#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aww s SER 2 N 0.00 1.12 0.09 1.61 0.15 -1.26 -5.13 113.70 110.28 1aww s SER 2 Ca 0.00 -0.50 0.01 0.00 0.70 0.00 0.00 55.95 56.16 1aww s SER 2 Cb 0.00 0.74 -0.04 0.00 -1.71 0.00 0.00 66.02 65.01 1aww s SER 2 CO 0.00 -0.36 -0.06 -0.32 1.20 0.00 0.00 173.24 173.69 1aww s MET 3 N 2.43 0.80 0.64 5.44 0.00 -1.26 -5.01 119.30 122.34 1aww s MET 3 Ca 0.10 -1.31 0.00 0.00 0.00 0.00 0.00 55.69 54.48 1aww s MET 3 Cb -0.14 -0.16 0.00 0.00 0.00 0.00 0.00 34.83 34.53 1aww s MET 3 CO -0.29 -0.03 0.00 -1.13 0.00 0.00 0.00 175.02 173.58 1aww n SER 4 N 0.02 0.00 -4.71 1.11 3.41 -1.26 -4.40 113.62 107.79 1aww n SER 4 Ca -0.13 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.08 1aww n SER 4 Cb 0.61 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.51 1aww n SER 4 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1aww s THR 5 N 0.00 5.03 0.00 6.66 -4.23 -1.26 -4.88 115.64 116.96 1aww s THR 5 Ca 0.00 1.49 0.00 0.00 -1.18 0.00 0.00 61.69 62.00 1aww s THR 5 Cb 0.00 -4.06 0.00 0.00 1.34 0.00 0.00 72.50 69.78 1aww s THR 5 CO 0.00 0.24 0.00 -1.54 -0.54 0.00 0.00 174.62 172.78 1aww n SER 6 N 3.86 0.00 -2.49 3.99 3.41 -1.26 -4.93 113.62 116.20 1aww n SER 6 Ca -0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.32 1aww n SER 6 Cb 0.51 0.11 -0.01 0.00 -0.26 0.00 0.00 64.21 64.56 1aww n SER 6 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1aww n GLU 7 N -2.32 2.41 -4.57 4.33 1.02 -1.26 -4.93 120.64 115.33 1aww n GLU 7 Ca 0.00 -2.57 -0.26 0.00 -0.02 0.00 0.00 57.16 54.31 1aww n GLU 7 Cb 0.00 -2.11 -0.11 0.00 -0.02 0.00 0.00 31.44 29.20 1aww n GLU 7 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1aww s LEU 8 N -2.68 2.73 0.31 -4.62 1.43 -1.26 -5.16 118.68 109.43 1aww s LEU 8 Ca 0.54 -1.33 0.05 0.00 -1.03 0.00 0.00 54.13 52.35 1aww s LEU 8 Cb 0.39 -0.83 -0.06 0.00 0.03 0.00 0.00 46.19 45.72 1aww s LEU 8 CO -0.22 -0.43 0.02 -0.54 0.23 0.00 0.00 176.35 175.41 1aww s LYS 9 N -3.72 1.61 0.16 1.70 1.02 -1.26 -5.09 119.74 114.15 1aww s LYS 9 Ca 0.35 -1.86 0.01 0.00 0.02 0.00 0.00 55.97 54.48 1aww s LYS 9 Cb 0.08 -0.97 0.01 0.00 -0.52 0.00 0.00 37.83 36.44 1aww s LYS 9 CO 0.17 -0.11 0.11 1.63 -0.92 0.00 0.00 175.35 176.23 1aww n LYS 10 N -0.65 1.29 -3.69 1.68 4.01 -1.26 -3.10 118.16 116.45 1aww n LYS 10 Ca -0.04 -1.02 -0.12 0.00 -0.51 0.00 0.00 58.31 56.62 1aww n LYS 10 Cb 0.65 0.13 -0.06 0.00 -0.51 0.00 0.00 35.03 35.24 1aww n LYS 10 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 1aww