#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 -0.53 -0.26 3.03 0.00 -1.26 -5.05 107.32 103.25 1aiw s GLY 2 Ca 0.00 1.42 -0.05 0.00 0.00 0.00 0.00 44.72 46.08 1aiw s GLY 2 CO 0.00 2.75 2.82 2.09 0.00 0.00 0.00 173.10 180.76 1aiw n ASP 3 N 5.39 4.59 -1.48 1.64 5.75 -1.26 -4.59 116.55 126.59 1aiw n ASP 3 Ca -0.06 -2.29 -0.14 0.00 -0.01 0.00 0.00 54.79 52.29 1aiw n ASP 3 Cb 0.50 -1.14 -0.06 0.00 -1.03 0.00 0.00 41.12 39.39 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 0.66 2.58 -0.71 0.00 0.00 -1.98 -0.42 119.26 119.39 1aiw h ALA 5 Ca -0.30 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.63 1aiw h ALA 5 Cb 0.95 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1aiw h ALA 5 CO 0.43 -1.20 0.47 -0.91 0.00 0.00 0.00 179.25 178.04 1aiw h ASN 6 N 0.00 0.71 -3.51 0.00 2.35 -1.96 -3.42 115.58 109.75 1aiw h ASN 6 Ca 0.36 -0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 56.02 1aiw h ASN 6 Cb 1.98 -0.16 0.02 0.00 0.05 0.00 0.00 38.32 40.21 1aiw h ASN 6 CO -0.00 0.48 0.03 0.00 -1.65 0.00 0.00 177.43 176.29 1aiw n ALA 7 N -2.44 -0.01 -1.87 -0.83 0.00 -0.17 -4.95 120.51 110.24 1aiw n ALA 7 Ca 0.10 -0.39 -0.30 0.00 0.00 0.00 0.00 53.44 52.85 1aiw n ALA 7 Cb 0.16 0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.62 1aiw n ALA 7 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1aiw s ASN 8 N -1.84 4.83 -0.14 0.00 -0.87 -1.26 -4.93 114.94 110.72 1aiw s ASN 8 Ca 0.14 0.09 -0.06 0.00 -1.57 0.00 0.00 52.86 51.45 1aiw s ASN 8 Cb -0.01 -2.54 -0.04 0.00 -0.02 0.00 0.00 41.25 38.65 1aiw s ASN 8 CO 0.09 -2.86 0.08 0.54 -2.57 0.00 0.00 177.10 172.38 1aiw s VAL 9 N 11.00 4.97 0.09 1.60 0.11 -1.26 -0.44 120.40 136.47 1aiw s VAL 9 Ca 0.78 0.02 -0.36 0.00 -2.93 0.00 0.00 61.98 59.49 1aiw s VAL 9 Cb -0.11 -3.18 -0.18 0.00 -1.53 0.00 0.00 36.38 31.38 1aiw s VAL 9 CO 0.12 0.55 1.11 0.00 -3.33 0.00 0.00 175.10 173.55 1aiw n TYR 10 N 2.66 0.91 -0.84 1.54 9.36 -0.93 -0.02 117.16 129.84 1aiw n TYR 10 Ca -0.18 0.84 -0.21 0.00 3.32 0.00 0.00 57.90 61.67 1aiw n TYR 10 Cb 0.53 -2.19 0.12 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 1.78 2.06 -1.01 2.98 -0.04 -1.26 -5.04 135.00 134.47 1aiw n PRO 11 Ca 0.18 -2.40 -0.26 0.00 -0.04 0.00 0.00 63.50 60.99 1aiw n PRO 11 Cb 0.17 -1.94 -0.06 0.00 -0.04 0.00 0.00 33.50 31.63 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 -0.68 6.42 -4.60 3.54 3.02 0.97 -4.81 115.26 119.12 1aiw n ASN 12 Ca 0.47 -2.42 -0.43 0.00 -0.03 0.00 0.00 54.58 52.17 1aiw n ASN 12 Cb 1.21 -1.32 -0.01 0.00 -0.61 0.00 0.00 39.78 39.06 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 3.49 1.32 0.09 3.10 5.03 -1.26 -4.51 117.44 124.70 1aiw n TRP 13 Ca 0.57 0.64 -0.04 0.00 3.03 0.00 0.00 57.50 61.70 1aiw n TRP 13 Cb 0.35 -2.26 -0.01 0.00 -1.03 0.00 0.00 31.31 28.36 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 1.90 1.53 0.00 -0.99 2.07 -1.89 -3.31 116.25 115.57 1aiw h VAL 14 Ca -0.42 -2.88 0.00 0.00 0.82 0.00 0.00 66.70 64.22 1aiw h VAL 14 Cb 1.33 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 33.68 1aiw h VAL 14 CO 0.59 0.81 0.00 0.28 0.02 0.00 0.00 177.57 179.27 1aiw h SER 15 N 0.00 0.00 0.00 0.57 0.02 -1.89 -3.46 113.55 108.79 1aiw h SER 15 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1aiw h SER 15 Cb 1.