#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 0.00 0.18 1.61 7.64 -1.26 -2.84 113.62 118.95 1aww n SER 2 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 1aww n SER 2 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 1aww n SER 2 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1aww h MET 3 N 0.00 -0.50 -6.20 1.43 4.05 -2.08 -3.47 114.93 108.15 1aww h MET 3 Ca 0.00 0.03 -0.44 0.00 -0.28 0.00 0.00 59.70 59.01 1aww h MET 3 Cb 0.00 0.11 0.02 0.00 -0.80 0.00 0.00 31.60 30.93 1aww h MET 3 CO 0.00 -0.33 -0.83 0.45 0.23 0.00 0.00 176.91 176.43 1aww n SER 4 N -4.94 -1.58 -2.96 1.39 2.88 -1.13 -4.92 113.62 102.36 1aww n SER 4 Ca -0.06 -0.85 -0.18 0.00 -1.33 0.00 0.00 58.87 56.44 1aww n SER 4 Cb 0.21 -3.84 -0.02 0.00 -0.75 0.00 0.00 64.21 59.81 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 -4.36 0.93 0.00 2.46 -1.04 -1.26 -4.83 114.28 106.18 1aww n THR 5 Ca -0.25 -4.45 0.00 0.00 -2.04 0.00 0.00 64.05 57.32 1aww n THR 5 Cb 0.65 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.82 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 0.04 0.00 -2.53 8.00 2.88 -1.26 -4.97 113.62 115.78 1aww n SER 6 Ca 0.24 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.46 1aww n SER 6 Cb 0.65 0.06 0.03 0.00 -0.75 0.00 0.00 64.21 64.20 1aww n SER 6 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1aww n GLU 7 N -1.37 3.12 -2.93 -1.46 1.02 -1.26 -5.03 120.64 112.74 1aww n GLU 7 Ca 0.00 -3.94 -0.24 0.00 -0.02 0.00 0.00 57.16 52.96 1aww n GLU 7 Cb 0.00 -2.27 0.01 0.00 -0.02 0.00 0.00 31.44 29.16 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 -3.77 3.63 0.35 -4.62 2.01 -1.26 -5.10 118.68 109.91 1aww s LEU 8 Ca 0.52 0.41 0.06 0.00 0.01 0.00 0.00 54.13 55.13 1aww s LEU 8 Cb 0.43 -3.28 -0.01 0.00 0.01 0.00 0.00 46.19 43.34 1aww s LEU 8 CO -0.20 -0.69 0.49 -0.75 1.01 0.00 0.00 176.35 176.21 1aww s LYS 9 N -4.60 3.13 0.29 1.70 2.20 -1.26 -4.96 119.74 116.24 1aww s LYS 9 Ca 0.48 -0.92 0.01 0.00 -0.36 0.00 0.00 55.97 55.18 1aww s LYS 9 Cb -0.10 -2.79 -0.00 0.00 -1.51 0.00 0.00 37.83 33.43 1aww s LYS 9 CO 0.39 0.03 0.05 1.63 -0.36 0.00 0.00 175.35 177.09 1aww n LYS 10 N -1.69 0.97 -3.59 4.03 4.01 -1.26 -1.66 118.16 118.97 1aww n LYS 10 Ca -0.00 -2.27 -0.11 0.00 -0.51 0.00 0.00 58.31 55.42 1aww n LYS 10 Cb 0.58 0.91 -0.04 0.00 -0.51 0.00 0.00 35.03 35.96 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 -2.34 0.05 0.58 -0.18 -7.23 -1.04 -3.07 120.40 107.18 1aww s VAL 11 Ca 0.06 -0.45 0.08 0.00 -1.81 0.00 0.00 61.98 59.86 1aww s VAL 11 Cb 0.00 -1.13 0.08 0.00 0.56 0.00 0.00 36.38 35.90 1aww s VAL 11 CO 0.05 -0.25 0.79 -0.69 -0.31 0.00 0.00 175.10 174.69 1aww s VAL 12 N -3.79 2.26 -0.05 1.32 1.01 -0.45 0.43 120.40 121.13 1aww s VAL 12 Ca 0.02 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.11 1aww s VAL 12 Cb 0.01 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 1aww s VAL 