#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 0.09 1.61 7.64 -1.26 -5.09 113.62 116.61 1aww n SER 2 Ca 0.00 -0.72 0.00 0.00 1.01 0.00 0.00 58.87 59.16 1aww n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1aww n SER 2 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1aww n MET 3 N -0.72 0.00 0.00 1.43 0.00 -1.26 -5.08 117.12 111.49 1aww n MET 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 1aww n MET 3 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 33.22 33.05 1aww n MET 3 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1aww n SER 4 N -3.31 0.00 -1.14 6.12 2.88 -1.26 -4.96 113.62 111.96 1aww n SER 4 Ca 0.00 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1aww n SER 4 Cb 0.04 0.37 0.23 0.00 -0.75 0.00 0.00 64.21 64.10 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 -2.16 2.50 0.20 2.46 -1.04 -1.26 -4.63 114.28 110.33 1aww n THR 5 Ca 0.00 -2.30 0.06 0.00 -2.04 0.00 0.00 64.05 59.77 1aww n THR 5 Cb 0.00 -0.31 0.55 0.00 -1.82 0.00 0.00 70.33 68.75 1aww n THR 5 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1aww h SER 6 N 1.37 0.10 -0.51 8.00 0.87 -1.98 -3.42 113.55 117.97 1aww h SER 6 Ca 0.16 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1aww h SER 6 Cb 1.67 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.60 1aww h SER 6 CO 0.38 0.14 0.00 -0.62 -0.53 0.00 0.00 176.83 176.19 1aww n GLU 7 N -4.45 2.18 -3.19 2.24 -0.58 -1.26 -4.82 120.64 110.76 1aww n GLU 7 Ca -0.02 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.66 1aww n GLU 7 Cb 0.14 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.01 1aww n GLU 7 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1aww n LEU 8 N 0.00 -5.90 -4.88 -4.62 7.99 -1.26 -5.03 117.00 103.30 1aww n LEU 8 Ca 0.00 -0.19 -0.23 0.00 -0.01 0.00 0.00 56.01 55.58 1aww n LEU 8 Cb 0.00 -2.98 -0.02 0.00 -0.11 0.00 0.00 43.42 40.31 1aww n LEU 8 CO 0.00 -0.93 0.02 -0.54 -1.51 0.00 0.00 177.39 174.43 1aww s LYS 9 N -3.31 2.36 0.47 3.23 1.02 -1.26 -4.92 119.74 117.33 1aww s LYS 9 Ca 0.03 -1.78 0.06 0.00 0.02 0.00 0.00 55.97 54.30 1aww s LYS 9 Cb -0.01 -2.22 0.08 0.00 -0.52 0.00 0.00 37.83 35.16 1aww s LYS 9 CO 0.78 -0.39 0.65 1.63 -0.92 0.00 0.00 175.35 177.10 1aww n LYS 10 N -1.63 0.57 -3.64 1.68 5.02 -1.26 -2.08 118.16 116.82 1aww n LYS 10 Ca 0.01 -2.37 -0.12 0.00 -2.02 0.00 0.00 58.31 53.81 1aww n LYS 10 Cb 0.63 -0.25 -0.05 0.00 -0.02 0.00 0.00 35.03 35.34 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 -1.90 0.06 0.63 -0.18 -7.23 -0.97 -2.87 120.40 107.93 1aww s VAL 11 Ca 0.48 -0.46 0.06 0.00 -1.81 0.00 0.00 61.98 60.26 1aww s VAL 11 Cb -0.04 -1.03 0.11 0.00 0.56 0.00 0.00 36.38 35.99 1aww s VAL 11 CO 0.31 -0.25 0.87 0.52 -0.31 0.00 0.00 175.10 176.23 1aww n VAL 12 N 0.22 0.00 -5.11 1.32 0.31 -0.96 0.63 118.33 114.74 1aww n VAL 12 Ca -0.18 -1.80 -0.30 0.00 -0.01 