#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 4.86 -0.35 1.61 0.15 -1.26 -5.07 113.70 113.64 1aww s SER 2 Ca 0.00 -0.14 -0.00 0.00 0.70 0.00 0.00 55.95 56.51 1aww s SER 2 Cb 0.00 -1.81 0.11 0.00 -1.71 0.00 0.00 66.02 62.62 1aww s SER 2 CO 0.00 0.14 0.15 -0.32 1.20 0.00 0.00 173.24 174.41 1aww s MET 3 N 0.56 0.77 -0.36 5.44 0.00 -1.26 -4.96 119.30 119.50 1aww s MET 3 Ca -0.02 -1.28 0.13 0.00 0.00 0.00 0.00 55.69 54.52 1aww s MET 3 Cb -0.14 -1.89 0.42 0.00 0.00 0.00 0.00 34.83 33.22 1aww s MET 3 CO 0.02 -1.06 1.29 0.45 0.00 0.00 0.00 175.02 175.72 1aww n SER 4 N 4.46 -0.84 -3.33 1.11 2.88 -1.26 -5.03 113.62 111.61 1aww n SER 4 Ca 0.02 -2.43 -0.09 0.00 -1.33 0.00 0.00 58.87 55.04 1aww n SER 4 Cb 0.39 0.51 0.00 0.00 -0.75 0.00 0.00 64.21 64.36 1aww n SER 4 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1aww n THR 5 N -0.68 -7.67 0.00 2.46 -1.04 -1.26 -4.98 114.28 101.11 1aww n THR 5 Ca -0.03 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1aww n THR 5 Cb 0.85 -5.47 0.00 0.00 -1.82 0.00 0.00 70.33 63.89 1aww n THR 5 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1aww n SER 6 N -2.09 0.00 -4.33 8.00 2.88 -1.26 -4.81 113.62 112.01 1aww n SER 6 Ca -0.12 0.19 -0.46 0.00 -1.33 0.00 0.00 58.87 57.15 1aww n SER 6 Cb 0.57 -0.37 -0.05 0.00 -0.75 0.00 0.00 64.21 63.61 1aww n SER 6 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1aww s GLU 7 N -0.73 3.00 -0.12 -1.46 0.41 -1.26 -5.05 118.70 113.49 1aww s GLU 7 Ca 0.00 -1.59 -0.03 0.00 -0.41 0.00 0.00 54.97 52.95 1aww s GLU 7 Cb 0.00 -4.26 -0.03 0.00 -1.78 0.00 0.00 34.13 28.06 1aww s GLU 7 CO 0.00 -1.29 -0.01 -1.17 -0.49 0.00 0.00 175.26 172.29 1aww s LEU 8 N 1.74 3.44 0.08 1.80 2.96 -1.26 -4.93 118.68 122.52 1aww s LEU 8 Ca 0.04 0.02 -0.27 0.00 -0.22 0.00 0.00 54.13 53.71 1aww s LEU 8 Cb -0.28 -1.80 0.08 0.00 0.50 0.00 0.00 46.19 44.69 1aww s LEU 8 CO 0.04 0.29 1.00 -1.59 -1.32 0.00 0.00 176.35 174.77 1aww s LYS 9 N -0.33 0.97 0.48 1.98 -2.85 -1.26 -5.09 119.74 113.65 1aww s LYS 9 Ca 0.06 -0.50 0.05 0.00 -1.00 0.00 0.00 55.97 54.58 1aww s LYS 9 Cb -0.12 0.35 0.05 0.00 -2.06 0.00 0.00 37.83 36.05 1aww s LYS 9 CO 0.02 -0.44 0.40 1.63 0.10 0.00 0.00 175.35 177.05 1aww n LYS 10 N -0.41 0.77 -3.61 1.78 5.02 -1.26 -1.46 118.16 118.99 1aww n LYS 10 Ca -0.07 -2.95 -0.11 0.00 -2.02 0.00 0.00 58.31 53.17 1aww n LYS 10 Cb 0.61 0.26 -0.04 0.00 -0.02 0.00 0.00 35.03 35.83 1aww n LYS 10 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1aww s VAL 11 N -2.34 0.06 0.51 -0.18 -7.23 -0.97 -2.99 120.40 107.26 1aww s VAL 11 Ca 0.30 -0.51 0.09 0.00 -1.81 0.00 0.00 61.98 60.05 1aww s VAL 11 Cb -0.02 -1.14 0.05 0.00 0.56 0.00 0.00 36.38 35.82 1aww s VAL 11 CO 0.19 -0.28 0.64 -0.69 -0.31 0.00 0.00 175.10 174.65 1aww s VAL 12 N -3.75 2.41 -0.00 1.32 1.01 -0.96 0.33 120.40 120.75 1aww s VAL 12 Ca 0.02 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 60.94 1aww s VAL 12 Cb 0.01 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 1aww s VAL 12 CO -0.12 0.00 -0.03 0.00 0.00 0.00 0.00 175.10 174.95 1aww s ALA 13 N -2.56 3.17 -0.09 5.51 0.00 0.51 -0.87 121.76 127.43 1aww s ALA 13 Ca 0.56 -0.98 0.05 0.00 0.00 0.00 0.00 51.96 51.59 1aww s ALA 13 Cb -0.06 -1.25 -0.09 0.00 0.00 0.00 0.00 23.12 21.72 1aww s ALA 13 CO 0.34 0.63 -0.01 1.28 0.00 0.00 0.00 175.76 178.00 1aww n LEU 14 N 1.47 1.05 -4.67 0.00 4.77 0.29 -1.68 117.00 118.23 1aww n LEU 14 Ca -0.15 -0.02 -0.31 0.00 -0.03 0.00 0.00 56.01 55.50 1aww n LEU 14 Cb 0.53 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.54 1aww n LEU 14 CO 0.32 0.36 -0.22 -0.31 -1.33 0.00 0.00 177.39 176.21 1aww s TYR 15 N -2.20 1.79 -0.23 -1.77 2.02 -1.24 -4.60 117.35 111.12 1aww s TYR 15 Ca -0.07 -1.13 -0.11 0.00 -0.37 0.00 0.00 57.07 55.39 1aww s TYR 15 Cb 0.03 -1.41 -0.05 0.00 -0.40 0.00 0.00 41.96 40.13 1aww s TYR 15 CO 0.29 -0.02 0.18 -0.51 -1.57 0.00 0.00 175.55 173.93 1aww s ASP 16 N -3.79 6.18 -0.27 2.29 1.01 -1.26 0.10 116.67 120.94 1aww s ASP 16 Ca 0.10 0.19 -0.03 0.00 0.71 0.00 0.00 52.55 53.52 1aww s ASP 16 Cb 0.01 -2.12 0.15 0.00 1.01 0.00 0.00 42.92 41.97 1aww s ASP 16 CO 0.07 0.07 0.49 -0.47 0.21 0.00 0.00 175.17 175.54 1aww s TYR 17 N 0.95 -1.18 0.26 4.23 6.14 -1.25 -4.92 117.35 121.58 1aww s TYR 17 Ca 0.09 1.39 0.05 0.00 0.64 0.00 0.00 57.07 59.25 1aww s TYR 17 Cb -0.13 0.34 -0.03 0.00 0.42 0.00 0.00 41.96 42.56 1aww s TYR 17 CO 0.04 -0.75 0.38 -1.64 0.64 0.00 0.00 175.55 174.21 1aww s MET 18 N 2.71 3.35 0.51 4.97 -1.94 -1.26 -1.01 119.30 126.63 1aww s MET 18 Ca 0.13 -0.83 -0.22 0.00 -1.71 0.00 0.00 55.69 53.06 1aww s MET 18 Cb -0.15 -2.87 -0.06 0.00 2.01 0.00 0.00 34.83 33.77 1aww s MET 18 CO -0.18 0.35 1.30 -2.14 -0.01 0.00 0.00 175.02 174.34 1aww s PRO 19 N -4.02 3.39 -0.25 2.03 0.02 -1.26 -4.91 135.00 129.99 1aww s PRO 19 Ca 0.36 2.10 -0.15 0.00 0.02 0.00 0.00 61.00 63.34 1aww s PRO 19 Cb -0.09 -2.34 -0.10 0.00 0.02 0.00 0.00 34.50 31.99 1aww s PRO 19 CO 0.29 -0.95 -0.35 -1.33 -0.33 0.00 0.00 177.00 174.33 1aww n MET 20 N -0.78 0.57 0.01 5.54 2.81 -1.26 -4.92 117.12 119.09 1aww n MET 20 Ca 0.09 0.24 -0.03 0.00 -1.81 0.00 0.00 57.70 56.19 1aww n MET 20 Cb 0.46 -1.46 -0.01 0.00 -0.71 0.00 0.00 33.22 31.50 1aww n MET 20 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1aww n ASN 21 N -4.30 1.27 0.00 7.83 3.02 -1.26 -5.06 115.26 116.76 1aww n ASN 21 Ca -0.42 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 1aww n ASN 21 Cb 0.78 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 1aww n ASN 21 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1aww n ALA 22 N -3.71 0.00 0.49 5.41 0.00 -1.26 -5.00 120.51 116.43 1aww n ALA 22 Ca -0.04 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 1aww n ALA 22 Cb 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.52 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 -1.13 -1.79 0.00 2.35 -1.97 -3.44 115.58 109.60 1aww h ASN 23 Ca 0.00 0.05 -0.64 0.00 -0.55 0.00 0.00 56.30 55.15 1aww h ASN 23 Cb 0.00 0.30 0.10 0.00 0.05 0.00 0.00 38.32 38.78 1aww h ASN 23 CO 0.00 -0.78 -0.09 0.47 -1.65 0.00 0.00 177.43 175.39 1aww n ASP 24 N -5.50 0.33 -4.74 5.81 8.00 -1.26 -2.07 116.55 117.12 1aww n ASP 24 Ca -0.16 1.15 -0.27 0.00 0.71 0.00 0.00 54.79 56.23 1aww n ASP 24 Cb 0.51 -1.14 -0.07 0.00 -0.02 0.00 0.00 41.12 40.40 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 1.38 3.61 0.07 0.64 2.96 -1.09 -4.44 118.68 121.80 1aww s LEU 25 Ca 0.64 -0.21 -0.31 0.00 -0.22 0.00 0.00 54.13 54.04 1aww s LEU 25 Cb -0.83 -2.25 -0.10 0.00 0.50 0.00 0.00 46.19 43.50 1aww s LEU 25 CO 0.57 0.10 1.93 1.67 -1.32 0.00 0.00 176.35 179.29 1aww n GLN 26 N -0.10 2.83 -0.94 1.98 7.27 -1.26 -4.53 117.38 122.64 1aww n GLN 26 Ca -0.09 1.03 0.02 0.00 0.07 0.00 0.00 57.00 58.04 1aww n GLN 26 Cb 0.54 -2.97 0.16 0.00 2.41 0.00 0.00 30.24 30.38 1aww n GLN 26 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1aww n LEU 27 N 6.82 2.70 -4.68 1.69 4.77 -0.18 -4.91 117.00 123.21 1aww n LEU 27 Ca 0.19 -3.72 -0.45 0.00 -0.03 0.00 0.00 56.01 52.01 1aww n LEU 27 Cb 0.39 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 41.03 1aww n LEU 27 CO 0.67 1.35 1.49 0.54 -1.33 0.00 0.00 177.39 180.12 1aww n ARG 28 N -0.84 2.51 -1.55 3.23 1.74 -1.25 -3.88 116.66 116.63 1aww n ARG 28 Ca 0.20 0.92 -0.45 0.00 -0.77 0.00 0.00 57.85 57.74 1aww n ARG 28 Cb 0.79 -2.80 -0.02 0.00 -1.02 0.00 0.00 32.46 29.41 1aww n ARG 28 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1aww n LYS 29 N 6.34 1.08 0.00 5.56 4.81 0.29 -1.46 118.16 134.79 1aww n LYS 29 Ca 0.20 0.38 