 0.00 -0.53 0.00 0.00 39.78 38.21 2w47 n ASN 67 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2w47 s ARG 68 N -1.25 2.78 0.54 1.20 0.52 -0.78 -4.96 118.95 116.99 2w47 s ARG 68 Ca 0.61 -3.32 -0.19 0.00 -0.52 0.00 0.00 55.73 52.30 2w47 s ARG 68 Cb -0.59 -3.63 -0.06 0.00 0.52 0.00 0.00 34.95 31.18 2w47 s ARG 68 CO 0.57 -1.28 1.10 -1.25 0.02 0.00 0.00 175.30 174.46 2w47 s PRO 69 N -1.42 3.45 0.02 3.54 0.04 -1.26 -3.88 135.00 135.50 2w47 s PRO 69 Ca 0.26 1.51 0.03 0.00 0.04 0.00 0.00 61.00 62.84 2w47 s PRO 69 Cb -0.06 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 2w47 s PRO 69 CO -0.15 -0.75 -0.08 -1.64 0.04 0.00 0.00 177.00 174.42 2w47 s MET 70 N -3.35 0.59 -0.18 4.56 -1.94 -0.08 -2.35 119.30 116.56 2w47 s MET 70 Ca 0.71 -0.56 -0.20 0.00 -1.71 0.00 0.00 55.69 53.93 2w47 s MET 70 Cb -0.21 -0.49 -0.03 0.00 2.01 0.00 0.00 34.83 36.11 2w47 s MET 70 CO 0.26 0.12 0.60 0.50 -0.01 0.00 0.00 175.02 176.48 2w47 s ARG 71 N -0.96 4.24 -0.21 2.03 3.52 0.08 -0.46 118.95 127.19 2w47 s ARG 71 Ca -0.03 0.58 -0.07 0.00 -0.13 0.00 0.00 55.73 56.07 2w47 s ARG 71 Cb -0.07 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.74 2w47 s ARG 71 CO 0.00 -0.16 0.07 0.42 -0.81 0.00 0.00 175.30 174.82 2w47 s ILE 72 N 1.63 4.61 0.05 4.11 -1.09 -0.39 -1.29 121.20 128.83 2w47 s ILE 72 Ca 0.28 -0.09 0.09 0.00 -2.23 0.00 0.00 60.65 58.70 2w47 s ILE 72 Cb -0.16 -3.11 -0.03 0.00 -1.58 0.00 0.00 42.46 37.59 2w47 s ILE 72 CO 0.11 0.41 -0.24 0.42 -1.23 0.00 0.00 174.94 174.41 2w47 s THR 73 N 0.84 1.95 -0.21 2.92 -4.23 -0.33 -0.96 115.64 115.61 2w47 s THR 73 Ca 0.04 -1.32 0.02 0.00 -1.18 0.00 0.00 61.69 59.24 2w47 s THR 73 Cb -0.14 -1.68 0.04 0.00 1.34 0.00 0.00 72.50 72.06 2w47 s THR 73 CO 0.02 0.30 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.57 2w47 s VAL 74 N -0.81 1.99 -1.49 2.29 1.01 0.09 -1.54 120.40 121.95 2w47 s VAL 74 Ca 0.10 -1.20 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 2w47 s VAL 74 Cb -0.09 -1.97 0.01 0.00 0.00 0.00 0.00 36.38 34.33 2w47 s VAL 74 CO 0.02 0.25 0.29 0.59 0.00 0.00 0.00 175.10 176.24 2w47 n ASN 75 N 4.57 -5.28 0.00 3.32 5.03 0.84 -1.12 115.26 122.61 2w47 n ASN 75 Ca -0.17 -0.12 0.00 0.00 0.87 0.00 0.00 54.58 55.16 2w47 n ASN 75 Cb 0.46 -4.36 0.00 0.00 -1.02 0.00 0.00 39.78 34.87 2w47 n ASN 75 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2w47 