#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aiw n GLY 2 N 0.00 3.88 0.00 3.17 0.00 -1.26 -4.86 105.19 106.12 1aiw n GLY 2 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1aiw n GLY 2 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1aiw n ASP 3 N 5.52 0.00 -0.11 1.61 8.00 -1.26 -0.13 116.55 130.19 1aiw n ASP 3 Ca 0.57 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 56.02 1aiw n ASP 3 Cb 0.32 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.44 1aiw n ASP 3 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1aiw n ALA 5 N -2.50 0.00 -2.77 0.00 0.00 0.82 -4.26 120.51 111.78 1aiw n ALA 5 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.45 1aiw n ALA 5 Cb 0.19 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.71 1aiw n ALA 5 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1aiw n ASN 6 N 0.92 0.55 -3.50 0.00 6.94 -1.26 -5.05 115.26 113.85 1aiw n ASN 6 Ca 0.00 -2.13 -0.06 0.00 -0.02 0.00 0.00 54.58 52.37 1aiw n ASN 6 Cb 0.00 -0.09 -0.00 0.00 -2.36 0.00 0.00 39.78 37.33 1aiw n ASN 6 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1aiw s ALA 7 N -2.47 -1.22 -0.48 -2.53 0.00 -1.26 -5.11 121.76 108.69 1aiw s ALA 7 Ca 0.21 -0.35 -0.35 0.00 0.00 0.00 0.00 51.96 51.48 1aiw s ALA 7 Cb 0.37 0.74 -0.14 0.00 0.00 0.00 0.00 23.12 24.10 1aiw s ALA 7 CO -0.06 -1.03 2.29 0.09 0.00 0.00 0.00 175.76 177.04 1aiw n ASN 8 N -0.84 1.68 -4.74 0.00 4.13 -1.26 -4.71 115.26 109.51 1aiw n ASN 8 Ca -0.06 0.30 -0.35 0.00 1.68 0.00 0.00 54.58 56.16 1aiw n ASN 8 Cb 0.60 -1.20 -0.08 0.00 -1.54 0.00 0.00 39.78 37.56 1aiw n ASN 8 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1aiw s VAL 9 N 7.97 5.42 0.10 2.41 1.01 -1.26 -0.39 120.40 135.66 1aiw s VAL 9 Ca 1.14 0.20 -0.35 0.00 0.00 0.00 0.00 61.98 62.97 1aiw s VAL 9 Cb -0.93 -3.47 -0.18 0.00 0.00 0.00 0.00 36.38 31.81 1aiw s VAL 9 CO 0.49 0.46 1.06 0.00 0.00 0.00 0.00 175.10 177.11 1aiw n TYR 10 N 3.37 0.83 -1.07 5.22 9.36 0.44 -0.14 117.16 135.17 1aiw n TYR 10 Ca -0.16 0.85 -0.26 0.00 3.32 0.00 0.00 57.90 61.65 1aiw n TYR 10 Cb 0.52 -2.17 0.10 0.00 -0.63 0.00 0.00 39.34 37.16 1aiw n TYR 10 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1aiw n PRO 11 N 1.68 2.28 -1.06 2.98 -0.04 -1.26 -5.02 135.00 134.55 1aiw n PRO 11 Ca 0.18 -2.69 -0.32 0.00 -0.04 0.00 0.00 63.50 60.64 1aiw n PRO 11 Cb 0.18 -2.05 -0.02 0.00 -0.04 0.00 0.00 33.50 31.56 1aiw n PRO 11 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1aiw n ASN 12 N -0.69 6.19 -4.56 3.54 3.02 0.81 -4.79 115.26 118.78 1aiw n ASN 12 Ca 0.52 -2.48 -0.34 0.00 -0.03 0.00 0.00 54.58 52.25 1aiw n ASN 12 Cb 