#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 5.43 -0.02 1.61 1.04 -1.26 -4.97 113.70 115.54 1aww s SER 2 Ca 0.00 -1.93 -0.01 0.00 0.48 0.00 0.00 55.95 54.50 1aww s SER 2 Cb 0.00 -1.90 -0.00 0.00 0.10 0.00 0.00 66.02 64.22 1aww s SER 2 CO 0.00 -0.59 -0.01 0.24 0.98 0.00 0.00 173.24 173.86 1aww h MET 3 N 8.22 0.00 -0.19 4.02 2.07 -2.08 -3.44 114.93 123.52 1aww h MET 3 Ca -0.17 0.00 -0.21 0.00 -2.07 0.00 0.00 59.70 57.26 1aww h MET 3 Cb 1.06 0.00 -0.36 0.00 -1.87 0.00 0.00 31.60 30.42 1aww h MET 3 CO 0.76 0.00 -1.01 0.43 1.07 0.00 0.00 176.91 178.15 1aww n SER 4 N -2.46 1.46 -3.13 1.22 7.64 -1.26 -4.96 113.62 112.14 1aww n SER 4 Ca -0.00 -2.25 -0.16 0.00 1.01 0.00 0.00 58.87 57.46 1aww n SER 4 Cb 0.01 -0.38 -0.05 0.00 -1.01 0.00 0.00 64.21 62.78 1aww n SER 4 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1aww s THR 5 N -1.83 -0.30 -0.07 0.44 -4.23 -1.26 -4.97 115.64 103.42 1aww s THR 5 Ca 0.33 -1.75 0.02 0.00 -1.18 0.00 0.00 61.69 59.11 1aww s THR 5 Cb 0.37 -0.66 -0.06 0.00 1.34 0.00 0.00 72.50 73.49 1aww s THR 5 CO -0.11 -0.64 -0.04 -1.54 -0.54 0.00 0.00 174.62 171.75 1aww n SER 6 N 3.06 3.39 -3.70 3.99 3.41 -1.26 -4.94 113.62 117.57 1aww n SER 6 Ca 0.23 -0.03 -0.13 0.00 -0.26 0.00 0.00 58.87 58.68 1aww n SER 6 Cb 0.51 0.15 -0.13 0.00 -0.26 0.00 0.00 64.21 64.48 1aww n SER 6 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1aww s GLU 7 N -2.16 0.18 -0.27 4.33 0.41 -1.26 -5.13 118.70 114.80 1aww s GLU 7 Ca -0.08 0.62 -0.02 0.00 -0.41 0.00 0.00 54.97 55.09 1aww s GLU 7 Cb 0.02 -0.09 0.16 0.00 -1.78 0.00 0.00 34.13 32.45 1aww s GLU 7 CO 0.21 -0.21 0.49 -1.17 -0.49 0.00 0.00 175.26 174.09 1aww s LEU 8 N 1.75 -1.04 0.26 1.80 2.96 -1.26 -5.04 118.68 118.10 1aww s LEU 8 Ca -0.05 0.54 -0.06 0.00 -0.22 0.00 0.00 54.13 54.34 1aww s LEU 8 Cb -0.11 1.66 -0.01 0.00 0.50 0.00 0.00 46.19 48.23 1aww s LEU 8 CO -0.09 -0.28 0.36 -1.59 -1.32 0.00 0.00 176.35 173.43 1aww s LYS 9 N 2.71 1.53 0.98 1.98 -2.85 -1.26 -5.05 119.74 117.79 1aww s LYS 9 Ca 0.17 -1.52 -0.17 0.00 -1.00 0.00 0.00 55.97 53.45 1aww s LYS 9 Cb -0.15 0.40 0.24 0.00 -2.06 0.00 0.00 37.83 36.25 1aww s LYS 9 CO -0.19 -0.60 1.05 1.63 0.10 0.00 0.00 175.35 177.34 1aww n LYS 10 N -0.40 -2.15 -3.60 1.78 5.02 -1.26 -3.57 118.16 113.99 1aww n LYS 10 Ca 0.01 -1.65 -0.11 0.00 -2.02 0.00 0.00 58.31 54.54 1aww n LYS 10 Cb 0.63 -1.34 -0.04 0.00 -0.02 0.00 0.00 35.03 34.26 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 -3.08 0.06 0.59 -0.18 -7.23 -1.01 -3.06 120.40 106.49 1aww s VAL 11 Ca 0.64 -0.48 0.05 0.00 -1.81 0.00 0.00 61.98 60.37 1aww s VAL 11 Cb -0.04 -1.14 0.08 0.00 0.56 0.00 0.00 36.38 35.84 1aww s VAL 11 CO 0.47 -0.27 0.82 -0.69 -0.31 0.00 0.00 175.10 175.13 1aww s VAL 12 N -3.79 2.36 -0.04 1.32 1.01 -0.91 0.46 120.40 120.81 1aww s VAL 12 Ca 0.03 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.25 1aww s VAL 12 Cb 0.01 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 1aww s VAL 12 CO -0.12 0.00 -0.20 0.00 0.00 0.00 0.00 175.10 174.78 1aww s ALA 13 N -2.79 2.43 0.00 5.51 0.00 0.31 -1.99 121.76 125.24 1aww s ALA 13 Ca 0.62 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.53 1aww s ALA 13 Cb -0.07 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.27 1aww s ALA 13 CO 0.40 0.54 0.00 1.28 0.00 0.00 0.00 175.76 177.97 1aww n LEU 14 N 2.39 0.26 -4.78 0.00 4.77 0.18 -2.06 117.00 117.76 1aww n LEU 14 Ca -0.17 0.20 -0.28 0.00 -0.03 0.00 0.00 56.01 55.73 1aww n LEU 14 Cb 0.52 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 1aww n LEU 14 CO 0.24 -0.41 -0.14 -0.31 -1.33 0.00 0.00 177.39 175.44 1aww s TYR 15 N -0.82 2.10 0.64 -1.77 1.51 -1.25 -4.25 117.35 113.51 1aww s TYR 15 Ca 0.00 -0.78 -0.17 0.00 -1.01 0.00 0.00 57.07 55.11 1aww s TYR 15 Cb 0.00 -1.82 -0.01 0.00 -0.11 0.00 0.00 41.96 40.02 1aww s TYR 15 CO 0.00 0.04 1.16 -0.51 -1.11 0.00 0.00 175.55 175.13 1aww s ASP 16 N -3.98 4.99 -0.44 2.29 1.01 -1.26 -3.92 116.67 115.36 1aww s ASP 16 Ca 0.27 2.22 0.01 0.00 0.71 0.00 0.00 52.55 55.77 1aww s ASP 16 Cb 0.02 -2.58 0.21 0.00 1.01 0.00 0.00 42.92 41.58 1aww s ASP 16 CO 0.16 -1.72 0.92 0.00 0.21 0.00 0.00 175.17 174.73 1aww n TYR 17 N -2.10 -2.47 -2.39 4.23 9.36 -1.25 -4.87 117.16 117.66 1aww n TYR 17 Ca 0.12 -1.12 -0.28 0.00 3.32 0.00 0.00 57.90 59.94 1aww n TYR 17 Cb 0.51 1.33 0.01 0.00 -0.63 0.00 0.00 39.34 40.56 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 0.83 3.48 -0.02 2.98 -1.94 -1.26 -2.27 119.30 121.10 1aww s MET 18 Ca 0.28 0.33 -0.30 0.00 -1.71 0.00 0.00 55.69 54.29 1aww s MET 18 Cb 0.09 -2.28 -0.06 0.00 2.01 0.00 0.00 34.83 34.59 1aww s MET 18 CO -0.10 -0.37 1.67 -1.25 -0.01 0.00 0.00 175.02 174.96 1aww s PRO 19 N -4.90 4.19 -0.13 2.03 0.05 -1.26 -4.86 135.00 130.12 1aww s PRO 19 Ca 0.50 2.24 0.10 0.00 0.05 0.00 0.00 61.00 63.90 1aww s PRO 19 Cb -0.11 -3.90 -0.16 0.00 0.05 0.00 0.00 34.50 30.38 1aww s PRO 19 CO 0.47 -0.82 0.02 -1.33 0.05 0.00 0.00 177.00 175.40 1aww n MET 20 N 6.78 1.68 -1.96 4.56 2.81 -1.26 -4.62 117.12 125.11 1aww n MET 20 Ca 0.17 0.01 -0.15 0.00 -1.81 0.00 0.00 57.70 55.92 1aww n MET 20 Cb 0.42 -1.34 0.05 0.00 -0.71 0.00 0.00 33.22 31.64 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 -2.55 3.80 -3.22 7.83 5.15 -1.26 -5.00 115.26 120.01 1aww n ASN 21 Ca -0.22 -3.41 -0.13 0.00 -0.60 0.00 0.00 54.58 50.21 1aww n ASN 21 Cb 0.92 -0.39 0.01 0.00 -0.53 0.00 0.00 39.78 39.79 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 -0.70 -2.68 0.03 5.20 0.00 -1.26 -4.88 120.51 116.22 1aww n ALA 22 Ca 0.33 0.32 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1aww n ALA 22 Cb 0.91 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1aww n ALA 22 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1aww n ASN 23 N -1.30 -0.61 -4.29 0.00 3.02 -1.26 -5.12 115.26 105.70 1aww n ASN 23 Ca -0.05 0.16 -0.34 0.00 -0.03 0.00 0.00 54.58 54.33 1aww n ASN 23 Cb 0.56 0.86 0.10 0.00 -0.61 0.00 0.00 39.78 40.68 1aww n ASN 23 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1aww n ASP 24 N -2.53 -3.23 -2.09 6.41 8.00 -1.26 -1.36 116.55 120.48 1aww n ASP 24 Ca 0.00 0.27 -0.11 0.00 0.71 0.00 0.00 54.79 55.66 1aww n ASP 24 Cb 0.00 -1.07 0.27 0.00 -0.02 0.00 0.00 41.12 40.31 1aww n ASP 24 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1aww n LEU 25 N 0.08 6.35 -3.27 0.64 -0.00 -0.33 -3.93 117.00 116.54 1aww n LEU 25 Ca 0.04 -3.33 -0.17 0.00 -0.00 0.00 0.00 56.01 52.54 1aww n LEU 25 Cb 0.55 -0.78 0.01 0.00 -0.00 0.00 0.00 43.42 43.20 1aww n LEU 25 CO 0.51 0.88 -0.02 1.67 -0.00 0.00 0.00 177.39 180.43 1aww n GLN 26 N -0.42 -1.84 -0.58 1.96 -0.06 -1.26 -4.75 117.38 110.44 1aww n GLN 26 Ca 0.47 1.51 0.00 0.00 -2.00 0.00 0.00 57.00 56.98 1aww n GLN 26 Cb 1.48 -4.08 0.00 0.00 -4.06 0.00 0.00 30.24 23.59 1aww n GLN 26 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 1aww n LEU 27 N -1.12 0.00 0.00 1.69 4.32 -0.96 -4.98 117.00 115.95 1aww n LEU 27 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 1aww n LEU 27 Cb 0.58 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.38 1aww n LEU 27 CO 0.55 -0.43 0.00 -1.14 -1.22 0.00 0.00 177.39 175.15 1aww n ARG 28 N -0.85 0.00 -4.09 3.23 0.63 -1.25 -3.94 116.66 110.38 1aww n ARG 28 Ca 0.00 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.59 1aww n ARG 28 Cb 0.00 0.00 -0.15 0.00 0.45 0.00 0.00 32.46 32.76 1aww n ARG 28 