s VAL 11 N -0.88 0.07 0.58 -0.18 -7.23 -0.98 -2.51 120.40 109.27 1aww s VAL 11 Ca 0.08 -0.55 0.08 0.00 -1.81 0.00 0.00 61.98 59.78 1aww s VAL 11 Cb -0.01 -0.99 0.08 0.00 0.56 0.00 0.00 36.38 36.03 1aww s VAL 11 CO 0.05 -0.30 0.80 -0.69 -0.31 0.00 0.00 175.10 174.65 1aww s VAL 12 N -2.73 2.24 -0.01 1.32 1.01 -0.29 0.37 120.40 122.30 1aww s VAL 12 Ca -0.04 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.07 1aww s VAL 12 Cb -0.00 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 1aww s VAL 12 CO -0.04 0.00 -0.20 0.00 0.00 0.00 0.00 175.10 174.86 1aww s ALA 13 N -2.70 2.44 -0.20 5.51 0.00 0.33 -2.18 121.76 124.96 1aww s ALA 13 Ca 0.62 -1.09 0.09 0.00 0.00 0.00 0.00 51.96 51.57 1aww s ALA 13 Cb -0.06 -0.73 -0.18 0.00 0.00 0.00 0.00 23.12 22.14 1aww s ALA 13 CO 0.39 0.55 -0.06 1.28 0.00 0.00 0.00 175.76 177.92 1aww n LEU 14 N 2.16 1.43 -4.16 0.00 4.77 0.24 -1.98 117.00 119.46 1aww n LEU 14 Ca -0.17 -0.06 -0.14 0.00 -0.03 0.00 0.00 56.01 55.62 1aww n LEU 14 Cb 0.52 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.38 1aww n LEU 14 CO 0.25 0.64 -0.05 -0.31 -1.33 0.00 0.00 177.39 176.59 1aww s TYR 15 N -2.43 1.17 0.51 -1.77 2.02 -1.23 -4.67 117.35 110.95 1aww s TYR 15 Ca -0.19 -1.33 -0.17 0.00 -0.37 0.00 0.00 57.07 55.00 1aww s TYR 15 Cb 0.06 -0.37 -0.08 0.00 -0.40 0.00 0.00 41.96 41.17 1aww s TYR 15 CO 0.62 -0.87 0.99 -0.51 -1.57 0.00 0.00 175.55 174.21 1aww s ASP 16 N -3.21 6.55 -0.43 2.29 1.11 -1.25 -3.62 116.67 118.11 1aww s ASP 16 Ca 0.35 1.64 0.03 0.00 0.18 0.00 0.00 52.55 54.74 1aww s ASP 16 Cb 0.03 -2.52 0.25 0.00 1.07 0.00 0.00 42.92 41.75 1aww s ASP 16 CO 0.18 -0.64 1.02 0.00 1.18 0.00 0.00 175.17 176.90 1aww n TYR 17 N -1.46 -2.30 -0.64 4.23 9.36 -1.26 -4.86 117.16 120.23 1aww n TYR 17 Ca 0.07 -1.34 -0.31 0.00 3.32 0.00 0.00 57.90 59.64 1aww n TYR 17 Cb 0.54 1.39 0.19 0.00 -0.63 0.00 0.00 39.34 40.82 1aww n TYR 17 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 1aww n MET 18 N 1.64 -0.84 -1.20 2.98 2.81 -1.26 -3.00 117.12 118.24 1aww n MET 18 Ca 0.06 -0.19 -0.30 0.00 -1.81 0.00 0.00 57.70 55.46 1aww n MET 18 Cb 0.66 -2.33 0.12 0.00 -0.71 0.00 0.00 33.22 30.96 1aww n MET 18 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1aww s PRO 19 N -4.57 1.68 -0.12 0.03 0.05 -1.26 -4.86 135.00 125.95 1aww s PRO 19 Ca 0.67 1.01 -0.05 0.00 0.05 0.00 0.00 61.00 62.68 1aww s PRO 19 Cb -0.23 -1.84 -0.05 0.00 0.05 0.00 0.00 34.50 32.42 1aww s PRO 19 CO 0.60 -2.00 -0.14 -1.33 0.05 0.00 0.00 177.00 174.17 1aww n MET 20 N -3.75 0.25 0.01 4.56 2.81 -1.26 -4.96 117.12 114.78 1aww n MET 20 Ca 0.08 0.10 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 1aww n MET 20 Cb 0.54 -0.96 0.00 0.00 -0.71 0.00 0.00 33.22 32.09 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 -3.42 0.05 0.00 7.83 2.85 -1.26 -5.06 115.26 116.25 1aww n ASN 21 Ca -0.22 0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.28 1aww n ASN 21 Cb 0.67 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.69 1aww n ASN 21 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1aww n ALA 22 N -2.84 0.00 0.45 5.20 0.00 -1.26 -5.01 120.51 117.06 1aww n ALA 22 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1aww n ALA 22 Cb 0.25 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.61 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 -1.07 -2.21 0.00 2.35 -1.96 -3.44 115.58 109.25 1aww h ASN 23 Ca 0.00 0.04 -0.62 0.00 -0.55 0.00 0.00 56.30 55.17 1aww h ASN 23 Cb 0.00 0.29 0.10 0.00 0.05 0.00 0.00 38.32 38.76 1aww h ASN 23 CO 0.00 -0.73 0.13 0.47 -1.65 0.00 0.00 177.43 175.65 1aww n ASP 24 N -5.29 1.15 -4.83 5.81 8.00 -1.26 -1.58 116.55 118.54 1aww n ASP 24 Ca -0.15 1.16 -0.37 0.00 0.71 0.00 0.00 54.79 56.15 1aww n ASP 24 Cb 0.48 -1.25 -0.06 0.00 -0.02 0.00 0.00 41.12 40.27 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 0.69 4.39 -0.82 0.64 2.96 -1.11 -4.45 118.68 120.97 1aww s LEU 25 Ca 0.63 0.63 -0.25 0.00 -0.22 0.00 0.00 54.13 54.91 1aww s LEU 25 Cb -0.76 -2.29 -0.10 0.00 0.50 0.00 0.00 46.19 43.55 1aww s LEU 25 CO 0.57 0.32 2.21 -1.58 -1.32 0.00 0.00 176.35 176.56 1aww s GLN 26 N -0.74 2.02 0.00 1.98 0.74 -1.26 -4.44 119.66 117.95 1aww s GLN 26 Ca 0.18 0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.79 1aww s GLN 26 Cb -0.14 -4.88 0.00 0.00 1.10 0.00 0.00 33.01 29.09 1aww s GLN 26 CO 0.07 -3.96 0.00 1.28 -0.55 0.00 0.00 175.29 172.13 1aww n LEU 27 N 16.60 0.00 0.00 3.68 4.32 -1.16 -4.96 117.00 135.48 1aww n LEU 27 Ca 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.42 1aww n LEU 27 Cb 0.45 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.25 1aww n LEU 27 CO 0.57 -0.39 0.00 -1.14 -1.22 0.00 0.00 177.39 175.21 1aww n ARG 28 N -0.78 0.00 -4.18 3.23 3.00 -1.24 -4.05 116.66 112.64 1aww n ARG 28 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.52 1aww n ARG 28 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.31 1aww n ARG 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1aww s LYS 29 N 0.50 3.12 0.00 -0.14 2.20 -1.25 -3.49 119.74 120.68 1aww