n GLY 76 N -1.18 1.87 3.71 7.41 0.00 -1.26 -5.02 105.19 110.72 2w47 n GLY 76 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 2w47 n GLY 76 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2w47 s ASN 77 N -3.39 7.07 -0.31 1.61 -0.87 -0.28 -4.99 114.94 113.78 2w47 s ASN 77 Ca 0.00 1.30 -0.29 0.00 -1.57 0.00 0.00 52.86 52.30 2w47 s ASN 77 Cb 0.00 -2.45 -0.00 0.00 -0.02 0.00 0.00 41.25 38.78 2w47 s ASN 77 CO 0.00 -0.17 1.39 -0.63 -2.57 0.00 0.00 177.10 175.12 2w47 s ILE 78 N 0.93 4.00 -0.10 0.60 1.01 -1.26 -0.73 121.20 125.65 2w47 s ILE 78 Ca 0.41 1.11 0.19 0.00 0.00 0.00 0.00 60.65 62.35 2w47 s ILE 78 Cb -0.18 -4.09 -0.28 0.00 0.01 0.00 0.00 42.46 37.92 2w47 s ILE 78 CO 0.20 -0.51 0.27 1.33 0.00 0.00 0.00 174.94 176.23 2w47 n VAL 79 N 6.46 0.61 -3.48 2.92 0.24 -0.14 -4.82 118.33 120.12 2w47 n VAL 79 Ca 0.16 -0.63 -0.21 0.00 -2.04 0.00 0.00 64.34 61.62 2w47 n VAL 79 Cb 0.47 -0.21 -0.13 0.00 -1.47 0.00 0.00 33.84 32.50 2w47 n VAL 79 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2w47 s LYS 80 N -2.99 0.22 0.31 7.34 2.47 -1.08 -5.02 119.74 121.00 2w47 s LYS 80 Ca -0.08 -0.12 0.02 0.00 -1.56 0.00 0.00 55.97 54.23 2w47 s LYS 80 Cb 0.10 -1.07 0.59 0.00 -1.46 0.00 0.00 37.83 35.99 2w47 s LYS 80 CO 0.82 -0.87 1.89 -1.35 0.16 0.00 0.00 175.35 176.00 2w47 h PRO 81 N 8.33 0.93 -2.12 4.03 0.11 -1.87 -1.02 132.00 140.38 2w47 h PRO 81 Ca -0.16 -0.06 -0.43 0.00 0.11 0.00 0.00 66.00 65.46 2w47 h PRO 81 Cb 1.09 -0.21 -0.33 0.00 0.11 0.00 0.00 31.00 31.66 2w47 h PRO 81 CO 0.34 0.61 -0.73 0.45 -0.21 0.00 0.00 178.00 178.46 2w47 s SER 82 N -5.90 1.66 -0.12 -2.05 0.15 -1.26 -3.99 113.70 102.19 2w47 s SER 82 Ca -0.11 -1.74 -0.25 0.00 0.70 0.00 0.00 55.95 54.55 2w47 s SER 82 Cb 0.21 0.30 -0.03 0.00 -1.71 0.00 0.00 66.02 64.79 2w47 s SER 82 CO 0.80 -0.27 0.78 -0.32 1.20 0.00 0.00 173.24 175.42 2w47 s MET 83 N 1.34 4.37 0.22 5.44 1.75 0.39 -4.85 119.30 127.96 2w47 s MET 83 Ca 0.17 0.96 -0.30 0.00 -1.25 0.00 0.00 55.69 55.28 2w47 s MET 83 Cb -0.17 -3.51 -0.08 0.00 2.84 0.00 0.00 34.83 33.90 2w47 s MET 83 CO -0.02 -0.14 1.01 -0.51 -0.65 0.00 0.00 175.02 174.71 2w47 s ASP 84 N 1.01 7.46 -0.53 1.11 1.01 -1.26 -0.90 116.67 124.56 2w47 s ASP 84 Ca 0.38 2.04 0.04 0.00 0.71 0.00 0.00 52.55 55.72 2w47 s ASP 84 Cb -0.17 -2.61 0.16 0.00 1.01 0.00 0.00 42.92 41.31 