#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aww n SER 2 N 0.00 -1.87 -4.92 1.61 2.88 -1.26 -4.71 113.62 105.35 1aww n SER 2 Ca 0.00 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.26 1aww n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1aww n SER 2 CO 0.00 0.00 0.00 -0.32 -1.23 0.00 0.00 175.04 173.49 1aww s MET 3 N 0.00 3.54 1.95 -1.46 -2.45 -1.26 -4.97 119.30 114.65 1aww s MET 3 Ca 0.00 -0.28 0.00 0.00 -1.25 0.00 0.00 55.69 54.16 1aww s MET 3 Cb 0.00 -2.84 0.00 0.00 1.25 0.00 0.00 34.83 33.24 1aww s MET 3 CO 0.00 0.41 0.00 0.45 1.05 0.00 0.00 175.02 176.93 1aww n SER 4 N -0.50 -1.76 -3.87 1.11 2.88 -1.26 -4.88 113.62 105.34 1aww n SER 4 Ca -0.04 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.12 1aww n SER 4 Cb 0.53 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.02 1aww n SER 4 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1aww n THR 5 N 0.00 -4.28 -4.51 2.46 -2.24 -1.26 -4.79 114.28 99.67 1aww n THR 5 Ca 0.00 -0.73 -0.31 0.00 -2.27 0.00 0.00 64.05 60.74 1aww n THR 5 Cb 0.00 -3.32 -0.06 0.00 -2.10 0.00 0.00 70.33 64.86 1aww n THR 5 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1aww s SER 6 N -3.46 4.28 -1.40 3.42 0.01 -1.26 -4.68 113.70 110.61 1aww s SER 6 Ca 0.45 -1.54 -0.05 0.00 1.31 0.00 0.00 55.95 56.13 1aww s SER 6 Cb -0.21 0.50 0.03 0.00 0.21 0.00 0.00 66.02 66.55 1aww s SER 6 CO 0.92 -0.93 0.75 -0.62 0.41 0.00 0.00 173.24 173.76 1aww n GLU 7 N -1.41 -4.83 -3.15 12.44 1.02 -1.26 -4.95 120.64 118.50 1aww n GLU 7 Ca -0.14 0.58 0.05 0.00 -0.02 0.00 0.00 57.16 57.62 1aww n GLU 7 Cb 0.66 -5.18 -0.00 0.00 -0.02 0.00 0.00 31.44 26.90 1aww n GLU 7 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1aww s LEU 8 N -6.91 -1.02 0.00 -4.62 2.96 -1.26 -4.93 118.68 102.91 1aww s LEU 8 Ca 0.22 0.10 0.00 0.00 -0.22 0.00 0.00 54.13 54.23 1aww s LEU 8 Cb -0.11 1.63 0.00 0.00 0.50 0.00 0.00 46.19 48.21 1aww s LEU 8 CO 0.83 -0.18 0.00 0.29 -1.32 0.00 0.00 176.35 175.97 1aww n LYS 9 N 5.22 1.63 -4.05 1.98 5.02 -1.18 -4.87 118.16 121.91 1aww n LYS 9 Ca 0.07 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.22 1aww n LYS 9 Cb 0.56 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.54 1aww n LYS 9 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1aww s LYS 10 N -0.58 1.97 0.21 1.97 0.00 -1.26 0.11 119.74 122.15 1aww s LYS 10 Ca 0.00 -1.73 -0.21 0.00 0.00 0.00 0.00 55.97 54.04 1aww s LYS 10 Cb 0.00 0.47 0.04 0.00 0.00 0.00 0.00 37.83 38.34 1aww s LYS 10 CO 0.00 -0.83 0.61 0.14 0.00 0.00 0.00 175.35 175.26 1aww