0.98 -1.32 0.11 0.00 -0.61 0.00 0.00 39.78 38.94 1aiw n ASN 12 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1aiw n TRP 13 N 4.33 -0.00 -0.01 3.10 7.02 -1.26 -4.56 117.44 126.06 1aiw n TRP 13 Ca 0.59 0.35 -0.10 0.00 -1.02 0.00 0.00 57.50 57.31 1aiw n TRP 13 Cb 0.21 -1.97 -0.08 0.00 -2.42 0.00 0.00 31.31 27.04 1aiw n TRP 13 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 1aiw h VAL 14 N -0.86 1.08 -3.81 -0.99 2.07 -1.86 -3.44 116.25 108.44 1aiw h VAL 14 Ca -0.45 -1.52 -0.48 0.00 0.82 0.00 0.00 66.70 65.06 1aiw h VAL 14 Cb 1.31 1.93 -0.02 0.00 -1.52 0.00 0.00 31.29 32.99 1aiw h VAL 14 CO 0.42 0.32 0.31 -0.44 0.02 0.00 0.00 177.57 178.21 1aiw s SER 15 N -5.75 7.37 0.31 0.57 0.01 0.43 -4.95 113.70 111.68 1aiw s SER 15 Ca -0.13 1.80 0.07 0.00 1.31 0.00 0.00 55.95 59.00 1aiw s SER 15 Cb -0.01 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 1aiw s SER 15 CO 0.49 0.00 -0.04 -0.54 0.41 0.00 0.00 173.24 173.56 1aiw s LYS 16 N -1.83 1.64 0.16 12.44 1.02 -1.26 -1.16 119.74 130.75 1aiw s LYS 16 Ca 0.47 -1.85 -0.15 0.00 0.02 0.00 0.00 55.97 54.45 1aiw s LYS 16 Cb -0.20 -1.25 0.03 0.00 -0.52 0.00 0.00 37.83 35.90 1aiw s LYS 16 CO 0.25 0.02 1.80 0.22 -0.92 0.00 0.00 175.35 176.72 1aiw h ASP 17 N 2.17 0.55 -0.06 2.83 3.58 -1.42 -3.44 116.42 120.64 1aiw h ASP 17 Ca -0.41 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.00 1aiw h ASP 17 Cb 1.24 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 42.15 1aiw h ASP 17 CO 0.69 0.43 0.00 0.79 -2.88 0.00 0.00 179.24 178.28 1aiw n TRP 18 N -4.73 0.00 0.00 0.28 7.02 -1.26 -4.98 117.44 113.77 1aiw n TRP 18 Ca 0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.50 1aiw n TRP 18 Cb 0.05 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.94 1aiw n TRP 18 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1aiw n ALA 19 N -0.15 0.00 -1.85 6.99 0.00 -1.26 -4.75 120.51 119.49 1aiw n ALA 19 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 1aiw n ALA 19 Cb 0.02 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.48 1aiw n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aiw n GLY 20 N 0.00 0.52 0.00 0.00 0.00 -1.26 -5.09 105.19 99.36 1aiw n GLY 20 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1aiw n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aiw n GLY 21 N -1.42 5.16 3.31 -0.02 0.00 -1.26 -5.16 105.19 105.80 1aiw n GLY 21 Ca -0.02 -1.63 -0.16 0.00 0.00 0.00 0.00 46.02 44.22 1aiw n GLY 21 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1aiw s GLN 22 N 2.55 1.26 0.61 1.61 -2.07 -1.26 -4.85 119.66 117.52 1aiw s GLN 22 Ca 0.00 -1.61 -0.18 0.00 -1.82 