s LYS 29 Ca 0.00 -0.77 0.00 0.00 -0.36 0.00 0.00 55.97 54.84 1aww s LYS 29 Cb 0.00 -2.68 0.00 0.00 -1.51 0.00 0.00 37.83 33.64 1aww s LYS 29 CO 0.00 -0.16 0.00 0.41 -0.36 0.00 0.00 175.35 175.24 1aww n GLY 30 N 4.53 3.18 3.83 5.54 0.00 -0.84 -4.99 105.19 116.44 1aww n GLY 30 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 1aww n GLY 30 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aww s ASP 31 N -0.27 4.52 0.17 1.61 1.11 -1.26 -4.61 116.67 117.93 1aww s ASP 31 Ca 0.00 1.16 0.04 0.00 0.18 0.00 0.00 52.55 53.93 1aww s ASP 31 Cb 0.00 -1.86 -0.05 0.00 1.07 0.00 0.00 42.92 42.09 1aww s ASP 31 CO 0.00 -1.94 -0.06 -1.61 1.18 0.00 0.00 175.17 172.74 1aww s GLU 32 N -5.26 1.11 0.01 8.23 8.01 -1.26 0.12 118.70 129.66 1aww s GLU 32 Ca 0.61 -1.50 0.00 0.00 0.01 0.00 0.00 54.97 54.09 1aww s GLU 32 Cb -0.13 -0.53 -0.00 0.00 -4.31 0.00 0.00 34.13 29.16 1aww s GLU 32 CO 0.53 -0.00 0.00 0.66 0.01 0.00 0.00 175.26 176.46 1aww n TYR 33 N -0.24 0.00 -4.16 1.61 4.01 0.16 -4.70 117.16 113.84 1aww n TYR 33 Ca -0.09 -0.07 -0.33 0.00 -0.16 0.00 0.00 57.90 57.24 1aww n TYR 33 Cb 0.62 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.49 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 -1.63 2.81 0.84 -0.72 0.40 0.71 -2.32 117.98 118.08 1aww s PHE 34 Ca 0.01 -1.40 -0.12 0.00 -0.60 0.00 0.00 56.93 54.82 1aww s PHE 34 Cb 0.00 -1.95 0.10 0.00 0.51 0.00 0.00 43.02 41.68 1aww s PHE 34 CO 0.00 -0.70 1.10 0.42 0.70 0.00 0.00 175.22 176.75 1aww s ILE 35 N 1.24 2.83 0.00 0.64 -1.09 -1.18 0.20 121.20 123.84 1aww s ILE 35 Ca 0.03 0.27 0.00 0.00 -2.23 0.00 0.00 60.65 58.72 1aww s ILE 35 Cb -0.14 -2.93 0.00 0.00 -1.58 0.00 0.00 42.46 37.81 1aww s ILE 35 CO -0.08 -0.35 0.00 -0.11 -1.23 0.00 0.00 174.94 173.16 1aww n LEU 36 N -3.61 0.29 -3.70 2.97 0.00 -1.25 -4.78 117.00 106.92 1aww n LEU 36 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 56.01 56.11 1aww n LEU 36 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.98 1aww n LEU 36 CO 0.56 -0.18 1.14 -0.70 0.00 0.00 0.00 177.39 178.21 1aww s GLU 37 N -1.84 0.23 -1.51 1.96 2.12 -1.26 -5.03 118.70 113.37 1aww s GLU 37 Ca 0.00 -0.14 -0.12 0.00 0.36 0.00 0.00 54.97 55.07 1aww s GLU 37 Cb 0.00 0.07 0.00 0.00 0.26 0.00 0.00 34.13 34.47 1aww s GLU 37 CO 0.00 -0.11 2.47 -0.85 -0.54 0.00 0.00 175.26 176.23 1aww n GLU 38 N -0.61 3.19 0.00 4.30 0.00 -1.26 -4.19 120.64 122.07 1aww n GLU 38 Ca -0.06 -2.51 0.00 0.00 0.00 0.00 0.00 57.16 54.60 1aww n GLU 38 Cb 0.62 -3.10 0.00 0.00 0.00 0.00 0.00 31.44 28.96 