#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aiw s GLY 2 N 0.00 -0.37 0.52 -5.12 0.00 -0.11 -4.79 107.32 97.45 1aiw s GLY 2 Ca 0.00 0.76 0.31 0.00 0.00 0.00 0.00 44.72 45.79 1aiw s GLY 2 CO 0.00 0.23 1.88 -0.55 0.00 0.00 0.00 173.10 174.66 1aiw h ASP 3 N 2.00 0.05 0.23 1.64 5.19 -1.89 0.28 116.42 123.92 1aiw h ASP 3 Ca -0.22 0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.19 1aiw h ASP 3 Cb 1.23 -0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.73 1aiw h ASP 3 CO 0.28 0.01 -0.13 0.00 -3.12 0.00 0.00 179.24 176.29 1aiw n ALA 5 N -2.27 0.00 -2.04 0.00 0.00 1.00 -4.91 120.51 112.28 1aiw n ALA 5 Ca -0.09 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.30 1aiw n ALA 5 Cb 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.57 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 -0.64 -4.86 0.00 6.94 -1.24 -0.94 115.26 114.51 1aiw n ASN 6 Ca 0.00 -1.83 -0.22 0.00 -0.02 0.00 0.00 54.58 52.51 1aiw n ASN 6 Cb 0.00 0.19 0.09 0.00 -2.36 0.00 0.00 39.78 37.70 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 0.00 4.30 -0.59 -2.53 0.00 -1.26 -4.52 121.76 117.16 1aiw s ALA 7 Ca 0.03 -2.04 -0.26 0.00 0.00 0.00 0.00 51.96 49.69 1aiw s ALA 7 Cb 0.03 -1.66 -0.06 0.00 0.00 0.00 0.00 23.12 21.43 1aiw s ALA 7 CO -0.01 -1.19 2.22 -0.80 0.00 0.00 0.00 175.76 175.97 1aiw s ASN 8 N -4.74 4.65 -0.11 0.00 -0.87 -1.26 -4.64 114.94 107.97 1aiw s ASN 8 Ca 0.65 0.61 -0.03 0.00 -1.57 0.00 0.00 52.86 52.51 1aiw s ASN 8 Cb -0.05 -2.52 -0.03 0.00 -0.02 0.00 0.00 41.25 38.63 1aiw s ASN 8 CO 0.42 -2.86 0.02 0.54 -2.57 0.00 0.00 177.10 172.65 1aiw s VAL 9 N 11.51 4.48 0.17 1.60 0.11 -1.26 -0.47 120.40 136.53 1aiw s VAL 9 Ca 0.86 -0.18 -0.32 0.00 -2.93 0.00 0.00 61.98 59.41 1aiw s VAL 9 Cb -0.14 -2.92 -0.16 0.00 -1.53 0.00 0.00 36.38 31.63 1aiw s VAL 9 CO 0.20 0.58 1.04 0.00 -3.33 0.00 0.00 175.10 173.58 1aiw n TYR 10 N 2.46 0.96 -0.67 1.54 9.36 0.27 -0.39 117.16 130.69 1aiw n TYR 10 Ca -0.18 0.77 -0.18 0.00 3.32 0.00 0.00 57.90 61.62 1aiw n TYR 10 Cb 0.53 -2.21 0.12 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 1.48 1.94 -1.15 2.98 -0.04 -1.26 -4.97 135.00 133.97 1aiw n PRO 11 Ca 0.15 -2.18 -0.34 0.00 -0.04 0.00 0.00 63.50 61.09 1aiw n PRO 11 Cb 0.24 -1.86 -0.03 0.00 -0.04 0.00 0.00 33.50 31.81 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 -0.62 7.69 -4.54 3.54 3.02 0.48 -4.82 115.26 120.02 1aiw n ASN 12 Ca 0.43 -2.50 -0.33 0.00 -0.03 0.00 0.00 54.58 52.15 1aiw n ASN 12 Cb 1.24 -1.43 0.12 0.00 -0.61 0.00 0.00 39.78 39.10 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 3.72 -0.26 -0.05 3.10 7.02 -1.26 -4.54 117.44 125.16 1aiw n TRP 13 Ca 0.69 0.33 -0.15 0.00 -1.02 0.00 0.00 57.50 57.34 1aiw n TRP 13 Cb 0.22 -1.93 -0.13 0.00 -2.42 0.00 0.00 31.31 27.05 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 -1.22 1.72 -3.84 -0.99 2.07 -1.85 -3.43 116.25 108.70 1aiw h VAL 14 Ca -0.44 -2.37 -0.49 0.00 0.82 0.00 0.00 66.70 64.21 1aiw h VAL 14 Cb 1.30 