#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 0.18 0.16 1.61 0.01 -1.26 -5.17 113.70 109.23 1aww s SER 2 Ca 0.00 -0.68 0.11 0.00 1.31 0.00 0.00 55.95 56.69 1aww s SER 2 Cb 0.00 0.30 -0.04 0.00 0.21 0.00 0.00 66.02 66.49 1aww s SER 2 CO 0.00 -0.67 -0.25 -0.04 0.41 0.00 0.00 173.24 172.69 1aww s MET 3 N -3.66 1.42 0.62 12.44 1.00 -1.26 -5.14 119.30 124.72 1aww s MET 3 Ca 0.04 -1.42 -0.06 0.00 0.00 0.00 0.00 55.69 54.25 1aww s MET 3 Cb 0.04 -1.80 0.02 0.00 0.00 0.00 0.00 34.83 33.10 1aww s MET 3 CO -0.10 0.41 0.93 -1.54 0.00 0.00 0.00 175.02 174.72 1aww s SER 4 N -2.36 5.44 0.03 3.03 1.04 -1.26 -5.08 113.70 114.55 1aww s SER 4 Ca 0.16 0.68 -0.03 0.00 0.48 0.00 0.00 55.95 57.24 1aww s SER 4 Cb -0.09 -1.60 -0.04 0.00 0.10 0.00 0.00 66.02 64.39 1aww s SER 4 CO 0.08 -1.18 0.23 0.42 0.98 0.00 0.00 173.24 173.77 1aww s THR 5 N -3.05 5.36 -0.23 2.02 -4.23 -1.26 -5.09 115.64 109.16 1aww s THR 5 Ca 0.55 -0.15 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 1aww s THR 5 Cb -0.11 -3.58 0.05 0.00 1.34 0.00 0.00 72.50 70.21 1aww s THR 5 CO 0.45 0.24 -0.09 -0.44 -0.54 0.00 0.00 174.62 174.24 1aww s SER 6 N -2.14 3.91 -1.40 3.99 0.01 -1.26 -4.78 113.70 112.04 1aww s SER 6 Ca 0.31 -1.16 -0.05 0.00 1.31 0.00 0.00 55.95 56.36 1aww s SER 6 Cb -0.13 -1.32 0.03 0.00 0.21 0.00 0.00 66.02 64.82 1aww s SER 6 CO 0.22 -0.19 0.75 -0.62 0.41 0.00 0.00 173.24 173.81 1aww n GLU 7 N 4.60 -4.85 0.00 12.44 1.02 -1.26 -4.96 120.64 127.63 1aww n GLU 7 Ca -0.14 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 1aww n GLU 7 Cb 0.44 -5.19 0.00 0.00 -0.02 0.00 0.00 31.44 26.68 1aww n GLU 7 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1aww n LEU 8 N -4.42 0.00 -1.12 -4.62 4.77 -1.26 -4.44 117.00 105.91 1aww n LEU 8 Ca -0.19 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 55.94 1aww n LEU 8 Cb 0.63 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.68 1aww n LEU 8 CO 0.72 0.00 -0.22 0.29 -1.33 0.00 0.00 177.39 176.85 1aww n LYS 9 N 0.00 -2.26 -0.00 3.23 5.02 -1.26 -4.76 118.16 118.14 1aww n LYS 9 Ca 0.00 1.51 -0.00 0.00 -2.02 0.00 0.00 58.31 57.80 1aww n LYS 9 Cb 0.00 -2.76 0.00 0.00 -0.02 0.00 0.00 35.03 32.25 1aww n LYS 9 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1aww n LYS 10 N -3.42 -2.01 -3.57 1.97 0.00 -1.26 -2.46 118.16 107.41 1aww n LYS 10 Ca 0.00 -0.01 -0.09 0.00 -0.00 0.00 0.00 58.31 58.21 1aww n LYS 10 Cb 0.63 -0.02 -0.04 0.00 -0.00 0.00 0.00 35.03 