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 5.11 0.00 -3.18 -1.84 7.64 -1.26 -4.03 113.62 116.06 1aww n SER 39 Ca 0.61 0.93 -0.22 0.00 1.01 0.00 0.00 58.87 61.20 1aww n SER 39 Cb 0.33 -0.43 -0.05 0.00 -1.01 0.00 0.00 64.21 63.06 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 -2.43 1.46 0.00 6.43 2.85 -1.00 -5.04 115.26 117.53 1aww n ASN 40 Ca 0.00 -3.05 0.00 0.00 -0.11 0.00 0.00 54.58 51.42 1aww n ASN 40 Cb 0.00 -0.62 0.00 0.00 1.24 0.00 0.00 39.78 40.40 1aww n ASN 40 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1aww n LEU 41 N 0.61 0.00 0.09 1.20 -0.00 -1.26 0.12 117.00 117.76 1aww n LEU 41 Ca 0.25 0.00 0.21 0.00 -0.00 0.00 0.00 56.01 56.47 1aww n LEU 41 Cb 0.56 0.00 0.72 0.00 -0.00 0.00 0.00 43.42 44.69 1aww n LEU 41 CO 0.24 0.00 1.18 -0.65 -0.00 0.00 0.00 177.39 178.16 1aww h PRO 42 N 0.00 0.00 -5.54 1.47 0.10 -1.97 -3.36 132.00 122.70 1aww h PRO 42 Ca 0.00 0.00 -0.46 0.00 0.10 0.00 0.00 66.00 65.64 1aww h PRO 42 Cb 0.00 0.00 -0.14 0.00 0.10 0.00 0.00 31.00 30.96 1aww h PRO 42 CO 0.00 0.00 -0.72 -1.58 0.10 0.00 0.00 178.00 175.80 1aww s TRP 43 N -4.54 1.77 0.00 0.65 0.52 0.33 0.10 118.94 117.77 1aww s TRP 43 Ca -0.04 -0.61 0.00 0.00 0.02 0.00 0.00 56.10 55.47 1aww s TRP 43 Cb 0.15 -0.88 0.00 0.00 -1.15 0.00 0.00 33.47 31.59 1aww s TRP 43 CO 0.51 0.33 0.00 0.91 0.02 0.00 0.00 176.95 178.72 1aww n TRP 44 N -0.44 0.00 -3.03 -1.98 8.01 0.13 -2.39 117.44 117.74 1aww n TRP 44 Ca -0.07 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 55.95 1aww n TRP 44 Cb 0.61 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 29.90 1aww n TRP 44 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 1aww n ARG 45 N 0.00 1.25 -3.00 -0.99 5.12 -1.26 -2.98 116.66 114.81 1aww n ARG 45 Ca 0.00 -3.50 -0.21 0.00 -1.93 0.00 0.00 57.85 52.22 1aww n ARG 45 Cb 0.00 -1.66 0.01 0.00 -1.16 0.00 0.00 32.46 29.65 1aww n ARG 45 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1aww s ALA 46 N -2.69 4.02 0.24 7.54 0.00 -1.26 -3.90 121.76 125.71 1aww s ALA 46 Ca 0.38 -1.32 0.10 0.00 0.00 0.00 0.00 51.96 51.12 1aww s ALA 46 Cb 0.37 -1.94 -0.04 0.00 0.00 0.00 0.00 23.12 21.51 1aww s ALA 46 CO -0.06 -0.39 -0.06 1.03 0.00 0.00 0.00 175.76 176.27 1aww s ARG 47 N -4.50 2.13 0.00 0.00 0.52 0.13 -1.68 118.95 115.55 1aww s ARG 47 Ca 0.51 -1.42 0.00 0.00 -0.52 0.00 0.00 55.73 54.30 1aww s ARG 47 Cb -0.10 -2.10 0.00 0.00 0.52 0.00 0.00 34.95 33.27 1aww s ARG 47 CO 0.36 0.38 0.00 -0.40 0.02 0.00 0.00 175.30 175.66 1aww n ASP 48 N -0.56 0.00 0.14 