s VAL 11 N -2.93 0.01 0.68 1.79 -7.23 -1.01 -3.74 120.40 107.97 1aww s VAL 11 Ca 0.29 -0.55 0.04 0.00 -1.81 0.00 0.00 61.98 59.94 1aww s VAL 11 Cb -0.01 -1.48 0.13 0.00 0.56 0.00 0.00 36.38 35.58 1aww s VAL 11 CO 0.19 -0.04 0.93 0.52 -0.31 0.00 0.00 175.10 176.39 1aww n VAL 12 N -0.39 0.00 -5.23 1.32 0.31 -1.01 0.60 118.33 113.94 1aww n VAL 12 Ca -0.11 -1.72 -0.31 0.00 -0.01 0.00 0.00 64.34 62.19 1aww n VAL 12 Cb 0.62 -0.75 -0.16 0.00 -0.91 0.00 0.00 33.84 32.65 1aww n VAL 12 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1aww s ALA 13 N -3.00 2.22 -0.10 3.52 0.00 0.30 -1.70 121.76 123.00 1aww s ALA 13 Ca 0.65 -1.13 0.12 0.00 0.00 0.00 0.00 51.96 51.60 1aww s ALA 13 Cb -0.04 -0.58 -0.18 0.00 0.00 0.00 0.00 23.12 22.32 1aww s ALA 13 CO 0.42 0.53 0.11 1.28 0.00 0.00 0.00 175.76 178.11 1aww n LEU 14 N 2.35 0.00 -4.16 0.00 4.77 0.28 -0.73 117.00 119.51 1aww n LEU 14 Ca -0.16 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.66 1aww n LEU 14 Cb 0.51 0.24 -0.06 0.00 -2.33 0.00 0.00 43.42 41.78 1aww n LEU 14 CO 0.23 0.24 0.01 -0.31 -1.33 0.00 0.00 177.39 176.23 1aww s TYR 15 N -2.49 1.28 0.44 -1.77 2.02 -1.25 -4.69 117.35 110.89 1aww s TYR 15 Ca -0.06 -1.40 -0.06 0.00 -0.37 0.00 0.00 57.07 55.18 1aww s TYR 15 Cb 0.05 -0.35 -0.04 0.00 -0.40 0.00 0.00 41.96 41.22 1aww s TYR 15 CO 0.55 -0.97 0.75 -0.51 -1.57 0.00 0.00 175.55 173.79 1aww s ASP 16 N -3.26 6.34 -0.41 2.29 1.11 -1.26 -2.18 116.67 119.30 1aww s ASP 16 Ca 0.35 0.93 0.01 0.00 0.18 0.00 0.00 52.55 54.02 1aww s ASP 16 Cb 0.01 -2.24 0.24 0.00 1.07 0.00 0.00 42.92 42.00 1aww s ASP 16 CO 0.21 -0.48 1.02 0.00 1.18 0.00 0.00 175.17 177.10 1aww n TYR 17 N -1.88 -2.03 -0.92 4.23 9.36 -1.25 -4.93 117.16 119.74 1aww n TYR 17 Ca 0.00 -1.16 -0.31 0.00 3.32 0.00 0.00 57.90 59.76 1aww n TYR 17 Cb 0.55 1.32 0.15 0.00 -0.63 0.00 0.00 39.34 40.72 1aww n TYR 17 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1aww s MET 18 N 0.55 1.23 0.90 2.98 0.23 -1.26 -2.83 119.30 121.09 1aww s MET 18 Ca 0.28 1.27 -0.11 0.00 -1.03 0.00 0.00 55.69 56.10 1aww s MET 18 Cb 0.18 -1.77 0.13 0.00 -1.53 0.00 0.00 34.83 31.84 1aww s MET 18 CO -0.14 -2.39 1.09 -1.25 -2.03 0.00 0.00 175.02 170.29 1aww s PRO 19 N -4.75 1.18 -0.02 3.16 0.05 -1.26 -4.85 135.00 128.51 1aww s PRO 19 Ca 0.65 0.90 -0.01 0.00 0.05 0.00 0.00 61.00 62.59 1aww s PRO 19 Cb -0.21 -1.79 -0.01 0.00 0.05 0.00 0.00 34.50 32.54 1aww s PRO 19 CO 0.58 -2.31 -0.03 -1.33 0.05 0.00 0.00 177.00 173.96 1aww n MET 20 N -3.94 0.05 0.05 4.56 2.81 -1.26 -4.98 117.12 114.41 1aww