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.06 1aiw h SER 15 CO 0.11 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 176.09 1aiw n LYS 16 N -2.83 0.00 0.00 3.45 5.02 -1.25 -4.28 118.16 118.27 1aiw n LYS 16 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1aiw n LYS 16 Cb 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.22 1aiw n LYS 16 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1aiw n ASP 17 N 1.02 0.00 -3.85 4.39 2.03 -1.26 -2.31 116.55 116.57 1aiw n ASP 17 Ca 0.00 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.20 1aiw n ASP 17 Cb 0.00 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.35 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 0.60 0.18 -0.67 1.48 -1.26 -4.98 118.94 114.29 1aiw s TRP 18 Ca 0.00 -0.93 -0.13 0.00 -1.06 0.00 0.00 56.10 53.98 1aiw s TRP 18 Cb 0.00 0.05 0.20 0.00 -1.16 0.00 0.00 33.47 32.56 1aiw s TRP 18 CO 0.00 -0.99 1.21 0.00 -4.06 0.00 0.00 176.95 173.11 1aiw n ALA 19 N -0.41 -0.08 -0.86 2.67 0.00 -1.26 -0.49 120.51 120.09 1aiw n ALA 19 Ca -0.01 0.78 0.08 0.00 0.00 0.00 0.00 53.44 54.29 1aiw n ALA 19 Cb 0.62 -0.36 0.23 0.00 0.00 0.00 0.00 19.45 19.95 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 -1.38 3.89 3.78 0.00 0.00 -1.26 -5.04 105.19 105.18 1aiw n GLY 20 Ca 0.08 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.80 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 -1.84 2.76 0.20 -0.02 0.00 0.36 -5.02 107.32 103.76 1aiw s GLY 21 Ca 0.38 0.77 -0.30 0.00 0.00 0.00 0.00 44.72 45.56 1aiw s GLY 21 CO 0.09 1.21 1.18 1.20 0.00 0.00 0.00 173.10 176.79 1aiw s GLN 22 N -2.48 4.51 0.17 2.90 -0.21 -1.26 -4.54 119.66 118.76 1aiw s GLN 22 Ca 0.58 1.87 -0.29 0.00 0.02 0.00 0.00 55.36 57.54 1aiw s GLN 22 Cb -0.24 -3.23 -0.17 0.00 1.00 0.00 0.00 33.01 30.37 1aiw s GLN 22 CO 0.30 -0.04 0.58 -2.30 -2.12 0.00 0.00 175.29 171.71 1aiw n PRO 23 N 2.24 0.00 0.00 2.91 -0.02 -1.24 -4.52 135.00 134.36 1aiw n PRO 23 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1aiw n PRO 23 Cb 0.45 -1.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.88 1aiw n PRO 23 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1aiw n THR 24 N 0.18 0.00 0.00 3.45 -2.24 -0.98 -4.87 114.28 109.82 1aiw n THR 24 Ca 0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 1aiw n THR 24 Cb 0.23 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 1aiw n THR 24 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aiw n HIS 25 N -1.77 0.00 -3.65 4.78 1.44 -1.26 -4.84 115.22 109.92 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 0.41 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.45 1aiw n HIS 25 CO 0.00 0.00 0.00 1.21 -2.81 0.00 0.00 176.34 174.74 1aiw s ASN 26 