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 1aww n LYS 29 Cb 0.34 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.71 1aww n LYS 29 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1aww n GLY 30 N 1.42 2.84 3.76 3.14 0.00 -0.68 -4.91 105.19 110.76 1aww n GLY 30 Ca 0.12 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 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 0.61 7.25 0.19 1.61 1.01 -0.53 -4.67 116.67 122.15 1aww s ASP 31 Ca 0.00 1.49 0.07 0.00 0.71 0.00 0.00 52.55 54.82 1aww s ASP 31 Cb 0.00 -2.46 -0.04 0.00 1.01 0.00 0.00 42.92 41.43 1aww s ASP 31 CO 0.00 0.11 0.05 -1.61 0.21 0.00 0.00 175.17 173.94 1aww s GLU 32 N -0.55 2.56 0.00 8.23 8.01 -1.26 -0.36 118.70 135.33 1aww s GLU 32 Ca 0.36 -1.09 0.00 0.00 0.01 0.00 0.00 54.97 54.26 1aww s GLU 32 Cb -0.21 -2.42 0.00 0.00 -4.31 0.00 0.00 34.13 27.19 1aww s GLU 32 CO 0.23 0.44 0.00 0.66 0.01 0.00 0.00 175.26 176.61 1aww n TYR 33 N -0.38 0.00 -4.56 1.61 4.01 0.15 -4.59 117.16 113.39 1aww n TYR 33 Ca -0.09 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.32 1aww n TYR 33 Cb 0.56 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.43 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 -1.20 2.74 -0.06 -0.72 0.40 0.78 -2.29 117.98 117.62 1aww s PHE 34 Ca 0.00 -1.16 -0.19 0.00 -0.60 0.00 0.00 56.93 54.98 1aww s PHE 34 Cb 0.00 -1.87 -0.05 0.00 0.51 0.00 0.00 43.02 41.62 1aww s PHE 34 CO 0.00 -0.53 0.51 0.42 0.70 0.00 0.00 175.22 176.32 1aww s ILE 35 N 0.84 5.07 -0.13 0.64 -1.09 -0.53 -0.04 121.20 125.95 1aww s ILE 35 Ca -0.05 1.05 0.09 0.00 -2.23 0.00 0.00 60.65 59.51 1aww s ILE 35 Cb -0.15 -3.85 -0.14 0.00 -1.58 0.00 0.00 42.46 36.73 1aww s ILE 35 CO -0.01 0.39 0.01 0.18 -1.23 0.00 0.00 174.94 174.28 1aww n LEU 36 N 3.12 0.52 0.00 2.97 4.77 -1.24 -4.17 117.00 122.97 1aww n LEU 36 Ca -0.08 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1aww n LEU 36 Cb 0.51 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.76 1aww n LEU 36 CO 0.43 0.39 0.00 1.21 -1.33 0.00 0.00 177.39 178.08 1aww n GLU 37 N -2.55 0.00 -0.42 3.23 2.13 -1.26 -5.01 120.64 116.76 1aww n GLU 37 Ca -0.22 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.60 1aww n GLU 37 Cb 0.89 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.60 1aww n GLU 37 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 1aww n GLU 38 N 0.00 0.00 0.00 5.31 0.28 -1.26 -3.72 120.64 121.25 1aww n GLU 38 Ca 0.00 -0.73 0.00 0.00 -0.16 0.00 0.00 57.16 56.27 1aww n GLU 38 Cb 0.00 -0.40 0.00 0.00 1.43 0.00 