0.00 0.00 55.36 51.75 1aiw s GLN 22 Cb 0.00 -0.64 -0.05 0.00 -1.09 0.00 0.00 33.01 31.23 1aiw s GLN 22 CO 0.00 -0.04 0.82 -2.30 -1.32 0.00 0.00 175.29 172.45 1aiw n PRO 23 N -0.35 0.72 0.00 9.60 -0.02 -1.26 -1.23 135.00 142.45 1aiw n PRO 23 Ca -0.07 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1aiw n PRO 23 Cb 0.63 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1aiw n PRO 23 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1aiw n THR 24 N -1.83 0.00 -3.57 3.45 5.66 -0.31 -4.59 114.28 113.09 1aiw n THR 24 Ca 0.13 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.16 1aiw n THR 24 Cb 0.48 0.19 -0.00 0.00 -1.55 0.00 0.00 70.33 69.44 1aiw n THR 24 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 1aiw s HIS 25 N 0.00 -0.00 -0.12 1.09 -3.43 -0.64 -4.74 115.29 107.45 1aiw s HIS 25 Ca 0.00 -0.00 0.01 0.00 -0.80 0.00 0.00 55.06 54.27 1aiw s HIS 25 Cb 0.00 0.50 -0.01 0.00 -1.43 0.00 0.00 32.58 31.64 1aiw s HIS 25 CO 0.00 -0.02 -0.15 1.21 -2.00 0.00 0.00 174.74 173.78 1aiw s ASN 26 N -2.84 3.89 0.33 7.38 3.84 0.36 -0.43 114.94 127.47 1aiw s ASN 26 Ca 0.14 -0.34 0.07 0.00 0.21 0.00 0.00 52.86 52.94 1aiw s ASN 26 Cb 0.06 -1.49 -0.02 0.00 -0.55 0.00 0.00 41.25 39.25 1aiw s ASN 26 CO -0.06 0.18 0.34 -1.61 -2.79 0.00 0.00 177.10 173.16 1aiw s GLU 27 N 0.23 2.83 -0.27 0.43 2.02 -1.26 -0.75 118.70 121.92 1aiw s GLU 27 Ca -0.10 -1.22 -0.43 0.00 0.02 0.00 0.00 54.97 53.25 1aiw s GLU 27 Cb -0.16 -2.57 -0.19 0.00 0.10 0.00 0.00 34.13 31.32 1aiw s GLU 27 CO 0.06 0.09 1.46 0.00 0.02 0.00 0.00 175.26 176.88 1aiw n ALA 28 N -1.44 -1.73 0.00 5.21 0.00 0.14 -0.20 120.51 122.49 1aiw n ALA 28 Ca -0.01 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1aiw n ALA 28 Cb 0.59 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.10 1aiw n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aiw n GLY 29 N 3.22 2.48 3.75 0.00 0.00 -0.29 -4.96 105.19 109.40 1aiw n GLY 29 Ca 0.26 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 1aiw n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aiw s GLN 30 N -0.24 4.76 0.20 1.61 -0.21 0.72 -4.84 119.66 121.65 1aiw s GLN 30 Ca 0.00 1.61 0.06 0.00 0.02 0.00 0.00 55.36 57.05 1aiw s GLN 30 Cb 0.00 -3.26 -0.04 0.00 1.00 0.00 0.00 33.01 30.72 1aiw s GLN 30 CO 0.00 0.36 0.15 -1.54 -2.12 0.00 0.00 175.29 172.15 1aiw s SER 31 N -0.92 5.49 0.25 5.90 1.04 -1.26 -2.44 113.70 121.77 1aiw s SER 31 Ca 0.43 -0.19 -0.19 0.00 0.48 0.00 0.00 55.95 56.49 1aiw s SER 31 Cb -0.28 -1.41 0.02 0.00 0.10 0.00 0.00 66.02 64.45 1aiw s SER 31 CO 0.35 0.03 0.63 -0.51 0.98 0.00 0.00 173.24 174.72 1aiw s ILE 32 N -1.90 