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 1aww s LYS 29 N 1.01 3.23 0.00 -0.14 2.20 -1.26 -3.78 119.74 121.00 1aww s LYS 29 Ca 0.00 -0.71 0.00 0.00 -0.36 0.00 0.00 55.97 54.90 1aww s LYS 29 Cb 0.00 -2.80 0.00 0.00 -1.51 0.00 0.00 37.83 33.52 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 4.59 3.31 3.83 5.54 0.00 -0.88 -5.01 105.19 116.57 1aww n GLY 30 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.71 6.87 0.28 1.61 1.11 -1.26 -4.67 116.67 119.90 1aww s ASP 31 Ca 0.00 1.64 0.11 0.00 0.18 0.00 0.00 52.55 54.48 1aww s ASP 31 Cb 0.00 -2.52 -0.05 0.00 1.07 0.00 0.00 42.92 41.41 1aww s ASP 31 CO 0.00 -0.39 -0.17 -1.61 1.18 0.00 0.00 175.17 174.18 1aww s GLU 32 N -3.33 1.65 0.00 8.23 8.01 -1.26 0.11 118.70 132.11 1aww s GLU 32 Ca 0.61 -1.77 0.00 0.00 0.01 0.00 0.00 54.97 53.82 1aww s GLU 32 Cb -0.09 -1.65 0.00 0.00 -4.31 0.00 0.00 34.13 28.08 1aww s GLU 32 CO 0.17 0.27 0.00 0.66 0.01 0.00 0.00 175.26 176.37 1aww n TYR 33 N -0.61 0.00 -4.09 1.61 4.01 0.17 -4.63 117.16 113.62 1aww n TYR 33 Ca -0.05 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.36 1aww n TYR 33 Cb 0.61 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.48 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 -1.34 2.65 0.23 -0.72 0.40 0.14 -2.42 117.98 116.92 1aww s PHE 34 Ca 0.00 -1.57 -0.25 0.00 -0.60 0.00 0.00 56.93 54.51 1aww s PHE 34 Cb 0.00 -1.84 -0.09 0.00 0.51 0.00 0.00 43.02 41.60 1aww s PHE 34 CO 0.00 -0.78 0.83 0.42 0.70 0.00 0.00 175.22 176.39 1aww s ILE 35 N 1.33 4.33 -0.02 0.64 -1.09 -1.23 0.09 121.20 125.25 1aww s ILE 35 Ca 0.05 1.69 0.02 0.00 -2.23 0.00 0.00 60.65 60.18 1aww s ILE 35 Cb -0.13 -4.07 -0.03 0.00 -1.58 0.00 0.00 42.46 36.65 1aww s ILE 35 CO -0.12 0.35 0.01 0.18 -1.23 0.00 0.00 174.94 174.13 1aww n LEU 36 N 1.11 0.00 -3.84 2.97 4.32 -1.24 -4.71 117.00 115.61 1aww n LEU 36 Ca -0.02 0.00 -0.01 0.00 -0.02 0.00 0.00 56.01 55.96 1aww n LEU 36 Cb 0.49 0.05 0.01 0.00 -1.62 0.00 0.00 43.42 42.35 1aww n LEU 36 CO 0.46 0.05 0.91 -1.83 -1.22 0.00 0.00 177.39 175.75 1aww s GLU 37 N -2.06 0.92 -0.94 3.23 -1.05 -1.26 -5.06 118.70 112.48 1aww s GLU 37 Ca -0.01 -0.57 -0.01 0.00 -0.15 0.00 0.00 54.97 54.24 1aww s GLU 37 Cb 0.01 0.27 0.30 0.00 -0.44 0.00 0.00 34.13 34.27 1aww s GLU 37 CO 0.09 -0.43 1.39 -0.85 0.95 0.00 0.00 175.26 176.41 1aww n GLU 38 N -0.67 4.27 0.00 -4.83 0.28 -1.26 -3.96 120.64 114.46 1aww n GLU 38 Ca -0.03 -4.64 0.00 0.00 -0.16 0.00 0.00 