35.60 1aww n LYS 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1aww s VAL 11 N -1.01 0.00 0.67 0.58 -7.23 -0.86 -4.38 120.40 108.18 1aww s VAL 11 Ca 0.01 0.00 0.05 0.00 -1.81 0.00 0.00 61.98 60.23 1aww s VAL 11 Cb -0.00 -1.00 0.12 0.00 0.56 0.00 0.00 36.38 36.06 1aww s VAL 11 CO 0.00 0.00 0.92 -0.69 -0.31 0.00 0.00 175.10 175.03 1aww s VAL 12 N -1.70 2.02 -0.03 1.32 1.01 -1.00 0.72 120.40 122.74 1aww s VAL 12 Ca 0.02 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.24 1aww s VAL 12 Cb -0.01 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 1aww s VAL 12 CO -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 175.10 174.86 1aww s ALA 13 N -2.94 1.83 -0.18 5.51 0.00 0.31 -1.79 121.76 124.50 1aww s ALA 13 Ca 0.65 -0.91 0.18 0.00 0.00 0.00 0.00 51.96 51.88 1aww s ALA 13 Cb -0.05 -0.52 -0.25 0.00 0.00 0.00 0.00 23.12 22.31 1aww s ALA 13 CO 0.42 0.40 0.14 1.28 0.00 0.00 0.00 175.76 178.01 1aww n LEU 14 N 2.77 0.09 -4.14 0.00 4.77 0.27 -2.50 117.00 118.25 1aww n LEU 14 Ca -0.16 0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 55.72 1aww n LEU 14 Cb 0.52 0.45 -0.07 0.00 -2.33 0.00 0.00 43.42 42.00 1aww n LEU 14 CO 0.24 0.47 -0.01 -0.31 -1.33 0.00 0.00 177.39 176.46 1aww s TYR 15 N -2.53 1.12 0.61 -1.77 2.02 -1.26 -4.71 117.35 110.83 1aww s TYR 15 Ca -0.09 -1.30 -0.09 0.00 -0.37 0.00 0.00 57.07 55.22 1aww s TYR 15 Cb 0.06 -0.30 -0.01 0.00 -0.40 0.00 0.00 41.96 41.31 1aww s TYR 15 CO 0.83 -0.92 0.96 -0.51 -1.57 0.00 0.00 175.55 174.34 1aww s ASP 16 N -3.21 5.86 -0.41 2.29 1.11 -1.26 -3.29 116.67 117.76 1aww s ASP 16 Ca 0.34 1.05 0.04 0.00 0.18 0.00 0.00 52.55 54.16 1aww s ASP 16 Cb 0.02 -2.08 0.29 0.00 1.07 0.00 0.00 42.92 42.22 1aww s ASP 16 CO 0.18 -0.98 1.14 0.00 1.18 0.00 0.00 175.17 176.68 1aww n TYR 17 N -2.67 -2.03 -0.96 4.23 9.36 -1.25 -4.88 117.16 118.96 1aww n TYR 17 Ca 0.05 -1.45 -0.33 0.00 3.32 0.00 0.00 57.90 59.49 1aww n TYR 17 Cb 0.56 1.42 0.14 0.00 -0.63 0.00 0.00 39.34 40.83 1aww n TYR 17 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1aww n MET 18 N 0.97 -0.04 -1.11 2.98 0.00 -1.26 -3.51 117.12 115.15 1aww n MET 18 Ca 0.03 0.07 -0.30 0.00 0.00 0.00 0.00 57.70 57.50 1aww n MET 18 Cb 0.69 -2.41 0.14 0.00 0.00 0.00 0.00 33.22 31.64 1aww n MET 18 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1aww s PRO 19 N -4.28 1.28 0.00 3.17 0.05 -1.26 -4.89 135.00 129.07 1aww s PRO 19 Ca 0.71 0.98 0.00 0.00 0.05 0.00 0.00 61.00 62.74 1aww