0.00 0.00 64.34 62.05 1aww n VAL 12 Cb 0.61 -0.65 -0.15 0.00 -0.91 0.00 0.00 33.84 32.74 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 -2.86 2.15 -0.13 3.52 0.00 0.30 -1.70 121.76 123.04 1aww s ALA 13 Ca 0.62 -1.16 0.15 0.00 0.00 0.00 0.00 51.96 51.58 1aww s ALA 13 Cb -0.04 -0.50 -0.22 0.00 0.00 0.00 0.00 23.12 22.35 1aww s ALA 13 CO 0.40 0.52 0.13 1.28 0.00 0.00 0.00 175.76 178.09 1aww n LEU 14 N 2.17 0.00 -4.09 0.00 4.77 0.27 -2.05 117.00 118.07 1aww n LEU 14 Ca -0.16 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.70 1aww n LEU 14 Cb 0.52 0.32 -0.06 0.00 -2.33 0.00 0.00 43.42 41.86 1aww n LEU 14 CO 0.23 0.32 0.04 -0.31 -1.33 0.00 0.00 177.39 176.34 1aww s TYR 15 N -2.57 0.80 0.56 -1.77 2.02 -1.25 -4.71 117.35 110.44 1aww s TYR 15 Ca -0.08 -1.08 -0.12 0.00 -0.37 0.00 0.00 57.07 55.42 1aww s TYR 15 Cb 0.06 -0.11 -0.05 0.00 -0.40 0.00 0.00 41.96 41.45 1aww s TYR 15 CO 0.68 -0.93 0.98 -0.51 -1.57 0.00 0.00 175.55 174.21 1aww s ASP 16 N -3.12 6.38 -0.41 2.29 1.01 -1.25 -3.86 116.67 117.71 1aww s ASP 16 Ca 0.30 1.42 -0.00 0.00 0.71 0.00 0.00 52.55 54.97 1aww s ASP 16 Cb 0.02 -2.46 0.22 0.00 1.01 0.00 0.00 42.92 41.71 1aww s ASP 16 CO 0.13 -0.73 0.99 0.00 0.21 0.00 0.00 175.17 175.77 1aww n TYR 17 N -2.24 -2.00 -0.93 4.23 9.36 -1.24 -4.86 117.16 119.49 1aww n TYR 17 Ca 0.06 -1.04 -0.30 0.00 3.32 0.00 0.00 57.90 59.94 1aww n TYR 17 Cb 0.54 1.28 0.16 0.00 -0.63 0.00 0.00 39.34 40.69 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 0.75 0.89 1.02 2.98 -1.94 -1.26 -2.26 119.30 119.48 1aww s MET 18 Ca 0.27 1.09 -0.13 0.00 -1.71 0.00 0.00 55.69 55.22 1aww s MET 18 Cb 0.12 -1.75 0.20 0.00 2.01 0.00 0.00 34.83 35.41 1aww s MET 18 CO -0.11 -2.57 1.09 -1.25 -0.01 0.00 0.00 175.02 172.18 1aww s PRO 19 N -4.75 0.25 -0.01 2.03 0.05 -1.26 -4.84 135.00 126.47 1aww s PRO 19 Ca 0.65 0.45 -0.00 0.00 0.05 0.00 0.00 61.00 62.15 1aww s PRO 19 Cb -0.21 -1.72 -0.00 0.00 0.05 0.00 0.00 34.50 32.62 1aww s PRO 19 CO 0.59 -2.84 -0.01 -1.33 0.05 0.00 0.00 177.00 173.46 1aww n MET 20 N -4.24 0.02 0.03 4.56 2.81 -1.26 -4.98 117.12 114.05 1aww n MET 20 Ca 0.05 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1aww n MET 20 Cb 0.58 -0.54 0.00 0.00 -0.71 0.00 0.00 33.22 32.55 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 -3.03 0.28 0.00 7.83 4.13 -1.26 -5.06 115.26 118.15 1aww n ASN 21 Ca -0.02 0.08 0.00 0.00 1.68 0.00 0.00 54.58 56.33 1aww n ASN 21 Cb 0.51 -0.05 0.00 0.00 -1.54 0.00 0.00 39.78 38.70 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 -3.10 0.00 0.53 5.41 0.00 -1.26 -5.00 120.51 117.09 1aww n ALA 22 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 1aww n ALA 22 Cb 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.59 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 -1.17 -1.90 0.00 2.35 -1.97 -3.44 115.58 109.46 1aww h ASN 23 Ca 0.00 