12 CO -0.12 0.00 -0.14 0.00 0.00 0.00 0.00 175.10 174.83 1aww s ALA 13 N -2.70 2.66 -0.21 5.51 0.00 0.33 -1.88 121.76 125.47 1aww s ALA 13 Ca 0.62 -0.98 0.13 0.00 0.00 0.00 0.00 51.96 51.72 1aww s ALA 13 Cb -0.06 -0.97 -0.23 0.00 0.00 0.00 0.00 23.12 21.86 1aww s ALA 13 CO 0.39 0.55 0.01 1.28 0.00 0.00 0.00 175.76 177.99 1aww n LEU 14 N 2.34 0.95 -4.03 0.00 4.77 0.12 -2.30 117.00 118.85 1aww n LEU 14 Ca -0.17 -0.02 -0.13 0.00 -0.03 0.00 0.00 56.01 55.66 1aww n LEU 14 Cb 0.52 0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 1aww n LEU 14 CO 0.25 0.63 0.20 -0.31 -1.33 0.00 0.00 177.39 176.84 1aww s TYR 15 N -2.50 0.84 0.49 -1.77 2.02 -1.22 -4.73 117.35 110.47 1aww s TYR 15 Ca -0.17 -1.15 -0.20 0.00 -0.37 0.00 0.00 57.07 55.17 1aww s TYR 15 Cb 0.07 0.09 -0.08 0.00 -0.40 0.00 0.00 41.96 41.64 1aww s TYR 15 CO 0.76 -1.19 1.05 -0.51 -1.57 0.00 0.00 175.55 174.09 1aww s ASP 16 N -3.19 6.28 -0.43 2.29 1.01 -1.25 -3.60 116.67 117.78 1aww s ASP 16 Ca 0.27 1.97 0.03 0.00 0.71 0.00 0.00 52.55 55.53 1aww s ASP 16 Cb -0.01 -2.56 0.25 0.00 1.01 0.00 0.00 42.92 41.61 1aww s ASP 16 CO 0.18 -0.82 1.01 0.00 0.21 0.00 0.00 175.17 175.75 1aww n TYR 17 N -0.96 -2.37 -0.80 4.23 9.36 -1.26 -4.87 117.16 120.50 1aww n TYR 17 Ca 0.09 -1.38 -0.30 0.00 3.32 0.00 0.00 57.90 59.63 1aww n TYR 17 Cb 0.52 1.40 0.18 0.00 -0.63 0.00 0.00 39.34 40.82 1aww n TYR 17 CO 0.00 0.00 0.00 -1.64 0.22 0.00 0.00 176.86 175.44 1aww s MET 18 N 0.49 0.47 0.86 2.98 -1.94 -1.26 -2.66 119.30 118.25 1aww s MET 18 Ca 0.30 1.12 -0.11 0.00 -1.71 0.00 0.00 55.69 55.29 1aww s MET 18 Cb 0.22 -1.70 0.11 0.00 2.01 0.00 0.00 34.83 35.47 1aww s MET 18 CO -0.19 -2.86 1.09 -1.25 -0.01 0.00 0.00 175.02 171.80 1aww s PRO 19 N -4.67 1.53 -0.10 2.03 0.05 -1.26 -4.85 135.00 127.74 1aww s PRO 19 Ca 0.66 0.97 -0.04 0.00 0.05 0.00 0.00 61.00 62.64 1aww s PRO 19 Cb -0.22 -1.83 -0.05 0.00 0.05 0.00 0.00 34.50 32.45 1aww s PRO 19 CO 0.60 -2.09 -0.12 -1.33 0.05 0.00 0.00 177.00 174.11 1aww n MET 20 N -3.80 0.21 0.03 4.56 2.81 -1.26 -4.97 117.12 114.70 1aww n MET 20 Ca 0.08 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.06 1aww n MET 20 Cb 0.54 -0.90 0.00 0.00 -0.71 0.00 0.00 33.22 32.16 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 -3.36 0.18 0.00 7.83 4.13 -1.26 -5.06 115.26 117.72 1aww n ASN 21 Ca -0.19 0.08 0.00 0.00 1.68 0.00 0.00 54.58 56.15 1aww n ASN 21 Cb 0.64 -0.02 0.00 0.00 -1.54 0.00 0.00 39.78 38.87 1aww n ASN 21 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1aww n ALA 22 N -3.01 0.00 0.50 5.41 0.00 -1.26 -5.00 120.51 117.15 1aww n ALA 22 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1aww n ALA 22 Cb 0.22 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.58 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 -1.12 -2.00 0.00 -0.26 -1.97 -3.44 115.58 106.80 1aww h ASN 23 Ca 0.00 0.04 -0.64 0.00 -0.56 0.00 0.00 56.30 