n MET 20 Ca 0.07 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.98 1aww n MET 20 Cb 0.55 -0.74 0.00 0.00 -0.71 0.00 0.00 33.22 32.32 1aww n MET 20 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1aww n ASN 21 N -2.93 0.72 0.00 7.83 5.15 -1.26 -5.06 115.26 119.70 1aww n ASN 21 Ca -0.05 0.16 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1aww n ASN 21 Cb 0.54 -0.17 0.00 0.00 -0.53 0.00 0.00 39.78 39.62 1aww n ASN 21 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1aww n ALA 22 N -3.38 0.00 0.37 5.20 0.00 -1.26 -4.99 120.51 116.44 1aww n ALA 22 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1aww n ALA 22 Cb 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.44 1aww n ALA 22 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1aww h ASN 23 N 0.00 -0.78 -2.02 0.00 -0.26 -1.97 -3.44 115.58 107.12 1aww h ASN 23 Ca 0.00 0.03 -0.64 0.00 -0.56 0.00 0.00 56.30 55.13 1aww h ASN 23 Cb 0.00 0.20 0.10 0.00 -1.06 0.00 0.00 38.32 37.56 1aww h ASN 23 CO 0.00 -0.55 0.10 0.47 -1.06 0.00 0.00 177.43 176.39 1aww n ASP 24 N -5.48 0.96 -4.89 5.81 8.00 -1.26 -1.99 116.55 117.70 1aww n ASP 24 Ca -0.14 1.16 -0.31 0.00 0.71 0.00 0.00 54.79 56.21 1aww n ASP 24 Cb 0.37 -1.21 -0.05 0.00 -0.02 0.00 0.00 41.12 40.22 1aww n ASP 24 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1aww s LEU 25 N 0.86 4.18 -0.94 0.64 2.96 -1.08 -4.43 118.68 120.87 1aww s LEU 25 Ca 0.66 0.77 -0.23 0.00 -0.22 0.00 0.00 54.13 55.12 1aww s LEU 25 Cb -0.81 -3.53 0.07 0.00 0.50 0.00 0.00 46.19 42.41 1aww s LEU 25 CO 0.56 -0.06 1.32 -1.58 -1.32 0.00 0.00 176.35 175.28 1aww s GLN 26 N -2.92 3.50 0.68 1.98 0.74 -1.26 -4.05 119.66 118.34 1aww s GLN 26 Ca 0.45 -1.11 -0.02 0.00 0.05 0.00 0.00 55.36 54.73 1aww s GLN 26 Cb -0.11 -5.02 0.14 0.00 1.10 0.00 0.00 33.01 29.11 1aww s GLN 26 CO 0.24 -2.08 0.93 1.28 -0.55 0.00 0.00 175.29 175.11 1aww n LEU 27 N 8.38 0.00 -3.55 3.68 4.32 -1.13 -4.92 117.00 123.79 1aww n LEU 27 Ca 0.24 -1.82 -0.00 0.00 -0.02 0.00 0.00 56.01 54.41 1aww n LEU 27 Cb 0.50 -0.62 -0.06 0.00 -1.62 0.00 0.00 43.42 41.63 1aww n LEU 27 CO 0.63 -0.99 0.69 -0.60 -1.22 0.00 0.00 177.39 175.90 1aww s ARG 28 N -4.91 0.31 0.28 3.23 3.52 -1.26 -3.95 118.95 116.18 1aww s ARG 28 Ca 0.60 0.62 -0.29 0.00 -0.13 0.00 0.00 55.73 56.53 1aww s ARG 28 Cb -0.03 0.20 -0.14 0.00 -1.56 0.00 0.00 34.95 33.42 1aww s ARG 28 CO 0.40 -0.08 1.18 0.36 -0.81 0.00 0.00 175.30 176.35 1aww n LYS 29 N 4.13 1.69 0.00 5.12 2.85 -0.93 -1.47 118.16 129.56 1aww n LYS 29 Ca -0.15 0.60 0.00 0.00 -1.05 0.00 