#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 -0.50 0.46 3.17 0.00 -1.26 -4.87 105.19 102.19 1aiw n GLY 2 Ca 0.00 0.22 0.34 0.00 0.00 0.00 0.00 46.02 46.57 1aiw n GLY 2 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1aiw h ASP 3 N -2.42 0.28 0.03 1.61 5.19 -1.95 0.81 116.42 119.97 1aiw h ASP 3 Ca -0.58 0.12 -0.10 0.00 -0.62 0.00 0.00 57.03 55.85 1aiw h ASP 3 Cb 1.37 0.09 -0.01 0.00 0.18 0.00 0.00 39.33 40.97 1aiw h ASP 3 CO 0.59 -0.11 -0.51 0.00 -3.12 0.00 0.00 179.24 176.09 1aiw n ALA 5 N -2.83 0.00 -1.34 0.00 0.00 0.28 -4.27 120.51 112.35 1aiw n ALA 5 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1aiw n ALA 5 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 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 0.00 0.00 -4.84 0.00 0.23 -1.26 -4.67 115.26 104.73 1aiw n ASN 6 Ca 0.00 -0.73 -0.32 0.00 -0.53 0.00 0.00 54.58 53.00 1aiw n ASN 6 Cb 0.00 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 37.71 1aiw n ASN 6 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1aiw s ALA 7 N 0.00 2.91 -0.64 -2.53 0.00 -1.26 -4.88 121.76 115.36 1aiw s ALA 7 Ca 0.00 0.10 -0.39 0.00 0.00 0.00 0.00 51.96 51.67 1aiw s ALA 7 Cb 0.00 -3.14 -0.19 0.00 0.00 0.00 0.00 23.12 19.78 1aiw s ALA 7 CO 0.00 -0.77 2.26 0.09 0.00 0.00 0.00 175.76 177.34 1aiw n ASN 8 N -2.50 0.59 -4.70 0.00 4.13 -1.26 -4.61 115.26 106.91 1aiw n ASN 8 Ca 0.07 0.51 -0.35 0.00 1.68 0.00 0.00 54.58 56.49 1aiw n ASN 8 Cb 0.54 -0.88 -0.09 0.00 -1.54 0.00 0.00 39.78 37.81 1aiw n ASN 8 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1aiw s VAL 9 N 6.77 5.04 0.13 2.41 0.11 -1.26 -0.14 120.40 133.46 1aiw s VAL 9 Ca 1.22 0.05 -0.34 0.00 -2.93 0.00 0.00 61.98 59.98 1aiw s VAL 9 Cb -1.39 -3.26 -0.17 0.00 -1.53 0.00 0.00 36.38 30.03 1aiw s VAL 9 CO 0.59 0.49 1.08 0.00 -3.33 0.00 0.00 175.10 173.93 1aiw n TYR 10 N 3.22 0.96 -0.73 1.54 9.36 -0.54 -0.13 117.16 130.84 1aiw n TYR 10 Ca -0.17 0.79 -0.19 0.00 3.32 0.00 0.00 57.90 61.65 1aiw n TYR 10 Cb 0.53 -2.21 0.09 0.00 -0.63 0.00 0.00 39.34 37.12 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 1.69 1.96 -1.08 2.98 -0.04 -1.26 -5.03 135.00 134.21 1aiw n PRO 11 Ca 0.17 -2.08 -0.32 0.00 -0.04 0.00 0.00 63.50 61.23 1aiw n PRO 11 Cb 0.21 -1.82 -0.03 0.00 -0.04 0.00 0.00 33.50 31.82 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 -0.38 7.21 -4.56 3.54 3.02 0.82 -4.90 115.26 120.02 1aiw n ASN 12 Ca 0.41 -2.47 -0.34 0.00 -0.03 0.00 0.00 54.58 52.15 1aiw n ASN 12 Cb 0.98 -1.38 0.11 0.00 -0.61 0.00 