s PRO 19 Cb -0.27 -1.80 0.00 0.00 0.05 0.00 0.00 34.50 32.48 1aww s PRO 19 CO 0.53 -2.27 0.00 -1.33 0.05 0.00 0.00 177.00 173.98 1aww n MET 20 N -3.93 0.00 -0.00 4.56 2.81 -1.26 -4.99 117.12 114.31 1aww n MET 20 Ca 0.08 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.96 1aww n MET 20 Cb 0.54 -0.58 -0.00 0.00 -0.71 0.00 0.00 33.22 32.47 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 -2.57 0.26 0.00 7.83 4.13 -1.26 -5.07 115.26 118.57 1aww n ASN 21 Ca 0.00 0.04 0.00 0.00 1.68 0.00 0.00 54.58 56.30 1aww n ASN 21 Cb 0.36 -0.27 0.00 0.00 -1.54 0.00 0.00 39.78 38.32 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 -2.75 0.00 0.18 5.41 0.00 -1.26 -4.99 120.51 117.10 1aww n ALA 22 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.29 1aww n ALA 22 Cb 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.37 -2.42 0.00 2.35 -1.97 -3.45 115.58 109.73 1aww h ASN 23 Ca 0.00 0.02 -0.59 0.00 -0.55 0.00 0.00 56.30 55.18 1aww h ASN 23 Cb 0.00 0.11 0.18 0.00 0.05 0.00 0.00 38.32 38.65 1aww h ASN 23 CO 0.00 -0.25 -0.81 0.47 -1.65 0.00 0.00 177.43 175.19 1aww n ASP 24 N -5.27 -2.46 -4.78 5.81 8.00 -1.26 -3.31 116.55 113.27 1aww n ASP 24 Ca -0.10 0.70 -0.32 0.00 0.71 0.00 0.00 54.79 55.79 1aww n ASP 24 Cb 0.19 -0.99 -0.07 0.00 -0.02 0.00 0.00 41.12 40.23 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 3.09 3.87 -1.08 0.64 2.96 -1.23 -4.44 118.68 122.48 1aww s LEU 25 Ca 0.62 0.08 -0.22 0.00 -0.22 0.00 0.00 54.13 54.39 1aww s LEU 25 Cb -0.48 -2.40 0.02 0.00 0.50 0.00 0.00 46.19 43.83 1aww s LEU 25 CO 0.61 0.22 1.65 -1.10 -1.32 0.00 0.00 176.35 176.41 1aww s GLN 26 N -2.07 3.40 0.58 1.98 -0.21 -1.26 -4.22 119.66 117.86 1aww s GLN 26 Ca 0.26 -1.19 -0.02 0.00 0.02 0.00 0.00 55.36 54.43 1aww s GLN 26 Cb -0.12 -5.34 0.12 0.00 1.00 0.00 0.00 33.01 28.67 1aww s GLN 26 CO 0.18 -2.60 0.80 1.28 -2.12 0.00 0.00 175.29 172.83 1aww n LEU 27 N 10.18 0.00 -3.63 2.90 4.32 -1.23 -4.94 117.00 124.61 1aww n LEU 27 Ca 0.39 -1.57 -0.04 0.00 -0.02 0.00 0.00 56.01 54.77 1aww n LEU 27 Cb 0.49 -0.53 -0.06 0.00 -1.62 0.00 0.00 43.42 41.70 1aww n LEU 27 CO 0.68 -0.91 1.06 0.00 -1.22 0.00 0.00 177.39 176.99 1aww s ARG 28 N -4.56 0.19 0.67 3.23 1.70 -1.26 -3.87 118.95 115.06 1aww s ARG 28 Ca 0.52 0.12 -0.17 0.00 -0.47 0.00 0.00 55.73 55.72 1aww s ARG 28 Cb -0.03 0.09 -0.00 0.00 -0.57 0.00 0.00 34.95 34.44 1aww s ARG 28 CO 0.35 -0.04 1.21 1.17 -1.08 0.00 0.00 175.30 176.90 1aww n LYS 29 N 