55.14 1aww h ASN 23 Cb 0.00 0.29 0.09 0.00 -1.06 0.00 0.00 38.32 37.64 1aww h ASN 23 CO 0.00 -0.78 0.19 0.47 -1.06 0.00 0.00 177.43 176.24 1aww n ASP 24 N -5.49 1.16 -4.86 5.81 8.00 -1.26 -1.45 116.55 118.45 1aww n ASP 24 Ca -0.16 1.15 -0.33 0.00 0.71 0.00 0.00 54.79 56.16 1aww n ASP 24 Cb 0.51 -1.21 -0.06 0.00 -0.02 0.00 0.00 41.12 40.34 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 0.74 4.18 -1.05 0.64 2.96 -1.05 -4.38 118.68 120.72 1aww s LEU 25 Ca 0.69 1.03 -0.22 0.00 -0.22 0.00 0.00 54.13 55.41 1aww s LEU 25 Cb -0.83 -3.69 0.05 0.00 0.50 0.00 0.00 46.19 42.23 1aww s LEU 25 CO 0.54 -0.07 1.50 -1.58 -1.32 0.00 0.00 176.35 175.43 1aww s GLN 26 N -2.68 3.60 0.00 1.98 0.74 -1.26 -4.13 119.66 117.91 1aww s GLN 26 Ca 0.47 -1.19 0.00 0.00 0.05 0.00 0.00 55.36 54.69 1aww s GLN 26 Cb -0.12 -5.37 0.00 0.00 1.10 0.00 0.00 33.01 28.62 1aww s GLN 26 CO 0.20 -2.26 0.00 1.28 -0.55 0.00 0.00 175.29 173.96 1aww n LEU 27 N 9.03 0.00 0.00 3.68 4.32 -1.09 -4.95 117.00 128.00 1aww n LEU 27 Ca 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.34 1aww n LEU 27 Cb 0.50 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.30 1aww n LEU 27 CO 0.67 -0.36 0.00 -1.14 -1.22 0.00 0.00 177.39 175.34 1aww n ARG 28 N -0.71 0.00 -4.72 3.23 0.63 -1.24 -4.01 116.66 109.85 1aww n ARG 28 Ca 0.00 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.60 1aww n ARG 28 Cb 0.00 0.00 -0.16 0.00 0.45 0.00 0.00 32.46 32.75 1aww n ARG 28 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 1aww s LYS 29 N 1.30 3.14 0.00 -0.14 -2.85 -1.25 -3.38 119.74 116.55 1aww s LYS 29 Ca 0.00 -0.80 0.00 0.00 -1.00 0.00 0.00 55.97 54.17 1aww s LYS 29 Cb 0.00 -2.51 0.00 0.00 -2.06 0.00 0.00 37.83 33.26 1aww s LYS 29 CO 0.00 0.05 0.00 0.41 0.10 0.00 0.00 175.35 175.91 1aww n GLY 30 N 3.92 3.11 3.86 0.59 0.00 -0.97 -4.99 105.19 110.71 1aww n GLY 30 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 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 5.17 0.18 1.61 2.15 -1.26 -4.64 116.67 119.38 1aww s ASP 31 Ca 0.00 1.17 0.04 0.00 0.43 0.00 0.00 52.55 54.20 1aww s ASP 31 Cb 0.00 -1.95 -0.05 0.00 -0.30 0.00 0.00 42.92 40.62 1aww s ASP 31 CO 0.00 -1.52 -0.07 -1.61 -0.17 0.00 0.00 175.17 171.80 1aww s GLU 32 N -5.31 1.17 0.12 4.34 8.01 -1.26 0.12 118.70 125.90 1aww s GLU 32 Ca 0.59 -1.54 0.01 0.00 0.01 0.00 0.00 54.97 54.04 1aww s GLU 32 Cb -0.12 -0.64 -0.00 0.00 -4.31 0.00 0.00 34.13 29.06 1aww s GLU 32 CO 0.52 0.02 0.04 0.66 0.01 0.00 0.00 175.26 176.51 1aww n TYR 33 N -0.28 0.08 -5.11 1.61 4.01 0.17 -4.64 117.16 113.00 1aww n TYR 33 Ca -0.08 -0.75 -0.31 0.00 -0.16 0.00 0.00 57.90 56.61 1aww n TYR 33 Cb 0.62 -0.01 -0.17 0.00 -0.31 0.00 0.00 39.34 39.46 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 -1.91 2.34 0.37 -0.72 0.40 0.79 -2.49 117.98 116.76 1aww s PHE 34 Ca 0.05 -0.91 -0.10 0.00 -0.60 0.00 0.00 56.93 55.37 1aww s PHE 34 Cb 