#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 -0.35 2.66 3.03 0.00 -1.26 -2.74 105.19 106.53 1aiw n GLY 2 Ca 0.00 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1aiw n GLY 2 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1aiw n ASP 3 N -1.44 4.92 0.00 1.61 5.75 -1.26 -4.09 116.55 122.03 1aiw n ASP 3 Ca -0.18 -2.82 0.00 0.00 -0.01 0.00 0.00 54.79 51.78 1aiw n ASP 3 Cb 0.65 -1.62 0.00 0.00 -1.03 0.00 0.00 41.12 39.11 1aiw n ASP 3 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1aiw h ALA 5 N 0.00 1.84 -0.92 0.00 0.00 -1.93 0.81 119.26 119.06 1aiw h ALA 5 Ca 0.00 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.03 1aiw h ALA 5 Cb 0.00 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 1aiw h ALA 5 CO 0.00 -0.53 0.59 -0.91 0.00 0.00 0.00 179.25 178.40 1aiw h ASN 6 N 0.00 0.75 -2.78 0.00 2.35 -2.01 -3.40 115.58 110.49 1aiw h ASN 6 Ca 0.12 0.04 -0.57 0.00 -0.55 0.00 0.00 56.30 55.34 1aiw h ASN 6 Cb 0.91 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 39.14 1aiw h ASN 6 CO -0.00 0.39 -0.45 0.00 -1.65 0.00 0.00 177.43 175.72 1aiw s ALA 7 N -5.77 3.95 -0.22 -0.83 0.00 0.28 -5.03 121.76 114.13 1aiw s ALA 7 Ca -0.11 -0.90 -0.40 0.00 0.00 0.00 0.00 51.96 50.56 1aiw s ALA 7 Cb 0.22 -1.86 -0.16 0.00 0.00 0.00 0.00 23.12 21.32 1aiw s ALA 7 CO 0.79 0.64 1.62 0.09 0.00 0.00 0.00 175.76 178.91 1aiw n ASN 8 N -0.20 2.02 -4.51 0.00 4.13 -1.26 -4.72 115.26 110.72 1aiw n ASN 8 Ca -0.06 1.10 -0.34 0.00 1.68 0.00 0.00 54.58 56.97 1aiw n ASN 8 Cb 0.53 -1.11 -0.12 0.00 -1.54 0.00 0.00 39.78 37.53 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 2.75 3.88 0.21 2.41 0.11 -1.26 -0.06 120.40 128.43 1aiw s VAL 9 Ca 0.96 -0.37 -0.31 0.00 -2.93 0.00 0.00 61.98 59.33 1aiw s VAL 9 Cb -1.10 -2.69 -0.15 0.00 -1.53 0.00 0.00 36.38 30.90 1aiw s VAL 9 CO 0.64 0.50 1.06 0.00 -3.33 0.00 0.00 175.10 173.97 1aiw n TYR 10 N 3.42 1.12 -0.17 1.54 9.36 -0.19 -0.06 117.16 132.18 1aiw n TYR 10 Ca -0.17 0.72 -0.03 0.00 3.32 0.00 0.00 57.90 61.73 1aiw n TYR 10 Cb 0.53 -2.24 0.18 0.00 -0.63 0.00 0.00 39.34 37.18 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 1.38 2.64 -1.25 2.98 -0.05 -1.26 -5.01 135.00 134.43 1aiw n PRO 11 Ca 0.14 -1.79 -0.41 0.00 -0.05 0.00 0.00 63.50 61.39 1aiw n PRO 11 Cb 0.26 -1.84 -0.04 0.00 -0.05 0.00 0.00 33.50 31.84 1aiw n PRO 11 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 1aiw n ASN 12 N 0.04 3.25 -4.45 3.54 3.02 0.91 -4.93 115.26 116.64 1aiw n ASN 12 Ca 0.23 -2.68 -0.34 0.00 -0.03 0.00 0.00 54.58 51.76 1aiw n ASN 12 Cb 0.95 -1.26 0.10 0.00 -0.61 0.00 0.00 39.78 38.97 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 6.71 -1.05 0.19 3.10 7.02 -1.26 -4.27 117.44 127.88 1aiw n TRP 13 Ca 0.51 0.29 0.10 0.00 -1.02 0.00 0.00 57.50 57.37 1aiw n TRP 13 Cb 0.37 -1.86 0.12 0.00 -2.42 0.00 0.00 31.31 27.52 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 -1.00 0.16 -4.10 -0.99 2.07 -1.83 -3.44 116.25 107.12 1aiw h VAL 14 Ca -0.44 -1.24 -0.14 0.00 0.82 0.00 