1.09 0.90 -2.20 3.89 4.81 -1.21 -2.58 118.16 122.86 1aww n LYS 29 Ca -0.06 0.37 -0.18 0.00 -0.87 0.00 0.00 58.31 57.56 1aww n LYS 29 Cb 0.58 -2.45 -0.02 0.00 0.02 0.00 0.00 35.03 33.16 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 0.93 -0.01 3.09 3.14 0.00 -1.04 -4.97 105.19 106.34 1aww n GLY 30 Ca 0.15 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.29 1.34 0.29 1.61 2.15 -1.06 -4.92 116.67 113.78 1aww s ASP 31 Ca 0.00 -0.40 0.10 0.00 0.43 0.00 0.00 52.55 52.68 1aww s ASP 31 Cb 0.00 -0.08 -0.05 0.00 -0.30 0.00 0.00 42.92 42.49 1aww s ASP 31 CO 0.00 0.01 -0.05 -1.61 -0.17 0.00 0.00 175.17 173.35 1aww s GLU 32 N -0.99 2.07 0.00 4.34 8.01 -1.26 0.11 118.70 130.99 1aww s GLU 32 Ca -0.00 -1.60 0.00 0.00 0.01 0.00 0.00 54.97 53.38 1aww s GLU 32 Cb -0.07 -1.99 0.00 0.00 -4.31 0.00 0.00 34.13 27.75 1aww s GLU 32 CO 0.01 0.29 0.00 0.66 0.01 0.00 0.00 175.26 176.23 1aww n TYR 33 N -0.84 0.00 -5.12 1.61 4.01 0.22 -4.52 117.16 112.52 1aww n TYR 33 Ca -0.05 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.37 1aww n TYR 33 Cb 0.60 0.00 -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 -1.40 2.49 -0.18 -0.72 0.40 0.34 -2.02 117.98 116.90 1aww s PHE 34 Ca 0.00 -1.04 -0.13 0.00 -0.60 0.00 0.00 56.93 55.16 1aww s PHE 34 Cb 0.00 -1.68 -0.05 0.00 0.51 0.00 0.00 43.02 41.81 1aww s PHE 34 CO 0.00 -0.43 0.26 0.42 0.70 0.00 0.00 175.22 176.17 1aww s ILE 35 N 0.41 5.33 -0.08 0.64 -1.09 -1.03 -0.90 121.20 124.48 1aww s ILE 35 Ca -0.17 0.46 0.08 0.00 -2.23 0.00 0.00 60.65 58.78 1aww s ILE 35 Cb -0.18 -3.60 -0.11 0.00 -1.58 0.00 0.00 42.46 37.00 1aww s ILE 35 CO 0.08 0.39 0.04 0.18 -1.23 0.00 0.00 174.94 174.40 1aww n LEU 36 N 3.64 0.00 -3.64 2.97 4.32 -1.26 -4.23 117.00 118.81 1aww n LEU 36 Ca -0.13 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.82 1aww n LEU 36 Cb 0.52 0.19 -0.07 0.00 -1.62 0.00 0.00 43.42 42.44 1aww n LEU 36 CO 0.39 0.19 0.81 -0.70 -1.22 0.00 0.00 177.39 176.86 1aww s GLU 37 N -2.24 0.33 -0.20 3.23 2.12 -1.26 -5.03 118.70 115.65 1aww s GLU 37 Ca -0.04 0.48 0.09 0.00 0.36 0.00 0.00 54.97 55.86 1aww s GLU 37 Cb 0.03 0.11 0.59 0.00 0.26 0.00 0.00 34.13 35.13 1aww s GLU 37 CO 0.35 -0.05 1.46 -0.85 -0.54 0.00 0.00 175.26 175.63 1aww n GLU 38 N 2.83 3.62 -2.08 4.30 0.00 -1.26 -1.63 120.64 126.42 1aww n GLU 38 Ca -0.15 -2.32 -0.02 0.00 0.00 0.00 0.00 57.16 54.66 1aww n GLU 38 Cb 0.57 -2.04 -0.00 0.00 0.00 0.00 0.00 31.44 29.96 