0.00 0.10 -1.02 2.07 0.19 -4.77 121.20 115.87 1aiw s ILE 32 Ca 0.32 -1.01 0.09 0.00 -1.41 0.00 0.00 60.65 58.63 1aiw s ILE 32 Cb -0.09 -1.94 -0.03 0.00 0.13 0.00 0.00 42.46 40.52 1aiw s ILE 32 CO 0.24 -0.02 -0.22 -0.69 -1.91 0.00 0.00 174.94 172.34 1aiw s VAL 33 N -3.93 1.80 -0.16 4.00 1.01 0.47 -0.56 120.40 123.04 1aiw s VAL 33 Ca 0.13 -1.54 -0.11 0.00 0.00 0.00 0.00 61.98 60.46 1aiw s VAL 33 Cb -0.04 -1.62 0.05 0.00 0.00 0.00 0.00 36.38 34.77 1aiw s VAL 33 CO 0.05 -0.00 0.40 -0.47 0.00 0.00 0.00 175.10 175.08 1aiw s TYR 34 N -1.10 -0.52 -1.02 5.22 5.04 -0.08 -0.42 117.35 124.47 1aiw s TYR 34 Ca 0.08 1.16 0.00 0.00 -2.44 0.00 0.00 57.07 55.87 1aiw s TYR 34 Cb -0.10 0.20 0.00 0.00 0.35 0.00 0.00 41.96 42.42 1aiw s TYR 34 CO 0.04 -0.28 0.00 1.63 -1.34 0.00 0.00 175.55 175.60 1aiw n LYS 35 N 3.66 -2.05 0.00 4.97 5.02 -1.26 -0.72 118.16 127.78 1aiw n LYS 35 Ca -0.19 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 1aiw n LYS 35 Cb 0.56 -5.08 0.00 0.00 -0.02 0.00 0.00 35.03 30.49 1aiw n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aiw n GLY 36 N -0.65 3.14 3.74 0.72 0.00 -1.26 -4.98 105.19 105.91 1aiw n GLY 36 Ca -0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 1aiw n GLY 36 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1aiw s ASN 37 N -0.68 7.59 -0.10 1.61 -0.87 0.11 -0.60 114.94 122.00 1aiw s ASN 37 Ca 0.00 1.90 -0.18 0.00 -1.57 0.00 0.00 52.86 53.00 1aiw s ASN 37 Cb 0.00 -2.60 -0.04 0.00 -0.02 0.00 0.00 41.25 38.58 1aiw s ASN 37 CO 0.00 0.08 0.49 -0.22 -2.57 0.00 0.00 177.10 174.88 1aiw s LEU 38 N -0.76 4.30 0.10 0.60 2.96 0.44 -0.91 118.68 125.42 1aiw s LEU 38 Ca 0.43 0.87 0.02 0.00 -0.22 0.00 0.00 54.13 55.23 1aiw s LEU 38 Cb -0.25 -2.72 -0.04 0.00 0.50 0.00 0.00 46.19 43.68 1aiw s LEU 38 CO 0.31 0.03 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.99 1aiw s TYR 39 N 0.43 0.91 0.01 5.38 1.51 0.27 -0.85 117.35 125.01 1aiw s TYR 39 Ca 0.27 -0.88 0.03 0.00 -1.01 0.00 0.00 57.07 55.47 1aiw s TYR 39 Cb -0.16 -0.52 -0.01 0.00 -0.11 0.00 0.00 41.96 41.16 1aiw s TYR 39 CO 0.11 -0.13 -0.10 0.99 -1.11 0.00 0.00 175.55 175.32 1aiw s THR 40 N -3.48 0.76 0.39 -0.71 2.01 0.37 -0.64 115.64 114.34 1aiw s THR 40 Ca 0.11 -0.59 -0.18 0.00 0.31 0.00 0.00 61.69 61.34 1aiw s THR 40 Cb 0.04 -0.67 -0.10 0.00 0.01 0.00 0.00 72.50 71.78 1aiw s THR 40 CO -0.04 0.08 0.87 0.00 -0.69 0.00 0.00 174.62 174.84 1aiw s ALA 41 N -0.48 3.15 -0.01 7.40 0.00 -1.02 -1.45 121.76 129.34 1aiw s ALA 41 Ca 0.01 0.25 0.02 0.00 0.00 0.00 0.00 51.96 52.25 1aiw s ALA 41 Cb -0.05 -3.00 -0.25 0.00 0.00 0.00 0.00 23.12 19.81 1aiw s ALA 41 CO 