0.23 5.75 -1.00 -0.21 116.55 120.91 1aww n ASP 48 Ca -0.08 -0.06 0.12 0.00 -0.01 0.00 0.00 54.79 54.76 1aww n ASP 48 Cb 0.58 0.00 0.51 0.00 -1.03 0.00 0.00 41.12 41.18 1aww n ASP 48 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 1aww h LYS 49 N 0.00 0.00 -0.43 0.11 6.56 -1.92 -2.76 116.57 118.13 1aww h LYS 49 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1aww h LYS 49 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1aww h LYS 49 CO 0.00 0.00 0.00 0.09 -2.06 0.00 0.00 179.45 177.48 1aww n ASN 50 N -2.31 1.87 -2.07 0.86 4.13 -1.26 -4.87 115.26 111.62 1aww n ASN 50 Ca 0.02 -2.09 -0.21 0.00 1.68 0.00 0.00 54.58 53.98 1aww n ASN 50 Cb 0.24 -0.29 -0.04 0.00 -1.54 0.00 0.00 39.78 38.15 1aww n ASN 50 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1aww n GLY 51 N 0.78 0.39 3.37 7.41 0.00 -1.04 -4.96 105.19 111.13 1aww n GLY 51 Ca 0.10 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 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 -4.57 3.42 0.37 1.61 -0.21 -1.26 -4.92 119.66 114.10 1aww s GLN 52 Ca 0.00 -0.65 -0.11 0.00 0.02 0.00 0.00 55.36 54.62 1aww s GLN 52 Cb 0.00 -2.78 -0.07 0.00 1.00 0.00 0.00 33.01 31.16 1aww s GLN 52 CO 0.00 0.10 0.74 -1.83 -2.12 0.00 0.00 175.29 172.18 1aww s GLU 53 N 0.67 3.83 0.00 2.91 -1.05 -1.26 -2.38 118.70 121.42 1aww s GLU 53 Ca -0.05 0.49 0.00 0.00 -0.15 0.00 0.00 54.97 55.26 1aww s GLU 53 Cb -0.15 -2.42 0.00 0.00 -0.44 0.00 0.00 34.13 31.11 1aww s GLU 53 CO 0.02 0.04 0.00 0.41 0.95 0.00 0.00 175.26 176.68 1aww n GLY 54 N -0.99 2.44 2.87 -3.83 0.00 -0.67 -4.88 105.19 100.13 1aww n GLY 54 Ca 0.02 0.18 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 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 1.61 0.38 -0.17 1.61 1.51 -0.61 -4.12 117.35 117.55 1aww s TYR 55 Ca 0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.01 1aww s TYR 55 Cb 0.00 -0.37 0.03 0.00 -0.11 0.00 0.00 41.96 41.52 1aww s TYR 55 CO 0.00 -0.09 -0.12 0.42 -1.11 0.00 0.00 175.55 174.65 1aww s ILE 56 N 0.57 1.54 -0.12 2.71 -1.09 -1.16 -2.76 121.20 120.88 1aww s ILE 56 Ca -0.06 -0.76 -0.29 0.00 -2.23 0.00 0.00 60.65 57.31 1aww s ILE 56 Cb -0.09 -1.53 -0.06 0.00 -1.58 0.00 0.00 42.46 39.20 1aww s ILE 56 CO -0.01 0.32 1.92 -2.84 -1.23 0.00 0.00 174.94 173.11 1aww s PRO 57 N 1.47 3.73 0.53 2.79 0.02 -1.26 0.19 135.00 142.46 1aww s PRO 57 Ca 0.02 2.12 0.38 0.00 0.02 0.00 0.00 61.00 63.55 1aww s PRO 57 Cb -0.14 -4.18 1.55 0.00 0.02 0.00 0.00 34.50 31.75 1aww s PRO 57 CO -0.09 -1.41 1.73 1.03 -0.33 