0.00 58.31 57.71 1aww n LYS 29 Cb 0.56 -2.09 0.00 0.00 -0.65 0.00 0.00 35.03 32.84 1aww n LYS 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1aww n GLY 30 N 1.32 2.70 3.88 2.58 0.00 0.09 -4.93 105.19 110.84 1aww n GLY 30 Ca 0.09 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1aww n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1aww s ASP 31 N 0.49 6.22 0.37 1.61 -1.08 -0.54 -4.57 116.67 119.17 1aww s ASP 31 Ca 0.00 1.33 0.09 0.00 -0.52 0.00 0.00 52.55 53.45 1aww s ASP 31 Cb 0.00 -2.42 -0.07 0.00 -1.46 0.00 0.00 42.92 38.97 1aww s ASP 31 CO 0.00 -0.83 -0.06 -1.61 0.52 0.00 0.00 175.17 173.19 1aww s GLU 32 N -5.11 1.86 0.04 4.34 8.01 -1.26 0.11 118.70 126.70 1aww s GLU 32 Ca 0.54 -2.00 0.01 0.00 0.01 0.00 0.00 54.97 53.53 1aww s GLU 32 Cb -0.11 -1.66 -0.00 0.00 -4.31 0.00 0.00 34.13 28.05 1aww s GLU 32 CO 0.52 0.07 0.02 0.66 0.01 0.00 0.00 175.26 176.54 1aww n TYR 33 N -0.85 -0.01 -4.58 1.61 4.01 0.20 -4.55 117.16 112.99 1aww n TYR 33 Ca -0.05 -0.30 -0.33 0.00 -0.16 0.00 0.00 57.90 57.06 1aww n TYR 33 Cb 0.65 0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 39.52 1aww n TYR 33 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1aww s PHE 34 N -1.80 2.72 0.19 -0.72 0.40 0.10 -2.40 117.98 116.47 1aww s PHE 34 Ca 0.03 -1.23 -0.08 0.00 -0.60 0.00 0.00 56.93 55.05 1aww s PHE 34 Cb 0.00 -1.85 -0.07 0.00 0.51 0.00 0.00 43.02 41.61 1aww s PHE 34 CO 0.02 -0.56 0.49 0.42 0.70 0.00 0.00 175.22 176.28 1aww s ILE 35 N 0.85 5.01 -0.03 0.64 -1.09 0.29 -0.39 121.20 126.48 1aww s ILE 35 Ca -0.06 0.35 0.01 0.00 -2.23 0.00 0.00 60.65 58.72 1aww s ILE 35 Cb -0.15 -3.62 -0.02 0.00 -1.58 0.00 0.00 42.46 37.08 1aww s ILE 35 CO -0.02 -0.01 -0.02 0.18 -1.23 0.00 0.00 174.94 173.85 1aww n LEU 36 N 0.02 2.21 -3.82 2.97 4.32 -1.25 -3.10 117.00 118.35 1aww n LEU 36 Ca -0.01 -0.01 -0.00 0.00 -0.02 0.00 0.00 56.01 55.97 1aww n LEU 36 Cb 0.52 -0.06 0.01 0.00 -1.62 0.00 0.00 43.42 42.27 1aww n LEU 36 CO 0.46 0.42 0.95 -0.70 -1.22 0.00 0.00 177.39 177.30 1aww s GLU 37 N -2.06 0.77 -1.01 3.23 2.12 -1.26 -4.90 118.70 115.59 1aww s GLU 37 Ca -0.03 -0.47 -0.02 0.00 0.36 0.00 0.00 54.97 54.81 1aww s GLU 37 Cb 0.01 0.23 0.31 0.00 0.26 0.00 0.00 34.13 34.95 1aww s GLU 37 CO 0.07 -0.36 1.60 -0.85 -0.54 0.00 0.00 175.26 175.18 1aww n GLU 38 N -0.67 4.83 0.00 4.30 0.00 -1.26 -4.22 120.64 123.63 1aww n GLU 38 Ca -0.03 -4.63 0.00 0.00 0.00 0.00 0.00 57.16 52.49 1aww n GLU 38 Cb 0.60 -2.47 0.00 0.00 0.00 0.00 0.00 31.44 29.58 1aww n GLU 38 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1aww