0.00 0.19 0.79 -0.91 0.00 0.00 0.00 175.76 175.83 1aiw h ASN 42 N 1.99 0.23 0.00 0.00 2.35 -1.35 -0.76 115.58 118.05 1aiw h ASN 42 Ca -0.48 -0.36 0.00 0.00 -0.55 0.00 0.00 56.30 54.90 1aiw h ASN 42 Cb 1.18 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.47 1aiw h ASN 42 CO 0.63 1.31 0.00 -2.67 -1.65 0.00 0.00 177.43 175.05 1aiw n TRP 43 N -3.32 0.00 -3.63 1.19 2.14 -1.26 -4.63 117.44 107.93 1aiw n TRP 43 Ca -0.16 0.00 -0.04 0.00 2.07 0.00 0.00 57.50 59.37 1aiw n TRP 43 Cb 1.03 0.21 -0.06 0.00 -0.81 0.00 0.00 31.31 31.68 1aiw n TRP 43 CO 0.00 0.00 0.00 -0.47 2.07 0.00 0.00 177.69 179.29 1aiw s TYR 44 N -0.42 -1.11 -0.10 -2.67 6.14 -1.26 0.24 117.35 118.18 1aiw s TYR 44 Ca 0.00 2.08 -0.30 0.00 0.64 0.00 0.00 57.07 59.49 1aiw s TYR 44 Cb 0.00 0.66 0.12 0.00 0.42 0.00 0.00 41.96 43.16 1aiw s TYR 44 CO 0.00 -0.55 0.95 -0.08 0.64 0.00 0.00 175.55 176.51 1aiw s THR 45 N 2.10 0.00 -0.06 4.34 -1.32 0.07 -5.00 115.64 115.77 1aiw s THR 45 Ca -0.08 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.49 1aiw s THR 45 Cb -0.07 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 70.06 1aiw s THR 45 CO -0.19 0.00 1.07 0.00 -2.21 0.00 0.00 174.62 173.29 1aiw n ALA 46 N 0.31 2.17 -1.92 11.08 0.00 -1.26 -0.49 120.51 130.40 1aiw n ALA 46 Ca -0.09 -1.77 -0.35 0.00 0.00 0.00 0.00 53.44 51.22 1aiw n ALA 46 Cb 0.59 -0.46 -0.06 0.00 0.00 0.00 0.00 19.45 19.52 1aiw n ALA 46 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1aiw s SER 47 N -1.86 7.07 -0.24 0.00 0.01 -1.26 -4.96 113.70 112.46 1aiw s SER 47 Ca 0.15 1.61 -0.40 0.00 1.31 0.00 0.00 55.95 58.62 1aiw s SER 47 Cb 0.14 -2.50 -0.16 0.00 0.21 0.00 0.00 66.02 63.71 1aiw s SER 47 CO 0.00 -0.15 1.65 0.52 0.41 0.00 0.00 173.24 175.67 1aiw n VAL 48 N 0.10 0.22 -1.63 3.43 0.31 -1.26 -4.79 118.33 114.70 1aiw n VAL 48 Ca 0.03 -0.04 -0.52 0.00 -0.01 0.00 0.00 64.34 63.80 1aiw n VAL 48 Cb 0.52 -1.04 -0.06 0.00 -0.91 0.00 0.00 33.84 32.35 1aiw n VAL 48 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1aiw n PRO 49 N 4.66 1.33 -1.62 5.55 -0.02 -1.26 -1.58 135.00 142.06 1aiw n PRO 49 Ca 0.26 0.48 -0.13 0.00 -2.02 0.00 0.00 63.50 62.09 1aiw n PRO 49 Cb 0.12 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.39 1aiw n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aiw n GLY 50 N 3.04 0.96 0.00 -1.23 0.00 -1.26 -4.90 105.19 101.80 1aiw n GLY 50 Ca 0.20 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1aiw n GLY 50 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1aiw n SER 51 N -0.23 0.00 0.00 1.61 3.41 -0.61 -4.91 113.62 112.89 1aiw n SER 51 Ca -0.14 0.76 