N 0.00 6.44 0.31 4.39 3.84 0.65 -2.93 114.94 127.64 1aiw s ASN 26 Ca 0.00 0.51 0.08 0.00 0.21 0.00 0.00 52.86 53.66 1aiw s ASN 26 Cb 0.00 -2.15 -0.03 0.00 -0.55 0.00 0.00 41.25 38.52 1aiw s ASN 26 CO 0.00 0.22 0.23 -1.61 -2.79 0.00 0.00 177.10 173.15 1aiw s GLU 27 N -0.12 2.70 -0.35 0.43 2.02 -1.26 -0.95 118.70 121.17 1aiw s GLU 27 Ca 0.16 -1.28 -0.44 0.00 0.02 0.00 0.00 54.97 53.42 1aiw s GLU 27 Cb -0.13 -2.44 -0.20 0.00 0.10 0.00 0.00 34.13 31.47 1aiw s GLU 27 CO 0.04 0.19 1.48 0.00 0.02 0.00 0.00 175.26 176.99 1aiw n ALA 28 N -1.27 -1.79 -0.62 5.21 0.00 1.00 -0.48 120.51 122.56 1aiw n ALA 28 Ca -0.04 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1aiw n ALA 28 Cb 0.59 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.13 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 3.38 1.72 3.64 0.00 0.00 0.25 -4.93 105.19 109.25 1aiw n GLY 29 Ca 0.28 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 -0.01 4.10 0.74 1.61 -1.52 0.37 -4.87 119.66 120.08 1aiw s GLN 30 Ca 0.00 0.96 -0.11 0.00 -1.95 0.00 0.00 55.36 54.26 1aiw s GLN 30 Cb 0.00 -3.69 0.03 0.00 -0.22 0.00 0.00 33.01 29.13 1aiw s GLN 30 CO 0.00 -0.70 1.10 -1.54 -0.25 0.00 0.00 175.29 173.91 1aiw s SER 31 N 1.48 5.10 0.11 5.90 1.04 -1.26 -3.20 113.70 122.87 1aiw s SER 31 Ca 0.39 1.17 -0.25 0.00 0.48 0.00 0.00 55.95 57.75 1aiw s SER 31 Cb -0.14 -1.94 0.08 0.00 0.10 0.00 0.00 66.02 64.12 1aiw s SER 31 CO 0.11 -1.57 0.66 -0.51 0.98 0.00 0.00 173.24 172.92 1aiw s ILE 32 N -3.30 0.00 0.18 -1.02 2.07 0.90 -4.84 121.20 115.18 1aiw s ILE 32 Ca 0.59 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.84 1aiw s ILE 32 Cb -0.12 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.43 1aiw s ILE 32 CO 0.52 0.00 0.34 -0.69 -1.91 0.00 0.00 174.94 173.20 1aiw s VAL 33 N -3.47 5.27 -0.30 4.00 1.01 0.42 -0.99 120.40 126.34 1aiw s VAL 33 Ca 0.01 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.22 1aiw s VAL 33 Cb -0.01 -3.75 0.19 0.00 0.00 0.00 0.00 36.38 32.81 1aiw s VAL 33 CO -0.11 -0.15 1.29 -0.47 0.00 0.00 0.00 175.10 175.66 1aiw s TYR 34 N -1.82 -0.16 -0.83 5.22 5.04 -1.05 -2.19 117.35 121.57 1aiw s TYR 34 Ca 0.36 0.34 -0.06 0.00 -2.44 0.00 0.00 57.07 55.28 1aiw s TYR 34 Cb -0.11 0.29 0.06 0.00 0.35 0.00 0.00 41.96 42.55 1aiw s TYR 34 CO 0.29 -0.08 0.22 1.63 -1.34 0.00 0.00 175.55 176.27 1aiw n LYS 35 N 2.42 -2.61 -1.60 4.97 4.76 -1.26 -0.44 118.16 124.39 1aiw n LYS 35 Ca -0.14 0.26 -0.10 0.00 -2.87 0.00 0.00 58.31 55.46 1aiw n LYS 35 Cb 0.57 -4.85 -0.03 0.00 -1.84 0.00 0.00 35.03 28.88 1aiw n LYS 35 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1aiw n GLY 36 N -0.82 0.72 3.38 0.72 0.00 -1.24 -4.95 105.19 102.99 1aiw n GLY 36 Ca -0.01 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.78 3.12 -0.27 1.61 0.01 0.41 -3.62 114.94 113.42 1aiw s ASN 37 Ca 0.00 -0.86 -0.13 0.00 -0.71 0.00 0.00 52.86 51.16 1aiw s ASN 37 Cb 0.00 -0.21 -0.04 0.00 0.41 0.00 0.00 41.25 41.40 1aiw s ASN 37 CO 0.00 0.06 0.27 -0.22 -1.51 0.00 