3.32 0.01 0.00 -1.52 0.00 0.00 31.29 34.40 1aiw h VAL 14 CO 0.40 0.62 0.19 -0.55 0.02 0.00 0.00 177.57 178.25 1aiw s SER 15 N -6.36 6.57 0.32 0.57 0.15 0.53 -4.95 113.70 110.54 1aiw s SER 15 Ca -0.19 1.27 0.05 0.00 0.70 0.00 0.00 55.95 57.79 1aiw s SER 15 Cb -0.02 -2.38 -0.06 0.00 -1.71 0.00 0.00 66.02 61.84 1aiw s SER 15 CO 0.71 -0.44 0.01 -0.54 1.20 0.00 0.00 173.24 174.18 1aiw s LYS 16 N -3.83 1.66 0.38 5.44 1.02 -1.26 -0.55 119.74 122.60 1aiw s LYS 16 Ca 0.54 -1.90 0.11 0.00 0.02 0.00 0.00 55.97 54.73 1aiw s LYS 16 Cb -0.10 -1.09 0.75 0.00 -0.52 0.00 0.00 37.83 36.88 1aiw s LYS 16 CO 0.30 -0.09 1.87 -0.44 -0.92 0.00 0.00 175.35 176.08 1aiw h ASP 17 N 2.12 0.14 -4.97 2.83 3.32 -1.88 -3.45 116.42 114.52 1aiw h ASP 17 Ca -0.41 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 1aiw h ASP 17 Cb 1.24 -0.04 -0.12 0.00 0.22 0.00 0.00 39.33 40.63 1aiw h ASP 17 CO 0.71 0.39 0.23 -1.66 -1.72 0.00 0.00 179.24 177.18 1aiw s TRP 18 N -4.50 -0.52 0.12 4.55 1.48 -1.26 -5.03 118.94 113.78 1aiw s TRP 18 Ca -0.04 0.31 -0.23 0.00 -1.06 0.00 0.00 56.10 55.08 1aiw s TRP 18 Cb 0.15 0.56 -0.05 0.00 -1.16 0.00 0.00 33.47 32.97 1aiw s TRP 18 CO 0.73 -0.83 1.30 0.00 -4.06 0.00 0.00 176.95 174.09 1aiw n ALA 19 N -0.37 -0.47 0.52 2.67 0.00 -1.26 -0.47 120.51 121.12 1aiw n ALA 19 Ca -0.16 0.63 0.05 0.00 0.00 0.00 0.00 53.44 53.95 1aiw n ALA 19 Cb 0.65 -0.02 0.18 0.00 0.00 0.00 0.00 19.45 20.25 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 -1.18 1.35 0.00 0.00 0.00 -1.26 -4.92 105.19 99.18 1aiw n GLY 20 Ca 0.01 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.74 -0.63 3.96 -0.02 0.00 0.38 -5.10 105.19 104.52 1aiw n GLY 21 Ca 0.13 -1.74 -0.22 0.00 0.00 0.00 0.00 46.02 44.19 1aiw n GLY 21 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aiw s GLN 22 N -2.64 3.40 0.47 1.61 -0.21 -1.26 -4.93 119.66 116.10 1aiw s GLN 22 Ca 0.00 -0.59 -0.22 0.00 0.02 0.00 0.00 55.36 54.57 1aiw s GLN 22 Cb 0.00 -2.77 -0.10 0.00 1.00 0.00 0.00 33.01 31.15 1aiw s GLN 22 CO 0.00 0.23 0.88 -2.30 -2.12 0.00 0.00 175.29 171.98 1aiw n PRO 23 N -1.64 1.06 0.00 2.91 -0.02 -1.26 -3.66 135.00 132.39 1aiw n PRO 23 Ca -0.06 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1aiw n PRO 23 Cb 0.57 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 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 -0.90 0.00 0.00 3.45 -1.04 0.29 -4.83 114.28 111.25 1aiw n THR 24 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1aiw n THR 24 Cb 0.42 -0.29 0.00 0.00 -1.82 0.00 0.00 70.33 68.64 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 -0.93 0.00 -4.66 -1.42 1.44 -1.00 -4.85 115.22 103.79 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 0.14 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.14 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 4.53 0.38 4.39 -0.87 0.15 -0.34 114.94 123.17 1aiw s ASN 26 Ca 0.00 -0.06 0.08 0.00 -1.57 0.00 0.00 52.86 51.30 1aiw s ASN 26 Cb 0.00 -1.10 -0.03 0.00 -0.02 0.00 0.00 41.25 40.10 1aiw s ASN 26 CO 0.00 0.35 0.25 -1.61 -2.57 0.00 0.00 177.10 173.53 1aiw s GLU 27 N -0.84 2.45 -0.41 -0.60 2.02 -1.26 -0.73 118.70 119.33 1aiw s GLU 27 Ca 0.13 -1.56 -0.45 0.00 0.02 0.00 0.00 54.97 53.10 1aiw s GLU 27 Cb -0.11 -2.25 -0.19 0.00 0.10 0.00 0.00 34.13 31.68 1aiw s GLU 27 CO 0.02 -0.04 1.58 0.00 0.02 0.00 0.00 175.26 176.83 1aiw n ALA 28 N -1.34 -1.35 0.00 5.21 0.00 0.11 -0.25 120.51 122.89 1aiw n ALA 28 Ca -0.00 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1aiw n ALA 28 Cb 0.62 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 18.11 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 3.79 1.79 3.68 0.00 0.00 0.50 -4.95 105.19 110.00 1aiw n GLY 29 Ca 0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.49 4.35 0.49 1.61 -0.21 0.65 -4.80 119.66 121.26 1aiw s GLN 30 Ca 0.00 1.26 -0.03 0.00 0.02 0.00 0.00 55.36 56.61 1aiw s GLN 30 Cb 0.00 -3.57 -0.01 0.00 1.00 0.00 0.00 33.01 30.43 1aiw s GLN 30 CO 0.00 -0.38 0.77 -1.54 -2.12 0.00 0.00 175.29 172.02 1aiw s SER 31 N 1.13 5.95 0.06 5.90 1.04 -1.26 -1.17 113.70 125.36 1aiw s SER 31 Ca 0.44 0.66 -0.27 0.00 0.48 0.00 0.00 55.95 57.26 1aiw s SER 31 Cb -0.17 -1.88 0.09 0.00 0.10 0.00 0.00 66.02 64.15 1aiw s SER 31 CO 0.14 -0.73 0.98 -0.51 0.98 0.00 0.00 173.24 174.10 1aiw s ILE 32 N -2.73 0.00 0.33 -1.02 2.07 0.23 -4.75 121.20 115.33 1aiw s ILE 32 Ca 0.49 -0.35 0.10 0.00 -1.41 0.00 0.00 60.65 59.47 1aiw s ILE 32 Cb -0.10 -1.59 -0.06 0.00 0.13 0.00 0.00 42.46 40.84 1aiw s ILE 32 CO 0.42 0.00 -0.08 -0.69 -1.91 0.00 0.00 174.94 172.69 1aiw s VAL 33 N -3.10 2.44 0.20 4.00 1.01 0.38 -0.51 120.40 124.82 1aiw s VAL 33 Ca 0.10 -2.16 0.00 0.00 0.00 0.00 0.00 61.98 59.92 1aiw s VAL 33 Cb -0.01 -2.64 0.00 0.00 0.00 0.00 0.00 36.38 33.73 1aiw s VAL 33 CO -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 175.10 174.83 1aiw n TYR 34 N -0.82 -1.46 -3.31 5.22 9.36 -1.14 -0.56 117.16 124.44 1aiw n TYR 34 Ca -0.05 0.26 -0.08 0.00 3.32 0.00 0.00 57.90 61.35 1aiw n TYR 34 Cb 0.62 0.35 -0.07 0.00 -0.63 0.00 0.00 39.34 39.62 1aiw n TYR 34 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 1aiw s LYS 35 N -1.92 0.39 0.00 2.98 -2.85 -1.26 -4.60 119.74 112.48 1aiw s LYS 35 Ca 0.00 0.45 0.00 0.00 -1.00 0.00 0.00 55.97 55.42 1aiw s LYS 35 Cb 0.00 -0.32 0.00 0.00 -2.06 0.00 0.00 37.83 35.45 1aiw s LYS 35 CO 0.00 -0.77 0.00 0.41 0.10 0.00 0.00 175.35 175.09 1aiw n GLY 36 N 5.37 0.61 3.83 0.59 0.00 -1.26 -4.89 105.19 109.44 1aiw n GLY 36 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 6.93 -0.16 1.61 0.01 -1.26 -0.55 114.94 121.52 1aiw s ASN 37 Ca 0.00 1.26 -0.10 0.00 -0.71 0.00 0.00 52.86 53.31 1aiw s ASN 37 Cb 0.00 -2.36 -0.05 0.00 0.41 0.00 0.00 41.25 39.25 1aiw s ASN 37 CO 0.00 0.04 0.17 -0.22 -1.51 0.00 0.00 177.10 175.58 1aiw s LEU 38 N -2.07 4.28 0.08 0.60 2.96 0.44 -2.88 118.68 122.09 1aiw s LEU 38 Ca 0.42 0.37 0.03 0.00 -0.22 0.00 0.00 54.13 54.73 1aiw s LEU 38 Cb -0.15 -2.15 -0.03 0.00 0.50 0.00 0.00 46.19 44.36 1aiw s LEU 38 CO 0.20 0.24 -0.09 -0.31 -1.32 0.00 0.00 176.35 175.07 1aiw s TYR 39 N -0.07 0.93 -0.04 5.38 1.51 0.34 -0.82 117.35 124.57 1aiw s TYR 39 Ca 0.12 -0.63 0.04 0.00 -1.01 0.00 0.00 57.07 55.59 1aiw s TYR 39 Cb -0.12 -0.52 -0.00 0.00 -0.11 0.00 0.00 41.96 41.20 1aiw s TYR 39 CO 0.01 -0.05 -0.18 0.99 -1.11 0.00 0.00 175.55 175.22 1aiw s THR 40 N -2.20 1.45 0.23 -0.71 2.01 0.21 -0.60 115.64 116.04 1aiw s THR 40 Ca 0.01 -0.73 -0.30 0.00 0.31 0.00 0.00 61.69 60.98 1aiw s THR 40 Cb -0.04 -1.25 -0.09 0.00 0.01 0.00 0.00 72.50 71.13 1aiw s THR 40 CO -0.00 0.42 1.21 0.00 -0.69 0.00 0.00 174.62 175.55 1aiw s ALA 41 N -0.00 3.45 -0.05 7.40 0.00 -0.32 -1.09 121.76 131.15 1aiw s ALA 41 Ca -0.03 1.01 -0.01 0.00 0.00 0.00 0.00 51.96 52.92 1aiw s ALA 41 Cb -0.11 -3.41 -0.26 0.00 0.00 0.00 0.00 23.12 19.33 1aiw s ALA 41 CO 0.02 -0.38 0.63 -0.91 0.00 0.00 0.00 175.76 175.12 1aiw h ASN 42 N 4.61 0.33 0.00 0.00 -0.26 -1.84 0.14 115.58 118.56 1aiw h ASN 42 Ca -0.46 -0.60 0.00 0.00 -0.56 0.00 0.00 56.30 54.68 1aiw h ASN 42 Cb 1.22 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 38.37 1aiw h ASN 42 CO 0.72 1.52 0.00 -2.67 -1.06 0.00 0.00 177.43 175.94 1aiw n TRP 43 N -3.38 0.00 -3.64 1.19 2.14 -1.26 -4.47 117.44 108.01 1aiw n TRP 43 Ca -0.23 0.00 -0.07 0.00 2.07 0.00 0.00 57.50 59.27 1aiw n TRP 43 Cb 1.05 0.43 -0.07 0.00 -0.81 0.00 0.00 31.31 31.90 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 -0.92 -1.04 -0.10 -2.67 6.14 -1.26 0.05 117.35 117.56 1aiw s TYR 44 Ca 0.00 2.09 -0.30 0.00 0.64 0.00 0.00 57.07 59.50 1aiw s TYR 44 Cb 0.00 0.61 0.10 0.00 0.42 0.00 0.00 41.96 43.09 1aiw s TYR 44 CO 0.00 -0.52 0.87 -0.08 0.64 0.00 0.00 175.55 176.46 1aiw s THR 45 N 1.59 0.00 -0.00 4.34 -1.32 0.09 -4.97 115.64 115.36 1aiw s THR 45 Ca -0.10 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.38 1aiw s THR 45 Cb -0.05 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 1aiw s THR 45 CO -0.19 0.00 0.97 0.00 -2.21 0.00 0.00 174.62 173.19 1aiw n ALA 46 N 0.65 1.94 -2.05 11.08 0.00 -1.26 -0.68 120.51 130.20 1aiw n ALA 46 Ca -0.13 -0.98 -0.27 0.00 0.00 0.00 0.00 53.44 52.06 1aiw n ALA 46 Cb 0.58 -0.47 0.03 0.00 0.00 0.00 0.00 19.45 19.60 1aiw n ALA 46 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1aiw s SER 47 N -0.95 5.55 -0.04 0.00 1.04 -1.26 -4.98 113.70 113.07 1aiw s SER 47 Ca 0.00 0.78 -0.32 0.00 0.48 0.00 0.00 55.95 56.89 1aiw s SER 47 Cb 0.00 -1.73 -0.10 0.00 0.10 0.00 0.00 66.02 64.29 1aiw s SER 47 CO 0.00 -1.12 1.95 0.52 0.98 0.00 0.00 173.24 175.57 1aiw n VAL 48 N -2.66 0.67 -1.64 5.02 0.31 -1.26 -4.84 118.33 113.92 1aiw n VAL 48 Ca 0.05 -0.14 -0.55 0.00 -0.01 0.00 0.00 64.34 63.69 1aiw n VAL 48 Cb 0.58 -2.12 -0.07 0.00 -0.91 0.00 0.00 33.84 31.32 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 7.20 1.10 0.00 5.55 -0.02 -1.26 -0.82 135.00 146.75 1aiw n PRO 49 Ca 0.22 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1aiw