0.04 -0.64 0.00 -0.55 0.00 0.00 56.30 55.16 1aww h ASN 23 Cb 0.00 0.31 0.10 0.00 0.05 0.00 0.00 38.32 38.78 1aww h ASN 23 CO 0.00 -0.82 -0.05 0.47 -1.65 0.00 0.00 177.43 175.38 1aww n ASP 24 N -5.67 0.50 -4.86 5.81 8.00 -1.26 -2.04 116.55 117.02 1aww n ASP 24 Ca -0.17 1.16 -0.35 0.00 0.71 0.00 0.00 54.79 56.14 1aww n ASP 24 Cb 0.54 -1.16 -0.06 0.00 -0.02 0.00 0.00 41.12 40.42 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 1.24 4.37 -1.11 0.64 2.96 -1.13 -4.44 118.68 121.21 1aww s LEU 25 Ca 0.63 0.85 -0.22 0.00 -0.22 0.00 0.00 54.13 55.17 1aww s LEU 25 Cb -0.81 -2.96 0.01 0.00 0.50 0.00 0.00 46.19 42.94 1aww s LEU 25 CO 0.57 0.19 1.72 0.00 -1.32 0.00 0.00 176.35 177.51 1aww s GLN 26 N -1.80 3.31 0.43 1.98 -2.07 -1.26 -4.17 119.66 116.08 1aww s GLN 26 Ca 0.32 -1.23 -0.05 0.00 -1.82 0.00 0.00 55.36 52.58 1aww s GLN 26 Cb -0.14 -5.33 0.09 0.00 -1.09 0.00 0.00 33.01 26.54 1aww s GLN 26 CO 0.17 -2.77 0.58 1.28 -1.32 0.00 0.00 175.29 173.23 1aww n LEU 27 N 10.73 0.00 0.00 2.60 4.32 -0.96 -4.94 117.00 128.76 1aww n LEU 27 Ca 0.41 -0.81 0.00 0.00 -0.02 0.00 0.00 56.01 55.59 1aww n LEU 27 Cb 0.48 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.85 1aww n LEU 27 CO 0.68 -0.88 0.00 0.54 -1.22 0.00 0.00 177.39 176.52 1aww n ARG 28 N -2.18 0.00 -3.86 3.23 1.74 -1.25 -3.71 116.66 110.62 1aww n ARG 28 Ca 0.08 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.80 1aww n ARG 28 Cb 0.28 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.58 1aww n ARG 28 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1aww s LYS 29 N -0.23 3.36 0.00 5.56 2.20 -1.25 -3.78 119.74 125.60 1aww s LYS 29 Ca 0.00 -0.65 0.00 0.00 -0.36 0.00 0.00 55.97 54.96 1aww s LYS 29 Cb 0.00 -3.11 0.00 0.00 -1.51 0.00 0.00 37.83 33.21 1aww s LYS 29 CO 0.00 -0.24 0.00 0.41 -0.36 0.00 0.00 175.35 175.16 1aww n GLY 30 N 4.82 3.29 3.82 5.54 0.00 -0.87 -4.99 105.19 116.79 1aww n GLY 30 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.80 5.35 0.24 1.61 2.15 -1.26 -4.51 116.67 119.45 1aww s ASP 31 Ca 0.00 1.64 0.09 0.00 0.43 0.00 0.00 52.55 54.71 1aww s ASP 31 Cb 0.00 -2.50 -0.05 0.00 -0.30 0.00 0.00 42.92 40.07 1aww s ASP 31 CO 0.00 -1.46 -0.16 -1.61 -0.17 0.00 0.00 175.17 171.77 1aww s GLU 32 N -4.98 1.50 0.00 4.34 8.01 -1.26 0.11 118.70 126.41 1aww s GLU 32 Ca 0.58 -1.69 0.00 0.00 0.01 0.00 0.00 54.97 53.88 1aww s GLU 32 Cb -0.14 -1.39 0.00 0.00 -4.31 0.00 0.00 34.13 28.29 1aww s GLU 32 CO 0.54 0.23 0.00 0.66 0.01 0.00 0.00 175.26 176.70 1aww n TYR 33 N -0.50 0.00 -4.85 1.61 4.01 0.20 -4.46 117.16 113.17 1aww n TYR 33 Ca -0.07 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.37 1aww n TYR 33 Cb 0.61 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.47 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 -1.26 2.39 -0.21 -0.72 0.40 0.13 -2.30 117.98 116.40 1aww s PHE 34 Ca 0.00 -1.08 -0.14 0.00 -0.60 0.00 0.00 56.93 55.12 1aww s PHE 34 Cb 0.00 -1.63 -0.04 0.00 0.51 0.00 0.00 43.02 41.86 1aww s PHE 34 CO 0.00 -0.48 0.31 0.42 0.70 0.00 0.00 175.22 176.17 1aww s ILE 35 N 0.64 5.26 -0.13 0.64 -1.09 -0.88 -0.75 121.20 124.88 1aww s ILE 35 Ca -0.12 0.52 0.12 0.00 -2.23 0.00 0.00 60.65 58.93 1aww s ILE 35 Cb -0.16 -3.64 -0.17 0.00 -1.58 0.00 0.00 42.46 36.90 1aww s ILE 35 CO 0.03 0.29 0.06 0.18 -1.23 0.00 0.00 174.94 174.26 1aww n LEU 36 N 4.39 0.00 -3.63 2.97 4.32 -1.25 -4.20 117.00 119.60 1aww n LEU 36 Ca -0.11 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.81 1aww n LEU 36 Cb 0.51 0.32 -0.07 0.00 -1.62 0.00 0.00 43.42 42.57 1aww n LEU 36 CO 0.38 0.32 0.86 -1.61 -1.22 0.00 0.00 177.39 176.12 1aww s GLU 37 N -2.35 0.39 -0.20 3.23 2.02 -1.26 -4.96 118.70 115.58 1aww s GLU 37 Ca -0.07 0.39 0.09 0.00 0.02 0.00 0.00 54.97 55.40 1aww s GLU 37 Cb 0.04 0.19 0.56 0.00 0.10 0.00 0.00 34.13 35.03 1aww s GLU 37 CO 0.55 -0.06 1.44 -0.85 0.02 0.00 0.00 175.26 176.36 1aww n GLU 38 N 1.79 3.42 -2.13 1.61 0.28 -1.26 -1.19 120.64 123.15 1aww n GLU 38 Ca -0.11 -2.22 -0.03 0.00 -0.16 0.00 0.00 57.16 54.64 1aww n GLU 38 Cb 0.56 -2.01 -0.00 0.00 1.43 0.00 0.00 31.44 31.42 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 0.23 -1.44 -3.43 -1.84 7.64 -1.26 -1.06 113.62 112.45 1aww n SER 39 Ca 0.24 0.34 -0.25 0.00 1.01 0.00 0.00 58.87 60.21 1aww n SER 39 Cb 1.01 -1.43 0.02 0.00 -1.01 0.00 0.00 64.21 62.80 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 -1.01 -4.78 -2.21 6.43 2.85 -1.26 -4.92 115.26 110.36 1aww n ASN 40 Ca -0.03 -0.47 -0.02 0.00 -0.11 0.00 0.00 54.58 53.94 1aww n ASN 40 Cb 0.42 -3.87 0.01 0.00 1.24 0.00 0.00 39.78 37.58 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 -4.12 0.00 -0.13 1.20 -0.00 -0.22 -5.05 117.00 108.68 1aww n LEU 41 Ca -0.02 -0.97 -0.09 0.00 -0.00 0.00 0.00 56.01 54.92 1aww n LEU 41 Cb 0.56 1.71 -0.01 0.00 -0.00 0.00 0.00 43.42 45.68 1aww n LEU 41 CO 0.57 -0.32 0.90 -0.65 -0.00 0.00 0.00 177.39 177.89 1aww h PRO 42 N 0.00 0.58 -6.31 1.47 0.11 -1.91 -3.41 132.00 122.53 1aww h PRO 42 Ca -0.16 -0.12 -0.55 0.00 0.11 0.00 0.00 66.00 65.28 1aww h PRO 42 Cb 0.67 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.66 1aww h PRO 42 CO 0.21 0.57 0.58 -1.58 -0.21 0.00 0.00 178.00 177.57 1aww s TRP 43 N -5.48 3.44 0.00 0.65 0.52 -1.26 0.63 118.94 117.44 1aww s TRP 43 Ca -0.13 1.49 0.00 0.00 0.02 0.00 0.00 56.10 57.48 1aww s TRP 43 Cb 0.10 -3.26 0.00 0.00 -1.15 0.00 0.00 33.47 29.16 1aww s TRP 43 CO 0.75 -0.55 0.00 0.91 0.02 0.00 0.00 176.95 178.08 1aww n TRP 44 N 4.84 -1.62 -3.40 -1.98 8.01 -0.66 -4.32 117.44 118.31 1aww n TRP 44 Ca 0.09 0.00 -0.26 0.00 -1.31 0.00 0.00 57.50 56.02 1aww n TRP 44 Cb 0.48 0.00 -0.09 0.00 -2.01 0.00 0.00 31.31 29.70 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 -0.54 1.35 -3.77 -0.99 