2w47 s ASP 84 CO 0.16 -0.02 0.38 -0.36 0.21 0.00 0.00 175.17 175.54 2w47 s PHE 85 N -0.85 2.23 0.80 4.23 0.08 -1.25 -4.94 117.98 118.28 2w47 s PHE 85 Ca 0.44 -2.74 -0.11 0.00 0.12 0.00 0.00 56.93 54.64 2w47 s PHE 85 Cb -0.28 -1.81 0.07 0.00 -0.57 0.00 0.00 43.02 40.43 2w47 s PHE 85 CO 0.35 -0.71 1.09 0.14 -0.10 0.00 0.00 175.22 175.99 2w47 s VAL 86 N -0.47 3.12 0.24 -0.44 -7.23 -1.26 -1.86 120.40 112.51 2w47 s VAL 86 Ca 0.27 0.36 -0.30 0.00 -1.81 0.00 0.00 61.98 60.50 2w47 s VAL 86 Cb -0.05 -3.08 -0.15 0.00 0.56 0.00 0.00 36.38 33.66 2w47 s VAL 86 CO -0.14 -0.48 1.07 -0.24 -0.31 0.00 0.00 175.10 175.00 2w47 n SER 87 N -3.45 1.31 -0.78 4.85 2.88 -1.26 -4.63 113.62 112.55 2w47 n SER 87 Ca 0.07 1.16 0.09 0.00 -1.33 0.00 0.00 58.87 58.87 2w47 n SER 87 Cb 0.56 -1.26 0.09 0.00 -0.75 0.00 0.00 64.21 62.85 2w47 n SER 87 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2w47 n THR 88 N 0.73 0.09 0.00 2.46 -2.24 0.15 -4.93 114.28 110.54 2w47 n THR 88 Ca 0.12 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2w47 n THR 88 Cb 0.29 1.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.83 2w47 n THR 88 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w47 n GLY 89 N 1.07 2.46 3.18 3.38 0.00 -1.18 -4.74 105.19 109.36 2w47 n GLY 89 Ca 0.12 -0.52 -0.15 0.00 0.00 0.00 0.00 46.02 45.47 2w47 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w47 s ALA 90 N 0.00 1.17 -0.46 4.61 0.00 -1.26 -4.79 121.76 121.02 2w47 s ALA 90 Ca 0.00 -1.17 0.23 0.00 0.00 0.00 0.00 51.96 51.01 2w47 s ALA 90 Cb 0.00 -0.00 0.98 0.00 0.00 0.00 0.00 23.12 24.10 2w47 s ALA 90 CO 0.00 0.01 1.69 0.91 0.00 0.00 0.00 175.76 178.37 2w47 n TRP 91 N 0.65 0.76 0.08 0.00 7.02 -1.26 -1.87 117.44 122.83 2w47 n TRP 91 Ca -0.17 0.31 0.10 0.00 -1.02 0.00 0.00 57.50 56.73 2w47 n TRP 91 Cb 0.57 -1.00 0.21 0.00 -2.42 0.00 0.00 31.31 28.67 2w47 n TRP 91 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2w47 n THR 92 N -2.21 0.66 -3.73 -0.99 -2.24 -1.26 -4.78 114.28 99.73 2w47 n THR 92 Ca 0.02 -0.83 -0.37 0.00 -2.27 0.00 0.00 64.05 60.60 2w47 n THR 92 Cb 0.20 0.82 -0.12 0.00 -2.10 0.00 0.00 70.33 69.12 2w47 n THR 92 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2w47 s THR 93 N -1.24 4.37 -0.19 4.28 2.01 -0.78 -4.72 115.64 119.36 2w47 s THR 93 Ca 0.36 -0.26 -0.03 0.00 0.31 0.00 0.00 61.69 62.07 2w47 