0.00 31.44 32.47 1aww n GLU 38 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1aww n SER 39 N 0.00 -1.24 -2.26 -1.84 7.64 -1.26 -3.44 113.62 111.22 1aww n SER 39 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 1aww n SER 39 Cb 0.63 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.94 1aww n SER 39 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1aww n ASN 40 N -3.75 6.42 -3.61 6.43 0.23 -1.26 -4.93 115.26 114.78 1aww n ASN 40 Ca 0.00 -3.67 -0.08 0.00 -0.53 0.00 0.00 54.58 50.30 1aww n ASN 40 Cb 0.00 -0.94 -0.02 0.00 -2.08 0.00 0.00 39.78 36.74 1aww n ASN 40 CO 0.00 0.00 0.00 -1.48 -0.93 0.00 0.00 177.26 174.85 1aww s LEU 41 N -3.50 -0.34 0.55 -4.53 2.34 -1.22 -5.03 118.68 106.94 1aww s LEU 41 Ca 0.60 -0.20 0.32 0.00 0.06 0.00 0.00 54.13 54.91 1aww s LEU 41 Cb 0.48 2.30 1.49 0.00 -0.56 0.00 0.00 46.19 49.89 1aww s LEU 41 CO 0.03 -0.89 1.86 -0.65 -1.06 0.00 0.00 176.35 175.64 1aww h PRO 42 N 2.00 0.00 -6.40 1.48 0.10 -1.92 -3.39 132.00 123.87 1aww h PRO 42 Ca -0.25 0.00 -0.54 0.00 0.10 0.00 0.00 66.00 65.31 1aww h PRO 42 Cb 1.26 0.00 -0.02 0.00 0.10 0.00 0.00 31.00 32.34 1aww h PRO 42 CO 0.30 0.00 0.46 -1.58 0.10 0.00 0.00 178.00 177.27 1aww s TRP 43 N -4.93 3.57 0.00 0.65 0.52 -1.25 0.10 118.94 117.60 1aww s TRP 43 Ca -0.05 1.58 0.00 0.00 0.02 0.00 0.00 56.10 57.65 1aww s TRP 43 Cb 0.21 -3.21 0.00 0.00 -1.15 0.00 0.00 33.47 29.32 1aww s TRP 43 CO 0.75 -0.37 0.00 0.91 0.02 0.00 0.00 176.95 178.27 1aww n TRP 44 N 4.15 -0.02 -3.22 -1.98 8.01 0.18 -4.33 117.44 120.24 1aww n TRP 44 Ca 0.07 0.00 -0.24 0.00 -1.31 0.00 0.00 57.50 56.02 1aww n TRP 44 Cb 0.49 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.73 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 -0.01 1.52 -3.88 -0.99 0.63 -1.24 -2.45 116.66 110.24 1aww n ARG 45 Ca 0.00 -3.81 -0.24 0.00 -0.92 0.00 0.00 57.85 52.89 1aww n ARG 45 Cb 0.00 -1.69 -0.02 0.00 0.45 0.00 0.00 32.46 31.19 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 -2.04 3.91 0.08 5.13 0.00 -1.26 -3.66 121.76 123.93 1aww s ALA 46 Ca 0.39 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 51.28 1aww s ALA 46 Cb 0.22 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 1aww s ALA 46 CO -0.08 0.34 0.11 1.03 0.00 0.00 0.00 175.76 177.16 1aww s ARG 47 N -3.68 3.01 0.00 0.00 0.52 0.94 -2.23 118.95 117.51 1aww s ARG 47 Ca 0.35 -0.64 0.00 0.00 -0.52 0.00 0.00 55.73 54.92 1aww s ARG 47 Cb -0.10 -2.80 0.00 0.00 0.52 0.00 0.00 34.95 32.57 1aww s ARG 47 CO 0.29 0.57 0.00 -0.40 0.02 0.00 