0.00 66.70 65.70 1aiw h VAL 14 Cb 1.31 2.03 -0.13 0.00 -1.52 0.00 0.00 31.29 32.98 1aiw h VAL 14 CO 0.38 0.09 -0.42 -0.44 0.02 0.00 0.00 177.57 177.21 1aiw s SER 15 N -6.16 0.10 -0.22 0.57 0.01 -1.17 -4.76 113.70 102.07 1aiw s SER 15 Ca 0.05 -1.05 -0.01 0.00 1.31 0.00 0.00 55.95 56.26 1aiw s SER 15 Cb 0.06 0.42 -0.20 0.00 0.21 0.00 0.00 66.02 66.51 1aiw s SER 15 CO 0.70 -0.88 -0.04 1.17 0.41 0.00 0.00 173.24 174.59 1aiw n LYS 16 N -0.22 0.68 0.00 12.44 4.81 -1.26 -0.55 118.16 134.07 1aiw n LYS 16 Ca -0.04 0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1aiw n LYS 16 Cb 0.64 -1.58 0.00 0.00 0.02 0.00 0.00 35.03 34.10 1aiw n LYS 16 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1aiw n ASP 17 N -3.34 0.00 -4.71 3.14 2.03 -1.26 -4.40 116.55 108.01 1aiw n ASP 17 Ca -0.42 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 54.65 1aiw n ASP 17 Cb 1.01 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 41.33 1aiw n ASP 17 CO 0.00 0.00 0.00 -1.66 -1.92 0.00 0.00 177.20 173.62 1aiw s TRP 18 N 0.00 2.63 0.00 -0.67 1.48 -1.26 -5.06 118.94 116.06 1aiw s TRP 18 Ca 0.00 -0.46 -0.06 0.00 -1.06 0.00 0.00 56.10 54.52 1aiw s TRP 18 Cb 0.00 -1.70 -0.03 0.00 -1.16 0.00 0.00 33.47 30.58 1aiw s TRP 18 CO 0.00 0.33 0.85 0.00 -4.06 0.00 0.00 176.95 174.07 1aiw h ALA 19 N 1.58 -0.82 0.00 2.67 0.00 -1.96 -3.29 119.26 117.45 1aiw h ALA 19 Ca -0.43 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1aiw h ALA 19 Cb 1.25 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1aiw h ALA 19 CO 0.66 -0.80 0.00 0.41 0.00 0.00 0.00 179.25 179.52 1aiw n GLY 20 N -0.40 -0.28 3.89 0.00 0.00 -1.26 -4.49 105.19 102.65 1aiw n GLY 20 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.44 1.84 -0.02 -0.02 0.00 -1.24 -5.00 107.32 101.44 1aiw s GLY 21 Ca 0.00 -0.32 -0.33 0.00 0.00 0.00 0.00 44.72 44.07 1aiw s GLY 21 CO 0.00 -0.15 1.89 -1.06 0.00 0.00 0.00 173.10 173.78 1aiw n GLN 22 N -1.42 2.43 -1.31 2.90 6.02 -1.26 -4.22 117.38 120.53 1aiw n GLN 22 Ca 0.01 0.89 -0.37 0.00 -0.01 0.00 0.00 57.00 57.53 1aiw n GLN 22 Cb 0.54 -2.77 0.06 0.00 1.02 0.00 0.00 30.24 29.09 1aiw n GLN 22 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1aiw n PRO 23 N 6.65 0.36 0.00 -1.09 -0.02 -1.26 -4.27 135.00 135.37 1aiw n PRO 23 Ca 0.21 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1aiw n PRO 23 Cb 0.33 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 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 -2.24 0.00 0.00 3.45 -1.04 0.29 -4.78 114.28 109.96 1aiw n THR 24 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1aiw n THR 24 Cb 0.49 0.10 0.00 0.00 -1.82 0.00 0.00 70.33 69.10 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 -3.89 -1.42 1.44 -0.62 -4.83 115.22 105.89 1aiw n HIS 25 Ca 0.00 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.35 1aiw n HIS 25 Cb 0.00 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.05 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 6.37 0.41 4.39 -0.87 0.23 -3.07 