s THR 93 Cb 0.20 -3.10 -0.01 0.00 0.01 0.00 0.00 72.50 69.60 2w47 s THR 93 CO 0.28 0.26 -0.07 0.26 -0.69 0.00 0.00 174.62 174.65 2w47 s TRP 94 N 1.61 2.92 0.46 4.92 0.52 -1.26 -4.44 118.94 123.66 2w47 s TRP 94 Ca 0.06 -0.81 0.01 0.00 0.02 0.00 0.00 56.10 55.38 2w47 s TRP 94 Cb -0.16 -2.01 0.01 0.00 -1.15 0.00 0.00 33.47 30.16 2w47 s TRP 94 CO 0.04 -0.40 0.05 0.09 0.02 0.00 0.00 176.95 176.75 2w47 n ASN 95 N 4.29 3.18 -4.50 2.95 3.02 0.14 -4.88 115.26 119.46 2w47 n ASN 95 Ca -0.18 -2.96 -0.31 0.00 -0.03 0.00 0.00 54.58 51.09 2w47 n ASN 95 Cb 0.51 0.27 -0.12 0.00 -0.61 0.00 0.00 39.78 39.84 2w47 n ASN 95 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2w47 s GLU 96 N -3.69 2.24 -0.03 3.52 2.02 -1.26 -0.71 118.70 120.78 2w47 s GLU 96 Ca 0.04 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.14 2w47 s GLU 96 Cb -0.00 -2.29 0.03 0.00 0.10 0.00 0.00 34.13 31.96 2w47 s GLU 96 CO 0.02 0.56 -0.01 0.00 0.02 0.00 0.00 175.26 175.85 2w47 s ALA 97 N -0.94 0.42 0.07 5.21 0.00 -0.48 -4.99 121.76 121.06 2w47 s ALA 97 Ca 0.15 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.22 2w47 s ALA 97 Cb -0.11 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 2w47 s ALA 97 CO 0.06 -0.07 -0.05 0.20 0.00 0.00 0.00 175.76 175.89 2w47 s GLY 98 N 1.03 0.62 0.13 0.00 0.00 -1.26 -0.51 107.32 107.34 2w47 s GLY 98 Ca -0.10 -1.21 0.01 0.00 0.00 0.00 0.00 44.72 43.42 2w47 s GLY 98 CO -0.01 -1.31 -0.02 -0.26 0.00 0.00 0.00 173.10 171.49 2w47 s ILE 99 N -3.41 0.59 -0.14 0.90 -4.36 -0.50 -4.99 121.20 109.30 2w47 s ILE 99 Ca 0.07 -1.95 -0.05 0.00 -0.26 0.00 0.00 60.65 58.46 2w47 s ILE 99 Cb 0.04 -1.92 -0.04 0.00 1.25 0.00 0.00 42.46 41.80 2w47 s ILE 99 CO -0.06 -0.65 0.02 -0.69 0.24 0.00 0.00 174.94 173.81 2w47 s VAL 100 N -3.70 4.48 0.02 8.37 1.01 -1.26 -0.47 120.40 128.84 2w47 s VAL 100 Ca 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 2w47 s VAL 100 Cb 0.06 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 2w47 s VAL 100 CO -0.00 0.53 -0.00 0.00 0.00 0.00 0.00 175.10 175.62 2w47 s ALA 101 N -0.14 0.05 -0.07 5.51 0.00 -0.20 -4.66 121.76 122.25 2w47 s ALA 101 Ca 0.05 -0.51 -0.30 0.00 0.00 0.00 0.00 51.96 51.21 2w47 s ALA 101 Cb -0.12 0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.12 2w47 s ALA 101 CO 0.02 -0.16 1.01 1.21 0.00 0.00 0.00 175.76 177.83 2w47 s ASN 