57.16 52.33 1aww n GLU 38 Cb 0.60 -2.43 0.00 0.00 1.43 0.00 0.00 31.44 31.04 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 0.73 0.00 -3.31 -1.84 7.64 -1.26 -3.78 113.62 111.81 1aww n SER 39 Ca 0.32 0.65 -0.26 0.00 1.01 0.00 0.00 58.87 60.59 1aww n SER 39 Cb 0.33 -0.15 -0.07 0.00 -1.01 0.00 0.00 64.21 63.31 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 -1.48 3.34 0.00 6.43 5.15 -0.99 -5.04 115.26 122.67 1aww n ASN 40 Ca 0.00 -3.38 0.00 0.00 -0.60 0.00 0.00 54.58 50.60 1aww n ASN 40 Cb 0.00 -0.65 0.00 0.00 -0.53 0.00 0.00 39.78 38.60 1aww n ASN 40 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1aww n LEU 41 N 0.72 0.00 -0.01 1.20 4.77 -1.25 0.13 117.00 122.56 1aww n LEU 41 Ca 0.29 0.00 0.23 0.00 -0.03 0.00 0.00 56.01 56.50 1aww n LEU 41 Cb 0.43 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 42.23 1aww n LEU 41 CO 0.36 0.00 1.21 -0.65 -1.33 0.00 0.00 177.39 176.98 1aww h PRO 42 N 0.00 0.00 -5.95 3.23 0.10 -1.96 -3.37 132.00 124.04 1aww h PRO 42 Ca 0.00 0.00 -0.54 0.00 0.10 0.00 0.00 66.00 65.56 1aww h PRO 42 Cb 0.00 0.00 -0.16 0.00 0.10 0.00 0.00 31.00 30.94 1aww h PRO 42 CO 0.00 0.00 -0.76 -1.58 0.10 0.00 0.00 178.00 175.76 1aww s TRP 43 N -4.67 1.96 0.10 0.65 0.52 0.35 0.98 118.94 118.83 1aww s TRP 43 Ca -0.04 -0.45 0.01 0.00 0.02 0.00 0.00 56.10 55.64 1aww s TRP 43 Cb 0.17 -0.92 -0.01 0.00 -1.15 0.00 0.00 33.47 31.57 1aww s TRP 43 CO 0.59 0.47 0.05 0.91 0.02 0.00 0.00 176.95 178.99 1aww n TRP 44 N -0.19 -0.05 -3.29 -1.98 8.01 -0.47 -2.35 117.44 117.11 1aww n TRP 44 Ca -0.09 -0.70 -0.25 0.00 -1.31 0.00 0.00 57.50 55.15 1aww n TRP 44 Cb 0.59 0.03 -0.08 0.00 -2.01 0.00 0.00 31.31 29.84 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 -0.21 1.38 -3.32 -0.99 0.63 -1.25 -2.96 116.66 109.93 1aww n ARG 45 Ca -0.00 -3.77 -0.22 0.00 -0.92 0.00 0.00 57.85 52.94 1aww n ARG 45 Cb 0.16 -1.62 0.04 0.00 0.45 0.00 0.00 32.46 31.49 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 -1.63 4.63 0.21 5.13 0.00 -1.19 -3.70 121.76 125.21 1aww s ALA 46 Ca 0.37 -1.85 0.06 0.00 0.00 0.00 0.00 51.96 50.54 1aww s ALA 46 Cb 0.16 -1.21 -0.05 0.00 0.00 0.00 0.00 23.12 22.02 1aww s ALA 46 CO -0.08 -0.73 -0.09 1.03 0.00 0.00 0.00 175.76 175.89 1aww s ARG 47 N -4.54 1.32 0.00 0.00 0.52 0.11 -1.28 118.95 115.08 1aww s ARG 47 Ca 0.52 -1.