n SER 39 N 0.54 0.00 -3.22 -1.84 7.64 -1.26 -3.75 113.62 111.73 1aww n SER 39 Ca 0.37 0.71 -0.27 0.00 1.01 0.00 0.00 58.87 60.69 1aww n SER 39 Cb 0.30 -0.21 -0.06 0.00 -1.01 0.00 0.00 64.21 63.23 1aww n SER 39 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1aww n ASN 40 N -1.59 4.20 0.00 6.43 2.85 -1.10 -5.03 115.26 121.02 1aww n ASN 40 Ca 0.00 -3.56 0.00 0.00 -0.11 0.00 0.00 54.58 50.91 1aww n ASN 40 Cb 0.00 -0.64 0.00 0.00 1.24 0.00 0.00 39.78 40.38 1aww n ASN 40 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1aww n LEU 41 N 0.34 0.00 -0.03 1.20 4.32 -1.25 0.14 117.00 121.72 1aww n LEU 41 Ca 0.31 0.00 0.24 0.00 -0.02 0.00 0.00 56.01 56.54 1aww n LEU 41 Cb 0.40 0.00 0.71 0.00 -1.62 0.00 0.00 43.42 42.90 1aww n LEU 41 CO 0.39 0.00 1.22 -0.65 -1.22 0.00 0.00 177.39 177.12 1aww h PRO 42 N 0.00 0.00 -5.76 3.23 0.10 -1.95 -3.36 132.00 124.26 1aww h PRO 42 Ca 0.00 0.00 -0.48 0.00 0.10 0.00 0.00 66.00 65.62 1aww h PRO 42 Cb 0.00 0.00 -0.18 0.00 0.10 0.00 0.00 31.00 30.92 1aww h PRO 42 CO 0.00 0.00 -0.77 -1.58 0.10 0.00 0.00 178.00 175.75 1aww s TRP 43 N -4.69 1.68 0.06 0.65 0.52 0.36 0.99 118.94 118.51 1aww s TRP 43 Ca -0.04 -0.50 0.01 0.00 0.02 0.00 0.00 56.10 55.58 1aww s TRP 43 Cb 0.17 -0.85 -0.00 0.00 -1.15 0.00 0.00 33.47 31.64 1aww s TRP 43 CO 0.60 0.26 0.03 0.91 0.02 0.00 0.00 176.95 178.78 1aww n TRP 44 N 0.37 -0.03 -3.33 -1.98 8.01 -0.57 -2.70 117.44 117.20 1aww n TRP 44 Ca -0.14 -0.40 -0.26 0.00 -1.31 0.00 0.00 57.50 55.40 1aww n TRP 44 Cb 0.57 0.02 -0.08 0.00 -2.01 0.00 0.00 31.31 29.81 1aww n TRP 44 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.69 174.55 1aww n ARG 45 N -0.12 1.44 -3.84 -0.99 0.63 -1.26 -2.81 116.66 109.71 1aww n ARG 45 Ca -0.00 -3.85 -0.23 0.00 -0.92 0.00 0.00 57.85 52.85 1aww n ARG 45 Cb 0.09 -1.71 -0.05 0.00 0.45 0.00 0.00 32.46 31.24 1aww n ARG 45 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1aww s ALA 46 N -1.61 3.87 0.27 5.13 0.00 -1.11 -3.80 121.76 124.52 1aww s ALA 46 Ca 0.36 -1.95 0.10 0.00 0.00 0.00 0.00 51.96 50.48 1aww s ALA 46 Cb 0.14 -0.71 -0.05 0.00 0.00 0.00 0.00 23.12 22.50 1aww s ALA 46 CO -0.08 -0.21 -0.08 1.03 0.00 0.00 0.00 175.76 176.41 1aww s ARG 47 N -4.04 2.06 0.00 0.00 0.52 0.48 -1.39 118.95 116.57 1aww s ARG 47 Ca 0.44 -1.54 0.00 0.00 -0.52 0.00 0.00 55.73 54.11 1aww s ARG 47 Cb 0.00 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.45 1aww s ARG 47 CO 0.25 0.36 0.00 -0.40 0.02 0.00 0.00 175.30 175.53 1aww n ASP 48 N -0.74 0.20 0.06 0.23 5.75 -0.88 0.01 