0.00 39.78 38.89 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 3.76 -0.03 0.11 3.10 5.03 -1.26 -4.52 117.44 123.62 1aiw n TRP 13 Ca 0.65 0.34 -0.01 0.00 3.03 0.00 0.00 57.50 61.51 1aiw n TRP 13 Cb 0.22 -1.96 -0.03 0.00 -1.03 0.00 0.00 31.31 28.51 1aiw n TRP 13 CO 0.00 0.00 0.00 0.28 -0.03 0.00 0.00 177.69 177.94 1aiw h VAL 14 N -1.04 1.15 -3.34 -0.99 2.07 -1.86 -3.46 116.25 108.79 1aiw h VAL 14 Ca -0.45 -2.64 -0.04 0.00 0.82 0.00 0.00 66.70 64.39 1aiw h VAL 14 Cb 1.30 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 33.59 1aiw h VAL 14 CO 0.41 0.66 0.09 -0.55 0.02 0.00 0.00 177.57 178.20 1aiw s SER 15 N -6.52 0.03 0.12 0.57 0.15 -0.74 -4.94 113.70 102.36 1aiw s SER 15 Ca 0.03 -0.97 0.01 0.00 0.70 0.00 0.00 55.95 55.72 1aiw s SER 15 Cb 0.08 0.72 0.01 0.00 -1.71 0.00 0.00 66.02 65.12 1aiw s SER 15 CO 0.77 -1.38 0.11 1.17 1.20 0.00 0.00 173.24 175.12 1aiw n LYS 16 N -0.47 1.18 0.17 5.44 0.00 -1.26 -0.91 118.16 122.30 1aiw n LYS 16 Ca -0.04 -0.69 0.02 0.00 0.00 0.00 0.00 58.31 57.60 1aiw n LYS 16 Cb 0.60 0.03 0.34 0.00 0.00 0.00 0.00 35.03 36.00 1aiw n LYS 16 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 1aiw h ASP 17 N 0.10 0.06 -4.40 3.14 3.58 -1.93 -3.44 116.42 113.52 1aiw h ASP 17 Ca -0.07 -0.02 -0.37 0.00 0.42 0.00 0.00 57.03 56.99 1aiw h ASP 17 Cb 0.26 -0.02 -0.20 0.00 1.72 0.00 0.00 39.33 41.10 1aiw h ASP 17 CO 0.10 0.42 -0.76 -1.66 -2.88 0.00 0.00 179.24 174.46 1aiw s TRP 18 N -4.23 1.15 0.10 0.28 1.48 -1.26 -5.09 118.94 111.38 1aiw s TRP 18 Ca -0.03 -0.54 -0.19 0.00 -1.06 0.00 0.00 56.10 54.27 1aiw s TRP 18 Cb 0.14 -0.63 -0.04 0.00 -1.16 0.00 0.00 33.47 31.78 1aiw s TRP 18 CO 0.73 0.04 1.27 0.00 -4.06 0.00 0.00 176.95 174.94 1aiw n ALA 19 N 0.94 -0.40 1.98 2.67 0.00 -1.26 -1.26 120.51 123.19 1aiw n ALA 19 Ca -0.19 0.53 0.10 0.00 0.00 0.00 0.00 53.44 53.89 1aiw n ALA 19 Cb 0.56 0.07 0.62 0.00 0.00 0.00 0.00 19.45 20.70 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 -1.16 -0.99 3.79 0.00 0.00 -1.26 -4.85 105.19 100.73 1aiw n GLY 20 Ca 0.01 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 1aiw n GLY 20 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aiw s GLY 21 N -1.67 2.65 -0.15 -0.02 0.00 -0.39 -4.99 107.32 102.76 1aiw s GLY 21 Ca 0.31 0.64 -0.29 0.00 0.00 0.00 0.00 44.72 45.38 1aiw s GLY 21 CO 0.24 1.03 1.30 1.20 0.00 0.00 0.00 173.10 176.87 1aiw s GLN 22 N -2.71 4.23 0.91 2.90 -0.21 -1.26 -4.35 119.66 119.16 1aiw s GLN 22 Ca 0.60 1.72 -0.16 0.00 0.02 0.00 0.00 55.36 57.54 1aiw s GLN 22 Cb -0.19 -3.78 -0.14 0.00 1.00 0.00 0.00 33.01 29.90 1aiw s GLN 22 CO 0.24 -0.72 -0.72 -2.30 -2.12 0.00 0.00 175.29 169.68 1aiw n PRO 23 N 6.63 0.00 0.00 2.91 -0.02 -1.26 -4.72 135.00 138.53 1aiw n PRO 23 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1aiw n PRO 23 Cb 0.45 -0.