0.00 -1.57 -0.06 0.00 0.51 0.00 0.00 43.02 41.89 1aww s PHE 34 CO 0.04 -0.36 0.72 0.42 0.70 0.00 0.00 175.22 176.74 1aww s ILE 35 N 0.32 4.82 0.00 0.64 -1.09 -0.66 0.75 121.20 125.97 1aww s ILE 35 Ca -0.16 0.55 0.00 0.00 -2.23 0.00 0.00 60.65 58.81 1aww s ILE 35 Cb -0.17 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 36.99 1aww s ILE 35 CO 0.07 -0.44 0.00 0.18 -1.23 0.00 0.00 174.94 173.52 1aww n LEU 36 N -1.11 0.53 0.00 2.97 7.99 -1.21 -4.63 117.00 121.54 1aww n LEU 36 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.02 1aww n LEU 36 Cb 0.54 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.85 1aww n LEU 36 CO 0.47 0.01 0.00 -0.62 -1.51 0.00 0.00 177.39 175.74 1aww n GLU 37 N -2.78 0.00 -1.59 3.23 1.02 -1.26 -5.07 120.64 114.19 1aww n GLU 37 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1aww n GLU 37 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.82 1aww n GLU 37 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1aww n GLU 38 N 0.00 -0.89 0.00 3.49 0.00 -1.26 -4.02 120.64 117.96 1aww n GLU 38 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 57.16 57.79 1aww n GLU 38 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 31.44 30.34 1aww n GLU 38 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1aww n SER 39 N 1.42 0.00 0.27 -1.84 2.88 -1.26 -4.53 113.62 110.55 1aww n SER 39 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 1aww n SER 39 Cb 0.00 0.04 0.92 0.00 -0.75 0.00 0.00 64.21 64.42 1aww n SER 39 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1aww h ASN 40 N 0.00 0.00 -2.10 -3.46 -1.07 -1.95 -3.41 115.58 103.58 1aww h ASN 40 Ca 0.00 0.00 -0.49 0.00 0.07 0.00 0.00 56.30 55.88 1aww h ASN 40 Cb 0.00 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 36.22 1aww h ASN 40 CO 0.00 0.00 -0.48 -1.48 0.07 0.00 0.00 177.43 175.54 1aww s LEU 41 N -7.31 3.91 0.08 6.14 2.34 -1.26 -5.05 118.68 117.52 1aww s LEU 41 Ca -0.05 -0.21 -0.31 0.00 0.06 0.00 0.00 54.13 53.62 1aww s LEU 41 Cb 0.14 -2.47 -0.17 0.00 -0.56 0.00 0.00 46.19 43.13 1aww s LEU 41 CO 0.51 -0.13 1.64 1.55 -1.06 0.00 0.00 176.35 178.86 1aww h PRO 42 N 1.33 -0.71 -6.40 1.48 0.13 -1.97 -3.42 132.00 122.43 1aww h PRO 42 Ca -0.48 0.05 -0.54 0.00 -0.87 0.00 0.00 66.00 64.15 1aww h PRO 42 Cb 1.24 0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.51 1aww h PRO 42 CO 0.60 -0.48 0.40 -1.58 -0.23 0.00 0.00 178.00 176.71 1aww s TRP 43 N -6.07 3.63 0.00 1.56 0.52 -1.26 -1.20 118.94 116.12 1aww s TRP 43 Ca -0.17 1.67 0.00 0.00 0.02 0.00 0.00 56.10 57.62 1aww s TRP 43 Cb 0.04 -3.14 0.00 0.00 -1.15 0.00 0.00 33.47 29.22 1aww s TRP 43 CO 0.63 -0.10 0.00 0.91 0.02 0.00 0.00 176.95 178.41 1aww n TRP 44 N 4.01 -1.64 -3.25 -1.98 8.01 -1.00 -4.70 117.44 116.88 1aww n TRP 44 Ca 0.06 0.00 -0.25 0.00 -1.31 0.00 0.00 57.50 56.01 1aww n TRP 44 Cb 0.51 0.00 -0.07 0.00 -2.01 0.00 0.00 31.31 29.74 