0.00 0.00 177.00 177.93 1aww h SER 58 N 11.96 0.06 0.19 2.53 0.87 0.53 0.21 113.55 129.89 1aww h SER 58 Ca -0.42 0.02 -0.31 0.00 -1.23 0.00 0.00 61.79 59.86 1aww h SER 58 Cb 1.21 0.01 0.03 0.00 -0.44 0.00 0.00 62.40 63.21 1aww h SER 58 CO 0.97 -0.01 -1.29 -0.55 -0.53 0.00 0.00 176.83 175.41 1aww h ASN 59 N 0.04 0.84 0.34 6.23 7.08 -1.88 -3.24 115.58 125.00 1aww h ASN 59 Ca 0.68 -0.81 0.00 0.00 -3.08 0.00 0.00 56.30 53.09 1aww h ASN 59 Cb 2.61 -0.27 0.00 0.00 -2.08 0.00 0.00 38.32 38.58 1aww h ASN 59 CO -0.07 1.61 0.00 1.88 -2.08 0.00 0.00 177.43 178.78 1aww h TYR 60 N 0.24 0.00 -2.99 4.14 -1.99 -0.95 -3.44 116.97 111.98 1aww h TYR 60 Ca -0.20 0.00 -0.42 0.00 2.00 0.00 0.00 58.73 60.11 1aww h TYR 60 Cb 1.97 0.00 -0.14 0.00 2.00 0.00 0.00 36.73 40.56 1aww h TYR 60 CO 0.11 0.00 -0.72 0.14 -0.00 0.00 0.00 178.16 177.70 1aww s VAL 61 N -3.76 1.55 0.00 -2.88 -7.23 -1.06 0.82 120.40 107.84 1aww s VAL 61 Ca -0.02 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.00 1aww s VAL 61 Cb 0.10 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 34.96 1aww s VAL 61 CO 0.38 -0.57 0.00 1.07 -0.31 0.00 0.00 175.10 175.67 1aww n THR 62 N -0.37 0.00 -2.83 5.32 5.66 -0.92 -4.86 114.28 116.27 1aww n THR 62 Ca -0.08 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.56 1aww n THR 62 Cb 0.61 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.33 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 3.10 4.47 0.59 1.09 2.02 -1.26 -1.14 118.70 127.56 1aww s GLU 63 Ca 0.00 1.22 0.29 0.00 0.02 0.00 0.00 54.97 56.50 1aww s GLU 63 Cb 0.00 -2.69 1.42 0.00 0.10 0.00 0.00 34.13 32.97 1aww s GLU 63 CO 0.00 0.23 1.83 0.00 0.02 0.00 0.00 175.26 177.34 1aww h ALA 64 N 2.95 2.31 -2.09 5.21 0.00 -1.65 -2.85 119.26 123.13 1aww h ALA 64 Ca -0.47 -0.02 -0.55 0.00 0.00 0.00 0.00 54.91 53.87 1aww h ALA 64 Cb 1.19 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 1aww h ALA 64 CO 0.64 -0.87 -0.59 -1.21 0.00 0.00 0.00 179.25 177.22 1aww s GLU 65 N -4.62 2.40 -0.15 0.00 8.01 -1.26 -4.62 118.70 118.47 1aww s GLU 65 Ca -0.04 -1.42 -0.06 0.00 0.01 0.00 0.00 54.97 53.47 1aww s GLU 65 Cb 0.16 -2.22 0.02 0.00 -4.31 0.00 0.00 34.13 27.78 1aww s GLU 65 CO 0.56 0.28 0.11 -3.47 0.01 0.00 0.00 175.26 172.75 1aww n ASP 66 N -1.02 -4.35 0.00 -0.19 -0.08 -1.26 -4.94 116.55 104.70 1aww n ASP 66 Ca -0.05 1.18 0.00 0.00 -1.51 0.00 0.00 54.79 54.40 1aww n ASP 66 Cb 0.60 -4.03 0.00 0.00 2.34 0.00 0.00 41.12 40.02 1aww n ASP 66 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78