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.12 1aww s ARG 47 Cb -0.04 -0.93 0.00 0.00 0.52 0.00 0.00 34.95 34.50 1aww s ARG 47 CO 0.33 0.08 0.00 -0.40 0.02 0.00 0.00 175.30 175.33 1aww n ASP 48 N -0.39 0.00 -1.66 0.23 5.75 -0.98 0.24 116.55 119.74 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 0.62 0.00 0.24 0.00 -1.03 0.00 0.00 41.12 40.95 1aww n ASP 48 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1aww n LYS 49 N 0.00 3.18 -0.02 0.11 0.00 -1.26 -4.05 118.16 116.12 1aww n LYS 49 Ca 0.00 -2.28 -0.01 0.00 0.00 0.00 0.00 58.31 56.02 1aww n LYS 49 Cb 0.00 -2.00 -0.06 0.00 0.00 0.00 0.00 35.03 32.98 1aww n LYS 49 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1aww n ASN 50 N 0.04 3.27 0.00 3.14 5.03 -1.26 -5.02 115.26 120.47 1aww n ASN 50 Ca 0.29 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.74 1aww n ASN 50 Cb 1.10 0.91 0.00 0.00 -1.02 0.00 0.00 39.78 40.77 1aww n ASN 50 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1aww n GLY 51 N 2.39 1.97 3.22 7.41 0.00 -1.26 -5.13 105.19 113.79 1aww n GLY 51 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.35 1.09 0.18 1.61 -0.21 -1.26 -5.01 119.66 115.70 1aww s GLN 52 Ca 0.00 -0.96 0.07 0.00 0.02 0.00 0.00 55.36 54.48 1aww s GLN 52 Cb 0.00 -1.20 -0.04 0.00 1.00 0.00 0.00 33.01 32.77 1aww s GLN 52 CO 0.00 0.29 0.05 -1.83 -2.12 0.00 0.00 175.29 171.68 1aww s GLU 53 N -1.49 2.57 0.00 2.91 -1.05 -1.26 -2.32 118.70 118.06 1aww s GLU 53 Ca 0.04 -1.04 0.00 0.00 -0.15 0.00 0.00 54.97 53.82 1aww s GLU 53 Cb -0.09 -2.45 0.00 0.00 -0.44 0.00 0.00 34.13 31.15 1aww s GLU 53 CO 0.02 0.46 0.00 0.41 0.95 0.00 0.00 175.26 177.11 1aww n GLY 54 N -0.24 2.79 3.60 -3.83 0.00 -0.40 -4.86 105.19 102.25 1aww n GLY 54 Ca -0.09 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.96 2.82 -0.20 1.61 2.02 -0.47 -3.18 117.35 119.00 1aww s TYR 55 Ca 0.00 -0.11 -0.04 0.00 -0.37 0.00 0.00 57.07 56.55 1aww s TYR 55 Cb 0.00 -1.49 0.09 0.00 -0.40 0.00 0.00 41.96 40.16 1aww s TYR 55 CO 0.00 0.42 0.23 0.42 -1.57 0.00 0.00 175.55 175.05 1aww s ILE 56 N -1.19 -0.35 -0.01 2.71 1.09 -1.16 -1.18 121.20 121.12 1aww s ILE 56 Ca 0.21 -0.09 -0.32 0.00 -1.10 0.00 0.00 60.65 59.35 1aww s ILE 56 Cb -0.11 -0.67 -0.10 0.00 -1.06 0.00 0.00 42.46 40.51 1aww s ILE 56 CO 0.13 -0.18 1.92 -2.65 -0.10 0.00 0.00 174.94 174.07 1aww n PRO 57 N 5.32 2.56 -0.31 2.79 -0.01 -1.26 -1.37 135.00 142.72 1aww n PRO 57 Ca -0.05 0.94 0.21 0.00 -0.01 0.00 0.00 63.50 64.59 1aww n PRO 57 Cb 0.50 -2.84 0.50 0.00 -0.01 0.00 0.00 33.50 31.64 1aww n PRO 57 