116.55 121.18 1aww n ASP 48 Ca -0.06 0.00 0.12 0.00 -0.01 0.00 0.00 54.79 54.84 1aww n ASP 48 Cb 0.59 0.00 0.46 0.00 -1.03 0.00 0.00 41.12 41.14 1aww n ASP 48 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1aww n LYS 49 N 0.00 0.13 -0.26 0.11 2.85 -1.26 -3.08 118.16 116.65 1aww n LYS 49 Ca 0.00 0.22 0.04 0.00 -1.05 0.00 0.00 58.31 57.52 1aww n LYS 49 Cb 0.00 -1.68 0.15 0.00 -0.65 0.00 0.00 35.03 32.85 1aww n LYS 49 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1aww n ASN 50 N -1.91 2.25 -2.13 -5.58 3.02 -1.26 -4.87 115.26 104.79 1aww n ASN 50 Ca 0.05 -2.17 -0.20 0.00 -0.03 0.00 0.00 54.58 52.23 1aww n ASN 50 Cb 0.31 -0.37 -0.02 0.00 -0.61 0.00 0.00 39.78 39.08 1aww n ASN 50 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1aww n GLY 51 N 0.67 -0.06 3.33 7.41 0.00 -1.18 -4.97 105.19 110.39 1aww n GLY 51 Ca 0.11 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1aww n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aww s GLN 52 N -4.77 3.21 0.19 1.61 -0.21 -1.26 -4.95 119.66 113.47 1aww s GLN 52 Ca 0.00 -0.75 -0.04 0.00 0.02 0.00 0.00 55.36 54.59 1aww s GLN 52 Cb 0.00 -2.51 -0.05 0.00 1.00 0.00 0.00 33.01 31.45 1aww s GLN 52 CO 0.00 0.24 0.43 -2.00 -2.12 0.00 0.00 175.29 171.84 1aww s GLU 53 N 0.25 3.61 0.00 2.91 -6.30 -1.26 -2.08 118.70 115.83 1aww s GLU 53 Ca -0.11 -0.10 0.00 0.00 -2.50 0.00 0.00 54.97 52.26 1aww s GLU 53 Cb -0.16 -2.79 0.00 0.00 0.00 0.00 0.00 34.13 31.18 1aww s GLU 53 CO 0.06 0.39 0.00 0.41 0.02 0.00 0.00 175.26 176.14 1aww n GLY 54 N -0.29 1.97 3.81 -1.50 0.00 -0.49 -4.81 105.19 103.88 1aww n GLY 54 Ca -0.02 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1aww n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1aww s TYR 55 N -1.00 3.36 -0.22 1.61 1.51 -0.84 -2.75 117.35 119.01 1aww s TYR 55 Ca 0.00 0.26 -0.04 0.00 -1.01 0.00 0.00 57.07 56.28 1aww s TYR 55 Cb 0.00 -1.77 0.07 0.00 -0.11 0.00 0.00 41.96 40.15 1aww s TYR 55 CO 0.00 0.58 0.10 0.42 -1.11 0.00 0.00 175.55 175.54 1aww s ILE 56 N -1.20 0.03 -0.02 2.71 1.09 -1.12 -2.63 121.20 120.06 1aww s ILE 56 Ca 0.23 -0.44 -0.32 0.00 -1.10 0.00 0.00 60.65 59.02 1aww s ILE 56 Cb -0.12 -0.80 -0.10 0.00 -1.06 0.00 0.00 42.46 40.38 1aww s ILE 56 CO 0.14 -0.42 1.93 -2.65 -0.10 0.00 0.00 174.94 173.83 1aww n PRO 57 N 5.22 2.54 -0.27 2.79 -0.01 -1.26 -1.52 135.00 142.50 1aww n PRO 57 Ca -0.07 0.93 0.07 0.00 -0.01 0.00 0.00 63.50 64.42 1aww n PRO 57 Cb 0.46 -2.83 0.21 0.00 -0.01 0.00 0.00 33.50 31.33 1aww n PRO 57 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 