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 1aiw n SER 51 Cb 0.48 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1aiw n SER 51 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1aiw n ASP 52 N -1.76 0.00 -3.85 4.04 9.92 -1.26 -5.15 116.55 118.49 1aiw n ASP 52 Ca 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.18 1aiw n ASP 52 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 1aiw n ASP 52 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1aiw s SER 53 N -1.37 -0.23 0.00 -2.24 0.01 -1.26 -4.95 113.70 103.66 1aiw s SER 53 Ca 0.00 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.62 1aiw s SER 53 Cb 0.00 0.64 0.00 0.00 0.21 0.00 0.00 66.02 66.87 1aiw s SER 53 CO 0.00 -1.19 0.00 -1.54 0.41 0.00 0.00 173.24 170.92 1aiw n SER 54 N -0.40 -0.17 -4.72 2.44 3.41 -1.26 -4.85 113.62 108.06 1aiw n SER 54 Ca -0.06 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.29 1aiw n SER 54 Cb 0.61 -1.21 -0.08 0.00 -0.26 0.00 0.00 64.21 63.27 1aiw n SER 54 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1aiw s TRP 55 N -2.54 2.46 -0.28 7.33 0.52 -1.26 -0.94 118.94 124.23 1aiw s TRP 55 Ca 0.00 -0.66 -0.12 0.00 0.02 0.00 0.00 56.10 55.35 1aiw s TRP 55 Cb 0.00 -1.88 0.11 0.00 -1.15 0.00 0.00 33.47 30.54 1aiw s TRP 55 CO 0.00 0.21 0.63 0.99 0.02 0.00 0.00 176.95 178.81 1aiw s THR 56 N -2.66 -0.57 0.37 2.01 2.01 -0.53 -4.79 115.64 111.48 1aiw s THR 56 Ca 0.36 0.02 -0.25 0.00 0.31 0.00 0.00 61.69 62.13 1aiw s THR 56 Cb 0.05 -0.95 -0.09 0.00 0.01 0.00 0.00 72.50 71.51 1aiw s THR 56 CO 0.20 0.01 1.05 -1.58 -0.69 0.00 0.00 174.62 173.60 1aiw s GLN 57 N 2.35 4.31 0.00 4.92 0.74 -1.26 -0.48 119.66 130.24 1aiw s GLN 57 Ca -0.07 1.56 0.00 0.00 0.05 0.00 0.00 55.36 56.90 1aiw s GLN 57 Cb -0.09 -2.71 0.00 0.00 1.10 0.00 0.00 33.01 31.31 1aiw s GLN 57 CO -0.19 -0.02 0.09 1.33 -0.55 0.00 0.00 175.29 175.95 1aiw n VAL 58 N 0.27 0.00 -0.67 1.34 0.24 -0.03 -4.89 118.33 114.60 1aiw n VAL 58 Ca 0.03 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 1aiw n VAL 58 Cb 0.49 1.17 0.00 0.00 -1.47 0.00 0.00 33.84 34.03 1aiw n VAL 58 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1aiw n GLY 59 N 0.33 -0.20 3.41 7.63 0.00 -1.17 -4.98 105.19 110.21 1aiw n GLY 59 Ca 0.00 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 44.83 1aiw n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1aiw s SER 60 N -4.00 -0.48 -0.09 1.61 1.04 -1.26 -0.42 113.70 110.10 1aiw s SER 60 Ca 0.00 0.35 -0.23 0.00 0.48 0.00 0.00 55.95 56.55 1aiw s SER 60 Cb 0.00 0.48 -0.28 0.00 0.10 0.00 0.00 66.02 66.32 1aiw s SER 60 CO 0.00 -0.64 0.74 0.00 0.98 0.00 0.00 173.24 174.33