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 0.29 -1.28 -1.79 -1.84 7.64 -1.26 -0.57 113.62 114.81 1aww n SER 39 Ca 0.24 0.33 -0.14 0.00 1.01 0.00 0.00 58.87 60.31 1aww n SER 39 Cb 1.02 -1.31 -0.04 0.00 -1.01 0.00 0.00 64.21 62.87 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 -0.90 -3.89 -3.74 6.43 2.85 -1.26 -4.91 115.26 109.85 1aww n ASN 40 Ca -0.03 0.27 -0.10 0.00 -0.11 0.00 0.00 54.58 54.62 1aww n ASN 40 Cb 0.39 -3.47 -0.05 0.00 1.24 0.00 0.00 39.78 37.89 1aww n ASN 40 CO 0.00 0.00 0.00 -1.48 -2.11 0.00 0.00 177.26 173.67 1aww s LEU 41 N -4.54 0.44 0.27 1.20 0.05 0.27 -5.06 118.68 111.31 1aww s LEU 41 Ca 0.00 -0.49 -0.01 0.00 0.05 0.00 0.00 54.13 53.68 1aww s LEU 41 Cb 0.00 1.80 0.60 0.00 -2.05 0.00 0.00 46.19 46.54 1aww s LEU 41 CO 0.00 -0.92 1.66 -0.65 -0.55 0.00 0.00 176.35 175.89 1aww h PRO 42 N 2.36 0.23 -6.31 1.48 0.10 -1.91 -3.38 132.00 124.56 1aww h PRO 42 Ca -0.32 -0.01 -0.55 0.00 0.10 0.00 0.00 66.00 65.22 1aww h PRO 42 Cb 1.25 -0.05 -0.02 0.00 0.10 0.00 0.00 31.00 32.27 1aww h PRO 42 CO 0.44 0.15 0.63 -1.58 0.10 0.00 0.00 178.00 177.74 1aww s TRP 43 N -5.99 3.34 0.00 0.65 0.52 -1.26 0.60 118.94 116.80 1aww s TRP 43 Ca -0.12 1.37 0.00 0.00 0.02 0.00 0.00 56.10 57.36 1aww s TRP 43 Cb 0.24 -3.33 0.00 0.00 -1.15 0.00 0.00 33.47 29.23 1aww s TRP 43 CO 0.77 -0.89 0.00 0.91 0.02 0.00 0.00 176.95 177.75 1aww n TRP 44 N 4.98 -1.39 -3.23 -1.98 8.01 -0.83 -4.38 117.44 118.62 1aww n TRP 44 Ca 0.10 0.00 -0.24 0.00 -1.31 0.00 0.00 57.50 56.05 1aww n TRP 44 Cb 0.47 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.71 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 -0.46 1.47 -3.67 -0.99 1.74 -0.65 -2.98 116.66 111.12 1aww n ARG 45 Ca 0.00 -3.79 -0.20 0.00 -0.77 0.00 0.00 57.85 53.09 1aww n ARG 45 Cb 0.00 -1.66 -0.02 0.00 -1.02 0.00 0.00 32.46 29.76 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 -1.93 4.05 0.21 7.54 0.00 -1.26 -3.98 121.76 126.39 1aww s ALA 46 Ca 0.38 -1.48 0.07 0.00 0.00 0.00 0.00 51.96 50.94 1aww s ALA 46 Cb 0.20 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 1aww s ALA 46 CO -0.08 0.03 0.09 1.03 0.00 0.00 0.00 175.76 176.83 1aww s ARG 47 N -4.08 2.65 0.00 0.00 0.52 -0.07 -2.07 118.95 115.90 1aww s ARG 47 Ca 0.42 -1.09 0.00 0.00 -0.52 0.00 0.00 55.73 54.54 1aww s ARG 47 Cb -0.08 -2.45 0.00 0.00 0.52 0.00 0.00 34.95 32.94 1aww s ARG 47 CO 0.29 0.43 0.00 -0.40 0.02 0.00 0.00 175.30 175.64 1aww n ASP 48 N -0.59 0.00 -1.40 0.23 5.75 -1.04 -0.50 116.55 119.00 1aww n ASP 48 Ca -0.08 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.72 1aww n ASP 48 Cb 0.56 0.00 0.23 0.00 -1.03 0.00 0.00 41.12 40.89 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 3.23 -0.03 0.11 4.76 -1.26 -3.97 118.16 121.00 1aww n LYS 49 Ca 0.00 -1.92 -0.02 0.00 -2.87 0.00 0.00 58.31 53.50 1aww n LYS 49 Cb 0.00 -1.95 -0.07 0.00 -1.84 0.00 0.00 35.03 31.18 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 0.29 2.94 0.00 4.39 4.13 -1.26 -5.02 115.26 120.74 1aww n ASN 50 Ca 0.19 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.45 1aww n ASN 50 Cb 0.87 0.87 0.00 0.00 -1.54 0.00 0.00 39.78 39.98 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 2.37 1.96 3.08 7.41 0.00 -1.25 -5.12 105.19 113.63 1aww n GLY 51 Ca -0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.42 1.37 0.17 1.61 -0.21 -1.26 -5.00 119.66 115.92 1aww s GLN 52 Ca 0.00 -0.48 -0.01 0.00 0.02 0.00 0.00 55.36 54.90 1aww s GLN 52 Cb 0.00 -1.23 -0.04 0.00 1.00 0.00 0.00 33.01 32.74 1aww s GLN 52 CO 0.00 0.20 0.35 -1.83 -2.12 0.00 0.00 175.29 171.90 1aww s GLU 53 N 0.04 3.51 0.00 2.91 -1.05 -1.26 -2.50 118.70 120.34 1aww s GLU 53 Ca -0.02 -0.36 0.00 0.00 -0.15 0.00 0.00 54.97 54.44 1aww s GLU 53 Cb -0.09 -2.88 0.00 0.00 -0.44 0.00 0.00 34.13 30.72 1aww s GLU 53 CO 0.01 0.45 0.00 0.41 0.95 0.00 0.00 175.26 177.08 1aww n GLY 54 N -0.46 1.31 3.01 -3.83 0.00 -0.88 -4.79 105.19 99.55 1aww n GLY 54 Ca -0.05 0.37 -0.17 0.00 0.00 0.00 0.00 46.02 46.17 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 2.16 0.68 -0.26 1.61 1.51 -1.21 -4.11 117.35 117.73 1aww s TYR 55 Ca 0.00 -0.19 -0.04 0.00 -1.01 0.00 0.00 57.07 55.83 1aww s TYR 55 Cb 0.00 -0.43 0.09 0.00 -0.11 0.00 0.00 41.96 41.51 1aww s TYR 55 CO 0.00 -0.02 0.13 0.42 -1.11 0.00 0.00 175.55 174.97 1aww s ILE 56 N -0.37 -0.09 0.14 2.71 1.09 -1.16 -3.55 121.20 119.96 1aww s ILE 56 Ca 0.01 -0.60 -0.32 0.00 -1.10 0.00 0.00 60.65 58.63 1aww s ILE 56 Cb -0.04 -0.88 -0.12 0.00 -1.06 0.00 0.00 42.46 40.36 1aww s ILE 56 CO -0.00 -0.61 1.74 -2.65 -0.10 0.00 0.00 174.94 173.32 1aww n PRO 57 N 5.26 2.55 -0.17 2.79 -0.01 -1.26 -1.96 135.00 142.19 1aww n PRO 57 Ca -0.06 0.92 -0.01 0.00 -0.01 0.00 0.00 63.50 64.34 1aww n PRO 57 Cb 0.44 -2.77 0.08 0.00 -0.01 0.00 0.00 33.50 31.24 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 7.42 -0.15 -0.97 2.55 0.87 -0.17 -1.26 113.55 121.85 1aww h SER 58 Ca -0.45 0.12 0.01 