102 N -1.41 7.27 0.17 0.00 2.47 -1.26 -0.80 114.94 121.38 2w47 s ASN 102 Ca -0.15 1.59 0.10 0.00 0.42 0.00 0.00 52.86 54.81 2w47 s ASN 102 Cb -0.09 -2.56 -0.04 0.00 -1.45 0.00 0.00 41.25 37.10 2w47 s ASN 102 CO -0.01 -0.40 -0.17 -0.76 -3.72 0.00 0.00 177.10 172.05 2w47 s LEU 103 N 1.69 2.72 0.15 3.21 1.43 0.21 -4.98 118.68 123.12 2w47 s LEU 103 Ca 0.50 -0.67 -0.08 0.00 -1.03 0.00 0.00 54.13 52.86 2w47 s LEU 103 Cb -0.20 -1.47 -0.06 0.00 0.03 0.00 0.00 46.19 44.50 2w47 s LEU 103 CO 0.21 0.13 0.44 0.20 0.23 0.00 0.00 176.35 177.56 2w47 s ASN 104 N -2.58 6.58 0.19 2.29 0.01 -1.26 -1.62 114.94 118.55 2w47 s ASN 104 Ca 0.21 0.75 -0.33 0.00 -0.71 0.00 0.00 52.86 52.79 2w47 s ASN 104 Cb -0.09 -2.16 -0.14 0.00 0.41 0.00 0.00 41.25 39.27 2w47 s ASN 104 CO 0.12 0.05 1.42 1.67 -1.51 0.00 0.00 177.10 178.85 2w47 n GLN 105 N 0.27 1.86 0.00 -0.60 7.27 -1.26 -4.34 117.38 120.57 2w47 n GLN 105 Ca -0.03 0.67 0.00 0.00 0.07 0.00 0.00 57.00 57.70 2w47 n GLN 105 Cb 0.52 -2.34 0.00 0.00 2.41 0.00 0.00 30.24 30.83 2w47 n GLN 105 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2w47 n GLY 106 N 2.58 0.30 3.79 1.69 0.00 -0.14 -4.92 105.19 108.49 2w47 n GLY 106 Ca 0.14 -1.73 -0.37 0.00 0.00 0.00 0.00 46.02 44.07 2w47 n GLY 106 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2w47 s ASN 107 N -4.00 7.23 -0.05 1.61 2.47 -1.26 -0.57 114.94 120.37 2w47 s ASN 107 Ca 0.00 1.66 0.01 0.00 0.42 0.00 0.00 52.86 54.95 2w47 s ASN 107 Cb 0.00 -2.51 0.02 0.00 -1.45 0.00 0.00 41.25 37.31 2w47 s ASN 107 CO 0.00 -0.01 -0.05 0.20 -3.72 0.00 0.00 177.10 173.51 2w47 s ASN 108 N -1.61 1.08 -0.45 -4.21 0.01 0.67 -4.83 114.94 105.60 2w47 s ASN 108 Ca 0.47 -0.15 -0.21 0.00 -0.71 0.00 0.00 52.86 52.25 2w47 s ASN 108 Cb -0.18 -0.50 0.03 0.00 0.41 0.00 0.00 41.25 41.01 2w47 s ASN 108 CO 0.23 -0.05 0.69 -0.69 -1.51 0.00 0.00 177.10 175.77 2w47 s VAL 109 N 0.91 4.76 -0.24 1.60 1.01 -1.26 -0.61 120.40 126.58 2w47 s VAL 109 Ca -0.11 0.14 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 2w47 s VAL 109 Cb -0.14 -4.26 -0.00 0.00 0.00 0.00 0.00 36.38 31.97 2w47 s VAL 109 CO 0.00 -0.67 -0.01 -0.63 0.00 0.00 0.00 175.10 173.79 2w47 s ILE 110 N 2.98 3.50 -0.03 2.22 1.01 -0.13 -0.11 121.20 130.64 2w47 s ILE 110 Ca 0.24 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.40 2w47 s ILE 110 Cb -0.14 -2.66 