1.74 -0.34 -2.88 116.66 111.24 1aww n ARG 45 Ca 0.00 -3.85 -0.22 0.00 -0.77 0.00 0.00 57.85 53.01 1aww n ARG 45 Cb 0.00 -1.78 -0.04 0.00 -1.02 0.00 0.00 32.46 29.62 1aww n ARG 45 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1aww s ALA 46 N -1.41 3.88 0.30 7.54 0.00 -1.05 -3.81 121.76 127.20 1aww s ALA 46 Ca 0.35 -1.91 0.10 0.00 0.00 0.00 0.00 51.96 50.49 1aww s ALA 46 Cb 0.11 -0.85 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 1aww s ALA 46 CO -0.10 -0.17 -0.06 1.03 0.00 0.00 0.00 175.76 176.47 1aww s ARG 47 N -4.04 2.04 0.00 0.00 0.52 0.07 -1.43 118.95 116.10 1aww s ARG 47 Ca 0.45 -1.64 0.00 0.00 -0.52 0.00 0.00 55.73 54.02 1aww s ARG 47 Cb -0.02 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.49 1aww s ARG 47 CO 0.26 0.27 0.00 -0.40 0.02 0.00 0.00 175.30 175.45 1aww n ASP 48 N -0.84 0.00 -1.60 0.23 5.75 -1.00 0.17 116.55 119.26 1aww n ASP 48 Ca -0.05 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.71 1aww n ASP 48 Cb 0.60 0.00 0.24 0.00 -1.03 0.00 0.00 41.12 40.93 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 3.19 -0.03 0.11 4.76 -1.26 -4.03 118.16 120.90 1aww n LYS 49 Ca 0.00 -2.19 -0.01 0.00 -2.87 0.00 0.00 58.31 53.24 1aww n LYS 49 Cb 0.00 -1.98 -0.06 0.00 -1.84 0.00 0.00 35.03 31.15 1aww n LYS 49 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1aww n ASN 50 N 0.10 3.02 0.00 4.39 4.13 -1.26 -5.02 115.26 120.63 1aww n ASN 50 Ca 0.27 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.53 1aww n ASN 50 Cb 1.05 0.94 0.00 0.00 -1.54 0.00 0.00 39.78 40.22 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 2.33 1.95 3.20 7.41 0.00 -1.26 -5.13 105.19 113.70 1aww n GLY 51 Ca -0.09 0.00 -0.21 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 -0.36 1.02 0.15 1.61 -0.21 -1.26 -5.01 119.66 115.60 1aww s GLN 52 Ca 0.00 -0.94 0.06 0.00 0.02 0.00 0.00 55.36 54.50 1aww s GLN 52 Cb 0.00 -1.11 -0.04 0.00 1.00 0.00 0.00 33.01 32.86 1aww s GLN 52 CO 0.00 0.27 0.04 -1.83 -2.12 0.00 0.00 175.29 171.65 1aww s GLU 53 N -1.50 2.60 0.00 2.91 -1.05 -1.26 -2.37 118.70 118.04 1aww s GLU 53 Ca 0.03 -0.96 0.00 0.00 -0.15 0.00 0.00 54.97 53.89 1aww s GLU 53 Cb -0.09 -2.50 0.00 0.00 -0.44 0.00 0.00 34.13 31.10 1aww s GLU 53 CO 0.02 0.49 0.00 0.41 0.95 0.00 0.00 175.26 177.13 1aww n GLY 54 N -0.03 1.93 3.87 -3.83 0.00 -0.52 -4.78 105.19 101.84 1aww n GLY 54 Ca -0.09 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.57 3.52 -0.24 1.61 1.51 -0.86 -2.53 117.35 118.78 1aww s TYR 55 Ca 0.00 0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 56.43 1aww s TYR 55 Cb 0.00 -1.85 0.08 0.00 -0.11 0.00 0.00 41.96 40.07 1aww s TYR 55 CO 0.00 0.66 0.07 0.42 -1.11 0.00 0.00 175.55 175.59 1aww s ILE 56 N -1.19 0.52 0.11 2.71 1.09 -1.14 -2.83 121.20 120.48 1aww s ILE 56 Ca 0.22 -0.82 -0.32 0.00 -1.10 0.00 0.00 60.65 58.63 1aww s ILE 56 Cb -0.12 -1.20 -0.11 0.00 -1.06 0.00 0.00 42.46 39.97 1aww s ILE 56 CO 0.12 -0.42 1.80 -2.65 -0.10 0.00 0.00 174.94 173.69 1aww n PRO 57 N 5.03 2.64 -0.15 2.79 -0.01 -1.26 -1.66 135.00 142.38 1aww n PRO 57 Ca -0.06 0.96 -0.03 0.00 -0.01 0.00 0.00 63.50 64.35 1aww n PRO 57 Cb 0.45 -2.83 0.04 0.00 -0.01 0.00 0.00 33.50 31.15 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 8.10 -0.35 -0.98 2.55 0.87 -0.13 -1.30 113.55 122.30 1aww h SER 58 Ca -0.46 0.13 0.01 0.00 -1.23 0.00 0.00 61.79 60.24 1aww h SER 58 Cb 1.23 0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 63.40 1aww h SER 58 CO 0.94 -0.13 0.65 -0.55 -0.53 0.00 0.00 176.83 177.22 1aww h ASN 59 N 0.04 1.12 -0.77 6.23 -1.07 -1.90 -2.43 115.58 116.80 1aww h ASN 59 Ca 0.23 -0.03 -0.00 0.00 0.07 0.00 0.00 56.30 56.57 1aww h ASN 59 Cb 0.35 -0.28 -0.04 0.00 -2.07 0.00 0.00 38.32 36.29 1aww h ASN 59 CO -0.45 0.81 0.48 1.88 0.07 0.00 0.00 177.43 180.21 1aww h TYR 60 N 1.32 1.00 -1.93 4.14 -1.99 -1.63 -3.44 116.97 114.44 1aww h TYR 60 Ca 0.37 0.01 -0.52 0.00 2.00 0.00 0.00 58.73 60.59 1aww h TYR 60 Cb -0.13 -0.33 -0.06 0.00 2.00 0.00 0.00 36.73 38.21 1aww h TYR 60 CO -0.00 0.65 -0.50 0.14 -0.00 0.00 0.00 178.16 178.45 1aww s VAL 61 N -5.82 3.48 0.00 -2.88 -7.23 -0.92 0.97 120.40 108.00 1aww s VAL 61 Ca -0.11 -1.52 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 1aww s VAL 61 Cb 0.17 -3.12 0.00 0.00 0.56 0.00 0.00 36.38 34.00 1aww s VAL 61 CO 0.79 -0.21 0.00 1.07 -0.31 0.00 0.00 175.10 176.44 1aww n THR 62 N -1.24 0.00 -3.29 5.32 5.66 -0.69 -4.84 114.28 115.20 1aww n THR 62 Ca -0.03 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.58 1aww n THR 62 Cb 0.60 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.32 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 4.52 4.19 0.60 1.09 2.02 -1.26 -2.27 118.70 127.59 1aww s GLU 63 Ca 0.00 0.69 0.29 0.00 0.02 0.00 0.00 54.97 55.97 1aww s GLU 63 Cb 0.00 -3.26 1.43 0.00 0.10 0.00 0.00 34.13 32.40 1aww s GLU 63 CO 0.00 0.59 1.84 0.00 0.02 0.00 0.00 175.26 177.71 1aww h ALA 64 N 4.79 2.20 -2.24 5.21 0.00 -1.69 -2.90 119.26 124.63 1aww h ALA 64 Ca -0.49 -0.02 0.27 0.00 0.00 0.00 0.00 54.91 54.67 1aww h ALA 64 Cb 1.21 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 1aww h ALA 64 CO 0.64 -0.79 -0.38 0.39 0.00 0.00 0.00 179.25 179.11 1aww n GLU 65 N -3.62 -2.01 -2.72 0.00 -0.58 -1.26 -4.64 120.64 105.82 1aww n GLU 65 Ca 0.09 1.34 -0.05 0.00 -0.42 0.00 0.00 57.16 58.12 1aww n GLU 65 Cb 0.73 -2.46 0.04 0.00 -0.57 0.00 0.00 31.44 29.19 1aww n GLU 65 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1aww n ASP 66 N -4.35 -2.42 -0.20 1.62 5.75 -1.26 -5.07 116.55 110.62 1aww n ASP 66 Ca 0.00 -2.43 0.15 0.00 -0.01 0.00 0.00 54.79 52.50 1aww n ASP 66 Cb 0.62 1.36 0.77 0.00 -1.03 0.00 0.00 41.12 42.84 1aww n ASP 66 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55