0.00 175.30 175.79 1aww n ASP 48 N 0.39 0.00 -1.45 0.23 5.75 -1.01 -0.15 116.55 120.30 1aww n ASP 48 Ca -0.08 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.73 1aww n ASP 48 Cb 0.52 0.00 0.25 0.00 -1.03 0.00 0.00 41.12 40.86 1aww n ASP 48 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1aww n LYS 49 N 0.00 3.37 -0.03 0.11 5.02 -1.26 -3.99 118.16 121.39 1aww n LYS 49 Ca 0.00 -2.05 -0.02 0.00 -2.02 0.00 0.00 58.31 54.23 1aww n LYS 49 Cb 0.00 -1.98 -0.07 0.00 -0.02 0.00 0.00 35.03 32.96 1aww n LYS 49 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1aww n ASN 50 N 0.31 2.99 0.00 4.39 3.02 -1.26 -5.02 115.26 119.69 1aww n ASN 50 Ca 0.20 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.75 1aww n ASN 50 Cb 0.91 0.91 0.00 0.00 -0.61 0.00 0.00 39.78 40.99 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 2.35 1.93 3.05 7.41 0.00 -1.26 -5.12 105.19 113.55 1aww n GLY 51 Ca -0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.39 1.22 0.22 1.61 -0.21 -1.26 -5.00 119.66 115.86 1aww s GLN 52 Ca 0.00 -0.41 -0.03 0.00 0.02 0.00 0.00 55.36 54.94 1aww s GLN 52 Cb 0.00 -1.11 -0.05 0.00 1.00 0.00 0.00 33.01 32.85 1aww s GLN 52 CO 0.00 0.16 0.45 -1.83 -2.12 0.00 0.00 175.29 171.96 1aww s GLU 53 N 0.12 3.59 0.00 2.91 -1.05 -1.26 -2.41 118.70 120.60 1aww s GLU 53 Ca -0.03 -0.14 0.00 0.00 -0.15 0.00 0.00 54.97 54.65 1aww s GLU 53 Cb -0.09 -2.76 0.00 0.00 -0.44 0.00 0.00 34.13 30.83 1aww s GLU 53 CO 0.01 0.34 0.00 0.41 0.95 0.00 0.00 175.26 176.97 1aww n GLY 54 N -0.60 3.02 3.21 -3.83 0.00 -0.94 -4.89 105.19 101.16 1aww n GLY 54 Ca -0.03 0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 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 1.43 1.59 -0.19 1.61 2.02 -0.88 -4.07 117.35 118.87 1aww s TYR 55 Ca 0.00 -0.37 -0.05 0.00 -0.37 0.00 0.00 57.07 56.28 1aww s TYR 55 Cb 0.00 -0.94 0.07 0.00 -0.40 0.00 0.00 41.96 40.69 1aww s TYR 55 CO 0.00 0.08 0.09 0.42 -1.57 0.00 0.00 175.55 174.57 1aww s ILE 56 N -0.85 -0.07 0.19 2.71 -1.09 -1.02 -2.68 121.20 118.39 1aww s ILE 56 Ca 0.05 -0.26 -0.31 0.00 -2.23 0.00 0.00 60.65 57.89 1aww s ILE 56 Cb -0.09 -0.65 -0.11 0.00 -1.58 0.00 0.00 42.46 40.04 1aww s ILE 56 CO 0.02 -0.35 1.59 -2.84 -1.23 0.00 0.00 174.94 172.13 1aww s PRO 57 N 2.13 4.19 0.16 2.79 0.02 -1.26 0.51 135.00 143.54 1aww s PRO 57 Ca 0.03 2.42 -0.17 0.00 0.02 0.00 0.00 61.00 63.30 1aww s PRO 57 Cb -0.16 -3.13 0.07 0.00 0.02 0.00 0.00 34.50 31.31 1aww s PRO 57 CO -0.13 -0.63 1.71 0.66 -0.33 0.00 0.00 177.00 178.28 