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 -0.55 1.61 -3.72 -0.99 0.63 -1.26 -2.98 116.66 109.41 1aww n ARG 45 Ca 0.00 -3.90 -0.21 0.00 -0.92 0.00 0.00 57.85 52.82 1aww n ARG 45 Cb 0.00 -1.73 -0.01 0.00 0.45 0.00 0.00 32.46 31.17 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 -1.98 3.98 0.27 5.13 0.00 -1.04 -3.33 121.76 124.79 1aww s ALA 46 Ca 0.39 -1.24 0.08 0.00 0.00 0.00 0.00 51.96 51.18 1aww s ALA 46 Cb 0.19 -1.78 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 1aww s ALA 46 CO -0.07 0.11 0.13 1.03 0.00 0.00 0.00 175.76 176.96 1aww s ARG 47 N -4.10 2.68 0.00 0.00 0.52 0.23 -1.38 118.95 116.90 1aww s ARG 47 Ca 0.38 -1.21 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 1aww s ARG 47 Cb -0.09 -2.41 0.00 0.00 0.52 0.00 0.00 34.95 32.97 1aww s ARG 47 CO 0.31 0.36 0.00 -0.40 0.02 0.00 0.00 175.30 175.59 1aww n ASP 48 N -1.10 0.00 -1.63 0.23 5.75 -1.03 -0.15 116.55 118.62 1aww n ASP 48 Ca -0.07 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 54.68 1aww n ASP 48 Cb 0.58 0.00 0.23 0.00 -1.03 0.00 0.00 41.12 40.91 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 3.09 -0.03 0.11 5.02 -1.26 -4.03 118.16 121.05 1aww n LYS 49 Ca 0.00 -2.20 -0.02 0.00 -2.02 0.00 0.00 58.31 54.07 1aww n LYS 49 Cb 0.00 -1.97 -0.07 0.00 -0.02 0.00 0.00 35.03 32.97 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 0.04 2.95 0.00 4.39 3.02 -1.26 -5.02 115.26 119.38 1aww n ASN 50 Ca 0.28 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 1aww n ASN 50 Cb 1.07 0.85 0.00 0.00 -0.61 0.00 0.00 39.78 41.09 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 2.39 1.92 3.05 7.41 0.00 -1.26 -5.13 105.19 113.57 1aww n GLY 51 Ca -0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.34 0.83 0.27 1.61 -0.21 -1.26 -5.01 119.66 115.55 1aww s GLN 52 Ca 0.00 -0.39 0.01 0.00 0.02 0.00 0.00 55.36 55.01 1aww s GLN 52 Cb 0.00 -0.80 -0.04 0.00 1.00 0.00 0.00 33.01 33.17 1aww s GLN 52 CO 0.00 0.22 0.44 -1.83 -2.12 0.00 0.00 175.29 172.00 1aww s GLU 53 N -0.29 3.49 0.00 2.91 4.04 -1.26 -2.48 118.70 125.10 1aww s GLU 53 Ca 0.04 -0.45 0.00 0.00 0.04 0.00 0.00 54.97 54.60 1aww s GLU 53 Cb -0.04 -2.79 0.00 0.00 0.02 0.00 0.00 34.13 31.32 1aww s GLU 53 CO -0.00 0.31 0.00 0.41 -1.84 0.00 0.00 175.26 174.14 1aww n GLY 54 N -1.29 1.91 3.90 -3.83 0.00 -0.48 -4.79 105.19 100.62 1aww n GLY 54 Ca -0.06 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.40 3.56 -0.30 1.61 1.51 -0.53 -2.50 117.35 118.31 1aww s TYR 55 Ca 0.00 0.40 -0.01 0.00 -1.01 0.00 0.00 57.07 56.45 1aww s TYR 55 Cb 0.00 -1.86 0.10 0.00 -0.11 0.00 0.00 41.96 40.09 1aww s TYR 55 CO 0.00 0.66 0.10 0.42 -1.11 0.00 0.00 175.55 175.61 1aww s ILE 56 N -1.28 0.74 0.16 2.71 1.09 -1.16 -2.53 121.20 120.93 1aww s ILE 56 Ca 0.26 -1.26 -0.32 0.00 -1.10 0.00 0.00 60.65 58.23 1aww s ILE 56 Cb -0.13 -1.54 -0.12 0.00 -1.06 0.00 0.00 42.46 39.62 1aww s ILE 56 CO 0.17 -0.64 