0.00 177.10 175.70 1aiw s LEU 38 N -2.67 4.05 0.23 0.60 2.96 0.33 -2.52 118.68 121.66 1aiw s LEU 38 Ca 0.19 0.15 0.10 0.00 -0.22 0.00 0.00 54.13 54.34 1aiw s LEU 38 Cb -0.07 -2.26 -0.05 0.00 0.50 0.00 0.00 46.19 44.31 1aiw s LEU 38 CO 0.09 -0.09 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.54 1aiw s TYR 39 N 1.78 1.97 -0.04 5.38 2.02 -0.16 -0.82 117.35 127.48 1aiw s TYR 39 Ca 0.11 -0.46 -0.07 0.00 -0.37 0.00 0.00 57.07 56.28 1aiw s TYR 39 Cb -0.16 -0.89 0.01 0.00 -0.40 0.00 0.00 41.96 40.52 1aiw s TYR 39 CO 0.10 0.51 0.17 0.99 -1.57 0.00 0.00 175.55 175.74 1aiw s THR 40 N -2.67 0.03 0.32 -0.71 2.01 0.06 -0.07 115.64 114.60 1aiw s THR 40 Ca 0.25 -0.22 -0.16 0.00 0.31 0.00 0.00 61.69 61.86 1aiw s THR 40 Cb -0.03 -0.31 -0.09 0.00 0.01 0.00 0.00 72.50 72.08 1aiw s THR 40 CO 0.10 -0.12 0.76 0.00 -0.69 0.00 0.00 174.62 174.67 1aiw s ALA 41 N -0.38 3.31 0.02 7.40 0.00 -1.19 -1.63 121.76 129.29 1aiw s ALA 41 Ca -0.05 0.10 0.08 0.00 0.00 0.00 0.00 51.96 52.09 1aiw s ALA 41 Cb -0.03 -2.82 -0.23 0.00 0.00 0.00 0.00 23.12 20.04 1aiw s ALA 41 CO 0.01 0.31 0.91 -0.91 0.00 0.00 0.00 175.76 176.08 1aiw h ASN 42 N 2.43 0.07 0.00 0.00 2.35 -1.24 0.73 115.58 119.91 1aiw h ASN 42 Ca -0.48 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.16 1aiw h ASN 42 Cb 1.18 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.52 1aiw h ASN 42 CO 0.65 1.09 0.00 -2.67 -1.65 0.00 0.00 177.43 174.85 1aiw n TRP 43 N -3.23 -0.33 -3.64 1.19 2.14 -1.26 -4.56 117.44 107.75 1aiw n TRP 43 Ca -0.11 0.00 -0.08 0.00 2.07 0.00 0.00 57.50 59.38 1aiw n TRP 43 Cb 1.01 0.35 -0.07 0.00 -0.81 0.00 0.00 31.31 31.79 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 -0.71 -0.62 -0.23 -2.67 6.14 -1.26 -0.00 117.35 118.00 1aiw s TYR 44 Ca 0.00 1.40 -0.33 0.00 0.64 0.00 0.00 57.07 58.78 1aiw s TYR 44 Cb 0.00 0.38 0.16 0.00 0.42 0.00 0.00 41.96 42.92 1aiw s TYR 44 CO 0.00 -0.30 1.26 -0.08 0.64 0.00 0.00 175.55 177.07 1aiw s THR 45 N 0.67 0.00 -0.06 4.34 -1.32 -0.13 -4.89 115.64 114.26 1aiw s THR 45 Ca -0.02 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.55 1aiw s THR 45 Cb -0.05 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 70.07 1aiw s THR 45 CO -0.09 0.00 1.04 0.00 -2.21 0.00 0.00 174.62 173.37 1aiw n ALA 46 N 0.23 2.07 -1.93 11.08 0.00 -1.26 -0.25 120.51 130.44 1aiw n ALA 46 Ca -0.00 -1.71 -0.27 0.00 0.00 0.00 0.00 53.44 51.47 1aiw n ALA 46 Cb 0.58 -0.40 0.09 0.00 0.00 0.00 0.00 19.45 19.72 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 -1.79 4.57 -0.06 0.00 1.04 -1.26 -4.97 113.70 111.23 1aiw s SER 47 Ca 0.14 0.44 -0.34 0.00 0.48 0.00 0.00 55.95 56.67 1aiw s SER 47 Cb 0.13 -0.99 -0.12 0.00 0.10 0.00 0.00 66.02 65.13 1aiw s SER 47 CO 0.01 -1.77 1.84 0.52 0.98 0.00 0.00 173.24 174.82 1aiw n VAL 48 N -3.06 0.50 -1.60 5.02 0.31 -1.26 -4.82 118.33 113.42 1aiw n VAL 48 Ca 0.09 -0.09 -0.49 0.00 -0.01 0.00 0.00 64.34 63.84 1aiw n VAL 48 Cb 0.60 -1.83 -0.05 0.00 -0.91 0.00 0.00 33.84 31.65 