n PRO 49 Cb 0.36 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 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 3.25 0.96 2.85 -1.23 0.00 -1.26 -4.86 105.19 104.90 1aiw n GLY 50 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1aiw n GLY 50 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aiw n SER 51 N 0.00 3.52 0.00 1.61 2.88 0.00 -4.90 113.62 116.73 1aiw n SER 51 Ca 0.00 -2.76 0.00 0.00 -1.33 0.00 0.00 58.87 54.78 1aiw n SER 51 Cb 0.00 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.02 1aiw n SER 51 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1aiw n ASP 52 N 6.51 0.00 0.00 -3.46 8.00 -1.26 -4.80 116.55 121.54 1aiw n ASP 52 Ca 0.52 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.02 1aiw n ASP 52 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 1aiw n ASP 52 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1aiw n SER 53 N 2.24 0.00 0.00 -2.24 2.88 -1.26 -3.67 113.62 111.57 1aiw n SER 53 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1aiw n SER 53 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1aiw n SER 53 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1aiw n SER 54 N 2.85 0.00 0.00 -3.46 3.41 -1.26 -4.94 113.62 110.22 1aiw n SER 54 Ca 0.00 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 1aiw n SER 54 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1aiw n SER 54 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1aiw n TRP 55 N -0.47 0.00 -3.04 7.33 5.03 -1.24 -4.69 117.44 120.36 1aiw n TRP 55 Ca 0.00 0.00 -0.42 0.00 3.03 0.00 0.00 57.50 60.11 1aiw n TRP 55 Cb 0.00 0.00 -0.06 0.00 -1.03 0.00 0.00 31.31 30.22 1aiw n TRP 55 CO 0.00 0.00 0.00 0.99 -0.03 0.00 0.00 177.69 178.65 1aiw s THR 56 N 0.00 4.82 0.18 -0.99 2.01 -0.25 -4.63 115.64 116.78 1aiw s THR 56 Ca 0.00 0.72 -0.31 0.00 0.31 0.00 0.00 61.69 62.41 1aiw s THR 56 Cb 0.00 -4.13 -0.09 0.00 0.01 0.00 0.00 72.50 68.29 1aiw s THR 56 CO 0.00 -0.36 1.40 -1.58 -0.69 0.00 0.00 174.62 173.38 1aiw s GLN 57 N 2.88 4.32 -0.01 4.92 0.74 -1.26 -0.62 119.66 130.63 1aiw s GLN 57 Ca 0.27 2.16 0.04 0.00 0.05 0.00 0.00 55.36 57.88 1aiw s GLN 57 Cb -0.14 -3.18 0.10 0.00 1.10 0.00 0.00 33.01 30.89 1aiw s GLN 57 CO 0.16 -0.39 1.08 1.33 -0.55 0.00 0.00 175.29 176.92 1aiw n VAL 58 N 3.08 1.05 0.00 1.34 0.24 0.00 -4.92 118.33 119.12 1aiw n VAL 58 Ca 0.09 -1.06 0.00 0.00 -2.04 0.00 0.00 64.34 61.33 1aiw n VAL 58 Cb 0.41 0.46 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 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 -0.27 0.45 3.92 7.63 0.00 -1.23 -4.94 105.19 110.74 1aiw n GLY 59 Ca 0.04 -2.17 -0.27 0.00 0.00 0.00 0.00 46.02 43.62 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 5.22 0.28 1.61 1.04 -1.26 -0.42 113.70 116.17 1aiw s SER 60 Ca 0.00 0.66 0.02 0.00 0.48 0.00 0.00 55.95 57.11 1aiw s SER 60 Cb 0.00 -1.47 0.65 0.00 0.10 0.00 0.00 66.02 65.30 1aiw s SER 60 CO 0.00 -1.34 1.74 0.00 0.98 0.00 0.00 173.24 174.62