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.99 1aiw n PRO 23 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1aiw n THR 24 N -2.29 0.00 0.00 3.45 -1.04 -0.26 -4.83 114.28 109.31 1aiw n THR 24 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1aiw n THR 24 Cb 0.52 0.76 0.00 0.00 -1.82 0.00 0.00 70.33 69.79 1aiw n THR 24 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1aiw n HIS 25 N 0.00 0.00 -4.59 -1.42 1.44 -0.08 -4.60 115.22 105.97 1aiw n HIS 25 Ca 0.00 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.37 1aiw n HIS 25 Cb 0.32 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.32 1aiw n HIS 25 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1aiw s ASN 26 N 0.00 4.70 0.41 4.39 -0.87 -0.02 -1.79 114.94 121.75 1aiw s ASN 26 Ca 0.00 -0.02 0.08 0.00 -1.57 0.00 0.00 52.86 51.35 1aiw s ASN 26 Cb 0.00 -1.25 -0.02 0.00 -0.02 0.00 0.00 41.25 39.96 1aiw s ASN 26 CO 0.00 0.35 0.39 -1.61 -2.57 0.00 0.00 177.10 173.65 1aiw s GLU 27 N -0.70 2.59 -0.26 -0.60 2.02 -1.26 -0.94 118.70 119.55 1aiw s GLU 27 Ca 0.11 -1.47 -0.43 0.00 0.02 0.00 0.00 54.97 53.20 1aiw s GLU 27 Cb -0.11 -2.43 -0.19 0.00 0.10 0.00 0.00 34.13 31.49 1aiw s GLU 27 CO 0.02 -0.16 1.45 0.00 0.02 0.00 0.00 175.26 176.59 1aiw n ALA 28 N -1.56 -1.76 0.00 5.21 0.00 0.13 -0.30 120.51 122.24 1aiw n ALA 28 Ca 0.03 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1aiw n ALA 28 Cb 0.61 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.12 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 3.18 2.95 3.70 0.00 0.00 0.19 -4.94 105.19 110.28 1aiw n GLY 29 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.11 4.41 0.32 1.61 -1.52 0.60 -4.77 119.66 120.20 1aiw s GLN 30 Ca 0.00 1.71 0.07 0.00 -1.95 0.00 0.00 55.36 55.19 1aiw s GLN 30 Cb 0.00 -3.44 -0.01 0.00 -0.22 0.00 0.00 33.01 29.34 1aiw s GLN 30 CO 0.00 -0.31 0.44 -1.12 -0.25 0.00 0.00 175.29 174.04 1aiw s SER 31 N 1.22 5.93 0.28 5.90 0.01 -1.26 -1.89 113.70 123.89 1aiw s SER 31 Ca 0.57 -0.20 -0.20 0.00 1.31 0.00 0.00 55.95 57.43 1aiw s SER 31 Cb -0.27 -1.26 0.04 0.00 0.21 0.00 0.00 66.02 64.74 1aiw s SER 31 CO 0.26 -0.38 0.80 -0.51 0.41 0.00 0.00 173.24 173.82 1aiw s ILE 32 N -2.17 0.00 0.16 1.44 2.07 0.27 -4.76 121.20 118.21 1aiw s ILE 32 Ca 0.43 -0.92 0.10 0.00 -1.41 0.00 0.00 60.65 58.86 1aiw s ILE 32 Cb -0.09 -2.31 -0.04 0.00 0.13 0.00 0.00 42.46 40.14 1aiw s ILE 32 CO 0.30 0.00 -0.23 -0.69 -1.91 0.00 0.00 174.94 172.42 1aiw s VAL 33 N -3.24 2.12 -0.28 4.00 1.01 0.79 -0.49 120.40 124.32 1aiw s VAL 33 Ca 0.13 -1.90 -0.05 0.00 0.00 0.00 0.00 61.98 60.17 1aiw s VAL 33 Cb -0.05 -1.96 0.15 0.00 0.00 0.00 0.00 36.38 34.52 1aiw s VAL 33 CO 0.07 -0.12 0.57 -0.47 0.00 0.00 0.00 175.10 175.15 1aiw s TYR 34 N -1.60 -1.34 -0.37 5.22 5.04 -0.18 -1.47 117.35 122.64 1aiw s TYR 34 Ca 0.17 1.78 -0.32 0.00 -2.44 0.00 0.00 57.07 56.26 1aiw s TYR 34 Cb -0.08 0.55 0.05 0.00 0.35 0.00 0.00 41.96 42.82 1aiw s TYR 34 CO 0.08 -0.75 0.55 1.63 -1.34 0.00 0.00 175.55 175.72 1aiw n LYS 35 N 5.42 -1.69 0.00 4.97 5.02 -1.26 -2.76 118.16 127.86 1aiw n LYS 35 Ca -0.06 1.36 0.00 0.00 -2.02 0.00 0.00 58.31 57.60 1aiw n LYS 35 Cb 0.50 -2.04 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 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 0.06 0.63 3.79 0.72 0.00 -1.09 -4.92 105.19 104.38 1aiw n GLY 36 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 6.73 -0.18 1.61 0.01 -1.11 -1.03 114.94 120.98 1aiw s ASN 37 Ca 0.00 2.00 -0.06 0.00 -0.71 0.00 0.00 52.86 54.09 1aiw s ASN 37 Cb 0.00 -2.58 -0.03 0.00 0.41 0.00 0.00 41.25 39.05 1aiw s ASN 37 CO 0.00 -0.51 0.02 -0.22 -1.51 0.00 0.00 177.10 174.88 1aiw s LEU 38 N -2.76 3.55 0.17 0.60 2.96 0.26 -1.01 118.68 122.45 1aiw s LEU 38 Ca 0.59 -0.03 0.04 0.00 -0.22 0.00 0.00 54.13 54.51 1aiw s LEU 38 Cb -0.20 -1.89 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 1aiw s LEU 38 CO 0.26 0.16 -0.05 -0.31 -1.32 0.00 0.00 176.35 175.08 1aiw s TYR 39 N 0.46 1.32 0.02 5.38 1.51 0.36 -0.77 117.35 125.63 1aiw s TYR 39 Ca 0.00 -0.87 0.03 0.00 -1.01 0.00 0.00 57.07 55.22 1aiw s TYR 39 Cb -0.13 -0.72 -0.01 0.00 -0.11 0.00 0.00 41.96 40.98 1aiw s TYR 39 CO 0.02 -0.02 -0.08 0.99 -1.11 0.00 0.00 175.55 175.34 1aiw s THR 40 N -3.43 0.62 0.27 -0.71 2.01 0.42 -0.57 115.64 114.24 1aiw s THR 40 Ca 0.21 -0.69 -0.20 0.00 0.31 0.00 0.00 61.69 61.33 1aiw s THR 40 Cb 0.04 -0.59 -0.09 0.00 0.01 0.00 0.00 72.50 71.87 1aiw s THR 40 CO 0.03 -0.07 0.77 0.00 -0.69 0.00 0.00 174.62 174.66 1aiw s ALA 41 N -0.71 3.35 -0.01 7.40 0.00 -0.79 -1.32 121.76 129.68 1aiw s ALA 41 Ca -0.02 0.20 0.05 0.00 0.00 0.00 0.00 51.96 52.19 1aiw s ALA 41 Cb -0.06 -2.87 -0.24 0.00 0.00 0.00 0.00 23.12 19.94 1aiw s ALA 41 CO 0.00 0.30 0.79 -0.91 0.00 0.00 