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 175.50 176.26 1aww h SER 58 N 9.84 0.47 -0.32 2.55 0.02 0.45 0.24 113.55 126.81 1aww h SER 58 Ca -0.49 0.08 -0.18 0.00 -0.84 0.00 0.00 61.79 60.36 1aww h SER 58 Cb 1.25 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.79 1aww h SER 58 CO 0.94 0.11 -0.49 -0.55 -1.14 0.00 0.00 176.83 175.70 1aww h ASN 59 N 0.42 0.98 0.24 3.07 -1.07 -1.89 -2.97 115.58 114.37 1aww h ASN 59 Ca 0.58 -0.51 -0.00 0.00 0.07 0.00 0.00 56.30 56.43 1aww h ASN 59 Cb 1.41 -0.28 -0.00 0.00 -2.07 0.00 0.00 38.32 37.38 1aww h ASN 59 CO -0.28 1.30 -0.00 1.88 0.07 0.00 0.00 177.43 180.40 1aww h TYR 60 N 0.69 0.00 -2.09 4.14 -1.99 -1.30 -3.43 116.97 112.99 1aww h TYR 60 Ca 0.03 0.00 -0.61 0.00 2.00 0.00 0.00 58.73 60.15 1aww h TYR 60 Cb 1.10 0.00 -0.14 0.00 2.00 0.00 0.00 36.73 39.69 1aww h TYR 60 CO 0.07 0.00 -0.72 0.14 -0.00 0.00 0.00 178.16 177.65 1aww s VAL 61 N -4.05 2.42 0.00 -2.88 -7.23 -1.06 0.48 120.40 108.09 1aww s VAL 61 Ca -0.04 -2.29 0.00 0.00 -1.81 0.00 0.00 61.98 57.84 1aww s VAL 61 Cb 0.12 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.58 1aww s VAL 61 CO 0.45 -0.31 0.00 1.07 -0.31 0.00 0.00 175.10 175.99 1aww n THR 62 N -0.71 0.00 -3.16 5.32 5.66 -0.84 -4.86 114.28 115.69 1aww n THR 62 Ca -0.05 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.57 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 4.60 4.30 0.58 1.09 2.02 -1.26 -2.14 118.70 127.88 1aww s GLU 63 Ca 0.00 0.87 0.28 0.00 0.02 0.00 0.00 54.97 56.14 1aww s GLU 63 Cb 0.00 -3.14 1.50 0.00 0.10 0.00 0.00 34.13 32.59 1aww s GLU 63 CO 0.00 0.55 1.95 0.00 0.02 0.00 0.00 175.26 177.79 1aww h ALA 64 N 4.14 2.21 -2.92 5.21 0.00 -1.70 -2.70 119.26 123.51 1aww h ALA 64 Ca -0.48 -0.02 -0.75 0.00 0.00 0.00 0.00 54.91 53.67 1aww h ALA 64 Cb 1.21 0.03 -0.30 0.00 0.00 0.00 0.00 17.79 18.73 1aww h ALA 64 CO 0.65 -0.65 -0.14 -1.21 0.00 0.00 0.00 179.25 177.90 1aww s GLU 65 N -4.72 3.06 0.39 0.00 2.02 -1.26 -4.62 118.70 113.57 1aww s GLU 65 Ca -0.04 -2.40 -0.25 0.00 0.02 0.00 0.00 54.97 52.29 1aww s GLU 65 Cb 0.17 -4.10 -0.09 0.00 0.10 0.00 0.00 34.13 30.21 1aww s GLU 65 CO 0.60 -1.24 1.14 0.16 0.02 0.00 0.00 175.26 175.94 1aww s ASP 66 N 1.67 6.64 0.00 -0.19 1.47 -1.24 -5.08 116.67 119.95 1aww s ASP 66 Ca 0.16 2.28 0.00 0.00 1.18 0.00 0.00 52.55 56.17 1aww s ASP 66 Cb -0.16 -2.61 0.00 0.00 -0.34 0.00 0.00 42.92 39.81 1aww s ASP 66 CO -0.06 -0.59 0.00 -1.54 0.68 0.00 0.00 175.17 173.67