0.00 -1.23 0.00 0.00 61.79 60.24 1aww h SER 58 Cb 1.23 0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 63.34 1aww h SER 58 CO 0.93 -0.05 0.64 -0.55 -0.53 0.00 0.00 176.83 177.28 1aww h ASN 59 N 0.16 1.11 -0.81 6.23 7.08 -1.90 -2.47 115.58 124.98 1aww h ASN 59 Ca 0.28 -0.03 -0.02 0.00 -3.08 0.00 0.00 56.30 53.45 1aww h ASN 59 Cb 0.42 -0.27 -0.04 0.00 -2.08 0.00 0.00 38.32 36.34 1aww h ASN 59 CO -0.42 0.80 0.45 1.88 -2.08 0.00 0.00 177.43 178.05 1aww h TYR 60 N 1.30 1.11 -1.71 4.14 -1.99 -1.62 -3.44 116.97 114.76 1aww h TYR 60 Ca 0.36 -0.02 -0.49 0.00 2.00 0.00 0.00 58.73 60.58 1aww h TYR 60 Cb -0.13 -0.36 -0.03 0.00 2.00 0.00 0.00 36.73 38.21 1aww h TYR 60 CO -0.00 0.77 -0.41 0.14 -0.00 0.00 0.00 178.16 178.65 1aww s VAL 61 N -5.76 3.20 0.00 -2.88 -7.23 -0.91 0.94 120.40 107.77 1aww s VAL 61 Ca -0.12 -1.34 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 1aww s VAL 61 Cb 0.17 -3.11 0.00 0.00 0.56 0.00 0.00 36.38 34.00 1aww s VAL 61 CO 0.81 -0.10 0.00 1.07 -0.31 0.00 0.00 175.10 176.57 1aww n THR 62 N -1.46 0.00 -2.97 5.32 5.66 -0.74 -4.84 114.28 115.25 1aww n THR 62 Ca 0.01 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 1aww n THR 62 Cb 0.60 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.39 1aww n THR 62 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1aww n GLU 63 N 0.00 4.56 0.00 1.09 1.02 -1.26 -2.37 120.64 123.68 1aww n GLU 63 Ca 0.00 -4.58 0.00 0.00 -0.02 0.00 0.00 57.16 52.56 1aww n GLU 63 Cb 0.00 -2.50 0.00 0.00 -0.02 0.00 0.00 31.44 28.92 1aww n GLU 63 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1aww n ALA 64 N 1.12 0.00 -1.74 0.62 0.00 -1.26 -3.59 120.51 115.66 1aww n ALA 64 Ca 0.29 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.37 1aww n ALA 64 Cb 0.32 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.82 1aww n ALA 64 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1aww n GLU 65 N -0.05 2.86 -0.77 0.00 1.02 -1.26 -4.31 120.64 118.12 1aww n GLU 65 Ca 0.00 -3.57 0.00 0.00 -0.02 0.00 0.00 57.16 53.57 1aww n GLU 65 Cb 0.00 -2.28 0.00 0.00 -0.02 0.00 0.00 31.44 29.14 1aww n GLU 65 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1aww n ASP 66 N -0.70 0.00 0.00 1.62 5.75 -1.24 -5.19 116.55 116.79 1aww n ASP 66 Ca 0.56 -0.57 0.00 0.00 -0.01 0.00 0.00 54.79 54.77 1aww n ASP 66 Cb 0.50 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 1aww n ASP 66 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85