114.94 122.41 1aiw s ASN 26 Ca 0.00 0.44 0.07 0.00 -1.57 0.00 0.00 52.86 51.80 1aiw s ASN 26 Cb 0.00 -2.05 -0.04 0.00 -0.02 0.00 0.00 41.25 39.14 1aiw s ASN 26 CO 0.00 0.37 0.24 -1.61 -2.57 0.00 0.00 177.10 173.53 1aiw s GLU 27 N -1.25 2.32 -0.30 -0.60 2.02 -1.26 -0.66 118.70 118.97 1aiw s GLU 27 Ca 0.18 -1.74 -0.43 0.00 0.02 0.00 0.00 54.97 53.00 1aiw s GLU 27 Cb -0.12 -2.11 -0.18 0.00 0.10 0.00 0.00 34.13 31.82 1aiw s GLU 27 CO 0.08 -0.13 1.58 0.00 0.02 0.00 0.00 175.26 176.81 1aiw n ALA 28 N -1.32 -1.09 0.00 5.21 0.00 0.10 -0.29 120.51 123.11 1aiw n ALA 28 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1aiw n ALA 28 Cb 0.64 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 18.05 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 3.68 3.10 3.72 0.00 0.00 0.49 -4.95 105.19 111.23 1aiw n GLY 29 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.56 4.54 0.36 1.61 -1.52 0.60 -4.80 119.66 119.89 1aiw s GLN 30 Ca 0.00 1.62 0.03 0.00 -1.95 0.00 0.00 55.36 55.06 1aiw s GLN 30 Cb 0.00 -3.37 -0.01 0.00 -0.22 0.00 0.00 33.01 29.41 1aiw s GLN 30 CO 0.00 -0.06 0.53 -1.54 -0.25 0.00 0.00 175.29 173.98 1aiw s SER 31 N 0.63 6.02 -0.15 5.90 1.04 -1.26 -1.31 113.70 124.57 1aiw s SER 31 Ca 0.53 0.10 -0.30 0.00 0.48 0.00 0.00 55.95 56.76 1aiw s SER 31 Cb -0.26 -1.53 0.12 0.00 0.10 0.00 0.00 66.02 64.44 1aiw s SER 31 CO 0.30 -0.45 0.94 -0.51 0.98 0.00 0.00 173.24 174.50 1aiw s ILE 32 N -2.30 0.00 0.16 -1.02 2.07 0.02 -4.67 121.20 115.47 1aiw s ILE 32 Ca 0.44 0.00 -0.00 0.00 -1.41 0.00 0.00 60.65 59.68 1aiw s ILE 32 Cb -0.10 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.45 1aiw s ILE 32 CO 0.34 0.00 0.34 -0.69 -1.91 0.00 0.00 174.94 173.02 1aiw s VAL 33 N -1.04 5.26 -0.28 4.00 1.01 0.91 -0.49 120.40 129.76 1aiw s VAL 33 Ca -0.03 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 1aiw s VAL 33 Cb -0.01 -3.71 0.15 0.00 0.00 0.00 0.00 36.38 32.81 1aiw s VAL 33 CO 0.03 -0.09 0.58 -0.47 0.00 0.00 0.00 175.10 175.15 1aiw s TYR 34 N -1.77 -1.33 -0.49 5.22 5.04 -0.00 -1.02 117.35 123.01 1aiw s TYR 34 Ca 0.37 1.88 -0.33 0.00 -2.44 0.00 0.00 57.07 56.54 1aiw s TYR 34 Cb -0.11 0.59 0.05 0.00 0.35 0.00 0.00 41.96 42.83 1aiw s TYR 34 CO 0.28 -0.73 0.64 1.63 -1.34 0.00 0.00 175.55 176.04 1aiw n LYS 35 N 5.43 -1.82 0.00 4.97 5.02 -1.26 -2.55 118.16 127.94 1aiw n LYS 35 Ca -0.07 1.29 0.00 0.00 -2.02 0.00 0.00 58.31 57.51 1aiw n LYS 35 Cb 0.50 -1.97 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 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 -0.38 0.59 3.80 0.72 0.00 -1.11 -4.90 105.19 103.90 1aiw n GLY 36 Ca -0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 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 7.20 -0.23 1.61 0.01 -1.06 -1.13 114.94 121.34 1aiw s ASN 37 Ca 0.00 1.70 -0.11 0.00 -0.71 0.00 0.00 52.86 53.74 1aiw s ASN 37 Cb 0.00 -2.53 -0.05 0.00 0.41 0.00 0.00 41.25 39.08 1aiw s ASN 37 CO 0.00 -0.09 0.18 -0.22 -1.51 0.00 0.00 177.10 175.46 1aiw s LEU 38 N -2.22 4.13 0.34 