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 6.22 1.72 0.00 5.55 -0.02 -1.26 -0.85 135.00 146.35 1aiw n PRO 49 Ca 0.22 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1aiw n PRO 49 Cb 0.29 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 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 5.20 0.78 2.10 -1.23 0.00 -1.26 -4.88 105.19 105.91 1aiw n GLY 50 Ca 0.30 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 4.18 0.00 1.61 3.41 -0.03 -4.94 113.62 117.85 1aiw n SER 51 Ca 0.00 -2.28 0.00 0.00 -0.26 0.00 0.00 58.87 56.33 1aiw n SER 51 Cb 0.00 -1.13 0.00 0.00 -0.26 0.00 0.00 64.21 62.82 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 2.60 0.00 0.00 4.04 8.00 -1.26 -4.63 116.55 125.30 1aiw n ASP 52 Ca 0.34 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.84 1aiw n ASP 52 Cb 0.73 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.83 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 -1.72 0.00 0.00 -2.24 2.88 -1.26 -0.49 113.62 110.78 1aiw n SER 53 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1aiw n SER 53 Cb 0.00 0.00 0.58 0.00 -0.75 0.00 0.00 64.21 64.04 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 5.14 0.00 -4.91 -3.46 3.41 -1.26 -4.86 113.62 107.69 1aiw n SER 54 Ca 0.00 -0.01 -0.23 0.00 -0.26 0.00 0.00 58.87 58.37 1aiw n SER 54 Cb 0.00 -0.30 -0.01 0.00 -0.26 0.00 0.00 64.21 63.64 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 -2.60 2.14 -0.28 7.33 0.52 0.35 -0.76 118.94 125.65 1aiw s TRP 55 Ca 0.21 -0.65 -0.21 0.00 0.02 0.00 0.00 56.10 55.47 1aiw s TRP 55 Cb 0.16 -2.08 0.10 0.00 -1.15 0.00 0.00 33.47 30.49 1aiw s TRP 55 CO 0.36 -0.39 0.83 0.99 0.02 0.00 0.00 176.95 178.76 1aiw s THR 56 N -2.61 0.00 -0.11 2.01 2.01 -0.64 -4.76 115.64 111.53 1aiw s THR 56 Ca 0.45 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 62.23 1aiw s THR 56 Cb -0.03 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.44 1aiw s THR 56 CO 0.27 0.00 0.63 -1.58 -0.69 0.00 0.00 174.62 173.25 1aiw s GLN 57 N 0.88 4.35 -0.02 4.92 0.74 -1.26 -0.76 119.66 128.52 1aiw s GLN 57 Ca -0.04 0.71 0.21 0.00 0.05 0.00 0.00 55.36 56.29 1aiw s GLN 57 Cb -0.05 -3.48 -0.28 0.00 1.10 0.00 0.00 33.01 30.31 1aiw s GLN 57 CO -0.10 0.00 0.66 1.33 -0.55 0.00 0.00 175.29 176.64 1aiw n VAL 58 N 4.00 0.00 -1.19 1.34 0.24 0.00 -4.95 118.33 117.77 1aiw n VAL 58 Ca -0.03 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 1aiw n VAL 58 Cb 0.51 0.49 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 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 1.39 0.18 3.77 7.63 0.00 -1.12 -5.00 105.19 112.04 1aiw n GLY 59 Ca -0.00 -1.36 -0.39 0.00 0.00 0.00 0.00 46.02 44.27 1aiw n GLY 59 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aiw s SER 60 N -4.00 6.93 -0.73 1.61 0.15 -1.26 -0.51 113.70 115.89 1aiw s SER 60 Ca 0.00 1.10 -0.27 0.00 0.70 0.00 0.00 55.95 57.49 1aiw s SER 60 Cb 0.00 -2.34 0.02 0.00 -1.71 0.00 0.00 66.02 61.99 1aiw s SER 60 CO 0.00 0.14 1.40 0.00 1.20 0.00 0.00 173.24 175.98