1aww h SER 58 N 6.57 -0.12 -0.91 2.53 4.64 0.35 -2.04 113.55 124.57 1aww h SER 58 Ca -0.43 0.08 0.01 0.00 -0.47 0.00 0.00 61.79 60.98 1aww h SER 58 Cb 1.21 0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 63.38 1aww h SER 58 CO 0.91 -0.02 0.60 -0.55 -0.87 0.00 0.00 176.83 176.90 1aww h ASN 59 N 0.11 1.04 -0.10 4.97 -1.07 -1.90 -2.38 115.58 116.25 1aww h ASN 59 Ca 0.17 -0.02 -0.02 0.00 0.07 0.00 0.00 56.30 56.49 1aww h ASN 59 Cb 0.23 -0.25 -0.01 0.00 -2.07 0.00 0.00 38.32 36.21 1aww h ASN 59 CO -0.28 0.74 0.01 1.88 0.07 0.00 0.00 177.43 179.85 1aww h TYR 60 N 1.22 0.26 -1.60 4.14 -1.99 -1.76 -3.45 116.97 113.79 1aww h TYR 60 Ca 0.34 -0.01 -0.57 0.00 2.00 0.00 0.00 58.73 60.49 1aww h TYR 60 Cb -0.11 -0.08 -0.09 0.00 2.00 0.00 0.00 36.73 38.45 1aww h TYR 60 CO -0.00 0.27 -0.51 0.14 -0.00 0.00 0.00 178.16 178.06 1aww s VAL 61 N -5.01 2.27 0.00 -2.88 -7.23 -0.90 0.11 120.40 106.76 1aww s VAL 61 Ca -0.06 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.38 1aww s VAL 61 Cb 0.16 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 34.10 1aww s VAL 61 CO 0.72 -0.00 0.00 1.07 -0.31 0.00 0.00 175.10 176.57 1aww n THR 62 N -1.20 0.00 -3.38 5.32 5.66 -0.05 -4.86 114.28 115.76 1aww n THR 62 Ca -0.02 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.60 1aww n THR 62 Cb 0.65 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.37 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 4.49 4.12 0.55 1.09 8.01 -1.26 -2.26 118.70 133.44 1aww s GLU 63 Ca 0.00 0.52 0.32 0.00 0.01 0.00 0.00 54.97 55.82 1aww s GLU 63 Cb 0.00 -3.29 1.49 0.00 -4.31 0.00 0.00 34.13 28.02 1aww s GLU 63 CO 0.00 0.52 1.86 0.00 0.01 0.00 0.00 175.26 177.65 1aww h ALA 64 N 5.25 2.82 -3.09 5.21 0.00 -1.68 -2.98 119.26 124.79 1aww h ALA 64 Ca -0.48 -0.03 -0.64 0.00 0.00 0.00 0.00 54.91 53.75 1aww h ALA 64 Cb 1.21 0.07 -0.12 0.00 0.00 0.00 0.00 17.79 18.94 1aww h ALA 64 CO 0.66 -1.14 -0.54 -1.21 0.00 0.00 0.00 179.25 177.02 1aww s GLU 65 N -4.92 3.62 -0.21 0.00 2.02 -1.26 -4.65 118.70 113.30 1aww s GLU 65 Ca -0.05 -0.28 -0.24 0.00 0.02 0.00 0.00 54.97 54.42 1aww s GLU 65 Cb 0.21 -3.14 -0.01 0.00 0.10 0.00 0.00 34.13 31.29 1aww s GLU 65 CO 0.75 0.53 0.79 0.34 0.02 0.00 0.00 175.26 177.69 1aww s ASP 66 N -0.35 6.84 0.00 -0.19 2.15 -1.26 -5.00 116.67 118.87 1aww s ASP 66 Ca 0.10 1.04 0.00 0.00 0.43 0.00 0.00 52.55 54.12 1aww s ASP 66 Cb -0.12 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1aww s ASP 66 CO 0.02 -0.44 0.00 -1.20 -0.17 0.00 0.00 175.17 173.38