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 2w47 s ILE 110 CO 0.19 0.33 -0.21 -0.60 0.00 0.00 0.00 174.94 174.65 2w47 s ARG 111 N 1.48 1.86 -0.24 2.79 3.52 -0.59 -0.76 118.95 127.02 2w47 s ARG 111 Ca 0.05 -0.76 0.01 0.00 -0.13 0.00 0.00 55.73 54.90 2w47 s ARG 111 Cb -0.15 -1.73 0.04 0.00 -1.56 0.00 0.00 34.95 31.55 2w47 s ARG 111 CO -0.02 0.41 -0.12 0.00 -0.81 0.00 0.00 175.30 174.76 2w47 s ALA 112 N -0.36 2.54 -0.14 6.12 0.00 -0.19 -1.19 121.76 128.54 2w47 s ALA 112 Ca 0.04 -1.57 -0.02 0.00 0.00 0.00 0.00 51.96 50.41 2w47 s ALA 112 Cb -0.10 -1.52 -0.02 0.00 0.00 0.00 0.00 23.12 21.49 2w47 s ALA 112 CO 0.00 -0.92 -0.08 0.99 0.00 0.00 0.00 175.76 175.76 2w47 s THR 113 N 1.19 3.55 0.12 0.00 2.01 -0.41 -2.01 115.64 120.09 2w47 s THR 113 Ca -0.04 -0.48 -0.31 0.00 0.31 0.00 0.00 61.69 61.17 2w47 s THR 113 Cb -0.18 -2.53 -0.08 0.00 0.01 0.00 0.00 72.50 69.73 2w47 s THR 113 CO -0.07 0.51 1.41 0.00 -0.69 0.00 0.00 174.62 175.78 2w47 s ALA 114 N 0.32 3.61 -0.15 7.40 0.00 0.18 -0.74 121.76 132.38 2w47 s ALA 114 Ca -0.07 1.15 -0.14 0.00 0.00 0.00 0.00 51.96 52.91 2w47 s ALA 114 Cb -0.15 -3.55 -0.24 0.00 0.00 0.00 0.00 23.12 19.19 2w47 s ALA 114 CO 0.04 -0.63 0.33 0.82 0.00 0.00 0.00 175.76 176.32 2w47 h ILE 115 N 4.21 0.79 -1.35 0.00 2.04 -1.77 -0.56 117.51 120.87 2w47 h ILE 115 Ca -0.42 -2.29 -0.44 0.00 1.00 0.00 0.00 64.86 62.71 2w47 h ILE 115 Cb 1.21 2.42 0.01 0.00 -0.74 0.00 0.00 36.82 39.72 2w47 h ILE 115 CO 0.87 0.65 -0.25 0.00 0.00 0.00 0.00 178.15 179.41 2w47 s ALA 116 N -2.47 4.49 -0.78 1.87 0.00 -1.26 -4.69 121.76 118.92 2w47 s ALA 116 Ca -0.25 -1.75 0.24 0.00 0.00 0.00 0.00 51.96 50.20 2w47 s ALA 116 Cb 0.06 -1.52 0.92 0.00 0.00 0.00 0.00 23.12 22.58 2w47 s ALA 116 CO 0.70 -0.35 1.73 0.43 0.00 0.00 0.00 175.76 178.28 2w47 n SER 117 N -1.86 0.43 -0.64 0.00 7.64 -1.26 -1.68 113.62 116.24 2w47 n SER 117 Ca 0.08 0.57 0.10 0.00 1.01 0.00 0.00 58.87 60.63 2w47 n SER 117 Cb 0.60 -0.67 0.34 0.00 -1.01 0.00 0.00 64.21 63.46 2w47 n SER 117 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2w47 n ASP 118 N -1.93 1.92 -0.01 6.43 2.03 -1.26 -2.31 116.55 121.43 2w47 n ASP 118 Ca 0.05 -1.77 0.00 0.00 0.52 0.00 0.00 54.79 53.59 2w47 n ASP 118 Cb 0.30 -0.13 0.00 0.00 -0.72 0.00 0.00 41.12 40.57 2w47 n ASP 118 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2w47 