0.00 175.76 175.95 1aiw h ASN 42 N 3.08 0.15 0.00 0.00 2.35 -1.02 0.56 115.58 120.70 1aiw h ASN 42 Ca -0.48 -0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.03 1aiw h ASN 42 Cb 1.19 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.51 1aiw h ASN 42 CO 0.65 1.21 0.00 -2.67 -1.65 0.00 0.00 177.43 174.97 1aiw n TRP 43 N -3.25 -2.35 -3.64 1.19 2.14 -1.26 -4.54 117.44 105.73 1aiw n TRP 43 Ca -0.15 0.50 -0.10 0.00 2.07 0.00 0.00 57.50 59.81 1aiw n TRP 43 Cb 1.03 1.34 -0.07 0.00 -0.81 0.00 0.00 31.31 32.80 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 -1.48 -0.93 -0.26 -2.67 6.14 -1.26 0.21 117.35 117.10 1aiw s TYR 44 Ca 0.00 2.02 -0.27 0.00 0.64 0.00 0.00 57.07 59.46 1aiw s TYR 44 Cb 0.00 0.46 0.16 0.00 0.42 0.00 0.00 41.96 43.00 1aiw s TYR 44 CO 0.00 -0.45 1.24 -0.08 0.64 0.00 0.00 175.55 176.90 1aiw s THR 45 N 1.02 0.00 -0.05 4.34 -1.32 -0.11 -4.90 115.64 114.62 1aiw s THR 45 Ca -0.05 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.50 1aiw s THR 45 Cb -0.05 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 70.05 1aiw s THR 45 CO -0.10 0.00 1.01 0.00 -2.21 0.00 0.00 174.62 173.32 1aiw n ALA 46 N 1.31 2.00 -1.72 11.08 0.00 -1.26 -0.84 120.51 131.08 1aiw n ALA 46 Ca -0.08 -1.56 -0.30 0.00 0.00 0.00 0.00 53.44 51.50 1aiw n ALA 46 Cb 0.57 -0.19 0.08 0.00 0.00 0.00 0.00 19.45 19.91 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 -1.60 4.76 -0.06 0.00 0.01 -1.26 -4.94 113.70 110.60 1aiw s SER 47 Ca 0.12 1.14 -0.32 0.00 1.31 0.00 0.00 55.95 58.20 1aiw s SER 47 Cb 0.11 -1.85 -0.10 0.00 0.21 0.00 0.00 66.02 64.38 1aiw s SER 47 CO 0.01 -1.78 1.97 0.52 0.41 0.00 0.00 173.24 174.37 1aiw n VAL 48 N -3.29 0.62 -1.67 3.43 0.31 -1.26 -4.85 118.33 111.62 1aiw n VAL 48 Ca 0.07 -0.16 -0.51 0.00 -0.01 0.00 0.00 64.34 63.73 1aiw n VAL 48 Cb 0.57 -2.11 -0.05 0.00 -0.91 0.00 0.00 33.84 31.34 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 7.27 1.84 0.00 5.55 -0.02 -1.26 -0.67 135.00 147.70 1aiw n PRO 49 Ca 0.23 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 1aiw n PRO 49 Cb 0.35 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 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 4.53 1.59 3.58 -1.23 0.00 -1.26 -4.81 105.19 107.60 1aiw n GLY 50 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 1aiw n GLY 50 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aiw s SER 51 N -0.87 5.67 0.20 1.61 0.15 0.16 -4.91 113.70 115.71 1aiw s SER 51 Ca 0.00 -1.95 -0.28 0.00 0.70 0.00 0.00 55.95 54.42 1aiw s