1.76 -0.81 -0.10 0.00 0.00 174.94 175.31 1aww n PRO 57 N 4.91 2.70 -0.21 2.79 -0.04 -1.26 -2.39 135.00 141.50 1aww n PRO 57 Ca -0.03 0.98 0.01 0.00 -0.04 0.00 0.00 63.50 64.41 1aww n PRO 57 Cb 0.42 -2.83 0.12 0.00 -0.04 0.00 0.00 33.50 31.17 1aww n PRO 57 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1aww h SER 58 N 7.43 0.18 -0.82 3.54 0.02 -1.50 -1.08 113.55 121.32 1aww h SER 58 Ca -0.45 0.09 0.01 0.00 -0.84 0.00 0.00 61.79 60.61 1aww h SER 58 Cb 1.22 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.80 1aww h SER 58 CO 0.95 0.10 0.54 -0.55 -1.14 0.00 0.00 176.83 176.73 1aww h ASN 59 N 0.37 0.93 0.00 3.07 -1.07 -1.90 -1.14 115.58 115.84 1aww h ASN 59 Ca 0.32 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.67 1aww h ASN 59 Cb 0.43 -0.23 0.00 0.00 -2.07 0.00 0.00 38.32 36.45 1aww h ASN 59 CO -0.34 0.67 0.00 -1.22 0.07 0.00 0.00 177.43 176.61 1aww n TYR 60 N -4.42 0.00 -4.13 4.14 4.01 -0.43 -4.82 117.16 111.51 1aww n TYR 60 Ca 0.09 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.68 1aww n TYR 60 Cb 0.04 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.02 1aww n TYR 60 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1aww s VAL 61 N -2.00 0.00 0.00 -0.72 -7.23 -0.43 0.11 120.40 110.13 1aww s VAL 61 Ca 0.26 -1.71 0.00 0.00 -1.81 0.00 0.00 61.98 58.73 1aww s VAL 61 Cb 0.12 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.50 1aww s VAL 61 CO 0.20 0.00 0.00 1.07 -0.31 0.00 0.00 175.10 176.06 1aww n THR 62 N -0.53 0.00 -2.89 5.32 5.66 -0.79 -4.84 114.28 116.22 1aww n THR 62 Ca 0.02 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.63 1aww n THR 62 Cb 0.62 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.34 1aww n THR 62 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1aww s GLU 63 N 3.80 4.65 0.58 1.09 2.12 -1.26 -1.34 118.70 128.34 1aww s GLU 63 Ca 0.00 1.28 0.29 0.00 0.36 0.00 0.00 54.97 56.90 1aww s GLU 63 Cb 0.00 -3.19 1.47 0.00 0.26 0.00 0.00 34.13 32.66 1aww s GLU 63 CO 0.00 0.51 1.90 0.00 -0.54 0.00 0.00 175.26 177.13 1aww h ALA 64 N 4.08 2.33 -2.65 6.30 0.00 -1.69 -2.88 119.26 124.75 1aww h ALA 64 Ca -0.46 -0.02 -0.58 0.00 0.00 0.00 0.00 54.91 53.85 1aww h ALA 64 Cb 1.20 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1aww h ALA 64 CO 0.67 -0.78 -0.21 -1.21 0.00 0.00 0.00 179.25 177.71 1aww s GLU 65 N -4.71 3.79 0.00 0.00 2.02 -1.26 -4.63 118.70 113.91 1aww s GLU 65 Ca -0.04 0.22 0.00 0.00 0.02 0.00 0.00 54.97 55.17 1aww s GLU 65 Cb 0.17 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.45 1aww s GLU 65 CO 0.60 0.52 0.00 -3.47 0.02 0.00 0.00 175.26 172.93 1aww n ASP 66 N 0.75 -0.02 0.00 -0.19 2.03 -1.26 -4.94 116.55 112.92 1aww n ASP 66 Ca -0.06 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.25 1aww n ASP 66 Cb 0.52 0.34 0.00 0.00 -0.72 0.00 0.00 41.12 41.26 1aww n ASP 66 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04