0.60 2.96 0.31 -0.82 118.68 123.97 1aiw s LEU 38 Ca 0.50 0.16 0.07 0.00 -0.22 0.00 0.00 54.13 54.64 1aiw s LEU 38 Cb -0.17 -2.14 -0.07 0.00 0.50 0.00 0.00 46.19 44.31 1aiw s LEU 38 CO 0.21 0.06 -0.03 -0.31 -1.32 0.00 0.00 176.35 174.97 1aiw s TYR 39 N 1.02 2.23 -0.09 5.38 2.02 0.36 -0.73 117.35 127.55 1aiw s TYR 39 Ca 0.09 -0.69 -0.11 0.00 -0.37 0.00 0.00 57.07 55.98 1aiw s TYR 39 Cb -0.13 -1.41 0.03 0.00 -0.40 0.00 0.00 41.96 40.04 1aiw s TYR 39 CO 0.04 0.35 0.30 0.99 -1.57 0.00 0.00 175.55 175.67 1aiw s THR 40 N -2.88 0.02 0.25 -0.71 2.01 0.46 -0.80 115.64 113.99 1aiw s THR 40 Ca 0.33 -0.15 -0.22 0.00 0.31 0.00 0.00 61.69 61.96 1aiw s THR 40 Cb 0.06 -0.48 -0.09 0.00 0.01 0.00 0.00 72.50 72.01 1aiw s THR 40 CO 0.16 -0.08 0.80 0.00 -0.69 0.00 0.00 174.62 174.80 1aiw s ALA 41 N -0.27 3.35 -0.17 7.40 0.00 -0.43 -0.94 121.76 130.70 1aiw s ALA 41 Ca -0.04 0.29 0.06 0.00 0.00 0.00 0.00 51.96 52.28 1aiw s ALA 41 Cb -0.03 -2.95 -0.23 0.00 0.00 0.00 0.00 23.12 19.91 1aiw s ALA 41 CO 0.01 0.28 0.17 0.09 0.00 0.00 0.00 175.76 176.31 1aiw n ASN 42 N 0.72 1.26 0.00 0.00 3.02 -1.26 -0.38 115.26 118.62 1aiw n ASN 42 Ca -0.01 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1aiw n ASN 42 Cb 0.51 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 1aiw n ASN 42 CO 0.00 0.00 0.00 -2.67 -2.62 0.00 0.00 177.26 171.97 1aiw n TRP 43 N -3.13 0.00 -3.64 3.10 2.14 -1.26 -4.36 117.44 110.28 1aiw n TRP 43 Ca -0.33 0.00 -0.04 0.00 2.07 0.00 0.00 57.50 59.19 1aiw n TRP 43 Cb 1.06 0.13 -0.06 0.00 -0.81 0.00 0.00 31.31 31.63 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 -0.46 -1.19 -0.14 -2.67 6.14 -1.26 0.01 117.35 117.78 1aiw s TYR 44 Ca 0.00 2.22 -0.30 0.00 0.64 0.00 0.00 57.07 59.63 1aiw s TYR 44 Cb 0.00 0.71 0.12 0.00 0.42 0.00 0.00 41.96 43.21 1aiw s TYR 44 CO 0.00 -0.59 0.94 -0.08 0.64 0.00 0.00 175.55 176.46 1aiw s THR 45 N 2.19 0.00 -0.02 4.34 -1.32 0.17 -4.82 115.64 116.18 1aiw s THR 45 Ca -0.08 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.43 1aiw s THR 45 Cb -0.08 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 69.96 1aiw s THR 45 CO -0.20 0.00 0.85 0.00 -2.21 0.00 0.00 174.62 173.07 1aiw n ALA 46 N 0.70 1.70 -1.32 11.08 0.00 -1.26 -0.60 120.51 130.81 1aiw n ALA 46 Ca -0.11 -1.09 -0.30 0.00 0.00 0.00 0.00 53.44 51.94 1aiw n ALA 46 Cb 0.58 -0.14 0.11 0.00 0.00 0.00 0.00 19.45 19.99 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 -0.95 4.16 0.04 0.00 0.01 -1.26 -4.92 113.70 110.78 1aiw s SER 47 Ca 0.05 1.57 -0.30 0.00 1.31 0.00 0.00 55.95 58.58 1aiw s SER 47 Cb 0.04 -2.28 -0.09 0.00 0.21 0.00 0.00 66.02 63.90 1aiw s SER 47 CO 0.00 -2.22 1.95 -0.69 0.41 0.00 0.00 173.24 172.70 1aiw s VAL 48 N -2.98 2.97 -0.15 3.43 1.01 -1.26 -4.85 120.40 118.57 1aiw s VAL 48 Ca 0.62 0.04 -0.39 0.00 0.00 0.00 0.00 61.98 62.25 1aiw s VAL 48 Cb -0.17 -3.03 -0.16 0.00 0.00 0.00 0.00 36.38 33.03 1aiw s VAL 48 CO 0.56 -0.00 1.65 -2.65 0.00 0.00 0.00 175.10 174.65 1aiw n PRO 49 N 7.32 1.27 0.00 2.72 -0.02 -1.26 -0.75 135.00 144.29 1aiw n PRO 49 Ca 0.20 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1aiw n PRO 49 Cb 0.41 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 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 3.76 2.96 3.12 -1.23 0.00 -1.26 -4.92 105.19 107.63 1aiw n GLY 50 Ca 0.24 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1aiw n GLY 50 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1aiw n SER 51 N 0.12 3.60 0.00 1.61 7.64 0.08 -4.88 113.62 121.78 1aiw n SER 51 Ca 0.00 -2.79 0.00 0.00 1.01 0.00 0.00 58.87 57.09 1aiw n SER 51 Cb 0.00 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 61.67 1aiw n SER 51 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1aiw n ASP 52 N 8.07 0.00 0.00 6.43 8.00 -1.26 -4.71 116.55 133.08 1aiw n ASP 52 Ca 0.50 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.00 1aiw n ASP 52 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 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 2.97 -0.84 0.10 -2.24 2.88 -1.26 -3.75 113.62 111.49 1aiw n SER 53 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1aiw n SER 53 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 1aiw n SER 53 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1aiw h SER 54 N 6.26 -0.26 0.00 -3.46 4.64 -1.92 -3.48 113.55 115.32 1aiw h SER 54 Ca 0.00 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1aiw h SER 54 Cb 0.00 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1aiw h SER 54 CO 0.00 0.19 0.00 0.79 -0.87 0.00 0.00 176.83 176.94 1aiw n TRP 55 N -5.03 0.00 -4.76 4.77 5.03 -1.25 -4.68 117.44 111.53 1aiw n TRP 55 Ca -0.09 0.00 -0.33 0.00 3.03 0.00 0.00 57.50 60.12 1aiw n TRP 55 Cb 0.26 0.00 -0.16 0.00 -1.03 0.00 0.00 31.31 30.38 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 2.40 0.33 -0.99 2.01 -0.11 -4.75 115.64 114.52 1aiw s THR 56 Ca 0.00 -0.88 -0.28 0.00 0.31 0.00 0.00 61.69 60.85 1aiw s THR 56 Cb 0.00 -1.98 -0.09 0.00 0.01 0.00 0.00 72.50 70.44 1aiw s THR 56 CO 0.00 0.54 1.12 -1.58 -0.69 0.00 0.00 174.62 174.01 1aiw s GLN 57 N 0.65 4.41 0.00 4.92 0.74 -1.26 -0.40 119.66 128.72 1aiw s GLN 57 Ca -0.10 1.80 0.00 0.00 0.05 0.00 0.00 55.36 57.11 1aiw s GLN 57 Cb -0.16 -2.96 0.00 0.00 1.10 0.00 0.00 33.01 30.99 1aiw s GLN 57 CO 0.02 0.00 0.00 1.33 -0.55 0.00 0.00 175.29 176.09 1aiw n VAL 58 N 0.70 0.00 -0.78 1.34 0.24 0.09 -4.87 118.33 115.04 1aiw n VAL 58 Ca 0.01 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1aiw n VAL 58 Cb 0.46 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 33.51 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 1.76 -1.42 2.68 7.63 0.00 -1.01 -4.98 105.19 109.85 1aiw n GLY 59 Ca 0.00 -1.03 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.98 2.55 0.13 1.61 1.04 -1.26 -0.53 113.70 116.25 1aiw s SER 60 Ca 0.00 -0.67 -0.08 0.00 0.48 0.00 0.00 55.95 55.68 1aiw s SER 60 Cb 0.00 -0.43 -0.09 0.00 0.10 0.00 0.00 66.02 65.60 1aiw s SER 60 CO 0.00 -0.32 1.33 0.00 0.98 0.00 0.00 173.24 175.24