175.50 176.52 1aww h SER 58 N 9.87 0.20 -0.89 2.55 0.87 0.48 0.22 113.55 126.86 1aww h SER 58 Ca -0.49 0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.19 1aww h SER 58 Cb 1.25 0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 63.31 1aww h SER 58 CO 0.94 0.04 0.52 -0.55 -0.53 0.00 0.00 176.83 177.25 1aww h ASN 59 N 0.38 1.08 -0.30 6.23 7.08 -1.89 -2.18 115.58 125.99 1aww h ASN 59 Ca 0.44 -0.08 -0.02 0.00 -3.08 0.00 0.00 56.30 53.57 1aww h ASN 59 Cb 0.74 -0.27 -0.02 0.00 -2.08 0.00 0.00 38.32 36.69 1aww h ASN 59 CO -0.47 0.85 0.15 1.88 -2.08 0.00 0.00 177.43 177.76 1aww h TYR 60 N 1.23 0.47 -1.64 4.14 -1.99 -1.31 -3.44 116.97 114.43 1aww h TYR 60 Ca 0.32 -0.01 -0.50 0.00 2.00 0.00 0.00 58.73 60.53 1aww h TYR 60 Cb -0.02 -0.15 -0.04 0.00 2.00 0.00 0.00 36.73 38.52 1aww h TYR 60 CO 0.00 0.37 -0.42 0.14 -0.00 0.00 0.00 178.16 178.25 1aww s VAL 61 N -5.26 2.89 0.00 -2.88 -7.23 -0.82 0.10 120.40 107.21 1aww s VAL 61 Ca -0.08 -1.41 0.00 0.00 -1.81 0.00 0.00 61.98 58.68 1aww s VAL 61 Cb 0.17 -3.05 0.00 0.00 0.56 0.00 0.00 36.38 34.06 1aww s VAL 61 CO 0.74 -0.06 0.00 1.07 -0.31 0.00 0.00 175.10 176.53 1aww n THR 62 N -1.44 0.00 -3.14 5.32 5.66 -0.69 -4.86 114.28 115.14 1aww n THR 62 Ca 0.01 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.62 1aww n THR 62 Cb 0.61 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.34 1aww n THR 62 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1aww s GLU 63 N 4.33 4.39 0.56 1.09 2.02 -1.26 -2.40 118.70 127.43 1aww s GLU 63 Ca 0.00 0.76 0.39 0.00 0.02 0.00 0.00 54.97 56.14 1aww s GLU 63 Cb 0.00 -3.41 1.52 0.00 0.10 0.00 0.00 34.13 32.33 1aww s GLU 63 CO 0.00 0.17 1.67 0.00 0.02 0.00 0.00 175.26 177.13 1aww h ALA 64 N 6.41 3.24 -1.95 5.21 0.00 -1.73 -3.06 119.26 127.38 1aww h ALA 64 Ca -0.42 -0.05 -0.60 0.00 0.00 0.00 0.00 54.91 53.84 1aww h ALA 64 Cb 1.19 0.10 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 1aww h ALA 64 CO 0.74 -1.74 -0.65 -1.21 0.00 0.00 0.00 179.25 176.39 1aww s GLU 65 N -4.81 1.97 -0.21 0.00 2.02 -1.26 -4.56 118.70 111.85 1aww s GLU 65 Ca -0.05 -1.81 0.01 0.00 0.02 0.00 0.00 54.97 53.15 1aww s GLU 65 Cb 0.22 -1.85 0.05 0.00 0.10 0.00 0.00 34.13 32.65 1aww s GLU 65 CO 0.76 0.16 -0.09 -0.51 0.02 0.00 0.00 175.26 175.60 1aww s ASP 66 N -3.66 3.56 0.00 -0.19 1.01 -1.26 -4.96 116.67 111.17 1aww s ASP 66 Ca 0.34 -0.98 0.05 0.00 0.71 0.00 0.00 52.55 52.67 1aww s ASP 66 Cb 0.00 -1.23 0.04 0.00 1.01 0.00 0.00 42.92 42.74 1aww s ASP 66 CO 0.18 -0.17 0.67 -1.54 0.21 0.00 0.00 175.17 174.52