n GLY 119 N 1.18 -1.82 3.96 0.27 0.00 -0.67 -4.40 105.19 103.71 2w47 n GLY 119 Ca 0.16 -1.37 -0.23 0.00 0.00 0.00 0.00 46.02 44.58 2w47 n GLY 119 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2w47 s GLY 120 N -0.62 1.78 0.93 -0.02 0.00 -1.26 -4.67 107.32 103.46 2w47 s GLY 120 Ca 0.00 -1.25 -0.12 0.00 0.00 0.00 0.00 44.72 43.35 2w47 s GLY 120 CO 0.00 -0.90 1.09 2.56 0.00 0.00 0.00 173.10 175.85 2w47 s PRO 121 N -4.95 0.96 0.20 2.90 0.04 -1.26 -4.52 135.00 128.37 2w47 s PRO 121 Ca 0.59 0.89 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 2w47 s PRO 121 Cb -0.10 -1.77 -0.08 0.00 0.04 0.00 0.00 34.50 32.59 2w47 s PRO 121 CO 0.41 -2.46 1.25 -0.80 0.04 0.00 0.00 177.00 175.43 2w47 s ASN 122 N -3.25 6.99 -0.15 6.66 0.01 -0.57 -4.48 114.94 120.16 2w47 s ASN 122 Ca 0.64 2.33 0.00 0.00 -0.71 0.00 0.00 52.86 55.12 2w47 s ASN 122 Cb -0.19 -2.61 0.02 0.00 0.41 0.00 0.00 41.25 38.88 2w47 s ASN 122 CO 0.58 -0.44 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.89 2w47 s VAL 123 N -0.05 1.58 -0.08 1.60 1.01 -0.24 -0.80 120.40 123.42 2w47 s VAL 123 Ca 0.54 -0.64 -0.24 0.00 0.00 0.00 0.00 61.98 61.63 2w47 s VAL 123 Cb -0.35 -1.48 -0.29 0.00 0.00 0.00 0.00 36.38 34.27 2w47 s VAL 123 CO 0.38 0.46 0.87 -0.78 0.00 0.00 0.00 175.10 176.03 2w47 h ASP 124 N 8.00 0.29 -5.41 3.32 3.58 -1.05 0.16 116.42 125.32 2w47 h ASP 124 Ca -0.38 -0.95 0.21 0.00 0.42 0.00 0.00 57.03 56.32 2w47 h ASP 124 Cb 1.14 -0.09 -0.09 0.00 1.72 0.00 0.00 39.33 42.01 2w47 h ASP 124 CO 0.53 1.22 0.55 -0.72 -2.88 0.00 0.00 179.24 177.94 2w47 s TYR 125 N -2.43 -0.11 -0.15 0.28 -0.85 -1.24 -2.95 117.35 109.90 2w47 s TYR 125 Ca -0.16 -0.15 -0.00 0.00 -0.52 0.00 0.00 57.07 56.24 2w47 s TYR 125 Cb -0.00 0.62 -0.01 0.00 0.38 0.00 0.00 41.96 42.95 2w47 s TYR 125 CO 0.78 -0.72 -0.14 -1.17 -1.52 0.00 0.00 175.55 172.78 2w47 s LEU 126 N -2.95 2.60 -0.16 -3.49 2.96 -0.46 -1.97 118.68 115.22 2w47 s LEU 126 Ca 0.13 -0.41 -0.04 0.00 -0.22 0.00 0.00 54.13 53.58 2w47 s LEU 126 Cb -0.00 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 2w47 s LEU 126 CO 0.01 0.11 -0.01 -0.75 -1.32 0.00 0.00 176.35 174.38 2w47 s LYS 127 N 0.70 3.69 -0.07 1.98 2.20 0.81 0.24 119.74 129.28 2w47 s LYS 127 Ca -0.07 -0.47 0.03 0.00 -0.36 0.00 0.00 55.97 55.10 2w47 s LYS 127 Cb -0.15 -2.97 0.01 0.00 -1.51 0.00 0.00 37.83 33.21 