SER 51 Cb 0.00 -2.59 -0.17 0.00 -1.71 0.00 0.00 66.02 61.56 1aiw s SER 51 CO 0.00 -2.40 0.59 -0.90 1.20 0.00 0.00 173.24 171.73 1aiw n ASP 52 N 12.26 -0.91 0.00 5.45 5.75 -1.26 -4.51 116.55 133.32 1aiw n ASP 52 Ca 0.46 1.14 0.00 0.00 -0.01 0.00 0.00 54.79 56.38 1aiw n ASP 52 Cb 0.46 -0.99 0.00 0.00 -1.03 0.00 0.00 41.12 39.56 1aiw n ASP 52 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1aiw n SER 53 N 1.90 0.00 -0.05 -1.12 2.88 -1.26 -4.87 113.62 111.09 1aiw n SER 53 Ca 0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 1aiw n SER 53 Cb 0.25 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.71 1aiw n SER 53 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1aiw n SER 54 N 0.00 0.00 -4.61 -3.46 2.88 -1.26 -5.04 113.62 102.13 1aiw n SER 54 Ca 0.00 -1.07 -0.25 0.00 -1.33 0.00 0.00 58.87 56.21 1aiw n SER 54 Cb 0.00 -0.01 -0.08 0.00 -0.75 0.00 0.00 64.21 63.36 1aiw n SER 54 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1aiw s TRP 55 N 0.00 2.68 -0.20 0.66 0.52 -1.26 -0.41 118.94 120.93 1aiw s TRP 55 Ca 0.00 -0.21 -0.09 0.00 0.02 0.00 0.00 56.10 55.82 1aiw s TRP 55 Cb 0.00 -1.26 0.08 0.00 -1.15 0.00 0.00 33.47 31.13 1aiw s TRP 55 CO 0.00 0.55 0.46 0.99 0.02 0.00 0.00 176.95 178.98 1aiw s THR 56 N -1.93 -0.29 0.30 2.01 2.01 -0.43 -4.67 115.64 112.64 1aiw s THR 56 Ca 0.28 0.10 -0.29 0.00 0.31 0.00 0.00 61.69 62.09 1aiw s THR 56 Cb -0.08 -0.70 -0.10 0.00 0.01 0.00 0.00 72.50 71.63 1aiw s THR 56 CO 0.17 0.04 1.14 -1.58 -0.69 0.00 0.00 174.62 173.70 1aiw s GLN 57 N 1.93 4.53 -0.00 4.92 0.74 -1.26 -0.44 119.66 130.08 1aiw s GLN 57 Ca -0.07 1.86 0.04 0.00 0.05 0.00 0.00 55.36 57.24 1aiw s GLN 57 Cb -0.09 -3.10 -0.06 0.00 1.10 0.00 0.00 33.01 30.86 1aiw s GLN 57 CO -0.14 0.09 0.11 1.33 -0.55 0.00 0.00 175.29 176.13 1aiw n VAL 58 N 0.99 0.00 -2.71 1.34 0.24 0.05 -4.88 118.33 113.37 1aiw n VAL 58 Ca -0.00 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1aiw n VAL 58 Cb 0.45 0.58 0.00 0.00 -1.47 0.00 0.00 33.84 33.40 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 1.94 -0.53 3.41 7.63 0.00 -1.08 -5.00 105.19 111.55 1aiw n GLY 59 Ca -0.00 -0.86 -0.14 0.00 0.00 0.00 0.00 46.02 45.02 1aiw n GLY 59 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1aiw s SER 60 N -4.00 -0.53 -0.13 1.61 0.01 -1.26 -0.57 113.70 108.83 1aiw s SER 60 Ca 0.00 0.99 -0.15 0.00 1.31 0.00 0.00 55.95 58.09 1aiw s SER 60 Cb 0.00 1.00 -0.25 0.00 0.21 0.00 0.00 66.02 66.98 1aiw s SER 60 CO 0.00 -0.20 0.45 0.00 0.41 0.00 0.00 173.24 173.90