2w47 s LYS 127 CO 0.02 0.28 -0.14 0.08 -0.36 0.00 0.00 175.35 175.23 2w47 s VAL 128 N 0.27 1.32 0.07 4.02 1.01 -0.06 -0.74 120.40 126.28 2w47 s VAL 128 Ca -0.01 -0.58 -0.11 0.00 0.00 0.00 0.00 61.98 61.27 2w47 s VAL 128 Cb -0.14 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.07 2w47 s VAL 128 CO 0.02 0.40 0.25 0.72 0.00 0.00 0.00 175.10 176.49 2w47 s PHE 129 N 0.63 0.00 0.26 5.22 -0.71 -0.96 -0.95 117.98 121.48 2w47 s PHE 129 Ca -0.15 -0.28 -0.30 0.00 -1.04 0.00 0.00 56.93 55.17 2w47 s PHE 129 Cb -0.16 0.04 -0.10 0.00 -1.21 0.00 0.00 43.02 41.59 2w47 s PHE 129 CO 0.04 -0.52 1.40 0.45 -1.34 0.00 0.00 175.22 175.25 2w47 s SER 130 N -2.42 6.69 -0.36 1.98 0.15 -1.26 -0.53 113.70 117.96 2w47 s SER 130 Ca -0.01 2.65 0.14 0.00 0.70 0.00 0.00 55.95 59.43 2w47 s SER 130 Cb 0.01 -2.63 0.39 0.00 -1.71 0.00 0.00 66.02 62.08 2w47 s SER 130 CO -0.07 -0.65 0.84 0.00 1.20 0.00 0.00 173.24 174.55 2w47 n ALA 131 N 2.01 2.39 0.30 5.45 0.00 0.11 -4.72 120.51 126.05 2w47 n ALA 131 Ca 0.05 -3.19 0.18 0.00 0.00 0.00 0.00 53.44 50.49 2w47 n ALA 131 Cb 0.41 -0.94 0.95 0.00 0.00 0.00 0.00 19.45 19.86 2w47 n ALA 131 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2w47 h ASN 132 N 2.98 0.00 0.29 0.00 -0.26 -1.92 -0.82 115.58 115.85 2w47 h ASN 132 Ca 0.01 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.73 2w47 h ASN 132 Cb 1.06 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 38.31 2w47 h ASN 132 CO 0.47 0.03 -0.12 0.00 -1.06 0.00 0.00 177.43 176.75 2w47 h ALA 133 N 1.97 1.39 -2.71 -0.83 0.00 -1.92 -3.43 119.26 113.73 2w47 h ALA 133 Ca -0.00 -0.11 -0.57 0.00 0.00 0.00 0.00 54.91 54.22 2w47 h ALA 133 Cb 0.21 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2w47 h ALA 133 CO 0.00 0.15 -0.49 -0.06 0.00 0.00 0.00 179.25 178.85 2w47 s PHE 134 N -4.33 3.44 -0.09 0.00 0.08 -0.31 -5.11 117.98 111.66 2w47 s PHE 134 Ca -0.03 0.14 -0.02 0.00 0.12 0.00 0.00 56.93 57.14 2w47 s PHE 134 Cb 0.14 -1.67 0.03 0.00 -0.57 0.00 0.00 43.02 40.95 2w47 s PHE 134 CO 0.60 0.54 0.02 -0.65 -0.10 0.00 0.00 175.22 175.64 2w47 s GLN 135 N -2.96 0.44 0.00 0.44 1.11 -1.26 -4.80 119.66 112.63 2w47 s GLN 135 Ca 0.34 0.08 0.18 0.00 0.01 0.00 0.00 55.36 55.97 2w47 s GLN 135 Cb -0.12 -1.08 1.07 0.00 -1.01 0.00 0.00 33.01 31.87 2w47 s GLN 135 CO 0.27 -0.37 1.47 -2.30 0.01 0.00 0.00 175.29 174.37